smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC001164643441	719217381	/nfs/dbraw/zinc/21/73/81/719217381.db2.gz	YVJKPLLLUMSRBP-MNOVXSKESA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1cccc(C)c1OCC[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126943774	742943047	/nfs/dbraw/zinc/94/30/47/742943047.db2.gz	WTHDNCVXFMMUCW-ZIAGYGMSSA-N	1	1	321.377	1.053	20	5		DDBDMO
Cn1c[nH+]c(Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)c1	ZINC001188995695	744806176	/nfs/dbraw/zinc/80/61/76/744806176.db2.gz	MATSLGGMDIESDZ-UHFFFAOYSA-N	1	1	301.262	1.193	20	5		DDBDMO
C[C@](N)(CCCC[NH3+])c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001212339360	747919887	/nfs/dbraw/zinc/91/98/87/747919887.db2.gz	YWIRILCXWUCNDG-ZDUSSCGKSA-N	1	1	324.316	1.482	20	5		DDBDMO
CS(=O)(=O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC001199793089	747998004	/nfs/dbraw/zinc/99/80/04/747998004.db2.gz	WUBYGIHXDHOAON-UHFFFAOYSA-N	1	1	324.358	1.989	20	5		DDBDMO
Cc1cc(NC(=O)N(C)CC[N@@H+](C)CCO)ccc1[N+](=O)[O-]	ZINC001202701549	749503894	/nfs/dbraw/zinc/50/38/94/749503894.db2.gz	DMVUXJQEONUEQW-UHFFFAOYSA-N	1	1	310.354	1.291	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001095625183	750093013	/nfs/dbraw/zinc/09/30/13/750093013.db2.gz	BTJNMKYREQNDPO-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
O=[N+]([O-])c1nc[nH]c1-c1nc(-c2ccc3c(n2)CC[NH2+]C3)no1	ZINC001212894166	750930765	/nfs/dbraw/zinc/93/07/65/750930765.db2.gz	RSCXKAKJWKVGDV-UHFFFAOYSA-N	1	1	313.277	1.076	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2cccnc2)CC1	ZINC000997770798	751270684	/nfs/dbraw/zinc/27/06/84/751270684.db2.gz	YVHFSEVYHFZMEB-HUUCEWRRSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(N1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1)C(F)(F)F	ZINC001169011892	762178064	/nfs/dbraw/zinc/17/80/64/762178064.db2.gz	NGLQVFVMIOGKKA-UWVGGRQHSA-N	1	1	309.288	1.138	20	5		DDBDMO
CC(=O)N1CCCC[C@]12CC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169030353	762186370	/nfs/dbraw/zinc/18/63/70/762186370.db2.gz	YYQFHTZRXZOLFS-HRCADAONSA-N	1	1	309.410	1.909	20	5		DDBDMO
O=C1CC[C@H]2[C@H](CC[N@@H+]2[C@H]2CC[C@H](C[N+](=O)[O-])C2)N1CC1CC1	ZINC001169019306	762199977	/nfs/dbraw/zinc/19/99/77/762199977.db2.gz	HOAZBEKFZLGCFT-VGWMRTNUSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CN(CC4CC4)C[C@@H](C2)O3)C1	ZINC001169023822	762202305	/nfs/dbraw/zinc/20/23/05/762202305.db2.gz	FLWKVSDPPWPYRE-QXSJWSMHSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H](N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023822	762202309	/nfs/dbraw/zinc/20/23/09/762202309.db2.gz	FLWKVSDPPWPYRE-QXSJWSMHSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H](N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023822	762202319	/nfs/dbraw/zinc/20/23/19/762202319.db2.gz	FLWKVSDPPWPYRE-QXSJWSMHSA-N	1	1	309.410	1.227	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)n1	ZINC001020138895	760613100	/nfs/dbraw/zinc/61/31/00/760613100.db2.gz	GUUUSHOZWNXCFO-KBUPBQIOSA-N	1	1	318.377	1.100	20	5		DDBDMO
Cc1nc(C)c(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC001020138966	760613146	/nfs/dbraw/zinc/61/31/46/760613146.db2.gz	KGEPOXCWYXWQBL-DDHJBXDOSA-N	1	1	324.406	1.162	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cs1	ZINC001020139530	760614077	/nfs/dbraw/zinc/61/40/77/760614077.db2.gz	CYNDEXLUGBYMKT-FDYHWXHSSA-N	1	1	309.391	1.459	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccsc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086084401	760944440	/nfs/dbraw/zinc/94/44/40/760944440.db2.gz	PLQBNRGMWGWLGR-YVECIDJPSA-N	1	1	309.391	1.398	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CC2=CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363440	761493199	/nfs/dbraw/zinc/49/31/99/761493199.db2.gz	URTPAOXKIXEMEF-KBUPBQIOSA-N	1	1	307.394	1.636	20	5		DDBDMO
CCc1ccc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)o1	ZINC001130351885	767463263	/nfs/dbraw/zinc/46/32/63/767463263.db2.gz	LPBKJAOPLSKKQW-UHFFFAOYSA-N	1	1	321.337	1.003	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cc(N[C@@H]2C[C@H]3CC[N@@H+](C2)[C@@H]3C)n1	ZINC001170965889	771969780	/nfs/dbraw/zinc/96/97/80/771969780.db2.gz	XKWFCCKDAMQLFV-GMTAPVOTSA-N	1	1	320.349	1.671	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCCn1cc[nH+]c1C(C)C	ZINC001136690811	772088077	/nfs/dbraw/zinc/08/80/77/772088077.db2.gz	UTGKEMTZBHVUJS-UHFFFAOYSA-N	1	1	320.353	1.236	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001100149761	775735488	/nfs/dbraw/zinc/73/54/88/775735488.db2.gz	PGUUVFFBHMJPGN-UHFFFAOYSA-N	1	1	308.382	1.487	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094574535	776049559	/nfs/dbraw/zinc/04/95/59/776049559.db2.gz	YVVKWKIHVOZJPX-UHFFFAOYSA-N	1	1	309.370	1.250	20	5		DDBDMO
CCN(CCNC(=O)CC[N@@H+](C)CC)c1ccccc1[N+](=O)[O-]	ZINC001100607000	776358633	/nfs/dbraw/zinc/35/86/33/776358633.db2.gz	GUENKZOJKXCRIS-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
CN(CCO)CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172906299	776917196	/nfs/dbraw/zinc/91/71/96/776917196.db2.gz	NXMNGBRYGRMOCH-INIZCTEOSA-N	1	1	321.421	1.746	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CN(C)C(=O)[C@H]2C1	ZINC001173227391	777062603	/nfs/dbraw/zinc/06/26/03/777062603.db2.gz	OCRIOMMJHBTCIP-LNSITVRQSA-N	1	1	303.362	1.546	20	5		DDBDMO
COC(=O)C[C@H]1COCC[N@@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173231914	777063471	/nfs/dbraw/zinc/06/34/71/777063471.db2.gz	OTFMTZKPJQMVRV-WFASDCNBSA-N	1	1	322.361	1.790	20	5		DDBDMO
COC(=O)C[C@H]1COCC[N@H+]1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173231914	777063479	/nfs/dbraw/zinc/06/34/79/777063479.db2.gz	OTFMTZKPJQMVRV-WFASDCNBSA-N	1	1	322.361	1.790	20	5		DDBDMO
COCCCC[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178463935	779060945	/nfs/dbraw/zinc/06/09/45/779060945.db2.gz	OFRBHYQUWZTXCM-ZIAGYGMSSA-N	1	1	315.414	1.344	20	5		DDBDMO
C[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)S(C)(=O)=O	ZINC000697622146	779669217	/nfs/dbraw/zinc/66/92/17/779669217.db2.gz	VIHYXOFQLLFZKV-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@H](C(C)C)N1CC[NH+](C)CC1	ZINC001117243985	780693555	/nfs/dbraw/zinc/69/35/55/780693555.db2.gz	NPOXBTOUWCEJDZ-CQSZACIVSA-N	1	1	321.425	1.404	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@@H]2CCO[C@@H]2C1=O	ZINC001119327193	781405621	/nfs/dbraw/zinc/40/56/21/781405621.db2.gz	HNEBYXKLCPENGB-ZFWWWQNUSA-N	1	1	319.361	1.274	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@@H]2CCO[C@@H]2C1=O	ZINC001119327193	781405626	/nfs/dbraw/zinc/40/56/26/781405626.db2.gz	HNEBYXKLCPENGB-ZFWWWQNUSA-N	1	1	319.361	1.274	20	5		DDBDMO
COc1ncnc2c1CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169021295	850518432	/nfs/dbraw/zinc/51/84/32/850518432.db2.gz	KLLPFFRQTUERTH-NWDGAFQWSA-N	1	1	306.366	1.331	20	5		DDBDMO
COCC[NH+](CCOC)C1CN(c2nccc(C)c2[N+](=O)[O-])C1	ZINC001327911163	862558350	/nfs/dbraw/zinc/55/83/50/862558350.db2.gz	LLQBMOPKVLCRLB-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCCn2cnnc2)ncc1[N+](=O)[O-]	ZINC001158039291	864382485	/nfs/dbraw/zinc/38/24/85/864382485.db2.gz	LEAQYUWGOKWUKF-HWKANZROSA-N	1	1	303.326	1.226	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001330570312	864458400	/nfs/dbraw/zinc/45/84/00/864458400.db2.gz	AESZOOKKNROUAC-UXIGCNINSA-N	1	1	321.377	1.569	20	5		DDBDMO
CC(C)[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1C	ZINC001158494827	864688095	/nfs/dbraw/zinc/68/80/95/864688095.db2.gz	RAYDYMCVWBOMJD-JTQLQIEISA-N	1	1	309.326	1.817	20	5		DDBDMO
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC001331273570	864980989	/nfs/dbraw/zinc/98/09/89/864980989.db2.gz	AZSXHBIFUHJCPK-LLVKDONJSA-N	1	1	324.312	1.017	20	5		DDBDMO
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC001331273570	864980996	/nfs/dbraw/zinc/98/09/96/864980996.db2.gz	AZSXHBIFUHJCPK-LLVKDONJSA-N	1	1	324.312	1.017	20	5		DDBDMO
CC[C@]([NH3+])(CO)Nc1nc(Cl)nc(SC)c1[N+](=O)[O-]	ZINC001159743576	865495592	/nfs/dbraw/zinc/49/55/92/865495592.db2.gz	JQGHEPNGUWHRDV-SECBINFHSA-N	1	1	307.763	1.229	20	5		DDBDMO
O=C1C[NH2+]CCN1CCNc1ccc2ccc3cccnc3c2n1	ZINC001161019415	866278355	/nfs/dbraw/zinc/27/83/55/866278355.db2.gz	MWKUKPDCPVVICC-UHFFFAOYSA-N	1	1	321.384	1.627	20	5		DDBDMO
Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1F	ZINC001323443999	866614009	/nfs/dbraw/zinc/61/40/09/866614009.db2.gz	UAWFNJMZPLCZHH-TZMCWYRMSA-N	1	1	321.352	1.538	20	5		DDBDMO
CN1Cc2cc(NC[C@H]3C[N@H+](C)CCO3)cc([N+](=O)[O-])c2N1	ZINC001162693997	867741498	/nfs/dbraw/zinc/74/14/98/867741498.db2.gz	KNTSGDOAIGRLLI-LBPRGKRZSA-N	1	1	307.354	1.110	20	5		DDBDMO
CN1Cc2cc(NC[C@H]3C[N@@H+](C)CCO3)cc([N+](=O)[O-])c2N1	ZINC001162693997	867741505	/nfs/dbraw/zinc/74/15/05/867741505.db2.gz	KNTSGDOAIGRLLI-LBPRGKRZSA-N	1	1	307.354	1.110	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1ccc([N+](=O)[O-])c(N)n1	ZINC001162875396	867887985	/nfs/dbraw/zinc/88/79/85/867887985.db2.gz	CBUVXFUKLWRRMA-GFCCVEGCSA-N	1	1	323.397	1.731	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)o1	ZINC001322340759	868122969	/nfs/dbraw/zinc/12/29/69/868122969.db2.gz	ULLAGALIGDOEBA-UHFFFAOYSA-N	1	1	314.305	1.892	20	5		DDBDMO
CC[NH+](CC)CCNC(=N)Nc1nc(C)cc(OC)c1[N+](=O)[O-]	ZINC001163125553	868128266	/nfs/dbraw/zinc/12/82/66/868128266.db2.gz	FHDOXOOVDPADJP-UHFFFAOYSA-N	1	1	324.385	1.585	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001335230802	868157964	/nfs/dbraw/zinc/15/79/64/868157964.db2.gz	REBSTVOKKFOCFN-IAQYHMDHSA-N	1	1	318.377	1.755	20	5		DDBDMO
Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ncc([N+](=O)[O-])s1)C2	ZINC001163636083	868578345	/nfs/dbraw/zinc/57/83/45/868578345.db2.gz	VLXXAUUBZHLADC-VIFPVBQESA-N	1	1	323.378	1.518	20	5		DDBDMO
Cn1c(Cl)cnc1C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001335888687	868599215	/nfs/dbraw/zinc/59/92/15/868599215.db2.gz	APBCXGYEDGZYSM-LLVKDONJSA-N	1	1	310.741	1.805	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@@H]2CCCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC001339268225	870430354	/nfs/dbraw/zinc/43/03/54/870430354.db2.gz	XCOVECHBCROMJM-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
Cc1c(CNC(=O)[C@H]2[NH2+]CCc3occc32)cccc1[N+](=O)[O-]	ZINC001340236936	870975611	/nfs/dbraw/zinc/97/56/11/870975611.db2.gz	OLHYSWKVKNHGRX-HNNXBMFYSA-N	1	1	315.329	1.999	20	5		DDBDMO
Cc1ccc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2N)[nH+]c1	ZINC001303956819	871170851	/nfs/dbraw/zinc/17/08/51/871170851.db2.gz	TYXPWWWLSAIXSL-UHFFFAOYSA-N	1	1	315.333	1.722	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](C(=O)N(C)C)C1	ZINC001308108816	871471376	/nfs/dbraw/zinc/47/13/76/871471376.db2.gz	MKFPHSMQZMAEDC-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1C[C@H](CO)[C@H](CCO)C1	ZINC001308982662	871542372	/nfs/dbraw/zinc/54/23/72/871542372.db2.gz	FVLIVSWWJKWIIW-ZIAGYGMSSA-N	1	1	308.378	1.634	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](c1ccco1)[NH+](C)C	ZINC001350754895	875873102	/nfs/dbraw/zinc/87/31/02/875873102.db2.gz	XTVIXRFTWNABFF-NSHDSACASA-N	1	1	321.337	1.112	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001352216038	876649901	/nfs/dbraw/zinc/64/99/01/876649901.db2.gz	GNLJMOFSEWSNBC-LBPRGKRZSA-N	1	1	303.362	1.821	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CCCC[N@@H+]1C	ZINC001353895338	877635317	/nfs/dbraw/zinc/63/53/17/877635317.db2.gz	TVOYUUWNPPFVLM-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1CO[C@H]1CCC[N@@H+](C)C1	ZINC001222772316	880693438	/nfs/dbraw/zinc/69/34/38/880693438.db2.gz	ALTRDJSUZIZNOL-NSHDSACASA-N	1	1	308.334	1.992	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC001222932106	880749241	/nfs/dbraw/zinc/74/92/41/880749241.db2.gz	QCJOCNUCCFXMAS-GFCCVEGCSA-N	1	1	321.333	1.973	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCc2cccc([N+](=O)[O-])c2C(=O)OC)C1	ZINC001223292833	880908979	/nfs/dbraw/zinc/90/89/79/880908979.db2.gz	AJTJJWMSZGDPRC-GFCCVEGCSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCc2ccc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001223413622	880951959	/nfs/dbraw/zinc/95/19/59/880951959.db2.gz	MHOOCIOSSDZKBQ-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[C@@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2ncncc2[N+](=O)[O-])C1	ZINC001228654009	883598000	/nfs/dbraw/zinc/59/80/00/883598000.db2.gz	DLNUXBSTSZTSML-NWDGAFQWSA-N	1	1	315.333	1.994	20	5		DDBDMO
C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ncncc2[N+](=O)[O-])C1	ZINC001228654009	883598010	/nfs/dbraw/zinc/59/80/10/883598010.db2.gz	DLNUXBSTSZTSML-NWDGAFQWSA-N	1	1	315.333	1.994	20	5		DDBDMO
CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccnc([N+](=O)[O-])c3)C[C@H]1[N@H+]2C	ZINC001233858967	887397252	/nfs/dbraw/zinc/39/72/52/887397252.db2.gz	IZUYNXQVGDWGNJ-DEQVHRJGSA-N	1	1	321.333	1.535	20	5		DDBDMO
N[C@]12CC[C@H]1C[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865057	892953472	/nfs/dbraw/zinc/95/34/72/892953472.db2.gz	XVZNMKRVJWRGNR-GUYCJALGSA-N	1	1	316.405	1.987	20	5		DDBDMO
N[C@]12CC[C@H]1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865057	892953483	/nfs/dbraw/zinc/95/34/83/892953483.db2.gz	XVZNMKRVJWRGNR-GUYCJALGSA-N	1	1	316.405	1.987	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2[C@H](C1)OCCN2C	ZINC001254554550	896499193	/nfs/dbraw/zinc/49/91/93/896499193.db2.gz	BOISKXGTLPDPLW-MAZHCROVSA-N	1	1	305.378	1.541	20	5		DDBDMO
CC(=O)N[C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254600391	896523674	/nfs/dbraw/zinc/52/36/74/896523674.db2.gz	PNCYLLMBLZESCU-HOCLYGCPSA-N	1	1	303.362	1.663	20	5		DDBDMO
COc1cc(N2CCC(N[C@@H]3C[C@H]3[NH3+])CC2)ccc1[N+](=O)[O-]	ZINC001256087526	897277663	/nfs/dbraw/zinc/27/76/63/897277663.db2.gz	DPVFOBJWPXHDTD-CHWSQXEVSA-N	1	1	306.366	1.261	20	5		DDBDMO
Cc1cc(NC(=O)NCCC[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC001263655945	900663068	/nfs/dbraw/zinc/66/30/68/900663068.db2.gz	XNWBJLGJRGWLEE-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000495202228	529443207	/nfs/dbraw/zinc/44/32/07/529443207.db2.gz	NRUVBGWANVSHDH-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000495202228	529443210	/nfs/dbraw/zinc/44/32/10/529443210.db2.gz	NRUVBGWANVSHDH-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000614934628	362084895	/nfs/dbraw/zinc/08/48/95/362084895.db2.gz	AVLKBCQZAONQOU-JTQLQIEISA-N	1	1	308.338	1.819	20	5		DDBDMO
CN(CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H]1CCC[N@@H+](C)C1	ZINC000090550399	185302531	/nfs/dbraw/zinc/30/25/31/185302531.db2.gz	YGDDNLZMJVOZLN-CYBMUJFWSA-N	1	1	308.382	1.030	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C	ZINC000444671534	529898573	/nfs/dbraw/zinc/89/85/73/529898573.db2.gz	CKWURWCSKUILCG-ZDUSSCGKSA-N	1	1	305.338	1.331	20	5		DDBDMO
C[N@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H](O)C(F)(F)F	ZINC000305789353	529928410	/nfs/dbraw/zinc/92/84/10/529928410.db2.gz	ZMDPIFANXRECCK-LLVKDONJSA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H](O)C(F)(F)F	ZINC000305789353	529928412	/nfs/dbraw/zinc/92/84/12/529928412.db2.gz	ZMDPIFANXRECCK-LLVKDONJSA-N	1	1	308.256	1.829	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC(F)(F)C[NH3+]	ZINC000418520262	529933624	/nfs/dbraw/zinc/93/36/24/529933624.db2.gz	CSDUKBFYZNZPEU-UHFFFAOYSA-N	1	1	316.308	1.373	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000041967725	352321867	/nfs/dbraw/zinc/32/18/67/352321867.db2.gz	GGKRMRLPUUUTAT-UHFFFAOYSA-N	1	1	315.395	1.663	20	5		DDBDMO
COc1ccc(C[N@H+](CC(N)=O)C2CCCC2)cc1[N+](=O)[O-]	ZINC000052826691	352626253	/nfs/dbraw/zinc/62/62/53/352626253.db2.gz	BKTGKTZFVTXIKQ-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1ccc(C[N@@H+](CC(N)=O)C2CCCC2)cc1[N+](=O)[O-]	ZINC000052826691	352626256	/nfs/dbraw/zinc/62/62/56/352626256.db2.gz	BKTGKTZFVTXIKQ-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000173101625	198184386	/nfs/dbraw/zinc/18/43/86/198184386.db2.gz	GUMGIIAIKXVUAB-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000064336999	352934342	/nfs/dbraw/zinc/93/43/42/352934342.db2.gz	RPDFTKVLHXIVLU-VHSXEESVSA-N	1	1	309.370	1.477	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000069528142	353165342	/nfs/dbraw/zinc/16/53/42/353165342.db2.gz	MXZQHBIWKKQHDJ-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1	ZINC000074073544	353288941	/nfs/dbraw/zinc/28/89/41/353288941.db2.gz	GXVMGARAJXEGIB-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(CO)CC2)cccc1[N+](=O)[O-]	ZINC000076991781	353447457	/nfs/dbraw/zinc/44/74/57/353447457.db2.gz	LGFMKRMXAKSBRL-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
COCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000080948224	353638540	/nfs/dbraw/zinc/63/85/40/353638540.db2.gz	OPDGNUNFSBVAHF-UHFFFAOYSA-N	1	1	324.337	1.662	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000093333452	353895482	/nfs/dbraw/zinc/89/54/82/353895482.db2.gz	ILPWCNORGBGEOA-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000093333452	353895486	/nfs/dbraw/zinc/89/54/86/353895486.db2.gz	ILPWCNORGBGEOA-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1sc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833225	354222266	/nfs/dbraw/zinc/22/22/66/354222266.db2.gz	WIAREDSNPPBDEK-KCJUWKMLSA-N	1	1	313.379	1.414	20	5		DDBDMO
Cc1sc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833225	354222269	/nfs/dbraw/zinc/22/22/69/354222269.db2.gz	WIAREDSNPPBDEK-KCJUWKMLSA-N	1	1	313.379	1.414	20	5		DDBDMO
NS(=O)(=O)c1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1	ZINC000314329345	354484853	/nfs/dbraw/zinc/48/48/53/354484853.db2.gz	ITBUESHYYVKGLF-UHFFFAOYSA-N	1	1	321.358	1.532	20	5		DDBDMO
Nc1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc(CO)c1[N+](=O)[O-]	ZINC000587309779	354881934	/nfs/dbraw/zinc/88/19/34/354881934.db2.gz	QUGNMBCJONQTNA-WCQYABFASA-N	1	1	306.366	1.708	20	5		DDBDMO
Cn1c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)ccc1[N+](=O)[O-]	ZINC000495123415	235128967	/nfs/dbraw/zinc/12/89/67/235128967.db2.gz	VELDELJYKJMJJZ-NEPJUHHUSA-N	1	1	306.366	1.490	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000590573513	355117500	/nfs/dbraw/zinc/11/75/00/355117500.db2.gz	ZOGOEAPMODYPDR-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000590443462	355097881	/nfs/dbraw/zinc/09/78/81/355097881.db2.gz	KKVUJZJVTKDJAD-ZWNOBZJWSA-N	1	1	304.350	1.413	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCc3cn[nH]n3)CC2)c1	ZINC000590604637	355128259	/nfs/dbraw/zinc/12/82/59/355128259.db2.gz	LMERXHNGVYSJNH-UHFFFAOYSA-N	1	1	302.338	1.078	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc([N+](=O)[O-])c1C	ZINC000590776542	355176648	/nfs/dbraw/zinc/17/66/48/355176648.db2.gz	WNAXXCHLRWVNTJ-SMDDNHRTSA-N	1	1	319.361	1.688	20	5		DDBDMO
CC(=O)N[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000591476884	355320693	/nfs/dbraw/zinc/32/06/93/355320693.db2.gz	MSMQDDOOUPBNLU-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](CO)[C@H]2C)c1	ZINC000593036806	355776562	/nfs/dbraw/zinc/77/65/62/355776562.db2.gz	UMKDYIOVSVHPBY-DGCLKSJQSA-N	1	1	322.361	1.974	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](C)[C@@H](C)[C@H]2C)n1	ZINC000593188911	355821145	/nfs/dbraw/zinc/82/11/45/355821145.db2.gz	FGIUHUPMZOOEGL-OUAUKWLOSA-N	1	1	309.370	1.364	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]2C)n1	ZINC000593188911	355821148	/nfs/dbraw/zinc/82/11/48/355821148.db2.gz	FGIUHUPMZOOEGL-OUAUKWLOSA-N	1	1	309.370	1.364	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593032470	355774940	/nfs/dbraw/zinc/77/49/40/355774940.db2.gz	XZZLOOUIXGOURI-TZMCWYRMSA-N	1	1	324.333	1.275	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593414965	355878376	/nfs/dbraw/zinc/87/83/76/355878376.db2.gz	HLEDRYYSONNNKN-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cn2)[C@@H](Cc2ccccc2)C1	ZINC000593505593	355906617	/nfs/dbraw/zinc/90/66/17/355906617.db2.gz	YAKPZRUQYDEXLS-AWEZNQCLSA-N	1	1	313.361	1.748	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000593578990	355932748	/nfs/dbraw/zinc/93/27/48/355932748.db2.gz	RQBUIIFUODOSOX-MNOVXSKESA-N	1	1	309.341	1.827	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000593420862	355880573	/nfs/dbraw/zinc/88/05/73/355880573.db2.gz	IJLAUQFQUWZODC-LBPRGKRZSA-N	1	1	307.325	1.629	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](OC2CCC2)C1	ZINC000594026163	356093100	/nfs/dbraw/zinc/09/31/00/356093100.db2.gz	DWROADFVBNQBCV-OAHLLOKOSA-N	1	1	321.377	1.790	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](C(=O)NCC3CC3)C2)c1[N+](=O)[O-]	ZINC000595289534	356434586	/nfs/dbraw/zinc/43/45/86/356434586.db2.gz	DWAPIZBRRBSCBO-LBPRGKRZSA-N	1	1	322.365	1.629	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](C(=O)NCC3CC3)C2)c1[N+](=O)[O-]	ZINC000595289534	356434591	/nfs/dbraw/zinc/43/45/91/356434591.db2.gz	DWAPIZBRRBSCBO-LBPRGKRZSA-N	1	1	322.365	1.629	20	5		DDBDMO
CCOC[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000081520575	192279640	/nfs/dbraw/zinc/27/96/40/192279640.db2.gz	ZTFPTVMSBNNCOZ-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000081520575	192279643	/nfs/dbraw/zinc/27/96/43/192279643.db2.gz	ZTFPTVMSBNNCOZ-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])n2C)CCCO1	ZINC000347094712	283176106	/nfs/dbraw/zinc/17/61/06/283176106.db2.gz	DZNWNCIHDJSWHG-GFCCVEGCSA-N	1	1	324.381	1.164	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](Cn2ccnn2)C1	ZINC000595607890	356574402	/nfs/dbraw/zinc/57/44/02/356574402.db2.gz	LKGUGIQROIRKRL-NSHDSACASA-N	1	1	305.313	1.848	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595756497	356638257	/nfs/dbraw/zinc/63/82/57/356638257.db2.gz	GMPCFPUGDNDKMI-LRDDRELGSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595756497	356638259	/nfs/dbraw/zinc/63/82/59/356638259.db2.gz	GMPCFPUGDNDKMI-LRDDRELGSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595835110	356671108	/nfs/dbraw/zinc/67/11/08/356671108.db2.gz	UNVHUHAKPXALEJ-OLZOCXBDSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595835110	356671111	/nfs/dbraw/zinc/67/11/11/356671111.db2.gz	UNVHUHAKPXALEJ-OLZOCXBDSA-N	1	1	319.361	1.810	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H]2COC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829825	356668094	/nfs/dbraw/zinc/66/80/94/356668094.db2.gz	ILBFDPUHCPWWIL-NWDGAFQWSA-N	1	1	305.334	1.502	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]2COC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829825	356668097	/nfs/dbraw/zinc/66/80/97/356668097.db2.gz	ILBFDPUHCPWWIL-NWDGAFQWSA-N	1	1	305.334	1.502	20	5		DDBDMO
Cc1c(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)cccc1[N+](=O)[O-]	ZINC000595864500	356682798	/nfs/dbraw/zinc/68/27/98/356682798.db2.gz	BGIJJSGBNMBVMT-INIZCTEOSA-N	1	1	319.405	1.934	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1	ZINC000596148173	356791410	/nfs/dbraw/zinc/79/14/10/356791410.db2.gz	ZAXHNSGEQGWPRT-UHFFFAOYSA-N	1	1	309.370	1.119	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)CO1	ZINC000596432131	356878045	/nfs/dbraw/zinc/87/80/45/356878045.db2.gz	QMHVUIHBEFDTJX-WDEREUQCSA-N	1	1	322.365	1.215	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)CO1	ZINC000596432131	356878047	/nfs/dbraw/zinc/87/80/47/356878047.db2.gz	QMHVUIHBEFDTJX-WDEREUQCSA-N	1	1	322.365	1.215	20	5		DDBDMO
CCC[N@H+]1CC[C@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000596516253	356903173	/nfs/dbraw/zinc/90/31/73/356903173.db2.gz	DEVOUTZVPPXMLU-NSHDSACASA-N	1	1	322.365	1.981	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1COCC[NH2+]1	ZINC000237256982	202208321	/nfs/dbraw/zinc/20/83/21/202208321.db2.gz	HSDOCWANYOEXFU-LBPRGKRZSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)C2	ZINC000597714278	357299083	/nfs/dbraw/zinc/29/90/83/357299083.db2.gz	HYYWNJNVSCZKMO-HNNXBMFYSA-N	1	1	321.381	1.126	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C	ZINC000597859331	357361645	/nfs/dbraw/zinc/36/16/45/357361645.db2.gz	UOYDIHCPVZBIJL-NSHDSACASA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597923777	357383740	/nfs/dbraw/zinc/38/37/40/357383740.db2.gz	POQMNVMFRCGDEP-LLVKDONJSA-N	1	1	309.370	1.089	20	5		DDBDMO
C[C@H](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[NH+](C)C	ZINC000597999828	357415923	/nfs/dbraw/zinc/41/59/23/357415923.db2.gz	SFYGGBYLWJESHZ-SECBINFHSA-N	1	1	305.338	1.541	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1CO	ZINC000598648476	357669267	/nfs/dbraw/zinc/66/92/67/357669267.db2.gz	RYJWXIMRZIMVHH-WDEREUQCSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1CO	ZINC000598648476	357669271	/nfs/dbraw/zinc/66/92/71/357669271.db2.gz	RYJWXIMRZIMVHH-WDEREUQCSA-N	1	1	304.350	1.921	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC1COC1)c1cccc([N+](=O)[O-])c1	ZINC000599079326	357808878	/nfs/dbraw/zinc/80/88/78/357808878.db2.gz	DPHGMXADXIUISU-CQSZACIVSA-N	1	1	302.334	1.654	20	5		DDBDMO
CCC(=O)c1ccc(NCC[N@@H+]2CC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000599199160	357847454	/nfs/dbraw/zinc/84/74/54/357847454.db2.gz	FTQBQTUTGZPLRI-LBPRGKRZSA-N	1	1	307.350	1.666	20	5		DDBDMO
CCC(=O)c1ccc(NCC[N@H+]2CC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000599199160	357847458	/nfs/dbraw/zinc/84/74/58/357847458.db2.gz	FTQBQTUTGZPLRI-LBPRGKRZSA-N	1	1	307.350	1.666	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000599568171	357976905	/nfs/dbraw/zinc/97/69/05/357976905.db2.gz	QVEWEMFEVDZEMP-NHYWBVRUSA-N	1	1	308.334	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCO[C@@H]2CCC[C@@H]21	ZINC000599600126	357988406	/nfs/dbraw/zinc/98/84/06/357988406.db2.gz	YOOSLURCAYKTKK-KCQAQPDRSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@@H]2CCC[C@@H]21	ZINC000599600126	357988410	/nfs/dbraw/zinc/98/84/10/357988410.db2.gz	YOOSLURCAYKTKK-KCQAQPDRSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCc3nc(C4CC4)ncc3C2)n1	ZINC000599619786	357994575	/nfs/dbraw/zinc/99/45/75/357994575.db2.gz	OYZFHLRJRXJIHK-UHFFFAOYSA-N	1	1	314.349	1.517	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599646023	358006136	/nfs/dbraw/zinc/00/61/36/358006136.db2.gz	YLNVMGUSVQAYDR-BJHJDKERSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1C[C@@H](O)C1	ZINC000599656517	358010887	/nfs/dbraw/zinc/01/08/87/358010887.db2.gz	WVKJTTZAQPJSNC-FRRDWIJNSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1c(NC(=O)NCC[N@H+]2CC[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000599701486	358032355	/nfs/dbraw/zinc/03/23/55/358032355.db2.gz	IZSQLHGKCQSNQV-LLVKDONJSA-N	1	1	308.338	1.091	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180531162	199172001	/nfs/dbraw/zinc/17/20/01/199172001.db2.gz	KYMQVRDPRBGTDJ-JTQLQIEISA-N	1	1	307.354	1.176	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](O)[C@@H]3CCCO3)c2c1	ZINC000601201016	358445211	/nfs/dbraw/zinc/44/52/11/358445211.db2.gz	JVICIHBNMZFSBM-GJZGRUSLSA-N	1	1	303.318	1.517	20	5		DDBDMO
O=C1CC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCN1	ZINC000601175977	358434672	/nfs/dbraw/zinc/43/46/72/358434672.db2.gz	MELSJVFEYOPZIQ-SNVBAGLBSA-N	1	1	300.318	1.646	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@H+](C)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000601186366	358439203	/nfs/dbraw/zinc/43/92/03/358439203.db2.gz	NOVGYWAHOMLUQC-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@@H+](C)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000601186366	358439205	/nfs/dbraw/zinc/43/92/05/358439205.db2.gz	NOVGYWAHOMLUQC-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+]CCOC[C@H]3CCOC3)nc2c1	ZINC000602534677	359032187	/nfs/dbraw/zinc/03/21/87/359032187.db2.gz	JAHJQHYJRJONIM-NSHDSACASA-N	1	1	321.333	1.879	20	5		DDBDMO
CN([C@@H]1CCC[N@H+](C)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185845820	199894219	/nfs/dbraw/zinc/89/42/19/199894219.db2.gz	IOKVAZRWXJWYKE-GFCCVEGCSA-N	1	1	313.379	1.310	20	5		DDBDMO
CN([C@@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185845820	199894221	/nfs/dbraw/zinc/89/42/21/199894221.db2.gz	IOKVAZRWXJWYKE-GFCCVEGCSA-N	1	1	313.379	1.310	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1[C@@H](O)C(F)(F)F	ZINC000602775665	359182327	/nfs/dbraw/zinc/18/23/27/359182327.db2.gz	MAFJAVFFTSAAQN-GXSJLCMTSA-N	1	1	322.287	1.487	20	5		DDBDMO
CCOC(=O)C[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C(C)(C)C	ZINC000602780943	359185950	/nfs/dbraw/zinc/18/59/50/359185950.db2.gz	DFWDQLUJNMACFF-UHFFFAOYSA-N	1	1	312.370	1.763	20	5		DDBDMO
CCOC(=O)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C(C)(C)C	ZINC000602780943	359185953	/nfs/dbraw/zinc/18/59/53/359185953.db2.gz	DFWDQLUJNMACFF-UHFFFAOYSA-N	1	1	312.370	1.763	20	5		DDBDMO
COCCO[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602795267	359197847	/nfs/dbraw/zinc/19/78/47/359197847.db2.gz	ADBXHDQYXPLJGD-ZDUSSCGKSA-N	1	1	312.370	1.227	20	5		DDBDMO
COCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1cccnc1	ZINC000602812621	359209164	/nfs/dbraw/zinc/20/91/64/359209164.db2.gz	AOPOPRQRTAUVPG-UHFFFAOYSA-N	1	1	319.365	1.643	20	5		DDBDMO
COCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1cccnc1	ZINC000602812621	359209166	/nfs/dbraw/zinc/20/91/66/359209166.db2.gz	AOPOPRQRTAUVPG-UHFFFAOYSA-N	1	1	319.365	1.643	20	5		DDBDMO
[NH3+]C1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCCCC1	ZINC000237768805	202351392	/nfs/dbraw/zinc/35/13/92/202351392.db2.gz	WDRYIVADKHJLJA-UHFFFAOYSA-N	1	1	317.349	1.863	20	5		DDBDMO
COC[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000189420958	200398878	/nfs/dbraw/zinc/39/88/78/200398878.db2.gz	ASHYMNOAKIYZHY-IUODEOHRSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000189420958	200398879	/nfs/dbraw/zinc/39/88/79/200398879.db2.gz	ASHYMNOAKIYZHY-IUODEOHRSA-N	1	1	310.350	1.709	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000609269711	360285949	/nfs/dbraw/zinc/28/59/49/360285949.db2.gz	VXNSBHDCOFPKOV-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
CC(C)(C)C[N@@H+](CCO)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000609483487	360312415	/nfs/dbraw/zinc/31/24/15/360312415.db2.gz	MSXYCXSIPQLRBI-UHFFFAOYSA-N	1	1	309.366	1.874	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609584787	360328938	/nfs/dbraw/zinc/32/89/38/360328938.db2.gz	IWBWVYPYXQCXTN-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)CC[C@H]2C)cc1[N+](=O)[O-]	ZINC000609584781	360329195	/nfs/dbraw/zinc/32/91/95/360329195.db2.gz	ITLHELYXWFRKQB-GFCCVEGCSA-N	1	1	321.377	1.699	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NC[C@H](C)C[NH+]2CCOCC2)n1	ZINC000611616853	360777497	/nfs/dbraw/zinc/77/74/97/360777497.db2.gz	QWLVLGCAUYLBSS-NSHDSACASA-N	1	1	308.382	1.987	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@]1(CO)CCOC1	ZINC000613130200	361282691	/nfs/dbraw/zinc/28/26/91/361282691.db2.gz	ABAPDAZDUQURPR-OAHLLOKOSA-N	1	1	310.350	1.447	20	5		DDBDMO
Nc1c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cccc1[N+](=O)[O-]	ZINC000619252140	363945602	/nfs/dbraw/zinc/94/56/02/363945602.db2.gz	FEUDVSHJUGYHKW-VXGBXAGGSA-N	1	1	322.340	1.435	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516993	364048401	/nfs/dbraw/zinc/04/84/01/364048401.db2.gz	SRJUTHBBAUVZFU-MFKMUULPSA-N	1	1	321.333	1.708	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516993	364048405	/nfs/dbraw/zinc/04/84/05/364048405.db2.gz	SRJUTHBBAUVZFU-MFKMUULPSA-N	1	1	321.333	1.708	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1	ZINC000261924354	203154271	/nfs/dbraw/zinc/15/42/71/203154271.db2.gz	IWUQUCZDOQBZNV-CYBMUJFWSA-N	1	1	318.308	1.849	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCc3nn(C)c(=O)cc3C2)cc1[N+](=O)[O-]	ZINC000093756224	193300139	/nfs/dbraw/zinc/30/01/39/193300139.db2.gz	VLSCXXSBWDDDIL-UHFFFAOYSA-N	1	1	314.345	1.555	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCc3nn(C)c(=O)cc3C2)cc1[N+](=O)[O-]	ZINC000093756224	193300142	/nfs/dbraw/zinc/30/01/42/193300142.db2.gz	VLSCXXSBWDDDIL-UHFFFAOYSA-N	1	1	314.345	1.555	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000264685207	204077717	/nfs/dbraw/zinc/07/77/17/204077717.db2.gz	QVVLADVPPRKYIQ-NSHDSACASA-N	1	1	323.397	1.732	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000264781575	204150569	/nfs/dbraw/zinc/15/05/69/204150569.db2.gz	QVFLFHLOONIBEF-NSHDSACASA-N	1	1	309.326	1.161	20	5		DDBDMO
COc1cc(C(=O)N2CC[NH+](C3CCC3)CC2)ccc1[N+](=O)[O-]	ZINC000264960421	204305465	/nfs/dbraw/zinc/30/54/65/204305465.db2.gz	MESQQJWWNRYSRP-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288342105	220096811	/nfs/dbraw/zinc/09/68/11/220096811.db2.gz	ISEDWBLMSBAAOG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288342105	220096812	/nfs/dbraw/zinc/09/68/12/220096812.db2.gz	ISEDWBLMSBAAOG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C1CCCN1CC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000076996341	248213337	/nfs/dbraw/zinc/21/33/37/248213337.db2.gz	KFVSKKYYVLRXQT-UHFFFAOYSA-N	1	1	318.377	1.339	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000173527739	248342030	/nfs/dbraw/zinc/34/20/30/248342030.db2.gz	RUVOMUIPMDZAMS-LBPRGKRZSA-N	1	1	310.350	1.829	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(CCOc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000284481185	218044837	/nfs/dbraw/zinc/04/48/37/218044837.db2.gz	AWCVUDAWKDAUMK-HOCLYGCPSA-N	1	1	321.377	1.379	20	5		DDBDMO
C[C@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCCC[C@@H]1C	ZINC000339003577	250242745	/nfs/dbraw/zinc/24/27/45/250242745.db2.gz	OCJKYRYAEGHHQS-WDEREUQCSA-N	1	1	321.381	1.764	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000106397020	194206784	/nfs/dbraw/zinc/20/67/84/194206784.db2.gz	KJHIBIGMPDLKGI-AWEZNQCLSA-N	1	1	307.350	1.124	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)C1	ZINC000491564791	532973207	/nfs/dbraw/zinc/97/32/07/532973207.db2.gz	ZAIKOVMKVHMVPY-VBROQKIQSA-N	1	1	319.361	1.445	20	5		DDBDMO
O=C(C[N@@H+](CCO)CC1CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000352463863	285068278	/nfs/dbraw/zinc/06/82/78/285068278.db2.gz	LJVIXXISHVUCFP-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
CCc1[nH+]ccn1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000158332644	197263177	/nfs/dbraw/zinc/26/31/77/197263177.db2.gz	QGGYTNCSWAZJKH-UHFFFAOYSA-N	1	1	300.318	1.943	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCn2ccnc2)CC1	ZINC000298032251	285165669	/nfs/dbraw/zinc/16/56/69/285165669.db2.gz	GDZGBUVJLAATNX-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
C[N@@H+]1CCCC[C@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507878	781991993	/nfs/dbraw/zinc/99/19/93/781991993.db2.gz	MCCBQCXNOWAOSR-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507878	781992000	/nfs/dbraw/zinc/99/20/00/781992000.db2.gz	MCCBQCXNOWAOSR-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@@H+]1CCCC[C@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507880	781992238	/nfs/dbraw/zinc/99/22/38/781992238.db2.gz	MCCBQCXNOWAOSR-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507880	781992246	/nfs/dbraw/zinc/99/22/46/781992246.db2.gz	MCCBQCXNOWAOSR-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H](C1CC1)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000073800330	406894700	/nfs/dbraw/zinc/89/47/00/406894700.db2.gz	JKGWGUPBQATVPH-SECBINFHSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[NH+]1CCN(Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1	ZINC000089884016	407155600	/nfs/dbraw/zinc/15/56/00/407155600.db2.gz	RAKZGKHVZUPYEC-UHFFFAOYSA-N	1	1	302.334	1.997	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCCNC1=O	ZINC000105610985	407354576	/nfs/dbraw/zinc/35/45/76/407354576.db2.gz	PVDSNBURIPTXSW-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000124907404	407373175	/nfs/dbraw/zinc/37/31/75/407373175.db2.gz	HMHLHDYZCGKSCZ-NSHDSACASA-N	1	1	322.365	1.690	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000125399730	407387156	/nfs/dbraw/zinc/38/71/56/407387156.db2.gz	DHDIXYGCFMVVKX-GHMZBOCLSA-N	1	1	307.354	1.027	20	5		DDBDMO
NC(=O)CC[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000170731883	407486597	/nfs/dbraw/zinc/48/65/97/407486597.db2.gz	YVHWIEILBYXRKX-ZDUSSCGKSA-N	1	1	321.377	1.951	20	5		DDBDMO
C[C@@H](C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000266541464	407551404	/nfs/dbraw/zinc/55/14/04/407551404.db2.gz	QCHAPEJHYKOPMU-XJKSGUPXSA-N	1	1	318.377	1.888	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC(C)(C)O	ZINC000114487435	407584855	/nfs/dbraw/zinc/58/48/55/407584855.db2.gz	XZGHDKXLPARPNG-CYBMUJFWSA-N	1	1	312.366	1.427	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCCCO)CC1	ZINC000265919660	407510544	/nfs/dbraw/zinc/51/05/44/407510544.db2.gz	ZSRXEEYVZVSICV-UHFFFAOYSA-N	1	1	307.350	1.125	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271439531	407685530	/nfs/dbraw/zinc/68/55/30/407685530.db2.gz	TVFXGQSSCABBTO-NSHDSACASA-N	1	1	309.370	1.036	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](CO)C1	ZINC000266944686	407686094	/nfs/dbraw/zinc/68/60/94/407686094.db2.gz	SDJASJLSMKFQBQ-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
COc1cc(N2C[C@@H]3OCC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000153134324	407759728	/nfs/dbraw/zinc/75/97/28/407759728.db2.gz	ICIFIEAJOIQGEX-JSGCOSHPSA-N	1	1	311.313	1.262	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000171803845	407770666	/nfs/dbraw/zinc/77/06/66/407770666.db2.gz	PSTLOWSBRHJFBF-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@@H]1CCOC1	ZINC000117340440	407830717	/nfs/dbraw/zinc/83/07/17/407830717.db2.gz	UCNYGTYKZYFNSY-GFCCVEGCSA-N	1	1	321.333	1.614	20	5		DDBDMO
CCNC(=O)C[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000133524846	407854980	/nfs/dbraw/zinc/85/49/80/407854980.db2.gz	UXRJGTARUZJKRZ-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
COc1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000153544189	407847209	/nfs/dbraw/zinc/84/72/09/407847209.db2.gz	MDZQOFIADZHDGR-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000154073321	407965875	/nfs/dbraw/zinc/96/58/75/407965875.db2.gz	ZPEPUSSEUVKUTB-UMVBOHGHSA-N	1	1	324.377	1.752	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1CO	ZINC000118400813	407917902	/nfs/dbraw/zinc/91/79/02/407917902.db2.gz	GNENHLPKUWEYGY-LBPRGKRZSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@@H](CO)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272477259	407941498	/nfs/dbraw/zinc/94/14/98/407941498.db2.gz	BJBUIBIZNLUJJS-RISCZKNCSA-N	1	1	304.350	1.636	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000118751817	407941453	/nfs/dbraw/zinc/94/14/53/407941453.db2.gz	FBKHIMUNNXASHQ-AWEZNQCLSA-N	1	1	322.365	1.515	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCc3ccccc3[C@H]2CO)c1	ZINC000268457407	408052012	/nfs/dbraw/zinc/05/20/12/408052012.db2.gz	COVXKDMIHFKOPV-OAHLLOKOSA-N	1	1	302.334	1.383	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000245852738	408080185	/nfs/dbraw/zinc/08/01/85/408080185.db2.gz	DBZZVXKEZWXKQB-HIFRSBDPSA-N	1	1	310.350	1.181	20	5		DDBDMO
CCOCCC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000273572938	408251645	/nfs/dbraw/zinc/25/16/45/408251645.db2.gz	DMZVKHCBNHDWEH-OCCSQVGLSA-N	1	1	323.397	1.934	20	5		DDBDMO
C[C@@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822332	408256552	/nfs/dbraw/zinc/25/65/52/408256552.db2.gz	PLXJOWNWGVAQCV-GHMZBOCLSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000182822332	408256555	/nfs/dbraw/zinc/25/65/55/408256555.db2.gz	PLXJOWNWGVAQCV-GHMZBOCLSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822332	408256563	/nfs/dbraw/zinc/25/65/63/408256563.db2.gz	PLXJOWNWGVAQCV-GHMZBOCLSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nnnc2Sc2ccccc2[N+](=O)[O-])C1	ZINC000131974459	162026923	/nfs/dbraw/zinc/02/69/23/162026923.db2.gz	UTDVNQBNUFUOOJ-JTQLQIEISA-N	1	1	320.378	1.684	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CC[C@H]1CCCC[N@H+]1C	ZINC000172832758	162307922	/nfs/dbraw/zinc/30/79/22/162307922.db2.gz	QCHLORYYCVBTDK-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000183594337	408450050	/nfs/dbraw/zinc/45/00/50/408450050.db2.gz	SDPCLACHKJQGIO-NSHDSACASA-N	1	1	323.353	1.222	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000274520376	408436535	/nfs/dbraw/zinc/43/65/35/408436535.db2.gz	SCQLHVBATIRFHN-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000264429785	408486694	/nfs/dbraw/zinc/48/66/94/408486694.db2.gz	ALKLVQKIRFZDKX-NSHDSACASA-N	1	1	307.354	1.327	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000183648265	408463142	/nfs/dbraw/zinc/46/31/42/408463142.db2.gz	JAVQGONZEAAQDX-SECBINFHSA-N	1	1	318.337	1.143	20	5		DDBDMO
CCC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248462883	408573659	/nfs/dbraw/zinc/57/36/59/408573659.db2.gz	QFWBTHHABKBDED-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248462883	408573667	/nfs/dbraw/zinc/57/36/67/408573667.db2.gz	QFWBTHHABKBDED-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)C[C@H]2C1	ZINC000192503129	408600158	/nfs/dbraw/zinc/60/01/58/408600158.db2.gz	WTUUVWMPZKEZDY-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
Cc1nc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000275662415	408636527	/nfs/dbraw/zinc/63/65/27/408636527.db2.gz	YROLTXUWUKRUMK-LLVKDONJSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H]1CO	ZINC000248936517	408664114	/nfs/dbraw/zinc/66/41/14/408664114.db2.gz	NHKDPQYNPIALBG-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H]1CO	ZINC000248936517	408664118	/nfs/dbraw/zinc/66/41/18/408664118.db2.gz	NHKDPQYNPIALBG-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)NCCn1cc[nH+]c1C	ZINC000275765847	408671128	/nfs/dbraw/zinc/67/11/28/408671128.db2.gz	PIAWYZWROXABLE-UHFFFAOYSA-N	1	1	319.321	1.930	20	5		DDBDMO
CC[C@@H](NC(=O)[C@H]1C[N@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796407	408715015	/nfs/dbraw/zinc/71/50/15/408715015.db2.gz	QNEJPXFNMUPRQG-ZIAGYGMSSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[C@@H](NC(=O)[C@H]1C[N@@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796407	408715019	/nfs/dbraw/zinc/71/50/19/408715019.db2.gz	QNEJPXFNMUPRQG-ZIAGYGMSSA-N	1	1	307.350	1.493	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000252441771	408793466	/nfs/dbraw/zinc/79/34/66/408793466.db2.gz	RXRDTFGXKQPDQQ-DZGCQCFKSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280795053	408835199	/nfs/dbraw/zinc/83/51/99/408835199.db2.gz	RLWJNBRSEQYRJB-MEBBXXQBSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000285704945	408847411	/nfs/dbraw/zinc/84/74/11/408847411.db2.gz	IYVGSUYMFUFCBY-KGLIPLIRSA-N	1	1	305.334	1.140	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+]3CCCC[C@H]3C2)n1	ZINC000280933401	408861018	/nfs/dbraw/zinc/86/10/18/408861018.db2.gz	HQEHSUNWFSCAHT-NSHDSACASA-N	1	1	320.349	1.451	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+]3CCCC[C@H]3C2)n1	ZINC000280933401	408861021	/nfs/dbraw/zinc/86/10/21/408861021.db2.gz	HQEHSUNWFSCAHT-NSHDSACASA-N	1	1	320.349	1.451	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)[C@@H]2C)c1[N+](=O)[O-]	ZINC000286989450	409003046	/nfs/dbraw/zinc/00/30/46/409003046.db2.gz	GXVHQJYVZHKGAX-WDEREUQCSA-N	1	1	307.354	1.325	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000277609203	408976085	/nfs/dbraw/zinc/97/60/85/408976085.db2.gz	PNOPMVSYYFROCT-UONOGXRCSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000293346390	409094413	/nfs/dbraw/zinc/09/44/13/409094413.db2.gz	HLNZEXCDKNZFDQ-FRRDWIJNSA-N	1	1	320.393	1.946	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283648965	409190931	/nfs/dbraw/zinc/19/09/31/409190931.db2.gz	CUROZUDNUWCDAA-SECBINFHSA-N	1	1	312.345	1.776	20	5		DDBDMO
C[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C[NH+](C)C	ZINC000293966124	409216421	/nfs/dbraw/zinc/21/64/21/409216421.db2.gz	WNPMJJWKGMJBGV-VIFPVBQESA-N	1	1	305.338	1.399	20	5		DDBDMO
NC(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000317043683	164025340	/nfs/dbraw/zinc/02/53/40/164025340.db2.gz	VBVFLVVBINSNDH-NEPJUHHUSA-N	1	1	304.350	1.732	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000354001344	409592131	/nfs/dbraw/zinc/59/21/31/409592131.db2.gz	OAEONKCSVDAKMX-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccon1	ZINC000349242778	409760289	/nfs/dbraw/zinc/76/02/89/409760289.db2.gz	PBJQHWWUCIXUMH-MNOVXSKESA-N	1	1	307.306	1.673	20	5		DDBDMO
C[C@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1	ZINC000332061812	409845437	/nfs/dbraw/zinc/84/54/37/409845437.db2.gz	QVLVHKXDFAWQCW-NSHDSACASA-N	1	1	321.333	1.614	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1	ZINC000332061812	409845443	/nfs/dbraw/zinc/84/54/43/409845443.db2.gz	QVLVHKXDFAWQCW-NSHDSACASA-N	1	1	321.333	1.614	20	5		DDBDMO
C[N@H+]1CCCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000297705573	409966767	/nfs/dbraw/zinc/96/67/67/409966767.db2.gz	BAGYOPQGHGOTHU-UHFFFAOYSA-N	1	1	317.349	1.782	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000332234647	410001604	/nfs/dbraw/zinc/00/16/04/410001604.db2.gz	RREYIMXJVPJNDS-LLVKDONJSA-N	1	1	314.345	1.919	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000332234647	410001612	/nfs/dbraw/zinc/00/16/12/410001612.db2.gz	RREYIMXJVPJNDS-LLVKDONJSA-N	1	1	314.345	1.919	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000298517397	410270353	/nfs/dbraw/zinc/27/03/53/410270353.db2.gz	LDOJPBINKHPESP-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000357908910	410321982	/nfs/dbraw/zinc/32/19/82/410321982.db2.gz	FMLOGRLGKUOUQM-GFCCVEGCSA-N	1	1	309.391	1.897	20	5		DDBDMO
CC[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@@H](C)CO	ZINC000339629579	410345515	/nfs/dbraw/zinc/34/55/15/410345515.db2.gz	LWOBCUCYKHOXDK-NSHDSACASA-N	1	1	323.349	1.596	20	5		DDBDMO
CCOc1ccc([C@@H](C)NC[C@@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358251984	410421341	/nfs/dbraw/zinc/42/13/41/410421341.db2.gz	NDFMMNRJFANMOT-WBMJQRKESA-N	1	1	323.393	1.711	20	5		DDBDMO
CCOc1ccc([C@@H](C)[NH2+]C[C@@]2(O)CCN(C)C2)cc1[N+](=O)[O-]	ZINC000358251984	410421349	/nfs/dbraw/zinc/42/13/49/410421349.db2.gz	NDFMMNRJFANMOT-WBMJQRKESA-N	1	1	323.393	1.711	20	5		DDBDMO
CCOc1ccc([C@@H](C)NC[C@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358251983	410421418	/nfs/dbraw/zinc/42/14/18/410421418.db2.gz	NDFMMNRJFANMOT-MLGOLLRUSA-N	1	1	323.393	1.711	20	5		DDBDMO
CCOc1ccc([C@@H](C)[NH2+]C[C@]2(O)CCN(C)C2)cc1[N+](=O)[O-]	ZINC000358251983	410421432	/nfs/dbraw/zinc/42/14/32/410421432.db2.gz	NDFMMNRJFANMOT-MLGOLLRUSA-N	1	1	323.393	1.711	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](CO)CC1	ZINC000339747521	410432129	/nfs/dbraw/zinc/43/21/29/410432129.db2.gz	KQISYMVEZCRLMO-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](CO)CC1	ZINC000339747521	410432133	/nfs/dbraw/zinc/43/21/33/410432133.db2.gz	KQISYMVEZCRLMO-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
CCC[N@@H+](CCO)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000299235468	410576214	/nfs/dbraw/zinc/57/62/14/410576214.db2.gz	SCZIFDOWCJHJGV-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000330436400	410690634	/nfs/dbraw/zinc/69/06/34/410690634.db2.gz	MMIPFIFGOJRHSM-NSHDSACASA-N	1	1	309.370	1.127	20	5		DDBDMO
Cc1nn(C)c(NC[C@@H]2C[N@@H+](CC(C)C)CCO2)c1[N+](=O)[O-]	ZINC000301301612	410696296	/nfs/dbraw/zinc/69/62/96/410696296.db2.gz	VMOVOTXSQLLLGR-GFCCVEGCSA-N	1	1	311.386	1.405	20	5		DDBDMO
Cc1ccc(NC[C@](C)(O)C[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC000301740609	410784480	/nfs/dbraw/zinc/78/44/80/410784480.db2.gz	DPAQYPQHWKLSME-HNNXBMFYSA-N	1	1	309.366	1.398	20	5		DDBDMO
C[C@@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330599613	410813811	/nfs/dbraw/zinc/81/38/11/410813811.db2.gz	ULMZLCIZBONOSL-NEPJUHHUSA-N	1	1	307.350	1.525	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(O)CCC1	ZINC000353482458	411020013	/nfs/dbraw/zinc/02/00/13/411020013.db2.gz	MIIRMHPENQHJGC-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(O)CCC1	ZINC000353482458	411020021	/nfs/dbraw/zinc/02/00/21/411020021.db2.gz	MIIRMHPENQHJGC-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@H+](C3CCOCC3)CC2)s1	ZINC000374491878	418534817	/nfs/dbraw/zinc/53/48/17/418534817.db2.gz	INLJQNSAHKCBAB-UHFFFAOYSA-N	1	1	312.395	1.742	20	5		DDBDMO
COc1cccc(C(=O)N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000192904574	418527686	/nfs/dbraw/zinc/52/76/86/418527686.db2.gz	UXWLTMPYJZRUNE-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360947545	418551776	/nfs/dbraw/zinc/55/17/76/418551776.db2.gz	XMXCEBHQVHAFGA-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360947545	418551780	/nfs/dbraw/zinc/55/17/80/418551780.db2.gz	XMXCEBHQVHAFGA-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)CCO1	ZINC000367049125	418555073	/nfs/dbraw/zinc/55/50/73/418555073.db2.gz	CDRHCSVDMYKJBM-ZIAGYGMSSA-N	1	1	323.397	1.149	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2cc(C)c([N+](=O)[O-])cc2F)CC1	ZINC000290943003	222019204	/nfs/dbraw/zinc/01/92/04/222019204.db2.gz	KYNUTDVYDJBLMH-UHFFFAOYSA-N	1	1	324.356	1.665	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000190063980	222066344	/nfs/dbraw/zinc/06/63/44/222066344.db2.gz	ZXASDKLSINTJPX-GWCFXTLKSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000190063980	222066348	/nfs/dbraw/zinc/06/63/48/222066348.db2.gz	ZXASDKLSINTJPX-GWCFXTLKSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000375053029	418595894	/nfs/dbraw/zinc/59/58/94/418595894.db2.gz	DWUBOMYXJFZFGQ-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000375035556	418592118	/nfs/dbraw/zinc/59/21/18/418592118.db2.gz	CTNFLEBQLKZOOS-IAQYHMDHSA-N	1	1	318.377	1.485	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2C[C@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316758	418628299	/nfs/dbraw/zinc/62/82/99/418628299.db2.gz	ZHMWGBYYEFISPT-KBPBESRZSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C1[C@@H]([N@H+]2C[C@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316758	418628300	/nfs/dbraw/zinc/62/83/00/418628300.db2.gz	ZHMWGBYYEFISPT-KBPBESRZSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000368240620	418708535	/nfs/dbraw/zinc/70/85/35/418708535.db2.gz	DHANKWIXMBMHNI-RWMBFGLXSA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000368240620	418708537	/nfs/dbraw/zinc/70/85/37/418708537.db2.gz	DHANKWIXMBMHNI-RWMBFGLXSA-N	1	1	308.334	1.198	20	5		DDBDMO
Cc1sc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000367995244	418671355	/nfs/dbraw/zinc/67/13/55/418671355.db2.gz	YKCWIXJCELIHKB-MRVPVSSYSA-N	1	1	305.306	1.644	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000420993408	419427130	/nfs/dbraw/zinc/42/71/30/419427130.db2.gz	ATBYJVMNQOVPLL-WFASDCNBSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c1	ZINC000411938081	419507478	/nfs/dbraw/zinc/50/74/78/419507478.db2.gz	JOCWHSLPFUPVNQ-HUUCEWRRSA-N	1	1	302.334	1.599	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000421705312	419688538	/nfs/dbraw/zinc/68/85/38/419688538.db2.gz	QZLAUXLJRUMRJM-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1Cc1cccc(C[NH+]2CCOCC2)c1	ZINC000421832276	419747021	/nfs/dbraw/zinc/74/70/21/419747021.db2.gz	FZODUOQJIRSASM-UHFFFAOYSA-N	1	1	316.361	1.980	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+](C)C1	ZINC000413511380	419787528	/nfs/dbraw/zinc/78/75/28/419787528.db2.gz	ZLKBUPZLGTZHHB-LBPRGKRZSA-N	1	1	322.365	1.148	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000413511380	419787534	/nfs/dbraw/zinc/78/75/34/419787534.db2.gz	ZLKBUPZLGTZHHB-LBPRGKRZSA-N	1	1	322.365	1.148	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CC2)CC1	ZINC000299357632	229071014	/nfs/dbraw/zinc/07/10/14/229071014.db2.gz	UDYQTKMKNATNJJ-GFCCVEGCSA-N	1	1	318.377	1.702	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000434419296	229293658	/nfs/dbraw/zinc/29/36/58/229293658.db2.gz	KIHBQOVTGCKKCK-LLVKDONJSA-N	1	1	319.365	1.319	20	5		DDBDMO
O=C(C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)NC1CC1	ZINC000299662155	229312248	/nfs/dbraw/zinc/31/22/48/229312248.db2.gz	WASPNMWQTHGWRQ-UHFFFAOYSA-N	1	1	315.276	1.564	20	5		DDBDMO
CCC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])CC(N)=O	ZINC000429174195	419982038	/nfs/dbraw/zinc/98/20/38/419982038.db2.gz	DMIKXPJIKLKECU-UHFFFAOYSA-N	1	1	311.338	1.180	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CNC(C)=O)C1	ZINC000430223277	420092856	/nfs/dbraw/zinc/09/28/56/420092856.db2.gz	UTNXCKNUATZBHW-ZDUSSCGKSA-N	1	1	321.377	1.952	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000416289731	420308384	/nfs/dbraw/zinc/30/83/84/420308384.db2.gz	FVYPLCBYYBZAGA-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000416289731	420308389	/nfs/dbraw/zinc/30/83/89/420308389.db2.gz	FVYPLCBYYBZAGA-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000416294348	420311699	/nfs/dbraw/zinc/31/16/99/420311699.db2.gz	KVODYNCPAXUXRG-NEPJUHHUSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000416294348	420311701	/nfs/dbraw/zinc/31/17/01/420311701.db2.gz	KVODYNCPAXUXRG-NEPJUHHUSA-N	1	1	321.377	1.430	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000470182977	420931387	/nfs/dbraw/zinc/93/13/87/420931387.db2.gz	LHFYVTZGTRSOBY-RCLYDWMDSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000470182977	420931390	/nfs/dbraw/zinc/93/13/90/420931390.db2.gz	LHFYVTZGTRSOBY-RCLYDWMDSA-N	1	1	319.361	1.573	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@](CO)(COC)C1	ZINC000449699581	421062460	/nfs/dbraw/zinc/06/24/60/421062460.db2.gz	QJMYPRMEUDLMQI-INIZCTEOSA-N	1	1	324.377	1.824	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@](CO)(COC)C1	ZINC000449699581	421062458	/nfs/dbraw/zinc/06/24/58/421062458.db2.gz	QJMYPRMEUDLMQI-INIZCTEOSA-N	1	1	324.377	1.824	20	5		DDBDMO
[NH3+]C[C@@H]1CC[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449716772	421067898	/nfs/dbraw/zinc/06/78/98/421067898.db2.gz	LYOUCWUVHBVEAY-RKDXNWHRSA-N	1	1	303.322	1.328	20	5		DDBDMO
CC[C@@H](C)[NH+]1CCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC1	ZINC000456540320	421180329	/nfs/dbraw/zinc/18/03/29/421180329.db2.gz	ZGKFTCPPVFKFMS-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CC[N@H+](C(C)C)C1	ZINC000522811423	421226256	/nfs/dbraw/zinc/22/62/56/421226256.db2.gz	PSESOKQFMBMGOS-ZDUSSCGKSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC000561527859	421328761	/nfs/dbraw/zinc/32/87/61/421328761.db2.gz	WEOSVLOZWMELPQ-GFCCVEGCSA-N	1	1	318.377	1.936	20	5		DDBDMO
COc1c(C(=O)NCC[N@H+]2CC[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000527248556	421370932	/nfs/dbraw/zinc/37/09/32/421370932.db2.gz	GPNDXDPCZCXVDW-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
COc1ccc(CSCc2nc(C[NH3+])no2)cc1[N+](=O)[O-]	ZINC000517935421	421633230	/nfs/dbraw/zinc/63/32/30/421633230.db2.gz	VSMWKKBCHJPCLK-UHFFFAOYSA-N	1	1	310.335	1.879	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000556321742	421709012	/nfs/dbraw/zinc/70/90/12/421709012.db2.gz	HARCNJZARQDTRO-HOSYDEDBSA-N	1	1	307.354	1.120	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)CC2(C)C)cc1[N+](=O)[O-]	ZINC000535755562	421709916	/nfs/dbraw/zinc/70/99/16/421709916.db2.gz	SQDPVTSKRMRKCE-UHFFFAOYSA-N	1	1	321.377	1.699	20	5		DDBDMO
CN(C)C(=O)CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000574627810	422144067	/nfs/dbraw/zinc/14/40/67/422144067.db2.gz	AWAUWAKPNDIPSF-GFCCVEGCSA-N	1	1	321.381	1.344	20	5		DDBDMO
Cc1[nH+]ccn1CCCn1cnc2sc([N+](=O)[O-])cc2c1=O	ZINC000576040375	422363259	/nfs/dbraw/zinc/36/32/59/422363259.db2.gz	CLSNLIXQKNARDE-UHFFFAOYSA-N	1	1	319.346	1.961	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000332253292	271033421	/nfs/dbraw/zinc/03/34/21/271033421.db2.gz	MJJUUVWLZXSUKG-KGLIPLIRSA-N	1	1	319.361	1.960	20	5		DDBDMO
COc1cc(C[NH2+][C@@](C)(C(N)=O)C(C)C)c([N+](=O)[O-])cc1F	ZINC000297609253	277819453	/nfs/dbraw/zinc/81/94/53/277819453.db2.gz	KNDGFQMZPLQKGM-CQSZACIVSA-N	1	1	313.329	1.732	20	5		DDBDMO
CCN(CCC[NH+]1CCCC1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000276500849	279181844	/nfs/dbraw/zinc/18/18/44/279181844.db2.gz	UUIVXMVIASXYCO-UHFFFAOYSA-N	1	1	309.370	1.574	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000358059669	299060408	/nfs/dbraw/zinc/06/04/08/299060408.db2.gz	SEDRCFHVRMCBAM-INIZCTEOSA-N	1	1	321.377	1.055	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CC[C@H](C)C1	ZINC000362153847	300017806	/nfs/dbraw/zinc/01/78/06/300017806.db2.gz	GIWMKFKJKPWSKO-UONOGXRCSA-N	1	1	323.393	1.894	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c([N+](=O)[O-])c1	ZINC000362454461	300067692	/nfs/dbraw/zinc/06/76/92/300067692.db2.gz	QNQJGKAMIONJMU-KGLIPLIRSA-N	1	1	319.361	1.695	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCO[C@@H](C3CC3)C2)c1	ZINC000362579773	300101080	/nfs/dbraw/zinc/10/10/80/300101080.db2.gz	XRVFWAOSSOQKTB-GOEBONIOSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCO[C@@H](C3CC3)C2)c1	ZINC000362579773	300101082	/nfs/dbraw/zinc/10/10/82/300101082.db2.gz	XRVFWAOSSOQKTB-GOEBONIOSA-N	1	1	322.361	1.445	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@H]2C[N@@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000362804440	300145059	/nfs/dbraw/zinc/14/50/59/300145059.db2.gz	FLZNSQKZLGNWCZ-RNCFNFMXSA-N	1	1	321.333	1.518	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@@H]2C[N@@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000362804439	300145304	/nfs/dbraw/zinc/14/53/04/300145304.db2.gz	FLZNSQKZLGNWCZ-NOZJJQNGSA-N	1	1	321.333	1.518	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000363439881	300267887	/nfs/dbraw/zinc/26/78/87/300267887.db2.gz	OQXXLTKQQNAXAS-JTQLQIEISA-N	1	1	306.322	1.006	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@@H]2C1	ZINC000363877254	300320151	/nfs/dbraw/zinc/32/01/51/300320151.db2.gz	UGILMMBVZONAEV-LNSITVRQSA-N	1	1	316.361	1.546	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000368351026	301008794	/nfs/dbraw/zinc/00/87/94/301008794.db2.gz	ADTGRRZVQIYQJF-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCOC2)O1	ZINC000369868898	301231945	/nfs/dbraw/zinc/23/19/45/301231945.db2.gz	VTDUJVHWLSUALY-CQSZACIVSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3ccncn3)C2)c1	ZINC000370002080	301256147	/nfs/dbraw/zinc/25/61/47/301256147.db2.gz	MNOPGTLXBIGEPM-LBPRGKRZSA-N	1	1	302.338	1.461	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)c1	ZINC000370285626	301309343	/nfs/dbraw/zinc/30/93/43/301309343.db2.gz	ONIMVCQAXAVSMO-QWHCGFSZSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)c1	ZINC000370285626	301309345	/nfs/dbraw/zinc/30/93/45/301309345.db2.gz	ONIMVCQAXAVSMO-QWHCGFSZSA-N	1	1	306.366	1.842	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000538714004	303390230	/nfs/dbraw/zinc/39/02/30/303390230.db2.gz	GFVUDZNREXXXAJ-XHDPSFHLSA-N	1	1	318.377	1.803	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000367377994	307092445	/nfs/dbraw/zinc/09/24/45/307092445.db2.gz	NVERFTSOIPHBAB-MNOVXSKESA-N	1	1	320.349	1.119	20	5		DDBDMO
Cc1ccc(C[NH+]2CCC(S(N)(=O)=O)CC2)cc1[N+](=O)[O-]	ZINC000369045422	307114794	/nfs/dbraw/zinc/11/47/94/307114794.db2.gz	ICXCPPMYJKXXPI-UHFFFAOYSA-N	1	1	313.379	1.156	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[NH+]([C@H]2CCOC2)CC1	ZINC000371109642	307142529	/nfs/dbraw/zinc/14/25/29/307142529.db2.gz	WPNYXUAEQMYION-HNNXBMFYSA-N	1	1	321.377	1.652	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000372358651	307168535	/nfs/dbraw/zinc/16/85/35/307168535.db2.gz	NUEHCSSKQJCHBP-AWEZNQCLSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000373798623	307195503	/nfs/dbraw/zinc/19/55/03/307195503.db2.gz	SNAQHXUZKQFKST-RRCSTGOVSA-N	1	1	315.373	1.795	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000376875150	307257521	/nfs/dbraw/zinc/25/75/21/307257521.db2.gz	ILLOSPNNURBPIE-MNOVXSKESA-N	1	1	305.338	1.160	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000576253291	308301159	/nfs/dbraw/zinc/30/11/59/308301159.db2.gz	KLTLSBLXMGDHNG-LBPRGKRZSA-N	1	1	322.365	1.642	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@]1(C)CO	ZINC000595874489	490372210	/nfs/dbraw/zinc/37/22/10/490372210.db2.gz	PCNNODFNRQTKFK-BDJLRTHQSA-N	1	1	322.361	1.912	20	5		DDBDMO
COc1cc(C[N@@H+]2[C@@H]3CC[C@H]2CN(C)C(=O)C3)ccc1[N+](=O)[O-]	ZINC000451871408	533831018	/nfs/dbraw/zinc/83/10/18/533831018.db2.gz	RJTGLJQXLYCUSO-OLZOCXBDSA-N	1	1	319.361	1.799	20	5		DDBDMO
C[C@H]1COCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000331928304	534022400	/nfs/dbraw/zinc/02/24/00/534022400.db2.gz	DCCVQIMWZFLELA-OLZOCXBDSA-N	1	1	310.350	1.303	20	5		DDBDMO
COC(=O)c1cccc(OC[C@H](O)C[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000414163800	534279999	/nfs/dbraw/zinc/27/99/99/534279999.db2.gz	GOUIPMMWBHIYEH-LLVKDONJSA-N	1	1	324.333	1.215	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCn3ccc([N+](=O)[O-])n3)[C@@H]2C1	ZINC000158413465	523707358	/nfs/dbraw/zinc/70/73/58/523707358.db2.gz	RPYCQNDTIORNGG-UPJWGTAASA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)[C@@H]2C1	ZINC000158413465	523707368	/nfs/dbraw/zinc/70/73/68/523707368.db2.gz	RPYCQNDTIORNGG-UPJWGTAASA-N	1	1	310.354	1.060	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000330990984	529064077	/nfs/dbraw/zinc/06/40/77/529064077.db2.gz	AUQMGFJLBIYUPT-GFCCVEGCSA-N	1	1	323.397	1.469	20	5		DDBDMO
C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820665054	599589763	/nfs/dbraw/zinc/58/97/63/599589763.db2.gz	DLEOMGJHWNNZIY-DTWKUNHWSA-N	1	1	318.341	1.065	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(NC[C@H]2C[N@@H+](C)CCN2C)c1	ZINC000747218015	700060441	/nfs/dbraw/zinc/06/04/41/700060441.db2.gz	OPLASIBCCBYSDK-JTQLQIEISA-N	1	1	312.345	1.400	20	5		DDBDMO
Cc1ncc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC000983650537	697286401	/nfs/dbraw/zinc/28/64/01/697286401.db2.gz	VUFOCNPWKQGYLV-FPQZTECRSA-N	1	1	324.406	1.101	20	5		DDBDMO
C[NH+](C)C1CC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000773486917	697767361	/nfs/dbraw/zinc/76/73/61/697767361.db2.gz	LEZBRODSKAPUGS-UHFFFAOYSA-N	1	1	303.322	1.294	20	5		DDBDMO
CCOCC[N@@H+](CC)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000749952107	700194016	/nfs/dbraw/zinc/19/40/16/700194016.db2.gz	SYVGGTKMJUFXFA-UHFFFAOYSA-N	1	1	307.354	1.964	20	5		DDBDMO
CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000778202615	698249262	/nfs/dbraw/zinc/24/92/62/698249262.db2.gz	CZSPPAGYJMYGSF-RYUDHWBXSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000778202615	698249265	/nfs/dbraw/zinc/24/92/65/698249265.db2.gz	CZSPPAGYJMYGSF-RYUDHWBXSA-N	1	1	322.283	1.873	20	5		DDBDMO
Cn1ccnc1[C@@H](N[C@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000780764752	698558368	/nfs/dbraw/zinc/55/83/68/698558368.db2.gz	PVXHBMAJFBIZAR-ZFWWWQNUSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@H](N[C@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000780765199	698558551	/nfs/dbraw/zinc/55/85/51/698558551.db2.gz	WYDDVCKNDXLRGL-DZGCQCFKSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@@H]3C[C@]3(CO)C2)cccc1[N+](=O)[O-]	ZINC000782603119	698747814	/nfs/dbraw/zinc/74/78/14/698747814.db2.gz	GBONWZYDSFKGSG-BLLLJJGKSA-N	1	1	319.361	1.546	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(N2CCN(c3[nH]cc[nH+]3)CC2)c(F)c1	ZINC000787886565	699251188	/nfs/dbraw/zinc/25/11/88/699251188.db2.gz	ORXFFNMQSLFOHL-UHFFFAOYSA-N	1	1	309.276	1.923	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)OCCC[NH+]1CCOCC1	ZINC000735894067	699708923	/nfs/dbraw/zinc/70/89/23/699708923.db2.gz	MNRWJWKNQPWVBU-UHFFFAOYSA-N	1	1	324.333	1.239	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](C[C@H](O)C2CC2)CC1	ZINC000736219980	699720771	/nfs/dbraw/zinc/72/07/71/699720771.db2.gz	GSWFLYURUOLMKN-HNNXBMFYSA-N	1	1	319.361	1.124	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3OC)C[C@@H]21	ZINC000794970432	699838798	/nfs/dbraw/zinc/83/87/98/699838798.db2.gz	FICNOFAMCLIJPB-IMRBUKKESA-N	1	1	306.318	1.454	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3OC)C[C@@H]21	ZINC000794970432	699838800	/nfs/dbraw/zinc/83/88/00/699838800.db2.gz	FICNOFAMCLIJPB-IMRBUKKESA-N	1	1	306.318	1.454	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000801840422	700344733	/nfs/dbraw/zinc/34/47/33/700344733.db2.gz	MSQAANSBTJCDLO-QMMMGPOBSA-N	1	1	308.313	1.283	20	5		DDBDMO
CC[NH+](CC)[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccsc1	ZINC000839526348	701725138	/nfs/dbraw/zinc/72/51/38/701725138.db2.gz	DYODSCVJVDHVKK-JHJVBQTASA-N	1	1	311.407	1.912	20	5		DDBDMO
C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839693544	701786699	/nfs/dbraw/zinc/78/66/99/701786699.db2.gz	DHMOEQNNMWIJQT-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000839693544	701786704	/nfs/dbraw/zinc/78/67/04/701786704.db2.gz	DHMOEQNNMWIJQT-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839693544	701786709	/nfs/dbraw/zinc/78/67/09/701786709.db2.gz	DHMOEQNNMWIJQT-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@@H]2[C@H](C1)C2(C)C)c1cccc([N+](=O)[O-])c1	ZINC000867948774	701848084	/nfs/dbraw/zinc/84/80/84/701848084.db2.gz	DVGHJGMSHUOERJ-DVOMOZLQSA-N	1	1	303.362	1.883	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000810839420	701859781	/nfs/dbraw/zinc/85/97/81/701859781.db2.gz	AYZLUZILNCPNHH-OLZOCXBDSA-N	1	1	322.365	1.660	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000840092512	701965385	/nfs/dbraw/zinc/96/53/85/701965385.db2.gz	WJGLVTXYVGKGIB-GFCCVEGCSA-N	1	1	318.381	1.631	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCOC[C@H](C)C2)c1	ZINC000811466790	701991525	/nfs/dbraw/zinc/99/15/25/701991525.db2.gz	YNQRALJQBYYGBS-LLVKDONJSA-N	1	1	308.334	1.850	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCOC[C@H](C)C2)c1	ZINC000811466790	701991533	/nfs/dbraw/zinc/99/15/33/701991533.db2.gz	YNQRALJQBYYGBS-LLVKDONJSA-N	1	1	308.334	1.850	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC000866204653	706648083	/nfs/dbraw/zinc/64/80/83/706648083.db2.gz	FMUURESLXBONGC-SMDDNHRTSA-N	1	1	318.377	1.485	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866206647	706648590	/nfs/dbraw/zinc/64/85/90/706648590.db2.gz	FDJOIRCKPAVCPR-JQWIXIFHSA-N	1	1	320.349	1.307	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H](CN)C1CC1	ZINC000843386342	702871126	/nfs/dbraw/zinc/87/11/26/702871126.db2.gz	HFKYPGYFSSCQDQ-CQSZACIVSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H](CN)C1CC1	ZINC000843386342	702871127	/nfs/dbraw/zinc/87/11/27/702871127.db2.gz	HFKYPGYFSSCQDQ-CQSZACIVSA-N	1	1	324.356	1.732	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](CC(C)(C)O)C2)c1	ZINC000869779994	703850287	/nfs/dbraw/zinc/85/02/87/703850287.db2.gz	BBOQSRCJMJPNNP-LBPRGKRZSA-N	1	1	321.377	1.478	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+][C@@H]2CCn3ccnc32)c1	ZINC000819338133	704110227	/nfs/dbraw/zinc/11/02/27/704110227.db2.gz	WZPIWZSLBTVAJT-GXTWGEPZSA-N	1	1	318.333	1.266	20	5		DDBDMO
CCO[C@@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870873420	704152882	/nfs/dbraw/zinc/15/28/82/704152882.db2.gz	CUDKDDWXHPKDOJ-GDBMZVCRSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000874836667	705193597	/nfs/dbraw/zinc/19/35/97/705193597.db2.gz	GJWXXFVAYULFIT-LSDHHAIUSA-N	1	1	303.362	1.832	20	5		DDBDMO
CN1C(=O)NCC12CC[NH+](Cc1cc(F)ccc1[N+](=O)[O-])CC2	ZINC000823656193	705288788	/nfs/dbraw/zinc/28/87/88/705288788.db2.gz	YKQBJBTWHGTKGB-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000823987721	705349972	/nfs/dbraw/zinc/34/99/72/705349972.db2.gz	QREMFNOKEWKNCH-KOLCDFICSA-N	1	1	307.354	1.781	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000825526995	705687970	/nfs/dbraw/zinc/68/79/70/705687970.db2.gz	KVCMCOYSMUXBHL-HUUCEWRRSA-N	1	1	321.377	1.081	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000826995123	705908535	/nfs/dbraw/zinc/90/85/35/705908535.db2.gz	QTXSUZQIPPIELQ-ZDUSSCGKSA-N	1	1	305.334	1.930	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000826995123	705908538	/nfs/dbraw/zinc/90/85/38/705908538.db2.gz	QTXSUZQIPPIELQ-ZDUSSCGKSA-N	1	1	305.334	1.930	20	5		DDBDMO
COCCN(C)CCC[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000876928407	705927937	/nfs/dbraw/zinc/92/79/37/705927937.db2.gz	CHLUUNPABAMNSB-UHFFFAOYSA-N	1	1	311.386	1.053	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]21	ZINC000827231537	705956424	/nfs/dbraw/zinc/95/64/24/705956424.db2.gz	HIHXYACCLVHVAP-TZMCWYRMSA-N	1	1	321.352	1.829	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328918	705976389	/nfs/dbraw/zinc/97/63/89/705976389.db2.gz	FTMIGKANZPNMFK-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328918	705976390	/nfs/dbraw/zinc/97/63/90/705976390.db2.gz	FTMIGKANZPNMFK-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328918	705976391	/nfs/dbraw/zinc/97/63/91/705976391.db2.gz	FTMIGKANZPNMFK-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCn1cc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)nn1	ZINC000865456205	706436119	/nfs/dbraw/zinc/43/61/19/706436119.db2.gz	SOERWHUHAQSAAI-UHFFFAOYSA-N	1	1	305.338	1.765	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1	ZINC000882042487	707476797	/nfs/dbraw/zinc/47/67/97/707476797.db2.gz	ONYUEKRGEMBKGR-UHFFFAOYSA-N	1	1	312.345	1.676	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)CCC(C)(C)[N+](=O)[O-])CCCO1	ZINC000830486482	706524712	/nfs/dbraw/zinc/52/47/12/706524712.db2.gz	FNXDMEJCIZZFNN-ZDUSSCGKSA-N	1	1	315.414	1.439	20	5		DDBDMO
C[C@]1(C(F)(F)F)CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000880001596	706850230	/nfs/dbraw/zinc/85/02/30/706850230.db2.gz	RCJQICRFJDBYKI-MNOVXSKESA-N	1	1	322.287	1.427	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000880047169	706862994	/nfs/dbraw/zinc/86/29/94/706862994.db2.gz	IZXYLPDYXRTKKL-SNVBAGLBSA-N	1	1	308.260	1.445	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCO[C@@H](C(F)(F)F)CC2)c1	ZINC000880047169	706862997	/nfs/dbraw/zinc/86/29/97/706862997.db2.gz	IZXYLPDYXRTKKL-SNVBAGLBSA-N	1	1	308.260	1.445	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H](C(C)(C)O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000880144505	706891259	/nfs/dbraw/zinc/89/12/59/706891259.db2.gz	GLKQVKCTLZBGTF-LBPRGKRZSA-N	1	1	321.377	1.650	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880528625	707005162	/nfs/dbraw/zinc/00/51/62/707005162.db2.gz	FJCYPLQFDLTCTP-CQDKDKBSSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880528625	707005164	/nfs/dbraw/zinc/00/51/64/707005164.db2.gz	FJCYPLQFDLTCTP-CQDKDKBSSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=c1c(F)cc([N+](=O)[O-])cn1Cc1[nH+]ccn1CC(F)F	ZINC000871674596	707164644	/nfs/dbraw/zinc/16/46/44/707164644.db2.gz	DKGNPRQDSJQAIJ-UHFFFAOYSA-N	1	1	302.212	1.406	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000882269900	707565315	/nfs/dbraw/zinc/56/53/15/707565315.db2.gz	WNGZVEGWSPAKIL-UHFFFAOYSA-N	1	1	315.333	1.847	20	5		DDBDMO
Cc1c(CN[C@H]2CC[N@H+](CC(C)(C)O)C2)cccc1[N+](=O)[O-]	ZINC000873145814	707748126	/nfs/dbraw/zinc/74/81/26/707748126.db2.gz	GQEYBIPWAZVBJM-AWEZNQCLSA-N	1	1	307.394	1.838	20	5		DDBDMO
Cc1c(CN[C@H]2CC[N@@H+](CC(C)(C)O)C2)cccc1[N+](=O)[O-]	ZINC000873145814	707748128	/nfs/dbraw/zinc/74/81/28/707748128.db2.gz	GQEYBIPWAZVBJM-AWEZNQCLSA-N	1	1	307.394	1.838	20	5		DDBDMO
Cc1cc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897222103	708259295	/nfs/dbraw/zinc/25/92/95/708259295.db2.gz	RPKBHMHOVNLVHC-HOTGVXAUSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000886578125	708780371	/nfs/dbraw/zinc/78/03/71/708780371.db2.gz	KUSVPNXLTQARLO-AZHAFVHUSA-N	1	1	319.361	1.625	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000910285951	709866599	/nfs/dbraw/zinc/86/65/99/709866599.db2.gz	DKELSMJLLSQJRV-LBPRGKRZSA-N	1	1	323.397	1.433	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC(C)(C)C[NH+](C)C)c1[N+](=O)[O-]	ZINC000890883804	710020830	/nfs/dbraw/zinc/02/08/30/710020830.db2.gz	OPGCVOSBXVXRQG-UHFFFAOYSA-N	1	1	311.386	1.540	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C	ZINC000928447864	713201133	/nfs/dbraw/zinc/20/11/33/713201133.db2.gz	AHXPGXYLZZGPRL-ZANVPECISA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000928453740	713204095	/nfs/dbraw/zinc/20/40/95/713204095.db2.gz	PVXJLFAKZKTQIB-ONGXEEELSA-N	1	1	321.333	1.188	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2c1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000894878159	711305412	/nfs/dbraw/zinc/30/54/12/711305412.db2.gz	FRQHMAZEKJTKHM-TXEJJXNPSA-N	1	1	316.361	1.762	20	5		DDBDMO
CC[C@H](C[NH+]1CCOCC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000895801535	711609549	/nfs/dbraw/zinc/60/95/49/711609549.db2.gz	KFKOKOHMORZJHN-LLVKDONJSA-N	1	1	319.365	1.994	20	5		DDBDMO
C[C@@H](NC(=O)[C@]1(C)C[C@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807204	713303478	/nfs/dbraw/zinc/30/34/78/713303478.db2.gz	XTCOLYBPDLLWJQ-ZETOZRRWSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@@H](NC(=O)[C@]1(C)C[C@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807204	713303480	/nfs/dbraw/zinc/30/34/80/713303480.db2.gz	XTCOLYBPDLLWJQ-ZETOZRRWSA-N	1	1	307.350	1.227	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)C2(CCCCC2)C1	ZINC000908572960	712810796	/nfs/dbraw/zinc/81/07/96/712810796.db2.gz	JISCHBWJQOURHU-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000917480110	713499535	/nfs/dbraw/zinc/49/95/35/713499535.db2.gz	JFACCYBGUCYSHZ-NSHDSACASA-N	1	1	304.306	1.397	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000917480110	713499538	/nfs/dbraw/zinc/49/95/38/713499538.db2.gz	JFACCYBGUCYSHZ-NSHDSACASA-N	1	1	304.306	1.397	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000929112884	713548897	/nfs/dbraw/zinc/54/88/97/713548897.db2.gz	PYQMNCSHQVIMGD-UHFFFAOYSA-N	1	1	309.341	1.831	20	5		DDBDMO
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCC[N@@H+](CC[N+](=O)[O-])C1	ZINC000930032436	713739915	/nfs/dbraw/zinc/73/99/15/713739915.db2.gz	QMTPTTGFHXABAF-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000921681048	713841288	/nfs/dbraw/zinc/84/12/88/713841288.db2.gz	PPKIZLWIFJQNTH-FZMZJTMJSA-N	1	1	306.366	1.529	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)[C@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000930915427	713957747	/nfs/dbraw/zinc/95/77/47/713957747.db2.gz	KWSXGMHCKRNEFO-TYNCELHUSA-N	1	1	321.377	1.948	20	5		DDBDMO
Cc1c(CNC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000922167841	713980754	/nfs/dbraw/zinc/98/07/54/713980754.db2.gz	GYRKRBHXFFHQOL-WCQYABFASA-N	1	1	306.366	1.795	20	5		DDBDMO
COc1cc(C[NH2+][C@@H](C)C(OC)OC)c([N+](=O)[O-])cc1OC	ZINC000922311599	714017720	/nfs/dbraw/zinc/01/77/20/714017720.db2.gz	INTJEINOHWPCIN-VIFPVBQESA-N	1	1	314.338	1.709	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[N@H+](CC[N+](=O)[O-])C(C)(C)CC1	ZINC000931532264	714121744	/nfs/dbraw/zinc/12/17/44/714121744.db2.gz	DDZBLCBIFNUGDD-UHFFFAOYSA-N	1	1	301.387	1.985	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[N@@H+](CC[N+](=O)[O-])C(C)(C)CC1	ZINC000931532264	714121745	/nfs/dbraw/zinc/12/17/45/714121745.db2.gz	DDZBLCBIFNUGDD-UHFFFAOYSA-N	1	1	301.387	1.985	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120450	714747200	/nfs/dbraw/zinc/74/72/00/714747200.db2.gz	HFAHTNJCMULCOG-YPMHNXCESA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120450	714747203	/nfs/dbraw/zinc/74/72/03/714747203.db2.gz	HFAHTNJCMULCOG-YPMHNXCESA-N	1	1	307.350	1.951	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)c2ncnn21	ZINC000925383086	714836927	/nfs/dbraw/zinc/83/69/27/714836927.db2.gz	QRJUMAXHKRFFHI-ZWNOBZJWSA-N	1	1	303.322	1.861	20	5		DDBDMO
Cc1nc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)ccc1[N+](=O)[O-]	ZINC001164966232	722067369	/nfs/dbraw/zinc/06/73/69/722067369.db2.gz	ZRVKGYWBPFMPBE-OKILXGFUSA-N	1	1	318.377	1.598	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cc(Cl)ccc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932455	742779763	/nfs/dbraw/zinc/77/97/63/742779763.db2.gz	YSZIAGLBXNUHFH-ZYHUDNBSSA-N	1	1	315.732	1.350	20	5		DDBDMO
C[NH+]1CCN(c2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])CC1	ZINC001184579995	744064788	/nfs/dbraw/zinc/06/47/88/744064788.db2.gz	IZXSPNTUCCLSAY-UHFFFAOYSA-N	1	1	317.305	1.803	20	5		DDBDMO
Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ccc([N+](=O)[O-])nc1)C2	ZINC001186895566	744462130	/nfs/dbraw/zinc/46/21/30/744462130.db2.gz	HQNFTUZJJCUTQM-LLVKDONJSA-N	1	1	317.349	1.456	20	5		DDBDMO
O=C(NCC1C[NH+](CC2CCC3(CC3)CC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031663067	747338364	/nfs/dbraw/zinc/33/83/64/747338364.db2.gz	QXZGAVRXZQZCJO-HUUCEWRRSA-N	1	1	321.421	1.670	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]C/C(Cl)=C/Cl)CC1	ZINC001200470899	748264720	/nfs/dbraw/zinc/26/47/20/748264720.db2.gz	AFTIQLZYHFMROL-JRJMJSEMSA-N	1	1	322.192	1.551	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccccn2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034643352	750625634	/nfs/dbraw/zinc/62/56/34/750625634.db2.gz	MXVAHRBACSHRKU-QHSBEEBCSA-N	1	1	318.377	1.264	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@]3(CCN3c3ncccn3)C2)C1	ZINC001169019738	762200008	/nfs/dbraw/zinc/20/00/08/762200008.db2.gz	JEJZIQYLZAAPHA-IJEWVQPXSA-N	1	1	317.393	1.577	20	5		DDBDMO
Cc1ccc(CC[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001020138896	760613031	/nfs/dbraw/zinc/61/30/31/760613031.db2.gz	GVZGLOHUHLOBMP-KLHDSHLOSA-N	1	1	317.389	1.440	20	5		DDBDMO
COc1cc(-n2[nH]c(=O)c(CC[NH3+])c2C)cc([N+](=O)[O-])c1C	ZINC001170343343	766274997	/nfs/dbraw/zinc/27/49/97/766274997.db2.gz	RFXACSULDHADAE-UHFFFAOYSA-N	1	1	306.322	1.613	20	5		DDBDMO
O=C(N[C@@]12CC[N@@H+](C1)CCC2)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC001132686108	769092602	/nfs/dbraw/zinc/09/26/02/769092602.db2.gz	AXSCIQZKDQCGNA-HNNXBMFYSA-N	1	1	315.333	1.439	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC001093770881	775067374	/nfs/dbraw/zinc/06/73/74/775067374.db2.gz	MHXGGFNFRLUBNC-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
Cc1cc(N(C)CCNC(=O)C[N@H+](C)C(C)C)ncc1[N+](=O)[O-]	ZINC001100149724	775735678	/nfs/dbraw/zinc/73/56/78/775735678.db2.gz	NERZPTIUSCQDRI-UHFFFAOYSA-N	1	1	323.397	1.191	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094517270	775973818	/nfs/dbraw/zinc/97/38/18/775973818.db2.gz	IZXIBEKCZAFFHU-UHFFFAOYSA-N	1	1	309.370	1.250	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](CO)[C@H](O)C1)CC2	ZINC001172902311	776915826	/nfs/dbraw/zinc/91/58/26/776915826.db2.gz	AKFINVJCANPYTF-ZMSDIMECSA-N	1	1	320.389	1.517	20	5		DDBDMO
Cc1cc(N(C(N)=[NH2+])[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC001173226490	777062398	/nfs/dbraw/zinc/06/23/98/777062398.db2.gz	MCSLPNVPAGMQJR-JTQLQIEISA-N	1	1	302.338	1.957	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)CC[C@@H]2C1	ZINC001173234406	777064914	/nfs/dbraw/zinc/06/49/14/777064914.db2.gz	RCAZYNUBEFAXDT-SWLSCSKDSA-N	1	1	303.362	1.832	20	5		DDBDMO
COCC(C)(C)C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001267206437	837533143	/nfs/dbraw/zinc/53/31/43/837533143.db2.gz	ALXJSHOTBXGWOM-UHFFFAOYSA-N	1	1	323.393	1.815	20	5		DDBDMO
COCC(C)(C)C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001267206437	837533147	/nfs/dbraw/zinc/53/31/47/837533147.db2.gz	ALXJSHOTBXGWOM-UHFFFAOYSA-N	1	1	323.393	1.815	20	5		DDBDMO
Cn1cnc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)c1	ZINC001266267883	836012276	/nfs/dbraw/zinc/01/22/76/836012276.db2.gz	RXTJJEKZSDQYDW-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
CC[C@@H]1[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021518	850518301	/nfs/dbraw/zinc/51/83/01/850518301.db2.gz	LGKQCJPNRMFIDS-NYTXWWLZSA-N	1	1	309.410	1.955	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)OCCOc1ccc([N+](=O)[O-])cc1	ZINC001224776862	881529030	/nfs/dbraw/zinc/52/90/30/881529030.db2.gz	GGONNRTXRQVWQA-ZDUSSCGKSA-N	1	1	310.350	1.711	20	5		DDBDMO
CC(C)[N@@H+](C)[C@@H]1CCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C1	ZINC001157009827	863515992	/nfs/dbraw/zinc/51/59/92/863515992.db2.gz	NFFOXEFPSPGNTR-SNVBAGLBSA-N	1	1	314.773	1.801	20	5		DDBDMO
CSc1nc(Cl)nc(N2CC3(C2)C[NH+](C)C3)c1[N+](=O)[O-]	ZINC001158866434	864947617	/nfs/dbraw/zinc/94/76/17/864947617.db2.gz	PPEAKRFBWPDXIN-UHFFFAOYSA-N	1	1	315.786	1.512	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C3CCC2(CO)CC3)c([N+](=O)[O-])c1	ZINC001333761268	866990358	/nfs/dbraw/zinc/99/03/58/866990358.db2.gz	YJJNIEIGVVOVKQ-UHFFFAOYSA-N	1	1	322.361	1.972	20	5		DDBDMO
Cn1ccnc1CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001161920922	867100774	/nfs/dbraw/zinc/10/07/74/867100774.db2.gz	JMYAFRFCYUWARS-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
Cn1ccnc1CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001161920922	867100779	/nfs/dbraw/zinc/10/07/79/867100779.db2.gz	JMYAFRFCYUWARS-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
C[C@@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[NH+]1CCSCC1	ZINC001324321703	867203623	/nfs/dbraw/zinc/20/36/23/867203623.db2.gz	BVRMPRAWCYOCFC-NSHDSACASA-N	1	1	321.402	1.874	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@]2(C)CCC[N@@H+](C)C2)n1	ZINC001162338566	867469299	/nfs/dbraw/zinc/46/92/99/867469299.db2.gz	BWBOMHLQUINSNY-CQSZACIVSA-N	1	1	308.338	1.673	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc2ncccc2c1[N+](=O)[O-]	ZINC001335073543	868044639	/nfs/dbraw/zinc/04/46/39/868044639.db2.gz	VTTKUPQLTKRTKK-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
Cc1cc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc(C)[nH+]1	ZINC001322604111	868274874	/nfs/dbraw/zinc/27/48/74/868274874.db2.gz	GEUJMBLSCBMHEW-UHFFFAOYSA-N	1	1	307.331	1.829	20	5		DDBDMO
COc1ncnc(N[C@H]2CC[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC001163361649	868395137	/nfs/dbraw/zinc/39/51/37/868395137.db2.gz	JYHWABWIEFKTKG-MNOVXSKESA-N	1	1	309.370	1.924	20	5		DDBDMO
NC(=O)[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC001336722631	869108382	/nfs/dbraw/zinc/10/83/82/869108382.db2.gz	LDSOAJAYSIVSNB-LSDHHAIUSA-N	1	1	315.329	1.444	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2C)c1	ZINC001336743980	869120251	/nfs/dbraw/zinc/12/02/51/869120251.db2.gz	CAQGNFOTLICCIS-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1ncc([N+](=O)[O-])cc1F)CC2	ZINC001166033410	869810895	/nfs/dbraw/zinc/81/08/95/869810895.db2.gz	WDNZQPTWBOMMNQ-UHFFFAOYSA-N	1	1	323.328	1.763	20	5		DDBDMO
C[C@H](c1nnc(N2CC[N@H+](C3CCC3)C[C@@H](C)C2)n1C)[N+](=O)[O-]	ZINC001339670216	870618923	/nfs/dbraw/zinc/61/89/23/870618923.db2.gz	XTGJCMIDGUKNOV-VXGBXAGGSA-N	1	1	322.413	1.463	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cccc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC001305873764	871306516	/nfs/dbraw/zinc/30/65/16/871306516.db2.gz	KQCIQNDXWBBDPU-WCQGTBRESA-N	1	1	304.350	1.247	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1CS(N)(=O)=O	ZINC001308118602	871472147	/nfs/dbraw/zinc/47/21/47/871472147.db2.gz	JISLRBVALFVUSP-SCZZXKLOSA-N	1	1	319.408	1.013	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1CS(N)(=O)=O	ZINC001308118602	871472163	/nfs/dbraw/zinc/47/21/63/871472163.db2.gz	JISLRBVALFVUSP-SCZZXKLOSA-N	1	1	319.408	1.013	20	5		DDBDMO
CC[N@H+](CCNC(=O)c1ccn[nH]1)Cc1ccccc1[N+](=O)[O-]	ZINC001317476153	871552643	/nfs/dbraw/zinc/55/26/43/871552643.db2.gz	FODDXNKBTGDQFG-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccn[nH]1)Cc1ccccc1[N+](=O)[O-]	ZINC001317476153	871552653	/nfs/dbraw/zinc/55/26/53/871552653.db2.gz	FODDXNKBTGDQFG-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
Cc1nc(N[C@H]2C[C@@H]([NH+]3CCOCC3)C2(C)C)ncc1[N+](=O)[O-]	ZINC001353016538	877070824	/nfs/dbraw/zinc/07/08/24/877070824.db2.gz	DQIMMBYPVMVPMI-QWHCGFSZSA-N	1	1	321.381	1.604	20	5		DDBDMO
Cc1ccc(CNC(=O)[C@@H]2[NH2+]CCc3occc32)cc1[N+](=O)[O-]	ZINC001354523373	878037542	/nfs/dbraw/zinc/03/75/42/878037542.db2.gz	KIKQJTWIMPFLQF-OAHLLOKOSA-N	1	1	315.329	1.999	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1[N+](=O)[O-]	ZINC001355171689	878452818	/nfs/dbraw/zinc/45/28/18/878452818.db2.gz	PIISSVFQHQWITE-KGYLQXTDSA-N	1	1	319.361	1.673	20	5		DDBDMO
COc1cc(COCC[N@@H+]2CC[C@@H](OC)C2)cc([N+](=O)[O-])c1	ZINC001223393839	880944651	/nfs/dbraw/zinc/94/46/51/880944651.db2.gz	FQCSYSHIKQAMLA-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COC(=O)[C@@H](OC[C@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647077	881042913	/nfs/dbraw/zinc/04/29/13/881042913.db2.gz	IXRPVYXXCFOALR-RISCZKNCSA-N	1	1	324.333	1.156	20	5		DDBDMO
COC(=O)[C@@H](OC[C@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647077	881042932	/nfs/dbraw/zinc/04/29/32/881042932.db2.gz	IXRPVYXXCFOALR-RISCZKNCSA-N	1	1	324.333	1.156	20	5		DDBDMO
COC(=O)c1cccc(COC2C[NH+](C(C)C)C2)c1[N+](=O)[O-]	ZINC001223665124	881050742	/nfs/dbraw/zinc/05/07/42/881050742.db2.gz	OBMRSTATKFEAGS-UHFFFAOYSA-N	1	1	308.334	1.991	20	5		DDBDMO
O=c1[nH]cnc(O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC001228144389	883361807	/nfs/dbraw/zinc/36/18/07/883361807.db2.gz	TVHKOZYBBPUDHK-LBPRGKRZSA-N	1	1	316.317	1.744	20	5		DDBDMO
CC(C)C(=O)Nc1nc2nc[nH]c2c(O[C@@H](C)C[N+](C)(C)C)n1	ZINC001230446753	884493671	/nfs/dbraw/zinc/49/36/71/884493671.db2.gz	WFZDBACOGKHVGN-JTQLQIEISA-O	1	1	321.405	1.421	20	5		DDBDMO
COCCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001231027272	885144821	/nfs/dbraw/zinc/14/48/21/885144821.db2.gz	FSIIIDOHDRDRPN-UHFFFAOYSA-N	1	1	309.366	1.569	20	5		DDBDMO
C[N@H+](CCCNC(=O)c1ccon1)Cc1csc([N+](=O)[O-])c1	ZINC001234513349	888040323	/nfs/dbraw/zinc/04/03/23/888040323.db2.gz	XMDXTEDMXDRLGS-UHFFFAOYSA-N	1	1	324.362	1.896	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccon1)Cc1csc([N+](=O)[O-])c1	ZINC001234513349	888040339	/nfs/dbraw/zinc/04/03/39/888040339.db2.gz	XMDXTEDMXDRLGS-UHFFFAOYSA-N	1	1	324.362	1.896	20	5		DDBDMO
Cc1ncc(C[NH3+])c(=N)n1[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254538432	896494375	/nfs/dbraw/zinc/49/43/75/896494375.db2.gz	UZFOZISRAKFCQK-SNVBAGLBSA-N	1	1	301.350	1.842	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2CCOC[C@@H]2C1	ZINC001254553568	896498994	/nfs/dbraw/zinc/49/89/94/896498994.db2.gz	XNNUYBXZUJOEPM-HIFRSBDPSA-N	1	1	305.378	1.542	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+](C)CC(=O)N1CCOCC1	ZINC001254550469	896499054	/nfs/dbraw/zinc/49/90/54/896499054.db2.gz	KFZFICYQZZJJRT-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C)CC(=O)N1CCOCC1	ZINC001254550469	896499060	/nfs/dbraw/zinc/49/90/60/896499060.db2.gz	KFZFICYQZZJJRT-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
O=C1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]2CCCN12	ZINC001254605302	896527965	/nfs/dbraw/zinc/52/79/65/896527965.db2.gz	BDLKYZGGFSAPOD-CVEARBPZSA-N	1	1	315.373	1.759	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)O1	ZINC001254603450	896528657	/nfs/dbraw/zinc/52/86/57/896528657.db2.gz	NGPTYYNHPHAOIR-GOEBONIOSA-N	1	1	317.345	1.636	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC001261648133	899681551	/nfs/dbraw/zinc/68/15/51/899681551.db2.gz	TUPDZMXDQNFETK-NSHDSACASA-N	1	1	304.354	1.781	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCN(C)c1ccc(C)cc1[N+](=O)[O-]	ZINC001263681117	900670089	/nfs/dbraw/zinc/67/00/89/900670089.db2.gz	YNRUBEASLDWKOL-UHFFFAOYSA-N	1	1	322.409	1.797	20	5		DDBDMO
Cc1oncc1C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1	ZINC001266135746	903001502	/nfs/dbraw/zinc/00/15/02/903001502.db2.gz	WCABPBARIMIDLI-ZIAGYGMSSA-N	1	1	322.365	1.119	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccccc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001280815209	904079349	/nfs/dbraw/zinc/07/93/49/904079349.db2.gz	XSODJBAXDOKNAL-HUUCEWRRSA-N	1	1	305.378	1.632	20	5		DDBDMO
CN(CCC[N@H+](C)Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280815209	904079364	/nfs/dbraw/zinc/07/93/64/904079364.db2.gz	XSODJBAXDOKNAL-HUUCEWRRSA-N	1	1	305.378	1.632	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280815209	904079378	/nfs/dbraw/zinc/07/93/78/904079378.db2.gz	XSODJBAXDOKNAL-HUUCEWRRSA-N	1	1	305.378	1.632	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248453913	282084457	/nfs/dbraw/zinc/08/44/57/282084457.db2.gz	KDVUQCYUCGMXRW-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248453913	282084462	/nfs/dbraw/zinc/08/44/62/282084462.db2.gz	KDVUQCYUCGMXRW-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000278453619	214162993	/nfs/dbraw/zinc/16/29/93/214162993.db2.gz	RDBVZNBEWGGPDU-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000278453619	214162995	/nfs/dbraw/zinc/16/29/95/214162995.db2.gz	RDBVZNBEWGGPDU-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000278453619	214162997	/nfs/dbraw/zinc/16/29/97/214162997.db2.gz	RDBVZNBEWGGPDU-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CCCCO)c1ccc([N+](=O)[O-])cc1	ZINC000278566930	214242054	/nfs/dbraw/zinc/24/20/54/214242054.db2.gz	FXXLMNDPFYOIMT-CQSZACIVSA-N	1	1	304.350	1.780	20	5		DDBDMO
CSC[C@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000249464846	282158140	/nfs/dbraw/zinc/15/81/40/282158140.db2.gz	QANAIYGPYLXJFD-ZYHUDNBSSA-N	1	1	312.395	1.200	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000249499773	282160976	/nfs/dbraw/zinc/16/09/76/282160976.db2.gz	ICOIXYYZYNDWIM-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
COC[C@]1(CO)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000451924896	231235676	/nfs/dbraw/zinc/23/56/76/231235676.db2.gz	JWMZJKZIRNEXPK-OAHLLOKOSA-N	1	1	310.350	1.434	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000451924896	231235680	/nfs/dbraw/zinc/23/56/80/231235680.db2.gz	JWMZJKZIRNEXPK-OAHLLOKOSA-N	1	1	310.350	1.434	20	5		DDBDMO
COC[C@@]1(CO)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000451924895	231236063	/nfs/dbraw/zinc/23/60/63/231236063.db2.gz	JWMZJKZIRNEXPK-HNNXBMFYSA-N	1	1	310.350	1.434	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000451924895	231236066	/nfs/dbraw/zinc/23/60/66/231236066.db2.gz	JWMZJKZIRNEXPK-HNNXBMFYSA-N	1	1	310.350	1.434	20	5		DDBDMO
CC[C@@H](C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)OC	ZINC000419227149	529473206	/nfs/dbraw/zinc/47/32/06/529473206.db2.gz	SGRXIPNRNUGWDR-HNNXBMFYSA-N	1	1	321.377	1.778	20	5		DDBDMO
CN1C(=O)CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000090030072	185278870	/nfs/dbraw/zinc/27/88/70/185278870.db2.gz	IQBWZERFEADYKL-LLVKDONJSA-N	1	1	311.725	1.485	20	5		DDBDMO
CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000614831826	362041823	/nfs/dbraw/zinc/04/18/23/362041823.db2.gz	XRBGQNPKDWWYDA-UHFFFAOYSA-N	1	1	322.365	1.515	20	5		DDBDMO
CC1(C)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000614831826	362041827	/nfs/dbraw/zinc/04/18/27/362041827.db2.gz	XRBGQNPKDWWYDA-UHFFFAOYSA-N	1	1	322.365	1.515	20	5		DDBDMO
CN1CC[NH+](CCCNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000299466355	529771426	/nfs/dbraw/zinc/77/14/26/529771426.db2.gz	ZNZRBYVYGQAHHV-UHFFFAOYSA-N	1	1	323.353	1.552	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985272	529801289	/nfs/dbraw/zinc/80/12/89/529801289.db2.gz	TZOSZQQBOBTPFZ-HZPDHXFCSA-N	1	1	305.378	1.628	20	5		DDBDMO
CN1CC[C@@](O)(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985272	529801290	/nfs/dbraw/zinc/80/12/90/529801290.db2.gz	TZOSZQQBOBTPFZ-HZPDHXFCSA-N	1	1	305.378	1.628	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000458184804	530060405	/nfs/dbraw/zinc/06/04/05/530060405.db2.gz	JUXMVEIUOXWDHD-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000458164608	530060889	/nfs/dbraw/zinc/06/08/89/530060889.db2.gz	KICUYGSPTVGQFZ-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181905817	186217296	/nfs/dbraw/zinc/21/72/96/186217296.db2.gz	XUDAERMVVUVILN-XQQFMLRXSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181905817	186217297	/nfs/dbraw/zinc/21/72/97/186217297.db2.gz	XUDAERMVVUVILN-XQQFMLRXSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[C@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000266853260	186360247	/nfs/dbraw/zinc/36/02/47/186360247.db2.gz	SBILWHQGQBJKDM-ZDUSSCGKSA-N	1	1	308.382	1.845	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H](C[NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000172353685	198084873	/nfs/dbraw/zinc/08/48/73/198084873.db2.gz	TWGPPSBOYWRQDZ-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](O)C1	ZINC000041886287	352317585	/nfs/dbraw/zinc/31/75/85/352317585.db2.gz	YPAKYRCCMLCUDM-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]3CCCC[C@H]32)c1	ZINC000331774299	234107237	/nfs/dbraw/zinc/10/72/37/234107237.db2.gz	KWJAWZSCYDCDRB-NWANDNLSSA-N	1	1	308.382	1.807	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000047268312	352488759	/nfs/dbraw/zinc/48/87/59/352488759.db2.gz	JNTCTNCQJGDGEI-CABCVRRESA-N	1	1	303.362	1.432	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c(C)c1[N+](=O)[O-]	ZINC000057703849	352824341	/nfs/dbraw/zinc/82/43/41/352824341.db2.gz	XYJMGRRSNZLRFR-SNVBAGLBSA-N	1	1	323.397	1.397	20	5		DDBDMO
C[C@H](CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[N@@H+](C)C1CC1	ZINC000057703845	352825020	/nfs/dbraw/zinc/82/50/20/352825020.db2.gz	IQSFINHIQPVDEM-SNVBAGLBSA-N	1	1	309.370	1.125	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000066126022	352979375	/nfs/dbraw/zinc/97/93/75/352979375.db2.gz	XTUCIRDSTQOMJV-GFCCVEGCSA-N	1	1	309.366	1.820	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000072665146	353207907	/nfs/dbraw/zinc/20/79/07/353207907.db2.gz	OLISUYIMNXPWKY-NSHDSACASA-N	1	1	319.365	1.097	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000072665146	353207910	/nfs/dbraw/zinc/20/79/10/353207910.db2.gz	OLISUYIMNXPWKY-NSHDSACASA-N	1	1	319.365	1.097	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000174618415	198360649	/nfs/dbraw/zinc/36/06/49/198360649.db2.gz	FXMPYNZSXRJGBW-OCCSQVGLSA-N	1	1	321.377	1.512	20	5		DDBDMO
COC1CCC([N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000075745688	353379077	/nfs/dbraw/zinc/37/90/77/353379077.db2.gz	ZJKLBYUIHKCOJJ-QRMWWUJWSA-N	1	1	312.370	1.042	20	5		DDBDMO
C[C@@H](c1ccccc1F)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174738157	198378591	/nfs/dbraw/zinc/37/85/91/198378591.db2.gz	MHADJYQXKOJFQJ-AAEUAGOBSA-N	1	1	322.340	1.984	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000093345223	353898095	/nfs/dbraw/zinc/89/80/95/353898095.db2.gz	UZTNZWOQJBBREC-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000093345223	353898098	/nfs/dbraw/zinc/89/80/98/353898098.db2.gz	UZTNZWOQJBBREC-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
CNC(=O)c1ccc(N2CCC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000142891161	354146740	/nfs/dbraw/zinc/14/67/40/354146740.db2.gz	NAKGMBWBSPQFIF-CYBMUJFWSA-N	1	1	318.377	1.629	20	5		DDBDMO
CC1(C)CN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC[NH2+]1	ZINC000212577120	354310473	/nfs/dbraw/zinc/31/04/73/354310473.db2.gz	QFSFANHFIOZTHU-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)C[C@H](O)C2CC2)cccc1[N+](=O)[O-]	ZINC000305211098	354469268	/nfs/dbraw/zinc/46/92/68/354469268.db2.gz	HALFEQVNWVPLRY-HNNXBMFYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CNc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-]	ZINC000322940183	354540451	/nfs/dbraw/zinc/54/04/51/354540451.db2.gz	QNJCFVBKDBTFBH-YHWZYXNKSA-N	1	1	318.377	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(CO)CC2)c1	ZINC000589494082	354995849	/nfs/dbraw/zinc/99/58/49/354995849.db2.gz	BHWJNRQNSAWJDB-UHFFFAOYSA-N	1	1	308.334	1.586	20	5		DDBDMO
CC[N@H+]1CCCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000589494569	354996283	/nfs/dbraw/zinc/99/62/83/354996283.db2.gz	PNWGAXSQWDLJAW-UHFFFAOYSA-N	1	1	321.377	1.909	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC000590010373	355039258	/nfs/dbraw/zinc/03/92/58/355039258.db2.gz	CIDCVFWUCWCRRI-SWLSCSKDSA-N	1	1	318.377	1.478	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590010575	355040443	/nfs/dbraw/zinc/04/04/43/355040443.db2.gz	PDPQJENEMDJWFL-SMDDNHRTSA-N	1	1	304.350	1.169	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H](O)CC1)OCCO2	ZINC000590381867	355078769	/nfs/dbraw/zinc/07/87/69/355078769.db2.gz	OSQVCEHSIGIYMR-LBPRGKRZSA-N	1	1	308.334	1.713	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@H](O)CC1)OCCO2	ZINC000590381867	355078774	/nfs/dbraw/zinc/07/87/74/355078774.db2.gz	OSQVCEHSIGIYMR-LBPRGKRZSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ncnc2ccc([N+](=O)[O-])cc21	ZINC000590739243	355160124	/nfs/dbraw/zinc/16/01/24/355160124.db2.gz	NGEIJMXXEURHLW-LLVKDONJSA-N	1	1	317.349	1.041	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ncnc2ccc([N+](=O)[O-])cc21	ZINC000590739245	355160185	/nfs/dbraw/zinc/16/01/85/355160185.db2.gz	NGEIJMXXEURHLW-NSHDSACASA-N	1	1	317.349	1.041	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@@H](O)[C@H]2C)cc1[N+](=O)[O-]	ZINC000590661478	355139844	/nfs/dbraw/zinc/13/98/44/355139844.db2.gz	WCZUQEYVHYVJMH-ZWNOBZJWSA-N	1	1	324.333	1.102	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[NH2+]1	ZINC000592246392	355546720	/nfs/dbraw/zinc/54/67/20/355546720.db2.gz	LUAXPXPLEUJQSC-CYBMUJFWSA-N	1	1	317.349	1.541	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](CO)[C@@H]2C)c1	ZINC000593036808	355776548	/nfs/dbraw/zinc/77/65/48/355776548.db2.gz	UMKDYIOVSVHPBY-WCQYABFASA-N	1	1	322.361	1.974	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C	ZINC000080717260	192185779	/nfs/dbraw/zinc/18/57/79/192185779.db2.gz	BSTOFDPRBIRSTC-YHWZYXNKSA-N	1	1	321.381	1.231	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+]C2CCN([C@@H]3CCOC3)CC2)cs1	ZINC000594992129	356369397	/nfs/dbraw/zinc/36/93/97/356369397.db2.gz	BEBDQUFPDIPWTD-CYBMUJFWSA-N	1	1	311.407	1.999	20	5		DDBDMO
O=C(C[NH2+][C@H]1CCCn2nccc21)Nc1ccccc1[N+](=O)[O-]	ZINC000595012793	356372012	/nfs/dbraw/zinc/37/20/12/356372012.db2.gz	OIOYNHOAHSTGPW-NSHDSACASA-N	1	1	315.333	1.855	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCN(C)C1=O	ZINC000595011342	356372373	/nfs/dbraw/zinc/37/23/73/356372373.db2.gz	HDPFPLKKBLKDMO-ZWNOBZJWSA-N	1	1	307.350	1.875	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1C[N@@H+](C)CCN1C	ZINC000595017608	356372990	/nfs/dbraw/zinc/37/29/90/356372990.db2.gz	KSTURMJKVCDXLH-TZMCWYRMSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CN(C)CCN1C	ZINC000595017608	356372993	/nfs/dbraw/zinc/37/29/93/356372993.db2.gz	KSTURMJKVCDXLH-TZMCWYRMSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000595374584	356470248	/nfs/dbraw/zinc/47/02/48/356470248.db2.gz	HALOVOKNTAHWME-JTQLQIEISA-N	1	1	319.321	1.673	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000595374584	356470253	/nfs/dbraw/zinc/47/02/53/356470253.db2.gz	HALOVOKNTAHWME-JTQLQIEISA-N	1	1	319.321	1.673	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595469716	356504733	/nfs/dbraw/zinc/50/47/33/356504733.db2.gz	XDIWDQYGQCGJJG-GFCCVEGCSA-N	1	1	311.357	1.886	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595469716	356504735	/nfs/dbraw/zinc/50/47/35/356504735.db2.gz	XDIWDQYGQCGJJG-GFCCVEGCSA-N	1	1	311.357	1.886	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1onc(C)c1[N+](=O)[O-]	ZINC000595473747	356507899	/nfs/dbraw/zinc/50/78/99/356507899.db2.gz	BKVZWSLTKUAJPK-LLVKDONJSA-N	1	1	310.354	1.772	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-]	ZINC000595473747	356507900	/nfs/dbraw/zinc/50/79/00/356507900.db2.gz	BKVZWSLTKUAJPK-LLVKDONJSA-N	1	1	310.354	1.772	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](C)[C@](C)(CO)C2)c1	ZINC000595860920	356680881	/nfs/dbraw/zinc/68/08/81/356680881.db2.gz	NBEQAVFLSDIWMR-ZBEGNZNMSA-N	1	1	322.361	1.832	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH2+][C@H](CO)c2ccc(F)cc2F)n1	ZINC000595867778	356684661	/nfs/dbraw/zinc/68/46/61/356684661.db2.gz	QLYIUWBZAXBLJN-GFCCVEGCSA-N	1	1	312.276	1.393	20	5		DDBDMO
CC(C)[C@H]([NH3+])CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000595945937	356717577	/nfs/dbraw/zinc/71/75/77/356717577.db2.gz	AEPGQNGPVBIVKV-LLVKDONJSA-N	1	1	305.338	1.574	20	5		DDBDMO
CN1CCC[N@@H+](CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596100900	356772116	/nfs/dbraw/zinc/77/21/16/356772116.db2.gz	CXPGKAMHXRFVTO-UHFFFAOYSA-N	1	1	309.370	1.135	20	5		DDBDMO
C[N@@H+]1CCCN(CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596100900	356772118	/nfs/dbraw/zinc/77/21/18/356772118.db2.gz	CXPGKAMHXRFVTO-UHFFFAOYSA-N	1	1	309.370	1.135	20	5		DDBDMO
C[N@H+]1CCCN(CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596100900	356772121	/nfs/dbraw/zinc/77/21/21/356772121.db2.gz	CXPGKAMHXRFVTO-UHFFFAOYSA-N	1	1	309.370	1.135	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1	ZINC000596512165	356901981	/nfs/dbraw/zinc/90/19/81/356901981.db2.gz	REJUUSVUHZHKCG-ZDUSSCGKSA-N	1	1	314.345	1.927	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1	ZINC000596512165	356901986	/nfs/dbraw/zinc/90/19/86/356901986.db2.gz	REJUUSVUHZHKCG-ZDUSSCGKSA-N	1	1	314.345	1.927	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)CCn2cc([N+](=O)[O-])nc2C)C1	ZINC000598341379	357543837	/nfs/dbraw/zinc/54/38/37/357543837.db2.gz	ADCAFGLKQWERSU-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
CC[N@@H+]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000598605330	357650374	/nfs/dbraw/zinc/65/03/74/357650374.db2.gz	AZYWEIQJZGTFTA-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CC[N@H+]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000598605330	357650377	/nfs/dbraw/zinc/65/03/77/357650377.db2.gz	AZYWEIQJZGTFTA-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598652063	357671246	/nfs/dbraw/zinc/67/12/46/357671246.db2.gz	WTISVTANRRKVJE-CHWSQXEVSA-N	1	1	321.377	1.874	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000598559947	357631875	/nfs/dbraw/zinc/63/18/75/357631875.db2.gz	JLXRHSBADRQABS-LBPRGKRZSA-N	1	1	306.366	1.775	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[NH2+][C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598569234	357635164	/nfs/dbraw/zinc/63/51/64/357635164.db2.gz	BZBAGIBJHCTSKN-SNVBAGLBSA-N	1	1	309.370	1.511	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[N@@H+]1CC[C@@H](O)C1	ZINC000599085291	357810444	/nfs/dbraw/zinc/81/04/44/357810444.db2.gz	ORZYPVSBWGZMAV-WCQYABFASA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599085291	357810446	/nfs/dbraw/zinc/81/04/46/357810446.db2.gz	ORZYPVSBWGZMAV-WCQYABFASA-N	1	1	309.366	1.321	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])[C@@H]1c1ccccc1	ZINC000179338573	199017838	/nfs/dbraw/zinc/01/78/38/199017838.db2.gz	KGDKJGXCIKJHIH-RISCZKNCSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1ccccc1	ZINC000179338573	199017840	/nfs/dbraw/zinc/01/78/40/199017840.db2.gz	KGDKJGXCIKJHIH-RISCZKNCSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1ccccc1	ZINC000179338573	199017841	/nfs/dbraw/zinc/01/78/41/199017841.db2.gz	KGDKJGXCIKJHIH-RISCZKNCSA-N	1	1	315.333	1.493	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@](C)(CO)[C@](C)(CO)C2)ccc1[N+](=O)[O-]	ZINC000599623338	357996159	/nfs/dbraw/zinc/99/61/59/357996159.db2.gz	LSWUCYYXOKRRJH-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H]2CCC[C@H]21	ZINC000599661225	358013698	/nfs/dbraw/zinc/01/36/98/358013698.db2.gz	TVCUSCRLCKCBBO-YNEHKIRRSA-N	1	1	322.365	1.455	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599672403	358019139	/nfs/dbraw/zinc/01/91/39/358019139.db2.gz	OMJZSXSHSIMEQG-XBXGTLAGSA-N	1	1	321.377	1.935	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1C1CCN(c2sccc2[N+](=O)[O-])CC1	ZINC000302042545	283350098	/nfs/dbraw/zinc/35/00/98/283350098.db2.gz	WXOOLKDFBFPMRG-LLVKDONJSA-N	1	1	324.406	1.575	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000180531269	199172118	/nfs/dbraw/zinc/17/21/18/199172118.db2.gz	WCYCXPHWKCXJRY-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000180838236	199216114	/nfs/dbraw/zinc/21/61/14/199216114.db2.gz	XRPMOQFJBMVXQJ-SECBINFHSA-N	1	1	307.306	1.005	20	5		DDBDMO
CC(C)N1CC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O	ZINC000601116910	358409217	/nfs/dbraw/zinc/40/92/17/358409217.db2.gz	RMRVVEDGQFUVLK-OAHLLOKOSA-N	1	1	314.345	1.986	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601137118	358416972	/nfs/dbraw/zinc/41/69/72/358416972.db2.gz	TVBJAUHYINMSQL-HTQZYQBOSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601137118	358416975	/nfs/dbraw/zinc/41/69/75/358416975.db2.gz	TVBJAUHYINMSQL-HTQZYQBOSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[S@](=O)C1(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000601160333	358427080	/nfs/dbraw/zinc/42/70/80/358427080.db2.gz	UNWURSKBYYOARL-NRFANRHFSA-N	1	1	305.359	1.888	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000602131711	358835433	/nfs/dbraw/zinc/83/54/33/358835433.db2.gz	GMJOGJJBHNBYIF-NSHDSACASA-N	1	1	304.350	1.216	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000602673577	359117887	/nfs/dbraw/zinc/11/78/87/359117887.db2.gz	WAVQSHPJGFRCTJ-GWCFXTLKSA-N	1	1	302.334	1.872	20	5		DDBDMO
C[C@H]1CC[C@](CO)([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000187963213	200183884	/nfs/dbraw/zinc/18/38/84/200183884.db2.gz	QOYFSAWGCNGBHS-WFASDCNBSA-N	1	1	309.366	1.239	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000604278111	359732134	/nfs/dbraw/zinc/73/21/34/359732134.db2.gz	GMAQTXWHNLCGPJ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@H]1CCC[N@H+](C)C1	ZINC000604278111	359732142	/nfs/dbraw/zinc/73/21/42/359732142.db2.gz	GMAQTXWHNLCGPJ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000609257579	360277313	/nfs/dbraw/zinc/27/73/13/360277313.db2.gz	BRNUSBPNJJNBCF-CQSZACIVSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2CO1	ZINC000281201901	216150566	/nfs/dbraw/zinc/15/05/66/216150566.db2.gz	CLXHUEQMRUVWRN-XBFCOCLRSA-N	1	1	321.333	1.059	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@H](CCO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000610213577	360391701	/nfs/dbraw/zinc/39/17/01/360391701.db2.gz	GGNFBFJRQBXDTC-CYBMUJFWSA-N	1	1	321.377	1.652	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@H](CCO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000610213577	360391708	/nfs/dbraw/zinc/39/17/08/360391708.db2.gz	GGNFBFJRQBXDTC-CYBMUJFWSA-N	1	1	321.377	1.652	20	5		DDBDMO
CC[N@@H+](CCC(F)(F)F)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000610368178	360423091	/nfs/dbraw/zinc/42/30/91/360423091.db2.gz	VKZXESYZRYGLJS-SNVBAGLBSA-N	1	1	310.276	1.427	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1	ZINC000611195856	360656257	/nfs/dbraw/zinc/65/62/57/360656257.db2.gz	YXFPSHHEEFAWTN-SNVBAGLBSA-N	1	1	302.334	1.900	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611088182	360620124	/nfs/dbraw/zinc/62/01/24/360620124.db2.gz	IMOJDTHWIIACRG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611088182	360620127	/nfs/dbraw/zinc/62/01/27/360620127.db2.gz	IMOJDTHWIIACRG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)cc1[N+](=O)[O-]	ZINC000611348844	360703161	/nfs/dbraw/zinc/70/31/61/360703161.db2.gz	MUAZPJOAMCYROS-AWEZNQCLSA-N	1	1	321.377	1.510	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000292525942	223126710	/nfs/dbraw/zinc/12/67/10/223126710.db2.gz	WRBVLUCAWPJOLQ-HZMBPMFUSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000292525942	223126712	/nfs/dbraw/zinc/12/67/12/223126712.db2.gz	WRBVLUCAWPJOLQ-HZMBPMFUSA-N	1	1	308.334	1.807	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619254976	363946734	/nfs/dbraw/zinc/94/67/34/363946734.db2.gz	ROJGCUDFHWSZFV-DZGCQCFKSA-N	1	1	321.352	1.782	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000376484073	307245556	/nfs/dbraw/zinc/24/55/56/307245556.db2.gz	ILHUYGDQVPKWKT-UHFFFAOYSA-N	1	1	308.382	1.460	20	5		DDBDMO
Cc1nn(CCC(=O)NC2C[NH+](C(C)C)C2)c(C)c1[N+](=O)[O-]	ZINC000275226020	212207890	/nfs/dbraw/zinc/20/78/90/212207890.db2.gz	LTFWNCCFBQIZPH-UHFFFAOYSA-N	1	1	309.370	1.007	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](O)C1	ZINC000265001615	204336611	/nfs/dbraw/zinc/33/66/11/204336611.db2.gz	DXLGYMVEXQHDKS-SKDRFNHKSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](O)C1	ZINC000265001615	204336616	/nfs/dbraw/zinc/33/66/16/204336616.db2.gz	DXLGYMVEXQHDKS-SKDRFNHKSA-N	1	1	304.306	1.772	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000567435193	304218666	/nfs/dbraw/zinc/21/86/66/304218666.db2.gz	JPFVJIOMRYWUKH-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[NH+](C[C@@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000285232020	218343471	/nfs/dbraw/zinc/34/34/71/218343471.db2.gz	YEWBESGWALZYFC-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc2c(c1)OCCO2	ZINC000341049318	251355294	/nfs/dbraw/zinc/35/52/94/251355294.db2.gz	CJCBQMCFUXDMLU-JTQLQIEISA-N	1	1	318.333	1.950	20	5		DDBDMO
C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc2c(c1)OCCO2	ZINC000341049373	251355535	/nfs/dbraw/zinc/35/55/35/251355535.db2.gz	CJCBQMCFUXDMLU-SNVBAGLBSA-N	1	1	318.333	1.950	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@@H+]1CCCC[C@H]1C	ZINC000065867576	184381715	/nfs/dbraw/zinc/38/17/15/184381715.db2.gz	JITQFLYFCGNLKI-LLVKDONJSA-N	1	1	309.370	1.090	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000444177172	532985044	/nfs/dbraw/zinc/98/50/44/532985044.db2.gz	SUPXTHZWJJHNNE-NSHDSACASA-N	1	1	323.349	1.054	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](CCO)CC1CC1	ZINC000352479101	285080431	/nfs/dbraw/zinc/08/04/31/285080431.db2.gz	AOCOHFSSARFWJL-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)Cn1cccn1	ZINC000352545625	285130810	/nfs/dbraw/zinc/13/08/10/285130810.db2.gz	YSGPKOGIOJBVIV-CQSZACIVSA-N	1	1	304.350	1.327	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444644156	533142508	/nfs/dbraw/zinc/14/25/08/533142508.db2.gz	UVCGRVXYJSAQCA-HNNXBMFYSA-N	1	1	318.333	1.856	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444644156	533142510	/nfs/dbraw/zinc/14/25/10/533142510.db2.gz	UVCGRVXYJSAQCA-HNNXBMFYSA-N	1	1	318.333	1.856	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](CO)COC(C)C	ZINC000433153525	533218588	/nfs/dbraw/zinc/21/85/88/533218588.db2.gz	PTGLRJZLOFYCMI-AWEZNQCLSA-N	1	1	312.366	1.821	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](CO)COC(C)C	ZINC000433153525	533218595	/nfs/dbraw/zinc/21/85/95/533218595.db2.gz	PTGLRJZLOFYCMI-AWEZNQCLSA-N	1	1	312.366	1.821	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](F)C1	ZINC000451189548	533224092	/nfs/dbraw/zinc/22/40/92/533224092.db2.gz	FPFXJJDXFQVQSV-JTQLQIEISA-N	1	1	311.313	1.976	20	5		DDBDMO
COc1ccc(C[NH+]2CCC(NC(N)=O)CC2)cc1[N+](=O)[O-]	ZINC000353286909	285643875	/nfs/dbraw/zinc/64/38/75/285643875.db2.gz	PAIFEDONXZXYCU-UHFFFAOYSA-N	1	1	308.338	1.236	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@H](C)[NH2+][C@@H](C)C1	ZINC000070077004	406808607	/nfs/dbraw/zinc/80/86/07/406808607.db2.gz	VQFUDNYLCHZVGK-QWRGUYRKSA-N	1	1	313.379	1.274	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1csc([N+](=O)[O-])c1	ZINC000044521397	407025110	/nfs/dbraw/zinc/02/51/10/407025110.db2.gz	BZANDWZMHNXYIJ-UHFFFAOYSA-N	1	1	301.368	1.354	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000079670138	407060636	/nfs/dbraw/zinc/06/06/36/407060636.db2.gz	QAPJHHFQSPGDAQ-UHFFFAOYSA-N	1	1	324.381	1.362	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000065209206	407240605	/nfs/dbraw/zinc/24/06/05/407240605.db2.gz	JHCUTBVBEODPNV-AWEZNQCLSA-N	1	1	307.350	1.526	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000067807056	407285604	/nfs/dbraw/zinc/28/56/04/407285604.db2.gz	FUSKEUMIKJGYAS-SNVBAGLBSA-N	1	1	309.322	1.274	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000067807056	407285607	/nfs/dbraw/zinc/28/56/07/407285607.db2.gz	FUSKEUMIKJGYAS-SNVBAGLBSA-N	1	1	309.322	1.274	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000068011971	407293493	/nfs/dbraw/zinc/29/34/93/407293493.db2.gz	NQJRFKWOPHTPNQ-SNVBAGLBSA-N	1	1	310.329	1.530	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCC[C@H](C)C1	ZINC000068084340	407294285	/nfs/dbraw/zinc/29/42/85/407294285.db2.gz	STEKDNZZAHAXKO-RYUDHWBXSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000108343040	407384850	/nfs/dbraw/zinc/38/48/50/407384850.db2.gz	NWWYVTHUXKMEJE-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000108343040	407384852	/nfs/dbraw/zinc/38/48/52/407384852.db2.gz	NWWYVTHUXKMEJE-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000108343040	407384854	/nfs/dbraw/zinc/38/48/54/407384854.db2.gz	NWWYVTHUXKMEJE-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@@H](C)C[S@](C)=O)cc1[N+](=O)[O-]	ZINC000126102788	407405516	/nfs/dbraw/zinc/40/55/16/407405516.db2.gz	GQJZUEIPCGIYDZ-WVDJIFEKSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H](C)C[S@](C)=O)cc1[N+](=O)[O-]	ZINC000126102788	407405517	/nfs/dbraw/zinc/40/55/17/407405517.db2.gz	GQJZUEIPCGIYDZ-WVDJIFEKSA-N	1	1	300.380	1.802	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159340	407407101	/nfs/dbraw/zinc/40/71/01/407407101.db2.gz	DBVNIYMGBRDROW-LITPITGPSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159340	407407104	/nfs/dbraw/zinc/40/71/04/407407104.db2.gz	DBVNIYMGBRDROW-LITPITGPSA-N	1	1	300.380	1.327	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1	ZINC000111321321	407407465	/nfs/dbraw/zinc/40/74/65/407407465.db2.gz	HUAFIPJOXJLXGC-KNUOEEMSSA-N	1	1	322.361	1.322	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000126469573	407413862	/nfs/dbraw/zinc/41/38/62/407413862.db2.gz	LLGLWCJQYKMWLV-GIPWTMENSA-N	1	1	300.380	1.672	20	5		DDBDMO
C[N@H+]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000271063462	407493843	/nfs/dbraw/zinc/49/38/43/407493843.db2.gz	TUTUCRVLOMYTLN-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000271063462	407493847	/nfs/dbraw/zinc/49/38/47/407493847.db2.gz	TUTUCRVLOMYTLN-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000271063462	407493853	/nfs/dbraw/zinc/49/38/53/407493853.db2.gz	TUTUCRVLOMYTLN-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000270985692	407450739	/nfs/dbraw/zinc/45/07/39/407450739.db2.gz	XSKFXBVGHSWZGK-WDMOLILDSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000270985692	407450745	/nfs/dbraw/zinc/45/07/45/407450745.db2.gz	XSKFXBVGHSWZGK-WDMOLILDSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000265795789	407460219	/nfs/dbraw/zinc/46/02/19/407460219.db2.gz	MKUSOXXRBLTAAT-LBPRGKRZSA-N	1	1	305.378	1.940	20	5		DDBDMO
COCC1=CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000185824236	407510534	/nfs/dbraw/zinc/51/05/34/407510534.db2.gz	IXVRDDLIJRUQQO-OAHLLOKOSA-N	1	1	322.361	1.613	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000178954176	407672027	/nfs/dbraw/zinc/67/20/27/407672027.db2.gz	LNYSVLJPBBTDGC-GHMZBOCLSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C3CCCC3)CC2)n1	ZINC000271390224	407665229	/nfs/dbraw/zinc/66/52/29/407665229.db2.gz	KYFRPUGGPVRAEW-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1C	ZINC000117285747	407823505	/nfs/dbraw/zinc/82/35/05/407823505.db2.gz	QGFGRKWUQVIWJU-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1C	ZINC000117285747	407823509	/nfs/dbraw/zinc/82/35/09/407823509.db2.gz	QGFGRKWUQVIWJU-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[NH+](CCO)CC2)ccc1[N+](=O)[O-]	ZINC000153734022	407890124	/nfs/dbraw/zinc/89/01/24/407890124.db2.gz	GSYNATDAPBTPJZ-UHFFFAOYSA-N	1	1	308.338	1.045	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000272544371	407975684	/nfs/dbraw/zinc/97/56/84/407975684.db2.gz	CJDIWVPGXCXKDV-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000268276224	407982066	/nfs/dbraw/zinc/98/20/66/407982066.db2.gz	WGHODFVLYIRGOD-IAQYHMDHSA-N	1	1	303.362	1.736	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000272441348	407923898	/nfs/dbraw/zinc/92/38/98/407923898.db2.gz	INGPOMKBVCEFHH-DOMZBBRYSA-N	1	1	303.362	1.690	20	5		DDBDMO
CNC(=O)CC1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000175026152	408031804	/nfs/dbraw/zinc/03/18/04/408031804.db2.gz	OTZUDQSWIHSENU-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000175150099	408065109	/nfs/dbraw/zinc/06/51/09/408065109.db2.gz	SZURXOXQQPIAOO-AWEZNQCLSA-N	1	1	321.377	1.667	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000175150099	408065116	/nfs/dbraw/zinc/06/51/16/408065116.db2.gz	SZURXOXQQPIAOO-AWEZNQCLSA-N	1	1	321.377	1.667	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246142594	408154855	/nfs/dbraw/zinc/15/48/55/408154855.db2.gz	KPSHJFXDYIEGPH-VXGBXAGGSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246142594	408154862	/nfs/dbraw/zinc/15/48/62/408154862.db2.gz	KPSHJFXDYIEGPH-VXGBXAGGSA-N	1	1	321.381	1.391	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190112769	408168328	/nfs/dbraw/zinc/16/83/28/408168328.db2.gz	IIKUBCRXERDDMB-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190112769	408168333	/nfs/dbraw/zinc/16/83/33/408168333.db2.gz	IIKUBCRXERDDMB-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000190240531	408198398	/nfs/dbraw/zinc/19/83/98/408198398.db2.gz	FYAIIRXUAMBPQI-YVZNUBBCSA-N	1	1	305.378	1.606	20	5		DDBDMO
CCOC(=O)C[C@H](C)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000182671685	408217581	/nfs/dbraw/zinc/21/75/81/408217581.db2.gz	SLBYCEBCTTZCBM-JTQLQIEISA-N	1	1	323.349	1.467	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H]1CO	ZINC000190376770	408230686	/nfs/dbraw/zinc/23/06/86/408230686.db2.gz	ZWDVSFFSCBOUHW-ZWNOBZJWSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H]1CO	ZINC000190376770	408230689	/nfs/dbraw/zinc/23/06/89/408230689.db2.gz	ZWDVSFFSCBOUHW-ZWNOBZJWSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000183202337	408352482	/nfs/dbraw/zinc/35/24/82/408352482.db2.gz	UVHSEDUHHAFEIX-GHMZBOCLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000183225392	408359970	/nfs/dbraw/zinc/35/99/70/408359970.db2.gz	QQHCYTHPSTUFMN-SCRDCRAPSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000274555567	408447704	/nfs/dbraw/zinc/44/77/04/408447704.db2.gz	YLLDYAPQSJLIQB-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247090678	408406809	/nfs/dbraw/zinc/40/68/09/408406809.db2.gz	UJCROWLDZBLADJ-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247090678	408406815	/nfs/dbraw/zinc/40/68/15/408406815.db2.gz	UJCROWLDZBLADJ-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000247161599	408418114	/nfs/dbraw/zinc/41/81/14/408418114.db2.gz	MIWSTJFFHIUTGG-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000274601304	408465493	/nfs/dbraw/zinc/46/54/93/408465493.db2.gz	XDDGGGJXADRSHM-UHFFFAOYSA-N	1	1	321.333	1.385	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@H](N3CCCC3=O)C2)cc1[N+](=O)[O-]	ZINC000270492128	408550587	/nfs/dbraw/zinc/55/05/87/408550587.db2.gz	ATWDHSSXBDMVHX-ZDUSSCGKSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](N3CCCC3=O)C2)cc1[N+](=O)[O-]	ZINC000270492128	408550590	/nfs/dbraw/zinc/55/05/90/408550590.db2.gz	ATWDHSSXBDMVHX-ZDUSSCGKSA-N	1	1	319.361	1.800	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CC(C)C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000265119906	408558590	/nfs/dbraw/zinc/55/85/90/408558590.db2.gz	NIXBFJGVSZIDMA-UHFFFAOYSA-N	1	1	323.397	1.819	20	5		DDBDMO
NS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000265205457	408578812	/nfs/dbraw/zinc/57/88/12/408578812.db2.gz	KNNCQVJRERXVMN-GFCCVEGCSA-N	1	1	313.379	1.095	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000275211435	408580609	/nfs/dbraw/zinc/58/06/09/408580609.db2.gz	JKEVOGUTYQRSPD-UHFFFAOYSA-N	1	1	314.345	1.965	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000248586226	408592470	/nfs/dbraw/zinc/59/24/70/408592470.db2.gz	QYLOCRBARMMPDC-WOPDTQHZSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000270619768	408606932	/nfs/dbraw/zinc/60/69/32/408606932.db2.gz	RGNMKUUFYGAAKQ-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](Cc2ccccc2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000270619768	408606934	/nfs/dbraw/zinc/60/69/34/408606934.db2.gz	RGNMKUUFYGAAKQ-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000270619768	408606938	/nfs/dbraw/zinc/60/69/38/408606938.db2.gz	RGNMKUUFYGAAKQ-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000162670286	408727115	/nfs/dbraw/zinc/72/71/15/408727115.db2.gz	WGGAEJYSPPVETO-ZYHUDNBSSA-N	1	1	319.365	1.407	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@H](C)O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000249492440	408731407	/nfs/dbraw/zinc/73/14/07/408731407.db2.gz	FNXHOTOTDUYEIS-STQMWFEESA-N	1	1	307.394	1.790	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@H]1C	ZINC000194725225	408795105	/nfs/dbraw/zinc/79/51/05/408795105.db2.gz	CQASJPDDPSNCAA-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@H]1C	ZINC000194725225	408795109	/nfs/dbraw/zinc/79/51/09/408795109.db2.gz	CQASJPDDPSNCAA-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
CCC[N@@H+](CCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000185183610	408776805	/nfs/dbraw/zinc/77/68/05/408776805.db2.gz	FIAYYRGBHCYOBR-UHFFFAOYSA-N	1	1	313.329	1.767	20	5		DDBDMO
C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000285853558	408875914	/nfs/dbraw/zinc/87/59/14/408875914.db2.gz	QHPFRHDJNVXVLC-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000285857039	408877742	/nfs/dbraw/zinc/87/77/42/408877742.db2.gz	IJSILTPKOHRNOT-CZUORRHYSA-N	1	1	305.378	1.890	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000285780980	408863482	/nfs/dbraw/zinc/86/34/82/408863482.db2.gz	NAVAKFBQSMKVFV-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[C@@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[N@H+](C2CCC2)C1	ZINC000291621529	408896096	/nfs/dbraw/zinc/89/60/96/408896096.db2.gz	ATSSNMXPUGGIIT-JTQLQIEISA-N	1	1	306.370	1.278	20	5		DDBDMO
Cc1cccc2c1C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000277371233	408928720	/nfs/dbraw/zinc/92/87/20/408928720.db2.gz	XQOXCLZKSKOMCX-OAHLLOKOSA-N	1	1	316.361	1.519	20	5		DDBDMO
CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CCn4cc([N+](=O)[O-])ccc4=O)[C@H]1[C@H]3C2	ZINC000286435532	408985607	/nfs/dbraw/zinc/98/56/07/408985607.db2.gz	JBFVOYUNKKICJH-GSJWJAIFSA-N	1	1	319.361	1.112	20	5		DDBDMO
Cc1cc(N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)c(F)cc1[N+](=O)[O-]	ZINC000292701801	409040039	/nfs/dbraw/zinc/04/00/39/409040039.db2.gz	SBOMCNDSZACXGE-LSDHHAIUSA-N	1	1	309.341	1.952	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](O)CC2)c1	ZINC000293288053	409083118	/nfs/dbraw/zinc/08/31/18/409083118.db2.gz	VURYUIXGWSLYMN-KBPBESRZSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000293375850	409101771	/nfs/dbraw/zinc/10/17/71/409101771.db2.gz	JNQYFQFKCHVJFA-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000293375850	409101773	/nfs/dbraw/zinc/10/17/73/409101773.db2.gz	JNQYFQFKCHVJFA-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CCOc1cccc(N2CC[C@H]3OCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000284995673	409391006	/nfs/dbraw/zinc/39/10/06/409391006.db2.gz	LREHYTSGIHXJDQ-ZIAGYGMSSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccc([N+](=O)[O-])c(F)c1F)C1CC1	ZINC000296100497	409429735	/nfs/dbraw/zinc/42/97/35/409429735.db2.gz	ZXCWESOZQWMRBO-SECBINFHSA-N	1	1	302.277	1.707	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290575618	409449073	/nfs/dbraw/zinc/44/90/73/409449073.db2.gz	UZNYAZYOIGUGDC-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc(F)cc1[N+](=O)[O-]	ZINC000324549126	164050815	/nfs/dbraw/zinc/05/08/15/164050815.db2.gz	YAEUHGAPYHMVND-WDEREUQCSA-N	1	1	322.340	1.673	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000363010927	164159697	/nfs/dbraw/zinc/15/96/97/164159697.db2.gz	WMQJJUUMKRIUQF-GFCCVEGCSA-N	1	1	321.381	1.315	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290694976	409490152	/nfs/dbraw/zinc/49/01/52/409490152.db2.gz	VDGLIZLEIRVDKA-LLVKDONJSA-N	1	1	321.381	1.621	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)CC[C@H]1C	ZINC000354006981	409595057	/nfs/dbraw/zinc/59/50/57/409595057.db2.gz	OFCRSYDGTFOLIU-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304290282	409597694	/nfs/dbraw/zinc/59/76/94/409597694.db2.gz	CFDLHPLGNGUOLU-PAPYEOQZSA-N	1	1	308.382	1.805	20	5		DDBDMO
C[C@]1(O)CCOC[C@@H]1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000331623720	409706835	/nfs/dbraw/zinc/70/68/35/409706835.db2.gz	YEXKBUXXPHEAMA-ILXRZTDVSA-N	1	1	324.381	1.043	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc([N+](=O)[O-])c1C	ZINC000331595777	409675993	/nfs/dbraw/zinc/67/59/93/409675993.db2.gz	YHPBUYQJGQHPJK-LBPRGKRZSA-N	1	1	319.361	1.878	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H]1C	ZINC000357049850	409819432	/nfs/dbraw/zinc/81/94/32/409819432.db2.gz	HOLQMOAPOWWGLM-QWRGUYRKSA-N	1	1	309.370	1.273	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2C)C1	ZINC000357154825	409906923	/nfs/dbraw/zinc/90/69/23/409906923.db2.gz	FKXLWESIFCHIGF-CQSZACIVSA-N	1	1	307.350	1.240	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2C)C1	ZINC000357154825	409906932	/nfs/dbraw/zinc/90/69/32/409906932.db2.gz	FKXLWESIFCHIGF-CQSZACIVSA-N	1	1	307.350	1.240	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCN(CCO)CC1	ZINC000357643508	410157525	/nfs/dbraw/zinc/15/75/25/410157525.db2.gz	DXIGETBYCBOGTD-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@H](O)C1	ZINC000351827956	410271648	/nfs/dbraw/zinc/27/16/48/410271648.db2.gz	MSUSNIUMXFCBPM-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347004176	410306953	/nfs/dbraw/zinc/30/69/53/410306953.db2.gz	BGCTZCGMAQWNFM-ZDUSSCGKSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCCC[C@@H]1C	ZINC000347012137	410312057	/nfs/dbraw/zinc/31/20/57/410312057.db2.gz	LSJBRUAPOIIYCR-QWRGUYRKSA-N	1	1	309.370	1.321	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298777804	410394075	/nfs/dbraw/zinc/39/40/75/410394075.db2.gz	DIIBZXMFQSDFJR-QWRGUYRKSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298777804	410394082	/nfs/dbraw/zinc/39/40/82/410394082.db2.gz	DIIBZXMFQSDFJR-QWRGUYRKSA-N	1	1	321.333	1.417	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000355376251	410481116	/nfs/dbraw/zinc/48/11/16/410481116.db2.gz	XEPFMWCKHRBWAD-GJZGRUSLSA-N	1	1	319.361	1.530	20	5		DDBDMO
Cc1c(CNC(=O)NC[C@@H]2CCC[N@@H+]2C)cccc1[N+](=O)[O-]	ZINC000358577104	410484624	/nfs/dbraw/zinc/48/46/24/410484624.db2.gz	FYMMWVQENRUMEJ-ZDUSSCGKSA-N	1	1	306.366	1.797	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000343550614	410526032	/nfs/dbraw/zinc/52/60/32/410526032.db2.gz	CCXJOILHUVPQTH-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000343615847	410572837	/nfs/dbraw/zinc/57/28/37/410572837.db2.gz	RTBLTUWHOUHKOP-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H]1CCCOC1	ZINC000352196559	410540599	/nfs/dbraw/zinc/54/05/99/410540599.db2.gz	ZXRGEQDHKBAZQG-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1CCCOC1	ZINC000352196559	410540604	/nfs/dbraw/zinc/54/06/04/410540604.db2.gz	ZXRGEQDHKBAZQG-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000343595915	410562068	/nfs/dbraw/zinc/56/20/68/410562068.db2.gz	HSOGKQHRPSGMBC-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C)CC[N@H+]1CCOC	ZINC000301400404	410715764	/nfs/dbraw/zinc/71/57/64/410715764.db2.gz	IGQXZXPSTWGWOC-CYBMUJFWSA-N	1	1	308.382	1.845	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343914972	410804233	/nfs/dbraw/zinc/80/42/33/410804233.db2.gz	WJUIARQZKPMYLV-WFASDCNBSA-N	1	1	320.393	1.919	20	5		DDBDMO
Cc1cc(N2CCC[C@@H]2C[N@H+]2CCC[C@H]2CO)ncc1[N+](=O)[O-]	ZINC000301591952	410749835	/nfs/dbraw/zinc/74/98/35/410749835.db2.gz	YMBUURHMBHKJCR-KGLIPLIRSA-N	1	1	320.393	1.724	20	5		DDBDMO
COC(=O)c1cnc(NC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000302747396	410856880	/nfs/dbraw/zinc/85/68/80/410856880.db2.gz	GAVZRNVOLWPSLG-JTQLQIEISA-N	1	1	308.338	1.530	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@@H+]2CC=C(C)CC2)c([N+](=O)[O-])c1	ZINC000302781580	410862964	/nfs/dbraw/zinc/86/29/64/410862964.db2.gz	SCLZXEFFWKZMKM-UHFFFAOYSA-N	1	1	320.349	1.840	20	5		DDBDMO
CC[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1C[C@@H](C)O	ZINC000330602316	410817534	/nfs/dbraw/zinc/81/75/34/410817534.db2.gz	FHKOUZBNQXMHOU-OCCSQVGLSA-N	1	1	323.393	1.577	20	5		DDBDMO
CC[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000330602316	410817539	/nfs/dbraw/zinc/81/75/39/410817539.db2.gz	FHKOUZBNQXMHOU-OCCSQVGLSA-N	1	1	323.393	1.577	20	5		DDBDMO
Cc1c(CNC(=O)[C@@H](C)[NH+]2CCSCC2)cccc1[N+](=O)[O-]	ZINC000331105409	410949384	/nfs/dbraw/zinc/94/93/84/410949384.db2.gz	GFBWXTTURJJWMJ-GFCCVEGCSA-N	1	1	323.418	1.957	20	5		DDBDMO
Cc1cc(C(=O)NCCC[N@H+](C)CCN(C)C)ccc1[N+](=O)[O-]	ZINC000356500183	411058447	/nfs/dbraw/zinc/05/84/47/411058447.db2.gz	DDOMHSZYDOIVHX-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1cc(C(=O)NCCCN(C)CC[NH+](C)C)ccc1[N+](=O)[O-]	ZINC000356500183	411058452	/nfs/dbraw/zinc/05/84/52/411058452.db2.gz	DDOMHSZYDOIVHX-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@H]1n1ccnc1	ZINC000129820290	196078157	/nfs/dbraw/zinc/07/81/57/196078157.db2.gz	DBNCRLPUSOSBBL-OLZOCXBDSA-N	1	1	304.354	1.571	20	5		DDBDMO
CCC[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000132469913	196257510	/nfs/dbraw/zinc/25/75/10/196257510.db2.gz	QFYKMKQBPCUQHZ-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000132469913	196257512	/nfs/dbraw/zinc/25/75/12/196257512.db2.gz	QFYKMKQBPCUQHZ-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)C1	ZINC000488756842	416562005	/nfs/dbraw/zinc/56/20/05/416562005.db2.gz	WXUHWAPJSSCJHP-GARJFASQSA-N	1	1	306.370	1.134	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cn3)CC[C@H]21	ZINC000366295035	418453280	/nfs/dbraw/zinc/45/32/80/418453280.db2.gz	PTQVWUVAGRYZJA-BXUZGUMPSA-N	1	1	304.350	1.546	20	5		DDBDMO
C[C@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000360651166	418483857	/nfs/dbraw/zinc/48/38/57/418483857.db2.gz	FWWZAXQQUKBHDW-WDEREUQCSA-N	1	1	313.379	1.356	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H](c2[nH+]ccn2C)C1	ZINC000361043150	418572303	/nfs/dbraw/zinc/57/23/03/418572303.db2.gz	NZWFHIHSAZNJKI-NSHDSACASA-N	1	1	304.354	1.847	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360937552	418551305	/nfs/dbraw/zinc/55/13/05/418551305.db2.gz	LPROCLPFMDMKRS-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360937552	418551309	/nfs/dbraw/zinc/55/13/09/418551309.db2.gz	LPROCLPFMDMKRS-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000374679135	418554212	/nfs/dbraw/zinc/55/42/12/418554212.db2.gz	MOMVAUZIIUYITG-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC(C)C[C@@H]1C(=O)NCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000189819088	222057740	/nfs/dbraw/zinc/05/77/40/222057740.db2.gz	KCWBDOMDKQIIEP-OAHLLOKOSA-N	1	1	305.378	1.984	20	5		DDBDMO
CC(C)C[C@@H]1C(=O)NCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000189819088	222057743	/nfs/dbraw/zinc/05/77/43/222057743.db2.gz	KCWBDOMDKQIIEP-OAHLLOKOSA-N	1	1	305.378	1.984	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)[C@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000375037018	418593163	/nfs/dbraw/zinc/59/31/63/418593163.db2.gz	HXURXPBZETUEKB-FZMZJTMJSA-N	1	1	318.377	1.652	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000375036890	418593434	/nfs/dbraw/zinc/59/34/34/418593434.db2.gz	IJGGVTLPBJRZJV-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CCOc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000375028368	418590543	/nfs/dbraw/zinc/59/05/43/418590543.db2.gz	CJZVNEMITLNGDK-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1cccc(NCCNc2ccc3ncc([N+](=O)[O-])n3n2)[nH+]1	ZINC000347862278	418639334	/nfs/dbraw/zinc/63/93/34/418639334.db2.gz	NGQDKAMVUJFGQD-UHFFFAOYSA-N	1	1	313.321	1.865	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@](CO)(c2ccccc2)C1	ZINC000368259872	418711434	/nfs/dbraw/zinc/71/14/34/418711434.db2.gz	GTDCVJGUNWEDSF-INIZCTEOSA-N	1	1	316.361	1.464	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@](CO)(c2ccccc2)C1	ZINC000368259872	418711436	/nfs/dbraw/zinc/71/14/36/418711436.db2.gz	GTDCVJGUNWEDSF-INIZCTEOSA-N	1	1	316.361	1.464	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000367984791	418668604	/nfs/dbraw/zinc/66/86/04/418668604.db2.gz	YWLSZLINJMBRJP-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[C@@H]([NH3+])C3)c1[N+](=O)[O-]	ZINC000372497087	418877979	/nfs/dbraw/zinc/87/79/79/418877979.db2.gz	OLBHUZGBJYGCOS-ILWJIGKKSA-N	1	1	307.354	1.365	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)NC[C@@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000411476552	418908005	/nfs/dbraw/zinc/90/80/05/418908005.db2.gz	BXFANZRKSKCEJC-NEPJUHHUSA-N	1	1	307.350	1.541	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](C3CCCC3)C2)c1	ZINC000420966306	419387506	/nfs/dbraw/zinc/38/75/06/419387506.db2.gz	VBLOFDOAZGSXIY-DZGCQCFKSA-N	1	1	308.382	1.664	20	5		DDBDMO
Nc1c([N+](=O)[O-])cnn1Cc1ccc(C[NH+]2CCOCC2)cc1	ZINC000421220921	419529670	/nfs/dbraw/zinc/52/96/70/419529670.db2.gz	XPIZWIIJJKANQP-UHFFFAOYSA-N	1	1	317.349	1.254	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000412079782	419632953	/nfs/dbraw/zinc/63/29/53/419632953.db2.gz	NATDXKPYNVKAED-UMVBOHGHSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000412038678	419583505	/nfs/dbraw/zinc/58/35/05/419583505.db2.gz	PCPCWBCBKNHKGC-YPMHNXCESA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCC1([NH3+])CCC1	ZINC000414884003	419859053	/nfs/dbraw/zinc/85/90/53/419859053.db2.gz	VKCCEXGZRCBIPG-NSHDSACASA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC1(N)CCC1	ZINC000414884003	419859060	/nfs/dbraw/zinc/85/90/60/419859060.db2.gz	VKCCEXGZRCBIPG-NSHDSACASA-N	1	1	306.366	1.783	20	5		DDBDMO
CC(C)c1ccc(C[NH2+]C[C@H]2CNCCN2C)cc1[N+](=O)[O-]	ZINC000414961083	419896769	/nfs/dbraw/zinc/89/67/69/419896769.db2.gz	IHJBWWSXLYMDSE-CQSZACIVSA-N	1	1	306.410	1.711	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000432249304	229090137	/nfs/dbraw/zinc/09/01/37/229090137.db2.gz	CUTUUKFJVVFKQQ-CHWSQXEVSA-N	1	1	321.377	1.833	20	5		DDBDMO
COCC[NH2+]CCN[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1	ZINC000423326011	420014048	/nfs/dbraw/zinc/01/40/48/420014048.db2.gz	IWSCJUDQULLFTD-STQMWFEESA-N	1	1	311.386	1.101	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000430928494	420210155	/nfs/dbraw/zinc/21/01/55/420210155.db2.gz	UFNYFSBWXSMQLC-ZDUSSCGKSA-N	1	1	320.393	1.773	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420585838	420324081	/nfs/dbraw/zinc/32/40/81/420324081.db2.gz	NFSGGRGPYRQTGY-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000425284895	420339739	/nfs/dbraw/zinc/33/97/39/420339739.db2.gz	WEGJGFQWBQJSKP-UHFFFAOYSA-N	1	1	312.345	1.676	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000439696543	420531324	/nfs/dbraw/zinc/53/13/24/420531324.db2.gz	NMXWLNXCBOGLMJ-CYBMUJFWSA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000451635537	420606627	/nfs/dbraw/zinc/60/66/27/420606627.db2.gz	RHUYMEFGDNFENO-WQAKAFBOSA-N	1	1	303.318	1.169	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-]	ZINC000457003921	420585609	/nfs/dbraw/zinc/58/56/09/420585609.db2.gz	XQWBSIAZQZOJSO-CYBMUJFWSA-N	1	1	314.345	1.720	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000453040661	420706584	/nfs/dbraw/zinc/70/65/84/420706584.db2.gz	UEDSLJPEGFNDMB-RNCFNFMXSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000453040661	420706587	/nfs/dbraw/zinc/70/65/87/420706587.db2.gz	UEDSLJPEGFNDMB-RNCFNFMXSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000453040661	420706590	/nfs/dbraw/zinc/70/65/90/420706590.db2.gz	UEDSLJPEGFNDMB-RNCFNFMXSA-N	1	1	315.333	1.247	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@@H](C3CC3)[C@H]2C2CC2)c1	ZINC000453046876	420708193	/nfs/dbraw/zinc/70/81/93/420708193.db2.gz	YRHOZWOCLGIWTF-QLFBSQMISA-N	1	1	306.366	1.273	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)C(=O)OC(C)(C)C	ZINC000459810182	420879670	/nfs/dbraw/zinc/87/96/70/420879670.db2.gz	PZORAKJDBIUKFV-NSHDSACASA-N	1	1	312.370	1.701	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455625956	421046174	/nfs/dbraw/zinc/04/61/74/421046174.db2.gz	OOSWVTIMYLNURX-NSHDSACASA-N	1	1	321.381	1.636	20	5		DDBDMO
C[C@H]1CN(c2ncnc3cccc([N+](=O)[O-])c32)CC[N@H+]1CCO	ZINC000490064923	421187893	/nfs/dbraw/zinc/18/78/93/421187893.db2.gz	VHUPFYGVTHPDDS-NSHDSACASA-N	1	1	317.349	1.041	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2CCC[N@@H+]2CCCO)c(Cl)c1	ZINC000450599219	421215005	/nfs/dbraw/zinc/21/50/05/421215005.db2.gz	SEFCRZFVKLZQAE-SNVBAGLBSA-N	1	1	314.773	1.902	20	5		DDBDMO
COc1c(C(=O)NCC[N@H+]2CC[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000527248557	421371502	/nfs/dbraw/zinc/37/15/02/421371502.db2.gz	GPNDXDPCZCXVDW-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C(C)(C)C)CC1	ZINC000548491785	421444587	/nfs/dbraw/zinc/44/45/87/421444587.db2.gz	LYWICEBXIJZXOA-UHFFFAOYSA-N	1	1	309.370	1.275	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000516225691	421534258	/nfs/dbraw/zinc/53/42/58/421534258.db2.gz	ATCQPMDXXIVKGQ-TZMCWYRMSA-N	1	1	321.377	1.535	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000554868331	421664156	/nfs/dbraw/zinc/66/41/56/421664156.db2.gz	FBHGZEISKJLLHI-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C(C)(C)C1	ZINC000556734267	421729817	/nfs/dbraw/zinc/72/98/17/421729817.db2.gz	ORMVHMDSRMLZOX-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C(C)(C)C1	ZINC000556734267	421729819	/nfs/dbraw/zinc/72/98/19/421729819.db2.gz	ORMVHMDSRMLZOX-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
NC(=O)c1cccc(NC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000557520147	421774043	/nfs/dbraw/zinc/77/40/43/421774043.db2.gz	WBQWURCPHWKIKJ-JTQLQIEISA-N	1	1	304.350	1.590	20	5		DDBDMO
O=C1C[C@H]([N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960201	421874505	/nfs/dbraw/zinc/87/45/05/421874505.db2.gz	HCNHCLOGAZDERY-YPMHNXCESA-N	1	1	303.318	1.189	20	5		DDBDMO
O=C1C[C@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960201	421874508	/nfs/dbraw/zinc/87/45/08/421874508.db2.gz	HCNHCLOGAZDERY-YPMHNXCESA-N	1	1	303.318	1.189	20	5		DDBDMO
Cc1nnsc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000583937287	422221389	/nfs/dbraw/zinc/22/13/89/422221389.db2.gz	HWGSOSHCZQHZRC-JTQLQIEISA-N	1	1	320.378	1.836	20	5		DDBDMO
Cc1nnsc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000583937287	422221395	/nfs/dbraw/zinc/22/13/95/422221395.db2.gz	HWGSOSHCZQHZRC-JTQLQIEISA-N	1	1	320.378	1.836	20	5		DDBDMO
C[C@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+](C2CC2)C1	ZINC000575873021	422340546	/nfs/dbraw/zinc/34/05/46/422340546.db2.gz	PJNPGKWQCVAWOG-LLVKDONJSA-N	1	1	316.365	1.558	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000345307573	272214542	/nfs/dbraw/zinc/21/45/42/272214542.db2.gz	WZBOILMMRLHXGD-NXEZZACHSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2C)C[C@@H]1C	ZINC000345924847	272367062	/nfs/dbraw/zinc/36/70/62/272367062.db2.gz	SAIMDUFOGUAZRS-QWRGUYRKSA-N	1	1	306.366	1.853	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269361859	276379476	/nfs/dbraw/zinc/37/94/76/276379476.db2.gz	JSOQEFDHECGJFL-JTQLQIEISA-N	1	1	309.370	1.655	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@H]2C1	ZINC000296854740	277180771	/nfs/dbraw/zinc/18/07/71/277180771.db2.gz	UMCMRHATTRNQIO-UONOGXRCSA-N	1	1	317.349	1.380	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000294023919	278001105	/nfs/dbraw/zinc/00/11/05/278001105.db2.gz	ZHOYELSPTFWFJZ-HNNXBMFYSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000294023919	278001106	/nfs/dbraw/zinc/00/11/06/278001106.db2.gz	ZHOYELSPTFWFJZ-HNNXBMFYSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000294023919	278001108	/nfs/dbraw/zinc/00/11/08/278001108.db2.gz	ZHOYELSPTFWFJZ-HNNXBMFYSA-N	1	1	321.381	1.609	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1	ZINC000492687745	279564693	/nfs/dbraw/zinc/56/46/93/279564693.db2.gz	HNODVCDYVHVARO-SZZPACECSA-N	1	1	319.361	1.133	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(CO)o3)C2)nc1	ZINC000093534483	281042873	/nfs/dbraw/zinc/04/28/73/281042873.db2.gz	NAVCLDYHJCGNIY-LLVKDONJSA-N	1	1	318.333	1.762	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1CO	ZINC000362100562	300005396	/nfs/dbraw/zinc/00/53/96/300005396.db2.gz	XSZMJBSKTGDBPE-JQWIXIFHSA-N	1	1	318.333	1.705	20	5		DDBDMO
COCCC[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000362886662	300170693	/nfs/dbraw/zinc/17/06/93/300170693.db2.gz	XQDAKOFMJQFGHL-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295551	300246480	/nfs/dbraw/zinc/24/64/80/300246480.db2.gz	HVUGFFZWCLUJPT-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2CCCCC2)CC1	ZINC000363295551	300246481	/nfs/dbraw/zinc/24/64/81/300246481.db2.gz	HVUGFFZWCLUJPT-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295551	300246483	/nfs/dbraw/zinc/24/64/83/300246483.db2.gz	HVUGFFZWCLUJPT-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
Cc1noc([C@H]2CCC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n1	ZINC000363322228	300251106	/nfs/dbraw/zinc/25/11/06/300251106.db2.gz	BLYKQXZWTXRHTO-JTQLQIEISA-N	1	1	306.326	1.399	20	5		DDBDMO
Cc1noc([C@H]2CCC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n1	ZINC000363322228	300251108	/nfs/dbraw/zinc/25/11/08/300251108.db2.gz	BLYKQXZWTXRHTO-JTQLQIEISA-N	1	1	306.326	1.399	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000363651024	300293057	/nfs/dbraw/zinc/29/30/57/300293057.db2.gz	JNNXLBTWHYODGB-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1c(CN2CC[NH+]([C@H]3CCOC3)CC2)cccc1[N+](=O)[O-]	ZINC000366510592	300708379	/nfs/dbraw/zinc/70/83/79/300708379.db2.gz	HCBBNGFVXDQOSM-HNNXBMFYSA-N	1	1	305.378	1.810	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000368475526	301036310	/nfs/dbraw/zinc/03/63/10/301036310.db2.gz	TZCFCMGTRVHHPH-HNNXBMFYSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000368475526	301036313	/nfs/dbraw/zinc/03/63/13/301036313.db2.gz	TZCFCMGTRVHHPH-HNNXBMFYSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@@]3(CNC(=O)O3)C2)cccc1[N+](=O)[O-]	ZINC000369042767	301124174	/nfs/dbraw/zinc/12/41/74/301124174.db2.gz	WSUPQJVPPUYABO-OAHLLOKOSA-N	1	1	305.334	1.978	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@@]3(CNC(=O)O3)C2)cccc1[N+](=O)[O-]	ZINC000369042767	301124177	/nfs/dbraw/zinc/12/41/77/301124177.db2.gz	WSUPQJVPPUYABO-OAHLLOKOSA-N	1	1	305.334	1.978	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000369998239	301255050	/nfs/dbraw/zinc/25/50/50/301255050.db2.gz	QRCPFOHZFWNPPX-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000369998239	301255053	/nfs/dbraw/zinc/25/50/53/301255053.db2.gz	QRCPFOHZFWNPPX-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000369998239	301255056	/nfs/dbraw/zinc/25/50/56/301255056.db2.gz	QRCPFOHZFWNPPX-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@H]12	ZINC000377673040	302209187	/nfs/dbraw/zinc/20/91/87/302209187.db2.gz	RLMNOGOHGSYJAW-FZMZJTMJSA-N	1	1	305.334	1.042	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCC[C@H](C)C1	ZINC000532134265	303276259	/nfs/dbraw/zinc/27/62/59/303276259.db2.gz	VLVVJCLGMXDMNM-NWDGAFQWSA-N	1	1	306.366	1.840	20	5		DDBDMO
CCc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000554877962	303709358	/nfs/dbraw/zinc/70/93/58/303709358.db2.gz	SYTUSGMJDVGQTP-SNVBAGLBSA-N	1	1	318.337	1.382	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]12	ZINC000366325108	307070915	/nfs/dbraw/zinc/07/09/15/307070915.db2.gz	JEPKZPDASJPCHW-QWRGUYRKSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]12	ZINC000366325108	307070916	/nfs/dbraw/zinc/07/09/16/307070916.db2.gz	JEPKZPDASJPCHW-QWRGUYRKSA-N	1	1	323.736	1.343	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](O)C3(CC3)C2)c([N+](=O)[O-])cc1OC	ZINC000375300178	307221018	/nfs/dbraw/zinc/22/10/18/307221018.db2.gz	WJNYTUPGWDIQGA-AWEZNQCLSA-N	1	1	308.334	1.569	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](O)C3(CC3)C2)c([N+](=O)[O-])cc1OC	ZINC000375300178	307221019	/nfs/dbraw/zinc/22/10/19/307221019.db2.gz	WJNYTUPGWDIQGA-AWEZNQCLSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000421021016	307300515	/nfs/dbraw/zinc/30/05/15/307300515.db2.gz	NVWXYBAYCGTULF-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000577527459	308396211	/nfs/dbraw/zinc/39/62/11/308396211.db2.gz	BQNZZJUMCFAWLB-UHFFFAOYSA-N	1	1	306.366	1.871	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3cccnc3)C2)c1	ZINC000582724550	337125552	/nfs/dbraw/zinc/12/55/52/337125552.db2.gz	ZVZXYFQCZZVFDK-ZFWWWQNUSA-N	1	1	317.349	1.037	20	5		DDBDMO
CC(C)NC(=O)NCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000584587848	337370088	/nfs/dbraw/zinc/37/00/88/337370088.db2.gz	GKBZXZUEXJBTNX-UHFFFAOYSA-N	1	1	308.382	1.777	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](c3nnc[nH]3)C2)cc1	ZINC000374528170	483938800	/nfs/dbraw/zinc/93/88/00/483938800.db2.gz	ATYTZKUHILKRFL-LBPRGKRZSA-N	1	1	317.349	1.971	20	5		DDBDMO
COc1cc(C[NH2+][C@@H](CO)c2cnn(C)c2)ccc1[N+](=O)[O-]	ZINC000494808284	533893048	/nfs/dbraw/zinc/89/30/48/533893048.db2.gz	JFMONQDDOCKZOH-LBPRGKRZSA-N	1	1	306.322	1.160	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000452055515	534189650	/nfs/dbraw/zinc/18/96/50/534189650.db2.gz	UMDLCUOOHJWRKQ-XHXGSEDSSA-N	1	1	320.393	1.520	20	5		DDBDMO
CC[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(=O)OC	ZINC000299352607	528400799	/nfs/dbraw/zinc/40/07/99/528400799.db2.gz	RWKOBXFCABEBCA-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(=O)OC	ZINC000299352607	528400801	/nfs/dbraw/zinc/40/08/01/528400801.db2.gz	RWKOBXFCABEBCA-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000451253358	529338671	/nfs/dbraw/zinc/33/86/71/529338671.db2.gz	JNZSTJUTPAXASJ-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CCC1)C2	ZINC000981763844	696906596	/nfs/dbraw/zinc/90/65/96/696906596.db2.gz	LXLHHDPJEQVXHB-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CC1CCC1)C2	ZINC000981763844	696906599	/nfs/dbraw/zinc/90/65/99/696906599.db2.gz	LXLHHDPJEQVXHB-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CCC1)C2	ZINC000981763844	696906603	/nfs/dbraw/zinc/90/66/03/696906603.db2.gz	LXLHHDPJEQVXHB-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])OCCC[NH+]1CCOCC1	ZINC000748492531	700121628	/nfs/dbraw/zinc/12/16/28/700121628.db2.gz	RCPGTIBFIBZWSV-UHFFFAOYSA-N	1	1	324.333	1.239	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)OCCC[NH+]1CCOCC1	ZINC000748499267	700122411	/nfs/dbraw/zinc/12/24/11/700122411.db2.gz	WOYKHVMVFPWEFP-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
C[N@@H+](Cc1ccns1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985426214	697509004	/nfs/dbraw/zinc/50/90/04/697509004.db2.gz	NINOXHGYOOWQGG-CHWSQXEVSA-N	1	1	324.406	1.231	20	5		DDBDMO
C[N@H+](Cc1ccns1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985426214	697509006	/nfs/dbraw/zinc/50/90/06/697509006.db2.gz	NINOXHGYOOWQGG-CHWSQXEVSA-N	1	1	324.406	1.231	20	5		DDBDMO
C[N@@H+](Cc1ccns1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985426214	697509008	/nfs/dbraw/zinc/50/90/08/697509008.db2.gz	NINOXHGYOOWQGG-CHWSQXEVSA-N	1	1	324.406	1.231	20	5		DDBDMO
C[N@@H+](Cc1cncs1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985427200	697509285	/nfs/dbraw/zinc/50/92/85/697509285.db2.gz	XTCQFMDWEQYFNO-CHWSQXEVSA-N	1	1	324.406	1.231	20	5		DDBDMO
C[N@H+](Cc1cncs1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985427200	697509286	/nfs/dbraw/zinc/50/92/86/697509286.db2.gz	XTCQFMDWEQYFNO-CHWSQXEVSA-N	1	1	324.406	1.231	20	5		DDBDMO
C[N@@H+](Cc1cncs1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985427200	697509287	/nfs/dbraw/zinc/50/92/87/697509287.db2.gz	XTCQFMDWEQYFNO-CHWSQXEVSA-N	1	1	324.406	1.231	20	5		DDBDMO
C[C@H]1C[NH2+]CCN1S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000193359466	697661915	/nfs/dbraw/zinc/66/19/15/697661915.db2.gz	WVCUYSLZFNSUOU-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749953537	700194350	/nfs/dbraw/zinc/19/43/50/700194350.db2.gz	NSGWZSLPCRKACA-GFCCVEGCSA-N	1	1	319.365	1.964	20	5		DDBDMO
CCOC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776271804	698090314	/nfs/dbraw/zinc/09/03/14/698090314.db2.gz	HKHOOXMNMGWFGO-DZGCQCFKSA-N	1	1	322.361	1.903	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H]3C[C@@]3(CO)C2)cccc1[N+](=O)[O-]	ZINC000782603122	698747921	/nfs/dbraw/zinc/74/79/21/698747921.db2.gz	GBONWZYDSFKGSG-WBMJQRKESA-N	1	1	319.361	1.546	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3C[C@]3(CO)C2)c2c(c1)COCO2	ZINC000782607982	698748961	/nfs/dbraw/zinc/74/89/61/698748961.db2.gz	XCDXNHDBDPSXIH-SWLSCSKDSA-N	1	1	306.318	1.276	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3C[C@]3(CO)C2)c2c(c1)COCO2	ZINC000782607982	698748964	/nfs/dbraw/zinc/74/89/64/698748964.db2.gz	XCDXNHDBDPSXIH-SWLSCSKDSA-N	1	1	306.318	1.276	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N)cc[nH+]1	ZINC000787112941	699191056	/nfs/dbraw/zinc/19/10/56/699191056.db2.gz	BKFSWRAMRITIEW-UHFFFAOYSA-N	1	1	301.306	1.890	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]1C	ZINC000787247955	699200015	/nfs/dbraw/zinc/20/00/15/699200015.db2.gz	VTIRFWYJRVRZCZ-GXFFZTMASA-N	1	1	318.333	1.785	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]1C	ZINC000787247955	699200016	/nfs/dbraw/zinc/20/00/16/699200016.db2.gz	VTIRFWYJRVRZCZ-GXFFZTMASA-N	1	1	318.333	1.785	20	5		DDBDMO
COCC[NH+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1	ZINC000731208477	699524278	/nfs/dbraw/zinc/52/42/78/699524278.db2.gz	HMINZQAOVJZYST-UHFFFAOYSA-N	1	1	322.390	1.973	20	5		DDBDMO
C[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CCC1	ZINC000742172571	699863043	/nfs/dbraw/zinc/86/30/43/699863043.db2.gz	FTCJYTZNASSLEZ-UHFFFAOYSA-N	1	1	318.333	1.805	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000744401438	699948155	/nfs/dbraw/zinc/94/81/55/699948155.db2.gz	VPQGVHNONUYKSV-UHFFFAOYSA-N	1	1	305.338	1.683	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](C(F)(F)F)C2)c1	ZINC000761056552	700837639	/nfs/dbraw/zinc/83/76/39/700837639.db2.gz	YADKAXYKHMQBIA-WPRPVWTQSA-N	1	1	308.260	1.036	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O	ZINC000768770140	701201163	/nfs/dbraw/zinc/20/11/63/701201163.db2.gz	SEHCUZDMDSHCMF-PRHODGIISA-N	1	1	313.741	1.499	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O	ZINC000768770140	701201166	/nfs/dbraw/zinc/20/11/66/701201166.db2.gz	SEHCUZDMDSHCMF-PRHODGIISA-N	1	1	313.741	1.499	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(C)c1[N+](=O)[O-]	ZINC000840118326	701977757	/nfs/dbraw/zinc/97/77/57/701977757.db2.gz	DBDZOADAHRXHMU-MJBXVCDLSA-N	1	1	308.382	1.991	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC000866204652	706648047	/nfs/dbraw/zinc/64/80/47/706648047.db2.gz	FMUURESLXBONGC-RISCZKNCSA-N	1	1	318.377	1.485	20	5		DDBDMO
C[C@H]([NH3+])[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843365769	702867245	/nfs/dbraw/zinc/86/72/45/702867245.db2.gz	RPCIXLZEMSHCPG-WDEREUQCSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[N@H+]1CC[C@H](CCOC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000847823443	703472807	/nfs/dbraw/zinc/47/28/07/703472807.db2.gz	FFSYFYXGXQIOSY-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
CN(CC1CCOCC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870911535	704165742	/nfs/dbraw/zinc/16/57/42/704165742.db2.gz	JSXOFHZLBXLCHS-MRXNPFEDSA-N	1	1	321.377	1.654	20	5		DDBDMO
C[N@H+](C[C@@H]1COCCO1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000853559930	704270363	/nfs/dbraw/zinc/27/03/63/704270363.db2.gz	QDGWPCKMCWBILX-CYBMUJFWSA-N	1	1	306.322	1.249	20	5		DDBDMO
C[N@@H+](C[C@@H]1COCCO1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000853559930	704270365	/nfs/dbraw/zinc/27/03/65/704270365.db2.gz	QDGWPCKMCWBILX-CYBMUJFWSA-N	1	1	306.322	1.249	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@H]4COC[C@H]4C3)c2c1	ZINC000853585906	704275944	/nfs/dbraw/zinc/27/59/44/704275944.db2.gz	KVEJXANPJLIGQZ-QWHCGFSZSA-N	1	1	302.334	1.870	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1	ZINC000853586437	704276538	/nfs/dbraw/zinc/27/65/38/704276538.db2.gz	RMQXRUCMLFGDFL-AAEUAGOBSA-N	1	1	302.334	1.870	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000855284599	704477247	/nfs/dbraw/zinc/47/72/47/704477247.db2.gz	WDBKTWSLNQZIFM-GXTWGEPZSA-N	1	1	321.377	1.617	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[N@@H+]1C	ZINC000867188238	706918765	/nfs/dbraw/zinc/91/87/65/706918765.db2.gz	WEFPIJJBOZJQGQ-MNOVXSKESA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@H]([NH2+][C@@H](CO)c1ccnn1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000858435832	704710926	/nfs/dbraw/zinc/71/09/26/704710926.db2.gz	UXTFIGKDAYFTIT-CABZTGNLSA-N	1	1	305.338	1.295	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@H+](CCO)[C@@H](C)C1	ZINC000822155885	704887057	/nfs/dbraw/zinc/88/70/57/704887057.db2.gz	QTZTVJUIXNXBFT-LBPRGKRZSA-N	1	1	321.377	1.350	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000822155885	704887063	/nfs/dbraw/zinc/88/70/63/704887063.db2.gz	QTZTVJUIXNXBFT-LBPRGKRZSA-N	1	1	321.377	1.350	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839962	705195544	/nfs/dbraw/zinc/19/55/44/705195544.db2.gz	YOHLHBPDTOZNQS-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874839962	705195545	/nfs/dbraw/zinc/19/55/45/705195545.db2.gz	YOHLHBPDTOZNQS-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839962	705195548	/nfs/dbraw/zinc/19/55/48/705195548.db2.gz	YOHLHBPDTOZNQS-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000874850727	705203455	/nfs/dbraw/zinc/20/34/55/705203455.db2.gz	WFPULLZBCUORJU-HUUCEWRRSA-N	1	1	303.362	1.832	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000826757503	705866591	/nfs/dbraw/zinc/86/65/91/705866591.db2.gz	DKJNGCUYPKALHN-AWEZNQCLSA-N	1	1	309.366	1.476	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC000827269758	705965197	/nfs/dbraw/zinc/96/51/97/705965197.db2.gz	ZUSKEJGTJNQOAH-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@H]21	ZINC000827278211	705967168	/nfs/dbraw/zinc/96/71/68/705967168.db2.gz	VDUYPHRLGNACGD-QMTHXVAHSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1ccc(C[NH2+]C2(CO)COC(C)(C)OC2)cc1[N+](=O)[O-]	ZINC000878517933	706413866	/nfs/dbraw/zinc/41/38/66/706413866.db2.gz	QHVUBCYFVHTYAB-UHFFFAOYSA-N	1	1	310.350	1.507	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])CCC1(C)C	ZINC000879072098	706580031	/nfs/dbraw/zinc/58/00/31/706580031.db2.gz	QUBWUGNUCQGHLG-UHFFFAOYSA-N	1	1	307.354	1.360	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880134676	706887210	/nfs/dbraw/zinc/88/72/10/706887210.db2.gz	OIYAJPRLQNJLJW-LSDHHAIUSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000872778977	707596567	/nfs/dbraw/zinc/59/65/67/707596567.db2.gz	BWLWHGHHTQWBSK-RYUDHWBXSA-N	1	1	304.350	1.367	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)CC[C@@H]1CCCC[N@@H+]1C	ZINC000873396538	707836388	/nfs/dbraw/zinc/83/63/88/707836388.db2.gz	RJQCBSJONUWVPF-ZDUSSCGKSA-N	1	1	324.381	1.907	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897220809	708258662	/nfs/dbraw/zinc/25/86/62/708258662.db2.gz	DKFGEXUUIIZGCJ-HOTGVXAUSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202725	708714214	/nfs/dbraw/zinc/71/42/14/708714214.db2.gz	CKGMAGXJXYAMCP-TZMCWYRMSA-N	1	1	306.366	1.285	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202725	708714215	/nfs/dbraw/zinc/71/42/15/708714215.db2.gz	CKGMAGXJXYAMCP-TZMCWYRMSA-N	1	1	306.366	1.285	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331563	710012452	/nfs/dbraw/zinc/01/24/52/710012452.db2.gz	XTCOLYBPDLLWJQ-ZIBATOQPSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331563	710012454	/nfs/dbraw/zinc/01/24/54/710012454.db2.gz	XTCOLYBPDLLWJQ-ZIBATOQPSA-N	1	1	307.350	1.227	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000913289232	713192408	/nfs/dbraw/zinc/19/24/08/713192408.db2.gz	KJYHKQKYNAOAOR-OKILXGFUSA-N	1	1	307.354	1.040	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000913289232	713192410	/nfs/dbraw/zinc/19/24/10/713192410.db2.gz	KJYHKQKYNAOAOR-OKILXGFUSA-N	1	1	307.354	1.040	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000913289232	713192412	/nfs/dbraw/zinc/19/24/12/713192412.db2.gz	KJYHKQKYNAOAOR-OKILXGFUSA-N	1	1	307.354	1.040	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928441881	713197518	/nfs/dbraw/zinc/19/75/18/713197518.db2.gz	PTMZBRMUWIOEHC-HZMBPMFUSA-N	1	1	316.361	1.827	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H]([C@@H](C)O)C2)c1[N+](=O)[O-]	ZINC000893418026	710644785	/nfs/dbraw/zinc/64/47/85/710644785.db2.gz	NZBVVBPIHICVAZ-MNOVXSKESA-N	1	1	310.350	1.902	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1C	ZINC000928444036	713198269	/nfs/dbraw/zinc/19/82/69/713198269.db2.gz	IJXRACWCVXEBRK-SKDRFNHKSA-N	1	1	311.313	1.322	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CC3(C2)CCOCC3)c1[N+](=O)[O-]	ZINC000894829878	711288733	/nfs/dbraw/zinc/28/87/33/711288733.db2.gz	GZBAMAPFVROWCU-UHFFFAOYSA-N	1	1	308.334	1.921	20	5		DDBDMO
CCN(OC)C(=O)C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000895116634	711421002	/nfs/dbraw/zinc/42/10/02/711421002.db2.gz	ZMCYNECDMUELLL-UHFFFAOYSA-N	1	1	301.730	1.748	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)[C@H](CO)C1	ZINC000913546381	713252777	/nfs/dbraw/zinc/25/27/77/713252777.db2.gz	OMRCSBCYJJPTKK-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)[C@H](CO)C1	ZINC000913546381	713252778	/nfs/dbraw/zinc/25/27/78/713252778.db2.gz	OMRCSBCYJJPTKK-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000895246342	711464098	/nfs/dbraw/zinc/46/40/98/711464098.db2.gz	NBFHJVGEASGMPJ-ZYHUDNBSSA-N	1	1	310.402	1.166	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2C[C@@H](O)CC(C)(C)C2)c1[N+](=O)[O-]	ZINC000895847776	711623967	/nfs/dbraw/zinc/62/39/67/711623967.db2.gz	FCPWEMFMAVFDNS-NSHDSACASA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H](O)CC(C)(C)C2)c1[N+](=O)[O-]	ZINC000895847776	711623969	/nfs/dbraw/zinc/62/39/69/711623969.db2.gz	FCPWEMFMAVFDNS-NSHDSACASA-N	1	1	310.350	1.902	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC000896524082	711738219	/nfs/dbraw/zinc/73/82/19/711738219.db2.gz	SBXALVRCMHCOEE-ZDUSSCGKSA-N	1	1	323.397	1.785	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000896580800	711758259	/nfs/dbraw/zinc/75/82/59/711758259.db2.gz	IYKJTLDPURECNG-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
CC(=O)N1CC[NH+](Cc2ccc(NCC[N+](=O)[O-])cc2)CC1	ZINC000905330738	712004305	/nfs/dbraw/zinc/00/43/05/712004305.db2.gz	QAUQFEXGHRIVOL-UHFFFAOYSA-N	1	1	306.366	1.039	20	5		DDBDMO
Cc1ccc(CNC(=O)C[C@]2(O)CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000913754688	713295793	/nfs/dbraw/zinc/29/57/93/713295793.db2.gz	VBTMVXDEMMVSLV-MRXNPFEDSA-N	1	1	321.377	1.366	20	5		DDBDMO
CCOCCOCC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000929269482	713579470	/nfs/dbraw/zinc/57/94/70/713579470.db2.gz	KVUNGLNTGUOLNZ-UHFFFAOYSA-N	1	1	323.393	1.770	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000929626565	713654228	/nfs/dbraw/zinc/65/42/28/713654228.db2.gz	ANRDCQWHCDNRBZ-NSHDSACASA-N	1	1	322.283	1.654	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000929626565	713654230	/nfs/dbraw/zinc/65/42/30/713654230.db2.gz	ANRDCQWHCDNRBZ-NSHDSACASA-N	1	1	322.283	1.654	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931394611	714083218	/nfs/dbraw/zinc/08/32/18/714083218.db2.gz	AZJYKILZQVCRPC-TXEJJXNPSA-N	1	1	304.350	1.312	20	5		DDBDMO
C[NH+](C)CC1(O)CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000931482655	714108092	/nfs/dbraw/zinc/10/80/92/714108092.db2.gz	KSPGEEAZOCOTMV-OAHLLOKOSA-N	1	1	323.393	1.017	20	5		DDBDMO
C[NH+](C)CC1(O)CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000931482654	714108240	/nfs/dbraw/zinc/10/82/40/714108240.db2.gz	KSPGEEAZOCOTMV-HNNXBMFYSA-N	1	1	323.393	1.017	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)N2CCn3cc[nH+]c32)cccc1[N+](=O)[O-]	ZINC000931523421	714118710	/nfs/dbraw/zinc/11/87/10/714118710.db2.gz	SLRARXUAFHOHKH-LLVKDONJSA-N	1	1	315.333	1.947	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000923303541	714304158	/nfs/dbraw/zinc/30/41/58/714304158.db2.gz	GBYHULZIYXSASS-GXTWGEPZSA-N	1	1	319.361	1.669	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1C[C@@H](O)C[N@@H+]1C	ZINC000924990244	714718261	/nfs/dbraw/zinc/71/82/61/714718261.db2.gz	UYVVSLXYMFQWSO-CHWSQXEVSA-N	1	1	321.377	1.315	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934272220	714783318	/nfs/dbraw/zinc/78/33/18/714783318.db2.gz	IISXQMYKXHFQDK-HUUCEWRRSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)n1	ZINC000934838778	714914130	/nfs/dbraw/zinc/91/41/30/714914130.db2.gz	OZFOKYWGXRIRGD-UONOGXRCSA-N	1	1	308.382	1.930	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H]1CCC[N@H+](C(C)C)C1	ZINC000935431359	715053630	/nfs/dbraw/zinc/05/36/30/715053630.db2.gz	ZTUHQBPIXHXYKB-LBPRGKRZSA-N	1	1	309.370	1.089	20	5		DDBDMO
C[C@@H]1CN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])[C@@H](C)C[N@@H+]1C	ZINC001164638882	719216505	/nfs/dbraw/zinc/21/65/05/719216505.db2.gz	PSXUZRQZNFFMPY-BDAKNGLRSA-N	1	1	300.746	1.410	20	5		DDBDMO
C[C@@H]1CN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])[C@@H](C)C[N@H+]1C	ZINC001164638882	719216508	/nfs/dbraw/zinc/21/65/08/719216508.db2.gz	PSXUZRQZNFFMPY-BDAKNGLRSA-N	1	1	300.746	1.410	20	5		DDBDMO
Cc1ccnc(N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928551	721854172	/nfs/dbraw/zinc/85/41/72/721854172.db2.gz	OFDFHGNKIGDNSP-UONOGXRCSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1ccnc(N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928551	721854173	/nfs/dbraw/zinc/85/41/73/721854173.db2.gz	OFDFHGNKIGDNSP-UONOGXRCSA-N	1	1	319.409	1.513	20	5		DDBDMO
CN(C)c1cc(NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)cc[nH+]1	ZINC001137170438	749376947	/nfs/dbraw/zinc/37/69/47/749376947.db2.gz	RAEZNGSVAIUNOU-CQSZACIVSA-N	1	1	316.317	1.728	20	5		DDBDMO
C[N@@H+](CCNC(=O)OC(C)(C)C)[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169006729	762174804	/nfs/dbraw/zinc/17/48/04/762174804.db2.gz	JFUJKXQMEJKKLJ-RYUDHWBXSA-N	1	1	301.387	1.888	20	5		DDBDMO
O=C(c1cccs1)N1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169039581	762193441	/nfs/dbraw/zinc/19/34/41/762193441.db2.gz	RCRAUJOLVYRIKH-CHWSQXEVSA-N	1	1	323.418	1.951	20	5		DDBDMO
CCN1CC[C@@]2(C[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2C)C1=O	ZINC001169025838	762203218	/nfs/dbraw/zinc/20/32/18/762203218.db2.gz	ZGHNKMYSVBISMA-YXWQFLTLSA-N	1	1	309.410	1.622	20	5		DDBDMO
COc1ccc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054467	762210298	/nfs/dbraw/zinc/21/02/98/762210298.db2.gz	MEGADDRCOXJBCA-GZBFAFLISA-N	1	1	321.377	1.989	20	5		DDBDMO
CC(C)[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])c(F)c1	ZINC001001522564	754376522	/nfs/dbraw/zinc/37/65/22/754376522.db2.gz	FOQPQVZMAILBRA-TZMCWYRMSA-N	1	1	309.341	1.605	20	5		DDBDMO
CCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)C(=O)OCC	ZINC001169932940	762758347	/nfs/dbraw/zinc/75/83/47/762758347.db2.gz	FCXYPSVNZZUORZ-LLVKDONJSA-N	1	1	312.370	1.763	20	5		DDBDMO
CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)C(=O)OCC	ZINC001169932940	762758349	/nfs/dbraw/zinc/75/83/49/762758349.db2.gz	FCXYPSVNZZUORZ-LLVKDONJSA-N	1	1	312.370	1.763	20	5		DDBDMO
CC(C)=CC[NH+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001050517661	763694229	/nfs/dbraw/zinc/69/42/29/763694229.db2.gz	ZSVORLVRSMQGJC-ZIAGYGMSSA-N	1	1	307.394	1.542	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1cc([N+](=O)[O-])cc2cc[nH]c21	ZINC001170340099	766273835	/nfs/dbraw/zinc/27/38/35/766273835.db2.gz	SFELVYGWHWZSBT-UHFFFAOYSA-N	1	1	301.306	1.777	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001097056879	771610798	/nfs/dbraw/zinc/61/07/98/771610798.db2.gz	NNGQLYHUSTYPQI-HDJSIYSDSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001136325776	771937920	/nfs/dbraw/zinc/93/79/20/771937920.db2.gz	IPUSOESMQJDWTD-JTQLQIEISA-N	1	1	317.349	1.748	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCC[NH2+]Cc1ccccc1[N+](=O)[O-]	ZINC001148571121	773528004	/nfs/dbraw/zinc/52/80/04/773528004.db2.gz	WWYSQOLHFXLRKH-UHFFFAOYSA-N	1	1	322.409	1.533	20	5		DDBDMO
CCC[N@H+](C)CCC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001148571121	773528007	/nfs/dbraw/zinc/52/80/07/773528007.db2.gz	WWYSQOLHFXLRKH-UHFFFAOYSA-N	1	1	322.409	1.533	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001148571121	773528012	/nfs/dbraw/zinc/52/80/12/773528012.db2.gz	WWYSQOLHFXLRKH-UHFFFAOYSA-N	1	1	322.409	1.533	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001093642105	774940789	/nfs/dbraw/zinc/94/07/89/774940789.db2.gz	KXOXNVOMBSXLIT-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1F)C1CCC1	ZINC001094221789	775543407	/nfs/dbraw/zinc/54/34/07/775543407.db2.gz	QZZJNCIRDCMXES-UHFFFAOYSA-N	1	1	324.356	1.746	20	5		DDBDMO
C[C@@]1(O)COCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1	ZINC001172906392	776916744	/nfs/dbraw/zinc/91/67/44/776916744.db2.gz	XPBWHHXHGSSTGE-RDJZCZTQSA-N	1	1	320.389	1.925	20	5		DDBDMO
O=C(NCCCCCC[NH2+]C/C=C\Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001178450196	779034509	/nfs/dbraw/zinc/03/45/09/779034509.db2.gz	XBOKYXLXZLHLPF-GKKDLHFNSA-N	1	1	303.790	1.670	20	5		DDBDMO
CCOc1ccc(C(=O)NCC[NH+]2CC=CC2)cc1[N+](=O)[O-]	ZINC001116129482	780476821	/nfs/dbraw/zinc/47/68/21/780476821.db2.gz	YHUFUVXKSZTQOA-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1cccn1)Cc1ccc([N+](=O)[O-])cc1	ZINC001266255380	835994497	/nfs/dbraw/zinc/99/44/97/835994497.db2.gz	PUVORCGEQQCFDQ-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCc1c[nH+]c2n1CCC2	ZINC001154937617	861583791	/nfs/dbraw/zinc/58/37/91/861583791.db2.gz	SMNGTCYRXIGXGM-UHFFFAOYSA-N	1	1	300.318	1.976	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001302425865	846786753	/nfs/dbraw/zinc/78/67/53/846786753.db2.gz	SWOPVFVRPZXEAB-OAHLLOKOSA-N	1	1	318.333	1.124	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC001203067138	860699482	/nfs/dbraw/zinc/69/94/82/860699482.db2.gz	GTADFWIDBCUPKB-NSHDSACASA-N	1	1	321.381	1.714	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H](F)C1)NCCc1ccc([N+](=O)[O-])cc1	ZINC001142082213	861015375	/nfs/dbraw/zinc/01/53/75/861015375.db2.gz	BIRIVIFRWIMOSM-ZDUSSCGKSA-N	1	1	309.341	1.687	20	5		DDBDMO
CN1CCN(C(=[NH2+])Nc2ncnc3cccc([N+](=O)[O-])c32)CC1	ZINC001157916257	864259073	/nfs/dbraw/zinc/25/90/73/864259073.db2.gz	QIJCAYSUVFOVBM-UHFFFAOYSA-N	1	1	315.337	1.132	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+](C2CC2)C1	ZINC001330658556	864515842	/nfs/dbraw/zinc/51/58/42/864515842.db2.gz	DKZOSLDVXNCRPZ-LLVKDONJSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[N@@H+](C1CN(c2cc([N+](=O)[O-])c3cc[nH]c3n2)C1)[C@H]1CCOC1	ZINC001158736388	864872714	/nfs/dbraw/zinc/87/27/14/864872714.db2.gz	LILPKJVGWRYNDC-JTQLQIEISA-N	1	1	317.349	1.380	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1	ZINC001334111555	867304115	/nfs/dbraw/zinc/30/41/15/867304115.db2.gz	VQFUAHYIAXTKMY-NWDGAFQWSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1cn(C)nc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC001334889348	867885548	/nfs/dbraw/zinc/88/55/48/867885548.db2.gz	WJCARVQHMISRGL-UHFFFAOYSA-N	1	1	304.354	1.670	20	5		DDBDMO
CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1cc(N)c([N+](=O)[O-])cn1	ZINC001162875569	867891507	/nfs/dbraw/zinc/89/15/07/867891507.db2.gz	GYXFKHWRGIDVJS-ZDUSSCGKSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)(C)OC(=O)[C@H]([NH3+])C1CN(c2cc([N+](=O)[O-])ccn2)C1	ZINC001163117443	868115375	/nfs/dbraw/zinc/11/53/75/868115375.db2.gz	HACDMUKFKXQNOF-GFCCVEGCSA-N	1	1	308.338	1.095	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC3(CC2)CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC001335769868	868526271	/nfs/dbraw/zinc/52/62/71/868526271.db2.gz	DCKBRZYMSPQXKW-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
CCOc1nc(N2CC([N@@H+](C)[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-]	ZINC001165205166	869429369	/nfs/dbraw/zinc/42/93/69/869429369.db2.gz	DEPJQLUSCRCXQX-LLVKDONJSA-N	1	1	322.365	1.298	20	5		DDBDMO
Cn1c(C[N+](=O)[O-])nnc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC001339553462	870552428	/nfs/dbraw/zinc/55/24/28/870552428.db2.gz	OKRCWAWNDRWBSE-WCQYABFASA-N	1	1	320.397	1.045	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CCCC[N@H+](C)C2)n1	ZINC001300873788	870965156	/nfs/dbraw/zinc/96/51/56/870965156.db2.gz	NCZBGSBASOPRTO-GFCCVEGCSA-N	1	1	306.366	1.760	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)NCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC001341343883	871614963	/nfs/dbraw/zinc/61/49/63/871614963.db2.gz	JFYXXXOYBVLAAJ-CFVMTHIKSA-N	1	1	318.377	1.734	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CCOC)C1	ZINC001318598010	872162184	/nfs/dbraw/zinc/16/21/84/872162184.db2.gz	AUEOLIXDWKGMKM-LLVKDONJSA-N	1	1	322.365	1.087	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2[nH]c(=O)nc3ccc([N+](=O)[O-])cc32)C1	ZINC001227094967	882827535	/nfs/dbraw/zinc/82/75/35/882827535.db2.gz	GQSNKWOYKRIGEO-SNVBAGLBSA-N	1	1	304.306	1.717	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CNc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC001348747744	874758504	/nfs/dbraw/zinc/75/85/04/874758504.db2.gz	PBKDVQJZQYUTPO-AVGNSLFASA-N	1	1	318.377	1.463	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[N@@H+]3CCOC[C@@H]3C2)c2ccccc21	ZINC001350007589	875497480	/nfs/dbraw/zinc/49/74/80/875497480.db2.gz	LIKFMPRUFPERGB-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[N@H+]3CCOC[C@@H]3C2)c2ccccc21	ZINC001350007589	875497486	/nfs/dbraw/zinc/49/74/86/875497486.db2.gz	LIKFMPRUFPERGB-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[N@@H+]1C[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC001213935550	876107866	/nfs/dbraw/zinc/10/78/66/876107866.db2.gz	SBLMOOUACGUZHS-LBPRGKRZSA-N	1	1	313.379	1.213	20	5		DDBDMO
C[N@H+]1C[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC001213935550	876107887	/nfs/dbraw/zinc/10/78/87/876107887.db2.gz	SBLMOOUACGUZHS-LBPRGKRZSA-N	1	1	313.379	1.213	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1C2CCC1(CO)CC2	ZINC001351632189	876358468	/nfs/dbraw/zinc/35/84/68/876358468.db2.gz	KPCHCXNJWGZCSH-UYJPIKCFSA-N	1	1	322.361	1.324	20	5		DDBDMO
C[C@H](CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1)[NH+](C)C	ZINC001353298242	877238158	/nfs/dbraw/zinc/23/81/58/877238158.db2.gz	RVQGSUCOYOXWPT-OCCSQVGLSA-N	1	1	311.382	1.264	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC001353614368	877452490	/nfs/dbraw/zinc/45/24/90/877452490.db2.gz	YGOROHRDAAMNGG-UHFFFAOYSA-N	1	1	305.256	1.377	20	5		DDBDMO
COC(=O)c1cccc(COC[C@H]2C[N@H+](C)CCO2)c1[N+](=O)[O-]	ZINC001223663450	881049607	/nfs/dbraw/zinc/04/96/07/881049607.db2.gz	XIFFBRPJMFNWHA-GFCCVEGCSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cccc(COC[C@H]2C[N@@H+](C)CCO2)c1[N+](=O)[O-]	ZINC001223663450	881049624	/nfs/dbraw/zinc/04/96/24/881049624.db2.gz	XIFFBRPJMFNWHA-GFCCVEGCSA-N	1	1	324.333	1.229	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC001231056030	885167653	/nfs/dbraw/zinc/16/76/53/885167653.db2.gz	OVKSCHIPUSRUCO-LLVKDONJSA-N	1	1	318.333	1.638	20	5		DDBDMO
O[C@H]1COCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1	ZINC001232218733	886166352	/nfs/dbraw/zinc/16/63/52/886166352.db2.gz	LCVIJHJRZGHYCO-MRXNPFEDSA-N	1	1	309.369	1.976	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])c([N+](=O)[O-])c3)[C@H]1CC(=O)C2	ZINC001233702912	887237253	/nfs/dbraw/zinc/23/72/53/887237253.db2.gz	RMAQMQUBVVDWGR-MCCGJVOXSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])c([N+](=O)[O-])c3)[C@H]1CC(=O)C2	ZINC001233702912	887237265	/nfs/dbraw/zinc/23/72/65/887237265.db2.gz	RMAQMQUBVVDWGR-MCCGJVOXSA-N	1	1	321.289	1.686	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2nc(NC(C)=O)nc(C)c2[N+](=O)[O-])C1	ZINC001234907427	888242690	/nfs/dbraw/zinc/24/26/90/888242690.db2.gz	AZSPVCCSEKPBKK-SNVBAGLBSA-N	1	1	309.326	1.125	20	5		DDBDMO
COC(=O)C[N@H+](C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254481093	896456232	/nfs/dbraw/zinc/45/62/32/896456232.db2.gz	RLHQRNWGKPLCQO-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
COC(=O)C[N@@H+](C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254481093	896456239	/nfs/dbraw/zinc/45/62/39/896456239.db2.gz	RLHQRNWGKPLCQO-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
C[C@]1(CO)CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1O	ZINC001254592069	896520378	/nfs/dbraw/zinc/52/03/78/896520378.db2.gz	ABVXNTGSQXHNHO-OWCLPIDISA-N	1	1	306.362	1.127	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@]3(CCOC3)C1)C2	ZINC001254593218	896521984	/nfs/dbraw/zinc/52/19/84/896521984.db2.gz	KAUNHDMLNPFOCF-HZPDHXFCSA-N	1	1	304.346	1.553	20	5		DDBDMO
CC(=O)N[C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254600388	896524265	/nfs/dbraw/zinc/52/42/65/896524265.db2.gz	PNCYLLMBLZESCU-GOEBONIOSA-N	1	1	303.362	1.663	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254605011	896527783	/nfs/dbraw/zinc/52/77/83/896527783.db2.gz	ZTGIHZHPVJIJNU-DOMZBBRYSA-N	1	1	304.346	1.947	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612473	896533086	/nfs/dbraw/zinc/53/30/86/896533086.db2.gz	WTGHAYFTYDWFBV-GOEBONIOSA-N	1	1	304.346	1.947	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC001262826286	900388047	/nfs/dbraw/zinc/38/80/47/900388047.db2.gz	GXWCKKDOLBDUGO-YNEHKIRRSA-N	1	1	319.361	1.673	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(NCC[N@H+]3CCCOCC3)nc2c1	ZINC000278367686	214121045	/nfs/dbraw/zinc/12/10/45/214121045.db2.gz	DIFVSNWOYNYWBV-UHFFFAOYSA-N	1	1	305.338	1.605	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	ZINC000251520167	282201938	/nfs/dbraw/zinc/20/19/38/282201938.db2.gz	CQHZVXHKBKFNJB-WFASDCNBSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	ZINC000251520167	282201940	/nfs/dbraw/zinc/20/19/40/282201940.db2.gz	CQHZVXHKBKFNJB-WFASDCNBSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000251434516	282201011	/nfs/dbraw/zinc/20/10/11/282201011.db2.gz	ASHYMNOAKIYZHY-DOMZBBRYSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000251434516	282201012	/nfs/dbraw/zinc/20/10/12/282201012.db2.gz	ASHYMNOAKIYZHY-DOMZBBRYSA-N	1	1	310.350	1.709	20	5		DDBDMO
Cc1c(CN2CC[N@@H+](CCO)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000614920171	362076296	/nfs/dbraw/zinc/07/62/96/362076296.db2.gz	GCCUDSHELJBJGY-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H]1CO)Nc1cc([N+](=O)[O-])ccc1F	ZINC000181684917	199338478	/nfs/dbraw/zinc/33/84/78/199338478.db2.gz	FPJCAMSMRUYDNP-NSHDSACASA-N	1	1	311.313	1.519	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000413435750	530055093	/nfs/dbraw/zinc/05/50/93/530055093.db2.gz	HUUDEMWASVCBMM-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000458192870	530060371	/nfs/dbraw/zinc/06/03/71/530060371.db2.gz	PHSZNIRWQYUYOC-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@H](CO)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000181714357	199342605	/nfs/dbraw/zinc/34/26/05/199342605.db2.gz	UZOPDBGNQQNURZ-JTQLQIEISA-N	1	1	311.313	1.377	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCS1	ZINC000181764148	199349379	/nfs/dbraw/zinc/34/93/79/199349379.db2.gz	MRQHJUHRJATQIE-NEPJUHHUSA-N	1	1	312.391	1.772	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CC[C@@H](C)C2)cc([N+](=O)[O-])c1C	ZINC000616359383	362656867	/nfs/dbraw/zinc/65/68/67/362656867.db2.gz	OZAAEVTVFLLYAU-LLVKDONJSA-N	1	1	321.377	1.983	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000181943837	199367079	/nfs/dbraw/zinc/36/70/79/199367079.db2.gz	ILUOZQZLESQXEL-KBPBESRZSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[N@@H+]1CCC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000272659318	210063973	/nfs/dbraw/zinc/06/39/73/210063973.db2.gz	HCOPAJYLOCJWAQ-NHYWBVRUSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000272659318	210063978	/nfs/dbraw/zinc/06/39/78/210063978.db2.gz	HCOPAJYLOCJWAQ-NHYWBVRUSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000279671848	215049071	/nfs/dbraw/zinc/04/90/71/215049071.db2.gz	DLYXIGJOPYGWIV-OLZOCXBDSA-N	1	1	309.366	1.382	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279881934	215202883	/nfs/dbraw/zinc/20/28/83/215202883.db2.gz	UKMUDVIRCKRWFG-AWEZNQCLSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000280018167	215315420	/nfs/dbraw/zinc/31/54/20/215315420.db2.gz	KGJLCEAQBQMINA-XJKSGUPXSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)Cn2cc([N+](=O)[O-])cn2)[nH+]c1	ZINC000172363503	198086006	/nfs/dbraw/zinc/08/60/06/198086006.db2.gz	OATIAVCGPZTENC-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N(C)C)CC1	ZINC000015297473	352153839	/nfs/dbraw/zinc/15/38/39/352153839.db2.gz	RFKMNYURCXXYLA-UHFFFAOYSA-N	1	1	321.377	1.904	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])o2)C1	ZINC000032267688	352276485	/nfs/dbraw/zinc/27/64/85/352276485.db2.gz	GOQUXCYIENCYNE-LLVKDONJSA-N	1	1	311.338	1.274	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc(C)ccc1[N+](=O)[O-]	ZINC000173086626	198183619	/nfs/dbraw/zinc/18/36/19/198183619.db2.gz	RJXTZXABRCHWMI-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000058848002	352853930	/nfs/dbraw/zinc/85/39/30/352853930.db2.gz	ZNYHVDBGGJEXMJ-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@@H](C)C1	ZINC000063810096	352925881	/nfs/dbraw/zinc/92/58/81/352925881.db2.gz	HDUTYEPVCRTIJZ-CHWSQXEVSA-N	1	1	323.397	1.418	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2CN2CCOCC2)c1	ZINC000174018238	198281055	/nfs/dbraw/zinc/28/10/55/198281055.db2.gz	IVTKVJXYKVOFNZ-INIZCTEOSA-N	1	1	305.378	1.891	20	5		DDBDMO
C[C@@](O)(CNc1ccc([N+](=O)[O-])cc1F)C[NH+]1CCOCC1	ZINC000078343485	353512236	/nfs/dbraw/zinc/51/22/36/353512236.db2.gz	PFJQVHWVPHHMEY-CQSZACIVSA-N	1	1	313.329	1.229	20	5		DDBDMO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000093064734	353884023	/nfs/dbraw/zinc/88/40/23/353884023.db2.gz	SUAKRCKROVPJES-KBPBESRZSA-N	1	1	304.350	1.079	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000093342410	353897115	/nfs/dbraw/zinc/89/71/15/353897115.db2.gz	VJXIKCWAOIZXTL-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NCC[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC000155614999	354214443	/nfs/dbraw/zinc/21/44/43/354214443.db2.gz	AOLILOUJYBPFND-UHFFFAOYSA-N	1	1	315.395	1.522	20	5		DDBDMO
CCOC(=O)CC[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000162081079	354245551	/nfs/dbraw/zinc/24/55/51/354245551.db2.gz	DNAIMNFYFSZRNM-ZDUSSCGKSA-N	1	1	324.381	1.847	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055730	354228498	/nfs/dbraw/zinc/22/84/98/354228498.db2.gz	CACLFRXXZRBNNI-WCQYABFASA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055730	354228502	/nfs/dbraw/zinc/22/85/02/354228502.db2.gz	CACLFRXXZRBNNI-WCQYABFASA-N	1	1	307.350	1.352	20	5		DDBDMO
CN1CC[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000265667624	354400988	/nfs/dbraw/zinc/40/09/88/354400988.db2.gz	WBFYLAZXXKBNGD-AWEZNQCLSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCNc2cccc(C)[nH+]2)c1[N+](=O)[O-]	ZINC000346237481	283037805	/nfs/dbraw/zinc/03/78/05/283037805.db2.gz	IHJMUTXHEMGVDR-UHFFFAOYSA-N	1	1	304.310	1.172	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587979633	354888681	/nfs/dbraw/zinc/88/86/81/354888681.db2.gz	WYNRRSIHCGUGMJ-NSHDSACASA-N	1	1	308.382	1.447	20	5		DDBDMO
CC(C)[C@@H]1CN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CC[N@H+]1C	ZINC000588032356	354896524	/nfs/dbraw/zinc/89/65/24/354896524.db2.gz	WVWFPCXPAMNXHB-AWEZNQCLSA-N	1	1	308.382	1.446	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588863021	354944539	/nfs/dbraw/zinc/94/45/39/354944539.db2.gz	NYGMJSNDNLUBLN-KBPBESRZSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000589498396	354996919	/nfs/dbraw/zinc/99/69/19/354996919.db2.gz	UQKZMVWBDWSYCG-NSHDSACASA-N	1	1	308.334	1.850	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCCCCO)c1	ZINC000589513057	354997795	/nfs/dbraw/zinc/99/77/95/354997795.db2.gz	SSGQILCPZCCCCS-UHFFFAOYSA-N	1	1	310.350	1.976	20	5		DDBDMO
CC[N@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000589737696	355017468	/nfs/dbraw/zinc/01/74/68/355017468.db2.gz	VTBVOQVAVBQSDQ-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000589737696	355017469	/nfs/dbraw/zinc/01/74/69/355017469.db2.gz	VTBVOQVAVBQSDQ-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590446552	355099258	/nfs/dbraw/zinc/09/92/58/355099258.db2.gz	UJAAVCQKXDYSIK-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2cscn2)c1	ZINC000591728818	355373242	/nfs/dbraw/zinc/37/32/42/355373242.db2.gz	SDFSDISKNWDLCR-LBPRGKRZSA-N	1	1	309.347	1.581	20	5		DDBDMO
Cn1c[nH+]c2cc(NC[C@H](O)Cn3cc([N+](=O)[O-])cn3)ccc21	ZINC000591774189	355382543	/nfs/dbraw/zinc/38/25/43/355382543.db2.gz	KBQPMELZBRTQFJ-LBPRGKRZSA-N	1	1	316.321	1.151	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000592530715	355616220	/nfs/dbraw/zinc/61/62/20/355616220.db2.gz	GILQIQUMOGUKBD-GXTWGEPZSA-N	1	1	308.334	1.259	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000592798145	355696244	/nfs/dbraw/zinc/69/62/44/355696244.db2.gz	QTGYIIOYPSCZLS-IUODEOHRSA-N	1	1	305.378	1.936	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@]2(C)CO)c1	ZINC000593025314	355773372	/nfs/dbraw/zinc/77/33/72/355773372.db2.gz	WRAKZXIPRSSUIV-HNNXBMFYSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000593065777	355784559	/nfs/dbraw/zinc/78/45/59/355784559.db2.gz	CDPHQUFCFPNGCX-VXGBXAGGSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](CO)C1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000593085771	355790218	/nfs/dbraw/zinc/79/02/18/355790218.db2.gz	XCIYIGDTWRPSRF-LBPRGKRZSA-N	1	1	321.377	1.874	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000593415035	355878488	/nfs/dbraw/zinc/87/84/88/355878488.db2.gz	JZSPNLPBBMDRCD-LLVKDONJSA-N	1	1	321.352	1.877	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594199314	356137860	/nfs/dbraw/zinc/13/78/60/356137860.db2.gz	JTELFQXANUVOET-QWHCGFSZSA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601337279	358504431	/nfs/dbraw/zinc/50/44/31/358504431.db2.gz	AJXYNQHOSUHPTM-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
CO[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000595413433	356484273	/nfs/dbraw/zinc/48/42/73/356484273.db2.gz	BNNJSTOAWCANTL-TVYUQYBPSA-N	1	1	314.363	1.057	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000595386175	356473951	/nfs/dbraw/zinc/47/39/51/356473951.db2.gz	AQLURBXUDSSGRE-UHFFFAOYSA-N	1	1	319.340	1.790	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H]1COCCO1	ZINC000595744938	356632272	/nfs/dbraw/zinc/63/22/72/356632272.db2.gz	WJBFRGARQPGQTO-FZMZJTMJSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1COCCO1	ZINC000595744938	356632275	/nfs/dbraw/zinc/63/22/75/356632275.db2.gz	WJBFRGARQPGQTO-FZMZJTMJSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[N@H+](CC1=CCCOC1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595746966	356633714	/nfs/dbraw/zinc/63/37/14/356633714.db2.gz	HKKRKBGSQHPHNN-CQSZACIVSA-N	1	1	322.361	1.613	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595760043	356640787	/nfs/dbraw/zinc/64/07/87/356640787.db2.gz	RWXVRWRSACDOHN-BLLLJJGKSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595760043	356640790	/nfs/dbraw/zinc/64/07/90/356640790.db2.gz	RWXVRWRSACDOHN-BLLLJJGKSA-N	1	1	319.361	1.810	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c1	ZINC000595761074	356641833	/nfs/dbraw/zinc/64/18/33/356641833.db2.gz	WNUKVDSDRIPXAG-CZUORRHYSA-N	1	1	320.345	1.850	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c([N+](=O)[O-])c1	ZINC000595872664	356686945	/nfs/dbraw/zinc/68/69/45/356686945.db2.gz	KLOYHUHEBMQXKW-MLGOLLRUSA-N	1	1	324.377	1.933	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1	ZINC000347432738	283213162	/nfs/dbraw/zinc/21/31/62/283213162.db2.gz	PEWDFBAAETUNTN-GFCCVEGCSA-N	1	1	321.381	1.132	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNc2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC000596058044	356756001	/nfs/dbraw/zinc/75/60/01/356756001.db2.gz	BICKTEPHYLVGCW-NSHDSACASA-N	1	1	310.354	1.464	20	5		DDBDMO
CCC[N@@H+]1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000596064900	356758586	/nfs/dbraw/zinc/75/85/86/356758586.db2.gz	CFRIQBDCNDIZED-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000596064900	356758587	/nfs/dbraw/zinc/75/85/87/356758587.db2.gz	CFRIQBDCNDIZED-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596143854	356790154	/nfs/dbraw/zinc/79/01/54/356790154.db2.gz	WJUBMDGLWLXDTA-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
CCC[C@H]1CN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000596176189	356802949	/nfs/dbraw/zinc/80/29/49/356802949.db2.gz	AJURIZSYQMSJPE-LBPRGKRZSA-N	1	1	324.381	1.633	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000597859617	357361689	/nfs/dbraw/zinc/36/16/89/357361689.db2.gz	WITWWHKSYVYJDB-SNVBAGLBSA-N	1	1	306.366	1.780	20	5		DDBDMO
C[C@@H](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[NH+](C)C	ZINC000597999831	357415264	/nfs/dbraw/zinc/41/52/64/357415264.db2.gz	SFYGGBYLWJESHZ-VIFPVBQESA-N	1	1	305.338	1.541	20	5		DDBDMO
Cc1nccnc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000598671906	357680142	/nfs/dbraw/zinc/68/01/42/357680142.db2.gz	FILJOHDJYDCDCQ-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1nccnc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000598671906	357680145	/nfs/dbraw/zinc/68/01/45/357680145.db2.gz	FILJOHDJYDCDCQ-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1CO	ZINC000598676815	357683027	/nfs/dbraw/zinc/68/30/27/357683027.db2.gz	LMTMAKYFQWZUEG-DGCLKSJQSA-N	1	1	322.361	1.816	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[N@@H+]1CC[C@@H](O)C1	ZINC000599085290	357810495	/nfs/dbraw/zinc/81/04/95/357810495.db2.gz	ORZYPVSBWGZMAV-DGCLKSJQSA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599085290	357810496	/nfs/dbraw/zinc/81/04/96/357810496.db2.gz	ORZYPVSBWGZMAV-DGCLKSJQSA-N	1	1	309.366	1.321	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC3(CCOCC3)CC[C@@H]2CO)n1	ZINC000599542838	357967944	/nfs/dbraw/zinc/96/79/44/357967944.db2.gz	FBAUDQZHJPWQSV-CYBMUJFWSA-N	1	1	324.381	1.045	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000599564076	357974845	/nfs/dbraw/zinc/97/48/45/357974845.db2.gz	QCSUDTGDOJMBRO-IAQYHMDHSA-N	1	1	308.334	1.920	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@](C)(CO)[C@](C)(CO)C2)cc1[N+](=O)[O-]	ZINC000599622128	357995734	/nfs/dbraw/zinc/99/57/34/357995734.db2.gz	BNTNLFHTQRIRIE-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@](C)(CO)[C@](C)(CO)C2)cc1[N+](=O)[O-]	ZINC000599622128	357995735	/nfs/dbraw/zinc/99/57/35/357995735.db2.gz	BNTNLFHTQRIRIE-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1	ZINC000599645694	358005158	/nfs/dbraw/zinc/00/51/58/358005158.db2.gz	SWQYALJECRFMIB-PHIMTYICSA-N	1	1	320.349	1.119	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](C)C1	ZINC000599688683	358025861	/nfs/dbraw/zinc/02/58/61/358025861.db2.gz	LLJMCMRKGCJBPJ-ZSBIGDGJSA-N	1	1	310.354	1.453	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000600836792	358329175	/nfs/dbraw/zinc/32/91/75/358329175.db2.gz	CFALFRGMLKDFCU-LLVKDONJSA-N	1	1	320.349	1.442	20	5		DDBDMO
C[C@@H](CN1CCCC1=O)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601106550	358404858	/nfs/dbraw/zinc/40/48/58/358404858.db2.gz	ZHOGMOKEXBNLOF-NSHDSACASA-N	1	1	314.345	1.988	20	5		DDBDMO
CC(=O)N1CC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1	ZINC000601199621	358444321	/nfs/dbraw/zinc/44/43/21/358444321.db2.gz	VTFIUYWCHGXCKX-LLVKDONJSA-N	1	1	300.318	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@]3(CCO)CCOC3)c2c1	ZINC000601129184	358414595	/nfs/dbraw/zinc/41/45/95/358414595.db2.gz	CRQBNAJXLKTTRB-MRXNPFEDSA-N	1	1	317.345	1.766	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602456376	358989584	/nfs/dbraw/zinc/98/95/84/358989584.db2.gz	YLLWANNVJFAMGO-GFCCVEGCSA-N	1	1	323.397	1.313	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602456376	358989588	/nfs/dbraw/zinc/98/95/88/358989588.db2.gz	YLLWANNVJFAMGO-GFCCVEGCSA-N	1	1	323.397	1.313	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@]2(CCCOC2)C1	ZINC000602786928	359191901	/nfs/dbraw/zinc/19/19/01/359191901.db2.gz	ZUUQCNJJDZKQCK-OAHLLOKOSA-N	1	1	308.382	1.992	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@]1(C)C(=O)NC2=O	ZINC000602729696	359153298	/nfs/dbraw/zinc/15/32/98/359153298.db2.gz	BLYSWXFOZUHBKB-GASCZTMLSA-N	1	1	303.318	1.079	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](O)C[C@H]1c1ccccc1	ZINC000602839807	359228511	/nfs/dbraw/zinc/22/85/11/359228511.db2.gz	IVAMJXIHFUMBNX-CABCVRRESA-N	1	1	316.361	1.908	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1	ZINC000602801073	359201329	/nfs/dbraw/zinc/20/13/29/359201329.db2.gz	LFFDODLLVLXTAS-QWHCGFSZSA-N	1	1	310.398	1.829	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@](C)(CO)C1	ZINC000602965036	359328915	/nfs/dbraw/zinc/32/89/15/359328915.db2.gz	YDDXYAJCFPXIQG-LSDHHAIUSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@@H](CO)[C@H](C(F)(F)F)C1	ZINC000602988339	359341273	/nfs/dbraw/zinc/34/12/73/359341273.db2.gz	HOVKIEZQXPZGBM-VHSXEESVSA-N	1	1	322.287	1.202	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000186847834	200020739	/nfs/dbraw/zinc/02/07/39/200020739.db2.gz	AKOXCFSIXMDJPM-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000604199913	359725146	/nfs/dbraw/zinc/72/51/46/359725146.db2.gz	XEGDMRAUXPPWLA-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000609269887	360285476	/nfs/dbraw/zinc/28/54/76/360285476.db2.gz	YQHFUORAQNLHOR-CYBMUJFWSA-N	1	1	307.350	1.435	20	5		DDBDMO
CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCOC1	ZINC000609631597	360339186	/nfs/dbraw/zinc/33/91/86/360339186.db2.gz	DQTCOJWHSLLRIN-NSHDSACASA-N	1	1	307.350	1.552	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000610489120	360450340	/nfs/dbraw/zinc/45/03/40/360450340.db2.gz	FBZLIWUEYBVLBV-ZDUSSCGKSA-N	1	1	306.366	1.681	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000610522708	360460698	/nfs/dbraw/zinc/46/06/98/360460698.db2.gz	RHCFFBOTYLBCPH-NSHDSACASA-N	1	1	304.350	1.391	20	5		DDBDMO
Cc1cn(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(C)[nH+]1	ZINC000611165028	360642474	/nfs/dbraw/zinc/64/24/74/360642474.db2.gz	WPEGQDOVIDMTPF-UHFFFAOYSA-N	1	1	300.318	1.997	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@H]1C	ZINC000611087678	360619066	/nfs/dbraw/zinc/61/90/66/360619066.db2.gz	CEWKGZYAPWDYHL-GFCCVEGCSA-N	1	1	305.378	1.998	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000611088181	360620280	/nfs/dbraw/zinc/62/02/80/360620280.db2.gz	IMOJDTHWIIACRG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000611088181	360620282	/nfs/dbraw/zinc/62/02/82/360620282.db2.gz	IMOJDTHWIIACRG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000611147070	360636831	/nfs/dbraw/zinc/63/68/31/360636831.db2.gz	UFJIKTOPYUKBQZ-ZDUSSCGKSA-N	1	1	306.366	1.531	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N3CCC(c4[nH]cc[nH+]4)CC3)nn21	ZINC000611153093	360639158	/nfs/dbraw/zinc/63/91/58/360639158.db2.gz	QTJYADNRUDQBRP-UHFFFAOYSA-N	1	1	313.321	1.745	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])s2)CC1	ZINC000611242446	360676209	/nfs/dbraw/zinc/67/62/09/360676209.db2.gz	ABQVLQDSYRZBSF-LLVKDONJSA-N	1	1	324.406	1.575	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C(=O)NCC[C@H]1C	ZINC000193633857	201092302	/nfs/dbraw/zinc/09/23/02/201092302.db2.gz	JMJVIXQRGVJDHE-IAQYHMDHSA-N	1	1	321.377	1.996	20	5		DDBDMO
COCC[N@H+](CCc1ccccc1)CCn1cc([N+](=O)[O-])cn1	ZINC000350725020	284249647	/nfs/dbraw/zinc/24/96/47/284249647.db2.gz	RLMDRKPTQQHVNP-UHFFFAOYSA-N	1	1	318.377	1.982	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000264914894	204265130	/nfs/dbraw/zinc/26/51/30/204265130.db2.gz	OCXKYETXTHMVET-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
COCC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC)c2)C[C@@H]1C	ZINC000266338982	205278373	/nfs/dbraw/zinc/27/83/73/205278373.db2.gz	IAJOSKAXUPPWQB-LBPRGKRZSA-N	1	1	309.366	1.760	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288473205	220165160	/nfs/dbraw/zinc/16/51/60/220165160.db2.gz	QNIACTBUTYEIDS-ONGXEEELSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000267558980	206144905	/nfs/dbraw/zinc/14/49/05/206144905.db2.gz	CVJKRKBZXNMPQR-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000267558980	206144908	/nfs/dbraw/zinc/14/49/08/206144908.db2.gz	CVJKRKBZXNMPQR-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000267558980	206144912	/nfs/dbraw/zinc/14/49/12/206144912.db2.gz	CVJKRKBZXNMPQR-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1c(CN2CCO[C@@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000284471386	218040662	/nfs/dbraw/zinc/04/06/62/218040662.db2.gz	AGLHBCNXDNPPAF-HZPDHXFCSA-N	1	1	305.378	1.808	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc([N+](=O)[O-])cc2)[N@@H+](C)C1	ZINC000284628437	218107208	/nfs/dbraw/zinc/10/72/08/218107208.db2.gz	LPTXYUCMWIXTKZ-KBPBESRZSA-N	1	1	307.350	1.386	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)c2nc3cc([N+](=O)[O-])ccc3[nH]2)[N@@H+](C)C1	ZINC000284659388	218120044	/nfs/dbraw/zinc/12/00/44/218120044.db2.gz	XPVJMGXVRVDHNI-RYUDHWBXSA-N	1	1	319.365	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1	ZINC000285020491	218259002	/nfs/dbraw/zinc/25/90/02/218259002.db2.gz	ZCFHCPNTCCCPCM-BBWFWOEESA-N	1	1	320.389	1.999	20	5		DDBDMO
CCC[N@H+](CC(=O)N(C)C)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000056510307	184014523	/nfs/dbraw/zinc/01/45/23/184014523.db2.gz	BJIGWUBMCGOXJP-UHFFFAOYSA-N	1	1	309.366	1.904	20	5		DDBDMO
CCC[N@@H+](CC(=O)N(C)C)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000056510307	184014525	/nfs/dbraw/zinc/01/45/25/184014525.db2.gz	BJIGWUBMCGOXJP-UHFFFAOYSA-N	1	1	309.366	1.904	20	5		DDBDMO
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c(C)c2)CC[N@@H+](C)C1	ZINC000413511422	533010071	/nfs/dbraw/zinc/01/00/71/533010071.db2.gz	ZPPXCCZZAOLRPI-GFCCVEGCSA-N	1	1	307.350	1.444	20	5		DDBDMO
CN(C(=O)C[N@H+](C)[C@H]1CCSC1)c1ccc([N+](=O)[O-])cc1	ZINC000119954030	195069810	/nfs/dbraw/zinc/06/98/10/195069810.db2.gz	VZHLSDFOJDIXPY-ZDUSSCGKSA-N	1	1	309.391	1.995	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@H]1CCSC1)c1ccc([N+](=O)[O-])cc1	ZINC000119954030	195069811	/nfs/dbraw/zinc/06/98/11/195069811.db2.gz	VZHLSDFOJDIXPY-ZDUSSCGKSA-N	1	1	309.391	1.995	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](CCO)CC1CC1	ZINC000352459518	285064527	/nfs/dbraw/zinc/06/45/27/285064527.db2.gz	ZUCQIVCFBAREPF-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cccc(N2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)c1	ZINC000157491612	197191276	/nfs/dbraw/zinc/19/12/76/197191276.db2.gz	JCQOGHNIWNISRL-UHFFFAOYSA-N	1	1	315.377	1.922	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000155376539	197049034	/nfs/dbraw/zinc/04/90/34/197049034.db2.gz	LHJAFAGRUYWANG-BETUJISGSA-N	1	1	320.393	1.582	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2C[NH2+]C[C@H]2C1	ZINC000289540719	221053547	/nfs/dbraw/zinc/05/35/47/221053547.db2.gz	BQXURDDJKNKXQN-UWVGGRQHSA-N	1	1	315.333	1.153	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1[C@H]1CCCO1	ZINC000289683215	221151244	/nfs/dbraw/zinc/15/12/44/221151244.db2.gz	HUCLQSZCLQRODY-HIFRSBDPSA-N	1	1	321.377	1.646	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N[C@H]1CCC[N@H+](CCCO)C1	ZINC000294998563	224368655	/nfs/dbraw/zinc/36/86/55/224368655.db2.gz	REXBEPDGAPARAB-NSHDSACASA-N	1	1	314.773	1.902	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000266575924	407566212	/nfs/dbraw/zinc/56/62/12/407566212.db2.gz	LWRSROHMIWCUHC-OAHLLOKOSA-N	1	1	304.350	1.593	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000046132938	407055210	/nfs/dbraw/zinc/05/52/10/407055210.db2.gz	WECJUHNPQVOIPM-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000079670161	407060275	/nfs/dbraw/zinc/06/02/75/407060275.db2.gz	JPFJZVVRNBKJRE-ZDUSSCGKSA-N	1	1	318.377	1.878	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000102183667	407320558	/nfs/dbraw/zinc/32/05/58/407320558.db2.gz	JSXQKGPCMMIOJS-UHFFFAOYSA-N	1	1	313.379	1.357	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000124923243	407373730	/nfs/dbraw/zinc/37/37/30/407373730.db2.gz	DUJKMJLQPYTLEM-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000126251838	407409412	/nfs/dbraw/zinc/40/94/12/407409412.db2.gz	ROQGBYJPHYNDFM-GWCFXTLKSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC(C)OCCC[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000265859546	407487817	/nfs/dbraw/zinc/48/78/17/407487817.db2.gz	JVOBUDSJNDQGSW-UHFFFAOYSA-N	1	1	309.366	1.941	20	5		DDBDMO
CC[C@H](O)[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000114188016	407552649	/nfs/dbraw/zinc/55/26/49/407552649.db2.gz	FXFZWVBSSBXKJX-HIFRSBDPSA-N	1	1	321.377	1.819	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000266550778	407554005	/nfs/dbraw/zinc/55/40/05/407554005.db2.gz	UFWJVXWCDUOWMF-NSHDSACASA-N	1	1	324.333	1.477	20	5		DDBDMO
CC(C)C[C@@](C)(C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236699893	407755755	/nfs/dbraw/zinc/75/57/55/407755755.db2.gz	MUBRYTPUTQFSHN-HNNXBMFYSA-N	1	1	319.365	1.964	20	5		DDBDMO
NS(=O)(=O)CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000179242519	407762754	/nfs/dbraw/zinc/76/27/54/407762754.db2.gz	CVUDQZHQQSNOEL-UHFFFAOYSA-N	1	1	313.379	1.238	20	5		DDBDMO
NS(=O)(=O)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000179242519	407762758	/nfs/dbraw/zinc/76/27/58/407762758.db2.gz	CVUDQZHQQSNOEL-UHFFFAOYSA-N	1	1	313.379	1.238	20	5		DDBDMO
CCOCC[NH+]1CCN(c2c([N+](=O)[O-])c(CC)nn2C)CC1	ZINC000179587858	407810610	/nfs/dbraw/zinc/81/06/10/407810610.db2.gz	KHWGHLSVHZMOFK-UHFFFAOYSA-N	1	1	311.386	1.049	20	5		DDBDMO
CCN(C)C(=O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000153511907	407842288	/nfs/dbraw/zinc/84/22/88/407842288.db2.gz	BBJXIGPASNABMT-LBPRGKRZSA-N	1	1	321.381	1.344	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000118096605	407886004	/nfs/dbraw/zinc/88/60/04/407886004.db2.gz	FNUWSNJSUOELMG-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000272506521	407952334	/nfs/dbraw/zinc/95/23/34/407952334.db2.gz	JHLUUSGATXIKIQ-CMPLNLGQSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000272506521	407952341	/nfs/dbraw/zinc/95/23/41/407952341.db2.gz	JHLUUSGATXIKIQ-CMPLNLGQSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000245404341	407962360	/nfs/dbraw/zinc/96/23/60/407962360.db2.gz	OWUCDDOSKZKTFU-TZMCWYRMSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272532695	407967415	/nfs/dbraw/zinc/96/74/15/407967415.db2.gz	ISKRCRQNZQATHP-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272532695	407967424	/nfs/dbraw/zinc/96/74/24/407967424.db2.gz	ISKRCRQNZQATHP-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000134624403	407917711	/nfs/dbraw/zinc/91/77/11/407917711.db2.gz	OVTZDWVUJZGSED-CYBMUJFWSA-N	1	1	316.361	1.829	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000153938225	407935150	/nfs/dbraw/zinc/93/51/50/407935150.db2.gz	DQMUTQAIIJRNGG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCOC1	ZINC000245897467	408089121	/nfs/dbraw/zinc/08/91/21/408089121.db2.gz	FCPBRGCAHFHRQX-UKRRQHHQSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@@H]21	ZINC000154825333	408091954	/nfs/dbraw/zinc/09/19/54/408091954.db2.gz	OJFLDAZPXYRQNP-AAEUAGOBSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@](C)(O)C1	ZINC000245901340	408093360	/nfs/dbraw/zinc/09/33/60/408093360.db2.gz	LFMJRECRFNCDEQ-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](C)(O)C1	ZINC000245901340	408093368	/nfs/dbraw/zinc/09/33/68/408093368.db2.gz	LFMJRECRFNCDEQ-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000190169627	408179298	/nfs/dbraw/zinc/17/92/98/408179298.db2.gz	FONRFWMXFAYBPV-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000175993631	408258928	/nfs/dbraw/zinc/25/89/28/408258928.db2.gz	VXXLQYZGWAYKGB-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
CCN(CC)C(=O)[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000176243171	408322846	/nfs/dbraw/zinc/32/28/46/408322846.db2.gz	LEFSWTBBVJQSIH-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000246557415	408290016	/nfs/dbraw/zinc/29/00/16/408290016.db2.gz	WLBDONHHXDRCQM-MWLCHTKSSA-N	1	1	309.370	1.339	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246889153	408360876	/nfs/dbraw/zinc/36/08/76/408360876.db2.gz	IUDPJRCCILMRBC-KGLIPLIRSA-N	1	1	319.409	1.960	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1(CO)CCOCC1	ZINC000191017800	408358892	/nfs/dbraw/zinc/35/88/92/408358892.db2.gz	SFTHUNTZTFFJHN-CQSZACIVSA-N	1	1	310.350	1.102	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192024	408385206	/nfs/dbraw/zinc/38/52/06/408385206.db2.gz	WVPGHUACUMNUMJ-NQBHXWOUSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192024	408385211	/nfs/dbraw/zinc/38/52/11/408385211.db2.gz	WVPGHUACUMNUMJ-NQBHXWOUSA-N	1	1	308.338	1.065	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000274589219	408460061	/nfs/dbraw/zinc/46/00/61/408460061.db2.gz	QHCFMPRSWOUXRW-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000176962911	408484989	/nfs/dbraw/zinc/48/49/89/408484989.db2.gz	NNKANWZMAPSQKZ-GFCCVEGCSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@H]1c1ccccc1	ZINC000270338983	408493134	/nfs/dbraw/zinc/49/31/34/408493134.db2.gz	ZBGUPNRJIBOLBA-DGCLKSJQSA-N	1	1	314.349	1.824	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177121074	408525242	/nfs/dbraw/zinc/52/52/42/408525242.db2.gz	UMKKDXRQWQXLLT-ZJUUUORDSA-N	1	1	304.350	1.532	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCC[N@H+]2C)cc([N+](=O)[O-])c1C	ZINC000191714672	408474872	/nfs/dbraw/zinc/47/48/72/408474872.db2.gz	AKFODJPOTGAIND-GFCCVEGCSA-N	1	1	307.350	1.736	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000192150085	408550117	/nfs/dbraw/zinc/55/01/17/408550117.db2.gz	XTDHZEGWSRCGDX-CHWSQXEVSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)Nc3ccncc3[N+](=O)[O-])CC[C@H]21	ZINC000248406082	408560080	/nfs/dbraw/zinc/56/00/80/408560080.db2.gz	SAYDBMBTINCZTD-DGCLKSJQSA-N	1	1	319.365	1.938	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCc1c[nH+]c(N(C)C)n1C	ZINC000265123243	408560806	/nfs/dbraw/zinc/56/08/06/408560806.db2.gz	OIWASXCWHOHOOP-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2ccncc2)c1	ZINC000270544549	408572783	/nfs/dbraw/zinc/57/27/83/408572783.db2.gz	MBWJOXNFVCFQGS-CABCVRRESA-N	1	1	317.349	1.384	20	5		DDBDMO
CNC(=O)c1ccc(N(C)C[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000265186489	408573863	/nfs/dbraw/zinc/57/38/63/408573863.db2.gz	GFRZAMPCXJTVIL-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000177470503	408630287	/nfs/dbraw/zinc/63/02/87/408630287.db2.gz	IDTOGBIOVHPDBX-OAHLLOKOSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000177470489	408631215	/nfs/dbraw/zinc/63/12/15/408631215.db2.gz	IDTOGBIOVHPDBX-HNNXBMFYSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC[C@@H](CO)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000275867077	408702464	/nfs/dbraw/zinc/70/24/64/408702464.db2.gz	JMKGGUFHADQMEI-JSGCOSHPSA-N	1	1	304.350	1.778	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000185229609	408784096	/nfs/dbraw/zinc/78/40/96/408784096.db2.gz	WFRYCQKBGNPREA-UHFFFAOYSA-N	1	1	313.379	1.310	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000270942885	408751514	/nfs/dbraw/zinc/75/15/14/408751514.db2.gz	RSFKXYPVNIOLCV-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000270942885	408751516	/nfs/dbraw/zinc/75/15/16/408751516.db2.gz	RSFKXYPVNIOLCV-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCCCO	ZINC000276217062	408825753	/nfs/dbraw/zinc/82/57/53/408825753.db2.gz	ANYKPGGRIALCEY-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCCCO	ZINC000276217062	408825754	/nfs/dbraw/zinc/82/57/54/408825754.db2.gz	ANYKPGGRIALCEY-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
C[C@@H]1CC[NH2+][C@H](C)[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000286095778	408922808	/nfs/dbraw/zinc/92/28/08/408922808.db2.gz	NJHBXOXQICRBMS-KKFJDGPESA-N	1	1	317.349	1.587	20	5		DDBDMO
COc1cccc2c1CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2	ZINC000193725524	163265814	/nfs/dbraw/zinc/26/58/14/163265814.db2.gz	BUFVJERXGQKPAP-UHFFFAOYSA-N	1	1	316.361	1.901	20	5		DDBDMO
CCNC(=O)NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000292204848	409000476	/nfs/dbraw/zinc/00/04/76/409000476.db2.gz	SPIGXFDXWXSEKC-UHFFFAOYSA-N	1	1	308.338	1.265	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)CCCO	ZINC000281927985	408955865	/nfs/dbraw/zinc/95/58/65/408955865.db2.gz	SFXQUPIKCHXGHD-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)CCCO	ZINC000281927985	408955868	/nfs/dbraw/zinc/95/58/68/408955868.db2.gz	SFXQUPIKCHXGHD-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293325948	409090217	/nfs/dbraw/zinc/09/02/17/409090217.db2.gz	GERMDTZPVSWVJV-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000293325948	409090219	/nfs/dbraw/zinc/09/02/19/409090219.db2.gz	GERMDTZPVSWVJV-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000293325948	409090221	/nfs/dbraw/zinc/09/02/21/409090221.db2.gz	GERMDTZPVSWVJV-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000293331383	409091525	/nfs/dbraw/zinc/09/15/25/409091525.db2.gz	GNSGIIAPTLFDFG-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)N1C	ZINC000293331383	409091528	/nfs/dbraw/zinc/09/15/28/409091528.db2.gz	GNSGIIAPTLFDFG-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)N1C	ZINC000293331383	409091530	/nfs/dbraw/zinc/09/15/30/409091530.db2.gz	GNSGIIAPTLFDFG-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1nn(C)cc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278813267	409094267	/nfs/dbraw/zinc/09/42/67/409094267.db2.gz	YWBDFOKGVWAUSX-UHFFFAOYSA-N	1	1	300.322	1.803	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000283281164	409127860	/nfs/dbraw/zinc/12/78/60/409127860.db2.gz	MBTNNCYGBIXOCD-CYBMUJFWSA-N	1	1	321.333	1.561	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000283281164	409127861	/nfs/dbraw/zinc/12/78/61/409127861.db2.gz	MBTNNCYGBIXOCD-CYBMUJFWSA-N	1	1	321.333	1.561	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC(=O)OC	ZINC000283337883	409140189	/nfs/dbraw/zinc/14/01/89/409140189.db2.gz	PZMQCZOMCKIMGF-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[N@H+](C2CCC2)C1	ZINC000293716421	409166607	/nfs/dbraw/zinc/16/66/07/409166607.db2.gz	PBBIMZAVFRBVOD-LBPRGKRZSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H](C)[N@H+]1C	ZINC000293987895	409220399	/nfs/dbraw/zinc/22/03/99/409220399.db2.gz	NMUUNZLJSNUZGI-DTORHVGOSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H](C)[N@@H+]1C	ZINC000293987895	409220404	/nfs/dbraw/zinc/22/04/04/409220404.db2.gz	NMUUNZLJSNUZGI-DTORHVGOSA-N	1	1	310.329	1.481	20	5		DDBDMO
CN(C[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000289306647	409245991	/nfs/dbraw/zinc/24/59/91/409245991.db2.gz	ATAPEEKYMCFMHU-HNNXBMFYSA-N	1	1	307.394	1.524	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C(C)(C)C(N)=O	ZINC000295609640	409357400	/nfs/dbraw/zinc/35/74/00/409357400.db2.gz	DBNLNCLSMBHLTG-UHFFFAOYSA-N	1	1	322.365	1.428	20	5		DDBDMO
C[C@@H]([N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)O	ZINC000295223013	409383616	/nfs/dbraw/zinc/38/36/16/409383616.db2.gz	VVKRZAWYDIXMDI-NEPJUHHUSA-N	1	1	312.366	1.426	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(N)c3F)C[C@H]21	ZINC000285018792	409392908	/nfs/dbraw/zinc/39/29/08/409392908.db2.gz	MRVRPDUFEFIHCA-NEPJUHHUSA-N	1	1	310.329	1.225	20	5		DDBDMO
COc1cc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)ccc1[N+](=O)[O-]	ZINC000295161156	409351962	/nfs/dbraw/zinc/35/19/62/409351962.db2.gz	DVGPOEMCHDZZQZ-CQSZACIVSA-N	1	1	311.313	1.377	20	5		DDBDMO
CNC(=O)C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000374510074	164173287	/nfs/dbraw/zinc/17/32/87/164173287.db2.gz	WLSXNAQHCFNOMF-UHFFFAOYSA-N	1	1	306.366	1.161	20	5		DDBDMO
CNC(=O)C[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000374510074	164173288	/nfs/dbraw/zinc/17/32/88/164173288.db2.gz	WLSXNAQHCFNOMF-UHFFFAOYSA-N	1	1	306.366	1.161	20	5		DDBDMO
CNc1c(C(=O)N(C)CC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000354081300	409636749	/nfs/dbraw/zinc/63/67/49/409636749.db2.gz	CVIOMBQOMYLJNB-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000356835052	409646975	/nfs/dbraw/zinc/64/69/75/409646975.db2.gz	BFTQUMIKABYBSH-NWDGAFQWSA-N	1	1	323.397	1.349	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccon1	ZINC000349245481	409765391	/nfs/dbraw/zinc/76/53/91/409765391.db2.gz	RLKKTMFBUXWDFM-CMPLNLGQSA-N	1	1	307.306	1.673	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC000356913440	409717682	/nfs/dbraw/zinc/71/76/82/409717682.db2.gz	YFCBZMPDAHMGLU-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000356913440	409717687	/nfs/dbraw/zinc/71/76/87/409717687.db2.gz	YFCBZMPDAHMGLU-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412989	409828755	/nfs/dbraw/zinc/82/87/55/409828755.db2.gz	ZMTAPUSKLHXABR-ZWNOBZJWSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412989	409828764	/nfs/dbraw/zinc/82/87/64/409828764.db2.gz	ZMTAPUSKLHXABR-ZWNOBZJWSA-N	1	1	310.350	1.815	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000354441800	409859091	/nfs/dbraw/zinc/85/90/91/409859091.db2.gz	WXDPGXVXYTWESE-NWDGAFQWSA-N	1	1	309.370	1.123	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000357539618	410091472	/nfs/dbraw/zinc/09/14/72/410091472.db2.gz	SPUCXKIPEOSMCA-NSHDSACASA-N	1	1	321.381	1.479	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3csc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000339396118	410158706	/nfs/dbraw/zinc/15/87/06/410158706.db2.gz	TWECKCWIRXRMQP-OLZOCXBDSA-N	1	1	311.407	1.951	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1cccnc1	ZINC000346993312	410295406	/nfs/dbraw/zinc/29/54/06/410295406.db2.gz	JCAMMCCOUAYWQP-HNNXBMFYSA-N	1	1	314.345	1.989	20	5		DDBDMO
Cc1[nH+]ccn1CCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000298836162	410418043	/nfs/dbraw/zinc/41/80/43/410418043.db2.gz	DHXKOOGQFMIQHK-UHFFFAOYSA-N	1	1	324.362	1.468	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000298719334	410367359	/nfs/dbraw/zinc/36/73/59/410367359.db2.gz	KIHBIMCPHWAUKI-UKRRQHHQSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000355365612	410471619	/nfs/dbraw/zinc/47/16/19/410471619.db2.gz	NCBGZVZXQLOIRC-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343460457	410471803	/nfs/dbraw/zinc/47/18/03/410471803.db2.gz	RVBOVKYMYFVITK-OLZOCXBDSA-N	1	1	320.393	1.996	20	5		DDBDMO
COC1CC([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000352214146	410556251	/nfs/dbraw/zinc/55/62/51/410556251.db2.gz	YGYYFUSYZRVEEK-OWYJLGKBSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)NCc2ccc([N+](=O)[O-])cc2)no1	ZINC000355626197	410612922	/nfs/dbraw/zinc/61/29/22/410612922.db2.gz	HZJWSAKZAJGTHV-UHFFFAOYSA-N	1	1	304.306	1.574	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343802150	410711326	/nfs/dbraw/zinc/71/13/26/410711326.db2.gz	SORXJRVKRHHPSW-WFASDCNBSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[NH+](C)CCSc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000301609896	410755797	/nfs/dbraw/zinc/75/57/97/410755797.db2.gz	QCEBVSVSMMDHJD-UHFFFAOYSA-N	1	1	304.393	1.652	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000330647656	410847909	/nfs/dbraw/zinc/84/79/09/410847909.db2.gz	ZRWQHQLOOIBENL-NWDGAFQWSA-N	1	1	307.350	1.525	20	5		DDBDMO
COc1cc(CN[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000330679905	410872444	/nfs/dbraw/zinc/87/24/44/410872444.db2.gz	YESWMKLXPYYBOU-ZYHUDNBSSA-N	1	1	309.366	1.881	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CC(O)C1	ZINC000353532578	411051631	/nfs/dbraw/zinc/05/16/31/411051631.db2.gz	VMUVFXADYBMXSR-UHFFFAOYSA-N	1	1	323.349	1.387	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000331229619	411029743	/nfs/dbraw/zinc/02/97/43/411029743.db2.gz	ZQVZXPGNUWEFGC-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc(C[NH+]3CCC(C)CC3)n2)n1C	ZINC000350924377	306759305	/nfs/dbraw/zinc/75/93/05/306759305.db2.gz	KXIRVSUFQYHXAF-UHFFFAOYSA-N	1	1	320.353	1.919	20	5		DDBDMO
O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461926	418431929	/nfs/dbraw/zinc/43/19/29/418431929.db2.gz	SIWSWKUMUOWVGP-QXSJWSMHSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461926	418431933	/nfs/dbraw/zinc/43/19/33/418431933.db2.gz	SIWSWKUMUOWVGP-QXSJWSMHSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461926	418431935	/nfs/dbraw/zinc/43/19/35/418431935.db2.gz	SIWSWKUMUOWVGP-QXSJWSMHSA-N	1	1	315.373	1.242	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000373743604	418455750	/nfs/dbraw/zinc/45/57/50/418455750.db2.gz	WYHCJROEHUIDRC-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2c([N+](=O)[O-])c(C)nn2CC)CC1	ZINC000192633687	418525598	/nfs/dbraw/zinc/52/55/98/418525598.db2.gz	AQEHFZGJMMHUGP-GFCCVEGCSA-N	1	1	311.386	1.013	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367288422	418580198	/nfs/dbraw/zinc/58/01/98/418580198.db2.gz	XEYYPJGDGITHAP-SNVBAGLBSA-N	1	1	319.695	1.927	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1	ZINC000375011466	418586881	/nfs/dbraw/zinc/58/68/81/418586881.db2.gz	FZGIKRQOISLMBE-KGLIPLIRSA-N	1	1	308.382	1.930	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CCOc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000375034705	418591992	/nfs/dbraw/zinc/59/19/92/418591992.db2.gz	DDUATUHTINATFK-DZGCQCFKSA-N	1	1	305.378	2.000	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2CCOc1ccc([N+](=O)[O-])cc1	ZINC000361341062	418630330	/nfs/dbraw/zinc/63/03/30/418630330.db2.gz	LVJDGOOVZDMHCI-OLZOCXBDSA-N	1	1	305.334	1.327	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](n3cccn3)C2)c1	ZINC000368269710	418712497	/nfs/dbraw/zinc/71/24/97/418712497.db2.gz	NADPGSWZQSMRDC-GJZGRUSLSA-N	1	1	302.334	1.772	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]12	ZINC000368064697	418682567	/nfs/dbraw/zinc/68/25/67/418682567.db2.gz	QNHFRCFPTHJPCW-SMDDNHRTSA-N	1	1	305.334	1.042	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]12	ZINC000368064696	418683154	/nfs/dbraw/zinc/68/31/54/418683154.db2.gz	QNHFRCFPTHJPCW-RISCZKNCSA-N	1	1	305.334	1.042	20	5		DDBDMO
COc1cc(C[NH2+][C@H]2CCc3[nH]cnc3C2)c([N+](=O)[O-])cc1O	ZINC000368087328	418688495	/nfs/dbraw/zinc/68/84/95/418688495.db2.gz	ARNXLSWGIZQWHH-JTQLQIEISA-N	1	1	318.333	1.679	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccco2)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000364457671	418777471	/nfs/dbraw/zinc/77/74/71/418777471.db2.gz	ORULYDCSLJEWTM-ZIAGYGMSSA-N	1	1	307.350	1.368	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]1n1ccnc1	ZINC000371324961	418780100	/nfs/dbraw/zinc/78/01/00/418780100.db2.gz	BLOWXHVWFZAVOA-NWDGAFQWSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]1n1ccnc1	ZINC000371324961	418780102	/nfs/dbraw/zinc/78/01/02/418780102.db2.gz	BLOWXHVWFZAVOA-NWDGAFQWSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000364621814	418793969	/nfs/dbraw/zinc/79/39/69/418793969.db2.gz	FBMXTYVBVSNCEX-HNCHTBHHSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000364621814	418793971	/nfs/dbraw/zinc/79/39/71/418793971.db2.gz	FBMXTYVBVSNCEX-HNCHTBHHSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000364621814	418793974	/nfs/dbraw/zinc/79/39/74/418793974.db2.gz	FBMXTYVBVSNCEX-HNCHTBHHSA-N	1	1	309.391	1.522	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000372545688	418881837	/nfs/dbraw/zinc/88/18/37/418881837.db2.gz	JGUHMBNTWHZQQE-UHFFFAOYSA-N	1	1	321.421	1.916	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681242	418893415	/nfs/dbraw/zinc/89/34/15/418893415.db2.gz	VYPRJWANGMBASF-OCCSQVGLSA-N	1	1	321.337	1.286	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681242	418893417	/nfs/dbraw/zinc/89/34/17/418893417.db2.gz	VYPRJWANGMBASF-OCCSQVGLSA-N	1	1	321.337	1.286	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H]1c2ccccc2CC[C@H]1CO	ZINC000365264495	418848176	/nfs/dbraw/zinc/84/81/76/418848176.db2.gz	GIRSQDFDRBKWDR-WFASDCNBSA-N	1	1	316.361	1.714	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411430314	418903652	/nfs/dbraw/zinc/90/36/52/418903652.db2.gz	OALBNPRODBTTJM-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000411430314	418903655	/nfs/dbraw/zinc/90/36/55/418903655.db2.gz	OALBNPRODBTTJM-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000411430314	418903658	/nfs/dbraw/zinc/90/36/58/418903658.db2.gz	OALBNPRODBTTJM-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@H]1C[C@H]1[N+](=O)[O-])CC2)C1CC1	ZINC000372840208	418907309	/nfs/dbraw/zinc/90/73/09/418907309.db2.gz	VWHYNTQPSQAING-FPMFFAJLSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@H+](C[C@@H]1CC12CCN(C(=O)[C@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840208	418907311	/nfs/dbraw/zinc/90/73/11/418907311.db2.gz	VWHYNTQPSQAING-FPMFFAJLSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840208	418907312	/nfs/dbraw/zinc/90/73/12/418907312.db2.gz	VWHYNTQPSQAING-FPMFFAJLSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420933437	419365650	/nfs/dbraw/zinc/36/56/50/419365650.db2.gz	FYGHRIPISSZYKS-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
CC1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](CO)O1	ZINC000420944539	419373511	/nfs/dbraw/zinc/37/35/11/419373511.db2.gz	SIJNLJSTZADROP-CQSZACIVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](CO)O1	ZINC000420944539	419373517	/nfs/dbraw/zinc/37/35/17/419373517.db2.gz	SIJNLJSTZADROP-CQSZACIVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000421701626	419689423	/nfs/dbraw/zinc/68/94/23/419689423.db2.gz	HZVJSHWLYFUTMT-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](CC)C[C@@H]2C)n1	ZINC000427393465	419652942	/nfs/dbraw/zinc/65/29/42/419652942.db2.gz	ZZDSLKBDXISRBV-MNOVXSKESA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@@H]2C)n1	ZINC000427393465	419652946	/nfs/dbraw/zinc/65/29/46/419652946.db2.gz	ZZDSLKBDXISRBV-MNOVXSKESA-N	1	1	309.370	1.366	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000428988701	419958409	/nfs/dbraw/zinc/95/84/09/419958409.db2.gz	ARZCVJZOSYXDDJ-VNHYZAJKSA-N	1	1	307.398	1.453	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@H+](CCO)C[C@H]2C)n1	ZINC000418994794	420041098	/nfs/dbraw/zinc/04/10/98/420041098.db2.gz	IEJFYMGDEXZMRF-QWHCGFSZSA-N	1	1	308.382	1.498	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[C@@H]([NH3+])[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000430955627	420221823	/nfs/dbraw/zinc/22/18/23/420221823.db2.gz	MCHQAZPYKWFYPB-DGCLKSJQSA-N	1	1	320.393	1.901	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN(CCN2CC[NH2+]CC2)C2CC2)cc1	ZINC000420363564	420239520	/nfs/dbraw/zinc/23/95/20/420239520.db2.gz	PLSSHWIZMFWVEK-UHFFFAOYSA-N	1	1	304.394	1.464	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]([NH3+])[C@@H](C)C1	ZINC000430946075	420218733	/nfs/dbraw/zinc/21/87/33/420218733.db2.gz	YYXIOKUZANYTAX-GXTWGEPZSA-N	1	1	320.393	1.901	20	5		DDBDMO
CC[C@](C)(C(=O)OC)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC1CC1	ZINC000425513150	420405677	/nfs/dbraw/zinc/40/56/77/420405677.db2.gz	OJKCMTMFWWXJOJ-OAHLLOKOSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000457094617	420609640	/nfs/dbraw/zinc/60/96/40/420609640.db2.gz	OUNWPHHDRXKANG-JTQLQIEISA-N	1	1	307.354	1.127	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]3NC(=O)OC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000493359145	420828876	/nfs/dbraw/zinc/82/88/76/420828876.db2.gz	QXIXAYAQGZHVCI-NEPJUHHUSA-N	1	1	321.333	1.534	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000525291586	421285553	/nfs/dbraw/zinc/28/55/53/421285553.db2.gz	KMTVASBYQLHLIX-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1	ZINC000548420030	421435351	/nfs/dbraw/zinc/43/53/51/421435351.db2.gz	BBWWAFPKCVDOEV-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
Cc1cccc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)c1[N+](=O)[O-]	ZINC000548717867	421465960	/nfs/dbraw/zinc/46/59/60/421465960.db2.gz	YTEBOPVBMAOLIB-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H]2CCC(=O)N(C)C2)cc1[N+](=O)[O-]	ZINC000563363914	421493657	/nfs/dbraw/zinc/49/36/57/421493657.db2.gz	NABPMAOJBBGZCZ-GFCCVEGCSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C(C)(C)C2)c1	ZINC000549725828	421506278	/nfs/dbraw/zinc/50/62/78/421506278.db2.gz	HVULLFFSPCJQHP-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C(C)(C)C2)c1	ZINC000549725828	421506280	/nfs/dbraw/zinc/50/62/80/421506280.db2.gz	HVULLFFSPCJQHP-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000551892048	421550247	/nfs/dbraw/zinc/55/02/47/421550247.db2.gz	BTGPGJFKHKATMS-SECBINFHSA-N	1	1	303.322	1.039	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000533831720	421683236	/nfs/dbraw/zinc/68/32/36/421683236.db2.gz	UDVWNTSYUHTQKS-AWEZNQCLSA-N	1	1	300.318	1.839	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000533831720	421683237	/nfs/dbraw/zinc/68/32/37/421683237.db2.gz	UDVWNTSYUHTQKS-AWEZNQCLSA-N	1	1	300.318	1.839	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)cc1[N+](=O)[O-]	ZINC000522188789	421818963	/nfs/dbraw/zinc/81/89/63/421818963.db2.gz	IPOGNXAPVPBNEK-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1nccc(C(N)=O)c1[N+](=O)[O-])CC2	ZINC000573890020	422032819	/nfs/dbraw/zinc/03/28/19/422032819.db2.gz	ATHILNXILFRXSX-UHFFFAOYSA-N	1	1	319.365	1.153	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594591227	422351777	/nfs/dbraw/zinc/35/17/77/422351777.db2.gz	IHRIXKCGSOYKKG-UPJWGTAASA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594591227	422351781	/nfs/dbraw/zinc/35/17/81/422351781.db2.gz	IHRIXKCGSOYKKG-UPJWGTAASA-N	1	1	308.382	2.208	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000344414493	272019761	/nfs/dbraw/zinc/01/97/61/272019761.db2.gz	AVDLWQIOGHIUDB-GXFFZTMASA-N	1	1	320.349	1.132	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])nc2)CC1	ZINC000344416435	272020818	/nfs/dbraw/zinc/02/08/18/272020818.db2.gz	JDYZOXRTRCPRKI-CYBMUJFWSA-N	1	1	307.398	1.675	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)n1	ZINC000344738696	272105514	/nfs/dbraw/zinc/10/55/14/272105514.db2.gz	ZSXYMHLSRLKIHT-LBPRGKRZSA-N	1	1	323.397	1.661	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000281367901	274267764	/nfs/dbraw/zinc/26/77/64/274267764.db2.gz	OICSYSOMQITISU-LLVKDONJSA-N	1	1	319.365	1.364	20	5		DDBDMO
C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1c1ccc(N)cc1[N+](=O)[O-]	ZINC000291240365	289048658	/nfs/dbraw/zinc/04/86/58/289048658.db2.gz	XJKQDEJMKVBYDD-DGCLKSJQSA-N	1	1	306.366	1.476	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000363103381	300211183	/nfs/dbraw/zinc/21/11/83/300211183.db2.gz	HVEBEGFFEYNWLO-KBPBESRZSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000364082710	300342046	/nfs/dbraw/zinc/34/20/46/300342046.db2.gz	JVISESNRMSOMRT-CHWSQXEVSA-N	1	1	318.377	1.750	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000367288881	300823309	/nfs/dbraw/zinc/82/33/09/300823309.db2.gz	ZOFNJOLSUALAAQ-LBPRGKRZSA-N	1	1	313.304	1.836	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000368587932	301059149	/nfs/dbraw/zinc/05/91/49/301059149.db2.gz	BUQQVMYWXKYPHJ-OCCSQVGLSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000369709209	301214964	/nfs/dbraw/zinc/21/49/64/301214964.db2.gz	CHJBGEOSVBZVHU-RBSFLKMASA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000369709209	301214966	/nfs/dbraw/zinc/21/49/66/301214966.db2.gz	CHJBGEOSVBZVHU-RBSFLKMASA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000369709209	301214969	/nfs/dbraw/zinc/21/49/69/301214969.db2.gz	CHJBGEOSVBZVHU-RBSFLKMASA-N	1	1	303.362	1.385	20	5		DDBDMO
Cc1nc([C@@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370025408	301260816	/nfs/dbraw/zinc/26/08/16/301260816.db2.gz	DTPGOMHDMKNGCQ-LLVKDONJSA-N	1	1	306.326	1.362	20	5		DDBDMO
Cc1nc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370025408	301260817	/nfs/dbraw/zinc/26/08/17/301260817.db2.gz	DTPGOMHDMKNGCQ-LLVKDONJSA-N	1	1	306.326	1.362	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000370083098	301272537	/nfs/dbraw/zinc/27/25/37/301272537.db2.gz	PLMWZWPMACITSL-MRXNPFEDSA-N	1	1	322.361	1.829	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000531970541	303268312	/nfs/dbraw/zinc/26/83/12/303268312.db2.gz	CRTUHCUNKJGXHM-UKRRQHHQSA-N	1	1	306.410	1.800	20	5		DDBDMO
COC(C)(C)C[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000533344765	303316148	/nfs/dbraw/zinc/31/61/48/303316148.db2.gz	GWHCNSOISMBARQ-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000533344765	303316150	/nfs/dbraw/zinc/31/61/50/303316150.db2.gz	GWHCNSOISMBARQ-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000533475138	303318913	/nfs/dbraw/zinc/31/89/13/303318913.db2.gz	RJFROIWPCLSTSY-UHFFFAOYSA-N	1	1	303.322	1.657	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073543	307012818	/nfs/dbraw/zinc/01/28/18/307012818.db2.gz	XNAXAFUMIYSNRX-VXGBXAGGSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073543	307012819	/nfs/dbraw/zinc/01/28/19/307012819.db2.gz	XNAXAFUMIYSNRX-VXGBXAGGSA-N	1	1	307.350	1.402	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1	ZINC000364443154	307045604	/nfs/dbraw/zinc/04/56/04/307045604.db2.gz	HVOZVJCTUQGROG-UHFFFAOYSA-N	1	1	306.366	1.735	20	5		DDBDMO
CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@H]3CC3[N+](=O)[O-])C2)CC1	ZINC000364485934	307046433	/nfs/dbraw/zinc/04/64/33/307046433.db2.gz	SKMBJLXENRHXNE-SOUVJXGZSA-N	1	1	309.410	1.622	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000366117964	307068324	/nfs/dbraw/zinc/06/83/24/307068324.db2.gz	GQLBEYOIFDGWQS-GFCCVEGCSA-N	1	1	322.390	1.253	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000366304616	307070406	/nfs/dbraw/zinc/07/04/06/307070406.db2.gz	ANBYSSWQTDZQJO-ZKYQVNSYSA-N	1	1	317.345	1.559	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000366584303	307076816	/nfs/dbraw/zinc/07/68/16/307076816.db2.gz	FIBVPLVQBQOHHL-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000366584303	307076817	/nfs/dbraw/zinc/07/68/17/307076817.db2.gz	FIBVPLVQBQOHHL-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c1	ZINC000375962493	307236160	/nfs/dbraw/zinc/23/61/60/307236160.db2.gz	OITWEWJVHKYBFR-OAHLLOKOSA-N	1	1	320.324	1.524	20	5		DDBDMO
Cc1ncccc1O[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000375976406	307237331	/nfs/dbraw/zinc/23/73/31/307237331.db2.gz	PAMCZJSOBSAGQH-CQSZACIVSA-N	1	1	317.349	1.648	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)Nc2c([N+](=O)[O-])ncn2C)CC1	ZINC000450925299	307306405	/nfs/dbraw/zinc/30/64/05/307306405.db2.gz	XYKLHDZOKVNLHH-UHFFFAOYSA-N	1	1	310.402	1.156	20	5		DDBDMO
CCc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000552341638	307820489	/nfs/dbraw/zinc/82/04/89/307820489.db2.gz	QYGWVYCRYFYMFO-SNVBAGLBSA-N	1	1	318.337	1.382	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000567345833	308078369	/nfs/dbraw/zinc/07/83/69/308078369.db2.gz	VTVMCALZTVGXPL-IPYPFGDCSA-N	1	1	323.393	1.407	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCSC[C@H]1C1CC1	ZINC000451646421	534320077	/nfs/dbraw/zinc/32/00/77/534320077.db2.gz	FKBCFBVPJHNJAB-ZDUSSCGKSA-N	1	1	309.391	1.584	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444622894	534354773	/nfs/dbraw/zinc/35/47/73/534354773.db2.gz	WUBJQYXNGXRTFS-SNVBAGLBSA-N	1	1	317.349	1.701	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444622894	534354779	/nfs/dbraw/zinc/35/47/79/534354779.db2.gz	WUBJQYXNGXRTFS-SNVBAGLBSA-N	1	1	317.349	1.701	20	5		DDBDMO
O=C1CCCN1CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000075470406	696420779	/nfs/dbraw/zinc/42/07/79/696420779.db2.gz	GXZJWDAESWDMCR-UHFFFAOYSA-N	1	1	318.377	1.339	20	5		DDBDMO
CO[C@H]1CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000076266131	696427930	/nfs/dbraw/zinc/42/79/30/696427930.db2.gz	SVPXZHLDSJJUMN-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000076266131	696427931	/nfs/dbraw/zinc/42/79/31/696427931.db2.gz	SVPXZHLDSJJUMN-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1ncccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000983653096	697286723	/nfs/dbraw/zinc/28/67/23/697286723.db2.gz	GRIOEBTZUZOQOY-NMFUWQPSSA-N	1	1	318.377	1.040	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000160149874	697315332	/nfs/dbraw/zinc/31/53/32/697315332.db2.gz	NLDSOTIFUFXVQC-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
C[NH+]1CCC(ONC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000773552411	697779214	/nfs/dbraw/zinc/77/92/14/697779214.db2.gz	OWZITKIWQOKTDF-UHFFFAOYSA-N	1	1	319.321	1.227	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN2CC[NH+]([C@H]3CCOC3)CC2)cc1	ZINC000776593482	698124226	/nfs/dbraw/zinc/12/42/26/698124226.db2.gz	JVTARQUHJAORIA-JKSUJKDBSA-N	1	1	321.377	1.035	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CCn3cc[nH+]c3C2)c2nonc21	ZINC000777801584	698223285	/nfs/dbraw/zinc/22/32/85/698223285.db2.gz	HHDDOICTXJGPQW-QMMMGPOBSA-N	1	1	300.278	1.754	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=S)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000730733781	699514796	/nfs/dbraw/zinc/51/47/96/699514796.db2.gz	OBFJHKYNSULUQM-LBPRGKRZSA-N	1	1	324.406	1.602	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588970	699642238	/nfs/dbraw/zinc/64/22/38/699642238.db2.gz	GZRZZILHJDSDEE-VBNZEHGJSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588970	699642239	/nfs/dbraw/zinc/64/22/39/699642239.db2.gz	GZRZZILHJDSDEE-VBNZEHGJSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000742197695	699866042	/nfs/dbraw/zinc/86/60/42/699866042.db2.gz	YBXJLCMDJUVXDY-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000742197695	699866044	/nfs/dbraw/zinc/86/60/44/699866044.db2.gz	YBXJLCMDJUVXDY-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000742238919	699868936	/nfs/dbraw/zinc/86/89/36/699868936.db2.gz	IQOPKKSCNFFZNH-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
CCc1[nH]nc(C(=O)OCC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000795612231	699878787	/nfs/dbraw/zinc/87/87/87/699878787.db2.gz	OVDZVBLOXMOURT-SNVBAGLBSA-N	1	1	310.354	1.912	20	5		DDBDMO
COc1ccc(OCCN2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000761075297	700839845	/nfs/dbraw/zinc/83/98/45/700839845.db2.gz	DODGVOIISCJACE-GFCCVEGCSA-N	1	1	309.366	1.618	20	5		DDBDMO
C[C@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@@H+]1C	ZINC000761078335	700840807	/nfs/dbraw/zinc/84/08/07/700840807.db2.gz	BOPKJHNCSHYIBW-SWLSCSKDSA-N	1	1	318.377	1.336	20	5		DDBDMO
C[C@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+]1C	ZINC000761078335	700840810	/nfs/dbraw/zinc/84/08/10/700840810.db2.gz	BOPKJHNCSHYIBW-SWLSCSKDSA-N	1	1	318.377	1.336	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000761287772	700854583	/nfs/dbraw/zinc/85/45/83/700854583.db2.gz	DZHJGXANIJJJND-LLVKDONJSA-N	1	1	318.333	1.705	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000761287772	700854585	/nfs/dbraw/zinc/85/45/85/700854585.db2.gz	DZHJGXANIJJJND-LLVKDONJSA-N	1	1	318.333	1.705	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000766974451	701076035	/nfs/dbraw/zinc/07/60/35/701076035.db2.gz	KMKMJPNGKDSIPO-UHFFFAOYSA-N	1	1	306.326	1.078	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000770474585	701279473	/nfs/dbraw/zinc/27/94/73/701279473.db2.gz	BOTKENIWKLUAQB-WDEREUQCSA-N	1	1	305.338	1.374	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000770474585	701279474	/nfs/dbraw/zinc/27/94/74/701279474.db2.gz	BOTKENIWKLUAQB-WDEREUQCSA-N	1	1	305.338	1.374	20	5		DDBDMO
C[C@H](NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576035	701898218	/nfs/dbraw/zinc/89/82/18/701898218.db2.gz	HKIVUIJNQFUYRK-UBHSHLNASA-N	1	1	320.393	1.691	20	5		DDBDMO
C[C@H]([NH2+]C[C@H]1CN2CCC[C@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576035	701898227	/nfs/dbraw/zinc/89/82/27/701898227.db2.gz	HKIVUIJNQFUYRK-UBHSHLNASA-N	1	1	320.393	1.691	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@](O)(C(F)F)C2)c1	ZINC000831175133	706650067	/nfs/dbraw/zinc/65/00/67/706650067.db2.gz	FVKYSZQPRMFPJK-DGCLKSJQSA-N	1	1	302.277	1.330	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)C2CC2)c(Cl)c1	ZINC000840965374	702296103	/nfs/dbraw/zinc/29/61/03/702296103.db2.gz	FGJLSOZVBXYSPN-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000817374759	702361566	/nfs/dbraw/zinc/36/15/66/702361566.db2.gz	VKXVOCPPFBBPFI-LBPRGKRZSA-N	1	1	320.349	1.486	20	5		DDBDMO
Cc1cc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c(N)c([N+](=O)[O-])c1	ZINC000817677555	702448195	/nfs/dbraw/zinc/44/81/95/702448195.db2.gz	XYAUDSJEAVRPAH-NSHDSACASA-N	1	1	306.366	1.652	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000817679649	702448909	/nfs/dbraw/zinc/44/89/09/702448909.db2.gz	VENUOKWZJGOQBL-ZIAGYGMSSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cc2noc(C[NH2+]C[C@@H]3CCCO3)n2)nc1	ZINC000843192703	702838349	/nfs/dbraw/zinc/83/83/49/702838349.db2.gz	XHOQPPBCYKAWFJ-LBPRGKRZSA-N	1	1	319.321	1.232	20	5		DDBDMO
COCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCOCC1	ZINC000879711141	706767286	/nfs/dbraw/zinc/76/72/86/706767286.db2.gz	BCXKBDKMGDZNBR-UHFFFAOYSA-N	1	1	312.370	1.227	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852412704	704038014	/nfs/dbraw/zinc/03/80/14/704038014.db2.gz	YDVZQMQTBDHKNW-GJZGRUSLSA-N	1	1	310.350	1.102	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000852569331	704076987	/nfs/dbraw/zinc/07/69/87/704076987.db2.gz	NJJDAAWLYLGWCZ-CYBMUJFWSA-N	1	1	311.338	1.258	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000819717202	704163439	/nfs/dbraw/zinc/16/34/39/704163439.db2.gz	DLLBHNNWHKXCCQ-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853513385	704255661	/nfs/dbraw/zinc/25/56/61/704255661.db2.gz	ZFMHMJVKGIFFOX-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853513385	704255663	/nfs/dbraw/zinc/25/56/63/704255663.db2.gz	ZFMHMJVKGIFFOX-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000853799555	704317200	/nfs/dbraw/zinc/31/72/00/704317200.db2.gz	MGYRYBZROIGGRQ-NEPJUHHUSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000853799555	704317203	/nfs/dbraw/zinc/31/72/03/704317203.db2.gz	MGYRYBZROIGGRQ-NEPJUHHUSA-N	1	1	319.365	1.764	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H]1CCC[N@@H+]2C	ZINC000874848149	705201594	/nfs/dbraw/zinc/20/15/94/705201594.db2.gz	RUWYMZWEGNRLQP-KGLIPLIRSA-N	1	1	304.350	1.607	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](n3ccnn3)C2)c1	ZINC000823469102	705250235	/nfs/dbraw/zinc/25/02/35/705250235.db2.gz	OQPLJUWJXPHQFP-LSDHHAIUSA-N	1	1	317.349	1.557	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000825336864	705649154	/nfs/dbraw/zinc/64/91/54/705649154.db2.gz	ADUCSIAUWATCGN-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
Cc1ccc(CNC(=O)[C@@H](C)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000825648582	705708962	/nfs/dbraw/zinc/70/89/62/705708962.db2.gz	UYDVGOFQVUIFSW-CYBMUJFWSA-N	1	1	320.393	1.155	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825970057	705752928	/nfs/dbraw/zinc/75/29/28/705752928.db2.gz	USNJYLOMLVRRAR-DOMZBBRYSA-N	1	1	321.377	1.428	20	5		DDBDMO
CN(CC(F)F)C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000876776155	705871965	/nfs/dbraw/zinc/87/19/65/705871965.db2.gz	KMVYAHVNENBZKX-UHFFFAOYSA-N	1	1	317.340	1.490	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000863327585	705903241	/nfs/dbraw/zinc/90/32/41/705903241.db2.gz	OQKKQSKOXUMNAX-SNVBAGLBSA-N	1	1	313.741	1.045	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000863945228	706042891	/nfs/dbraw/zinc/04/28/91/706042891.db2.gz	YLDRXHHQYYYJMG-JTQLQIEISA-N	1	1	313.741	1.045	20	5		DDBDMO
CC(C)[N@@H+](CCc1nnnn1C)Cc1ccc([N+](=O)[O-])cc1	ZINC000877993069	706259921	/nfs/dbraw/zinc/25/99/21/706259921.db2.gz	WRARRPAVKWMWTP-UHFFFAOYSA-N	1	1	304.354	1.571	20	5		DDBDMO
C[C@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C	ZINC000878317612	706356654	/nfs/dbraw/zinc/35/66/54/706356654.db2.gz	RXYOXFPOZPTTOU-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C	ZINC000878317612	706356658	/nfs/dbraw/zinc/35/66/58/706356658.db2.gz	RXYOXFPOZPTTOU-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCCN1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000880070661	706870336	/nfs/dbraw/zinc/87/03/36/706870336.db2.gz	JHAUWQQTFOXKCO-UONOGXRCSA-N	1	1	321.377	1.115	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867475953	707012956	/nfs/dbraw/zinc/01/29/56/707012956.db2.gz	NUMBGGGJMYZCAF-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
CCOC(=O)[C@H]1NCC[C@@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000873296977	707802124	/nfs/dbraw/zinc/80/21/24/707802124.db2.gz	ORDBLJNXCCSDEL-JKOKRWQUSA-N	1	1	307.350	1.539	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)n1	ZINC000897221941	708259500	/nfs/dbraw/zinc/25/95/00/708259500.db2.gz	QOMCJTZXKNQCEC-QWHCGFSZSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886027723	708684044	/nfs/dbraw/zinc/68/40/44/708684044.db2.gz	HWNNUCUNMQPQMH-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
O=C1NCCCN1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886081854	708694530	/nfs/dbraw/zinc/69/45/30/708694530.db2.gz	ZOJPNEOSJUEFMC-UHFFFAOYSA-N	1	1	319.365	1.370	20	5		DDBDMO
CC(C)N(C)S(=O)(=O)c1ccc(C[NH2+]CC[N+](=O)[O-])cc1	ZINC000899873399	709223702	/nfs/dbraw/zinc/22/37/02/709223702.db2.gz	NZTHPRYUFJYIFA-UHFFFAOYSA-N	1	1	315.395	1.082	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C	ZINC000900159757	709310861	/nfs/dbraw/zinc/31/08/61/709310861.db2.gz	PVFIATGNZBNBEY-SWLSCSKDSA-N	1	1	307.350	1.008	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000890080226	709739035	/nfs/dbraw/zinc/73/90/35/709739035.db2.gz	ZJACOTZZZAVULN-UHFFFAOYSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000913095971	713161906	/nfs/dbraw/zinc/16/19/06/713161906.db2.gz	ACVRCHDLJXGUKT-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095971	713161907	/nfs/dbraw/zinc/16/19/07/713161907.db2.gz	ACVRCHDLJXGUKT-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095971	713161908	/nfs/dbraw/zinc/16/19/08/713161908.db2.gz	ACVRCHDLJXGUKT-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
CN1CC[C@@H]1CNc1nc(NC[C@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000895770309	711601333	/nfs/dbraw/zinc/60/13/33/711601333.db2.gz	LUBOMHMXXRLYHB-VXGBXAGGSA-N	1	1	320.397	1.222	20	5		DDBDMO
CC(C)NC(=O)c1ccc(NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895776591	711604171	/nfs/dbraw/zinc/60/41/71/711604171.db2.gz	KNLBFGQWGJWFEQ-GFCCVEGCSA-N	1	1	306.366	1.849	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C1CN(C)CC[N@@H+](C)C1	ZINC000906065317	712235169	/nfs/dbraw/zinc/23/51/69/712235169.db2.gz	TUKZSQXYQVZTPS-UHFFFAOYSA-N	1	1	320.393	1.047	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000929411493	713605039	/nfs/dbraw/zinc/60/50/39/713605039.db2.gz	JXVFFXMCIUJKHD-OAHLLOKOSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1C[C@H]2COC[C@@H]2O1	ZINC000930353097	713811984	/nfs/dbraw/zinc/81/19/84/713811984.db2.gz	HFWIBODEMPHSNK-BPUTZDHNSA-N	1	1	306.362	1.873	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1	ZINC000931311822	714062704	/nfs/dbraw/zinc/06/27/04/714062704.db2.gz	PPYRQDFKJMZAMU-YESZJQIVSA-N	1	1	319.405	1.902	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000923330840	714317186	/nfs/dbraw/zinc/31/71/86/714317186.db2.gz	CJSDOWYUUOJWJF-DTZQCDIJSA-N	1	1	305.378	1.687	20	5		DDBDMO
CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1	ZINC000923335928	714319524	/nfs/dbraw/zinc/31/95/24/714319524.db2.gz	SGXPIPUFIDIMDB-UONOGXRCSA-N	1	1	323.393	1.408	20	5		DDBDMO
CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[NH2+]CC1	ZINC000923335925	714319693	/nfs/dbraw/zinc/31/96/93/714319693.db2.gz	SGXPIPUFIDIMDB-KBPBESRZSA-N	1	1	323.393	1.408	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN(C[C@@H]2CC3(C[NH2+]C3)CO2)C2CC2)c1	ZINC000923369619	714330506	/nfs/dbraw/zinc/33/05/06/714330506.db2.gz	LSDPJGXOWKBUFW-INIZCTEOSA-N	1	1	317.389	1.938	20	5		DDBDMO
[NH3+]C[C@]12CCC[C@H]1CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000923386842	714337300	/nfs/dbraw/zinc/33/73/00/714337300.db2.gz	KGYCYAZVJKMENV-BPUTZDHNSA-N	1	1	305.378	1.689	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000933226547	714541807	/nfs/dbraw/zinc/54/18/07/714541807.db2.gz	JMFNDMSMCYKMTC-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000933226547	714541809	/nfs/dbraw/zinc/54/18/09/714541809.db2.gz	JMFNDMSMCYKMTC-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000933869189	714688497	/nfs/dbraw/zinc/68/84/97/714688497.db2.gz	PKBKHMFHYYYMQL-UHFFFAOYSA-N	1	1	323.349	1.419	20	5		DDBDMO
C/C(=C/C(=O)NC[C@@H]1C[C@@H](O)C[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000924982131	714714960	/nfs/dbraw/zinc/71/49/60/714714960.db2.gz	OPLBNAWKSQZRGY-XSNQJSSTSA-N	1	1	319.361	1.179	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1C[C@@H](O)C[N@@H+]1C	ZINC000924990256	714718460	/nfs/dbraw/zinc/71/84/60/714718460.db2.gz	UYVVSLXYMFQWSO-QWHCGFSZSA-N	1	1	321.377	1.315	20	5		DDBDMO
Cc1c(CN2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)cccc1[N+](=O)[O-]	ZINC000934257980	714777783	/nfs/dbraw/zinc/77/77/83/714777783.db2.gz	KSAIBTGNYBTRMG-IRXDYDNUSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H]3[C@@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257980	714777784	/nfs/dbraw/zinc/77/77/84/714777784.db2.gz	KSAIBTGNYBTRMG-IRXDYDNUSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H]3[C@@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257980	714777785	/nfs/dbraw/zinc/77/77/85/714777785.db2.gz	KSAIBTGNYBTRMG-IRXDYDNUSA-N	1	1	319.405	1.934	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H](O)[C@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570369	714854189	/nfs/dbraw/zinc/85/41/89/714854189.db2.gz	DXABTQLKKXUEBN-ZWNOBZJWSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H](O)[C@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570369	714854191	/nfs/dbraw/zinc/85/41/91/714854191.db2.gz	DXABTQLKKXUEBN-ZWNOBZJWSA-N	1	1	311.313	1.328	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@@H+](C)C[C@H]2C)n1	ZINC001164631363	719254283	/nfs/dbraw/zinc/25/42/83/719254283.db2.gz	DODQEMVSIJWTFV-DTWKUNHWSA-N	1	1	322.369	1.180	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@H+](C)C[C@H]2C)n1	ZINC001164631363	719254285	/nfs/dbraw/zinc/25/42/85/719254285.db2.gz	DODQEMVSIJWTFV-DTWKUNHWSA-N	1	1	322.369	1.180	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CCC2=CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020140113	736999314	/nfs/dbraw/zinc/99/93/14/736999314.db2.gz	ZFPSHOSHBVIVQW-KBUPBQIOSA-N	1	1	307.394	1.779	20	5		DDBDMO
C[C@@H](NC(=O)[C@]1(C)C[C@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000928246692	740129858	/nfs/dbraw/zinc/12/98/58/740129858.db2.gz	LBZJLXMFZLQIGH-DGFSRKRXSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134283	743704957	/nfs/dbraw/zinc/70/49/57/743704957.db2.gz	GUQDOYDNBAQSQB-YPMHNXCESA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134283	743704960	/nfs/dbraw/zinc/70/49/60/743704960.db2.gz	GUQDOYDNBAQSQB-YPMHNXCESA-N	1	1	300.742	1.566	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)C1CCC1	ZINC001031511135	746923291	/nfs/dbraw/zinc/92/32/91/746923291.db2.gz	WVONHQBNCWLOLK-UHFFFAOYSA-N	1	1	303.362	1.943	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CC=C(Cl)Cl)CC1	ZINC001200472495	748265119	/nfs/dbraw/zinc/26/51/19/748265119.db2.gz	PNANYOXMTLJYMC-NXEZZACHSA-N	1	1	322.192	1.551	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2C[C@H]3CN(CC4CC4)C[C@@H](C2)O3)C1	ZINC001169023824	762201939	/nfs/dbraw/zinc/20/19/39/762201939.db2.gz	FLWKVSDPPWPYRE-YHUYYLMFSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H](N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023824	762201943	/nfs/dbraw/zinc/20/19/43/762201943.db2.gz	FLWKVSDPPWPYRE-YHUYYLMFSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H](N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023824	762201947	/nfs/dbraw/zinc/20/19/47/762201947.db2.gz	FLWKVSDPPWPYRE-YHUYYLMFSA-N	1	1	309.410	1.227	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC001097212359	756981551	/nfs/dbraw/zinc/98/15/51/756981551.db2.gz	ROJYNRAGWMRGRV-TXEJJXNPSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001020139543	760614108	/nfs/dbraw/zinc/61/41/08/760614108.db2.gz	DRJFMGCLRCNGMC-KLHDSHLOSA-N	1	1	317.389	1.651	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCCN(C)C(=O)C2)c([N+](=O)[O-])c1	ZINC001170346446	766277124	/nfs/dbraw/zinc/27/71/24/766277124.db2.gz	NOIUMFORBYBZMH-GFCCVEGCSA-N	1	1	321.377	1.699	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCCN(C)C(=O)C2)c([N+](=O)[O-])c1	ZINC001170346446	766277129	/nfs/dbraw/zinc/27/71/29/766277129.db2.gz	NOIUMFORBYBZMH-GFCCVEGCSA-N	1	1	321.377	1.699	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)C[NH+]1CCOCC1	ZINC001135505166	771539515	/nfs/dbraw/zinc/53/95/15/771539515.db2.gz	ZDGPXCNKULJCIK-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cc1cnc(NCCNC(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC001093674083	774989452	/nfs/dbraw/zinc/98/94/52/774989452.db2.gz	NMSNINFGSYFVNA-UHFFFAOYSA-N	1	1	309.370	1.167	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001094517016	775973498	/nfs/dbraw/zinc/97/34/98/775973498.db2.gz	AZMZMOFVQORXAA-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCCO1	ZINC001173231936	777063965	/nfs/dbraw/zinc/06/39/65/777063965.db2.gz	PAVWENMSIMTQIQ-IUODEOHRSA-N	1	1	322.361	1.790	20	5		DDBDMO
O=[N+]([O-])c1cccc(Br)c1C[NH2+]C/C=C\CO	ZINC001179122375	779288532	/nfs/dbraw/zinc/28/85/32/779288532.db2.gz	AFHDZCXFBREBOH-UPHRSURJSA-N	1	1	301.140	1.995	20	5		DDBDMO
C[C@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)S(C)(=O)=O	ZINC000697622141	779668751	/nfs/dbraw/zinc/66/87/51/779668751.db2.gz	VIHYXOFQLLFZKV-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
C[NH+]1CC(C(=O)n2c3ccccc3cc3c(=O)c(N)ccc2-3)C1	ZINC001142599053	861192595	/nfs/dbraw/zinc/19/25/95/861192595.db2.gz	MVDXWLZHLAFOPC-UHFFFAOYSA-N	1	1	307.353	1.890	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1c[nH]c2cccc([N+](=O)[O-])c21	ZINC001149204105	861486528	/nfs/dbraw/zinc/48/65/28/861486528.db2.gz	FRNWANJAEDXYKS-UHFFFAOYSA-N	1	1	320.349	1.072	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC001150030319	862037802	/nfs/dbraw/zinc/03/78/02/862037802.db2.gz	LHNSTEVKAGJJNX-PWSUYJOCSA-N	1	1	320.349	1.252	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCC(F)(F)F)C2	ZINC001072725831	857641940	/nfs/dbraw/zinc/64/19/40/857641940.db2.gz	SBVFLBKDPCWZAS-NXEZZACHSA-N	1	1	321.299	1.138	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CCC(F)(F)F)C2	ZINC001072725831	857641944	/nfs/dbraw/zinc/64/19/44/857641944.db2.gz	SBVFLBKDPCWZAS-NXEZZACHSA-N	1	1	321.299	1.138	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCC(F)(F)F)C2	ZINC001072725831	857641947	/nfs/dbraw/zinc/64/19/47/857641947.db2.gz	SBVFLBKDPCWZAS-NXEZZACHSA-N	1	1	321.299	1.138	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC001328498508	863009326	/nfs/dbraw/zinc/00/93/26/863009326.db2.gz	CFNDFCMMUODFCL-LLVKDONJSA-N	1	1	306.366	1.700	20	5		DDBDMO
Nc1c(Cl)cc(C(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC001156480235	863085959	/nfs/dbraw/zinc/08/59/59/863085959.db2.gz	XPEBFGOXVDGMIH-UHFFFAOYSA-N	1	1	324.768	1.822	20	5		DDBDMO
CO[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC001331097077	864852313	/nfs/dbraw/zinc/85/23/13/864852313.db2.gz	DOMPHTWDTMLJAU-JTQLQIEISA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC001331097077	864852323	/nfs/dbraw/zinc/85/23/23/864852323.db2.gz	DOMPHTWDTMLJAU-JTQLQIEISA-N	1	1	304.306	1.866	20	5		DDBDMO
CC[C@]([NH3+])(CO)Nc1nc(SC)nc(Cl)c1[N+](=O)[O-]	ZINC001159744214	865497476	/nfs/dbraw/zinc/49/74/76/865497476.db2.gz	SDXFVXRXEKURSA-SECBINFHSA-N	1	1	307.763	1.229	20	5		DDBDMO
Nc1cc(NCC[C@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-]	ZINC001162813674	867847390	/nfs/dbraw/zinc/84/73/90/867847390.db2.gz	YAYLIDKJRIZVBK-MRVPVSSYSA-N	1	1	301.297	1.619	20	5		DDBDMO
CN1CC[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)C1=O	ZINC001166691599	870158028	/nfs/dbraw/zinc/15/80/28/870158028.db2.gz	AAKBOSNYOYCVDN-ZDUSSCGKSA-N	1	1	304.350	1.225	20	5		DDBDMO
CN1CC[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)C1=O	ZINC001166691599	870158033	/nfs/dbraw/zinc/15/80/33/870158033.db2.gz	AAKBOSNYOYCVDN-ZDUSSCGKSA-N	1	1	304.350	1.225	20	5		DDBDMO
C[C@H](c1nnc(N2CC[N@H+](C3CCC3)C[C@H](C)C2)n1C)[N+](=O)[O-]	ZINC001339670214	870618693	/nfs/dbraw/zinc/61/86/93/870618693.db2.gz	XTGJCMIDGUKNOV-NWDGAFQWSA-N	1	1	322.413	1.463	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001303985494	871173335	/nfs/dbraw/zinc/17/33/35/871173335.db2.gz	GWBLCGCKJWKYBM-AWEZNQCLSA-N	1	1	321.377	1.820	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001308109352	871472285	/nfs/dbraw/zinc/47/22/85/871472285.db2.gz	VMMLXNVERUDWHG-ZFWWWQNUSA-N	1	1	321.377	1.428	20	5		DDBDMO
Cc1cc(NC(=O)NC[C@@]2(O)CC[N@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001311323312	871694056	/nfs/dbraw/zinc/69/40/56/871694056.db2.gz	UGWMFVKADKRFDH-AWEZNQCLSA-N	1	1	308.338	1.091	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001347505017	874165496	/nfs/dbraw/zinc/16/54/96/874165496.db2.gz	UOOJJDVBKDPNPE-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1ncc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001227109368	882840769	/nfs/dbraw/zinc/84/07/69/882840769.db2.gz	XZLKVQHOLCZVLD-DOFRTFSJSA-N	1	1	308.294	1.902	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC001215997636	876839359	/nfs/dbraw/zinc/83/93/59/876839359.db2.gz	FYBRDTLDTPMSEL-UHFFFAOYSA-N	1	1	307.354	1.265	20	5		DDBDMO
COC(=O)c1sc([N+](=O)[O-])cc1O[C@H]1C[NH+]2CCC1CC2	ZINC001227542213	883069937	/nfs/dbraw/zinc/06/99/37/883069937.db2.gz	VSCIGPREPUCZMT-JTQLQIEISA-N	1	1	312.347	1.916	20	5		DDBDMO
Nc1cc(N2CC[NH+](Cc3ccsc3)CC2)ncc1[N+](=O)[O-]	ZINC001354063665	877725198	/nfs/dbraw/zinc/72/51/98/877725198.db2.gz	YLCKJVQNLSZDNA-UHFFFAOYSA-N	1	1	319.390	1.956	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCc2ccc([N+](=O)[O-])cc2C(=O)OC)C1	ZINC001223449765	880966128	/nfs/dbraw/zinc/96/61/28/880966128.db2.gz	GTWKJWITLIWEKS-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCc2cc(C(=O)OC)cc([N+](=O)[O-])c2)C1	ZINC001223688265	881057443	/nfs/dbraw/zinc/05/74/43/881057443.db2.gz	HEDWMPUGYOOTKV-AWEZNQCLSA-N	1	1	308.334	1.992	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C	ZINC001227696121	883136783	/nfs/dbraw/zinc/13/67/83/883136783.db2.gz	KQILJZKDNQPLOD-BHYNMZESSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001227696121	883136792	/nfs/dbraw/zinc/13/67/92/883136792.db2.gz	KQILJZKDNQPLOD-BHYNMZESSA-N	1	1	306.318	1.786	20	5		DDBDMO
[NH2+]=C(NO)c1ccc(O[C@@H](C[N+](=O)[O-])c2cccnc2)cc1F	ZINC001229083104	883805504	/nfs/dbraw/zinc/80/55/04/883805504.db2.gz	NFTAOELZNJEDTR-ZDUSSCGKSA-N	1	1	320.280	1.922	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]1CC(=O)C2	ZINC001229486051	884006524	/nfs/dbraw/zinc/00/65/24/884006524.db2.gz	DKJKMWUBHCFRLQ-BHYNMZESSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]1CC(=O)C2	ZINC001229486051	884006542	/nfs/dbraw/zinc/00/65/42/884006542.db2.gz	DKJKMWUBHCFRLQ-BHYNMZESSA-N	1	1	317.301	1.919	20	5		DDBDMO
COC(=O)c1cc(O[C@H]2CCC[N@@H+](C)C2)c(F)cc1[N+](=O)[O-]	ZINC001229942925	884240880	/nfs/dbraw/zinc/24/08/80/884240880.db2.gz	RHZOZWAZWOTFJM-VIFPVBQESA-N	1	1	312.297	1.994	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCCC[C@@](O)(C[NH3+])C1	ZINC001246559075	892698938	/nfs/dbraw/zinc/69/89/38/892698938.db2.gz	NFEMFNYYOHHEDD-CZUORRHYSA-N	1	1	307.394	1.702	20	5		DDBDMO
O=C1NCC[C@]12CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254598327	896523747	/nfs/dbraw/zinc/52/37/47/896523747.db2.gz	WHRJMOOUTXTYJI-WBVHZDCISA-N	1	1	315.373	1.664	20	5		DDBDMO
Cc1nc(NCC(C)(C)[NH+]2CCN(C)CC2)ncc1[N+](=O)[O-]	ZINC001261260735	899438689	/nfs/dbraw/zinc/43/86/89/899438689.db2.gz	WLLIYZONBHKYMN-UHFFFAOYSA-N	1	1	308.386	1.131	20	5		DDBDMO
CC(C)[N@H+](C)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC001262564503	900248154	/nfs/dbraw/zinc/24/81/54/900248154.db2.gz	KFUSBHGQBYNKDU-ZDUSSCGKSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC001262564503	900248163	/nfs/dbraw/zinc/24/81/63/900248163.db2.gz	KFUSBHGQBYNKDU-ZDUSSCGKSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC001262653033	900286857	/nfs/dbraw/zinc/28/68/57/900286857.db2.gz	XHKBYSXPPAIUHU-GFCCVEGCSA-N	1	1	306.366	1.607	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000295611727	529381910	/nfs/dbraw/zinc/38/19/10/529381910.db2.gz	DEXGORMKOFCEOI-SNVBAGLBSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@]12C[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000451378523	231081856	/nfs/dbraw/zinc/08/18/56/231081856.db2.gz	YCSRAVJDXLUOAI-CQOGHXNDSA-N	1	1	318.377	1.296	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000444260994	529465198	/nfs/dbraw/zinc/46/51/98/529465198.db2.gz	PYIDFOUHGSIRQS-WDEREUQCSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000444260994	529465199	/nfs/dbraw/zinc/46/51/99/529465199.db2.gz	PYIDFOUHGSIRQS-WDEREUQCSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000444260994	529465200	/nfs/dbraw/zinc/46/52/00/529465200.db2.gz	PYIDFOUHGSIRQS-WDEREUQCSA-N	1	1	323.397	1.825	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000495225947	529572443	/nfs/dbraw/zinc/57/24/43/529572443.db2.gz	RAYRPTQGVKLPHB-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000495225947	529572448	/nfs/dbraw/zinc/57/24/48/529572448.db2.gz	RAYRPTQGVKLPHB-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000425061242	529822392	/nfs/dbraw/zinc/82/23/92/529822392.db2.gz	YLMMHAYYKAYRAJ-IINYFYTJSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000425061242	529822394	/nfs/dbraw/zinc/82/23/94/529822394.db2.gz	YLMMHAYYKAYRAJ-IINYFYTJSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000413761742	529823461	/nfs/dbraw/zinc/82/34/61/529823461.db2.gz	TVNUYPQGHWIAEE-LQKXBSAESA-N	1	1	315.373	1.718	20	5		DDBDMO
CS(=O)(=O)C1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000279620847	215011393	/nfs/dbraw/zinc/01/13/93/215011393.db2.gz	GVCSBPMNUOGORM-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000121246230	185771158	/nfs/dbraw/zinc/77/11/58/185771158.db2.gz	JFAWDLMMMDJZQS-DOMZBBRYSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](O)C(C)(C)C1	ZINC000279723180	215092169	/nfs/dbraw/zinc/09/21/69/215092169.db2.gz	IZHYQCNXYGYLIX-GWCFXTLKSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](O)C(C)(C)C1	ZINC000279723180	215092171	/nfs/dbraw/zinc/09/21/71/215092171.db2.gz	IZHYQCNXYGYLIX-GWCFXTLKSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)ccc1[N+](=O)[O-]	ZINC000423972649	282568588	/nfs/dbraw/zinc/56/85/88/282568588.db2.gz	PQDPJHVAECWWPP-ZDUSSCGKSA-N	1	1	315.333	1.115	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000152405054	186069481	/nfs/dbraw/zinc/06/94/81/186069481.db2.gz	RGPPVTKDTFTQJF-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
C[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O	ZINC000189934968	186251812	/nfs/dbraw/zinc/25/18/12/186251812.db2.gz	USDGHNLPZYFILW-NSHDSACASA-N	1	1	313.423	1.933	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046996646	352475997	/nfs/dbraw/zinc/47/59/97/352475997.db2.gz	MJJUUVWLZXSUKG-UONOGXRCSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1	ZINC000047648871	352506567	/nfs/dbraw/zinc/50/65/67/352506567.db2.gz	BBCYMJUKADYPRY-ZDUSSCGKSA-N	1	1	318.333	1.803	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000052153562	352601433	/nfs/dbraw/zinc/60/14/33/352601433.db2.gz	STDCTHQSRAJDGZ-UHFFFAOYSA-N	1	1	322.296	1.434	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000067717829	353064330	/nfs/dbraw/zinc/06/43/30/353064330.db2.gz	SIGPXVNLZPEMHE-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000067837660	353070157	/nfs/dbraw/zinc/07/01/57/353070157.db2.gz	SONSJJQFVUKQLN-HZPDHXFCSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000074105423	353292878	/nfs/dbraw/zinc/29/28/78/353292878.db2.gz	HCMCREPAJFPRHM-GFCCVEGCSA-N	1	1	307.350	1.435	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000174473450	198339026	/nfs/dbraw/zinc/33/90/26/198339026.db2.gz	CWGQFEKWTDUFDR-CYBMUJFWSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000079914528	353581861	/nfs/dbraw/zinc/58/18/61/353581861.db2.gz	DEONKRBEWHLUJN-NSHDSACASA-N	1	1	306.366	1.980	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000079914524	353582166	/nfs/dbraw/zinc/58/21/66/353582166.db2.gz	DEONKRBEWHLUJN-LLVKDONJSA-N	1	1	306.366	1.980	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)c1	ZINC000088718357	353758137	/nfs/dbraw/zinc/75/81/37/353758137.db2.gz	PAPWLLYPXZHOOK-ZDUSSCGKSA-N	1	1	320.393	1.903	20	5		DDBDMO
CC(C)(C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1)n1cc([N+](=O)[O-])cn1	ZINC000108298392	353948990	/nfs/dbraw/zinc/94/89/90/353948990.db2.gz	BDQWAIYUVUKWCM-GFCCVEGCSA-N	1	1	321.381	1.127	20	5		DDBDMO
CC(C)(C(=O)NC[C@H]1CC[N@H+](C2CC2)C1)n1cc([N+](=O)[O-])cn1	ZINC000102487500	353926066	/nfs/dbraw/zinc/92/60/66/353926066.db2.gz	IXKCERWYBJYYAH-LLVKDONJSA-N	1	1	321.381	1.127	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000108345023	353951409	/nfs/dbraw/zinc/95/14/09/353951409.db2.gz	FLPZUFDKBKLSJD-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC000142253055	354144198	/nfs/dbraw/zinc/14/41/98/354144198.db2.gz	TZBVPRAAJYYMKP-ZDUSSCGKSA-N	1	1	319.361	1.670	20	5		DDBDMO
CCc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157276944	354224173	/nfs/dbraw/zinc/22/41/73/354224173.db2.gz	QJMLRCIQRMYOIY-XHDPSFHLSA-N	1	1	321.377	1.606	20	5		DDBDMO
CCc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157276944	354224175	/nfs/dbraw/zinc/22/41/75/354224175.db2.gz	QJMLRCIQRMYOIY-XHDPSFHLSA-N	1	1	321.377	1.606	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423369	354225071	/nfs/dbraw/zinc/22/50/71/354225071.db2.gz	QHMBDNCOKOSXEB-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423369	354225074	/nfs/dbraw/zinc/22/50/74/354225074.db2.gz	QHMBDNCOKOSXEB-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
COCC[N@@H+](C)CCNc1ncnc2ccc([N+](=O)[O-])cc21	ZINC000316061822	354500157	/nfs/dbraw/zinc/50/01/57/354500157.db2.gz	JWJBRXFMOHGPBW-UHFFFAOYSA-N	1	1	305.338	1.528	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCC[C@@](CO)(OC)C2)cc1[N+](=O)[O-]	ZINC000401782131	354667254	/nfs/dbraw/zinc/66/72/54/354667254.db2.gz	QVPHZXVFRPZQFM-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@](CO)(OC)C2)cc1[N+](=O)[O-]	ZINC000401782131	354667257	/nfs/dbraw/zinc/66/72/57/354667257.db2.gz	QVPHZXVFRPZQFM-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@H]2O)c1	ZINC000585800600	354848999	/nfs/dbraw/zinc/84/89/99/354848999.db2.gz	ASSFKBLNZGTBAM-RRFJBIMHSA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@H]2O)c1	ZINC000585800600	354849002	/nfs/dbraw/zinc/84/90/02/354849002.db2.gz	ASSFKBLNZGTBAM-RRFJBIMHSA-N	1	1	324.381	1.043	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588861872	354944502	/nfs/dbraw/zinc/94/45/02/354944502.db2.gz	VTYRTBXSUPIVGC-NEPJUHHUSA-N	1	1	323.324	1.015	20	5		DDBDMO
CC(C)[N@H+](C)C[C@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000589958357	355035299	/nfs/dbraw/zinc/03/52/99/355035299.db2.gz	PQPNPDDMFYFZAG-JTQLQIEISA-N	1	1	323.349	1.782	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590010567	355040351	/nfs/dbraw/zinc/04/03/51/355040351.db2.gz	PDPQJENEMDJWFL-BXUZGUMPSA-N	1	1	304.350	1.169	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590044202	355042465	/nfs/dbraw/zinc/04/24/65/355042465.db2.gz	IFRXHFZPJYPXOM-UKRRQHHQSA-N	1	1	303.362	1.933	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH+](C)C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000590403321	355085437	/nfs/dbraw/zinc/08/54/37/355085437.db2.gz	KSBNHEGZLQRNQW-GXSJLCMTSA-N	1	1	309.370	1.435	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC(C[NH+]3CCOCC3)C2)c(Cl)c1	ZINC000590568112	355115838	/nfs/dbraw/zinc/11/58/38/355115838.db2.gz	QRSPEMZDSGEEHF-UHFFFAOYSA-N	1	1	312.757	1.412	20	5		DDBDMO
C[N@H+]1CCCN(CCCNc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000591143046	355254324	/nfs/dbraw/zinc/25/43/24/355254324.db2.gz	NUHORQMEKVNSJU-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
CN1CCC[N@H+](CCCNc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000591143046	355254327	/nfs/dbraw/zinc/25/43/27/355254327.db2.gz	NUHORQMEKVNSJU-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
CN1CCC[N@@H+](CCCNc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000591143046	355254329	/nfs/dbraw/zinc/25/43/29/355254329.db2.gz	NUHORQMEKVNSJU-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
CC(=O)N[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000591476883	355320846	/nfs/dbraw/zinc/32/08/46/355320846.db2.gz	MSMQDDOOUPBNLU-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000591687930	355363096	/nfs/dbraw/zinc/36/30/96/355363096.db2.gz	IRHQYYRGUWIWLY-OAHLLOKOSA-N	1	1	312.329	1.777	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@@H]2CO)c1	ZINC000593024740	355772918	/nfs/dbraw/zinc/77/29/18/355772918.db2.gz	LOCXTLDBABTFBF-HZMBPMFUSA-N	1	1	308.334	1.584	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000594195393	356136185	/nfs/dbraw/zinc/13/61/85/356136185.db2.gz	GKRZYTBDVXILAL-JSGCOSHPSA-N	1	1	304.350	1.737	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cn2cc(C[N@H+]3CCC[C@@H]3CO)nn2)cc1	ZINC000594651937	356275434	/nfs/dbraw/zinc/27/54/34/356275434.db2.gz	PMVGDBONKBGAAF-OAHLLOKOSA-N	1	1	317.349	1.191	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cn2cc(C[N@@H+]3CCC[C@@H]3CO)nn2)cc1	ZINC000594651937	356275438	/nfs/dbraw/zinc/27/54/38/356275438.db2.gz	PMVGDBONKBGAAF-OAHLLOKOSA-N	1	1	317.349	1.191	20	5		DDBDMO
CCO[C@H]1C[C@@](CO)([NH2+]Cc2onc(C)c2[N+](=O)[O-])C1(C)C	ZINC000595447078	356496790	/nfs/dbraw/zinc/49/67/90/356496790.db2.gz	FTBFXJHVHYOBAN-FZMZJTMJSA-N	1	1	313.354	1.547	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000081519636	192279786	/nfs/dbraw/zinc/27/97/86/192279786.db2.gz	KPDAHCKUEZWXIY-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=C(C[N@H+](C1CC1)C1(CO)CCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000595533183	356537373	/nfs/dbraw/zinc/53/73/73/356537373.db2.gz	ILZBSUQYKPCPLM-UHFFFAOYSA-N	1	1	319.361	1.913	20	5		DDBDMO
O=C(C[N@@H+](C1CC1)C1(CO)CCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000595533183	356537375	/nfs/dbraw/zinc/53/73/75/356537375.db2.gz	ILZBSUQYKPCPLM-UHFFFAOYSA-N	1	1	319.361	1.913	20	5		DDBDMO
CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000595771735	356646465	/nfs/dbraw/zinc/64/64/65/356646465.db2.gz	FBIKLHRTGFLVPO-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@]1(C)CO	ZINC000595873338	356687290	/nfs/dbraw/zinc/68/72/90/356687290.db2.gz	LVCGPQARYWNKSD-MEBBXXQBSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@]1(C)CO	ZINC000595873338	356687295	/nfs/dbraw/zinc/68/72/95/356687295.db2.gz	LVCGPQARYWNKSD-MEBBXXQBSA-N	1	1	304.350	1.921	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000595864793	356682863	/nfs/dbraw/zinc/68/28/63/356682863.db2.gz	COPPYBRTINYIRR-CYBMUJFWSA-N	1	1	323.368	1.765	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@]1(C)CO	ZINC000595868949	356684493	/nfs/dbraw/zinc/68/44/93/356684493.db2.gz	CNXFAHGXXPBUCR-MLGOLLRUSA-N	1	1	321.377	1.874	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH2+][C@@H](CO)c2ccc(F)cc2F)n1	ZINC000595867779	356685202	/nfs/dbraw/zinc/68/52/02/356685202.db2.gz	QLYIUWBZAXBLJN-LBPRGKRZSA-N	1	1	312.276	1.393	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@H]3CCC[NH2+]C3)CC2)c1[N+](=O)[O-]	ZINC000595936099	356712424	/nfs/dbraw/zinc/71/24/24/356712424.db2.gz	MYZHFGPXUUJNDV-LBPRGKRZSA-N	1	1	321.381	1.478	20	5		DDBDMO
NC(=O)c1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000596078989	356764894	/nfs/dbraw/zinc/76/48/94/356764894.db2.gz	HQGIEBOYCROUBX-JTQLQIEISA-N	1	1	304.350	1.590	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000598341606	357544064	/nfs/dbraw/zinc/54/40/64/357544064.db2.gz	DLSDZXKLYOUJAZ-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000598624162	357659313	/nfs/dbraw/zinc/65/93/13/357659313.db2.gz	FDZZWZBHWAVOAV-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000598624162	357659316	/nfs/dbraw/zinc/65/93/16/357659316.db2.gz	FDZZWZBHWAVOAV-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@H](O)C2)c2ccncc21	ZINC000599203571	357850013	/nfs/dbraw/zinc/85/00/13/357850013.db2.gz	XHTKEPVHVQVZMA-NSHDSACASA-N	1	1	302.334	1.622	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599780220	358056871	/nfs/dbraw/zinc/05/68/71/358056871.db2.gz	UEDOPZDXTLIDAL-GFCCVEGCSA-N	1	1	322.365	1.400	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@](C)(O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000180184281	199127405	/nfs/dbraw/zinc/12/74/05/199127405.db2.gz	KGXZNPNSUZEACJ-INIZCTEOSA-N	1	1	316.361	1.952	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccnc2ccc([N+](=O)[O-])cc21	ZINC000601116399	358409033	/nfs/dbraw/zinc/40/90/33/358409033.db2.gz	SXOJPSDBCXLYHD-CYBMUJFWSA-N	1	1	315.377	1.223	20	5		DDBDMO
CC(=O)N1CCC(Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000601101404	358402538	/nfs/dbraw/zinc/40/25/38/358402538.db2.gz	QTZCWTYYZZBYPX-UHFFFAOYSA-N	1	1	314.345	1.988	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000602132212	358835378	/nfs/dbraw/zinc/83/53/78/358835378.db2.gz	INXLGZVQSSRZAN-AWEZNQCLSA-N	1	1	304.350	1.359	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCOC3(CCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000602619076	359077422	/nfs/dbraw/zinc/07/74/22/359077422.db2.gz	LGUZBUIDTWEXSW-UHFFFAOYSA-N	1	1	310.354	1.100	20	5		DDBDMO
Cn1cc(C[N@H+]2CCOC3(CCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000602619076	359077426	/nfs/dbraw/zinc/07/74/26/359077426.db2.gz	LGUZBUIDTWEXSW-UHFFFAOYSA-N	1	1	310.354	1.100	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C(C)(C)C	ZINC000603143330	359432377	/nfs/dbraw/zinc/43/23/77/359432377.db2.gz	SRVVMEKKUOGDGS-CYBMUJFWSA-N	1	1	323.397	1.370	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC1(CO)CC1	ZINC000186812407	200015141	/nfs/dbraw/zinc/01/51/41/200015141.db2.gz	IIMCDOIMXJUBDL-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(CO)CC1	ZINC000186812407	200015143	/nfs/dbraw/zinc/01/51/43/200015143.db2.gz	IIMCDOIMXJUBDL-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)c1	ZINC000186817323	200016282	/nfs/dbraw/zinc/01/62/82/200016282.db2.gz	NXVKESURXLXBQQ-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000604290910	359731824	/nfs/dbraw/zinc/73/18/24/359731824.db2.gz	LXZWBRUKWNTYKG-GFCCVEGCSA-N	1	1	322.365	1.497	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000189375953	200390117	/nfs/dbraw/zinc/39/01/17/200390117.db2.gz	UDTMEWXABVPCGZ-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CCCOCC1	ZINC000189375953	200390119	/nfs/dbraw/zinc/39/01/19/200390119.db2.gz	UDTMEWXABVPCGZ-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000609044641	360258193	/nfs/dbraw/zinc/25/81/93/360258193.db2.gz	NVQMWTQYHZDBMK-LBPRGKRZSA-N	1	1	307.350	1.356	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609383566	360302851	/nfs/dbraw/zinc/30/28/51/360302851.db2.gz	UJGJRMPVXYSVHE-CQSZACIVSA-N	1	1	303.362	1.738	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609383565	360302941	/nfs/dbraw/zinc/30/29/41/360302941.db2.gz	UJGJRMPVXYSVHE-AWEZNQCLSA-N	1	1	303.362	1.738	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000610518580	360458693	/nfs/dbraw/zinc/45/86/93/360458693.db2.gz	RWQHPYJFOTZWLD-NSHDSACASA-N	1	1	303.322	1.733	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[NH+](C(C)(C)CO)CC2)cc1[N+](=O)[O-]	ZINC000611165917	360643212	/nfs/dbraw/zinc/64/32/12/360643212.db2.gz	IZTPXJMDYKOHMW-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612086273	360913527	/nfs/dbraw/zinc/91/35/27/360913527.db2.gz	LVWZMVSICSKQBS-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cnc(N[C@H](C)CC[NH+]2CCN(C)CC2)c([N+](=O)[O-])c1	ZINC000613704766	361526781	/nfs/dbraw/zinc/52/67/81/361526781.db2.gz	QVCFDZNISCOOPR-CYBMUJFWSA-N	1	1	307.398	1.736	20	5		DDBDMO
O=C1N[C@H]2CC[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000281523626	216359782	/nfs/dbraw/zinc/35/97/82/216359782.db2.gz	ZOEFIKMRJHILNC-PWSUYJOCSA-N	1	1	309.297	1.664	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000281523626	216359785	/nfs/dbraw/zinc/35/97/85/216359785.db2.gz	ZOEFIKMRJHILNC-PWSUYJOCSA-N	1	1	309.297	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[N@H+]2CCN1CCC2	ZINC000619873754	364170307	/nfs/dbraw/zinc/17/03/07/364170307.db2.gz	UTESVQZCBCCKQB-AWEZNQCLSA-N	1	1	318.377	1.023	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1C[N@H+]2CCN1CCC2	ZINC000619874131	364170439	/nfs/dbraw/zinc/17/04/39/364170439.db2.gz	ZJEBTIXRMGTBLS-CQSZACIVSA-N	1	1	318.377	1.023	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000275271070	212238475	/nfs/dbraw/zinc/23/84/75/212238475.db2.gz	UUZPFOOFPHFJBE-LLVKDONJSA-N	1	1	305.334	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000275271070	212238478	/nfs/dbraw/zinc/23/84/78/212238478.db2.gz	UUZPFOOFPHFJBE-LLVKDONJSA-N	1	1	305.334	1.834	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@@H+](CCOC)C2)c([N+](=O)[O-])c1	ZINC000264585586	204011471	/nfs/dbraw/zinc/01/14/71/204011471.db2.gz	KKXILBXPLZEJBS-LBPRGKRZSA-N	1	1	322.365	1.087	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282509849	217049710	/nfs/dbraw/zinc/04/97/10/217049710.db2.gz	RTWNBKWZTNGVGN-OAHLLOKOSA-N	1	1	310.350	1.383	20	5		DDBDMO
Cc1cnc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000266226055	205198647	/nfs/dbraw/zinc/19/86/47/205198647.db2.gz	RUKOCVKSIIUUQS-LLVKDONJSA-N	1	1	307.354	1.050	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c(N)c([N+](=O)[O-])c1	ZINC000267365955	206014473	/nfs/dbraw/zinc/01/44/73/206014473.db2.gz	XHZBLBNREQWVGU-OLZOCXBDSA-N	1	1	318.377	1.842	20	5		DDBDMO
Cc1ccc2c(c1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CCO2	ZINC000285365993	218399054	/nfs/dbraw/zinc/39/90/54/218399054.db2.gz	AQSMGWOVXBMMEP-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
Cc1ccc2c(c1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)CCO2	ZINC000285365993	218399055	/nfs/dbraw/zinc/39/90/55/218399055.db2.gz	AQSMGWOVXBMMEP-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@H](C)OC)c([N+](=O)[O-])c1	ZINC000285594549	218528449	/nfs/dbraw/zinc/52/84/49/218528449.db2.gz	IYMDKKJQFARKAA-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C[C@H](C)OC)c([N+](=O)[O-])c1	ZINC000285594549	218528452	/nfs/dbraw/zinc/52/84/52/218528452.db2.gz	IYMDKKJQFARKAA-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])CC1	ZINC000059014093	184133944	/nfs/dbraw/zinc/13/39/44/184133944.db2.gz	CSNWCFUCKUSRTO-UHFFFAOYSA-N	1	1	323.349	1.390	20	5		DDBDMO
CC[C@@]1(C)COCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871829	251253970	/nfs/dbraw/zinc/25/39/70/251253970.db2.gz	CXSDYYZHWCYEMM-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)COCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871829	251253973	/nfs/dbraw/zinc/25/39/73/251253973.db2.gz	CXSDYYZHWCYEMM-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+](C2CC2)CC1	ZINC000061605803	184177524	/nfs/dbraw/zinc/17/75/24/184177524.db2.gz	KNKPZECMZYUZNO-UHFFFAOYSA-N	1	1	303.362	1.834	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341025444	251345038	/nfs/dbraw/zinc/34/50/38/251345038.db2.gz	JCNSXHOKDYJJTC-OCCSQVGLSA-N	1	1	320.393	1.919	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCC[N@@H+](C)CCN(C)C	ZINC000341047284	251353752	/nfs/dbraw/zinc/35/37/52/251353752.db2.gz	LRGVCDTZUXMGHR-UHFFFAOYSA-N	1	1	312.418	1.415	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCCN(C)CC[NH+](C)C	ZINC000341047284	251353755	/nfs/dbraw/zinc/35/37/55/251353755.db2.gz	LRGVCDTZUXMGHR-UHFFFAOYSA-N	1	1	312.418	1.415	20	5		DDBDMO
CCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)N(C)C	ZINC000065535897	184362241	/nfs/dbraw/zinc/36/22/41/184362241.db2.gz	RWOULXGPTKUMNR-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
Cc1c(NC(=O)N2CC[NH+](CCO)CC2)cccc1[N+](=O)[O-]	ZINC000120098648	195096852	/nfs/dbraw/zinc/09/68/52/195096852.db2.gz	VCEMFIODLPVLIC-UHFFFAOYSA-N	1	1	308.338	1.045	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000155218417	197034128	/nfs/dbraw/zinc/03/41/28/197034128.db2.gz	UHNLNSONFNGTCL-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507882	781992558	/nfs/dbraw/zinc/99/25/58/781992558.db2.gz	MCCBQCXNOWAOSR-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507882	781992566	/nfs/dbraw/zinc/99/25/66/781992566.db2.gz	MCCBQCXNOWAOSR-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@H+](C)C1CCCCC1	ZINC000068244005	406626866	/nfs/dbraw/zinc/62/68/66/406626866.db2.gz	FRJHVZMJPPAMNM-UHFFFAOYSA-N	1	1	323.397	1.480	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](CCn2cccn2)CC1	ZINC000049983247	407126653	/nfs/dbraw/zinc/12/66/53/407126653.db2.gz	QEISFMJAKVYTKF-UHFFFAOYSA-N	1	1	301.350	1.614	20	5		DDBDMO
Cc1ccc([C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](C)C)cc1	ZINC000122351563	407298262	/nfs/dbraw/zinc/29/82/62/407298262.db2.gz	CPHJQSSNVJPHGF-GFCCVEGCSA-N	1	1	317.349	1.659	20	5		DDBDMO
COCC[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C)o1	ZINC000125297444	407383934	/nfs/dbraw/zinc/38/39/34/407383934.db2.gz	LDLRTFBHLVESJV-UHFFFAOYSA-N	1	1	308.338	1.841	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C)o1	ZINC000125297444	407383936	/nfs/dbraw/zinc/38/39/36/407383936.db2.gz	LDLRTFBHLVESJV-UHFFFAOYSA-N	1	1	308.338	1.841	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)c1	ZINC000127153508	407429115	/nfs/dbraw/zinc/42/91/15/407429115.db2.gz	SHAPRFFPQXLGMI-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000178558640	407490770	/nfs/dbraw/zinc/49/07/70/407490770.db2.gz	PIEJMUAPMZUYCT-ZDUSSCGKSA-N	1	1	323.397	1.276	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1(O)CCCC1	ZINC000152074417	407556389	/nfs/dbraw/zinc/55/63/89/407556389.db2.gz	WNPODTKKUVQZJC-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1(O)CCCC1	ZINC000152074417	407556397	/nfs/dbraw/zinc/55/63/97/407556397.db2.gz	WNPODTKKUVQZJC-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000114062594	407536568	/nfs/dbraw/zinc/53/65/68/407536568.db2.gz	BXOCKCRSWAEZJM-NSHDSACASA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000114062594	407536571	/nfs/dbraw/zinc/53/65/71/407536571.db2.gz	BXOCKCRSWAEZJM-NSHDSACASA-N	1	1	323.349	1.583	20	5		DDBDMO
CN(CC(=O)NC[C@@H]1CC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000266258655	407537849	/nfs/dbraw/zinc/53/78/49/407537849.db2.gz	KGHRHIRJXKALHF-LBPRGKRZSA-N	1	1	306.366	1.099	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000178812986	407611884	/nfs/dbraw/zinc/61/18/84/407611884.db2.gz	CRKFSHRIHAQEAG-SECBINFHSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000129964889	407640973	/nfs/dbraw/zinc/64/09/73/407640973.db2.gz	RUTCSOCQJFSGIP-TUAOUCFPSA-N	1	1	309.370	1.169	20	5		DDBDMO
CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC[N@@H+](C)C1CC1	ZINC000186747999	407761459	/nfs/dbraw/zinc/76/14/59/407761459.db2.gz	VAECUPMJPLVFMW-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(CC[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000186747999	407761465	/nfs/dbraw/zinc/76/14/65/407761465.db2.gz	VAECUPMJPLVFMW-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(CC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000186747999	407761468	/nfs/dbraw/zinc/76/14/68/407761468.db2.gz	VAECUPMJPLVFMW-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000153191644	407773719	/nfs/dbraw/zinc/77/37/19/407773719.db2.gz	WWPGNGLGERCYGL-GWCFXTLKSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[C@H](NC(=O)[C@H](C)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000272107416	407777279	/nfs/dbraw/zinc/77/72/79/407777279.db2.gz	MUDWPPDSMKLHGD-STQMWFEESA-N	1	1	320.393	1.408	20	5		DDBDMO
COCCC[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000117336723	407832124	/nfs/dbraw/zinc/83/21/24/407832124.db2.gz	SMAQPARUPWCBRV-UHFFFAOYSA-N	1	1	323.349	1.861	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000187418260	407854408	/nfs/dbraw/zinc/85/44/08/407854408.db2.gz	NFEFQCMPAUSPEK-RISCZKNCSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000187418260	407854416	/nfs/dbraw/zinc/85/44/16/407854416.db2.gz	NFEFQCMPAUSPEK-RISCZKNCSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000118129262	407898486	/nfs/dbraw/zinc/89/84/86/407898486.db2.gz	HVSPGFSHJGWPNY-SNVBAGLBSA-N	1	1	320.349	1.132	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000268248145	407967679	/nfs/dbraw/zinc/96/76/79/407967679.db2.gz	WKVDDGCYFPWOSJ-NHYWBVRUSA-N	1	1	303.362	1.736	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)C[C@H](C)O	ZINC000245778836	408068851	/nfs/dbraw/zinc/06/88/51/408068851.db2.gz	LWQMDCPVJAABLM-DTWKUNHWSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)C[C@H](C)O	ZINC000245778836	408068856	/nfs/dbraw/zinc/06/88/56/408068856.db2.gz	LWQMDCPVJAABLM-DTWKUNHWSA-N	1	1	315.757	1.888	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[N@@H+](C)CC1	ZINC000119934967	408116056	/nfs/dbraw/zinc/11/60/56/408116056.db2.gz	YFMFQJUPNIPKRQ-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCC[N@H+](C)CC1	ZINC000119934967	408116062	/nfs/dbraw/zinc/11/60/62/408116062.db2.gz	YFMFQJUPNIPKRQ-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+]2CCC[C@H]2C1	ZINC000246212073	408179020	/nfs/dbraw/zinc/17/90/20/408179020.db2.gz	ANFSWBMDTWCALO-AWEZNQCLSA-N	1	1	318.377	1.622	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000175729261	408189552	/nfs/dbraw/zinc/18/95/52/408189552.db2.gz	BYCCSKXKZZMPGR-RKDXNWHRSA-N	1	1	307.354	1.235	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000175905994	408234842	/nfs/dbraw/zinc/23/48/42/408234842.db2.gz	MMKFGSVLDQYUDP-CYBMUJFWSA-N	1	1	320.349	1.073	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000175905994	408234849	/nfs/dbraw/zinc/23/48/49/408234849.db2.gz	MMKFGSVLDQYUDP-CYBMUJFWSA-N	1	1	320.349	1.073	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000246726291	408326103	/nfs/dbraw/zinc/32/61/03/408326103.db2.gz	AHUMEXGWCLDOTE-JOYOIKCWSA-N	1	1	324.356	1.775	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC[C@H](c2[nH]cc[nH+]2)C1	ZINC000263902017	408307017	/nfs/dbraw/zinc/30/70/17/408307017.db2.gz	BQWOQZPEQPAXAJ-VIFPVBQESA-N	1	1	316.321	1.196	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000176209545	408310700	/nfs/dbraw/zinc/31/07/00/408310700.db2.gz	RINGJAIJPRSLLE-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
Cc1noc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000176214825	408312910	/nfs/dbraw/zinc/31/29/10/408312910.db2.gz	PLNZNMSQJIPMRR-NSHDSACASA-N	1	1	306.326	1.362	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000183195825	408350473	/nfs/dbraw/zinc/35/04/73/408350473.db2.gz	CMCIEMWMFLZBEV-SRVKXCTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176714168	408422272	/nfs/dbraw/zinc/42/22/72/408422272.db2.gz	RSEYAPWAGBUPLH-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177033659	408503795	/nfs/dbraw/zinc/50/37/95/408503795.db2.gz	SMCLSNVZAAOGAC-NEPJUHHUSA-N	1	1	318.377	1.748	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(C)(O)CC1	ZINC000177300927	408575355	/nfs/dbraw/zinc/57/53/55/408575355.db2.gz	JMAXLZIWEYJGCK-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
[NH3+][C@H]1CCC[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000160873870	408535528	/nfs/dbraw/zinc/53/55/28/408535528.db2.gz	AOMQAEYXTOARRG-DTWKUNHWSA-N	1	1	303.322	1.471	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000265298766	408607086	/nfs/dbraw/zinc/60/70/86/408607086.db2.gz	LZKGKRBLSFNDAR-CQSZACIVSA-N	1	1	305.378	1.938	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000265298765	408607270	/nfs/dbraw/zinc/60/72/70/408607270.db2.gz	LZKGKRBLSFNDAR-AWEZNQCLSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCN1CC[NH+]([C@H]2CCN(c3cc(N)ccc3[N+](=O)[O-])C2)CC1	ZINC000193419694	408718306	/nfs/dbraw/zinc/71/83/06/408718306.db2.gz	SLZHPZZPHFLCFV-AWEZNQCLSA-N	1	1	319.409	1.393	20	5		DDBDMO
CC(C)C[C@@H](CO)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000185333639	408795300	/nfs/dbraw/zinc/79/53/00/408795300.db2.gz	NYAXTKNOZBSZME-LBPRGKRZSA-N	1	1	309.366	1.872	20	5		DDBDMO
CC(C)C[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000185333639	408795306	/nfs/dbraw/zinc/79/53/06/408795306.db2.gz	NYAXTKNOZBSZME-LBPRGKRZSA-N	1	1	309.366	1.872	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000183594314	162857735	/nfs/dbraw/zinc/85/77/35/162857735.db2.gz	SDPCLACHKJQGIO-LLVKDONJSA-N	1	1	323.353	1.222	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000290837446	408841077	/nfs/dbraw/zinc/84/10/77/408841077.db2.gz	GZPVQDDCRMFICP-JTQLQIEISA-N	1	1	311.386	1.487	20	5		DDBDMO
Cc1c(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000285953373	408895893	/nfs/dbraw/zinc/89/58/93/408895893.db2.gz	WHZJGQCERZADPG-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H](CC[NH3+])C2)c1[N+](=O)[O-]	ZINC000281618135	408897871	/nfs/dbraw/zinc/89/78/71/408897871.db2.gz	BWVQROOECJHRRG-SNVBAGLBSA-N	1	1	309.370	1.471	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014908	408907326	/nfs/dbraw/zinc/90/73/26/408907326.db2.gz	PPOATBOMPSLUMF-WCQYABFASA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014908	408907328	/nfs/dbraw/zinc/90/73/28/408907328.db2.gz	PPOATBOMPSLUMF-WCQYABFASA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1CC[NH2+][C@@H](C)[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000286095780	408922926	/nfs/dbraw/zinc/92/29/26/408922926.db2.gz	NJHBXOXQICRBMS-VYUIOLGVSA-N	1	1	317.349	1.587	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000286223740	408944773	/nfs/dbraw/zinc/94/47/73/408944773.db2.gz	YVIGNNKPZVQCDH-CZUORRHYSA-N	1	1	305.378	1.890	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC(F)(F)[C@@H](CO)C2)c1	ZINC000291959778	408953298	/nfs/dbraw/zinc/95/32/98/408953298.db2.gz	UYOJFZNODAWIDG-LLVKDONJSA-N	1	1	316.304	1.923	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000292129662	408985475	/nfs/dbraw/zinc/98/54/75/408985475.db2.gz	BFQGVVOQFYJAMW-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000287306774	409016144	/nfs/dbraw/zinc/01/61/44/409016144.db2.gz	UNXZXRSNFZCFKW-ABAIWWIYSA-N	1	1	319.361	1.999	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H](O)CC2)c1	ZINC000293288062	409083804	/nfs/dbraw/zinc/08/38/04/409083804.db2.gz	VURYUIXGWSLYMN-ZIAGYGMSSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CN1	ZINC000278837665	409098066	/nfs/dbraw/zinc/09/80/66/409098066.db2.gz	IXLDDXANPCURAC-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
CCc1nn(C)c(NCc2c[nH+]c(N(C)C)n2C)c1[N+](=O)[O-]	ZINC000288852724	409188980	/nfs/dbraw/zinc/18/89/80/409188980.db2.gz	KNVFACAFVWWOJJ-UHFFFAOYSA-N	1	1	307.358	1.302	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1	ZINC000288418030	409165188	/nfs/dbraw/zinc/16/51/88/409165188.db2.gz	MAAZIVJKWZGUCN-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C1	ZINC000288418030	409165190	/nfs/dbraw/zinc/16/51/90/409165190.db2.gz	MAAZIVJKWZGUCN-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000293895015	409201937	/nfs/dbraw/zinc/20/19/37/409201937.db2.gz	NEDMRRLFWKYBON-INIZCTEOSA-N	1	1	303.362	1.692	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]2OCCN(C)[C@@H]2C1	ZINC000284328672	409321769	/nfs/dbraw/zinc/32/17/69/409321769.db2.gz	KOYJWIPLSYPJBD-HZPDHXFCSA-N	1	1	305.378	1.808	20	5		DDBDMO
CCOc1cccc(N2CC[C@H]3OCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000284995668	409390028	/nfs/dbraw/zinc/39/00/28/409390028.db2.gz	LREHYTSGIHXJDQ-UONOGXRCSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000284350120	409330470	/nfs/dbraw/zinc/33/04/70/409330470.db2.gz	MFSPIUBWGDDFOX-CJKAQPIMSA-N	1	1	319.405	1.995	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC(C)(C)CO	ZINC000295293466	409416785	/nfs/dbraw/zinc/41/67/85/409416785.db2.gz	UJFAOYZZPYKVTK-LLVKDONJSA-N	1	1	309.366	1.872	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)cc1F	ZINC000316493830	164022369	/nfs/dbraw/zinc/02/23/69/164022369.db2.gz	XZRSZOVCYPUAJQ-ZDUSSCGKSA-N	1	1	309.341	1.640	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](N3CCOCC3)C2)cc1F	ZINC000316493830	164022371	/nfs/dbraw/zinc/02/23/71/164022371.db2.gz	XZRSZOVCYPUAJQ-ZDUSSCGKSA-N	1	1	309.341	1.640	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1)C1CCCCC1	ZINC000285509809	409473086	/nfs/dbraw/zinc/47/30/86/409473086.db2.gz	QCOZYXPJNKLMTE-UHFFFAOYSA-N	1	1	309.370	1.702	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CCC[N@@H+](CCCO)C2)ccc1[N+](=O)[O-]	ZINC000295412603	409474061	/nfs/dbraw/zinc/47/40/61/409474061.db2.gz	JLTZOKTUDOVGCT-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)CCO1	ZINC000408464934	164340049	/nfs/dbraw/zinc/34/00/49/164340049.db2.gz	GFKRESWQZPWBLU-LLVKDONJSA-N	1	1	324.356	1.818	20	5		DDBDMO
COC(=O)c1cnc(N[C@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC000290703925	409493763	/nfs/dbraw/zinc/49/37/63/409493763.db2.gz	NRVRHVRJVRESIW-SNVBAGLBSA-N	1	1	310.354	1.917	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)CC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000354079116	409637129	/nfs/dbraw/zinc/63/71/29/409637129.db2.gz	CGFQSLWDYSOOCC-NSHDSACASA-N	1	1	306.366	1.485	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)CC[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000354007557	409594042	/nfs/dbraw/zinc/59/40/42/409594042.db2.gz	QNFNCIDYEPSWPI-NSHDSACASA-N	1	1	323.397	1.351	20	5		DDBDMO
C[C@]1(O)CCOC[C@@H]1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000331623722	409705665	/nfs/dbraw/zinc/70/56/65/409705665.db2.gz	YEXKBUXXPHEAMA-KFWWJZLASA-N	1	1	324.381	1.043	20	5		DDBDMO
C[N@@H+](CC(C)(C)O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000304737535	409642364	/nfs/dbraw/zinc/64/23/64/409642364.db2.gz	SNZZUVMELBEAEU-ZDUSSCGKSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000356843158	409655406	/nfs/dbraw/zinc/65/54/06/409655406.db2.gz	GBLWLEUAMPODOX-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CC[N@@H+](C3CC3)C2)cc1	ZINC000354284114	409748603	/nfs/dbraw/zinc/74/86/03/409748603.db2.gz	WANIICLWZLXUGV-SNVBAGLBSA-N	1	1	311.363	1.110	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1	ZINC000354284114	409748610	/nfs/dbraw/zinc/74/86/10/409748610.db2.gz	WANIICLWZLXUGV-SNVBAGLBSA-N	1	1	311.363	1.110	20	5		DDBDMO
CCOCC[N@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)C[C@H]1CC	ZINC000297054962	409780356	/nfs/dbraw/zinc/78/03/56/409780356.db2.gz	IQCSLXYDYAOSLT-CYBMUJFWSA-N	1	1	323.397	1.630	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)C2)C1	ZINC000346263209	409890446	/nfs/dbraw/zinc/89/04/46/409890446.db2.gz	BXJPKZALBQTUPV-OAHLLOKOSA-N	1	1	321.381	1.081	20	5		DDBDMO
C[C@H](C[C@H](C)[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000320233250	409903041	/nfs/dbraw/zinc/90/30/41/409903041.db2.gz	HQWCRHGZFNNQIQ-JGVFFNPUSA-N	1	1	305.331	1.138	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357686995	410185894	/nfs/dbraw/zinc/18/58/94/410185894.db2.gz	QVSATNMAJPZSLJ-NSHDSACASA-N	1	1	321.381	1.621	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000357774923	410241516	/nfs/dbraw/zinc/24/15/16/410241516.db2.gz	NCEWVVNOITVOCE-JTQLQIEISA-N	1	1	309.370	1.621	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](O)[C@@H](C)C1	ZINC000351827957	410271839	/nfs/dbraw/zinc/27/18/39/410271839.db2.gz	MSUSNIUMXFCBPM-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000351774896	410224719	/nfs/dbraw/zinc/22/47/19/410224719.db2.gz	PGFPHEDEWSVUPT-ZWNOBZJWSA-N	1	1	321.333	1.205	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000298430188	410225509	/nfs/dbraw/zinc/22/55/09/410225509.db2.gz	QAAFOJDEEVRCPV-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000357908911	410321889	/nfs/dbraw/zinc/32/18/89/410321889.db2.gz	FMLOGRLGKUOUQM-LBPRGKRZSA-N	1	1	309.391	1.897	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1cccnc1	ZINC000346993314	410297045	/nfs/dbraw/zinc/29/70/45/410297045.db2.gz	JCAMMCCOUAYWQP-OAHLLOKOSA-N	1	1	314.345	1.989	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000355084262	410304817	/nfs/dbraw/zinc/30/48/17/410304817.db2.gz	XAMSFDHVEFIBBS-MRXNPFEDSA-N	1	1	322.361	1.873	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000355084262	410304826	/nfs/dbraw/zinc/30/48/26/410304826.db2.gz	XAMSFDHVEFIBBS-MRXNPFEDSA-N	1	1	322.361	1.873	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCCO1	ZINC000347187230	410379957	/nfs/dbraw/zinc/37/99/57/410379957.db2.gz	KVJMEMUEHODSKM-NSHDSACASA-N	1	1	310.354	1.154	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358407961	410461053	/nfs/dbraw/zinc/46/10/53/410461053.db2.gz	GCOLWDDGDUCFRG-ZUZCIYMTSA-N	1	1	321.352	1.875	20	5		DDBDMO
O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1ccccc1[N+](=O)[O-]	ZINC000352034074	410431707	/nfs/dbraw/zinc/43/17/07/410431707.db2.gz	XZRCCJBHIWOHQQ-LBPRGKRZSA-N	1	1	321.358	1.918	20	5		DDBDMO
Cc1cc(NC(=O)c2cc([N+](=O)[O-])cnc2N)cn2cc[nH+]c12	ZINC000355484320	410540353	/nfs/dbraw/zinc/54/03/53/410540353.db2.gz	VSMLQQLKJIWYCH-UHFFFAOYSA-N	1	1	312.289	1.780	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000343598129	410561997	/nfs/dbraw/zinc/56/19/97/410561997.db2.gz	ICBHVSLZYMAEPS-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCC(F)(F)CC1	ZINC000347610939	410630301	/nfs/dbraw/zinc/63/03/01/410630301.db2.gz	CAALOCHHZNNECA-GFCCVEGCSA-N	1	1	318.324	1.662	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C1	ZINC000301304597	410696538	/nfs/dbraw/zinc/69/65/38/410696538.db2.gz	TWCAOSZMGJVBRK-AWEZNQCLSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343802148	410710807	/nfs/dbraw/zinc/71/08/07/410710807.db2.gz	SORXJRVKRHHPSW-IUODEOHRSA-N	1	1	320.393	1.919	20	5		DDBDMO
CCC(=O)c1ccc(NC[C@@]2(O)CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000359564390	410733903	/nfs/dbraw/zinc/73/39/03/410733903.db2.gz	KWNWROSKKMKORO-HNNXBMFYSA-N	1	1	307.350	1.666	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]2Cc2ccccc2)c1	ZINC000353040143	410753841	/nfs/dbraw/zinc/75/38/41/410753841.db2.gz	NIBAZDMKTGMDLQ-GDBMZVCRSA-N	1	1	316.361	1.469	20	5		DDBDMO
Cc1nc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)ccc1[N+](=O)[O-]	ZINC000301646818	410763893	/nfs/dbraw/zinc/76/38/93/410763893.db2.gz	IDUCGJGORMAGMD-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000331184642	411003831	/nfs/dbraw/zinc/00/38/31/411003831.db2.gz	YIYASLLSUYDWMI-OAHLLOKOSA-N	1	1	321.377	1.772	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@]3(CNC(=O)C3)C2)cc1[N+](=O)[O-]	ZINC000353767457	411126701	/nfs/dbraw/zinc/12/67/01/411126701.db2.gz	LELKIQVKNHZOLV-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
Cc1nc(N2CCC[C@H](C[NH+]3CCOCC3)C2)ncc1[N+](=O)[O-]	ZINC000296718956	226158016	/nfs/dbraw/zinc/15/80/16/226158016.db2.gz	HEICPGBQNQQSNJ-CYBMUJFWSA-N	1	1	321.381	1.242	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@@H+]2CCOc1ccc([N+](=O)[O-])cc1	ZINC000366882758	418531147	/nfs/dbraw/zinc/53/11/47/418531147.db2.gz	MCKHDXLSFTYMKM-ZIAGYGMSSA-N	1	1	305.334	1.184	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@H](C)[N@H+]1C	ZINC000294050792	418582660	/nfs/dbraw/zinc/58/26/60/418582660.db2.gz	UFPPKLWBCRYXKT-DTORHVGOSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@H](C)[N@@H+]1C	ZINC000294050792	418582661	/nfs/dbraw/zinc/58/26/61/418582661.db2.gz	UFPPKLWBCRYXKT-DTORHVGOSA-N	1	1	310.329	1.481	20	5		DDBDMO
O=C1[C@H]([N@@H+]2C[C@@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316765	418627784	/nfs/dbraw/zinc/62/77/84/418627784.db2.gz	ZHMWGBYYEFISPT-ZIAGYGMSSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C1[C@H]([N@H+]2C[C@@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316765	418627787	/nfs/dbraw/zinc/62/77/87/418627787.db2.gz	ZHMWGBYYEFISPT-ZIAGYGMSSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000375668209	418670582	/nfs/dbraw/zinc/67/05/82/418670582.db2.gz	DNOMXMNIDZOPBW-SOUVJXGZSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000375668209	418670585	/nfs/dbraw/zinc/67/05/85/418670585.db2.gz	DNOMXMNIDZOPBW-SOUVJXGZSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000375668209	418670586	/nfs/dbraw/zinc/67/05/86/418670586.db2.gz	DNOMXMNIDZOPBW-SOUVJXGZSA-N	1	1	303.362	1.290	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H]3C(=O)NC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000368063183	418682623	/nfs/dbraw/zinc/68/26/23/418682623.db2.gz	MLSLBHXJOMLPQM-QWHCGFSZSA-N	1	1	319.361	1.561	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000372470060	418873730	/nfs/dbraw/zinc/87/37/30/418873730.db2.gz	CZNCTTYBUZLTBH-GHMZBOCLSA-N	1	1	305.334	1.657	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@]1(CO)CCOC1	ZINC000411511613	418911168	/nfs/dbraw/zinc/91/11/68/418911168.db2.gz	ZDSQPOBWDZISAM-OAHLLOKOSA-N	1	1	323.349	1.007	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000372943702	418915305	/nfs/dbraw/zinc/91/53/05/418915305.db2.gz	CFPNLPUTFBOTBO-ZIAGYGMSSA-N	1	1	319.361	1.496	20	5		DDBDMO
CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[N@H+]1C	ZINC000421000181	419434267	/nfs/dbraw/zinc/43/42/67/419434267.db2.gz	KANZSJACSKSMHN-GJZGRUSLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000181	419434273	/nfs/dbraw/zinc/43/42/73/419434273.db2.gz	KANZSJACSKSMHN-GJZGRUSLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000181	419434284	/nfs/dbraw/zinc/43/42/84/419434284.db2.gz	KANZSJACSKSMHN-GJZGRUSLSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1ccc(CN2C[C@@H](C)[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000418112747	419542030	/nfs/dbraw/zinc/54/20/30/419542030.db2.gz	LNOXLYBBJPMREP-ZIAGYGMSSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1C[C@H](C)[N@H+](CCO)C[C@@H]1C	ZINC000418122948	419553294	/nfs/dbraw/zinc/55/32/94/419553294.db2.gz	YGKIXUWHGVKXNG-KBPBESRZSA-N	1	1	307.394	1.790	20	5		DDBDMO
CC(C)[C@@H]1[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000427188143	419613577	/nfs/dbraw/zinc/61/35/77/419613577.db2.gz	WZAHFBFQEGKILY-KBPBESRZSA-N	1	1	308.382	1.663	20	5		DDBDMO
COc1c(C(=O)N(C)C[C@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC000421711923	419697859	/nfs/dbraw/zinc/69/78/59/419697859.db2.gz	PKHYHDPDUDAWGP-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](CCNc2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000413276509	419779585	/nfs/dbraw/zinc/77/95/85/419779585.db2.gz	FODBTCJDICGQHH-UHFFFAOYSA-N	1	1	320.397	1.479	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000299561416	229210150	/nfs/dbraw/zinc/21/01/50/229210150.db2.gz	UBBVREAHYMURGW-MRVPVSSYSA-N	1	1	306.326	1.197	20	5		DDBDMO
CCCn1cc[nH+]c1CCCN(C)Cc1c([N+](=O)[O-])ncn1C	ZINC000429239968	419991538	/nfs/dbraw/zinc/99/15/38/419991538.db2.gz	SAXZTVHPJUAWLN-UHFFFAOYSA-N	1	1	320.397	1.999	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCC(F)(F)C[NH3+]	ZINC000423325566	420014267	/nfs/dbraw/zinc/01/42/67/420014267.db2.gz	LQGXIDWWZOCRAN-SECBINFHSA-N	1	1	316.308	1.496	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CN	ZINC000420290193	420184878	/nfs/dbraw/zinc/18/48/78/420184878.db2.gz	LMSPBEDFMLCXRQ-IUODEOHRSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CN	ZINC000420290193	420184880	/nfs/dbraw/zinc/18/48/80/420184880.db2.gz	LMSPBEDFMLCXRQ-IUODEOHRSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1[NH3+]	ZINC000430940743	420216657	/nfs/dbraw/zinc/21/66/57/420216657.db2.gz	QVIWFIOZHAPQQT-RYUDHWBXSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228305	420251694	/nfs/dbraw/zinc/25/16/94/420251694.db2.gz	OJZOZNGWYMZMKJ-DOTOQJQBSA-N	1	1	319.405	1.973	20	5		DDBDMO
CN1CC[C@@](O)(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228305	420251699	/nfs/dbraw/zinc/25/16/99/420251699.db2.gz	OJZOZNGWYMZMKJ-DOTOQJQBSA-N	1	1	319.405	1.973	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000433847088	420255932	/nfs/dbraw/zinc/25/59/32/420255932.db2.gz	CMMMJRVOHNNBAT-WDEREUQCSA-N	1	1	321.381	1.798	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1CCO	ZINC000416303859	420321939	/nfs/dbraw/zinc/32/19/39/420321939.db2.gz	HMXGOVLBYDOHJA-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425060285	420325582	/nfs/dbraw/zinc/32/55/82/420325582.db2.gz	VFHHBTXHDRHAGR-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425060285	420325587	/nfs/dbraw/zinc/32/55/87/420325587.db2.gz	VFHHBTXHDRHAGR-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425060285	420325590	/nfs/dbraw/zinc/32/55/90/420325590.db2.gz	VFHHBTXHDRHAGR-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)CC[NH+]1CCOCC1	ZINC000446048743	230221969	/nfs/dbraw/zinc/22/19/69/230221969.db2.gz	VXWPDXRZHYJRLF-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC[C@H]3CCOC3)C2)nc1	ZINC000438096546	420438994	/nfs/dbraw/zinc/43/89/94/420438994.db2.gz	OWDGXCZLZIKYRK-QWHCGFSZSA-N	1	1	306.366	1.903	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCNc2cccc(C)[nH+]2)c1[N+](=O)[O-]	ZINC000439520773	420520607	/nfs/dbraw/zinc/52/06/07/420520607.db2.gz	AFZKJMIHBUDOON-UHFFFAOYSA-N	1	1	318.337	1.426	20	5		DDBDMO
C[C@@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H](C)[N@@H+]1CCO	ZINC000450796931	420533169	/nfs/dbraw/zinc/53/31/69/420533169.db2.gz	RNWOFKYZCHPCGM-TXEJJXNPSA-N	1	1	320.393	1.454	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000492988041	420728029	/nfs/dbraw/zinc/72/80/29/420728029.db2.gz	NPYRFTZVECOGRS-FMFIFOJESA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000492988041	420728033	/nfs/dbraw/zinc/72/80/33/420728033.db2.gz	NPYRFTZVECOGRS-FMFIFOJESA-N	1	1	319.361	1.133	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000447816465	420804684	/nfs/dbraw/zinc/80/46/84/420804684.db2.gz	KYQMNOQDZMHFPG-LBPRGKRZSA-N	1	1	321.381	1.621	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000454735377	420917509	/nfs/dbraw/zinc/91/75/09/420917509.db2.gz	KHAWYYBNRWHFIJ-LLVKDONJSA-N	1	1	321.381	1.636	20	5		DDBDMO
CC[C@H](CNS(C)(=O)=O)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000449442822	421012753	/nfs/dbraw/zinc/01/27/53/421012753.db2.gz	NDMSLRSXMZKMGO-SECBINFHSA-N	1	1	307.397	1.074	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000450321401	421183038	/nfs/dbraw/zinc/18/30/38/421183038.db2.gz	RWUQYTJWMMEMHS-UHFFFAOYSA-N	1	1	315.333	1.420	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+]2CCCO)c1	ZINC000450593997	421213819	/nfs/dbraw/zinc/21/38/19/421213819.db2.gz	JWWUYSGXEGVKEX-GFCCVEGCSA-N	1	1	309.366	1.862	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000560978312	421300794	/nfs/dbraw/zinc/30/07/94/421300794.db2.gz	AEILUQFFTQCNMB-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000546809470	421311890	/nfs/dbraw/zinc/31/18/90/421311890.db2.gz	QRSHPSPOOGWVDJ-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000563399253	421503199	/nfs/dbraw/zinc/50/31/99/421503199.db2.gz	QXUXOMXLKKDHBH-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000563399253	421503200	/nfs/dbraw/zinc/50/32/00/421503200.db2.gz	QXUXOMXLKKDHBH-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCn1ccc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000574911959	422212868	/nfs/dbraw/zinc/21/28/68/422212868.db2.gz	JRYFUUWOMBXMLG-CYBMUJFWSA-N	1	1	320.349	1.341	20	5		DDBDMO
Nc1nccc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594418492	422348229	/nfs/dbraw/zinc/34/82/29/422348229.db2.gz	JMOKFPHYETVWSR-NWDGAFQWSA-N	1	1	319.365	1.319	20	5		DDBDMO
Nc1nc(NC[C@H]2CC[N@H+]2C2CCCCC2)ncc1[N+](=O)[O-]	ZINC000599125863	422402950	/nfs/dbraw/zinc/40/29/50/422402950.db2.gz	DTECERYJSHIECY-LLVKDONJSA-N	1	1	306.370	1.208	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])cn2C)CCCO1	ZINC000578386601	422561008	/nfs/dbraw/zinc/56/10/08/422561008.db2.gz	QGCYQDKFOQPMGQ-GFCCVEGCSA-N	1	1	324.381	1.164	20	5		DDBDMO
C[C@](O)(C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(F)(F)F	ZINC000578741027	422635420	/nfs/dbraw/zinc/63/54/20/422635420.db2.gz	BMMDREPXNWYHKL-NSHDSACASA-N	1	1	318.255	1.874	20	5		DDBDMO
CC(C)NC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000345629823	272293721	/nfs/dbraw/zinc/29/37/21/272293721.db2.gz	FAVVDZLPVSCSAW-LLVKDONJSA-N	1	1	307.354	1.001	20	5		DDBDMO
CC(C)NC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000345629823	272293722	/nfs/dbraw/zinc/29/37/22/272293722.db2.gz	FAVVDZLPVSCSAW-LLVKDONJSA-N	1	1	307.354	1.001	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@H](C)O)CC2)c([N+](=O)[O-])cc1F	ZINC000275021617	274096491	/nfs/dbraw/zinc/09/64/91/274096491.db2.gz	MCEDUHDTZSYKOC-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000331225061	276167580	/nfs/dbraw/zinc/16/75/80/276167580.db2.gz	XLPFUVDJYLDVTB-SNVBAGLBSA-N	1	1	309.370	1.655	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000174534492	276209112	/nfs/dbraw/zinc/20/91/12/276209112.db2.gz	DTVRJUFHQTUCHU-AWEZNQCLSA-N	1	1	305.334	1.205	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000174534492	276209113	/nfs/dbraw/zinc/20/91/13/276209113.db2.gz	DTVRJUFHQTUCHU-AWEZNQCLSA-N	1	1	305.334	1.205	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)C1	ZINC000301309228	277053883	/nfs/dbraw/zinc/05/38/83/277053883.db2.gz	XHLYPROGQZVDKQ-CQSZACIVSA-N	1	1	322.384	1.950	20	5		DDBDMO
CNc1nc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000425062992	277303738	/nfs/dbraw/zinc/30/37/38/277303738.db2.gz	DWURFDYIUGYTDF-GXFFZTMASA-N	1	1	319.365	1.198	20	5		DDBDMO
CC1CC[NH+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000129971774	281363480	/nfs/dbraw/zinc/36/34/80/281363480.db2.gz	WOBDKWAJXZGFHD-AWEZNQCLSA-N	1	1	317.345	1.959	20	5		DDBDMO
O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000367289524	300823153	/nfs/dbraw/zinc/82/31/53/300823153.db2.gz	AFMPCADNHBMQMX-JTQLQIEISA-N	1	1	319.695	1.927	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000368352838	301009609	/nfs/dbraw/zinc/00/96/09/301009609.db2.gz	XVHIBGJIIUXRKV-GDNZZTSVSA-N	1	1	308.334	1.282	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000368352838	301009610	/nfs/dbraw/zinc/00/96/10/301009610.db2.gz	XVHIBGJIIUXRKV-GDNZZTSVSA-N	1	1	308.334	1.282	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC12CCOCC2	ZINC000368898024	301103974	/nfs/dbraw/zinc/10/39/74/301103974.db2.gz	VVPNJTVIEPMMBB-CYBMUJFWSA-N	1	1	322.361	1.589	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000370148575	301283462	/nfs/dbraw/zinc/28/34/62/301283462.db2.gz	BFQHNSYPOOGNPN-KCXAZCMYSA-N	1	1	305.378	1.654	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000538918460	303392267	/nfs/dbraw/zinc/39/22/67/303392267.db2.gz	CKZAEYUCECPRGQ-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000538918460	303392268	/nfs/dbraw/zinc/39/22/68/303392268.db2.gz	CKZAEYUCECPRGQ-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cn(Cc2[nH+]ccn2CC(F)(F)F)c1=O	ZINC000359439959	306954663	/nfs/dbraw/zinc/95/46/63/306954663.db2.gz	QCAIGSBWTGOGFN-UHFFFAOYSA-N	1	1	316.239	1.872	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)N2CCc3c2cccc3[N+](=O)[O-])no1	ZINC000359443318	306954905	/nfs/dbraw/zinc/95/49/05/306954905.db2.gz	CJWTVUHBCMXJNH-UHFFFAOYSA-N	1	1	316.317	1.847	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@]1(CO)CCc2ccccc21	ZINC000362390950	307020522	/nfs/dbraw/zinc/02/05/22/307020522.db2.gz	FUYZOLMYNROSRX-HNNXBMFYSA-N	1	1	302.334	1.252	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000364072937	307041006	/nfs/dbraw/zinc/04/10/06/307041006.db2.gz	PZXJKQFVHVAEJY-CABCVRRESA-N	1	1	319.361	1.266	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000364072939	307041104	/nfs/dbraw/zinc/04/11/04/307041104.db2.gz	PZXJKQFVHVAEJY-HUUCEWRRSA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000366304614	307070475	/nfs/dbraw/zinc/07/04/75/307070475.db2.gz	ANBYSSWQTDZQJO-VHRBIJSZSA-N	1	1	317.345	1.559	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000371555459	307153353	/nfs/dbraw/zinc/15/33/53/307153353.db2.gz	UJOFSJKOXGIUOC-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C[C@H]21	ZINC000375047433	307217864	/nfs/dbraw/zinc/21/78/64/307217864.db2.gz	DDQQTRDWIAFFNO-GHMZBOCLSA-N	1	1	302.338	1.168	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)[C@@H]2C1	ZINC000378507647	307290536	/nfs/dbraw/zinc/29/05/36/307290536.db2.gz	WPDYHAQXBHKEEU-GHMZBOCLSA-N	1	1	302.338	1.168	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000567016853	308068599	/nfs/dbraw/zinc/06/85/99/308068599.db2.gz	JAPAFODNMIZBCJ-ZDUSSCGKSA-N	1	1	323.397	1.351	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000567105344	308071097	/nfs/dbraw/zinc/07/10/97/308071097.db2.gz	BQVPUARPGJKUJE-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000569805246	308149891	/nfs/dbraw/zinc/14/98/91/308149891.db2.gz	QYIGVLBVDZLTKC-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1CCOC	ZINC000570686449	308176603	/nfs/dbraw/zinc/17/66/03/308176603.db2.gz	QWUBXASGZUXKKM-LLVKDONJSA-N	1	1	312.345	1.676	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1CCOC	ZINC000570686449	308176604	/nfs/dbraw/zinc/17/66/04/308176604.db2.gz	QWUBXASGZUXKKM-LLVKDONJSA-N	1	1	312.345	1.676	20	5		DDBDMO
Cc1ocnc1C[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000576749826	308336717	/nfs/dbraw/zinc/33/67/17/308336717.db2.gz	XXEMJBUCBYVMCJ-NSHDSACASA-N	1	1	307.306	1.421	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000488728933	484215279	/nfs/dbraw/zinc/21/52/79/484215279.db2.gz	IVLIYSNHWQLVRT-MBNYWOFBSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](S(N)(=O)=O)C1	ZINC000330715830	534349199	/nfs/dbraw/zinc/34/91/99/534349199.db2.gz	SYXIJMYRMRVWQN-JQWIXIFHSA-N	1	1	313.379	1.327	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H](S(N)(=O)=O)C1	ZINC000330715830	534349203	/nfs/dbraw/zinc/34/92/03/534349203.db2.gz	SYXIJMYRMRVWQN-JQWIXIFHSA-N	1	1	313.379	1.327	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444645143	534361697	/nfs/dbraw/zinc/36/16/97/534361697.db2.gz	XHHSFNPOCAMOQO-SNVBAGLBSA-N	1	1	317.349	1.559	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444645143	534361688	/nfs/dbraw/zinc/36/16/88/534361688.db2.gz	XHHSFNPOCAMOQO-SNVBAGLBSA-N	1	1	317.349	1.559	20	5		DDBDMO
[NH3+]C1CCN(CCCC(=O)NCc2ccccc2[N+](=O)[O-])CC1	ZINC000433128569	534565710	/nfs/dbraw/zinc/56/57/10/534565710.db2.gz	BAXCCIVBQGFUDG-UHFFFAOYSA-N	1	1	320.393	1.414	20	5		DDBDMO
CC[C@@H](C)[NH+]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000296743038	529354337	/nfs/dbraw/zinc/35/43/37/529354337.db2.gz	ASLMAOBBQQQPLH-SNVBAGLBSA-N	1	1	309.370	1.193	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000821266280	599146626	/nfs/dbraw/zinc/14/66/26/599146626.db2.gz	AHBYSYNQZJGTGY-VIFPVBQESA-N	1	1	318.341	1.066	20	5		DDBDMO
CCOCC[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000092885172	696597813	/nfs/dbraw/zinc/59/78/13/696597813.db2.gz	UEFVOIVCHFHKQC-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
CCOCC[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000092885172	696597814	/nfs/dbraw/zinc/59/78/14/696597814.db2.gz	UEFVOIVCHFHKQC-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000748355616	700113305	/nfs/dbraw/zinc/11/33/05/700113305.db2.gz	SLWSGHMHTYTUMD-VIFPVBQESA-N	1	1	322.321	1.588	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000748355616	700113307	/nfs/dbraw/zinc/11/33/07/700113307.db2.gz	SLWSGHMHTYTUMD-VIFPVBQESA-N	1	1	322.321	1.588	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CC1)C2	ZINC000982278731	697082159	/nfs/dbraw/zinc/08/21/59/697082159.db2.gz	QGGJIFDWIINFOQ-XOUADPBQSA-N	1	1	307.394	1.232	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CC1CC1)C2	ZINC000982278731	697082161	/nfs/dbraw/zinc/08/21/61/697082161.db2.gz	QGGJIFDWIINFOQ-XOUADPBQSA-N	1	1	307.394	1.232	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CC1)C2	ZINC000982278731	697082163	/nfs/dbraw/zinc/08/21/63/697082163.db2.gz	QGGJIFDWIINFOQ-XOUADPBQSA-N	1	1	307.394	1.232	20	5		DDBDMO
Cc1cncc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC000983649648	697286343	/nfs/dbraw/zinc/28/63/43/697286343.db2.gz	PXPWLEPOTFBKTL-NMFUWQPSSA-N	1	1	318.377	1.040	20	5		DDBDMO
CCC[C@H]1CN(Cn2nccc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000159834019	697312447	/nfs/dbraw/zinc/31/24/47/697312447.db2.gz	KGDBIGRZSNJZPO-ZDUSSCGKSA-N	1	1	311.386	1.182	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000776582116	698121004	/nfs/dbraw/zinc/12/10/04/698121004.db2.gz	QNUIPDIIELLOCW-NHYWBVRUSA-N	1	1	322.361	1.902	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581312	698121261	/nfs/dbraw/zinc/12/12/61/698121261.db2.gz	CIXQDFVVUYMATI-HUUCEWRRSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581312	698121262	/nfs/dbraw/zinc/12/12/62/698121262.db2.gz	CIXQDFVVUYMATI-HUUCEWRRSA-N	1	1	319.361	1.371	20	5		DDBDMO
C[C@H]1[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000719624986	699302963	/nfs/dbraw/zinc/30/29/63/699302963.db2.gz	NLCCIGVLSLZIMT-CBAPKCEASA-N	1	1	315.171	1.679	20	5		DDBDMO
C[C@H]1[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000719624986	699302966	/nfs/dbraw/zinc/30/29/66/699302966.db2.gz	NLCCIGVLSLZIMT-CBAPKCEASA-N	1	1	315.171	1.679	20	5		DDBDMO
O=C1CN(C[NH+]2CCCCC2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000726582661	699369078	/nfs/dbraw/zinc/36/90/78/699369078.db2.gz	FRXJRPPVBGSGIN-UHFFFAOYSA-N	1	1	318.333	1.807	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000732060746	699545031	/nfs/dbraw/zinc/54/50/31/699545031.db2.gz	SUGPUZJHEZENTE-LLVKDONJSA-N	1	1	317.349	1.012	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1	ZINC000790773814	699596379	/nfs/dbraw/zinc/59/63/79/699596379.db2.gz	ZAYJQKMHSCKZKK-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(Cn3ncc4ccc([N+](=O)[O-])cc43)C2)C1	ZINC000793745386	699776069	/nfs/dbraw/zinc/77/60/69/699776069.db2.gz	ODFUBEHFDMJXGN-MRXNPFEDSA-N	1	1	315.377	1.930	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000751951366	700329496	/nfs/dbraw/zinc/32/94/96/700329496.db2.gz	TVGCNHYJPYNOHR-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000751951366	700329500	/nfs/dbraw/zinc/32/95/00/700329500.db2.gz	TVGCNHYJPYNOHR-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000802138251	700371327	/nfs/dbraw/zinc/37/13/27/700371327.db2.gz	CRZVQUCRFXPMLO-NSHDSACASA-N	1	1	311.338	1.199	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000802141598	700372666	/nfs/dbraw/zinc/37/26/66/700372666.db2.gz	XPUHFYDNMJHTGY-AWEZNQCLSA-N	1	1	322.361	1.790	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000771404461	701318677	/nfs/dbraw/zinc/31/86/77/701318677.db2.gz	JCWZYHCBJGRYQF-ZJUUUORDSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000771404461	701318678	/nfs/dbraw/zinc/31/86/78/701318678.db2.gz	JCWZYHCBJGRYQF-ZJUUUORDSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839696359	701787825	/nfs/dbraw/zinc/78/78/25/701787825.db2.gz	QRCPFOHZFWNPPX-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839696359	701787829	/nfs/dbraw/zinc/78/78/29/701787829.db2.gz	QRCPFOHZFWNPPX-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839696359	701787834	/nfs/dbraw/zinc/78/78/34/701787834.db2.gz	QRCPFOHZFWNPPX-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
COc1ccc([C@@H](C[NH+](C)C)NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC000839759863	701814127	/nfs/dbraw/zinc/81/41/27/701814127.db2.gz	DSWSKDCVFRFDCM-MGPQQGTHSA-N	1	1	307.350	1.079	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000810839421	701859921	/nfs/dbraw/zinc/85/99/21/701859921.db2.gz	AYZLUZILNCPNHH-QWHCGFSZSA-N	1	1	322.365	1.660	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)NCc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000868062291	701920395	/nfs/dbraw/zinc/92/03/95/701920395.db2.gz	KJWFUVRYWCCNCI-KBPBESRZSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[C@@H]1CCN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1=O	ZINC000840057948	701943060	/nfs/dbraw/zinc/94/30/60/701943060.db2.gz	GRFKDHASNPDNQE-LLVKDONJSA-N	1	1	307.354	1.254	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000868160302	701970259	/nfs/dbraw/zinc/97/02/59/701970259.db2.gz	DUDFEYCUOQJVJH-ZFWWWQNUSA-N	1	1	318.377	1.830	20	5		DDBDMO
COC(=O)CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000844386581	703024103	/nfs/dbraw/zinc/02/41/03/703024103.db2.gz	OEYJLUQDGMRKQP-UHFFFAOYSA-N	1	1	309.278	1.688	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852436527	704048158	/nfs/dbraw/zinc/04/81/58/704048158.db2.gz	INPYGQXUUOINRZ-UONOGXRCSA-N	1	1	321.333	1.155	20	5		DDBDMO
CCC[C@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870911416	704165226	/nfs/dbraw/zinc/16/52/26/704165226.db2.gz	WDHOJYJLLRSPSC-HOCLYGCPSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000874851034	705204156	/nfs/dbraw/zinc/20/41/56/705204156.db2.gz	ZCGGRJPAIMYLEC-CHWSQXEVSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2cccc([N+](=O)[O-])c2Cl)C1	ZINC000860826878	705293504	/nfs/dbraw/zinc/29/35/04/705293504.db2.gz	PTVPFQICQXKUKV-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
Cc1ccc(CNC(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000876169422	705646978	/nfs/dbraw/zinc/64/69/78/705646978.db2.gz	WNANJSALLYBQKN-UHFFFAOYSA-N	1	1	318.377	1.964	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000827363506	705985345	/nfs/dbraw/zinc/98/53/45/705985345.db2.gz	BBEAWCZSVYSKJX-DOMZBBRYSA-N	1	1	319.361	1.526	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@H]1C1OCCO1	ZINC000878046522	706274081	/nfs/dbraw/zinc/27/40/81/706274081.db2.gz	BQJQSEVPJXHPCE-LBPRGKRZSA-N	1	1	310.354	1.327	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@H]1C1OCCO1	ZINC000878046522	706274082	/nfs/dbraw/zinc/27/40/82/706274082.db2.gz	BQJQSEVPJXHPCE-LBPRGKRZSA-N	1	1	310.354	1.327	20	5		DDBDMO
COc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)cc1[N+](=O)[O-]	ZINC000880071183	706870231	/nfs/dbraw/zinc/87/02/31/706870231.db2.gz	WAHSLYZSWVELPM-UONOGXRCSA-N	1	1	321.377	1.244	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880134675	706887132	/nfs/dbraw/zinc/88/71/32/706887132.db2.gz	OIYAJPRLQNJLJW-HUUCEWRRSA-N	1	1	318.377	1.702	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880433023	706974524	/nfs/dbraw/zinc/97/45/24/706974524.db2.gz	SSEABQYWVCCHAV-SOUVJXGZSA-N	1	1	310.350	1.364	20	5		DDBDMO
C[C@@H](NCC1(O)CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037365	707283958	/nfs/dbraw/zinc/28/39/58/707283958.db2.gz	DXKZMSOADNBBLI-LLVKDONJSA-N	1	1	311.357	1.841	20	5		DDBDMO
O=C1CC2(CCOCC2)[N@H+](Cc2cccc([N+](=O)[O-])c2)CCN1	ZINC000872287072	707366103	/nfs/dbraw/zinc/36/61/03/707366103.db2.gz	GRHOLNVBITYBBM-UHFFFAOYSA-N	1	1	319.361	1.466	20	5		DDBDMO
O=C1CC2(CCOCC2)[N@@H+](Cc2cccc([N+](=O)[O-])c2)CCN1	ZINC000872287072	707366106	/nfs/dbraw/zinc/36/61/06/707366106.db2.gz	GRHOLNVBITYBBM-UHFFFAOYSA-N	1	1	319.361	1.466	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000882478847	707649639	/nfs/dbraw/zinc/64/96/39/707649639.db2.gz	GXFJHHPTFRUOPC-ZDUSSCGKSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1cc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)ncc1[N+](=O)[O-]	ZINC000897220416	708258768	/nfs/dbraw/zinc/25/87/68/708258768.db2.gz	AYBTWJRBMLILOM-OLZOCXBDSA-N	1	1	306.366	1.334	20	5		DDBDMO
COc1cccc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222341	708259957	/nfs/dbraw/zinc/25/99/57/708259957.db2.gz	UQGGXSVURIMMGA-CHWSQXEVSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])o1	ZINC000885854670	708639777	/nfs/dbraw/zinc/63/97/77/708639777.db2.gz	BGFAUJCAMCSXCK-LLVKDONJSA-N	1	1	309.322	1.171	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)N1CCCC1	ZINC000886006210	708680538	/nfs/dbraw/zinc/68/05/38/708680538.db2.gz	OPRCKTIAHXVMCG-CQSZACIVSA-N	1	1	318.377	1.824	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@]2(C)C1	ZINC000887927826	709166885	/nfs/dbraw/zinc/16/68/85/709166885.db2.gz	KTUNWOAKFDHYNZ-PSLIRLAXSA-N	1	1	322.340	1.340	20	5		DDBDMO
O=C(C1C[NH+]([C@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000900099692	709288711	/nfs/dbraw/zinc/28/87/11/709288711.db2.gz	TUUCTOQLYRSREQ-AWEZNQCLSA-N	1	1	317.345	1.205	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)c1[N+](=O)[O-]	ZINC000892176466	710388539	/nfs/dbraw/zinc/38/85/39/710388539.db2.gz	VHVFXTUVEAZCGO-OAHLLOKOSA-N	1	1	308.334	1.921	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000913295179	713193873	/nfs/dbraw/zinc/19/38/73/713193873.db2.gz	RMEYXKMRQMEBFY-IYBDPMFKSA-N	1	1	318.377	1.591	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000893942026	710894604	/nfs/dbraw/zinc/89/46/04/710894604.db2.gz	YQFCSHAPEIVHQU-CMPLNLGQSA-N	1	1	320.349	1.225	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@H]1CC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318418	711095625	/nfs/dbraw/zinc/09/56/25/711095625.db2.gz	PMQIJENKOFUFDS-CABCVRRESA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@H]1CC[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318418	711095631	/nfs/dbraw/zinc/09/56/31/711095631.db2.gz	PMQIJENKOFUFDS-CABCVRRESA-N	1	1	315.377	1.711	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000928570536	713233063	/nfs/dbraw/zinc/23/30/63/713233063.db2.gz	FIYMCBNFEKWUPM-AWEZNQCLSA-N	1	1	303.362	1.837	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000928570536	713233064	/nfs/dbraw/zinc/23/30/64/713233064.db2.gz	FIYMCBNFEKWUPM-AWEZNQCLSA-N	1	1	303.362	1.837	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000895386249	711500140	/nfs/dbraw/zinc/50/01/40/711500140.db2.gz	PIUCGUBEOSRVSC-NHYWBVRUSA-N	1	1	308.334	1.777	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+]2C2CCOCC2)c1	ZINC000896524902	711738108	/nfs/dbraw/zinc/73/81/08/711738108.db2.gz	XPDYWZYCPMKSCQ-ZDUSSCGKSA-N	1	1	306.366	1.842	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000914432471	713395017	/nfs/dbraw/zinc/39/50/17/713395017.db2.gz	VJBXLMUECYTLMT-BETUJISGSA-N	1	1	305.334	1.279	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000914432471	713395019	/nfs/dbraw/zinc/39/50/19/713395019.db2.gz	VJBXLMUECYTLMT-BETUJISGSA-N	1	1	305.334	1.279	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000929224037	713570631	/nfs/dbraw/zinc/57/06/31/713570631.db2.gz	HERJQKIVLBGACK-UHFFFAOYSA-N	1	1	309.341	1.831	20	5		DDBDMO
CCOC(=O)c1cnn(C2CC[NH+](CC[N+](=O)[O-])CC2)c1C	ZINC000930438364	713835075	/nfs/dbraw/zinc/83/50/75/713835075.db2.gz	MAZXMRCDBXZMLG-UHFFFAOYSA-N	1	1	310.354	1.282	20	5		DDBDMO
CN(C)[C@@H]1[C@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000931276409	714054749	/nfs/dbraw/zinc/05/47/49/714054749.db2.gz	HQRZIALUTXXACB-ZSHCYNCHSA-N	1	1	305.378	1.856	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@H]1C[C@H]1CCCO1	ZINC000933684395	714647894	/nfs/dbraw/zinc/64/78/94/714647894.db2.gz	ARKIRYPUHBUNEN-ZIAGYGMSSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@H]1C[C@H]1CCCO1	ZINC000933684395	714647896	/nfs/dbraw/zinc/64/78/96/714647896.db2.gz	ARKIRYPUHBUNEN-ZIAGYGMSSA-N	1	1	324.381	1.370	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000351508208	719250572	/nfs/dbraw/zinc/25/05/72/719250572.db2.gz	GKEJBALPRLSIPC-MNOVXSKESA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000351508208	719250574	/nfs/dbraw/zinc/25/05/74/719250574.db2.gz	GKEJBALPRLSIPC-MNOVXSKESA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1cc(Cl)nc(N2C[C@@H]3[C@H](C2)OCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC001164665844	719385019	/nfs/dbraw/zinc/38/50/19/719385019.db2.gz	IWTBKWUDDFDAPD-ZJUUUORDSA-N	1	1	312.757	1.471	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932528	721853695	/nfs/dbraw/zinc/85/36/95/721853695.db2.gz	YQVAGGKZVBCUMK-QWHCGFSZSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932528	721853696	/nfs/dbraw/zinc/85/36/96/721853696.db2.gz	YQVAGGKZVBCUMK-QWHCGFSZSA-N	1	1	305.382	1.204	20	5		DDBDMO
Cc1ccnc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c1[N+](=O)[O-]	ZINC001164965796	722068945	/nfs/dbraw/zinc/06/89/45/722068945.db2.gz	NMSCYYQRDQGQQU-OKILXGFUSA-N	1	1	318.377	1.598	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001120873812	782201200	/nfs/dbraw/zinc/20/12/00/782201200.db2.gz	GYEXGHRHKQUKQF-WBMJQRKESA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)[C@@H]1CN(C)CC[N@@H+]1C	ZINC001120873812	782201210	/nfs/dbraw/zinc/20/12/10/782201210.db2.gz	GYEXGHRHKQUKQF-WBMJQRKESA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)[C@@H]1CN(C)CC[N@H+]1C	ZINC001120873812	782201220	/nfs/dbraw/zinc/20/12/20/782201220.db2.gz	GYEXGHRHKQUKQF-WBMJQRKESA-N	1	1	322.409	1.787	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001121199292	782406193	/nfs/dbraw/zinc/40/61/93/782406193.db2.gz	NWIVISKYVGODAB-CUOATXAZSA-N	1	1	307.325	1.804	20	5		DDBDMO
O=c1cc([C@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)[nH]c(=O)[nH]1	ZINC001195694451	746680568	/nfs/dbraw/zinc/68/05/68/746680568.db2.gz	MTYNGVDQMXJPRB-VIFPVBQESA-N	1	1	322.346	1.847	20	5		DDBDMO
O=c1cc([C@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)[nH]c(=O)[nH]1	ZINC001195694451	746680571	/nfs/dbraw/zinc/68/05/71/746680571.db2.gz	MTYNGVDQMXJPRB-VIFPVBQESA-N	1	1	322.346	1.847	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC001196952428	747018050	/nfs/dbraw/zinc/01/80/50/747018050.db2.gz	HDTLOXMREJVLPU-CQSZACIVSA-N	1	1	318.333	1.126	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1ccn[nH]1	ZINC001031558348	747027023	/nfs/dbraw/zinc/02/70/23/747027023.db2.gz	VVJXBEKBHSCXHP-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC001198362459	747464162	/nfs/dbraw/zinc/46/41/62/747464162.db2.gz	GATRMTNVZVDJGO-NSHDSACASA-N	1	1	322.365	1.380	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2cncs2)CC1	ZINC000997770943	751268441	/nfs/dbraw/zinc/26/84/41/751268441.db2.gz	CVQRRTPOPPAQDM-CHWSQXEVSA-N	1	1	324.406	1.137	20	5		DDBDMO
O=C(c1ccco1)N1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169007155	762174706	/nfs/dbraw/zinc/17/47/06/762174706.db2.gz	LOHCKSDVOTZOBN-QWHCGFSZSA-N	1	1	307.350	1.483	20	5		DDBDMO
C[N@@H+](CCNC(=O)OC(C)(C)C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169006727	762174878	/nfs/dbraw/zinc/17/48/78/762174878.db2.gz	JFUJKXQMEJKKLJ-NWDGAFQWSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000823754176	758347596	/nfs/dbraw/zinc/34/75/96/758347596.db2.gz	VTGZIWCTSDFSTC-BETUJISGSA-N	1	1	321.402	1.992	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000823754176	758347611	/nfs/dbraw/zinc/34/76/11/758347611.db2.gz	VTGZIWCTSDFSTC-BETUJISGSA-N	1	1	321.402	1.992	20	5		DDBDMO
COc1cccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001020138886	760612995	/nfs/dbraw/zinc/61/29/95/760612995.db2.gz	GNULRKCVNQEIFE-QHSBEEBCSA-N	1	1	319.361	1.097	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363191	761492862	/nfs/dbraw/zinc/49/28/62/761492862.db2.gz	GYYHEMQMAVEMDK-NMFUWQPSSA-N	1	1	321.352	1.475	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCCNc1ncccc1[N+](=O)[O-]	ZINC001109463505	763732087	/nfs/dbraw/zinc/73/20/87/763732087.db2.gz	LMMDDYJBWQLWSL-UHFFFAOYSA-N	1	1	323.397	1.590	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CC[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329369	766255102	/nfs/dbraw/zinc/25/51/02/766255102.db2.gz	PMPRZXWUOCNROL-IAQYHMDHSA-N	1	1	312.341	1.941	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CC[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329369	766255104	/nfs/dbraw/zinc/25/51/04/766255104.db2.gz	PMPRZXWUOCNROL-IAQYHMDHSA-N	1	1	312.341	1.941	20	5		DDBDMO
CSc1nc(Cl)nc(N[C@H](N)CCC[NH3+])c1[N+](=O)[O-]	ZINC001159784946	771926454	/nfs/dbraw/zinc/92/64/54/771926454.db2.gz	MWIDWOMWEDEIHC-YFKPBYRVSA-N	1	1	306.779	1.196	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001093840556	775125936	/nfs/dbraw/zinc/12/59/36/775125936.db2.gz	MUITXOLJWBGNGF-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ncccc1[N+](=O)[O-])CC(C)(C)C	ZINC001094141397	775525616	/nfs/dbraw/zinc/52/56/16/775525616.db2.gz	UPYXCDZCPFHLPQ-UHFFFAOYSA-N	1	1	323.397	1.496	20	5		DDBDMO
Cc1ccc(N(C)CCNC(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC001100149704	775735223	/nfs/dbraw/zinc/73/52/23/775735223.db2.gz	LZZHZFDHMXKVEC-UHFFFAOYSA-N	1	1	322.409	1.796	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233803	777064867	/nfs/dbraw/zinc/06/48/67/777064867.db2.gz	YXFMNWGBDDMDQN-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233803	777064872	/nfs/dbraw/zinc/06/48/72/777064872.db2.gz	YXFMNWGBDDMDQN-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCN1CCN(C)CC1	ZINC001173234049	777065071	/nfs/dbraw/zinc/06/50/71/777065071.db2.gz	OYZLGNAIVSHZSO-HNNXBMFYSA-N	1	1	320.437	1.705	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN1CCN(C)CC1	ZINC001173234049	777065076	/nfs/dbraw/zinc/06/50/76/777065076.db2.gz	OYZLGNAIVSHZSO-HNNXBMFYSA-N	1	1	320.437	1.705	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H]([C@@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243240	778092008	/nfs/dbraw/zinc/09/20/08/778092008.db2.gz	NJRVTAPAOYXVHT-IINYFYTJSA-N	1	1	324.337	1.602	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H]([C@@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243240	778092017	/nfs/dbraw/zinc/09/20/17/778092017.db2.gz	NJRVTAPAOYXVHT-IINYFYTJSA-N	1	1	324.337	1.602	20	5		DDBDMO
COc1ccc(C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)o1	ZINC001179525191	779395555	/nfs/dbraw/zinc/39/55/55/779395555.db2.gz	KPIALYOEUYQRRP-UKRRQHHQSA-N	1	1	322.317	1.381	20	5		DDBDMO
C[N@H+](CCNC(=O)Cc1cnoc1)Cc1ccccc1[N+](=O)[O-]	ZINC001266313561	836103465	/nfs/dbraw/zinc/10/34/65/836103465.db2.gz	LUOHTILEVMDLKK-UHFFFAOYSA-N	1	1	318.333	1.374	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cc1cnoc1)Cc1ccccc1[N+](=O)[O-]	ZINC001266313561	836103467	/nfs/dbraw/zinc/10/34/67/836103467.db2.gz	LUOHTILEVMDLKK-UHFFFAOYSA-N	1	1	318.333	1.374	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C	ZINC001328044646	862655938	/nfs/dbraw/zinc/65/59/38/862655938.db2.gz	LOAQGQVZCLLYNV-WDMOLILDSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC001328044646	862655943	/nfs/dbraw/zinc/65/59/43/862655943.db2.gz	LOAQGQVZCLLYNV-WDMOLILDSA-N	1	1	307.350	1.179	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC001122733052	858951644	/nfs/dbraw/zinc/95/16/44/858951644.db2.gz	WJLPDSCDCIPOKJ-OLZOCXBDSA-N	1	1	322.413	1.241	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)n1	ZINC001157282400	863708851	/nfs/dbraw/zinc/70/88/51/863708851.db2.gz	NBWPIYZLELCEHC-ZWNOBZJWSA-N	1	1	320.349	1.307	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1csc(C2CC2)n1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761587	864111590	/nfs/dbraw/zinc/11/15/90/864111590.db2.gz	SNWLGLOYYOGTPD-VXGBXAGGSA-N	1	1	324.406	1.282	20	5		DDBDMO
[NH3+]Cc1ncn(-c2ccc([N+](=O)[O-])c(-c3ccc(F)cc3)n2)n1	ZINC001157931389	864277170	/nfs/dbraw/zinc/27/71/70/864277170.db2.gz	KCAUOOKMZUUPDE-UHFFFAOYSA-N	1	1	314.280	1.835	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)CCNS(C)(=O)=O	ZINC001331043190	864798319	/nfs/dbraw/zinc/79/83/19/864798319.db2.gz	UCSCOLWZFJSOEC-UHFFFAOYSA-N	1	1	315.395	1.193	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CCNS(C)(=O)=O	ZINC001331043190	864798324	/nfs/dbraw/zinc/79/83/24/864798324.db2.gz	UCSCOLWZFJSOEC-UHFFFAOYSA-N	1	1	315.395	1.193	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001332403323	865816116	/nfs/dbraw/zinc/81/61/16/865816116.db2.gz	PVVNHMYDBNDLAQ-YGRLFVJLSA-N	1	1	304.350	1.713	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)NCc2cccc([N+](=O)[O-])c2)no1	ZINC001320247423	866586280	/nfs/dbraw/zinc/58/62/80/866586280.db2.gz	RHSGYDYLDYXBHD-UHFFFAOYSA-N	1	1	304.306	1.574	20	5		DDBDMO
CN1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)C1	ZINC001162690167	867737601	/nfs/dbraw/zinc/73/76/01/867737601.db2.gz	TUQRCHNNYKBRFU-LBPRGKRZSA-N	1	1	320.393	1.325	20	5		DDBDMO
CN1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)C1	ZINC001162690167	867737607	/nfs/dbraw/zinc/73/76/07/867737607.db2.gz	TUQRCHNNYKBRFU-LBPRGKRZSA-N	1	1	320.393	1.325	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC([NH2+]C3COC3)C2)c(C(F)(F)F)c1	ZINC001164220662	869030364	/nfs/dbraw/zinc/03/03/64/869030364.db2.gz	KCIHSWBTJKNQEL-UHFFFAOYSA-N	1	1	318.255	1.186	20	5		DDBDMO
Cc1cc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)on1	ZINC001164491023	869229540	/nfs/dbraw/zinc/22/95/40/869229540.db2.gz	XSKUJUGLHPNLPH-CHWSQXEVSA-N	1	1	322.365	1.024	20	5		DDBDMO
COCC[NH+](CCOC)C1CN(c2ccsc2[N+](=O)[O-])C1	ZINC001337204094	869378438	/nfs/dbraw/zinc/37/84/38/869378438.db2.gz	ZFWMOHIVWDEWEB-UHFFFAOYSA-N	1	1	315.395	1.440	20	5		DDBDMO
CC(=O)c1c(N[C@@H](C)[C@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085167	869791297	/nfs/dbraw/zinc/79/12/97/869791297.db2.gz	VLQABJDAHZELAA-XHDPSFHLSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1c(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085167	869791302	/nfs/dbraw/zinc/79/13/02/869791302.db2.gz	VLQABJDAHZELAA-XHDPSFHLSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2cc(C(=O)OC)c([N+](=O)[O-])cc2OC)C1	ZINC001226441554	882434549	/nfs/dbraw/zinc/43/45/49/882434549.db2.gz	RICWHBLAMLCOBC-SNVBAGLBSA-N	1	1	324.333	1.863	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1NC	ZINC001303469074	871125693	/nfs/dbraw/zinc/12/56/93/871125693.db2.gz	IVCHJDKAZBOOQM-UHFFFAOYSA-N	1	1	317.349	1.825	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c(N)c1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC001348311188	874476011	/nfs/dbraw/zinc/47/60/11/874476011.db2.gz	GOTGLUQOPDFAET-CABZTGNLSA-N	1	1	311.361	1.362	20	5		DDBDMO
COCCCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001234397368	887934487	/nfs/dbraw/zinc/93/44/87/887934487.db2.gz	BMRGYSLWMXBNOM-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CNC(=O)[C@H]2C1	ZINC001254559141	896501680	/nfs/dbraw/zinc/50/16/80/896501680.db2.gz	IXFJFTUYSWLKFX-UBHSHLNASA-N	1	1	303.362	1.594	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001254564399	896501949	/nfs/dbraw/zinc/50/19/49/896501949.db2.gz	LNDLKGKDQROGFX-GXTWGEPZSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001254564399	896501959	/nfs/dbraw/zinc/50/19/59/896501959.db2.gz	LNDLKGKDQROGFX-GXTWGEPZSA-N	1	1	319.361	1.069	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCO[C@]3(CCOC3)C1)C2	ZINC001254593219	896522095	/nfs/dbraw/zinc/52/20/95/896522095.db2.gz	KAUNHDMLNPFOCF-JKSUJKDBSA-N	1	1	304.346	1.553	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCC[C@H](n3ccnn3)C1)C2	ZINC001254610583	896530147	/nfs/dbraw/zinc/53/01/47/896530147.db2.gz	LHJAHDMAQCYOQT-HOTGVXAUSA-N	1	1	313.361	1.991	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC001293263420	914377796	/nfs/dbraw/zinc/37/77/96/914377796.db2.gz	YABBBJJWOWAWOS-LLVKDONJSA-N	1	1	304.350	1.391	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1[NH2+]CCc2occc21	ZINC001263073233	900482066	/nfs/dbraw/zinc/48/20/66/900482066.db2.gz	WKKCOMYAEOJKDX-AWEZNQCLSA-N	1	1	301.302	1.691	20	5		DDBDMO
COc1ccc(NC(=O)C[C@@]2(O)CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001295474642	915834095	/nfs/dbraw/zinc/83/40/95/915834095.db2.gz	GKDJMSGNEMXKBT-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1CO	ZINC000248865541	282113201	/nfs/dbraw/zinc/11/32/01/282113201.db2.gz	AVQZUULGYJRHQY-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)n1	ZINC000249096364	282132682	/nfs/dbraw/zinc/13/26/82/282132682.db2.gz	YFDBCFIEXUHSBK-LBPRGKRZSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O	ZINC000451334530	231070140	/nfs/dbraw/zinc/07/01/40/231070140.db2.gz	BVFUGYKBVKEADN-OUCADQQQSA-N	1	1	308.382	1.844	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@H]1O	ZINC000249590447	282179493	/nfs/dbraw/zinc/17/94/93/282179493.db2.gz	VGJPRKOGAFGXNM-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@H]1O	ZINC000249590447	282179496	/nfs/dbraw/zinc/17/94/96/282179496.db2.gz	VGJPRKOGAFGXNM-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](CCCO)C1	ZINC000452136608	231317447	/nfs/dbraw/zinc/31/74/47/231317447.db2.gz	YSWUJQZHDXKHCC-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](CCCO)C1	ZINC000452136608	231317451	/nfs/dbraw/zinc/31/74/51/231317451.db2.gz	YSWUJQZHDXKHCC-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1	ZINC000090512317	185299694	/nfs/dbraw/zinc/29/96/94/185299694.db2.gz	JCTHXVYRTIULNO-UHFFFAOYSA-N	1	1	317.345	1.897	20	5		DDBDMO
CCOC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090549242	185302365	/nfs/dbraw/zinc/30/23/65/185302365.db2.gz	TUJQOAGNSNJDSH-CYBMUJFWSA-N	1	1	309.366	1.505	20	5		DDBDMO
C[N@@H+](CCC(N)=O)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000286625507	219091082	/nfs/dbraw/zinc/09/10/82/219091082.db2.gz	XWOJDQGEIMINRL-UHFFFAOYSA-N	1	1	318.333	1.600	20	5		DDBDMO
CNS(=O)(=O)C[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000330618914	530019283	/nfs/dbraw/zinc/01/92/83/530019283.db2.gz	YGZBYZNGGZPGGZ-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNS(=O)(=O)C[C@@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000330618914	530019284	/nfs/dbraw/zinc/01/92/84/530019284.db2.gz	YGZBYZNGGZPGGZ-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000358395660	299142021	/nfs/dbraw/zinc/14/20/21/299142021.db2.gz	PGRGLIJPBIOLBN-CYBMUJFWSA-N	1	1	307.325	1.583	20	5		DDBDMO
C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000138649610	186018232	/nfs/dbraw/zinc/01/82/32/186018232.db2.gz	ARJHYFJUWAIJNK-GMTAPVOTSA-N	1	1	309.370	1.414	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1	ZINC000152521566	186081626	/nfs/dbraw/zinc/08/16/26/186081626.db2.gz	BPDQHKDIZRVPIR-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000266842761	186356244	/nfs/dbraw/zinc/35/62/44/186356244.db2.gz	OXQWMJQELPVTIY-UHFFFAOYSA-N	1	1	317.349	1.642	20	5		DDBDMO
O=C(NCC1([NH+]2CCCCC2)CCCCC1)[C@H]1CC1[N+](=O)[O-]	ZINC000047295366	352489557	/nfs/dbraw/zinc/48/95/57/352489557.db2.gz	BQBZVMXICACNEW-UONOGXRCSA-N	1	1	309.410	1.957	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000052875304	352630119	/nfs/dbraw/zinc/63/01/19/352630119.db2.gz	LQIVUAMKTWYXFM-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@@H](C)O1	ZINC000054925855	352710433	/nfs/dbraw/zinc/71/04/33/352710433.db2.gz	LHQRTSYUYYVJIJ-GHMZBOCLSA-N	1	1	324.381	1.541	20	5		DDBDMO
Cc1ccccc1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000053968487	352674183	/nfs/dbraw/zinc/67/41/83/352674183.db2.gz	ABDUDTMYONNUPN-CVEARBPZSA-N	1	1	317.389	1.741	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1Cc1[nH+]ccn1CC(F)(F)F	ZINC000057742780	352826705	/nfs/dbraw/zinc/82/67/05/352826705.db2.gz	ATCADQIPEYMACM-UHFFFAOYSA-N	1	1	302.212	1.564	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CCC[C@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000067374575	353046128	/nfs/dbraw/zinc/04/61/28/353046128.db2.gz	DMYDJBKDOQKKMM-KBPBESRZSA-N	1	1	305.334	1.157	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC[C@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000067374575	353046133	/nfs/dbraw/zinc/04/61/33/353046133.db2.gz	DMYDJBKDOQKKMM-KBPBESRZSA-N	1	1	305.334	1.157	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)CC[C@H](C)O)cccc1[N+](=O)[O-]	ZINC000072713230	353210659	/nfs/dbraw/zinc/21/06/59/353210659.db2.gz	RUYSNIBRBBOFEC-NSHDSACASA-N	1	1	309.366	1.935	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2	ZINC000072830759	353219520	/nfs/dbraw/zinc/21/95/20/353219520.db2.gz	UACFNEQOGLDTFM-MRXNPFEDSA-N	1	1	319.361	1.576	20	5		DDBDMO
Cn1nnc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1	ZINC000494388671	282889243	/nfs/dbraw/zinc/88/92/43/282889243.db2.gz	WKMPVXAYLZLOMX-LBPRGKRZSA-N	1	1	302.338	1.229	20	5		DDBDMO
Cc1cc(NC2CC[NH+](CCN(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000074740238	353327731	/nfs/dbraw/zinc/32/77/31/353327731.db2.gz	XLUBSCAGRXNMQS-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccccn2)C2CC2)c1	ZINC000174665999	198367416	/nfs/dbraw/zinc/36/74/16/198367416.db2.gz	KKXOCHSZMFCZEN-OAHLLOKOSA-N	1	1	317.349	1.212	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(C(=O)c3cc([N+](=O)[O-])c[nH]3)CC2)CCO1	ZINC000079427314	353561067	/nfs/dbraw/zinc/56/10/67/353561067.db2.gz	DRTZLMWKWCLPDI-NSHDSACASA-N	1	1	322.365	1.248	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000091478069	353827105	/nfs/dbraw/zinc/82/71/05/353827105.db2.gz	JZSQLOUPZIDGAW-GFCCVEGCSA-N	1	1	306.366	1.594	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1	ZINC000091478046	353827212	/nfs/dbraw/zinc/82/72/12/353827212.db2.gz	SNFNRHJRHUAAFN-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCC[C@H](C(N)=O)C1	ZINC000092642214	353865016	/nfs/dbraw/zinc/86/50/16/353865016.db2.gz	DJZBAPDACFDISL-LBPRGKRZSA-N	1	1	321.381	1.298	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000108304201	353949531	/nfs/dbraw/zinc/94/95/31/353949531.db2.gz	LFXWHYDQUMZZSJ-ZDUSSCGKSA-N	1	1	319.361	1.818	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000093345224	353897548	/nfs/dbraw/zinc/89/75/48/353897548.db2.gz	UZTNZWOQJBBREC-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000093345224	353897550	/nfs/dbraw/zinc/89/75/50/353897550.db2.gz	UZTNZWOQJBBREC-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000156795685	354221494	/nfs/dbraw/zinc/22/14/94/354221494.db2.gz	UBEZHSDJULELLZ-WFASDCNBSA-N	1	1	321.377	1.363	20	5		DDBDMO
C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000156795685	354221498	/nfs/dbraw/zinc/22/14/98/354221498.db2.gz	UBEZHSDJULELLZ-WFASDCNBSA-N	1	1	321.377	1.363	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@@H](CO)CC2)c1	ZINC000293114302	354454046	/nfs/dbraw/zinc/45/40/46/354454046.db2.gz	LVKSBXOYNPTBIA-HIFRSBDPSA-N	1	1	324.377	1.429	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000316903140	354506876	/nfs/dbraw/zinc/50/68/76/354506876.db2.gz	PAOXBICMQAWGIS-LBPRGKRZSA-N	1	1	305.334	1.666	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)C(C)(C)C2)c1	ZINC000317580125	354512194	/nfs/dbraw/zinc/51/21/94/354512194.db2.gz	PUMSNEANJDXWQO-UHFFFAOYSA-N	1	1	307.350	1.912	20	5		DDBDMO
CC[N@@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000588006097	354892763	/nfs/dbraw/zinc/89/27/63/354892763.db2.gz	VRXUYAGWZHHGCX-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000588006097	354892765	/nfs/dbraw/zinc/89/27/65/354892765.db2.gz	VRXUYAGWZHHGCX-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589501392	354997031	/nfs/dbraw/zinc/99/70/31/354997031.db2.gz	MCZJCTLCURQFCA-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589501392	354997035	/nfs/dbraw/zinc/99/70/35/354997035.db2.gz	MCZJCTLCURQFCA-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1O	ZINC000589505441	354998111	/nfs/dbraw/zinc/99/81/11/354998111.db2.gz	IHHOEQQDYYBZGI-QMTHXVAHSA-N	1	1	308.334	1.584	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590447424	355099271	/nfs/dbraw/zinc/09/92/71/355099271.db2.gz	XDCSNEKQAIPBIM-ZYHUDNBSSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)C[C@@H]21	ZINC000590659994	355139857	/nfs/dbraw/zinc/13/98/57/355139857.db2.gz	RIPNZYFSDJLEKN-ABAIWWIYSA-N	1	1	319.361	1.597	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592829334	355705913	/nfs/dbraw/zinc/70/59/13/355705913.db2.gz	NXKHYASARCWTQN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@H+](C)C1	ZINC000592829334	355705916	/nfs/dbraw/zinc/70/59/16/355705916.db2.gz	NXKHYASARCWTQN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592829334	355705919	/nfs/dbraw/zinc/70/59/19/355705919.db2.gz	NXKHYASARCWTQN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2C[C@H]1C[S@@]2=O)Nc1ccccc1[N+](=O)[O-]	ZINC000593104226	355799253	/nfs/dbraw/zinc/79/92/53/355799253.db2.gz	XUJBMGFLXUSUBV-GANBNBROSA-N	1	1	323.374	1.129	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000593187836	355821131	/nfs/dbraw/zinc/82/11/31/355821131.db2.gz	USWHIQWUFBGJCU-IJLUTSLNSA-N	1	1	309.370	1.121	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCCC[C@@H]1CO	ZINC000594017221	356089837	/nfs/dbraw/zinc/08/98/37/356089837.db2.gz	VQWCGWKJPHVLBY-KGLIPLIRSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1	ZINC000594357517	356182231	/nfs/dbraw/zinc/18/22/31/356182231.db2.gz	OSMOWHWMNQZRJQ-ZDUSSCGKSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594418564	356204042	/nfs/dbraw/zinc/20/40/42/356204042.db2.gz	KDZXQNSEIRHDJO-RYUDHWBXSA-N	1	1	321.381	1.627	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000594584485	356256043	/nfs/dbraw/zinc/25/60/43/356256043.db2.gz	DPNDOEMVGYTNEG-LBPRGKRZSA-N	1	1	324.381	1.280	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000594584485	356256044	/nfs/dbraw/zinc/25/60/44/356256044.db2.gz	DPNDOEMVGYTNEG-LBPRGKRZSA-N	1	1	324.381	1.280	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+]C2CCN([C@H]3CCOC3)CC2)cs1	ZINC000594992143	356369092	/nfs/dbraw/zinc/36/90/92/356369092.db2.gz	BEBDQUFPDIPWTD-ZDUSSCGKSA-N	1	1	311.407	1.999	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c1[N+](=O)[O-]	ZINC000595309171	356443186	/nfs/dbraw/zinc/44/31/86/356443186.db2.gz	QVVRCMDMCBHNRO-LBPRGKRZSA-N	1	1	324.381	1.875	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](CNC(=O)C(C)C)C2)c1[N+](=O)[O-]	ZINC000595309171	356443189	/nfs/dbraw/zinc/44/31/89/356443189.db2.gz	QVVRCMDMCBHNRO-LBPRGKRZSA-N	1	1	324.381	1.875	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H](C[NH2+]C)C2)c1[N+](=O)[O-]	ZINC000236884049	202052098	/nfs/dbraw/zinc/05/20/98/202052098.db2.gz	CLBORPWYKUAMPG-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000595659799	356595872	/nfs/dbraw/zinc/59/58/72/356595872.db2.gz	AOZLARFOVZVIAH-HNNXBMFYSA-N	1	1	310.350	1.447	20	5		DDBDMO
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000595660662	356597418	/nfs/dbraw/zinc/59/74/18/356597418.db2.gz	CZJOSVWOHSRNNQ-CMPLNLGQSA-N	1	1	314.725	1.668	20	5		DDBDMO
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1OC	ZINC000595666974	356600655	/nfs/dbraw/zinc/60/06/55/356600655.db2.gz	NKACMSRLCGMBEH-WCQYABFASA-N	1	1	310.306	1.024	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1C[C@H](C)C(O)[C@@H](C)C1	ZINC000595741710	356631162	/nfs/dbraw/zinc/63/11/62/356631162.db2.gz	DCMWJXGXHHLLFO-RYUDHWBXSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1COCCO1	ZINC000595735754	356627854	/nfs/dbraw/zinc/62/78/54/356627854.db2.gz	CCUCLFOTKSXFOL-NSHDSACASA-N	1	1	307.306	1.583	20	5		DDBDMO
C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1COCCO1	ZINC000595735754	356627858	/nfs/dbraw/zinc/62/78/58/356627858.db2.gz	CCUCLFOTKSXFOL-NSHDSACASA-N	1	1	307.306	1.583	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])c1	ZINC000595767178	356643761	/nfs/dbraw/zinc/64/37/61/356643761.db2.gz	WGFUHBJRZXHLJN-GXFFZTMASA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])c1	ZINC000595767178	356643764	/nfs/dbraw/zinc/64/37/64/356643764.db2.gz	WGFUHBJRZXHLJN-GXFFZTMASA-N	1	1	323.349	1.387	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595761063	356642308	/nfs/dbraw/zinc/64/23/08/356642308.db2.gz	WLSUIAYUPQMIJC-XHBSWPGZSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595761063	356642313	/nfs/dbraw/zinc/64/23/13/356642313.db2.gz	WLSUIAYUPQMIJC-XHBSWPGZSA-N	1	1	319.361	1.890	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000595828454	356666769	/nfs/dbraw/zinc/66/67/69/356666769.db2.gz	FASTVKPTQAMWQI-STQMWFEESA-N	1	1	305.334	1.162	20	5		DDBDMO
C[N@H+](CC1=CCSC1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595895042	356694897	/nfs/dbraw/zinc/69/48/97/356694897.db2.gz	BQKPATCKCHCKRL-AWEZNQCLSA-N	1	1	324.402	1.940	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596121319	356781081	/nfs/dbraw/zinc/78/10/81/356781081.db2.gz	VOWBIKGRCJTAPC-GFCCVEGCSA-N	1	1	306.366	1.980	20	5		DDBDMO
COc1cc(N[C@@H](C)C[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1C	ZINC000596123178	356781600	/nfs/dbraw/zinc/78/16/00/356781600.db2.gz	LFJNYJXJESWWKG-ZDUSSCGKSA-N	1	1	322.409	1.960	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H](C)[C@H]1O	ZINC000597204349	357091922	/nfs/dbraw/zinc/09/19/22/357091922.db2.gz	HSODFMUHMOCLAA-CDMJZVDBSA-N	1	1	322.361	1.815	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@H](C)O1	ZINC000347605125	283241346	/nfs/dbraw/zinc/24/13/46/283241346.db2.gz	IZVHERAXFGTJPQ-TXEJJXNPSA-N	1	1	324.381	1.542	20	5		DDBDMO
CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](CC)C1	ZINC000598039038	357437882	/nfs/dbraw/zinc/43/78/82/357437882.db2.gz	HRMPENRJISMQSI-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1	ZINC000598039038	357437884	/nfs/dbraw/zinc/43/78/84/357437884.db2.gz	HRMPENRJISMQSI-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1nccc(C(=O)OC)c1[N+](=O)[O-]	ZINC000598594813	357646417	/nfs/dbraw/zinc/64/64/17/357646417.db2.gz	DDTLXAFZWQQDBP-UHFFFAOYSA-N	1	1	310.354	1.920	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598651088	357671210	/nfs/dbraw/zinc/67/12/10/357671210.db2.gz	QQOSGWPRLOODMD-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598651088	357671215	/nfs/dbraw/zinc/67/12/15/357671215.db2.gz	QQOSGWPRLOODMD-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347890595	283291622	/nfs/dbraw/zinc/29/16/22/283291622.db2.gz	KDWBUUSUFWJTHN-LBPRGKRZSA-N	1	1	321.381	1.222	20	5		DDBDMO
CCOC(=O)C[C@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000599404966	357924054	/nfs/dbraw/zinc/92/40/54/357924054.db2.gz	OMUCAOFIQDTGEF-AWEZNQCLSA-N	1	1	310.350	1.383	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CC2(C)COC2)c1	ZINC000599572627	357979062	/nfs/dbraw/zinc/97/90/62/357979062.db2.gz	DAGUIKBNVQIVDC-UHFFFAOYSA-N	1	1	308.334	1.850	20	5		DDBDMO
C[C@]1(CO)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000599624935	357996903	/nfs/dbraw/zinc/99/69/03/357996903.db2.gz	ZIMIKZPTBAXUDM-IYBDPMFKSA-N	1	1	324.377	1.286	20	5		DDBDMO
O=c1ccc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)n[nH]1	ZINC000599641259	358002844	/nfs/dbraw/zinc/00/28/44/358002844.db2.gz	METOZIFGLVUBQG-GFCCVEGCSA-N	1	1	304.310	1.124	20	5		DDBDMO
O=c1ccc([C@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)n[nH]1	ZINC000599641259	358002849	/nfs/dbraw/zinc/00/28/49/358002849.db2.gz	METOZIFGLVUBQG-GFCCVEGCSA-N	1	1	304.310	1.124	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)C[C@H]2C[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000599670350	358018154	/nfs/dbraw/zinc/01/81/54/358018154.db2.gz	FDYFCEFFNNFHRI-BETUJISGSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599673873	358019290	/nfs/dbraw/zinc/01/92/90/358019290.db2.gz	VDGIAUMJNDUUMJ-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1	ZINC000600115359	358127363	/nfs/dbraw/zinc/12/73/63/358127363.db2.gz	FXPCLPSHIXZPRN-NSHDSACASA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1	ZINC000600115359	358127366	/nfs/dbraw/zinc/12/73/66/358127366.db2.gz	FXPCLPSHIXZPRN-NSHDSACASA-N	1	1	303.322	1.973	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)Nc1nncs1)c1cccc([N+](=O)[O-])c1	ZINC000180432500	199158489	/nfs/dbraw/zinc/15/84/89/199158489.db2.gz	AJAUIROJNCWHGR-MRVPVSSYSA-N	1	1	307.335	1.736	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000600472263	358233843	/nfs/dbraw/zinc/23/38/43/358233843.db2.gz	NMEXCWXHZFUUAV-GFCCVEGCSA-N	1	1	318.377	1.924	20	5		DDBDMO
CCn1cnnc1CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601118500	358409939	/nfs/dbraw/zinc/40/99/39/358409939.db2.gz	NVLUFNLKPNGRHX-UHFFFAOYSA-N	1	1	312.333	1.831	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000601956529	358753081	/nfs/dbraw/zinc/75/30/81/358753081.db2.gz	RUNLZTJFGASDIC-GOEBONIOSA-N	1	1	308.378	1.939	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000601956529	358753083	/nfs/dbraw/zinc/75/30/83/358753083.db2.gz	RUNLZTJFGASDIC-GOEBONIOSA-N	1	1	308.378	1.939	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)C[C@H]1CC[N@@H+](C)C1	ZINC000602073711	358801814	/nfs/dbraw/zinc/80/18/14/358801814.db2.gz	OJWIWQDPTMTPPW-LLVKDONJSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC(C)OC(=O)C[C@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602616965	359076652	/nfs/dbraw/zinc/07/66/52/359076652.db2.gz	LBWZLSSAZWFBPU-GFCCVEGCSA-N	1	1	324.381	1.882	20	5		DDBDMO
CC(C)OC(=O)C[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602616965	359076655	/nfs/dbraw/zinc/07/66/55/359076655.db2.gz	LBWZLSSAZWFBPU-GFCCVEGCSA-N	1	1	324.381	1.882	20	5		DDBDMO
CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602635830	359089189	/nfs/dbraw/zinc/08/91/89/359089189.db2.gz	CCEKWIIVBNMOKE-HNNXBMFYSA-N	1	1	324.381	1.740	20	5		DDBDMO
CN1CCN(CCC[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000602594225	359060994	/nfs/dbraw/zinc/06/09/94/359060994.db2.gz	WAQWDKYRUCQBQM-UHFFFAOYSA-N	1	1	306.410	1.364	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1	ZINC000602783086	359188992	/nfs/dbraw/zinc/18/89/92/359188992.db2.gz	YESKUXVPIIDHBT-GFCCVEGCSA-N	1	1	324.381	1.763	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000602707128	359137680	/nfs/dbraw/zinc/13/76/80/359137680.db2.gz	CPDGQFNVZLCKQI-AWEZNQCLSA-N	1	1	323.397	1.015	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000602707128	359137683	/nfs/dbraw/zinc/13/76/83/359137683.db2.gz	CPDGQFNVZLCKQI-AWEZNQCLSA-N	1	1	323.397	1.015	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC(C)(C)[C@@H]1[C@H]1CCCO1	ZINC000602835139	359226630	/nfs/dbraw/zinc/22/66/30/359226630.db2.gz	XVKOMGXTCAAMNZ-OCCSQVGLSA-N	1	1	308.382	1.989	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@H](OCc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602819089	359213737	/nfs/dbraw/zinc/21/37/37/359213737.db2.gz	APMMWXGHCFVEGH-CQSZACIVSA-N	1	1	317.349	1.514	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](OCc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602819089	359213742	/nfs/dbraw/zinc/21/37/42/359213742.db2.gz	APMMWXGHCFVEGH-CQSZACIVSA-N	1	1	317.349	1.514	20	5		DDBDMO
COC(=O)[C@H](C)[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCC1	ZINC000602827706	359220831	/nfs/dbraw/zinc/22/08/31/359220831.db2.gz	MZGYJASOCVUMLT-JTQLQIEISA-N	1	1	310.354	1.516	20	5		DDBDMO
COC(=O)[C@H](C)[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCC1	ZINC000602827706	359220834	/nfs/dbraw/zinc/22/08/34/359220834.db2.gz	MZGYJASOCVUMLT-JTQLQIEISA-N	1	1	310.354	1.516	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1Cc2c[nH]nc2CC(C)(C)C1	ZINC000602902435	359282895	/nfs/dbraw/zinc/28/28/95/359282895.db2.gz	LVFKPKPSSLJQCP-UHFFFAOYSA-N	1	1	318.381	1.907	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](CN2CCCC2=O)C1	ZINC000602903829	359283989	/nfs/dbraw/zinc/28/39/89/359283989.db2.gz	SUFAFDCSXSEORT-ZDUSSCGKSA-N	1	1	321.381	1.044	20	5		DDBDMO
Cc1nn(CC[N@@H+]2CCO[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603325191	359570145	/nfs/dbraw/zinc/57/01/45/359570145.db2.gz	HMQVWFZINNILQJ-JTQLQIEISA-N	1	1	305.338	1.369	20	5		DDBDMO
Cc1nn(CC[N@H+]2CCO[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603325191	359570148	/nfs/dbraw/zinc/57/01/48/359570148.db2.gz	HMQVWFZINNILQJ-JTQLQIEISA-N	1	1	305.338	1.369	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1O	ZINC000186825286	200018168	/nfs/dbraw/zinc/01/81/68/200018168.db2.gz	XQKFUJGWWZLFAB-ZLDLUXBVSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2c([N+](=O)[O-])ncn2C)CC1	ZINC000603401241	359617565	/nfs/dbraw/zinc/61/75/65/359617565.db2.gz	KICFDKWFIGFDRJ-NSHDSACASA-N	1	1	309.370	1.018	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000609383605	360303402	/nfs/dbraw/zinc/30/34/02/360303402.db2.gz	WIKONWGIJSNAOG-ZDUSSCGKSA-N	1	1	318.377	1.851	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000609269557	360285914	/nfs/dbraw/zinc/28/59/14/360285914.db2.gz	UAONIOPJQPNDGO-GFCCVEGCSA-N	1	1	307.350	1.435	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000609471159	360311496	/nfs/dbraw/zinc/31/14/96/360311496.db2.gz	CWHGPHBJPFHBAN-GFCCVEGCSA-N	1	1	322.365	1.367	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)CO	ZINC000609894926	360362673	/nfs/dbraw/zinc/36/26/73/360362673.db2.gz	OIPICJAGOUKNKA-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)CO	ZINC000609894926	360362679	/nfs/dbraw/zinc/36/26/79/360362679.db2.gz	OIPICJAGOUKNKA-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CCC[N@@H+](C)C1	ZINC000610187911	360389296	/nfs/dbraw/zinc/38/92/96/360389296.db2.gz	XBMCJZUORWAQMV-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C[C@H]1C	ZINC000619441025	364009491	/nfs/dbraw/zinc/00/94/91/364009491.db2.gz	CGJCTGFQRHMGBX-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C[C@H]1C	ZINC000619441025	364009494	/nfs/dbraw/zinc/00/94/94/364009494.db2.gz	CGJCTGFQRHMGBX-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)ccc1[N+](=O)[O-]	ZINC000619873375	364170945	/nfs/dbraw/zinc/17/09/45/364170945.db2.gz	HZTNLJFSUYBHKT-AWEZNQCLSA-N	1	1	318.377	1.023	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000275526526	212395230	/nfs/dbraw/zinc/39/52/30/212395230.db2.gz	WHUIJTWJYRNJQD-NSHDSACASA-N	1	1	311.313	1.783	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H](c2ccccc2)C1	ZINC000351486022	284336404	/nfs/dbraw/zinc/33/64/04/284336404.db2.gz	LTSBOBKVIUSAIH-UKRRQHHQSA-N	1	1	314.345	1.751	20	5		DDBDMO
C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000351486886	284337306	/nfs/dbraw/zinc/33/73/06/284337306.db2.gz	YJPGXAFELDWRIB-GXTWGEPZSA-N	1	1	314.345	1.751	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H]3OCCN(C)[C@H]3C2)cc1[N+](=O)[O-]	ZINC000284504887	218055738	/nfs/dbraw/zinc/05/57/38/218055738.db2.gz	XXKNHUTVJNGTLR-JKSUJKDBSA-N	1	1	305.378	1.808	20	5		DDBDMO
COCC[N@H+](CCO)Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000104958697	194058267	/nfs/dbraw/zinc/05/82/67/194058267.db2.gz	MRQUYDYKKSGLHT-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
COCC[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000104958697	194058269	/nfs/dbraw/zinc/05/82/69/194058269.db2.gz	MRQUYDYKKSGLHT-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1[C@H]1CCCO1	ZINC000284669836	218124292	/nfs/dbraw/zinc/12/42/92/218124292.db2.gz	GUTZNXJURBHRSG-UONOGXRCSA-N	1	1	307.350	1.400	20	5		DDBDMO
CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(C)C1=O	ZINC000338966786	250222896	/nfs/dbraw/zinc/22/28/96/250222896.db2.gz	YZIYJJBZDOTZBG-CQSZACIVSA-N	1	1	319.361	1.873	20	5		DDBDMO
CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(C)C1=O	ZINC000338966786	250222901	/nfs/dbraw/zinc/22/29/01/250222901.db2.gz	YZIYJJBZDOTZBG-CQSZACIVSA-N	1	1	319.361	1.873	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000339140068	250311770	/nfs/dbraw/zinc/31/17/70/250311770.db2.gz	LDAUOCDJSNKIDX-CYBMUJFWSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCN1CC[NH+](CCCNc2ccc([N+](=O)[O-])c(C)n2)CC1	ZINC000268427568	206705669	/nfs/dbraw/zinc/70/56/69/206705669.db2.gz	AMELFDLAPJQNBG-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1ccc([C@H](C)NC[C@H]2C[N@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847717	207015596	/nfs/dbraw/zinc/01/55/96/207015596.db2.gz	BQBWEFGGCYOTGC-ZFWWWQNUSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1ccc([C@H](C)NC[C@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847717	207015600	/nfs/dbraw/zinc/01/56/00/207015600.db2.gz	BQBWEFGGCYOTGC-ZFWWWQNUSA-N	1	1	306.410	1.800	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000156258995	197099797	/nfs/dbraw/zinc/09/97/97/197099797.db2.gz	JGSYEFRZOVFTPH-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)CC1	ZINC000059014083	184133948	/nfs/dbraw/zinc/13/39/48/184133948.db2.gz	GLBJSYKEIXNWEH-UHFFFAOYSA-N	1	1	321.333	1.159	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000340992611	251323322	/nfs/dbraw/zinc/32/33/22/251323322.db2.gz	NIMCABNANJMBNF-SECBINFHSA-N	1	1	315.333	1.438	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000119623649	195004846	/nfs/dbraw/zinc/00/48/46/195004846.db2.gz	UDMGNNVOXJSSRG-LBPRGKRZSA-N	1	1	320.393	1.885	20	5		DDBDMO
O=C1[C@H]([N@@H+](CCO)CC2CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000352468359	285072765	/nfs/dbraw/zinc/07/27/65/285072765.db2.gz	ROSAXQKVPKRIKD-OAHLLOKOSA-N	1	1	319.361	1.404	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000352660765	285204800	/nfs/dbraw/zinc/20/48/00/285204800.db2.gz	TVIVGBBDAJDQKS-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000156258995	197099796	/nfs/dbraw/zinc/09/97/96/197099796.db2.gz	JGSYEFRZOVFTPH-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1C	ZINC000444700026	533436229	/nfs/dbraw/zinc/43/62/29/533436229.db2.gz	FOSHXCNRDUJYOA-KOLCDFICSA-N	1	1	318.333	1.855	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1C	ZINC000444700026	533436234	/nfs/dbraw/zinc/43/62/34/533436234.db2.gz	FOSHXCNRDUJYOA-KOLCDFICSA-N	1	1	318.333	1.855	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000066832330	407260613	/nfs/dbraw/zinc/26/06/13/407260613.db2.gz	PNXKDQNHYBRLJM-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000063761987	407235066	/nfs/dbraw/zinc/23/50/66/407235066.db2.gz	WEHVWNQGHTXWEY-UHFFFAOYSA-N	1	1	320.393	1.585	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1CO	ZINC000101546691	407310339	/nfs/dbraw/zinc/31/03/39/407310339.db2.gz	BZFOTBHEVNHDBE-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCCNC1=O	ZINC000105612120	407354964	/nfs/dbraw/zinc/35/49/64/407354964.db2.gz	NDGJYZRCLCWWTE-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCOC1	ZINC000107696096	407378435	/nfs/dbraw/zinc/37/84/35/407378435.db2.gz	FCPBRGCAHFHRQX-HIFRSBDPSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111320867	407407398	/nfs/dbraw/zinc/40/73/98/407407398.db2.gz	YTQCRTHCEWVJFY-ZOKQIPHBSA-N	1	1	319.361	1.910	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111320867	407407399	/nfs/dbraw/zinc/40/73/99/407407399.db2.gz	YTQCRTHCEWVJFY-ZOKQIPHBSA-N	1	1	319.361	1.910	20	5		DDBDMO
C[NH+]1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000265849364	407483680	/nfs/dbraw/zinc/48/36/80/407483680.db2.gz	HWSOLCUWECPOQY-UHFFFAOYSA-N	1	1	313.785	1.795	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC1CCS(=O)(=O)CC1	ZINC000271211483	407575991	/nfs/dbraw/zinc/57/59/91/407575991.db2.gz	HSMFYHMEYPKQFN-UHFFFAOYSA-N	1	1	312.391	1.851	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])CC1CCS(=O)(=O)CC1	ZINC000271211483	407575997	/nfs/dbraw/zinc/57/59/97/407575997.db2.gz	HSMFYHMEYPKQFN-UHFFFAOYSA-N	1	1	312.391	1.851	20	5		DDBDMO
COCC[N@@H+](C)CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000171070434	407587536	/nfs/dbraw/zinc/58/75/36/407587536.db2.gz	BRDFNXVDJPYUKS-UHFFFAOYSA-N	1	1	322.365	1.470	20	5		DDBDMO
CN(CC(=O)NC[C@H]1CC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000266258648	407533980	/nfs/dbraw/zinc/53/39/80/407533980.db2.gz	KGHRHIRJXKALHF-GFCCVEGCSA-N	1	1	306.366	1.099	20	5		DDBDMO
CC(C)(C)[C@H](C[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000261755498	407604544	/nfs/dbraw/zinc/60/45/44/407604544.db2.gz	UIOJDCYDRIOFCW-JTQLQIEISA-N	1	1	319.358	1.386	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@](O)(C(F)(F)F)C1	ZINC000266881639	407660080	/nfs/dbraw/zinc/66/00/80/407660080.db2.gz	XNZZCELUIMIMLW-LBPRGKRZSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@](O)(C(F)(F)F)C1	ZINC000266881639	407660082	/nfs/dbraw/zinc/66/00/82/407660082.db2.gz	XNZZCELUIMIMLW-LBPRGKRZSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN2CCC[N@H+](C3CC3)CC2)c1	ZINC000178858401	407630813	/nfs/dbraw/zinc/63/08/13/407630813.db2.gz	NVWYJMMKYISOBF-INIZCTEOSA-N	1	1	305.378	1.798	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2[C@@H](O)C(F)(F)F)c1	ZINC000266907306	407670658	/nfs/dbraw/zinc/67/06/58/407670658.db2.gz	BOLNDTIPIMBBNL-NXEZZACHSA-N	1	1	308.260	1.179	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000115432799	407679732	/nfs/dbraw/zinc/67/97/32/407679732.db2.gz	NPEXMZSAIMIWHV-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](Oc3ccncc3)C2)n1	ZINC000131842881	407756240	/nfs/dbraw/zinc/75/62/40/407756240.db2.gz	FXLFYXUYRUZSKX-ZDUSSCGKSA-N	1	1	303.322	1.340	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000267248824	407807034	/nfs/dbraw/zinc/80/70/34/407807034.db2.gz	GFBSVEKXBJOHPB-VXGBXAGGSA-N	1	1	304.350	1.534	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000268171917	407925333	/nfs/dbraw/zinc/92/53/33/407925333.db2.gz	QTWXJGVYMYZILG-YGRLFVJLSA-N	1	1	318.377	1.849	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1	ZINC000245443750	407984613	/nfs/dbraw/zinc/98/46/13/407984613.db2.gz	JCBCKDAIWRZTBT-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCSCC1	ZINC000273170913	408091732	/nfs/dbraw/zinc/09/17/32/408091732.db2.gz	OTZNHASXHUBTOZ-LBPRGKRZSA-N	1	1	312.391	1.773	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCOC2(CCC2)C1	ZINC000182321002	408124526	/nfs/dbraw/zinc/12/45/26/408124526.db2.gz	ROFOEMRDWYTPEB-ZDUSSCGKSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCOC2(CCC2)C1	ZINC000182321002	408124534	/nfs/dbraw/zinc/12/45/34/408124534.db2.gz	ROFOEMRDWYTPEB-ZDUSSCGKSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH2+][C@@H](CO)c2c(F)cccc2F)n1	ZINC000273094890	408055831	/nfs/dbraw/zinc/05/58/31/408055831.db2.gz	KKAPTPPXJNALMD-NSHDSACASA-N	1	1	312.276	1.393	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CC[NH+](C2CC2)CC1	ZINC000122136714	408255345	/nfs/dbraw/zinc/25/53/45/408255345.db2.gz	FJALXXCPCCSOMV-UHFFFAOYSA-N	1	1	323.324	1.419	20	5		DDBDMO
COC(=O)c1cc(C[N@H+](C)CCn2ccc([N+](=O)[O-])n2)oc1C	ZINC000176200031	408306380	/nfs/dbraw/zinc/30/63/80/408306380.db2.gz	VBKPGBWTNFMOOY-UHFFFAOYSA-N	1	1	322.321	1.611	20	5		DDBDMO
COC(=O)c1cc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)oc1C	ZINC000176200031	408306385	/nfs/dbraw/zinc/30/63/85/408306385.db2.gz	VBKPGBWTNFMOOY-UHFFFAOYSA-N	1	1	322.321	1.611	20	5		DDBDMO
CCOC(=O)N[C@@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176210050	408309925	/nfs/dbraw/zinc/30/99/25/408309925.db2.gz	DWWOYMJFJLXUSE-LLVKDONJSA-N	1	1	311.342	1.002	20	5		DDBDMO
CCOC(=O)N[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176210050	408309928	/nfs/dbraw/zinc/30/99/28/408309928.db2.gz	DWWOYMJFJLXUSE-LLVKDONJSA-N	1	1	311.342	1.002	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000183196585	408350597	/nfs/dbraw/zinc/35/05/97/408350597.db2.gz	QYLOCRBARMMPDC-SRVKXCTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000264014657	408344823	/nfs/dbraw/zinc/34/48/23/408344823.db2.gz	WFVOASOODVWILC-UHFFFAOYSA-N	1	1	312.395	1.024	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000183225433	408360463	/nfs/dbraw/zinc/36/04/63/408360463.db2.gz	QQHCYTHPSTUFMN-OBJOEFQTSA-N	1	1	310.350	1.037	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCn3ccc([N+](=O)[O-])n3)[C@H]2C1	ZINC000246908142	408364127	/nfs/dbraw/zinc/36/41/27/408364127.db2.gz	RPYCQNDTIORNGG-AGIUHOORSA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)[C@H]2C1	ZINC000246908142	408364133	/nfs/dbraw/zinc/36/41/33/408364133.db2.gz	RPYCQNDTIORNGG-AGIUHOORSA-N	1	1	310.354	1.060	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000247318325	408448641	/nfs/dbraw/zinc/44/86/41/408448641.db2.gz	MIJYZYZAUUQHTQ-MWLCHTKSSA-N	1	1	309.370	1.095	20	5		DDBDMO
CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176828351	408452995	/nfs/dbraw/zinc/45/29/95/408452995.db2.gz	JNMIMAGQVZHVGZ-CYBMUJFWSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176828351	408452998	/nfs/dbraw/zinc/45/29/98/408452998.db2.gz	JNMIMAGQVZHVGZ-CYBMUJFWSA-N	1	1	306.366	1.589	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000247340720	408453805	/nfs/dbraw/zinc/45/38/05/408453805.db2.gz	JFAWDLMMMDJZQS-SWLSCSKDSA-N	1	1	305.378	1.936	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCS1	ZINC000247237118	408435654	/nfs/dbraw/zinc/43/56/54/408435654.db2.gz	DKFYHXZEQKVNIN-CHWSQXEVSA-N	1	1	314.411	1.226	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177087994	408516035	/nfs/dbraw/zinc/51/60/35/408516035.db2.gz	LOLMANGLGOBSRZ-RYUDHWBXSA-N	1	1	319.361	1.715	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000183974565	408522294	/nfs/dbraw/zinc/52/22/94/408522294.db2.gz	ZPGWGILPUQLABY-BQYQJAHWSA-N	1	1	307.350	1.038	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247993130	408524080	/nfs/dbraw/zinc/52/40/80/408524080.db2.gz	JQJBSKOPJPPVAD-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247993130	408524086	/nfs/dbraw/zinc/52/40/86/408524086.db2.gz	JQJBSKOPJPPVAD-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC1(O)CC[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000177311550	162587898	/nfs/dbraw/zinc/58/78/98/162587898.db2.gz	SVCQTSCIFYTVKT-AWEZNQCLSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1	ZINC000177269613	408567528	/nfs/dbraw/zinc/56/75/28/408567528.db2.gz	KBFUXBNLXVTJJU-AAEUAGOBSA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1	ZINC000177269613	408567530	/nfs/dbraw/zinc/56/75/30/408567530.db2.gz	KBFUXBNLXVTJJU-AAEUAGOBSA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@H]1CN(Cc2csc([N+](=O)[O-])c2)C[C@@H]1[NH+]1CCOCC1	ZINC000177269613	408567532	/nfs/dbraw/zinc/56/75/32/408567532.db2.gz	KBFUXBNLXVTJJU-AAEUAGOBSA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248456629	408571021	/nfs/dbraw/zinc/57/10/21/408571021.db2.gz	LTJHUTQBLAQSHH-BFHYXJOUSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCC([C@H](O)C(F)(F)F)CC2)n1	ZINC000161500932	408610156	/nfs/dbraw/zinc/61/01/56/408610156.db2.gz	JNAMRLORYDKJSZ-NSHDSACASA-N	1	1	322.287	1.427	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270858193	408711770	/nfs/dbraw/zinc/71/17/70/408711770.db2.gz	HTSLTFKLXPPEAY-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270858193	408711775	/nfs/dbraw/zinc/71/17/75/408711775.db2.gz	HTSLTFKLXPPEAY-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000265733792	408762407	/nfs/dbraw/zinc/76/24/07/408762407.db2.gz	AJJBRIDONRNKRX-LLVKDONJSA-N	1	1	308.334	1.930	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000290863214	408846475	/nfs/dbraw/zinc/84/64/75/408846475.db2.gz	YVJJQCLEYDRNKA-UWVGGRQHSA-N	1	1	307.354	1.008	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CC[N@H+](C)C2)c1	ZINC000280855702	408847461	/nfs/dbraw/zinc/84/74/61/408847461.db2.gz	ATSSVRGAFYYGMU-ZDUSSCGKSA-N	1	1	321.377	1.740	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000281674564	408907845	/nfs/dbraw/zinc/90/78/45/408907845.db2.gz	LWIYKCOUAJRHLT-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[NH+](C)[C@@H]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000277303990	408915726	/nfs/dbraw/zinc/91/57/26/408915726.db2.gz	PHEYTMSKIHWGFX-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
CN(C)CC[NH+]1CCC(Nc2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000286264267	408951769	/nfs/dbraw/zinc/95/17/69/408951769.db2.gz	WBRLPISQMJWFSK-UHFFFAOYSA-N	1	1	307.398	1.615	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)C1	ZINC000292073888	408974653	/nfs/dbraw/zinc/97/46/53/408974653.db2.gz	DVEUVNAISZXJPD-INIZCTEOSA-N	1	1	318.377	1.221	20	5		DDBDMO
CCCN(CCC[NH+](C)C)C(=O)c1n[nH]c(CC)c1[N+](=O)[O-]	ZINC000277972933	409043473	/nfs/dbraw/zinc/04/34/73/409043473.db2.gz	NOUZWXGHZLDELY-UHFFFAOYSA-N	1	1	311.386	1.684	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H](O)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000293297327	409084371	/nfs/dbraw/zinc/08/43/71/409084371.db2.gz	WICKTNGMKKNZPC-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)C[C@H]2C1	ZINC000278962796	409122241	/nfs/dbraw/zinc/12/22/41/409122241.db2.gz	AZYDEOVYNVMSQR-PHIMTYICSA-N	1	1	323.324	1.133	20	5		DDBDMO
C[C@@H]1[C@H]([N@@H+](C)CCO)CCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000293687232	409161127	/nfs/dbraw/zinc/16/11/27/409161127.db2.gz	NSBSZDUCCHIOSN-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)C2)C1	ZINC000293807813	409183727	/nfs/dbraw/zinc/18/37/27/409183727.db2.gz	AMAJZJICWOGWFQ-OAHLLOKOSA-N	1	1	320.349	1.253	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1C1CC1	ZINC000279492328	409223749	/nfs/dbraw/zinc/22/37/49/409223749.db2.gz	RSEFPJUUPNLAIC-BDAKNGLRSA-N	1	1	322.340	1.671	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1C1CC1	ZINC000279492332	409223812	/nfs/dbraw/zinc/22/38/12/409223812.db2.gz	RSEFPJUUPNLAIC-DTWKUNHWSA-N	1	1	322.340	1.671	20	5		DDBDMO
Cc1ccc(C(=O)NCCC[N@H+](C)CCN(C)C)cc1[N+](=O)[O-]	ZINC000290221571	409327640	/nfs/dbraw/zinc/32/76/40/409327640.db2.gz	VDIMABJBUDMVGF-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1ccc(C(=O)NCCCN(C)CC[NH+](C)C)cc1[N+](=O)[O-]	ZINC000290221571	409327644	/nfs/dbraw/zinc/32/76/44/409327644.db2.gz	VDIMABJBUDMVGF-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000295210695	409376458	/nfs/dbraw/zinc/37/64/58/409376458.db2.gz	LNKGICWICNPCIB-CQSZACIVSA-N	1	1	321.312	1.245	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3ncc([N+](=O)[O-])cc3Cl)[C@H]2C1	ZINC000284571801	409350847	/nfs/dbraw/zinc/35/08/47/409350847.db2.gz	OKWSUCKTVFRBON-RYUDHWBXSA-N	1	1	312.757	1.553	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc(F)cc1[N+](=O)[O-]	ZINC000324549124	164050991	/nfs/dbraw/zinc/05/09/91/164050991.db2.gz	YAEUHGAPYHMVND-MNOVXSKESA-N	1	1	322.340	1.673	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000328574796	164052065	/nfs/dbraw/zinc/05/20/65/164052065.db2.gz	XGJWYUBSIQUISJ-PHIMTYICSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000328574796	164052066	/nfs/dbraw/zinc/05/20/66/164052066.db2.gz	XGJWYUBSIQUISJ-PHIMTYICSA-N	1	1	306.366	1.801	20	5		DDBDMO
CS[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296233464	409473815	/nfs/dbraw/zinc/47/38/15/409473815.db2.gz	KTIWJEMKZCPREF-NEPJUHHUSA-N	1	1	312.391	1.772	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(Cc3cc([O-])ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000407998990	164193727	/nfs/dbraw/zinc/19/37/27/164193727.db2.gz	SORWLXFFJBWCFM-CABCVRRESA-N	1	1	307.350	1.205	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000407998990	164193729	/nfs/dbraw/zinc/19/37/29/164193729.db2.gz	SORWLXFFJBWCFM-CABCVRRESA-N	1	1	307.350	1.205	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)CC[C@@H]1C	ZINC000354006987	409596443	/nfs/dbraw/zinc/59/64/43/409596443.db2.gz	OFVGNGXVFMHWQK-NSHDSACASA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@]1(O)CCOC[C@H]1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000331623724	409707618	/nfs/dbraw/zinc/70/76/18/409707618.db2.gz	YEXKBUXXPHEAMA-KKUMJFAQSA-N	1	1	324.381	1.043	20	5		DDBDMO
Cc1cc(OCC(=O)NC2C[NH+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000297171064	409834856	/nfs/dbraw/zinc/83/48/56/409834856.db2.gz	TXWJYQNUWKSFBS-UHFFFAOYSA-N	1	1	307.350	1.491	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)C1CC1	ZINC000342896436	409982106	/nfs/dbraw/zinc/98/21/06/409982106.db2.gz	CRTFMFZLUSHRIA-UHFFFAOYSA-N	1	1	302.334	1.900	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239810	410007232	/nfs/dbraw/zinc/00/72/32/410007232.db2.gz	IOIPQZRZMLZKKB-NXEZZACHSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000332239810	410007237	/nfs/dbraw/zinc/00/72/37/410007237.db2.gz	IOIPQZRZMLZKKB-NXEZZACHSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239810	410007244	/nfs/dbraw/zinc/00/72/44/410007244.db2.gz	IOIPQZRZMLZKKB-NXEZZACHSA-N	1	1	317.349	1.684	20	5		DDBDMO
COc1ccc(CNC(=O)NCC[N@@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000338464306	410008073	/nfs/dbraw/zinc/00/80/73/410008073.db2.gz	NGNVHYKVVZUHRH-UHFFFAOYSA-N	1	1	324.381	1.743	20	5		DDBDMO
Cc1ncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000351872239	410307028	/nfs/dbraw/zinc/30/70/28/410307028.db2.gz	DBJVAWOZMMMICZ-CYBMUJFWSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000351872239	410307038	/nfs/dbraw/zinc/30/70/38/410307038.db2.gz	DBJVAWOZMMMICZ-CYBMUJFWSA-N	1	1	314.349	1.775	20	5		DDBDMO
CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)CCOC	ZINC000347338267	410482392	/nfs/dbraw/zinc/48/23/92/410482392.db2.gz	MBAHOWATIWVEDB-UHFFFAOYSA-N	1	1	323.349	1.861	20	5		DDBDMO
C[C@]12CCC[N@H+]1C[C@@H](c1noc(-c3ccc([N+](=O)[O-])[nH]3)n1)OC2	ZINC000347343720	410484240	/nfs/dbraw/zinc/48/42/40/410484240.db2.gz	SSYNBEYMYRCTFS-IINYFYTJSA-N	1	1	319.321	1.899	20	5		DDBDMO
CCOc1cc(N2CC[C@@H]3OCC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000579935187	422859528	/nfs/dbraw/zinc/85/95/28/422859528.db2.gz	PYMQBFCQTDSNTL-CABCVRRESA-N	1	1	321.377	1.903	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)C[NH+]2CCOCC2)c1	ZINC000359392862	410636685	/nfs/dbraw/zinc/63/66/85/410636685.db2.gz	NWGUNFYVZGFWJQ-CYBMUJFWSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cc1c(NC(=O)N2CC[NH+](C[C@@H](C)O)CC2)cccc1[N+](=O)[O-]	ZINC000343717333	410645570	/nfs/dbraw/zinc/64/55/70/410645570.db2.gz	QDGMGYXTSXPFBD-LLVKDONJSA-N	1	1	322.365	1.434	20	5		DDBDMO
CN(C(=O)c1cc([O-])ccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000352956298	410700431	/nfs/dbraw/zinc/70/04/31/410700431.db2.gz	LBHLDINZVFHWBY-LLVKDONJSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000301915424	410830432	/nfs/dbraw/zinc/83/04/32/410830432.db2.gz	ISDNIPOFSDPNDM-LLVKDONJSA-N	1	1	304.354	1.781	20	5		DDBDMO
Cc1c([C@H](C)NC[C@@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673533	410866115	/nfs/dbraw/zinc/86/61/15/410866115.db2.gz	HKGPOMFCILMVPH-UONOGXRCSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1c([C@H](C)NC[C@@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673533	410866119	/nfs/dbraw/zinc/86/61/19/410866119.db2.gz	HKGPOMFCILMVPH-UONOGXRCSA-N	1	1	306.410	1.800	20	5		DDBDMO
CNS(=O)(=O)C[C@@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000330604173	410821538	/nfs/dbraw/zinc/82/15/38/410821538.db2.gz	GSFFMSXKURGQQN-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNS(=O)(=O)C[C@@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000330604173	410821542	/nfs/dbraw/zinc/82/15/42/410821542.db2.gz	GSFFMSXKURGQQN-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000344121276	410971244	/nfs/dbraw/zinc/97/12/44/410971244.db2.gz	DWVZTYJUKVMUTE-GHMZBOCLSA-N	1	1	307.350	1.287	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000348522942	410997036	/nfs/dbraw/zinc/99/70/36/410997036.db2.gz	AQSBBLMXRRVNSX-NWDGAFQWSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC(O)C1	ZINC000353466842	411006797	/nfs/dbraw/zinc/00/67/97/411006797.db2.gz	JTJQKAHJLABHIB-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC(O)C1	ZINC000353466842	411006803	/nfs/dbraw/zinc/00/68/03/411006803.db2.gz	JTJQKAHJLABHIB-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
C[C@H](NC(=O)N1CC[NH2+]C[C@@](C)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000417140703	225222906	/nfs/dbraw/zinc/22/29/06/225222906.db2.gz	QJVVFHKGURGKJK-XHDPSFHLSA-N	1	1	324.356	1.999	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000417223378	225251585	/nfs/dbraw/zinc/25/15/85/225251585.db2.gz	GNAKEGACOAVSOW-OAHLLOKOSA-N	1	1	324.356	1.480	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290501275	221701922	/nfs/dbraw/zinc/70/19/22/221701922.db2.gz	ASWZBRGHZRGWAD-LLVKDONJSA-N	1	1	321.381	1.399	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1	ZINC000374105750	418488268	/nfs/dbraw/zinc/48/82/68/418488268.db2.gz	JQSHJFVQGHMBTL-AEGPPILISA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1	ZINC000374105750	418488270	/nfs/dbraw/zinc/48/82/70/418488270.db2.gz	JQSHJFVQGHMBTL-AEGPPILISA-N	1	1	308.334	1.198	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000361403210	418645896	/nfs/dbraw/zinc/64/58/96/418645896.db2.gz	NFYCZFSURSATDG-JSGCOSHPSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC(C)N1CC[C@H]([N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403848	418634679	/nfs/dbraw/zinc/63/46/79/418634679.db2.gz	MOIIZZYJZIWZNZ-JSGCOSHPSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)N1CC[C@H]([N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403848	418634682	/nfs/dbraw/zinc/63/46/82/418634682.db2.gz	MOIIZZYJZIWZNZ-JSGCOSHPSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)N1CC[C@@H]([N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403851	418635119	/nfs/dbraw/zinc/63/51/19/418635119.db2.gz	MOIIZZYJZIWZNZ-TZMCWYRMSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)N1CC[C@@H]([N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403851	418635121	/nfs/dbraw/zinc/63/51/21/418635121.db2.gz	MOIIZZYJZIWZNZ-TZMCWYRMSA-N	1	1	321.381	1.438	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000365568547	418876444	/nfs/dbraw/zinc/87/64/44/418876444.db2.gz	ZGJUYYVRPJLDOE-UHFFFAOYSA-N	1	1	318.337	1.160	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3cc(F)ccc3[N+](=O)[O-])CC2)C1	ZINC000365100675	418837288	/nfs/dbraw/zinc/83/72/88/418837288.db2.gz	PPFUCTDQZMEIDH-AWEZNQCLSA-N	1	1	322.384	1.950	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411430317	418903389	/nfs/dbraw/zinc/90/33/89/418903389.db2.gz	OALBNPRODBTTJM-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000411430317	418903392	/nfs/dbraw/zinc/90/33/92/418903392.db2.gz	OALBNPRODBTTJM-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000411430317	418903393	/nfs/dbraw/zinc/90/33/93/418903393.db2.gz	OALBNPRODBTTJM-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000365249228	418846255	/nfs/dbraw/zinc/84/62/55/418846255.db2.gz	PZTQGNJCHGFBFZ-NWDGAFQWSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2CC[NH2+][C@@H]2C1	ZINC000372871584	418911484	/nfs/dbraw/zinc/91/14/84/418911484.db2.gz	QSCUGXZZQZQJPX-NOZJJQNGSA-N	1	1	315.333	1.295	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@](O)(C2CC2)C1	ZINC000365838410	418914744	/nfs/dbraw/zinc/91/47/44/418914744.db2.gz	NVNCRWPYYQOHNM-MRXNPFEDSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365838410	418914746	/nfs/dbraw/zinc/91/47/46/418914746.db2.gz	NVNCRWPYYQOHNM-MRXNPFEDSA-N	1	1	319.361	1.689	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913819	419366093	/nfs/dbraw/zinc/36/60/93/419366093.db2.gz	GPXRHUQXQLSGAW-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913819	419366100	/nfs/dbraw/zinc/36/61/00/419366100.db2.gz	GPXRHUQXQLSGAW-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@@H]2CCO)c1	ZINC000426254578	419423809	/nfs/dbraw/zinc/42/38/09/419423809.db2.gz	DZLRASKILOYYJZ-TZMCWYRMSA-N	1	1	310.350	1.181	20	5		DDBDMO
CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCC[N@H+]1C	ZINC000420996871	419431396	/nfs/dbraw/zinc/43/13/96/419431396.db2.gz	GHYQFRNBLAXINB-ZDUSSCGKSA-N	1	1	306.366	1.220	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@]12CCOC2	ZINC000421010948	419446648	/nfs/dbraw/zinc/44/66/48/419446648.db2.gz	DBFUSZYEFKYTHY-IUODEOHRSA-N	1	1	308.334	1.199	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](O)[C@H](CO)C1	ZINC000412111116	419675070	/nfs/dbraw/zinc/67/50/70/419675070.db2.gz	VQTMZJJUJBKXEK-DZGCQCFKSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](O)[C@H](CO)C1	ZINC000412111116	419675076	/nfs/dbraw/zinc/67/50/76/419675076.db2.gz	VQTMZJJUJBKXEK-DZGCQCFKSA-N	1	1	324.377	1.557	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091202	419650172	/nfs/dbraw/zinc/65/01/72/419650172.db2.gz	QOUIBIVHRKSJPV-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091202	419650179	/nfs/dbraw/zinc/65/01/79/419650179.db2.gz	QOUIBIVHRKSJPV-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[NH+](C)C1CCC(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000422003430	419801880	/nfs/dbraw/zinc/80/18/80/419801880.db2.gz	CYMNCQDSRHCMLM-UHFFFAOYSA-N	1	1	307.350	1.903	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000299470095	229136902	/nfs/dbraw/zinc/13/69/02/229136902.db2.gz	BHEQUHMMTZGVCE-STQMWFEESA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1c(CC(=O)N2CC[NH2+]C[C@](C)(F)C2)cccc1[N+](=O)[O-]	ZINC000423679510	420124185	/nfs/dbraw/zinc/12/41/85/420124185.db2.gz	KNNQVBDOTFKPGD-HNNXBMFYSA-N	1	1	309.341	1.606	20	5		DDBDMO
CC1(C)C[C@H](NC[C@H]2C[NH2+]CCO2)c2cc([N+](=O)[O-])ccc21	ZINC000423580167	420086104	/nfs/dbraw/zinc/08/61/04/420086104.db2.gz	XHTIRRHKOZJKPL-DOMZBBRYSA-N	1	1	305.378	1.895	20	5		DDBDMO
[NH3+]C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCC1	ZINC000423943139	420278054	/nfs/dbraw/zinc/27/80/54/420278054.db2.gz	QNYIVRAANRGPJL-CYBMUJFWSA-N	1	1	317.349	1.718	20	5		DDBDMO
Cc1c(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000416294352	420310206	/nfs/dbraw/zinc/31/02/06/420310206.db2.gz	KVODYNCPAXUXRG-RYUDHWBXSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000416294352	420310209	/nfs/dbraw/zinc/31/02/09/420310209.db2.gz	KVODYNCPAXUXRG-RYUDHWBXSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1cccc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425068911	420325774	/nfs/dbraw/zinc/32/57/74/420325774.db2.gz	USYHQPYCCBYIHP-WCQYABFASA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000444180099	230060793	/nfs/dbraw/zinc/06/07/93/230060793.db2.gz	FNZLAGDTGQHSLG-LLVKDONJSA-N	1	1	323.349	1.596	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCCO	ZINC000440943410	420619497	/nfs/dbraw/zinc/61/94/97/420619497.db2.gz	QJRSJDSTFPTQMM-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000452112041	420621862	/nfs/dbraw/zinc/62/18/62/420621862.db2.gz	DWAIDMQNVVWOFN-CQSZACIVSA-N	1	1	320.393	1.608	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1CO	ZINC000441692434	420660229	/nfs/dbraw/zinc/66/02/29/420660229.db2.gz	TUCRKFAXGKSFBY-XPKDYRNWSA-N	1	1	324.377	1.427	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000493138354	420766020	/nfs/dbraw/zinc/76/60/20/420766020.db2.gz	HWCIOCXYQZQPCB-FOQNGQEVSA-N	1	1	311.288	1.674	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000454376794	420849431	/nfs/dbraw/zinc/84/94/31/420849431.db2.gz	SVXJJVSKXZDPLH-JTQLQIEISA-N	1	1	307.354	1.246	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000449746131	421073621	/nfs/dbraw/zinc/07/36/21/421073621.db2.gz	QGTDGNSTARXLME-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000449746131	421073623	/nfs/dbraw/zinc/07/36/23/421073623.db2.gz	QGTDGNSTARXLME-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000546810969	421310575	/nfs/dbraw/zinc/31/05/75/421310575.db2.gz	DRBANJHDLSYPCQ-WFASDCNBSA-N	1	1	310.350	1.181	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)n1	ZINC000548692861	421463471	/nfs/dbraw/zinc/46/34/71/421463471.db2.gz	LKSAQIGJQZEBGD-CYBMUJFWSA-N	1	1	322.409	1.888	20	5		DDBDMO
CNc1nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)ccc1[N+](=O)[O-]	ZINC000563397794	421501544	/nfs/dbraw/zinc/50/15/44/421501544.db2.gz	WMSYICOKAGLPCE-WDEREUQCSA-N	1	1	319.365	1.340	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H](N3CCOCC3)C2)cc1	ZINC000571223226	421698497	/nfs/dbraw/zinc/69/84/97/421698497.db2.gz	TUJULPIJANMGBL-QGZVFWFLSA-N	1	1	319.405	1.934	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1	ZINC000536597335	421722054	/nfs/dbraw/zinc/72/20/54/421722054.db2.gz	YGDLSZJGNBMWCK-UHFFFAOYSA-N	1	1	318.381	1.948	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000581926076	422069686	/nfs/dbraw/zinc/06/96/86/422069686.db2.gz	FEBBAOXXOMHMCT-GXFFZTMASA-N	1	1	305.334	1.380	20	5		DDBDMO
COc1cc(C[N@H+](C)CCO)c([N+](=O)[O-])cc1OCC(F)F	ZINC000179866674	263362810	/nfs/dbraw/zinc/36/28/10/263362810.db2.gz	RBQJUXPXUFNAGT-UHFFFAOYSA-N	1	1	320.292	1.671	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCO)c([N+](=O)[O-])cc1OCC(F)F	ZINC000179866674	263362813	/nfs/dbraw/zinc/36/28/13/263362813.db2.gz	RBQJUXPXUFNAGT-UHFFFAOYSA-N	1	1	320.292	1.671	20	5		DDBDMO
Cn1cc([C@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)C(C)(C)C)cn1	ZINC000342314808	271373279	/nfs/dbraw/zinc/37/32/79/271373279.db2.gz	ZVSGAAYRZXSKFV-LBPRGKRZSA-N	1	1	306.370	1.939	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000342474116	271428476	/nfs/dbraw/zinc/42/84/76/271428476.db2.gz	NKYCPKNBIQTKAA-LKFCYVNXSA-N	1	1	307.325	1.946	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000344425758	272022703	/nfs/dbraw/zinc/02/27/03/272022703.db2.gz	OHMXTSWQVLRGSK-PHIMTYICSA-N	1	1	309.370	1.041	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2C)C[C@@H]1C	ZINC000345925769	272366451	/nfs/dbraw/zinc/36/64/51/272366451.db2.gz	SAIMDUFOGUAZRS-WDEREUQCSA-N	1	1	306.366	1.853	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000413482122	274017149	/nfs/dbraw/zinc/01/71/49/274017149.db2.gz	XSNRWHXVZRQXKY-UHFFFAOYSA-N	1	1	309.366	1.378	20	5		DDBDMO
C[C@@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC[N@@H+]1CCO	ZINC000302911997	274360912	/nfs/dbraw/zinc/36/09/12/274360912.db2.gz	ZXANZSKTZSLSBQ-LLVKDONJSA-N	1	1	306.366	1.066	20	5		DDBDMO
C[C@@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC[N@H+]1CCO	ZINC000302911997	274360914	/nfs/dbraw/zinc/36/09/14/274360914.db2.gz	ZXANZSKTZSLSBQ-LLVKDONJSA-N	1	1	306.366	1.066	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](C)C[NH+]1CCOCC1	ZINC000192613590	276722420	/nfs/dbraw/zinc/72/24/20/276722420.db2.gz	YWULWQPDIBHADU-NSHDSACASA-N	1	1	311.386	1.500	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000124941007	281197747	/nfs/dbraw/zinc/19/77/47/281197747.db2.gz	OJGMQQHPLDMZLT-VMPITWQZSA-N	1	1	301.346	1.915	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000126299813	281233648	/nfs/dbraw/zinc/23/36/48/281233648.db2.gz	UJUFOSXWIRICRB-NSHDSACASA-N	1	1	309.370	1.036	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000128404398	281310346	/nfs/dbraw/zinc/31/03/46/281310346.db2.gz	VRVFGXSYFFRFQA-GFCCVEGCSA-N	1	1	323.397	1.569	20	5		DDBDMO
CN(C(=O)[C@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000362985819	300194257	/nfs/dbraw/zinc/19/42/57/300194257.db2.gz	JVZOOQBEOJIVBQ-JKSUJKDBSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000363050831	300204050	/nfs/dbraw/zinc/20/40/50/300204050.db2.gz	NMAYFIITZFOZCJ-HRCADAONSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363050831	300204051	/nfs/dbraw/zinc/20/40/51/300204051.db2.gz	NMAYFIITZFOZCJ-HRCADAONSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363050831	300204055	/nfs/dbraw/zinc/20/40/55/300204055.db2.gz	NMAYFIITZFOZCJ-HRCADAONSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000364173983	300353796	/nfs/dbraw/zinc/35/37/96/300353796.db2.gz	KKHOUPHJNCJFPF-XGUBFFRZSA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000364173983	300353798	/nfs/dbraw/zinc/35/37/98/300353798.db2.gz	KKHOUPHJNCJFPF-XGUBFFRZSA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000364173983	300353800	/nfs/dbraw/zinc/35/38/00/300353800.db2.gz	KKHOUPHJNCJFPF-XGUBFFRZSA-N	1	1	318.377	1.198	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](n3cncn3)C2)c1	ZINC000368412122	301022437	/nfs/dbraw/zinc/02/24/37/301022437.db2.gz	RCNQNIBISWBXIF-ZDUSSCGKSA-N	1	1	303.322	1.512	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CCOCC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000368717621	301080582	/nfs/dbraw/zinc/08/05/82/301080582.db2.gz	YLWMRWVTJWCXGR-UHFFFAOYSA-N	1	1	319.361	1.696	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCOCC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000368717621	301080585	/nfs/dbraw/zinc/08/05/85/301080585.db2.gz	YLWMRWVTJWCXGR-UHFFFAOYSA-N	1	1	319.361	1.696	20	5		DDBDMO
CN(C(=O)[C@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccncc2)CC1	ZINC000368818582	301092361	/nfs/dbraw/zinc/09/23/61/301092361.db2.gz	UIKMNBHQDOIQGO-LSDHHAIUSA-N	1	1	318.377	1.170	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000369143537	301136479	/nfs/dbraw/zinc/13/64/79/301136479.db2.gz	KWOZVDDEPSBEQC-ZJUUUORDSA-N	1	1	307.354	1.237	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000369143534	301136601	/nfs/dbraw/zinc/13/66/01/301136601.db2.gz	KWOZVDDEPSBEQC-NXEZZACHSA-N	1	1	307.354	1.237	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000531829407	303259784	/nfs/dbraw/zinc/25/97/84/303259784.db2.gz	HIDDBKIFLGPWJN-CYBMUJFWSA-N	1	1	312.366	1.691	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H](CO)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000362091390	307014272	/nfs/dbraw/zinc/01/42/72/307014272.db2.gz	UQBLICXTDQIMAN-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccnc(N2CC[NH+]([C@H]3CCSC3)CC2)c1[N+](=O)[O-]	ZINC000363917265	307037529	/nfs/dbraw/zinc/03/75/29/307037529.db2.gz	FHWNRRSFEBBZOF-LBPRGKRZSA-N	1	1	308.407	1.926	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2ccco2)C1	ZINC000367142448	307087010	/nfs/dbraw/zinc/08/70/10/307087010.db2.gz	WRUWXULKRUQLLF-GFCCVEGCSA-N	1	1	303.318	1.839	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000367377995	307092357	/nfs/dbraw/zinc/09/23/57/307092357.db2.gz	NVERFTSOIPHBAB-QWRGUYRKSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)C[C@H]21	ZINC000376662930	307252475	/nfs/dbraw/zinc/25/24/75/307252475.db2.gz	DANQRIJTORCLAL-ZWNOBZJWSA-N	1	1	307.325	1.900	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000510146626	307398997	/nfs/dbraw/zinc/39/89/97/307398997.db2.gz	WYTJNMPXRNFPJO-BETUJISGSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000510146626	307398998	/nfs/dbraw/zinc/39/89/98/307398998.db2.gz	WYTJNMPXRNFPJO-BETUJISGSA-N	1	1	307.350	1.951	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000565715625	308038287	/nfs/dbraw/zinc/03/82/87/308038287.db2.gz	HZRQHQBXQXPOLS-JTQLQIEISA-N	1	1	313.379	1.140	20	5		DDBDMO
C[N@@H+](C[C@H](O)CNCCOc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000566117003	308043702	/nfs/dbraw/zinc/04/37/02/308043702.db2.gz	LJAOSOAPYKYLDO-CQSZACIVSA-N	1	1	309.366	1.018	20	5		DDBDMO
CN(C[C@H](O)C[NH2+]CCOc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000566117003	308043703	/nfs/dbraw/zinc/04/37/03/308043703.db2.gz	LJAOSOAPYKYLDO-CQSZACIVSA-N	1	1	309.366	1.018	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](CO)[C@@H](O)C1	ZINC000574228348	308265767	/nfs/dbraw/zinc/26/57/67/308265767.db2.gz	ZBXWQMNEJKGHPQ-DOMZBBRYSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CO)[C@@H](O)C1	ZINC000574228348	308265768	/nfs/dbraw/zinc/26/57/68/308265768.db2.gz	ZBXWQMNEJKGHPQ-DOMZBBRYSA-N	1	1	324.377	1.557	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](CO)[C@H]1C	ZINC000488801829	484219281	/nfs/dbraw/zinc/21/92/81/484219281.db2.gz	NHVIXJIZBKDJLO-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595875161	490372381	/nfs/dbraw/zinc/37/23/81/490372381.db2.gz	PWFBSUPWRHBQGQ-DVOMOZLQSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccn1	ZINC000181784963	490688585	/nfs/dbraw/zinc/68/85/85/490688585.db2.gz	WIOHNPUZSLYGIJ-SNVBAGLBSA-N	1	1	300.318	1.940	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@](O)(CO)C1	ZINC000459638448	528210844	/nfs/dbraw/zinc/21/08/44/528210844.db2.gz	BYRFKFNZKBXMFD-MRXNPFEDSA-N	1	1	324.377	1.701	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@](O)(CO)C1	ZINC000459638448	528210847	/nfs/dbraw/zinc/21/08/47/528210847.db2.gz	BYRFKFNZKBXMFD-MRXNPFEDSA-N	1	1	324.377	1.701	20	5		DDBDMO
CCOc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000419007321	528312947	/nfs/dbraw/zinc/31/29/47/528312947.db2.gz	RKITYCALSFULKG-CHWSQXEVSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000330710593	529122916	/nfs/dbraw/zinc/12/29/16/529122916.db2.gz	XIWNIVHXDIPUTE-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000330710593	529122917	/nfs/dbraw/zinc/12/29/17/529122917.db2.gz	XIWNIVHXDIPUTE-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000797525085	700013276	/nfs/dbraw/zinc/01/32/76/700013276.db2.gz	AKODOWSXMQAENN-HIFRSBDPSA-N	1	1	307.350	1.086	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CC[NH+](Cc2ccccc2)CC1	ZINC000054421530	696275862	/nfs/dbraw/zinc/27/58/62/696275862.db2.gz	QMCFNSFPXFWJML-UHFFFAOYSA-N	1	1	301.350	1.567	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1	ZINC000070076981	696387152	/nfs/dbraw/zinc/38/71/52/696387152.db2.gz	DRSUPVCBPYVIJT-PHIMTYICSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2CCC[N@@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194732202	697719222	/nfs/dbraw/zinc/71/92/22/697719222.db2.gz	CLNXPGZDNJNLDV-SNVBAGLBSA-N	1	1	322.321	1.635	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC(N2CC[NH+](C)CC2)CC1	ZINC000223468270	697761520	/nfs/dbraw/zinc/76/15/20/697761520.db2.gz	DKYLCCMURVKSAA-UHFFFAOYSA-N	1	1	319.409	1.514	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678496	700176397	/nfs/dbraw/zinc/17/63/97/700176397.db2.gz	SRUWIYVQWAKQAH-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678496	700176401	/nfs/dbraw/zinc/17/64/01/700176401.db2.gz	SRUWIYVQWAKQAH-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]1C	ZINC000775100189	697962652	/nfs/dbraw/zinc/96/26/52/697962652.db2.gz	BMGVMDGDFXPSAY-SKDRFNHKSA-N	1	1	323.305	1.886	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]1C	ZINC000775100189	697962654	/nfs/dbraw/zinc/96/26/54/697962654.db2.gz	BMGVMDGDFXPSAY-SKDRFNHKSA-N	1	1	323.305	1.886	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776578185	698119948	/nfs/dbraw/zinc/11/99/48/698119948.db2.gz	CGSMCFHUWYNXKD-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776578185	698119952	/nfs/dbraw/zinc/11/99/52/698119952.db2.gz	CGSMCFHUWYNXKD-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
CCOCCO[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776592139	698123504	/nfs/dbraw/zinc/12/35/04/698123504.db2.gz	YZRRWJVICUUHRF-JKSUJKDBSA-N	1	1	324.377	1.756	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000246354040	698348308	/nfs/dbraw/zinc/34/83/08/698348308.db2.gz	WOEMMHMHEKODFY-XHDPSFHLSA-N	1	1	322.361	1.902	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+]CCS(=O)(=O)N2CCCC2)cs1	ZINC000721888283	699316345	/nfs/dbraw/zinc/31/63/45/699316345.db2.gz	ANAWNVUEXSAPRT-UHFFFAOYSA-N	1	1	319.408	1.172	20	5		DDBDMO
CC(C)[C@@H](C[NH+](C)C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000733164655	699581469	/nfs/dbraw/zinc/58/14/69/699581469.db2.gz	ARROZFWVYUMPJX-CYBMUJFWSA-N	1	1	319.365	1.787	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000751949551	700329900	/nfs/dbraw/zinc/32/99/00/700329900.db2.gz	LQWJNTAPBYORQY-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@H](OC(F)F)C2)c1	ZINC000801986911	700361960	/nfs/dbraw/zinc/36/19/60/700361960.db2.gz	YFMJHTTXHMMZHD-RYUDHWBXSA-N	1	1	302.277	1.942	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](OC(F)F)C2)c1	ZINC000801986911	700361963	/nfs/dbraw/zinc/36/19/63/700361963.db2.gz	YFMJHTTXHMMZHD-RYUDHWBXSA-N	1	1	302.277	1.942	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H]1C	ZINC000754227935	700490732	/nfs/dbraw/zinc/49/07/32/700490732.db2.gz	CVSDWMFFPDOABD-SNVBAGLBSA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H]1C	ZINC000754227935	700490733	/nfs/dbraw/zinc/49/07/33/700490733.db2.gz	CVSDWMFFPDOABD-SNVBAGLBSA-N	1	1	322.321	1.669	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@H](C)C1	ZINC000761077377	700840201	/nfs/dbraw/zinc/84/02/01/700840201.db2.gz	RTSBDVIZGKKQQU-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCNc2nc(N3CCCC3)cc[nH+]2)c1	ZINC000768538955	701185421	/nfs/dbraw/zinc/18/54/21/701185421.db2.gz	NGUYTNLMKQJORC-UHFFFAOYSA-N	1	1	303.326	1.294	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCC1	ZINC000769745503	701254777	/nfs/dbraw/zinc/25/47/77/701254777.db2.gz	CNMLCMBPBZAZFZ-UHFFFAOYSA-N	1	1	317.349	1.620	20	5		DDBDMO
O=C(N[C@@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839502367	701718468	/nfs/dbraw/zinc/71/84/68/701718468.db2.gz	IIVNKZHHWDBSJX-QLFBSQMISA-N	1	1	303.362	1.605	20	5		DDBDMO
CC(C)(C(=O)O[C@@H]1CC[N@H+]2CCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000810839514	701859578	/nfs/dbraw/zinc/85/95/78/701859578.db2.gz	BSOLGBGUNNNJDT-WCQYABFASA-N	1	1	322.365	1.696	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000840092514	701964954	/nfs/dbraw/zinc/96/49/54/701964954.db2.gz	WJGLVTXYVGKGIB-LBPRGKRZSA-N	1	1	318.381	1.631	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)C[N@H+](C)C(C)C)c(N)c([N+](=O)[O-])c1	ZINC000811601925	702015730	/nfs/dbraw/zinc/01/57/30/702015730.db2.gz	SBMOYRIIYHFQSK-NSHDSACASA-N	1	1	308.382	1.944	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000866206763	706648434	/nfs/dbraw/zinc/64/84/34/706648434.db2.gz	NAYJROBUMLTZJL-NEPJUHHUSA-N	1	1	304.350	1.224	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@](O)(C(F)F)C2)c1	ZINC000831175136	706649901	/nfs/dbraw/zinc/64/99/01/706649901.db2.gz	FVKYSZQPRMFPJK-YPMHNXCESA-N	1	1	302.277	1.330	20	5		DDBDMO
CO[C@@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000813172855	702308085	/nfs/dbraw/zinc/30/80/85/702308085.db2.gz	OZQIRFUQJHGADM-FZMZJTMJSA-N	1	1	308.334	1.747	20	5		DDBDMO
CO[C@@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000813172855	702308089	/nfs/dbraw/zinc/30/80/89/702308089.db2.gz	OZQIRFUQJHGADM-FZMZJTMJSA-N	1	1	308.334	1.747	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000817371917	702358523	/nfs/dbraw/zinc/35/85/23/702358523.db2.gz	FNIXVRPDFFUDAJ-CQSZACIVSA-N	1	1	303.366	1.928	20	5		DDBDMO
O=C1O[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC000844312612	703011039	/nfs/dbraw/zinc/01/10/39/703011039.db2.gz	DFRKDIJOEXUAFU-ZDUSSCGKSA-N	1	1	318.333	1.331	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC000844312612	703011042	/nfs/dbraw/zinc/01/10/42/703011042.db2.gz	DFRKDIJOEXUAFU-ZDUSSCGKSA-N	1	1	318.333	1.331	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852695836	704101545	/nfs/dbraw/zinc/10/15/45/704101545.db2.gz	GYLQUSUNUYXAAK-KWCYVHTRSA-N	1	1	308.334	1.512	20	5		DDBDMO
COC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000852765439	704118831	/nfs/dbraw/zinc/11/88/31/704118831.db2.gz	RKXVRFPNXHPDMK-UHFFFAOYSA-N	1	1	323.349	1.924	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871152293	704231996	/nfs/dbraw/zinc/23/19/96/704231996.db2.gz	AFGZONRWDVUQAV-UHFFFAOYSA-N	1	1	309.370	1.193	20	5		DDBDMO
CN1CC(C[N@H+](C)Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1	ZINC000853553121	704266834	/nfs/dbraw/zinc/26/68/34/704266834.db2.gz	BFBHZSAWLLSWKB-UHFFFAOYSA-N	1	1	315.377	1.909	20	5		DDBDMO
CN1CC(C[N@@H+](C)Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1	ZINC000853553121	704266836	/nfs/dbraw/zinc/26/68/36/704266836.db2.gz	BFBHZSAWLLSWKB-UHFFFAOYSA-N	1	1	315.377	1.909	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1	ZINC000822152025	704885627	/nfs/dbraw/zinc/88/56/27/704885627.db2.gz	QIGUGQPYYPCXJF-GFCCVEGCSA-N	1	1	309.370	1.041	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)c([N+](=O)[O-])n1	ZINC000876626863	705790580	/nfs/dbraw/zinc/79/05/80/705790580.db2.gz	KRLJXMAGRFBONE-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827300341	705971025	/nfs/dbraw/zinc/97/10/25/705971025.db2.gz	MJACEPXRDOTZIK-GDBMZVCRSA-N	1	1	317.389	1.998	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000863832220	706023903	/nfs/dbraw/zinc/02/39/03/706023903.db2.gz	VOZAAMIGDRFXOF-VIFPVBQESA-N	1	1	313.741	1.045	20	5		DDBDMO
C[C@@H]1C[C@@H](N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000877831481	706226953	/nfs/dbraw/zinc/22/69/53/706226953.db2.gz	UXWOMRDUAOLYJZ-WXYCVUISSA-N	1	1	323.393	1.061	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000877831481	706226955	/nfs/dbraw/zinc/22/69/55/706226955.db2.gz	UXWOMRDUAOLYJZ-WXYCVUISSA-N	1	1	323.393	1.061	20	5		DDBDMO
NC(=O)[C@@H](F)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000879040182	706569598	/nfs/dbraw/zinc/56/95/98/706569598.db2.gz	AXQBILLXDBJNAM-ZDUSSCGKSA-N	1	1	313.304	1.769	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]C[C@H]1C[C@H](O)C1)c1cccc([N+](=O)[O-])c1	ZINC000872127710	707297993	/nfs/dbraw/zinc/29/79/93/707297993.db2.gz	WGOHSFDZLSHTNB-KCPJHIHWSA-N	1	1	316.361	1.778	20	5		DDBDMO
CN1CCCC[C@@H]([N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265669	707355629	/nfs/dbraw/zinc/35/56/29/707355629.db2.gz	VALIDUBPBXBUIY-HUUCEWRRSA-N	1	1	321.377	1.571	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265669	707355636	/nfs/dbraw/zinc/35/56/36/707355636.db2.gz	VALIDUBPBXBUIY-HUUCEWRRSA-N	1	1	321.377	1.571	20	5		DDBDMO
CN1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2cccnc21	ZINC000872317950	707380502	/nfs/dbraw/zinc/38/05/02/707380502.db2.gz	DCNVNVAUKPAJAV-UHFFFAOYSA-N	1	1	302.338	1.138	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000872779584	707596768	/nfs/dbraw/zinc/59/67/68/707596768.db2.gz	GTERTWXKJNRIIW-KGLIPLIRSA-N	1	1	306.366	1.342	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c([N+](=O)[O-])c1	ZINC000872781605	707597761	/nfs/dbraw/zinc/59/77/61/707597761.db2.gz	VZKYNHHMICEPEL-OLZOCXBDSA-N	1	1	318.377	1.627	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403308	709037456	/nfs/dbraw/zinc/03/74/56/709037456.db2.gz	SZEOWTDITPDZOM-IUODEOHRSA-N	1	1	321.377	1.535	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403308	709037459	/nfs/dbraw/zinc/03/74/59/709037459.db2.gz	SZEOWTDITPDZOM-IUODEOHRSA-N	1	1	321.377	1.535	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887924350	709165067	/nfs/dbraw/zinc/16/50/67/709165067.db2.gz	HQGDOZLUGIWVSU-WBMJQRKESA-N	1	1	321.352	1.687	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NCC[N@@H+]1CCc2sccc2C1	ZINC000891966326	710341715	/nfs/dbraw/zinc/34/17/15/710341715.db2.gz	NAVWBURNMPIBDZ-UHFFFAOYSA-N	1	1	307.379	1.860	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NCC[N@H+]1CCc2sccc2C1	ZINC000891966326	710341717	/nfs/dbraw/zinc/34/17/17/710341717.db2.gz	NAVWBURNMPIBDZ-UHFFFAOYSA-N	1	1	307.379	1.860	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452782	713203665	/nfs/dbraw/zinc/20/36/65/713203665.db2.gz	JKDBAAREQHFQDM-GXFFZTMASA-N	1	1	309.391	1.896	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637879	710833040	/nfs/dbraw/zinc/83/30/40/710833040.db2.gz	KTQAUNVEMMGILO-OCCSQVGLSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637879	710833043	/nfs/dbraw/zinc/83/30/43/710833043.db2.gz	KTQAUNVEMMGILO-OCCSQVGLSA-N	1	1	317.349	1.920	20	5		DDBDMO
CCOc1ccc(C(=O)NC[C@H]2CC[N@H+]2CC)cc1[N+](=O)[O-]	ZINC000893872773	710867228	/nfs/dbraw/zinc/86/72/28/710867228.db2.gz	VFTKPFOEBANLGB-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1	ZINC000902806551	710907632	/nfs/dbraw/zinc/90/76/32/710907632.db2.gz	LXOYNBGDWASQGO-GASCZTMLSA-N	1	1	306.366	1.347	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1	ZINC000894803453	711276687	/nfs/dbraw/zinc/27/66/87/711276687.db2.gz	YXBQDSBACCSYMK-GASCZTMLSA-N	1	1	307.398	1.898	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc4nonc4c3[N+](=O)[O-])CC[C@H]21	ZINC000895021673	711372684	/nfs/dbraw/zinc/37/26/84/711372684.db2.gz	HUOXPPDSBAEUGC-MWLCHTKSSA-N	1	1	303.322	1.661	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328403	711485788	/nfs/dbraw/zinc/48/57/88/711485788.db2.gz	FZUADFQDTPVDTO-ZWNOBZJWSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328403	711485789	/nfs/dbraw/zinc/48/57/89/711485789.db2.gz	FZUADFQDTPVDTO-ZWNOBZJWSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1c(O)ccc(C[N@H+](C)C[C@@H]2COCCO2)c1[N+](=O)[O-]	ZINC000895364441	711494814	/nfs/dbraw/zinc/49/48/14/711494814.db2.gz	PVWZBWZOBDGVBR-LLVKDONJSA-N	1	1	312.322	1.156	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+](C)C[C@@H]2COCCO2)c1[N+](=O)[O-]	ZINC000895364441	711494817	/nfs/dbraw/zinc/49/48/17/711494817.db2.gz	PVWZBWZOBDGVBR-LLVKDONJSA-N	1	1	312.322	1.156	20	5		DDBDMO
C[C@@H]1[C@H](Nc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C	ZINC000895735271	711590477	/nfs/dbraw/zinc/59/04/77/711590477.db2.gz	CBRDJOPBCDHFMI-RNFRBKRXSA-N	1	1	307.276	1.852	20	5		DDBDMO
C[C@@H]1[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737535	711590876	/nfs/dbraw/zinc/59/08/76/711590876.db2.gz	AZFLAUXCEGRXHF-ZWNOBZJWSA-N	1	1	318.377	1.992	20	5		DDBDMO
C[C@H]1[C@@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[N@H+]1C	ZINC000895739554	711591649	/nfs/dbraw/zinc/59/16/49/711591649.db2.gz	GWAMZUUMLUEGIS-IUCAKERBSA-N	1	1	306.322	1.430	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000895771330	711602203	/nfs/dbraw/zinc/60/22/03/711602203.db2.gz	YHOLMYRLUUFVMP-AWEZNQCLSA-N	1	1	320.393	1.543	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@@H]2CC[N@@H+]2C)c([N+](=O)[O-])c1=O	ZINC000895776908	711604111	/nfs/dbraw/zinc/60/41/11/711604111.db2.gz	NTUKOVVRMIYHLQ-JTQLQIEISA-N	1	1	302.334	1.563	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])c1=O	ZINC000895776908	711604112	/nfs/dbraw/zinc/60/41/12/711604112.db2.gz	NTUKOVVRMIYHLQ-JTQLQIEISA-N	1	1	302.334	1.563	20	5		DDBDMO
CN1CC[NH+](CCOc2ccc(NCC[N+](=O)[O-])cc2)CC1	ZINC000905331533	712004709	/nfs/dbraw/zinc/00/47/09/712004709.db2.gz	XSWDXSJXFAJEME-UHFFFAOYSA-N	1	1	308.382	1.001	20	5		DDBDMO
C[N@@H+](CCN1CCN(CC[N+](=O)[O-])CC1)Cc1ccccc1	ZINC000929606465	713650604	/nfs/dbraw/zinc/65/06/04/713650604.db2.gz	NMRYKYLGZILKET-UHFFFAOYSA-N	1	1	306.410	1.013	20	5		DDBDMO
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])C1	ZINC000930032437	713739995	/nfs/dbraw/zinc/73/99/95/713739995.db2.gz	QMTPTTGFHXABAF-NWDGAFQWSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1C[C@@H]2COC[C@H]2O1	ZINC000930353100	713811798	/nfs/dbraw/zinc/81/17/98/713811798.db2.gz	HFWIBODEMPHSNK-VNQPRFMTSA-N	1	1	306.362	1.873	20	5		DDBDMO
C[C@H]1[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000922556752	714087840	/nfs/dbraw/zinc/08/78/40/714087840.db2.gz	JKTKCGRYKMGLSF-CMPLNLGQSA-N	1	1	307.350	1.548	20	5		DDBDMO
C[C@H]1[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000922556752	714087842	/nfs/dbraw/zinc/08/78/42/714087842.db2.gz	JKTKCGRYKMGLSF-CMPLNLGQSA-N	1	1	307.350	1.548	20	5		DDBDMO
COC1(OC)CCOC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000931675907	714158217	/nfs/dbraw/zinc/15/82/17/714158217.db2.gz	RJAYMJOBJVIHCH-ZDUSSCGKSA-N	1	1	314.313	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](C3OCCO3)C2)cc1	ZINC000932003466	714230814	/nfs/dbraw/zinc/23/08/14/714230814.db2.gz	PWASTLKWPCSLRX-TZMCWYRMSA-N	1	1	308.334	1.323	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000923264706	714289158	/nfs/dbraw/zinc/28/91/58/714289158.db2.gz	MFRKESDBCRHWAF-NWANDNLSSA-N	1	1	319.361	1.323	20	5		DDBDMO
C[C@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C[NH3+]	ZINC000923497705	714378830	/nfs/dbraw/zinc/37/88/30/714378830.db2.gz	CMVOTGKBZAZCKN-QWHCGFSZSA-N	1	1	320.393	1.474	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000932979085	714448329	/nfs/dbraw/zinc/44/83/29/714448329.db2.gz	FSEYOOSRCGHGRP-ZFWWWQNUSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)cc1	ZINC000934255064	714776033	/nfs/dbraw/zinc/77/60/33/714776033.db2.gz	OJJICVSFFDOSSH-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3[C@H]2CCCN3CCO)cc1	ZINC000934255064	714776037	/nfs/dbraw/zinc/77/60/37/714776037.db2.gz	OJJICVSFFDOSSH-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3[C@H]2CCCN3CCO)cc1	ZINC000934255064	714776039	/nfs/dbraw/zinc/77/60/39/714776039.db2.gz	OJJICVSFFDOSSH-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H](O)[C@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580214	714857922	/nfs/dbraw/zinc/85/79/22/714857922.db2.gz	XDEASSXBUQIEQA-OLZOCXBDSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@H](O)[C@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580214	714857923	/nfs/dbraw/zinc/85/79/23/714857923.db2.gz	XDEASSXBUQIEQA-OLZOCXBDSA-N	1	1	311.313	1.328	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@@H]21	ZINC000934763120	714897046	/nfs/dbraw/zinc/89/70/46/714897046.db2.gz	YPFODDBSGORYJY-HZSPNIEDSA-N	1	1	308.382	1.663	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000936057368	715146594	/nfs/dbraw/zinc/14/65/94/715146594.db2.gz	KFULLBDQFWEJMB-LLVKDONJSA-N	1	1	311.386	1.336	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC001164643442	719217663	/nfs/dbraw/zinc/21/76/63/719217663.db2.gz	YVJKPLLLUMSRBP-QWRGUYRKSA-N	1	1	322.365	1.695	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3nccc4ccc([N+](=O)[O-])cc43)C[C@H]21	ZINC001164674826	719425677	/nfs/dbraw/zinc/42/56/77/719425677.db2.gz	XOBFLWRFKXMHKS-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
Cc1ccnc(N2CC[NH+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000609669434	721904222	/nfs/dbraw/zinc/90/42/22/721904222.db2.gz	DZNGPAYJKYVGRQ-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])c(=O)n(C)c1	ZINC001167751023	737701747	/nfs/dbraw/zinc/70/17/47/737701747.db2.gz	DJMOUXAGUSFNSO-GFCCVEGCSA-N	1	1	308.382	1.970	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(Cl)cc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932289	742777269	/nfs/dbraw/zinc/77/72/69/742777269.db2.gz	QRBDMUPDHXPALJ-ZYHUDNBSSA-N	1	1	315.732	1.350	20	5		DDBDMO
CCc1ccccc1CC[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936427	742833029	/nfs/dbraw/zinc/83/30/29/742833029.db2.gz	HDKNDJUYFJKCAX-HUUCEWRRSA-N	1	1	305.378	1.163	20	5		DDBDMO
O=[N+]([O-])c1cc(NCC2([NH+]3CCCC3)COC2)cn2ccnc12	ZINC001168451083	745113025	/nfs/dbraw/zinc/11/30/25/745113025.db2.gz	GACMWCQNNLXCTP-UHFFFAOYSA-N	1	1	317.349	1.519	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1cocn1	ZINC001031580554	747100926	/nfs/dbraw/zinc/10/09/26/747100926.db2.gz	WFHSCDXPLPGCHF-UHFFFAOYSA-N	1	1	316.317	1.445	20	5		DDBDMO
Cc1ccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1C	ZINC001031662405	747337507	/nfs/dbraw/zinc/33/75/07/747337507.db2.gz	DOKYILMIMIVMKM-HZPDHXFCSA-N	1	1	317.389	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCCC2CCC2)CC1	ZINC001200472111	748265554	/nfs/dbraw/zinc/26/55/54/748265554.db2.gz	MOGKGZKQAQFVCJ-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
CCOC(=O)C1=C(O)CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169029691	762186362	/nfs/dbraw/zinc/18/63/62/762186362.db2.gz	VFSCUCSJTKGPJQ-YNEHKIRRSA-N	1	1	312.366	1.276	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2cncs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001398461	762824340	/nfs/dbraw/zinc/82/43/40/762824340.db2.gz	FLYZLOLJBHPAHT-CHWSQXEVSA-N	1	1	324.406	1.137	20	5		DDBDMO
COc1ccc(C[C@@H](C)n2cnc(C[NH3+])cc2=N)c([N+](=O)[O-])c1	ZINC001170306979	766258627	/nfs/dbraw/zinc/25/86/27/766258627.db2.gz	CLBCISMBRLQAEE-SNVBAGLBSA-N	1	1	317.349	1.542	20	5		DDBDMO
CCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2	ZINC001048525472	769493582	/nfs/dbraw/zinc/49/35/82/769493582.db2.gz	WVFVAUIFZNYYGA-XLWJZTARSA-N	1	1	309.410	1.811	20	5		DDBDMO
CCCC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001048525472	769493587	/nfs/dbraw/zinc/49/35/87/769493587.db2.gz	WVFVAUIFZNYYGA-XLWJZTARSA-N	1	1	309.410	1.811	20	5		DDBDMO
CCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001048525472	769493590	/nfs/dbraw/zinc/49/35/90/769493590.db2.gz	WVFVAUIFZNYYGA-XLWJZTARSA-N	1	1	309.410	1.811	20	5		DDBDMO
CCCCC1(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001133360433	769726648	/nfs/dbraw/zinc/72/66/48/769726648.db2.gz	SCBMCAUNINBCLE-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
CN1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O	ZINC001172907727	776917885	/nfs/dbraw/zinc/91/78/85/776917885.db2.gz	HTUMYLPHWJRARA-CQSZACIVSA-N	1	1	303.362	1.616	20	5		DDBDMO
CN1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O	ZINC001172907727	776917890	/nfs/dbraw/zinc/91/78/90/776917890.db2.gz	HTUMYLPHWJRARA-CQSZACIVSA-N	1	1	303.362	1.616	20	5		DDBDMO
CCN(CC)CCNC(=[NH2+])N[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173218474	777049926	/nfs/dbraw/zinc/04/99/26/777049926.db2.gz	BFGGTDHZVUVHEM-ZDUSSCGKSA-N	1	1	321.425	1.982	20	5		DDBDMO
CNC(=O)N1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001173232394	777063249	/nfs/dbraw/zinc/06/32/49/777063249.db2.gz	QWLOCNLWRRSNND-LBPRGKRZSA-N	1	1	306.366	1.483	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101704642	777413365	/nfs/dbraw/zinc/41/33/65/777413365.db2.gz	UJRIVPCPGSWELR-UHFFFAOYSA-N	1	1	309.370	1.202	20	5		DDBDMO
Cc1cnoc1C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001267225027	837561069	/nfs/dbraw/zinc/56/10/69/837561069.db2.gz	OUNHAAYQSPMRNE-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
O=C(N[C@H]1CC[C@H](C[NH2+]C/C=C\Cl)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001272726443	846724242	/nfs/dbraw/zinc/72/42/42/846724242.db2.gz	DHTVUNWODUCIES-SPYGVBLXSA-N	1	1	315.801	1.669	20	5		DDBDMO
CC(C)[N@H+](C)CC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001152440093	863345168	/nfs/dbraw/zinc/34/51/68/863345168.db2.gz	YGOMTTNSCYFFEM-UHFFFAOYSA-N	1	1	314.411	1.202	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001152440093	863345183	/nfs/dbraw/zinc/34/51/83/863345183.db2.gz	YGOMTTNSCYFFEM-UHFFFAOYSA-N	1	1	314.411	1.202	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)C)CC1	ZINC001121794117	858598347	/nfs/dbraw/zinc/59/83/47/858598347.db2.gz	WMZWWXYOIOLOHX-LBPRGKRZSA-N	1	1	310.402	1.556	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Nc2c(C)cncc2[N+](=O)[O-])C1	ZINC001203061448	860686178	/nfs/dbraw/zinc/68/61/78/860686178.db2.gz	OAVJTOQLHCUIBC-NSHDSACASA-N	1	1	307.354	1.183	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)cc1[N+](=O)[O-]	ZINC001141196752	860807321	/nfs/dbraw/zinc/80/73/21/860807321.db2.gz	LSULSESLIOACHR-RISCZKNCSA-N	1	1	304.350	1.413	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2CC[C@@H]([N@@H+](C)C(C)C)C2)n1	ZINC001157010831	863516262	/nfs/dbraw/zinc/51/62/62/863516262.db2.gz	TZHCSYMTCVJHCL-LLVKDONJSA-N	1	1	309.370	1.621	20	5		DDBDMO
O=C(NCCC[NH2+]CCCCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767468	864117990	/nfs/dbraw/zinc/11/79/90/864117990.db2.gz	NOERSCJPUIEUCB-HZPDHXFCSA-N	1	1	319.405	1.770	20	5		DDBDMO
CSc1nc(Cl)nc(N2CC[N@@H+]3CC[C@H]3C2)c1[N+](=O)[O-]	ZINC001158434995	864654645	/nfs/dbraw/zinc/65/46/45/864654645.db2.gz	UGOBRYGOIGEUJM-ZETCQYMHSA-N	1	1	315.786	1.654	20	5		DDBDMO
CSc1nc(Cl)nc(N2CC[N@H+]3CC[C@H]3C2)c1[N+](=O)[O-]	ZINC001158434995	864654660	/nfs/dbraw/zinc/65/46/60/864654660.db2.gz	UGOBRYGOIGEUJM-ZETCQYMHSA-N	1	1	315.786	1.654	20	5		DDBDMO
CC/C(C)=C/C(=O)NCC1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001277049251	881869144	/nfs/dbraw/zinc/86/91/44/881869144.db2.gz	PXKAHENYPJYCKK-YRNVUSSQSA-N	1	1	321.381	1.423	20	5		DDBDMO
CN1CCO[C@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)C1	ZINC001162690166	867739253	/nfs/dbraw/zinc/73/92/53/867739253.db2.gz	TUQRCHNNYKBRFU-GFCCVEGCSA-N	1	1	320.393	1.325	20	5		DDBDMO
CN1CCO[C@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)C1	ZINC001162690166	867739260	/nfs/dbraw/zinc/73/92/60/867739260.db2.gz	TUQRCHNNYKBRFU-GFCCVEGCSA-N	1	1	320.393	1.325	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2nccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164490753	869229982	/nfs/dbraw/zinc/22/99/82/869229982.db2.gz	UYZIQVCQGCOUJY-GHMZBOCLSA-N	1	1	324.406	1.184	20	5		DDBDMO
COc1ccc(C(=O)NC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC001338295402	869909943	/nfs/dbraw/zinc/90/99/43/869909943.db2.gz	RQQJKVGVHCVURI-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@H]1CC[N@H+](CCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001338493462	870012434	/nfs/dbraw/zinc/01/24/34/870012434.db2.gz	ZTDOGKHZGBKAJG-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001338493462	870012450	/nfs/dbraw/zinc/01/24/50/870012450.db2.gz	ZTDOGKHZGBKAJG-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@]23CCCOC3)c1	ZINC001308171583	871477148	/nfs/dbraw/zinc/47/71/48/871477148.db2.gz	VKCLWKIADIORFB-GJZGRUSLSA-N	1	1	324.381	1.187	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(Cl)c([N+](=O)[O-])cn2)C1	ZINC001226915353	882717554	/nfs/dbraw/zinc/71/75/54/882717554.db2.gz	GMVSEIOYAHEORU-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(O[C@H]2CCc3[nH+]ccn3C2)c1	ZINC001227043355	882790779	/nfs/dbraw/zinc/79/07/79/882790779.db2.gz	DJGOTTMBFPRPLI-NSHDSACASA-N	1	1	317.301	1.972	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001355320573	878498026	/nfs/dbraw/zinc/49/80/26/878498026.db2.gz	CEALFXWNBPDUBD-CMPLNLGQSA-N	1	1	307.350	1.445	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3ccnc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228056976	883310615	/nfs/dbraw/zinc/31/06/15/883310615.db2.gz	JZUFWFXDTJHNLT-NMLBEHRDSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ccnc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228056976	883310633	/nfs/dbraw/zinc/31/06/33/883310633.db2.gz	JZUFWFXDTJHNLT-NMLBEHRDSA-N	1	1	311.725	1.826	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228603018	883568004	/nfs/dbraw/zinc/56/80/04/883568004.db2.gz	HZCHEYXKMIEQDA-JTQLQIEISA-N	1	1	308.338	1.829	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228603018	883568014	/nfs/dbraw/zinc/56/80/14/883568014.db2.gz	HZCHEYXKMIEQDA-JTQLQIEISA-N	1	1	308.338	1.829	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC1=CC[N@@H+](C)CC1	ZINC001254177960	896284474	/nfs/dbraw/zinc/28/44/74/896284474.db2.gz	QHOBRDYRBLMMAV-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](N2CCOCC2)C1	ZINC001254562874	896502476	/nfs/dbraw/zinc/50/24/76/896502476.db2.gz	QKPRWMRYZQAKBV-GOEBONIOSA-N	1	1	319.405	1.932	20	5		DDBDMO
O=C1NCC[C@@]12CCC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254598325	896525500	/nfs/dbraw/zinc/52/55/00/896525500.db2.gz	WHRJMOOUTXTYJI-NVXWUHKLSA-N	1	1	315.373	1.664	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)[C@@H]1C[N@H+](C)CCN1C	ZINC001262705524	900320720	/nfs/dbraw/zinc/32/07/20/900320720.db2.gz	LIMGDEHWRCWJDU-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001262705524	900320726	/nfs/dbraw/zinc/32/07/26/900320726.db2.gz	LIMGDEHWRCWJDU-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2nnc(C[N+](=O)[O-])n2CC2CC2)C[C@@H]1C	ZINC001263676063	900668114	/nfs/dbraw/zinc/66/81/14/900668114.db2.gz	FYMXXAPGPJEQQC-RYUDHWBXSA-N	1	1	322.413	1.384	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12	ZINC001263980015	900853630	/nfs/dbraw/zinc/85/36/30/900853630.db2.gz	LEJBWASZLQXSAR-KCPJHIHWSA-N	1	1	303.362	1.973	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1	ZINC001265581123	902155993	/nfs/dbraw/zinc/15/59/93/902155993.db2.gz	QPVKZRBTWBKZJE-CYBMUJFWSA-N	1	1	320.393	1.928	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@@H]1C(C)(C)C	ZINC001307195212	915850073	/nfs/dbraw/zinc/85/00/73/915850073.db2.gz	BMSLHZSNVFMCMH-GFCCVEGCSA-N	1	1	321.381	1.255	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)n1	ZINC000248676004	282098922	/nfs/dbraw/zinc/09/89/22/282098922.db2.gz	TWCQAYSQYPHLMQ-WDEREUQCSA-N	1	1	309.370	1.366	20	5		DDBDMO
CN1CC[NH+](CCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000278528976	214215470	/nfs/dbraw/zinc/21/54/70/214215470.db2.gz	TZFYXUSHNFQDFM-UHFFFAOYSA-N	1	1	304.354	1.130	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452064488	231287023	/nfs/dbraw/zinc/28/70/23/231287023.db2.gz	FLPOSEODXIRBNI-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452064488	231287027	/nfs/dbraw/zinc/28/70/27/231287027.db2.gz	FLPOSEODXIRBNI-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072219	231290627	/nfs/dbraw/zinc/29/06/27/231290627.db2.gz	WIVAFEZXICPFTG-BXUZGUMPSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@@H](CCCO)C1	ZINC000452126069	231313187	/nfs/dbraw/zinc/31/31/87/231313187.db2.gz	TZIQTMRWBLGYAA-ZIAGYGMSSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](C3CC3)[C@@H]2C2CC2)c1	ZINC000453046874	231456628	/nfs/dbraw/zinc/45/66/28/231456628.db2.gz	YRHOZWOCLGIWTF-KFWWJZLASA-N	1	1	306.366	1.273	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CCO)C(C)(C)C1	ZINC000614923254	362080637	/nfs/dbraw/zinc/08/06/37/362080637.db2.gz	AJLSKJQTXCLBCY-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090551753	185302653	/nfs/dbraw/zinc/30/26/53/185302653.db2.gz	NJHWJFBSJJFHIV-CYBMUJFWSA-N	1	1	308.382	1.030	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	ZINC000292352948	529801471	/nfs/dbraw/zinc/80/14/71/529801471.db2.gz	VOFNPVNQVFLDJQ-OAHLLOKOSA-N	1	1	307.325	1.902	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000181644473	199332136	/nfs/dbraw/zinc/33/21/36/199332136.db2.gz	MKFVNZSTJWOKKL-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000272655475	282318067	/nfs/dbraw/zinc/31/80/67/282318067.db2.gz	QOENHQLPGOEZRN-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
CON1CCC([N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000459575609	233327146	/nfs/dbraw/zinc/32/71/46/233327146.db2.gz	GIJFPXYXFXLOID-UHFFFAOYSA-N	1	1	322.365	1.491	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[N@H+](C2CCCC2)CC1	ZINC000172423045	198094947	/nfs/dbraw/zinc/09/49/47/198094947.db2.gz	LTBUHBBRWORPFL-UHFFFAOYSA-N	1	1	321.381	1.268	20	5		DDBDMO
CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000029622297	352242201	/nfs/dbraw/zinc/24/22/01/352242201.db2.gz	WTHKFIJWUSFXGI-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000045428117	352410708	/nfs/dbraw/zinc/41/07/08/352410708.db2.gz	WYTXZMFOCNVNDZ-UHFFFAOYSA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[C@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000045753205	352422292	/nfs/dbraw/zinc/42/22/92/352422292.db2.gz	LGBLTSUGWVIAHP-KBPBESRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000045753205	352422298	/nfs/dbraw/zinc/42/22/98/352422298.db2.gz	LGBLTSUGWVIAHP-KBPBESRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000072858393	191239878	/nfs/dbraw/zinc/23/98/78/191239878.db2.gz	BTYNGUTYUDSHKK-LBPRGKRZSA-N	1	1	320.393	1.467	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000069470742	353162216	/nfs/dbraw/zinc/16/22/16/353162216.db2.gz	SIHCLXMCGFJCCX-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)C[C@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000078022587	353501662	/nfs/dbraw/zinc/50/16/62/353501662.db2.gz	VYRSHBMMNOOMBW-HNNXBMFYSA-N	1	1	320.393	1.731	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCO)C3CC3)o2)cc1	ZINC000079482882	353563576	/nfs/dbraw/zinc/56/35/76/353563576.db2.gz	OKZPWYBEGXFUPS-UHFFFAOYSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CCO)C3CC3)o2)cc1	ZINC000079482882	353563578	/nfs/dbraw/zinc/56/35/78/353563578.db2.gz	OKZPWYBEGXFUPS-UHFFFAOYSA-N	1	1	304.306	1.602	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000080374903	353604316	/nfs/dbraw/zinc/60/43/16/353604316.db2.gz	LGTMNMVNPFUBPI-UHFFFAOYSA-N	1	1	318.333	1.685	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)C[NH+]1CCN(C)CC1	ZINC000080617559	353618749	/nfs/dbraw/zinc/61/87/49/353618749.db2.gz	MYEWIOCWPGOCNU-ZDUSSCGKSA-N	1	1	322.409	1.789	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000108307433	353950837	/nfs/dbraw/zinc/95/08/37/353950837.db2.gz	SMJUTGSIRMKRPW-NSHDSACASA-N	1	1	307.325	1.948	20	5		DDBDMO
C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000617751299	363287785	/nfs/dbraw/zinc/28/77/85/363287785.db2.gz	FHMPGKJKYBEFSW-SLEUVZQESA-N	1	1	321.377	1.534	20	5		DDBDMO
C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000617751299	363287788	/nfs/dbraw/zinc/28/77/88/363287788.db2.gz	FHMPGKJKYBEFSW-SLEUVZQESA-N	1	1	321.377	1.534	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C3CC3)CC2)c1	ZINC000148859008	354171521	/nfs/dbraw/zinc/17/15/21/354171521.db2.gz	HWBQAOUJJFYUJY-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000141679207	354141414	/nfs/dbraw/zinc/14/14/14/354141414.db2.gz	YBRPSIIKYXPGRQ-AWEZNQCLSA-N	1	1	319.361	1.670	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H](C)C1	ZINC000346178544	283014243	/nfs/dbraw/zinc/01/42/43/283014243.db2.gz	LLZLRWIMXJCWIV-TUAOUCFPSA-N	1	1	321.381	1.131	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601314551	358492123	/nfs/dbraw/zinc/49/21/23/358492123.db2.gz	JHSHKBHMVSUGHS-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601314551	358492125	/nfs/dbraw/zinc/49/21/25/358492125.db2.gz	JHSHKBHMVSUGHS-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
COc1ccc(OCCN2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC000590010311	355038869	/nfs/dbraw/zinc/03/88/69/355038869.db2.gz	AUZNHXZRCRARHM-WFASDCNBSA-N	1	1	321.377	1.618	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000590345173	355074938	/nfs/dbraw/zinc/07/49/38/355074938.db2.gz	UUZAHLAHPMUAJM-NSHDSACASA-N	1	1	308.338	1.252	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000590447661	355099833	/nfs/dbraw/zinc/09/98/33/355099833.db2.gz	ZRENJKZSRAHWEG-MFKMUULPSA-N	1	1	305.334	1.380	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@]2(C)CO)c1	ZINC000593025315	355773615	/nfs/dbraw/zinc/77/36/15/355773615.db2.gz	WRAKZXIPRSSUIV-OAHLLOKOSA-N	1	1	308.334	1.728	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000593065152	355784864	/nfs/dbraw/zinc/78/48/64/355784864.db2.gz	YAVSHMWGQFVLHK-NWANDNLSSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000593065152	355784867	/nfs/dbraw/zinc/78/48/67/355784867.db2.gz	YAVSHMWGQFVLHK-NWANDNLSSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000593175544	355817163	/nfs/dbraw/zinc/81/71/63/355817163.db2.gz	SUBYDGWBPUUUJG-UHFFFAOYSA-N	1	1	309.370	1.511	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000593187546	355820120	/nfs/dbraw/zinc/82/01/20/355820120.db2.gz	LQYORTDHMSBWMH-YNEHKIRRSA-N	1	1	321.377	1.913	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c2ccncc21	ZINC000593508652	355908271	/nfs/dbraw/zinc/90/82/71/355908271.db2.gz	UMFGZMQMLYOMDR-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC[N@H+](CCO)CC1	ZINC000593460942	355892519	/nfs/dbraw/zinc/89/25/19/355892519.db2.gz	LJIOFROWEULRSK-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
O=c1[nH]ccc2c1C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000276961387	213204325	/nfs/dbraw/zinc/20/43/25/213204325.db2.gz	PZAIOZWXQXMZAQ-HNNXBMFYSA-N	1	1	315.329	1.787	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594198113	356137485	/nfs/dbraw/zinc/13/74/85/356137485.db2.gz	CXFPOGWXZNSHNF-ZIAGYGMSSA-N	1	1	321.381	1.315	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594200383	356138212	/nfs/dbraw/zinc/13/82/12/356138212.db2.gz	LRQWSSHZPJDCFR-CHWSQXEVSA-N	1	1	306.366	1.680	20	5		DDBDMO
Cc1noc(C[N@H+]2CCCC[C@@H]2[C@@H]2CNC(=O)C2)c1[N+](=O)[O-]	ZINC000595406332	356481891	/nfs/dbraw/zinc/48/18/91/356481891.db2.gz	BXHCMZIXAODAHS-WDEREUQCSA-N	1	1	308.338	1.382	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595761058	356642337	/nfs/dbraw/zinc/64/23/37/356642337.db2.gz	WLSUIAYUPQMIJC-BFQNTYOBSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595761058	356642340	/nfs/dbraw/zinc/64/23/40/356642340.db2.gz	WLSUIAYUPQMIJC-BFQNTYOBSA-N	1	1	319.361	1.890	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000595850506	356677372	/nfs/dbraw/zinc/67/73/72/356677372.db2.gz	GADBPNZPFVPODI-GSJFWJNXSA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000595850506	356677374	/nfs/dbraw/zinc/67/73/74/356677374.db2.gz	GADBPNZPFVPODI-GSJFWJNXSA-N	1	1	308.334	1.987	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595870481	356686195	/nfs/dbraw/zinc/68/61/95/356686195.db2.gz	GOPXMXZZUOLHPO-WBMJQRKESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595870481	356686199	/nfs/dbraw/zinc/68/61/99/356686199.db2.gz	GOPXMXZZUOLHPO-WBMJQRKESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@@]2(CC[N@H+](C)C2)C1	ZINC000597713681	357297891	/nfs/dbraw/zinc/29/78/91/357297891.db2.gz	FOKQDVSBFNBCEX-INIZCTEOSA-N	1	1	318.377	1.856	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C	ZINC000597856850	357359879	/nfs/dbraw/zinc/35/98/79/357359879.db2.gz	BGSWDXBDZTZFEG-NSHDSACASA-N	1	1	306.366	1.901	20	5		DDBDMO
CCN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](C)C1	ZINC000597947459	357395648	/nfs/dbraw/zinc/39/56/48/357395648.db2.gz	YTZKHVSLENYDBE-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@H+](C)C1	ZINC000597947459	357395654	/nfs/dbraw/zinc/39/56/54/357395654.db2.gz	YTZKHVSLENYDBE-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](C)C1	ZINC000597947459	357395660	/nfs/dbraw/zinc/39/56/60/357395660.db2.gz	YTZKHVSLENYDBE-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CCn3cc[nH+]c3C2)c1[N+](=O)[O-]	ZINC000598618641	357656968	/nfs/dbraw/zinc/65/69/68/357656968.db2.gz	NNSWYXZKIOKITL-SECBINFHSA-N	1	1	317.305	1.400	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598651090	357671131	/nfs/dbraw/zinc/67/11/31/357671131.db2.gz	QQOSGWPRLOODMD-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598651090	357671134	/nfs/dbraw/zinc/67/11/34/357671134.db2.gz	QQOSGWPRLOODMD-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC(CN3CC[NH+](C)CC3)C2)c1	ZINC000599109605	357818365	/nfs/dbraw/zinc/81/83/65/357818365.db2.gz	VGBUOGFVUHQCSG-UHFFFAOYSA-N	1	1	304.394	1.587	20	5		DDBDMO
COC(=O)CCCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000599325623	357895128	/nfs/dbraw/zinc/89/51/28/357895128.db2.gz	HXQXQTYZYXMGSU-LBPRGKRZSA-N	1	1	322.365	1.819	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000599564201	357974566	/nfs/dbraw/zinc/97/45/66/357974566.db2.gz	QKSDMZUNEGBPCA-HNNXBMFYSA-N	1	1	324.333	1.238	20	5		DDBDMO
O=C(NC1CC([NH+]2CCOCC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000600068436	358114010	/nfs/dbraw/zinc/11/40/10/358114010.db2.gz	CEAZXJYWTYAMDO-UHFFFAOYSA-N	1	1	305.334	1.188	20	5		DDBDMO
CC[N@H+](CCN)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000600717451	358293301	/nfs/dbraw/zinc/29/33/01/358293301.db2.gz	ALFJEIOPTYMHKC-UHFFFAOYSA-N	1	1	308.338	1.173	20	5		DDBDMO
CC[N@@H+](CCN)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000600717451	358293304	/nfs/dbraw/zinc/29/33/04/358293304.db2.gz	ALFJEIOPTYMHKC-UHFFFAOYSA-N	1	1	308.338	1.173	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CCC1	ZINC000600826521	358327641	/nfs/dbraw/zinc/32/76/41/358327641.db2.gz	OUYJJUCTAKGSDN-UHFFFAOYSA-N	1	1	317.349	1.572	20	5		DDBDMO
CN1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCC1=O	ZINC000601119745	358410059	/nfs/dbraw/zinc/41/00/59/358410059.db2.gz	BCLANHRVPLTMHQ-JTQLQIEISA-N	1	1	300.318	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(NCC[N@@H+]3CC[C@@H](O)C3)c2c1	ZINC000601203803	358446530	/nfs/dbraw/zinc/44/65/30/358446530.db2.gz	VNQLBDYOQDZOTL-GFCCVEGCSA-N	1	1	302.334	1.043	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCC[C@@]3(O)CCCOC3)c2c1	ZINC000601184621	358438696	/nfs/dbraw/zinc/43/86/96/358438696.db2.gz	MUGPBEIFTCFCLW-INIZCTEOSA-N	1	1	317.345	1.908	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)CC1(O)CCOCC1	ZINC000601956630	358753020	/nfs/dbraw/zinc/75/30/20/358753020.db2.gz	SEOCRJFQGQWAJY-AWEZNQCLSA-N	1	1	324.377	1.319	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)CC1(O)CCOCC1	ZINC000601956630	358753021	/nfs/dbraw/zinc/75/30/21/358753021.db2.gz	SEOCRJFQGQWAJY-AWEZNQCLSA-N	1	1	324.377	1.319	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000181215066	199265932	/nfs/dbraw/zinc/26/59/32/199265932.db2.gz	TYMIEASKASKGFI-YPMHNXCESA-N	1	1	318.377	1.733	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000602043314	358789107	/nfs/dbraw/zinc/78/91/07/358789107.db2.gz	CUJZMUSWSFVUNI-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCN(C)c3ccccc3C2)c([N+](=O)[O-])n1	ZINC000602460989	358992129	/nfs/dbraw/zinc/99/21/29/358992129.db2.gz	VNSRFQGWOFAYGG-UHFFFAOYSA-N	1	1	301.350	1.780	20	5		DDBDMO
Cn1cc(C[N@H+]2CCN(C)c3ccccc3C2)c([N+](=O)[O-])n1	ZINC000602460989	358992131	/nfs/dbraw/zinc/99/21/31/358992131.db2.gz	VNSRFQGWOFAYGG-UHFFFAOYSA-N	1	1	301.350	1.780	20	5		DDBDMO
Cn1cc(C[N@H+](CCO)CCc2ccccc2)c([N+](=O)[O-])n1	ZINC000602468044	358998570	/nfs/dbraw/zinc/99/85/70/358998570.db2.gz	IVJAQBCFDRMIDW-UHFFFAOYSA-N	1	1	304.350	1.365	20	5		DDBDMO
Cn1cc(C[N@@H+](CCO)CCc2ccccc2)c([N+](=O)[O-])n1	ZINC000602468044	358998574	/nfs/dbraw/zinc/99/85/74/358998574.db2.gz	IVJAQBCFDRMIDW-UHFFFAOYSA-N	1	1	304.350	1.365	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCc3cnccn3)C2)nc1	ZINC000602794272	359196536	/nfs/dbraw/zinc/19/65/36/359196536.db2.gz	NOTMQIUANWNQRI-CYBMUJFWSA-N	1	1	314.349	1.509	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@H]1[C@@H]1CNC(=O)C1	ZINC000602795886	359198236	/nfs/dbraw/zinc/19/82/36/359198236.db2.gz	BYAGAKDJUMSECD-STQMWFEESA-N	1	1	321.381	1.090	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H]1CCCc2c1cnn2C	ZINC000602802070	359201564	/nfs/dbraw/zinc/20/15/64/359201564.db2.gz	SPTKQVVSPTUVFO-ZDUSSCGKSA-N	1	1	318.381	1.843	20	5		DDBDMO
COc1cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000602962509	359325270	/nfs/dbraw/zinc/32/52/70/359325270.db2.gz	LCGTWSNVCHDHTN-INIZCTEOSA-N	1	1	317.345	1.996	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](OC)C[C@@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964944	359329373	/nfs/dbraw/zinc/32/93/73/359329373.db2.gz	WNRYUACUJOVMMJ-CJNGLKHVSA-N	1	1	324.377	1.965	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)n1	ZINC000603141668	359430207	/nfs/dbraw/zinc/43/02/07/359430207.db2.gz	HDDVXJUNRCGEPM-GFCCVEGCSA-N	1	1	323.397	1.614	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)n1	ZINC000603141668	359430210	/nfs/dbraw/zinc/43/02/10/359430210.db2.gz	HDDVXJUNRCGEPM-GFCCVEGCSA-N	1	1	323.397	1.614	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000186827044	200017744	/nfs/dbraw/zinc/01/77/44/200017744.db2.gz	ZPDDVQYTDYNISJ-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@@H]1CC[NH2+]C[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000186766371	200006141	/nfs/dbraw/zinc/00/61/41/200006141.db2.gz	HFBXFUUYFWPKBJ-PELKAZGASA-N	1	1	303.322	1.199	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC000603399528	359616342	/nfs/dbraw/zinc/61/63/42/359616342.db2.gz	CBZASBFVJJTJQB-LLVKDONJSA-N	1	1	307.354	1.074	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCOC1	ZINC000603854339	359688532	/nfs/dbraw/zinc/68/85/32/359688532.db2.gz	GUIPMQLYMTZGHR-DZGCQCFKSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H]1CC[C@@](CO)([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000187963132	200183926	/nfs/dbraw/zinc/18/39/26/200183926.db2.gz	QOYFSAWGCNGBHS-IUODEOHRSA-N	1	1	309.366	1.239	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3CC[C@@H]([NH+]4CCOCC4)C3)nc2c1	ZINC000618584775	363682985	/nfs/dbraw/zinc/68/29/85/363682985.db2.gz	FJGQDJYSYYKMGQ-GFCCVEGCSA-N	1	1	317.349	1.382	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@@H](CCO)C2)c1	ZINC000609204398	360273953	/nfs/dbraw/zinc/27/39/53/360273953.db2.gz	MUQXDZKGYRNRMX-DZGCQCFKSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000609470713	360311915	/nfs/dbraw/zinc/31/19/15/360311915.db2.gz	LKVDJNZKNAJGGA-UHFFFAOYSA-N	1	1	322.365	1.321	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000610489145	360449417	/nfs/dbraw/zinc/44/94/17/360449417.db2.gz	HKTBIYKBDXYICG-CYBMUJFWSA-N	1	1	306.366	1.681	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000610615591	360482532	/nfs/dbraw/zinc/48/25/32/360482532.db2.gz	ULTIYBCPMKYFSF-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000610615591	360482536	/nfs/dbraw/zinc/48/25/36/360482536.db2.gz	ULTIYBCPMKYFSF-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC1(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000611560747	360760391	/nfs/dbraw/zinc/76/03/91/360760391.db2.gz	MLOODOMKHJNHOU-AWEZNQCLSA-N	1	1	316.361	1.780	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(Cl)c(S(=O)(=O)N2CC[NH2+]CC2)c1	ZINC000193229189	201009891	/nfs/dbraw/zinc/00/98/91/201009891.db2.gz	MNGCPBRDXJRLIF-UHFFFAOYSA-N	1	1	319.770	1.151	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252703	363945592	/nfs/dbraw/zinc/94/55/92/363945592.db2.gz	NOMUVPMXMVGGIY-JSGCOSHPSA-N	1	1	307.325	1.853	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCCC[C@@H]1C	ZINC000350014789	284132273	/nfs/dbraw/zinc/13/22/73/284132273.db2.gz	QMUXUGYLPUOYTD-QWRGUYRKSA-N	1	1	321.381	1.565	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000264615143	204029071	/nfs/dbraw/zinc/02/90/71/204029071.db2.gz	QPCNBJVRHXMAHW-VIFPVBQESA-N	1	1	307.354	1.094	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000350764130	284256915	/nfs/dbraw/zinc/25/69/15/284256915.db2.gz	OCZHPQOVCHXRQF-CQSZACIVSA-N	1	1	307.398	1.455	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@H](C)C1	ZINC000288202898	220015615	/nfs/dbraw/zinc/01/56/15/220015615.db2.gz	BZOZGFCADRTYBJ-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@H](C)C1	ZINC000288202898	220015620	/nfs/dbraw/zinc/01/56/20/220015620.db2.gz	BZOZGFCADRTYBJ-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
O=C1N[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C[C@@H]2CO1	ZINC000282615937	217127199	/nfs/dbraw/zinc/12/71/99/217127199.db2.gz	ZIXJJBRKWHTUEO-PWSUYJOCSA-N	1	1	309.297	1.664	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C[C@@H]2CO1	ZINC000282615937	217127200	/nfs/dbraw/zinc/12/72/00/217127200.db2.gz	ZIXJJBRKWHTUEO-PWSUYJOCSA-N	1	1	309.297	1.664	20	5		DDBDMO
CC(C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH+]1CCC(C)CC1	ZINC000160006337	197379735	/nfs/dbraw/zinc/37/97/35/197379735.db2.gz	XWVMXXSAOFAONE-GFCCVEGCSA-N	1	1	323.397	1.804	20	5		DDBDMO
COc1ccc(C[N@H+]2CCCC[C@@H]2CC(N)=O)cc1[N+](=O)[O-]	ZINC000339137937	250309373	/nfs/dbraw/zinc/30/93/73/250309373.db2.gz	XMHMPHJXGROSAX-GFCCVEGCSA-N	1	1	307.350	1.833	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2[C@H]2CCC[C@H]2O)cc1	ZINC000285020497	218258783	/nfs/dbraw/zinc/25/87/83/218258783.db2.gz	ZCFHCPNTCCCPCM-BRWVUGGUSA-N	1	1	320.389	1.999	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000106393586	194206467	/nfs/dbraw/zinc/20/64/67/194206467.db2.gz	QFSNFDDBEALDDJ-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC000106395458	194206515	/nfs/dbraw/zinc/20/65/15/194206515.db2.gz	ZGRTVWQGVNSQFK-OAHLLOKOSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC[C@H]1CCCO1	ZINC000285208365	218333889	/nfs/dbraw/zinc/33/38/89/218333889.db2.gz	DLAQSWYBBFQTLO-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC[C@H]1CCCO1	ZINC000285208365	218333893	/nfs/dbraw/zinc/33/38/93/218333893.db2.gz	DLAQSWYBBFQTLO-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000285322354	218380299	/nfs/dbraw/zinc/38/02/99/218380299.db2.gz	IZCXENQETKNLFQ-OKILXGFUSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000285322354	218380301	/nfs/dbraw/zinc/38/03/01/218380301.db2.gz	IZCXENQETKNLFQ-OKILXGFUSA-N	1	1	319.361	1.593	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000109627517	194278910	/nfs/dbraw/zinc/27/89/10/194278910.db2.gz	YLDUAAHRKUODQO-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000110609637	194342739	/nfs/dbraw/zinc/34/27/39/194342739.db2.gz	KWJLLDGALFWUMG-LBPRGKRZSA-N	1	1	306.366	1.607	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000110997424	194379931	/nfs/dbraw/zinc/37/99/31/194379931.db2.gz	DROLEYLIEPHDLP-GFCCVEGCSA-N	1	1	306.366	1.902	20	5		DDBDMO
CC(C)[N@@H+](CCCC(=O)NC(N)=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000065953514	184383726	/nfs/dbraw/zinc/38/37/26/184383726.db2.gz	CPZKQVPIIAUWKD-UHFFFAOYSA-N	1	1	322.365	1.780	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000352590971	285161572	/nfs/dbraw/zinc/16/15/72/285161572.db2.gz	PPLSADPEGVGDJS-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccccc3O)CC2)c1	ZINC000157338311	197179692	/nfs/dbraw/zinc/17/96/92/197179692.db2.gz	ZJDBLCLUVPXXCF-UHFFFAOYSA-N	1	1	317.349	1.319	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1[C@@H]1CCCO1	ZINC000289683230	221151290	/nfs/dbraw/zinc/15/12/90/221151290.db2.gz	HUCLQSZCLQRODY-ZFWWWQNUSA-N	1	1	321.377	1.646	20	5		DDBDMO
Cc1n[nH]c(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000299508364	533658335	/nfs/dbraw/zinc/65/83/35/533658335.db2.gz	FLCHLVQMKCULGP-UHFFFAOYSA-N	1	1	323.397	1.963	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[N@H+](C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000299508364	533658346	/nfs/dbraw/zinc/65/83/46/533658346.db2.gz	FLCHLVQMKCULGP-UHFFFAOYSA-N	1	1	323.397	1.963	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000299508364	533658352	/nfs/dbraw/zinc/65/83/52/533658352.db2.gz	FLCHLVQMKCULGP-UHFFFAOYSA-N	1	1	323.397	1.963	20	5		DDBDMO
CCC[N@@H+](CC)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593559544	397393250	/nfs/dbraw/zinc/39/32/50/397393250.db2.gz	WLKHJBPHWFVKFA-UHFFFAOYSA-N	1	1	316.383	1.000	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1	ZINC000569743682	304376561	/nfs/dbraw/zinc/37/65/61/304376561.db2.gz	CIWHOXFHFMOOLW-GFCCVEGCSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000046990346	407068658	/nfs/dbraw/zinc/06/86/58/407068658.db2.gz	DNFCRLQFYYLAQC-CYBMUJFWSA-N	1	1	323.397	1.420	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@H](CNC(C)=O)C2)cc1[N+](=O)[O-]	ZINC000067413310	407273374	/nfs/dbraw/zinc/27/33/74/407273374.db2.gz	VQMCARDKTQOSFQ-AWEZNQCLSA-N	1	1	321.377	1.952	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CCC[N@@H+](C)CC2)cc([N+](=O)[O-])c1	ZINC000097617859	407300769	/nfs/dbraw/zinc/30/07/69/407300769.db2.gz	VPVFMRZOKNOMGK-UHFFFAOYSA-N	1	1	321.333	1.159	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)CC12CCCCC2	ZINC000125446117	407388768	/nfs/dbraw/zinc/38/87/68/407388768.db2.gz	ZYIUCPSAHXMGFF-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000113225731	407476513	/nfs/dbraw/zinc/47/65/13/407476513.db2.gz	ZJLFGGFCYWXNAQ-VXGBXAGGSA-N	1	1	321.381	1.222	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC(C)(C)O	ZINC000114487433	407582046	/nfs/dbraw/zinc/58/20/46/407582046.db2.gz	XZGHDKXLPARPNG-ZDUSSCGKSA-N	1	1	312.366	1.427	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+](CCO)[C@@H]2CCc3ccccc32)c1	ZINC000266926082	407677219	/nfs/dbraw/zinc/67/72/19/407677219.db2.gz	KJMQTILYMGDDQX-MRXNPFEDSA-N	1	1	316.361	1.773	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCSC3(CCOCC3)C2)n1	ZINC000186847615	407785947	/nfs/dbraw/zinc/78/59/47/407785947.db2.gz	QPUDJHNAASNBJU-UHFFFAOYSA-N	1	1	312.395	1.389	20	5		DDBDMO
CCOc1cc(N2CC[NH+](CCOC)CC2)ccc1[N+](=O)[O-]	ZINC000267267226	407811497	/nfs/dbraw/zinc/81/14/97/407811497.db2.gz	YMAMLVXFEBAHIP-UHFFFAOYSA-N	1	1	309.366	1.762	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000153659226	407870318	/nfs/dbraw/zinc/87/03/18/407870318.db2.gz	XOXYRYKYLLQBGX-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000153659226	407870321	/nfs/dbraw/zinc/87/03/21/407870321.db2.gz	XOXYRYKYLLQBGX-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC[C@@](C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(N)=O	ZINC000133965806	407878468	/nfs/dbraw/zinc/87/84/68/407878468.db2.gz	MSTNSHNZWVGMCC-CQSZACIVSA-N	1	1	308.338	1.085	20	5		DDBDMO
C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000134054358	407883392	/nfs/dbraw/zinc/88/33/92/407883392.db2.gz	RTOORFLEXWVDHX-FZMZJTMJSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000134054358	407883400	/nfs/dbraw/zinc/88/34/00/407883400.db2.gz	RTOORFLEXWVDHX-FZMZJTMJSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C(C)(C)C1	ZINC000272397685	407901427	/nfs/dbraw/zinc/90/14/27/407901427.db2.gz	DLWNCJZLRMFLHG-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C(C)(C)C1	ZINC000272397685	407901429	/nfs/dbraw/zinc/90/14/29/407901429.db2.gz	DLWNCJZLRMFLHG-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000153982323	407945558	/nfs/dbraw/zinc/94/55/58/407945558.db2.gz	FXAGPSIPIHCXKA-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@H+]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000118826117	407951177	/nfs/dbraw/zinc/95/11/77/407951177.db2.gz	VMTNRSWCFRQCPO-UHFFFAOYSA-N	1	1	306.366	1.221	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000268261563	407975716	/nfs/dbraw/zinc/97/57/16/407975716.db2.gz	ZJLIJBMCKPXAKK-KCJUWKMLSA-N	1	1	307.354	1.093	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[NH2+]1	ZINC000262955599	407983534	/nfs/dbraw/zinc/98/35/34/407983534.db2.gz	VXTYATDEVFZRAL-DTWKUNHWSA-N	1	1	303.322	1.341	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000268151147	407917912	/nfs/dbraw/zinc/91/79/12/407917912.db2.gz	UQUPASLZXMTSEW-IAQYHMDHSA-N	1	1	318.377	1.877	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000135541319	408026916	/nfs/dbraw/zinc/02/69/16/408026916.db2.gz	XZWAFRJLCNNKKW-WCQYABFASA-N	1	1	319.365	1.097	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C[C@@H](C)O)C[C@H]1C	ZINC000189561349	408049468	/nfs/dbraw/zinc/04/94/68/408049468.db2.gz	LKVRLXFUBPWPED-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[NH2+]1	ZINC000262955604	407983853	/nfs/dbraw/zinc/98/38/53/407983853.db2.gz	VXTYATDEVFZRAL-RKDXNWHRSA-N	1	1	303.322	1.341	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000452065510	533677797	/nfs/dbraw/zinc/67/77/97/533677797.db2.gz	COODFZNKXOBVAJ-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000452065510	533677804	/nfs/dbraw/zinc/67/78/04/533677804.db2.gz	COODFZNKXOBVAJ-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
O=C1NCCCC[C@@H]1[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245857446	408080292	/nfs/dbraw/zinc/08/02/92/408080292.db2.gz	KIGOKQIOSAHHMD-AAEUAGOBSA-N	1	1	319.365	1.145	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)CC[N@H+]1C[C@@H](C)O	ZINC000150767499	408194521	/nfs/dbraw/zinc/19/45/21/408194521.db2.gz	LCRLUWVUTSKYIN-DGCLKSJQSA-N	1	1	308.382	1.580	20	5		DDBDMO
CCN1CC[NH+](CCCNc2nc(C)ccc2[N+](=O)[O-])CC1	ZINC000121276658	408176737	/nfs/dbraw/zinc/17/67/37/408176737.db2.gz	LQCOJMASOLJZSS-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000273536393	408237441	/nfs/dbraw/zinc/23/74/41/408237441.db2.gz	VQNAMSSLEGHYTJ-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000269524189	408340255	/nfs/dbraw/zinc/34/02/55/408340255.db2.gz	QXKWLIXDQHBRRO-CYBMUJFWSA-N	1	1	307.350	1.124	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCn3cncn3)CC2)cc1	ZINC000264159434	408384935	/nfs/dbraw/zinc/38/49/35/408384935.db2.gz	XXJGZLZKWUDEGU-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000173495164	162343033	/nfs/dbraw/zinc/34/30/33/162343033.db2.gz	FTUSMSKCRPNSEQ-LBPRGKRZSA-N	1	1	310.350	1.687	20	5		DDBDMO
COc1ccc(C[N@H+](CCO)C2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000264351555	408456654	/nfs/dbraw/zinc/45/66/54/408456654.db2.gz	HDXYNLVJJDAZQP-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)C2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000264351555	408456658	/nfs/dbraw/zinc/45/66/58/408456658.db2.gz	HDXYNLVJJDAZQP-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@H]1CCC[C@@H]1O	ZINC000159533132	408414552	/nfs/dbraw/zinc/41/45/52/408414552.db2.gz	BNBSKHRHMQIHPM-OCCSQVGLSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O	ZINC000159533132	408414554	/nfs/dbraw/zinc/41/45/54/408414554.db2.gz	BNBSKHRHMQIHPM-OCCSQVGLSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000274495252	408428358	/nfs/dbraw/zinc/42/83/58/408428358.db2.gz	CTNXHYVFYTWVNT-UHFFFAOYSA-N	1	1	323.393	1.303	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000264429797	408486667	/nfs/dbraw/zinc/48/66/67/408486667.db2.gz	ALRYNXZWEOXSGJ-PSKZRQQASA-N	1	1	319.361	1.445	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248456967	408572183	/nfs/dbraw/zinc/57/21/83/408572183.db2.gz	LZPBWQMQNGGYDP-YNEHKIRRSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCOC1	ZINC000248470921	408575638	/nfs/dbraw/zinc/57/56/38/408575638.db2.gz	VLNAJDIMKOYKAO-CHWSQXEVSA-N	1	1	310.350	1.303	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000274802686	408538835	/nfs/dbraw/zinc/53/88/35/408538835.db2.gz	KVKVASOYUOJXAR-ZDUSSCGKSA-N	1	1	322.365	1.745	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)n1	ZINC000248663925	408612143	/nfs/dbraw/zinc/61/21/43/408612143.db2.gz	KHRLFCIDMYATHE-NEPJUHHUSA-N	1	1	323.397	1.661	20	5		DDBDMO
C[C@@H](c1ccccn1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680760	408634392	/nfs/dbraw/zinc/63/43/92/408634392.db2.gz	URCSPOHINMCOLU-WCQYABFASA-N	1	1	305.338	1.240	20	5		DDBDMO
CC[N@@H+](CCCO)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000270684894	408636078	/nfs/dbraw/zinc/63/60/78/408636078.db2.gz	APVLWAYOKNWEDO-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H]1CO	ZINC000248919310	408660648	/nfs/dbraw/zinc/66/06/48/408660648.db2.gz	KMNGYYFUMPTGDA-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1cnc(N2CC[N@H+](CC(C)(C)O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000275891328	408709897	/nfs/dbraw/zinc/70/98/97/408709897.db2.gz	XZZINADPICLJJL-LBPRGKRZSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)C1CCC1	ZINC000275887063	408710088	/nfs/dbraw/zinc/71/00/88/408710088.db2.gz	RJZSXAXDPMANEA-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)C1CCC1	ZINC000275887063	408710093	/nfs/dbraw/zinc/71/00/93/408710093.db2.gz	RJZSXAXDPMANEA-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290851372	408843760	/nfs/dbraw/zinc/84/37/60/408843760.db2.gz	XJVULEABSKKEDO-UHFFFAOYSA-N	1	1	304.310	1.096	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000190862225	163162429	/nfs/dbraw/zinc/16/24/29/163162429.db2.gz	MZTZSQYNALTNMR-NEPJUHHUSA-N	1	1	307.350	1.484	20	5		DDBDMO
CCOc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000192461757	163223878	/nfs/dbraw/zinc/22/38/78/163223878.db2.gz	PMTFUGVIAUAAAY-BETUJISGSA-N	1	1	319.361	1.627	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000286174119	408936498	/nfs/dbraw/zinc/93/64/98/408936498.db2.gz	WXNUBHGNSABBKV-PBHICJAKSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000286174123	408936557	/nfs/dbraw/zinc/93/65/57/408936557.db2.gz	WXNUBHGNSABBKV-RHSMWYFYSA-N	1	1	319.405	1.932	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000277386086	408931333	/nfs/dbraw/zinc/93/13/33/408931333.db2.gz	BOCNNUTYQIFZAA-NSHDSACASA-N	1	1	321.381	1.627	20	5		DDBDMO
CC(C)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000286235340	408945753	/nfs/dbraw/zinc/94/57/53/408945753.db2.gz	UIPRUCHEKFYFIL-MRXNPFEDSA-N	1	1	321.425	1.861	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@@H](C2CCC2)C1	ZINC000292183524	408997120	/nfs/dbraw/zinc/99/71/20/408997120.db2.gz	QUCNCTHDISBAKQ-AWEZNQCLSA-N	1	1	321.377	1.505	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000287517758	409048213	/nfs/dbraw/zinc/04/82/13/409048213.db2.gz	UVCMBEFOZPZEBC-GFCCVEGCSA-N	1	1	321.377	1.577	20	5		DDBDMO
COCCO[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000278261683	409077800	/nfs/dbraw/zinc/07/78/00/409077800.db2.gz	IGZVKZREEOZTEX-UKRRQHHQSA-N	1	1	324.377	1.441	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[NH2+]CC[C@H]3C2)c1[N+](=O)[O-]	ZINC000293327976	409089884	/nfs/dbraw/zinc/08/98/84/409089884.db2.gz	IWNZLWPGLPHUML-VHSXEESVSA-N	1	1	307.354	1.094	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000279313536	409189478	/nfs/dbraw/zinc/18/94/78/409189478.db2.gz	NKOZJWBPKPHLMS-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+]1C1CC1	ZINC000279231747	409174625	/nfs/dbraw/zinc/17/46/25/409174625.db2.gz	RLXPGRAMGNLHQB-OAHLLOKOSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCC[N@@H+]1CC=CCC1	ZINC000280268368	409281293	/nfs/dbraw/zinc/28/12/93/409281293.db2.gz	PDKNPYHIXIOLLY-RMKNXTFCSA-N	1	1	301.346	1.986	20	5		DDBDMO
C[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000280537999	409347929	/nfs/dbraw/zinc/34/79/29/409347929.db2.gz	PLMLNRRPYFNXOW-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000280537999	409347934	/nfs/dbraw/zinc/34/79/34/409347934.db2.gz	PLMLNRRPYFNXOW-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000296095420	409430098	/nfs/dbraw/zinc/43/00/98/409430098.db2.gz	HPYZSVHGXGFRKE-YRGRVCCFSA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC=C(c3ccco3)C2)c1	ZINC000285405650	409433042	/nfs/dbraw/zinc/43/30/42/409433042.db2.gz	UJPNDHOZOHRXAE-CQSZACIVSA-N	1	1	318.333	1.535	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000321979919	164045992	/nfs/dbraw/zinc/04/59/92/164045992.db2.gz	OZBQQPQKLNAFRU-RYUDHWBXSA-N	1	1	323.324	1.327	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331591907	409670077	/nfs/dbraw/zinc/67/00/77/409670077.db2.gz	XZBUEQYHXSLZJN-GHMZBOCLSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000356891009	409691467	/nfs/dbraw/zinc/69/14/67/409691467.db2.gz	WCVYAGCNCZKOSW-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000346319633	409914288	/nfs/dbraw/zinc/91/42/88/409914288.db2.gz	CMGLOKKIDHYPHZ-ZKYQVNSYSA-N	1	1	322.361	1.815	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000357331640	409975919	/nfs/dbraw/zinc/97/59/19/409975919.db2.gz	JRLNNNSXBFHJMX-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@]1(O)CC[N@@H+](C)C1	ZINC000342833359	409933942	/nfs/dbraw/zinc/93/39/42/409933942.db2.gz	ZDLUVOPLMXRTGG-OAHLLOKOSA-N	1	1	323.349	1.168	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H]1C	ZINC000346657677	410061401	/nfs/dbraw/zinc/06/14/01/410061401.db2.gz	LHCKZTKLSZRNRQ-BXUZGUMPSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[C@H]1CC[C@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)O1	ZINC000298036794	410088549	/nfs/dbraw/zinc/08/85/49/410088549.db2.gz	GVJWYPUQRMXLDV-QWHCGFSZSA-N	1	1	306.366	1.679	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000357706890	410199519	/nfs/dbraw/zinc/19/95/19/410199519.db2.gz	IVSDQGPWUGXGRE-UHFFFAOYSA-N	1	1	310.354	1.920	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@H]1C	ZINC000351940185	410354083	/nfs/dbraw/zinc/35/40/83/410354083.db2.gz	ZUCYTKUUCNAYSQ-ZJUUUORDSA-N	1	1	307.354	1.127	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000298744294	410377046	/nfs/dbraw/zinc/37/70/46/410377046.db2.gz	YFYQHFIIBQSOPX-SNVBAGLBSA-N	1	1	307.354	1.375	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCCC[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000298752434	410382524	/nfs/dbraw/zinc/38/25/24/410382524.db2.gz	NMKKFEMVHRAVHZ-CQSZACIVSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCC[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000298752434	410382527	/nfs/dbraw/zinc/38/25/27/410382527.db2.gz	NMKKFEMVHRAVHZ-CQSZACIVSA-N	1	1	307.350	1.404	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1[C@H](CO)CC[C@H]1CO	ZINC000347304794	410457296	/nfs/dbraw/zinc/45/72/96/410457296.db2.gz	LPQWHCXYRIHHQV-GJZGRUSLSA-N	1	1	324.377	1.700	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343460458	410471864	/nfs/dbraw/zinc/47/18/64/410471864.db2.gz	RVBOVKYMYFVITK-QWHCGFSZSA-N	1	1	320.393	1.996	20	5		DDBDMO
COc1ccc(CNC(=O)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000298910495	410447420	/nfs/dbraw/zinc/44/74/20/410447420.db2.gz	CYJDUPGGROORFA-UHFFFAOYSA-N	1	1	308.338	1.060	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000352233282	410565812	/nfs/dbraw/zinc/56/58/12/410565812.db2.gz	BOHGUXSLWWWKEN-SWLSCSKDSA-N	1	1	319.361	1.668	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000301896939	410823538	/nfs/dbraw/zinc/82/35/38/410823538.db2.gz	ZVNBBMWHBMQBRE-GFCCVEGCSA-N	1	1	318.381	1.806	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)CC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356099557	410831849	/nfs/dbraw/zinc/83/18/49/410831849.db2.gz	QSVFZZLZOCYGIV-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@@H+]2CCCC[C@H]2CO1	ZINC000301878318	410818022	/nfs/dbraw/zinc/81/80/22/410818022.db2.gz	UCQUJUMGMYWQBC-JSGCOSHPSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@H+]2CCCC[C@H]2CO1	ZINC000301878318	410818029	/nfs/dbraw/zinc/81/80/29/410818029.db2.gz	UCQUJUMGMYWQBC-JSGCOSHPSA-N	1	1	306.366	1.963	20	5		DDBDMO
COc1c(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000356203260	410893647	/nfs/dbraw/zinc/89/36/47/410893647.db2.gz	LLTGALCDHMZTNG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(O)CCC1	ZINC000353480878	411021184	/nfs/dbraw/zinc/02/11/84/411021184.db2.gz	JNSLQXXNHCYXHM-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000296665974	226104569	/nfs/dbraw/zinc/10/45/69/226104569.db2.gz	KJOKVXOJRGIMRP-GDBMZVCRSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000419322455	226114830	/nfs/dbraw/zinc/11/48/30/226114830.db2.gz	HKDGQTWFYUWDMQ-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C1CO[C@@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]2N1	ZINC000366784191	418518126	/nfs/dbraw/zinc/51/81/26/418518126.db2.gz	UKSZQTFYRKLPCA-YQRAZLAVSA-N	1	1	317.345	1.197	20	5		DDBDMO
O=C1CO[C@@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]2N1	ZINC000366784191	418518127	/nfs/dbraw/zinc/51/81/27/418518127.db2.gz	UKSZQTFYRKLPCA-YQRAZLAVSA-N	1	1	317.345	1.197	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188369416	222011825	/nfs/dbraw/zinc/01/18/25/222011825.db2.gz	WCLHPTNNBVKQTQ-NSHDSACASA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188369416	222011827	/nfs/dbraw/zinc/01/18/27/222011827.db2.gz	WCLHPTNNBVKQTQ-NSHDSACASA-N	1	1	322.365	1.434	20	5		DDBDMO
CCN1CCC([N@@H+](CCn2ccc([N+](=O)[O-])n2)C2CC2)CC1	ZINC000375006455	418587607	/nfs/dbraw/zinc/58/76/07/418587607.db2.gz	XCQOZBZULOLEFS-UHFFFAOYSA-N	1	1	307.398	1.740	20	5		DDBDMO
CC[NH+]1CCC(N(CCn2ccc([N+](=O)[O-])n2)C2CC2)CC1	ZINC000375006455	418587609	/nfs/dbraw/zinc/58/76/09/418587609.db2.gz	XCQOZBZULOLEFS-UHFFFAOYSA-N	1	1	307.398	1.740	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCN1CCCOCC1	ZINC000361376898	418639098	/nfs/dbraw/zinc/63/90/98/418639098.db2.gz	NAJSZDCYNAOSBS-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)CC[N@@H+]1CCCOCC1	ZINC000361376898	418639101	/nfs/dbraw/zinc/63/91/01/418639101.db2.gz	NAJSZDCYNAOSBS-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)CC[N@H+]1CCCOCC1	ZINC000361376898	418639103	/nfs/dbraw/zinc/63/91/03/418639103.db2.gz	NAJSZDCYNAOSBS-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583379	418685488	/nfs/dbraw/zinc/68/54/88/418685488.db2.gz	LMAOJIYEEQJBBP-QMTHXVAHSA-N	1	1	320.349	1.443	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583379	418685490	/nfs/dbraw/zinc/68/54/90/418685490.db2.gz	LMAOJIYEEQJBBP-QMTHXVAHSA-N	1	1	320.349	1.443	20	5		DDBDMO
CNc1c(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000388640052	418747084	/nfs/dbraw/zinc/74/70/84/418747084.db2.gz	MTCGQDRNOWURPR-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000372376838	418862134	/nfs/dbraw/zinc/86/21/34/418862134.db2.gz	PLQCIDSVQUPKNL-UHFFFAOYSA-N	1	1	316.361	1.901	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681243	418892996	/nfs/dbraw/zinc/89/29/96/418892996.db2.gz	VYPRJWANGMBASF-TZMCWYRMSA-N	1	1	321.337	1.286	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681243	418892997	/nfs/dbraw/zinc/89/29/97/418892997.db2.gz	VYPRJWANGMBASF-TZMCWYRMSA-N	1	1	321.337	1.286	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000411607711	419361003	/nfs/dbraw/zinc/36/10/03/419361003.db2.gz	DFUYVQOBKFOFGS-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000420943349	419372229	/nfs/dbraw/zinc/37/22/29/419372229.db2.gz	PSSHVQSGBFTFFP-CHWSQXEVSA-N	1	1	321.377	1.874	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000421002855	419438387	/nfs/dbraw/zinc/43/83/87/419438387.db2.gz	BTVXYPXAHKXSEJ-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000421002855	419438395	/nfs/dbraw/zinc/43/83/95/419438395.db2.gz	BTVXYPXAHKXSEJ-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000412045619	419587244	/nfs/dbraw/zinc/58/72/44/419587244.db2.gz	YKGHVHLIJPLEDC-MFKMUULPSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000412045619	419587251	/nfs/dbraw/zinc/58/72/51/419587251.db2.gz	YKGHVHLIJPLEDC-MFKMUULPSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1[C@@H](CO)CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079258	419630364	/nfs/dbraw/zinc/63/03/64/419630364.db2.gz	LCOYBTLIODQPGN-QWHCGFSZSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1[C@@H](CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079258	419630372	/nfs/dbraw/zinc/63/03/72/419630372.db2.gz	LCOYBTLIODQPGN-QWHCGFSZSA-N	1	1	321.377	1.650	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](O)[C@@H](CO)C1	ZINC000412108269	419667975	/nfs/dbraw/zinc/66/79/75/419667975.db2.gz	SAXOHZSAIZXSPY-OCCSQVGLSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](O)[C@@H](CO)C1	ZINC000412108269	419667984	/nfs/dbraw/zinc/66/79/84/419667984.db2.gz	SAXOHZSAIZXSPY-OCCSQVGLSA-N	1	1	310.350	1.169	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc(F)cc1[N+](=O)[O-]	ZINC000299002311	228870468	/nfs/dbraw/zinc/87/04/68/228870468.db2.gz	JWXRWTRYIVHTFN-NWDGAFQWSA-N	1	1	322.340	1.673	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)CC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000431989413	229072343	/nfs/dbraw/zinc/07/23/43/229072343.db2.gz	ANOVAQUYDJSSCO-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CC(N)=O)C1	ZINC000430236368	420094339	/nfs/dbraw/zinc/09/43/39/420094339.db2.gz	HDVAOFPZJAVJRA-NSHDSACASA-N	1	1	307.350	1.691	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000430787129	420190380	/nfs/dbraw/zinc/19/03/80/420190380.db2.gz	FFLGINURLBHFHV-GXTWGEPZSA-N	1	1	321.377	1.881	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000420774891	420386754	/nfs/dbraw/zinc/38/67/54/420386754.db2.gz	YXBDPTDKVDIOEC-SECBINFHSA-N	1	1	319.408	1.371	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000420774891	420386756	/nfs/dbraw/zinc/38/67/56/420386756.db2.gz	YXBDPTDKVDIOEC-SECBINFHSA-N	1	1	319.408	1.371	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000417758731	420469808	/nfs/dbraw/zinc/46/98/08/420469808.db2.gz	CSDCCKZLIKJIOR-OAHLLOKOSA-N	1	1	324.356	1.480	20	5		DDBDMO
COc1cccc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450788930	420531651	/nfs/dbraw/zinc/53/16/51/420531651.db2.gz	FBOBWWPWJORPCU-TXEJJXNPSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](CC[NH3+])C1	ZINC000443063899	420742474	/nfs/dbraw/zinc/74/24/74/420742474.db2.gz	XISDSYYZYVVQII-QWHCGFSZSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])C[C@H]2C1	ZINC000493594424	420891246	/nfs/dbraw/zinc/89/12/46/420891246.db2.gz	UCTFPLLMKMVFEG-AYKMPCHXSA-N	1	1	319.336	1.767	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)N1CCN(C)CC1	ZINC000449134360	420956706	/nfs/dbraw/zinc/95/67/06/420956706.db2.gz	IRBNDVKSUJVSBH-GJZGRUSLSA-N	1	1	320.437	1.751	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000455098672	420969426	/nfs/dbraw/zinc/96/94/26/420969426.db2.gz	JZVRXYPPLROUCC-NSHDSACASA-N	1	1	319.365	1.342	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000455098672	420969428	/nfs/dbraw/zinc/96/94/28/420969428.db2.gz	JZVRXYPPLROUCC-NSHDSACASA-N	1	1	319.365	1.342	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN[C@H]2CCC[N@@H+](CCCO)C2)c(F)c1	ZINC000449397071	421007603	/nfs/dbraw/zinc/00/76/03/421007603.db2.gz	NWIQMKKMOFQUFB-ZDUSSCGKSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN[C@H]2CCC[N@H+](CCCO)C2)c(F)c1	ZINC000449397071	421007607	/nfs/dbraw/zinc/00/76/07/421007607.db2.gz	NWIQMKKMOFQUFB-ZDUSSCGKSA-N	1	1	311.357	1.670	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@](C)(F)C1	ZINC000449569786	421028423	/nfs/dbraw/zinc/02/84/23/421028423.db2.gz	DLBAHKQRQLJEMH-CQSZACIVSA-N	1	1	311.313	1.377	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456051270	421093402	/nfs/dbraw/zinc/09/34/02/421093402.db2.gz	JFBXXOATOYPFDU-NSHDSACASA-N	1	1	321.381	1.636	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000449786396	421084897	/nfs/dbraw/zinc/08/48/97/421084897.db2.gz	NMYODXAENJIQKC-YVZNUBBCSA-N	1	1	305.378	1.606	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000456355129	421146725	/nfs/dbraw/zinc/14/67/25/421146725.db2.gz	PXRBFQFSOIFLAZ-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000456387421	421158054	/nfs/dbraw/zinc/15/80/54/421158054.db2.gz	SNBOMWFWQRXTGI-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2CCCC[N@H+]2CCO)c(Cl)c1	ZINC000450608501	421217581	/nfs/dbraw/zinc/21/75/81/421217581.db2.gz	DKUCBRSWAJQOOX-SNVBAGLBSA-N	1	1	314.773	1.902	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2CCCC[N@@H+]2CCO)c(Cl)c1	ZINC000450608501	421217582	/nfs/dbraw/zinc/21/75/82/421217582.db2.gz	DKUCBRSWAJQOOX-SNVBAGLBSA-N	1	1	314.773	1.902	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777273	421629712	/nfs/dbraw/zinc/62/97/12/421629712.db2.gz	DWYZWLZQBDZSHE-TZMCWYRMSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777273	421629716	/nfs/dbraw/zinc/62/97/16/421629716.db2.gz	DWYZWLZQBDZSHE-TZMCWYRMSA-N	1	1	310.350	1.169	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+][C@@H]2CCC[C@@H]2F)cc1	ZINC000571075213	421687461	/nfs/dbraw/zinc/68/74/61/421687461.db2.gz	QIBDMLFAETUWFL-QWHCGFSZSA-N	1	1	316.354	1.849	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000557071811	421758830	/nfs/dbraw/zinc/75/88/30/421758830.db2.gz	QIGIMNNMWVROEC-JTQLQIEISA-N	1	1	307.354	1.264	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000520766177	421761814	/nfs/dbraw/zinc/76/18/14/421761814.db2.gz	MPRKGDCUYGEORL-VIFPVBQESA-N	1	1	319.317	1.290	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)C1	ZINC000522145311	421817650	/nfs/dbraw/zinc/81/76/50/421817650.db2.gz	VLXFVGUEZLQMHT-ZDUSSCGKSA-N	1	1	318.377	1.195	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000542778311	421828688	/nfs/dbraw/zinc/82/86/88/421828688.db2.gz	KUWDZIAQYYHDGQ-DZGCQCFKSA-N	1	1	318.377	1.830	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000580889238	421856669	/nfs/dbraw/zinc/85/66/69/421856669.db2.gz	XSOLQUHBGXHIEP-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000344756086	272111008	/nfs/dbraw/zinc/11/10/08/272111008.db2.gz	GQEUKTVNCRAVJG-JTQLQIEISA-N	1	1	305.338	1.504	20	5		DDBDMO
CC(C)OC[C@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000098066286	273541536	/nfs/dbraw/zinc/54/15/36/273541536.db2.gz	OPLCOLNJLYMJAW-CQSZACIVSA-N	1	1	323.393	1.503	20	5		DDBDMO
CCOc1cccc(N2CC[NH+](CCCO)CC2)c1[N+](=O)[O-]	ZINC000183147489	276381221	/nfs/dbraw/zinc/38/12/21/276381221.db2.gz	QZJWFUFVZPJEFE-UHFFFAOYSA-N	1	1	309.366	1.498	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1	ZINC000264860711	277049370	/nfs/dbraw/zinc/04/93/70/277049370.db2.gz	LSWIADFDZOLUHW-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
CN1CCNC[C@H]1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423522042	277116783	/nfs/dbraw/zinc/11/67/83/277116783.db2.gz	RENADVVNARJTTA-BBRMVZONSA-N	1	1	318.421	1.810	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000408073941	288100226	/nfs/dbraw/zinc/10/02/26/288100226.db2.gz	VDSKGHUOPYGWPJ-NWDGAFQWSA-N	1	1	321.377	1.986	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000448058397	279385107	/nfs/dbraw/zinc/38/51/07/279385107.db2.gz	NECSRGCREKQWFY-DGCLKSJQSA-N	1	1	305.382	1.781	20	5		DDBDMO
Cc1c(C(=O)NC[C@H](C)C[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000150730747	280214983	/nfs/dbraw/zinc/21/49/83/280214983.db2.gz	ZNRRSTOBAHHDFX-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCN(c3ccc(N)[nH+]c3)CC2)n1	ZINC000178198790	281012346	/nfs/dbraw/zinc/01/23/46/281012346.db2.gz	NBSZPHJDCLZIAY-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000330577756	281261102	/nfs/dbraw/zinc/26/11/02/281261102.db2.gz	HBNUTEZEANYGQL-OLZOCXBDSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3ncc(Cl)cc3[N+](=O)[O-])C[C@H]21	ZINC000285012770	290115505	/nfs/dbraw/zinc/11/55/05/290115505.db2.gz	MKUFLZVNNGCLAT-NEPJUHHUSA-N	1	1	312.757	1.553	20	5		DDBDMO
O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367289525	300823184	/nfs/dbraw/zinc/82/31/84/300823184.db2.gz	AFMPCADNHBMQMX-SNVBAGLBSA-N	1	1	319.695	1.927	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368966164	301111737	/nfs/dbraw/zinc/11/17/37/301111737.db2.gz	NLCHNDLEPWJAMO-BBRMVZONSA-N	1	1	323.393	1.017	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)N1CCCCC1	ZINC000369010254	301118668	/nfs/dbraw/zinc/11/86/68/301118668.db2.gz	POKUSOVGVVGJAM-ZDUSSCGKSA-N	1	1	321.381	1.441	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)N1CCCCC1	ZINC000369010254	301118670	/nfs/dbraw/zinc/11/86/70/301118670.db2.gz	POKUSOVGVVGJAM-ZDUSSCGKSA-N	1	1	321.381	1.441	20	5		DDBDMO
CC(C)OC[C@@H](O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012206	301119715	/nfs/dbraw/zinc/11/97/15/301119715.db2.gz	UMXJYJZBBXLXBR-JSGCOSHPSA-N	1	1	312.370	1.214	20	5		DDBDMO
O=C1CCCCN1[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000370002408	301256076	/nfs/dbraw/zinc/25/60/76/301256076.db2.gz	OBBIOAJAFDWGJA-ZDUSSCGKSA-N	1	1	321.381	1.268	20	5		DDBDMO
COC(=O)CN1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000370030437	301261812	/nfs/dbraw/zinc/26/18/12/301261812.db2.gz	YMQBZJKWNWKWGP-CYBMUJFWSA-N	1	1	321.377	1.837	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CC[C@](O)(C3CC3)C2)c2c(c1)COCO2	ZINC000370084984	301272970	/nfs/dbraw/zinc/27/29/70/301272970.db2.gz	QNLUVWAHOREORB-MRXNPFEDSA-N	1	1	320.345	1.808	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000531883055	303263155	/nfs/dbraw/zinc/26/31/55/303263155.db2.gz	WWQKNFXOOYARCJ-TXEJJXNPSA-N	1	1	306.366	1.983	20	5		DDBDMO
C[NH+](C)C[C@@H]1CCCCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000532891444	303301274	/nfs/dbraw/zinc/30/12/74/303301274.db2.gz	LWGBXCLELMEOIX-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
COc1ccc(C[NH2+][C@H]2CCc3cn[nH]c3C2)cc1[N+](=O)[O-]	ZINC000363938669	307038200	/nfs/dbraw/zinc/03/82/00/307038200.db2.gz	PIERUSWZGFHYBY-LBPRGKRZSA-N	1	1	302.334	1.974	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccsc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000371664639	307155726	/nfs/dbraw/zinc/15/57/26/307155726.db2.gz	WJSVTCAFOVYNQP-QWHCGFSZSA-N	1	1	309.391	1.494	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1	ZINC000372086654	307162954	/nfs/dbraw/zinc/16/29/54/307162954.db2.gz	NQSCZDULLJSWJT-GFCCVEGCSA-N	1	1	321.381	1.267	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920463	307233176	/nfs/dbraw/zinc/23/31/76/307233176.db2.gz	NRMMBEIURUTKPK-MBNYWOFBSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920463	307233177	/nfs/dbraw/zinc/23/31/77/307233177.db2.gz	NRMMBEIURUTKPK-MBNYWOFBSA-N	1	1	310.354	1.060	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000376642884	307251095	/nfs/dbraw/zinc/25/10/95/307251095.db2.gz	MLLUEUZLLUSESB-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[N@@H+]2CC[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000566444062	308052606	/nfs/dbraw/zinc/05/26/06/308052606.db2.gz	JALXRKTWTPFFNZ-JTQLQIEISA-N	1	1	321.333	1.662	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[N@H+]2CC[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000566444062	308052607	/nfs/dbraw/zinc/05/26/07/308052607.db2.gz	JALXRKTWTPFFNZ-JTQLQIEISA-N	1	1	321.333	1.662	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H](C)[NH+]1CC(C)C1	ZINC000581833175	325920638	/nfs/dbraw/zinc/92/06/38/325920638.db2.gz	FLJCBMUXOPSOQF-LLVKDONJSA-N	1	1	307.350	1.560	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1C	ZINC000357540310	484510136	/nfs/dbraw/zinc/51/01/36/484510136.db2.gz	XBOUCIATZSDQAZ-QWRGUYRKSA-N	1	1	321.381	1.398	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[NH2+]C[C@](C)(F)C2)cccc1[N+](=O)[O-]	ZINC000418084727	533854352	/nfs/dbraw/zinc/85/43/52/533854352.db2.gz	WAYWPJJVKGSNNL-HNNXBMFYSA-N	1	1	324.356	1.746	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000154398166	527313760	/nfs/dbraw/zinc/31/37/60/527313760.db2.gz	DWVCBCMWPDXPEA-IUODEOHRSA-N	1	1	318.377	1.855	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)[C@@H](C)C1	ZINC000330832855	527750723	/nfs/dbraw/zinc/75/07/23/527750723.db2.gz	VKJCIBVOVSVOEE-GXFFZTMASA-N	1	1	321.381	1.374	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000490294144	527842639	/nfs/dbraw/zinc/84/26/39/527842639.db2.gz	ZKUYPJUEFUNPMX-GFCCVEGCSA-N	1	1	308.338	1.108	20	5		DDBDMO
CC(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557078	528094401	/nfs/dbraw/zinc/09/44/01/528094401.db2.gz	KZOZTBGXWAXMJB-BBRMVZONSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CC[C@H](O)[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557078	528094405	/nfs/dbraw/zinc/09/44/05/528094405.db2.gz	KZOZTBGXWAXMJB-BBRMVZONSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000451741337	529290315	/nfs/dbraw/zinc/29/03/15/529290315.db2.gz	OFSZVRMVGBKRGG-ZDUSSCGKSA-N	1	1	308.382	1.173	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CCC[N@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000108461808	696633960	/nfs/dbraw/zinc/63/39/60/696633960.db2.gz	RPAABVKNVLBBKM-LLVKDONJSA-N	1	1	306.366	1.557	20	5		DDBDMO
Cc1cnc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC000983655178	697286829	/nfs/dbraw/zinc/28/68/29/697286829.db2.gz	QUZAHHZTNFBGLN-DDHJBXDOSA-N	1	1	324.406	1.101	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccco1	ZINC000195128610	697731561	/nfs/dbraw/zinc/73/15/61/697731561.db2.gz	CMTGECZGOXEBTD-ZDUSSCGKSA-N	1	1	318.333	1.803	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581316	698121052	/nfs/dbraw/zinc/12/10/52/698121052.db2.gz	CIXQDFVVUYMATI-LSDHHAIUSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581316	698121055	/nfs/dbraw/zinc/12/10/55/698121055.db2.gz	CIXQDFVVUYMATI-LSDHHAIUSA-N	1	1	319.361	1.371	20	5		DDBDMO
COC(=O)CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000776583148	698121703	/nfs/dbraw/zinc/12/17/03/698121703.db2.gz	XYCMXGUKXMHAOC-AWEZNQCLSA-N	1	1	310.350	1.902	20	5		DDBDMO
COCCO[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594003	698124320	/nfs/dbraw/zinc/12/43/20/698124320.db2.gz	QQMCHLJJVMRAAH-HZPDHXFCSA-N	1	1	324.377	1.756	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000800374539	700219013	/nfs/dbraw/zinc/21/90/13/700219013.db2.gz	RTVUHMXMGJIIPE-HEHGZKQESA-N	1	1	323.393	1.015	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2C[C@@]2(CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000782620084	698752305	/nfs/dbraw/zinc/75/23/05/698752305.db2.gz	KLYFJVCRADUSST-ABAIWWIYSA-N	1	1	305.334	1.238	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(Cn3ncc4cc([N+](=O)[O-])ccc43)C2)C1	ZINC000793769381	699778157	/nfs/dbraw/zinc/77/81/57/699778157.db2.gz	UQYIOSDELHWCJZ-INIZCTEOSA-N	1	1	315.377	1.930	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000743637067	699921026	/nfs/dbraw/zinc/92/10/26/699921026.db2.gz	KXAUUXFULZNAOE-MNOVXSKESA-N	1	1	306.366	1.698	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCCn1cc[nH+]c1C(C)C	ZINC000744389592	699947419	/nfs/dbraw/zinc/94/74/19/699947419.db2.gz	CPOWIZBZPKLAHG-UHFFFAOYSA-N	1	1	320.353	1.236	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801914238	700353100	/nfs/dbraw/zinc/35/31/00/700353100.db2.gz	UVKVENPCZWWDKD-VIFPVBQESA-N	1	1	310.329	1.388	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248750	700557902	/nfs/dbraw/zinc/55/79/02/700557902.db2.gz	NUTDEGVQLGLRCS-ZFWWWQNUSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248750	700557904	/nfs/dbraw/zinc/55/79/04/700557904.db2.gz	NUTDEGVQLGLRCS-ZFWWWQNUSA-N	1	1	307.350	1.358	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[NH+]([C@@H]3CCOC3)CC2)nc2ccccn21	ZINC000770436955	701277829	/nfs/dbraw/zinc/27/78/29/701277829.db2.gz	MTHADIMMKIXOEQ-GFCCVEGCSA-N	1	1	317.349	1.153	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cnn(C)n1	ZINC000806166993	701428439	/nfs/dbraw/zinc/42/84/39/701428439.db2.gz	FTPQVNRXFSHGIH-JTQLQIEISA-N	1	1	318.337	1.230	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@H](C(=O)N3CCCC3)C2)c(C)c1[N+](=O)[O-]	ZINC000808205400	701507510	/nfs/dbraw/zinc/50/75/10/701507510.db2.gz	DATVLOJZKCRZGX-ZDUSSCGKSA-N	1	1	321.381	1.310	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](C(=O)N3CCCC3)C2)c(C)c1[N+](=O)[O-]	ZINC000808205400	701507511	/nfs/dbraw/zinc/50/75/11/701507511.db2.gz	DATVLOJZKCRZGX-ZDUSSCGKSA-N	1	1	321.381	1.310	20	5		DDBDMO
Cc1ccccc1[C@@H]([C@H](C)NC(=O)[C@@H]1CC1[N+](=O)[O-])[NH+](C)C	ZINC000839761221	701814571	/nfs/dbraw/zinc/81/45/71/701814571.db2.gz	LYPMYJQNMIXRSA-ZGKBOVNRSA-N	1	1	305.378	1.768	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCC[C@@H]2OCC[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000867984089	701873976	/nfs/dbraw/zinc/87/39/76/701873976.db2.gz	MXSZJVMIYOBKFJ-DZKIICNBSA-N	1	1	319.361	1.549	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccnc(N(C)C)n1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815601376	701902710	/nfs/dbraw/zinc/90/27/10/701902710.db2.gz	URSXFYXKURKTRK-SNVBAGLBSA-N	1	1	316.365	1.884	20	5		DDBDMO
C[C@H]1C(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C[C@H]1C	ZINC000840058950	701944433	/nfs/dbraw/zinc/94/44/33/701944433.db2.gz	YINZDZRBVSSARF-VXGBXAGGSA-N	1	1	321.381	1.500	20	5		DDBDMO
CCOC(C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)OCC	ZINC000879271953	706636662	/nfs/dbraw/zinc/63/66/62/706636662.db2.gz	JOUQEZPFFDLPIM-OAHLLOKOSA-N	1	1	312.366	1.791	20	5		DDBDMO
Cc1ccc(CNC(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000868366318	702089739	/nfs/dbraw/zinc/08/97/39/702089739.db2.gz	PSDWMCDHNRBYRK-ZDUSSCGKSA-N	1	1	318.377	1.939	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879318738	706648181	/nfs/dbraw/zinc/64/81/81/706648181.db2.gz	ZXQJKCVZBWBBBP-JGGQBBKZSA-N	1	1	324.377	1.834	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000817377190	702363669	/nfs/dbraw/zinc/36/36/69/702363669.db2.gz	IXJUWDHISPJXKR-CQSZACIVSA-N	1	1	303.366	1.928	20	5		DDBDMO
O=C(O[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000842334521	702705259	/nfs/dbraw/zinc/70/52/59/702705259.db2.gz	YEYJABGMGGAVLZ-RBSFLKMASA-N	1	1	304.346	1.859	20	5		DDBDMO
O=C(O[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000842334521	702705261	/nfs/dbraw/zinc/70/52/61/702705261.db2.gz	YEYJABGMGGAVLZ-RBSFLKMASA-N	1	1	304.346	1.859	20	5		DDBDMO
O=C(O[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000842334521	702705262	/nfs/dbraw/zinc/70/52/62/702705262.db2.gz	YEYJABGMGGAVLZ-RBSFLKMASA-N	1	1	304.346	1.859	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CC[N@@H+](C)C1	ZINC000843990991	702949792	/nfs/dbraw/zinc/94/97/92/702949792.db2.gz	ZWOWRWHRKYCSDY-SNVBAGLBSA-N	1	1	324.356	1.872	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000879571286	706722073	/nfs/dbraw/zinc/72/20/73/706722073.db2.gz	OSLBIFPAFTZLEK-ZIAGYGMSSA-N	1	1	305.378	2.000	20	5		DDBDMO
CCON(C)C(=O)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000846064888	703233157	/nfs/dbraw/zinc/23/31/57/703233157.db2.gz	NHGMDOXDTRQMDB-UHFFFAOYSA-N	1	1	301.730	1.748	20	5		DDBDMO
CC1(C)OC[C@@H](CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)O1	ZINC000851908567	703881710	/nfs/dbraw/zinc/88/17/10/703881710.db2.gz	OTZHDCJVSTYLRS-CYBMUJFWSA-N	1	1	307.350	1.890	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852410507	704036628	/nfs/dbraw/zinc/03/66/28/704036628.db2.gz	CDPYSWPJECBZCH-CABCVRRESA-N	1	1	310.350	1.102	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCc3cn[nH]c3C2)cc1	ZINC000819154241	704077653	/nfs/dbraw/zinc/07/76/53/704077653.db2.gz	GCTPNVCFSNXMEI-SWLSCSKDSA-N	1	1	302.334	1.498	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CCC1(C)C	ZINC000871151220	704231310	/nfs/dbraw/zinc/23/13/10/704231310.db2.gz	YWZZXGJTSJUNBK-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853513386	704255635	/nfs/dbraw/zinc/25/56/35/704255635.db2.gz	ZFMHMJVKGIFFOX-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853513386	704255636	/nfs/dbraw/zinc/25/56/36/704255636.db2.gz	ZFMHMJVKGIFFOX-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
C[N@H+](C[C@H]1COCCO1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000853559931	704270285	/nfs/dbraw/zinc/27/02/85/704270285.db2.gz	QDGWPCKMCWBILX-ZDUSSCGKSA-N	1	1	306.322	1.249	20	5		DDBDMO
C[N@@H+](C[C@H]1COCCO1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000853559931	704270288	/nfs/dbraw/zinc/27/02/88/704270288.db2.gz	QDGWPCKMCWBILX-ZDUSSCGKSA-N	1	1	306.322	1.249	20	5		DDBDMO
O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CC[C@H]2C[C@H]2C1	ZINC000853575710	704273984	/nfs/dbraw/zinc/27/39/84/704273984.db2.gz	JHDLEIWPXHHOGR-MKBNYLNASA-N	1	1	317.345	1.831	20	5		DDBDMO
O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CC[C@H]2C[C@H]2C1	ZINC000853575710	704273986	/nfs/dbraw/zinc/27/39/86/704273986.db2.gz	JHDLEIWPXHHOGR-MKBNYLNASA-N	1	1	317.345	1.831	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H]3COC[C@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC000853587164	704276796	/nfs/dbraw/zinc/27/67/96/704276796.db2.gz	FZHUKHOJHPWXHH-NWDGAFQWSA-N	1	1	317.349	1.574	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC[C@H]2COC[C@H]2C1	ZINC000853587967	704277556	/nfs/dbraw/zinc/27/75/56/704277556.db2.gz	OZXYYWZDBUJWDI-WDEREUQCSA-N	1	1	319.317	1.429	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000853587967	704277557	/nfs/dbraw/zinc/27/75/57/704277557.db2.gz	OZXYYWZDBUJWDI-WDEREUQCSA-N	1	1	319.317	1.429	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000821328838	704391818	/nfs/dbraw/zinc/39/18/18/704391818.db2.gz	QBNURPYKKQVFIP-BETUJISGSA-N	1	1	307.325	1.644	20	5		DDBDMO
O=C1CC[C@@H](C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)O1	ZINC000821348758	704394831	/nfs/dbraw/zinc/39/48/31/704394831.db2.gz	QHLPSZHJAUYQKW-LBPRGKRZSA-N	1	1	305.334	1.422	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000855408679	704483120	/nfs/dbraw/zinc/48/31/20/704483120.db2.gz	XLUVLXSAPZJMHP-NEPJUHHUSA-N	1	1	301.387	1.047	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1CCNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000855408679	704483121	/nfs/dbraw/zinc/48/31/21/704483121.db2.gz	XLUVLXSAPZJMHP-NEPJUHHUSA-N	1	1	301.387	1.047	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000856073448	704512298	/nfs/dbraw/zinc/51/22/98/704512298.db2.gz	QACKRPOGOBSDBN-VIFPVBQESA-N	1	1	310.329	1.530	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[NH+](C[C@H]2CCCO2)CC1)[N+](=O)[O-]	ZINC000822218444	704894935	/nfs/dbraw/zinc/89/49/35/704894935.db2.gz	LIALSBBBJISPRA-CYBMUJFWSA-N	1	1	313.398	1.145	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c([N+](=O)[O-])c1	ZINC000860132177	705110185	/nfs/dbraw/zinc/11/01/85/705110185.db2.gz	WKTOVTAAUPWIMY-CUOATXAZSA-N	1	1	307.306	1.848	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@](C)(O)c1ccccc1	ZINC000823591362	705274922	/nfs/dbraw/zinc/27/49/22/705274922.db2.gz	KCFFYQAMIVCNTG-OAHLLOKOSA-N	1	1	304.350	1.631	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823970662	705347875	/nfs/dbraw/zinc/34/78/75/705347875.db2.gz	GTSFGJNGYMAYJE-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000823973426	705348391	/nfs/dbraw/zinc/34/83/91/705348391.db2.gz	HXDKATVXWYGRJV-NOZJJQNGSA-N	1	1	323.353	1.018	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000823973426	705348395	/nfs/dbraw/zinc/34/83/95/705348395.db2.gz	HXDKATVXWYGRJV-NOZJJQNGSA-N	1	1	323.353	1.018	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825970058	705752742	/nfs/dbraw/zinc/75/27/42/705752742.db2.gz	USNJYLOMLVRRAR-IUODEOHRSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000862793703	705799684	/nfs/dbraw/zinc/79/96/84/705799684.db2.gz	SKXUIDPQOBDMQZ-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826722479	705857789	/nfs/dbraw/zinc/85/77/89/705857789.db2.gz	QVTVHFREGAESHG-FZMZJTMJSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297890	705970509	/nfs/dbraw/zinc/97/05/09/705970509.db2.gz	HNVKQNOYTMYAAQ-MNOVXSKESA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297890	705970510	/nfs/dbraw/zinc/97/05/10/705970510.db2.gz	HNVKQNOYTMYAAQ-MNOVXSKESA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297890	705970512	/nfs/dbraw/zinc/97/05/12/705970512.db2.gz	HNVKQNOYTMYAAQ-MNOVXSKESA-N	1	1	321.381	1.608	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)c(N)c([N+](=O)[O-])c1	ZINC000827312338	705973317	/nfs/dbraw/zinc/97/33/17/705973317.db2.gz	UNMORWJSMQSIBG-DGCLKSJQSA-N	1	1	318.377	1.652	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1	ZINC000827358355	705984791	/nfs/dbraw/zinc/98/47/91/705984791.db2.gz	XRYPVLAMQDANTA-SMDDNHRTSA-N	1	1	304.350	1.464	20	5		DDBDMO
COC(=O)C1=NO[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000877715428	706186995	/nfs/dbraw/zinc/18/69/95/706186995.db2.gz	YTVXFFTZAHMPBG-HNNXBMFYSA-N	1	1	319.317	1.489	20	5		DDBDMO
COC(=O)C1=NO[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000877715428	706186999	/nfs/dbraw/zinc/18/69/99/706186999.db2.gz	YTVXFFTZAHMPBG-HNNXBMFYSA-N	1	1	319.317	1.489	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000880309910	706937098	/nfs/dbraw/zinc/93/70/98/706937098.db2.gz	LTJQMAWATPNLNR-OKILXGFUSA-N	1	1	319.361	1.384	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430913	706973048	/nfs/dbraw/zinc/97/30/48/706973048.db2.gz	XJLQPXNPKBBGEA-UONOGXRCSA-N	1	1	323.349	1.269	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430913	706973050	/nfs/dbraw/zinc/97/30/50/706973050.db2.gz	XJLQPXNPKBBGEA-UONOGXRCSA-N	1	1	323.349	1.269	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCOC[C@@H]1OC	ZINC000880436984	706975721	/nfs/dbraw/zinc/97/57/21/706975721.db2.gz	DWCBGRPFGQCERA-HIFRSBDPSA-N	1	1	310.350	1.839	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])[C@@H]12	ZINC000880528601	707005330	/nfs/dbraw/zinc/00/53/30/707005330.db2.gz	FMNQXOKFKALGIU-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCOc3ccccc3[N+](=O)[O-])[C@@H]12	ZINC000880528601	707005331	/nfs/dbraw/zinc/00/53/31/707005331.db2.gz	FMNQXOKFKALGIU-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1CC2(CCOCC2)[N@H+](Cc2ccccc2[N+](=O)[O-])CCN1	ZINC000872285554	707365521	/nfs/dbraw/zinc/36/55/21/707365521.db2.gz	WSHLRFVTCBFHDE-UHFFFAOYSA-N	1	1	319.361	1.466	20	5		DDBDMO
O=C1CC2(CCOCC2)[N@@H+](Cc2ccccc2[N+](=O)[O-])CCN1	ZINC000872285554	707365524	/nfs/dbraw/zinc/36/55/24/707365524.db2.gz	WSHLRFVTCBFHDE-UHFFFAOYSA-N	1	1	319.361	1.466	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000837187648	707593585	/nfs/dbraw/zinc/59/35/85/707593585.db2.gz	AWXNEKKIGZBJAS-CABCVRRESA-N	1	1	321.377	1.569	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000885855390	708640281	/nfs/dbraw/zinc/64/02/81/708640281.db2.gz	PWCJXTYBNKSKCW-OAHLLOKOSA-N	1	1	319.361	1.578	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cc3cccnc3[N+](=O)[O-])C[C@H]1COCC2	ZINC000886184217	708711578	/nfs/dbraw/zinc/71/15/78/708711578.db2.gz	WPWQHORYQKWNJU-SWLSCSKDSA-N	1	1	321.333	1.001	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000910269081	709853539	/nfs/dbraw/zinc/85/35/39/709853539.db2.gz	DSOGJLVYQBLFKU-WFASDCNBSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000893266691	710583125	/nfs/dbraw/zinc/58/31/25/710583125.db2.gz	SQKMOQGANXGWNB-ZFWWWQNUSA-N	1	1	318.377	1.483	20	5		DDBDMO
COc1cc(OCC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000928442801	713197779	/nfs/dbraw/zinc/19/77/79/713197779.db2.gz	CFFOFIPZLTVHGL-JQWIXIFHSA-N	1	1	323.349	1.191	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC([N@@H+](C)Cc2ccccc2)C1	ZINC000893827032	710845464	/nfs/dbraw/zinc/84/54/64/710845464.db2.gz	GUTXKGRRCYAIAF-UHFFFAOYSA-N	1	1	301.350	1.649	20	5		DDBDMO
C[C@@H](NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccccc1[N+](=O)[O-]	ZINC000894016736	710929179	/nfs/dbraw/zinc/92/91/79/710929179.db2.gz	VJJCUPAFSPLQEB-UPJWGTAASA-N	1	1	318.377	1.859	20	5		DDBDMO
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@@H+]1C	ZINC000928569791	713233131	/nfs/dbraw/zinc/23/31/31/713233131.db2.gz	RGLXLMCQQFYNDL-JQWIXIFHSA-N	1	1	309.391	1.896	20	5		DDBDMO
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@H+]1C	ZINC000928569791	713233132	/nfs/dbraw/zinc/23/31/32/713233132.db2.gz	RGLXLMCQQFYNDL-JQWIXIFHSA-N	1	1	309.391	1.896	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000896579334	711757787	/nfs/dbraw/zinc/75/77/87/711757787.db2.gz	FQBXIXPPYJPYNC-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
CON1CC[C@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000930636367	713883654	/nfs/dbraw/zinc/88/36/54/713883654.db2.gz	GAKYIBRVBFDQKW-ZFWWWQNUSA-N	1	1	319.361	1.937	20	5		DDBDMO
O=C(CCc1cc(F)ccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000930927227	713961882	/nfs/dbraw/zinc/96/18/82/713961882.db2.gz	AWACQQHIEBWICK-UHFFFAOYSA-N	1	1	321.352	1.973	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931434445	714096941	/nfs/dbraw/zinc/09/69/41/714096941.db2.gz	VDUGBQNBIFAHTD-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931434445	714096943	/nfs/dbraw/zinc/09/69/43/714096943.db2.gz	VDUGBQNBIFAHTD-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
COC1(OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000931640968	714147075	/nfs/dbraw/zinc/14/70/75/714147075.db2.gz	UBUBFYYPTRPYKJ-AWEZNQCLSA-N	1	1	310.350	1.459	20	5		DDBDMO
CN(C[C@H]1CCCC[N@@H+]1CC[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000931692772	714162554	/nfs/dbraw/zinc/16/25/54/714162554.db2.gz	YVQYWGJEVUSWDA-GFCCVEGCSA-N	1	1	301.387	1.985	20	5		DDBDMO
CN(C[C@H]1CCCC[N@H+]1CC[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000931692772	714162555	/nfs/dbraw/zinc/16/25/55/714162555.db2.gz	YVQYWGJEVUSWDA-GFCCVEGCSA-N	1	1	301.387	1.985	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000932104363	714259516	/nfs/dbraw/zinc/25/95/16/714259516.db2.gz	FIOUHMBSJVCHDD-KYOSRNDESA-N	1	1	322.361	1.759	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C	ZINC000933645207	714637934	/nfs/dbraw/zinc/63/79/34/714637934.db2.gz	LAAYCFYVUPHWDU-YHWZYXNKSA-N	1	1	321.381	1.231	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2C2OCCO2)c1	ZINC000933910132	714699842	/nfs/dbraw/zinc/69/98/42/714699842.db2.gz	SFYMNDXFLNDUHJ-AWEZNQCLSA-N	1	1	308.334	1.811	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CC[N@H+]1C	ZINC000925333469	714815173	/nfs/dbraw/zinc/81/51/73/714815173.db2.gz	FCMYAZQJCBSDHA-RISCZKNCSA-N	1	1	318.377	1.755	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CC1CC1)CC2	ZINC000957547765	715950547	/nfs/dbraw/zinc/95/05/47/715950547.db2.gz	PPKBDJNAOXTLDX-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3CC4(CCC4)C3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025777422	736850108	/nfs/dbraw/zinc/85/01/08/736850108.db2.gz	MBXPEEHRAITPIT-QMIVOQANSA-N	1	1	319.405	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CC3CC4(CCC4)C3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025777422	736850112	/nfs/dbraw/zinc/85/01/12/736850112.db2.gz	MBXPEEHRAITPIT-QMIVOQANSA-N	1	1	319.405	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3CC4(CCC4)C3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025777422	736850113	/nfs/dbraw/zinc/85/01/13/736850113.db2.gz	MBXPEEHRAITPIT-QMIVOQANSA-N	1	1	319.405	1.278	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022061419	734366699	/nfs/dbraw/zinc/36/66/99/734366699.db2.gz	HKLQBTXXVQEVDK-XJFOESAGSA-N	1	1	307.325	1.228	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)n1	ZINC001022063683	734368254	/nfs/dbraw/zinc/36/82/54/734368254.db2.gz	GUUUSHOZWNXCFO-LXTVHRRPSA-N	1	1	318.377	1.100	20	5		DDBDMO
O=C(NCC[NH2+]CCOC1CCCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126939468	742881443	/nfs/dbraw/zinc/88/14/43/742881443.db2.gz	ZXJSLKQWISYAAP-ZIAGYGMSSA-N	1	1	313.398	1.097	20	5		DDBDMO
O=C(NCC1C[NH+](CCCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031660548	747335205	/nfs/dbraw/zinc/33/52/05/747335205.db2.gz	KOTRZVPHVUDLIW-HZPDHXFCSA-N	1	1	317.389	1.332	20	5		DDBDMO
COc1ccccc1C1([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)COC1	ZINC001168994066	762167557	/nfs/dbraw/zinc/16/75/57/762167557.db2.gz	OLFLAOADKUUQCA-QWHCGFSZSA-N	1	1	306.362	1.956	20	5		DDBDMO
O=C(c1ccco1)N1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169007154	762174538	/nfs/dbraw/zinc/17/45/38/762174538.db2.gz	LOHCKSDVOTZOBN-OLZOCXBDSA-N	1	1	307.350	1.483	20	5		DDBDMO
C[N@@H+](CCNC(=O)OC(C)(C)C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169006726	762174685	/nfs/dbraw/zinc/17/46/85/762174685.db2.gz	JFUJKXQMEJKKLJ-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045527	762186533	/nfs/dbraw/zinc/18/65/33/762186533.db2.gz	JKJJQMCRXRNLCL-DOMZBBRYSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045527	762186537	/nfs/dbraw/zinc/18/65/37/762186537.db2.gz	JKJJQMCRXRNLCL-DOMZBBRYSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCOC[C@H]1Cn2nccc2C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169025783	762203332	/nfs/dbraw/zinc/20/33/32/762203332.db2.gz	UWQQZUWGWUMIDE-RRFJBIMHSA-N	1	1	322.409	1.797	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000823785270	758363242	/nfs/dbraw/zinc/36/32/42/758363242.db2.gz	ZZQIEMZNCHWRON-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(F)(F)c2cc([N+](=O)[O-])cnc2Cl)C1	ZINC001156580484	763336101	/nfs/dbraw/zinc/33/61/01/763336101.db2.gz	LHRKDJBKZPEGTC-ZETCQYMHSA-N	1	1	306.700	1.986	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCCNc1ccc([N+](=O)[O-])cn1	ZINC001109520290	763778572	/nfs/dbraw/zinc/77/85/72/763778572.db2.gz	CTJZIONPWYVNAF-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
CCNC(=O)C[N@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170329586	766255090	/nfs/dbraw/zinc/25/50/90/766255090.db2.gz	RWODCHDXYWDLON-LLVKDONJSA-N	1	1	309.366	1.602	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170329586	766255091	/nfs/dbraw/zinc/25/50/91/766255091.db2.gz	RWODCHDXYWDLON-LLVKDONJSA-N	1	1	309.366	1.602	20	5		DDBDMO
COCC(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048630706	769593849	/nfs/dbraw/zinc/59/38/49/769593849.db2.gz	OSVYYKVXARNWRA-OKILXGFUSA-N	1	1	319.361	1.131	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ccc([N+](=O)[O-])cn1	ZINC001093770805	775066784	/nfs/dbraw/zinc/06/67/84/775066784.db2.gz	ISHPIRLNHYHBRX-UHFFFAOYSA-N	1	1	309.370	1.250	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001100149201	775734668	/nfs/dbraw/zinc/73/46/68/775734668.db2.gz	AMTHMEOYMYBGRR-UHFFFAOYSA-N	1	1	308.382	1.487	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ccc([N+](=O)[O-])cc1	ZINC001094517315	775974222	/nfs/dbraw/zinc/97/42/22/775974222.db2.gz	LTDDBXHWKZQHQN-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094667022	776147811	/nfs/dbraw/zinc/14/78/11/776147811.db2.gz	CLRAQJKZTOYUGJ-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094667191	776149863	/nfs/dbraw/zinc/14/98/63/776149863.db2.gz	INNXKVIXWZYDQW-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCOC[C@H](O)C1)CC2	ZINC001172903900	776917229	/nfs/dbraw/zinc/91/72/29/776917229.db2.gz	JKBXUHKTIIBVFR-GOEBONIOSA-N	1	1	306.362	1.535	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCN1CCN(C)CC1	ZINC001173211128	777067078	/nfs/dbraw/zinc/06/70/78/777067078.db2.gz	PQPBNUFXAINJFH-CQSZACIVSA-N	1	1	306.410	1.363	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cnns1)Cc1ccccc1[N+](=O)[O-]	ZINC001267186953	837495695	/nfs/dbraw/zinc/49/56/95/837495695.db2.gz	KXAXHTKTDALPCN-UHFFFAOYSA-N	1	1	321.362	1.308	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cnns1)Cc1ccccc1[N+](=O)[O-]	ZINC001267186953	837495698	/nfs/dbraw/zinc/49/56/98/837495698.db2.gz	KXAXHTKTDALPCN-UHFFFAOYSA-N	1	1	321.362	1.308	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]n1	ZINC001266260142	835999380	/nfs/dbraw/zinc/99/93/80/835999380.db2.gz	LKJQDKWSLMWXTF-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]n1	ZINC001266260142	835999393	/nfs/dbraw/zinc/99/93/93/835999393.db2.gz	LKJQDKWSLMWXTF-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C[NH+](C)C)on1	ZINC001327169283	861941939	/nfs/dbraw/zinc/94/19/39/861941939.db2.gz	YBZUJEAXHCVOTK-UHFFFAOYSA-N	1	1	319.321	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@@H]3CCC[NH2+]C3)C2)nc1	ZINC001327863865	862524772	/nfs/dbraw/zinc/52/47/72/862524772.db2.gz	JVPRZNIRYYQNEO-CHWSQXEVSA-N	1	1	305.382	1.476	20	5		DDBDMO
C[C@H]1CN(C)C(=O)CN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001156191235	862795989	/nfs/dbraw/zinc/79/59/89/862795989.db2.gz	VRJFPSSPWGSNMI-QRGHLMKCSA-N	1	1	319.365	1.189	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)n1	ZINC001157282395	863709608	/nfs/dbraw/zinc/70/96/08/863709608.db2.gz	NBWPIYZLELCEHC-GWCFXTLKSA-N	1	1	320.349	1.307	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3csnn3)CC2)cn1	ZINC001331743138	865291381	/nfs/dbraw/zinc/29/13/81/865291381.db2.gz	JRWKBERHVHZTLB-UHFFFAOYSA-N	1	1	320.378	1.600	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ncc(C)cc2[N+](=O)[O-])CC[NH2+]C1	ZINC001159453109	865309812	/nfs/dbraw/zinc/30/98/12/865309812.db2.gz	OUNYIKORPXINJI-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H]1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001161042339	866310388	/nfs/dbraw/zinc/31/03/88/866310388.db2.gz	MHTHJFACDMPZMD-RUULKOMLSA-N	1	1	320.349	1.743	20	5		DDBDMO
C[NH+](C)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC001320786415	867025414	/nfs/dbraw/zinc/02/54/14/867025414.db2.gz	ONEBDZLCOODHQS-UONOGXRCSA-N	1	1	307.350	1.903	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2cc(C(C)=O)ccc2[N+](=O)[O-])C1	ZINC001225805904	882041071	/nfs/dbraw/zinc/04/10/71/882041071.db2.gz	NPOGLOXAOUQREJ-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(C(C)=O)ccc2[N+](=O)[O-])C1	ZINC001225805904	882041092	/nfs/dbraw/zinc/04/10/92/882041092.db2.gz	NPOGLOXAOUQREJ-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
Cc1cnc(N2CC([C@H]([NH3+])C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC001163117556	868115628	/nfs/dbraw/zinc/11/56/28/868115628.db2.gz	JXSFACOFHUVIHF-LBPRGKRZSA-N	1	1	322.365	1.403	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC([C@H]([NH3+])C(=O)OC(C)(C)C)C1	ZINC001163118522	868117907	/nfs/dbraw/zinc/11/79/07/868117907.db2.gz	ZECRVQXCRJWVBO-LBPRGKRZSA-N	1	1	322.365	1.403	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2C[C@@H](F)C[C@H](CO)C2)ncc1[N+](=O)[O-]	ZINC001164050488	868913501	/nfs/dbraw/zinc/91/35/01/868913501.db2.gz	NQMPFZPBEYOJJB-JXSWWZISSA-N	1	1	324.356	1.679	20	5		DDBDMO
COC(=O)/C=C\c1ccc(NCC[N@@H+](C)CCO)c([N+](=O)[O-])c1	ZINC001164120552	868952180	/nfs/dbraw/zinc/95/21/80/868952180.db2.gz	WVBPIMCMSALUMB-XQRVVYSFSA-N	1	1	323.349	1.117	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC([NH2+]C3COC3)C2)cccc1C(F)(F)F	ZINC001164220370	869030992	/nfs/dbraw/zinc/03/09/92/869030992.db2.gz	HMCSYCDWPGAKGG-UHFFFAOYSA-N	1	1	317.267	1.791	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ncc1NCC[C@H]1CCC[N@@H+](C)C1	ZINC001165300481	869506100	/nfs/dbraw/zinc/50/61/00/869506100.db2.gz	PFMDDDAYBUGUDM-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N1CCC[N@H+](C2CCCC2)CC1	ZINC001340112417	870896595	/nfs/dbraw/zinc/89/65/95/870896595.db2.gz	GCWBXVDUAGLVMZ-UHFFFAOYSA-N	1	1	322.413	1.529	20	5		DDBDMO
COc1cc(C[NH2+]Cc2ccc[nH]c2=O)c([N+](=O)[O-])cc1O	ZINC001308482083	871500716	/nfs/dbraw/zinc/50/07/16/871500716.db2.gz	GEQZERSUEYLCPS-UHFFFAOYSA-N	1	1	305.290	1.699	20	5		DDBDMO
Cc1ccc(CC[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC001316823113	872116684	/nfs/dbraw/zinc/11/66/84/872116684.db2.gz	CKSQSFJORDRVLQ-HZPDHXFCSA-N	1	1	319.405	1.641	20	5		DDBDMO
Cc1ccc(CC[N@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001316823113	872116689	/nfs/dbraw/zinc/11/66/89/872116689.db2.gz	CKSQSFJORDRVLQ-HZPDHXFCSA-N	1	1	319.405	1.641	20	5		DDBDMO
Cc1ccc(CC[N@@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001316823113	872116694	/nfs/dbraw/zinc/11/66/94/872116694.db2.gz	CKSQSFJORDRVLQ-HZPDHXFCSA-N	1	1	319.405	1.641	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891820	874300965	/nfs/dbraw/zinc/30/09/65/874300965.db2.gz	VNQDRCAGKMQEMJ-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891820	874300978	/nfs/dbraw/zinc/30/09/78/874300978.db2.gz	VNQDRCAGKMQEMJ-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1C2CCC1(CO)CC2	ZINC001351632187	876358067	/nfs/dbraw/zinc/35/80/67/876358067.db2.gz	KPCHCXNJWGZCSH-MFOWVQHXSA-N	1	1	322.361	1.324	20	5		DDBDMO
O=C(NCCCCC[NH+]1CCNCC1)c1ccc([N+](=O)[O-])cc1	ZINC001358213831	880368863	/nfs/dbraw/zinc/36/88/63/880368863.db2.gz	UTGRLIFVFFZZTR-UHFFFAOYSA-N	1	1	320.393	1.400	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCc2cccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC001223664361	881049356	/nfs/dbraw/zinc/04/93/56/881049356.db2.gz	HWHMBDNBECDDOJ-GFCCVEGCSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3ccnc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228056975	883310387	/nfs/dbraw/zinc/31/03/87/883310387.db2.gz	JZUFWFXDTJHNLT-JVUFJMBOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ccnc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228056975	883310405	/nfs/dbraw/zinc/31/04/05/883310405.db2.gz	JZUFWFXDTJHNLT-JVUFJMBOSA-N	1	1	311.725	1.826	20	5		DDBDMO
Cc1ccc2c(c1)nc(=O)[nH]c2OC(=O)C[C@@H](O)C[N+](C)(C)C	ZINC001230888649	885012496	/nfs/dbraw/zinc/01/24/96/885012496.db2.gz	ORAHIXWFHSYTGO-LLVKDONJSA-O	1	1	320.369	1.006	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC([N@@H+](C)[C@@H]2CCOC2)C1	ZINC001254560872	896502602	/nfs/dbraw/zinc/50/26/02/896502602.db2.gz	YRCBPKGSOPROFU-UKRRQHHQSA-N	1	1	319.405	1.931	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(C3COC3)CC1)C2	ZINC001254599209	896524490	/nfs/dbraw/zinc/52/44/90/896524490.db2.gz	MFARSYOPCKFBKI-HNNXBMFYSA-N	1	1	303.362	1.078	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[NH+](CCC2CCCCC2)CC1	ZINC001261281665	899449332	/nfs/dbraw/zinc/44/93/32/899449332.db2.gz	HCEVQGANLDVRKS-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)CN1	ZINC000278760991	214383194	/nfs/dbraw/zinc/38/31/94/214383194.db2.gz	BNOGNRNNMGBMGG-OAHLLOKOSA-N	1	1	305.334	1.186	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@H](O)C1	ZINC000452064915	231287729	/nfs/dbraw/zinc/28/77/29/231287729.db2.gz	GVJCZNSNDVTOCR-FZMZJTMJSA-N	1	1	321.377	1.935	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000286603610	219076993	/nfs/dbraw/zinc/07/69/93/219076993.db2.gz	WSOYJRHYSVGXPD-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000255526984	282263605	/nfs/dbraw/zinc/26/36/05/282263605.db2.gz	LVEFHICVUXKXLC-HJWRWDBZSA-N	1	1	321.377	1.693	20	5		DDBDMO
CC1(C)[C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000563821263	303976277	/nfs/dbraw/zinc/97/62/77/303976277.db2.gz	QBJIKQSUAFPMTP-NEPJUHHUSA-N	1	1	318.333	1.894	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301962657	529931849	/nfs/dbraw/zinc/93/18/49/529931849.db2.gz	ISAIONUFMVYBHA-GFCCVEGCSA-N	1	1	318.381	1.948	20	5		DDBDMO
C[C@@H]1[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851888	232112584	/nfs/dbraw/zinc/11/25/84/232112584.db2.gz	QGAUUEZTJRLKKA-STQMWFEESA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851888	232112587	/nfs/dbraw/zinc/11/25/87/232112587.db2.gz	QGAUUEZTJRLKKA-STQMWFEESA-N	1	1	324.377	1.834	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000277567936	213623319	/nfs/dbraw/zinc/62/33/19/213623319.db2.gz	KWUKJXAVIGEOEJ-QWRGUYRKSA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279881940	215202719	/nfs/dbraw/zinc/20/27/19/215202719.db2.gz	UKMUDVIRCKRWFG-CQSZACIVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CC=CCC2)c(N)c([N+](=O)[O-])c1	ZINC000279924993	215241825	/nfs/dbraw/zinc/24/18/25/215241825.db2.gz	GLWMUGKEUSCYMD-UHFFFAOYSA-N	1	1	304.350	1.477	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)N1CC(C[NH+]2CCOCC2)C1	ZINC000601226556	358455558	/nfs/dbraw/zinc/45/55/58/358455558.db2.gz	UOTKLDGBQDTIJX-UHFFFAOYSA-N	1	1	320.349	1.391	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000287096630	219310299	/nfs/dbraw/zinc/31/02/99/219310299.db2.gz	YZSKYRPDTZJVRU-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000287096630	219310301	/nfs/dbraw/zinc/31/03/01/219310301.db2.gz	YZSKYRPDTZJVRU-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CN(C)CC(C)(C)[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000459548624	233303705	/nfs/dbraw/zinc/30/37/05/233303705.db2.gz	MIBMGYWEDCNPRN-UHFFFAOYSA-N	1	1	308.382	1.487	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000617285156	363037347	/nfs/dbraw/zinc/03/73/47/363037347.db2.gz	CTDNZDZQJPMGQV-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000617285156	363037352	/nfs/dbraw/zinc/03/73/52/363037352.db2.gz	CTDNZDZQJPMGQV-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)n1	ZINC000331725256	234048963	/nfs/dbraw/zinc/04/89/63/234048963.db2.gz	MPZRHBFUMSRBSC-WDEREUQCSA-N	1	1	307.354	1.168	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000046861370	352465886	/nfs/dbraw/zinc/46/58/86/352465886.db2.gz	YPGYNEMXOCGEEF-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000052101700	352599681	/nfs/dbraw/zinc/59/96/81/352599681.db2.gz	KIHBIMCPHWAUKI-DZGCQCFKSA-N	1	1	310.350	1.445	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000052590861	352619614	/nfs/dbraw/zinc/61/96/14/352619614.db2.gz	KHUMVAZXWPCPKL-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCCC[C@H]1C	ZINC000055362620	352730379	/nfs/dbraw/zinc/73/03/79/352730379.db2.gz	HYFYOIFIFATVMS-NEPJUHHUSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000064570587	352940804	/nfs/dbraw/zinc/94/08/04/352940804.db2.gz	YRVJASZLBIUCEJ-UHFFFAOYSA-N	1	1	324.333	1.846	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CNC(C)=O)C1	ZINC000067417873	353048670	/nfs/dbraw/zinc/04/86/70/353048670.db2.gz	SGCSLPFVPPIVAA-ZDUSSCGKSA-N	1	1	321.377	1.952	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CNC(C)=O)C1	ZINC000067417873	353048674	/nfs/dbraw/zinc/04/86/74/353048674.db2.gz	SGCSLPFVPPIVAA-ZDUSSCGKSA-N	1	1	321.377	1.952	20	5		DDBDMO
Cc1cc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)nc(C)[nH+]1	ZINC000069193072	353150203	/nfs/dbraw/zinc/15/02/03/353150203.db2.gz	ZPVVDKMSGJLMFW-UHFFFAOYSA-N	1	1	314.349	1.723	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCOC3(CCCCC3)C2)c1	ZINC000075832659	353381175	/nfs/dbraw/zinc/38/11/75/353381175.db2.gz	BCBFAKCRJOUUJT-AWEZNQCLSA-N	1	1	324.381	1.187	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@]3(CCCOC3)C2)c1	ZINC000355776143	291003595	/nfs/dbraw/zinc/00/35/95/291003595.db2.gz	BBSUGMQCQXLIPY-LSDHHAIUSA-N	1	1	324.381	1.045	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC[C@H]2c2ccccc2F)c1	ZINC000081626458	353685018	/nfs/dbraw/zinc/68/50/18/353685018.db2.gz	VBTOGBUXQVWPTJ-WFASDCNBSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H]2c2ccccc2F)c1	ZINC000081626458	353685019	/nfs/dbraw/zinc/68/50/19/353685019.db2.gz	VBTOGBUXQVWPTJ-WFASDCNBSA-N	1	1	320.324	1.738	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000108304199	353949212	/nfs/dbraw/zinc/94/92/12/353949212.db2.gz	LFXWHYDQUMZZSJ-CYBMUJFWSA-N	1	1	319.361	1.818	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[N@@H+](C)C[C@H]21	ZINC000277039155	213257147	/nfs/dbraw/zinc/25/71/47/213257147.db2.gz	HBIMQNHJZWFVRB-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000281125842	354425808	/nfs/dbraw/zinc/42/58/08/354425808.db2.gz	OAKVACLIVUTCRL-INIZCTEOSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@@H](O)C[N@H+](C)Cc1ccccc1	ZINC000305356028	354470007	/nfs/dbraw/zinc/47/00/07/354470007.db2.gz	XQCPFLCLCZDWQV-AWEZNQCLSA-N	1	1	304.350	1.593	20	5		DDBDMO
CN(CC(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21)c1ccccc1[N+](=O)[O-]	ZINC000590046409	355043932	/nfs/dbraw/zinc/04/39/32/355043932.db2.gz	CKRSECMEWLYSPC-IUODEOHRSA-N	1	1	318.377	1.194	20	5		DDBDMO
Cc1cc(C(=O)N2CC(C[NH+]3CCOCC3)C2)cc([N+](=O)[O-])c1	ZINC000590557541	355113149	/nfs/dbraw/zinc/11/31/49/355113149.db2.gz	DFVGIVDPUKIDJD-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000590442696	355096317	/nfs/dbraw/zinc/09/63/17/355096317.db2.gz	ACHHCXYGGZBWPW-YPMHNXCESA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590446544	355099089	/nfs/dbraw/zinc/09/90/89/355099089.db2.gz	UJAAVCQKXDYSIK-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)C[C@@H]21	ZINC000590872558	355202512	/nfs/dbraw/zinc/20/25/12/355202512.db2.gz	HUNPVHDUHMJCDV-SKDRFNHKSA-N	1	1	319.317	1.100	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000248683297	283094534	/nfs/dbraw/zinc/09/45/34/283094534.db2.gz	XTDHZEGWSRCGDX-QWHCGFSZSA-N	1	1	318.377	1.614	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2C2CCC2)c1	ZINC000592198751	355534387	/nfs/dbraw/zinc/53/43/87/355534387.db2.gz	RUQZTPIGHVQUAO-GJZGRUSLSA-N	1	1	308.382	1.807	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H](O)C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532026	355617184	/nfs/dbraw/zinc/61/71/84/355617184.db2.gz	LYUNHNXBZMUJMA-QWHCGFSZSA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H](O)C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532026	355617188	/nfs/dbraw/zinc/61/71/88/355617188.db2.gz	LYUNHNXBZMUJMA-QWHCGFSZSA-N	1	1	308.334	1.259	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000593064587	355784394	/nfs/dbraw/zinc/78/43/94/355784394.db2.gz	REPBQTHQZQZQRY-NWDGAFQWSA-N	1	1	300.742	1.830	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000593064587	355784400	/nfs/dbraw/zinc/78/44/00/355784400.db2.gz	REPBQTHQZQZQRY-NWDGAFQWSA-N	1	1	300.742	1.830	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)CCO	ZINC000593107072	355799812	/nfs/dbraw/zinc/79/98/12/355799812.db2.gz	GILDHKCGXAPKOF-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)C1	ZINC000593161974	355815516	/nfs/dbraw/zinc/81/55/16/355815516.db2.gz	FUUCGSMJOISTBE-INIZCTEOSA-N	1	1	321.352	1.831	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000593186969	355819986	/nfs/dbraw/zinc/81/99/86/355819986.db2.gz	BMIJCOFGDXPBLU-XQQFMLRXSA-N	1	1	321.377	1.913	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000593969919	356076041	/nfs/dbraw/zinc/07/60/41/356076041.db2.gz	GNYIHCASRJFJJM-CHWSQXEVSA-N	1	1	311.382	1.185	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594417366	356202943	/nfs/dbraw/zinc/20/29/43/356202943.db2.gz	BZDBOQOBFZCBPD-WDEREUQCSA-N	1	1	307.354	1.075	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594418444	356203879	/nfs/dbraw/zinc/20/38/79/356203879.db2.gz	JBAFFCZSRDJNJH-GHMZBOCLSA-N	1	1	307.354	1.373	20	5		DDBDMO
Cc1noc(C[NH2+]C2(CO)Cc3ccccc3C2)c1[N+](=O)[O-]	ZINC000595324887	356450496	/nfs/dbraw/zinc/45/04/96/356450496.db2.gz	SBQUEZWAHSWZAJ-UHFFFAOYSA-N	1	1	303.318	1.511	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@]3(O)C[C@H]3C2)c1	ZINC000595757611	356639596	/nfs/dbraw/zinc/63/95/96/356639596.db2.gz	NWKSDDRXPRIXRJ-SWLSCSKDSA-N	1	1	306.318	1.338	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@]3(O)C[C@H]3C2)c1	ZINC000595757611	356639598	/nfs/dbraw/zinc/63/95/98/356639598.db2.gz	NWKSDDRXPRIXRJ-SWLSCSKDSA-N	1	1	306.318	1.338	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC(C3CC3)(C3CC3)C2)n1	ZINC000595822387	356664167	/nfs/dbraw/zinc/66/41/67/356664167.db2.gz	SKNDCCQXSGCNRI-UHFFFAOYSA-N	1	1	306.366	1.682	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595880768	356689088	/nfs/dbraw/zinc/68/90/88/356689088.db2.gz	ZBVMGICFWAKHGC-HWWQOWPSSA-N	1	1	321.377	1.872	20	5		DDBDMO
CCn1nccc1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000596063160	356757627	/nfs/dbraw/zinc/75/76/27/356757627.db2.gz	YXZAWJMXJSGYMT-UHFFFAOYSA-N	1	1	318.333	1.872	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CCc3c[nH+]cn3C2)ccc1[N+](=O)[O-]	ZINC000596229454	356824821	/nfs/dbraw/zinc/82/48/21/356824821.db2.gz	BZWXAXIDTACLLW-JTQLQIEISA-N	1	1	301.306	1.317	20	5		DDBDMO
C[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CC[N@H+](C2CCC2)C1	ZINC000596241230	356829673	/nfs/dbraw/zinc/82/96/73/356829673.db2.gz	PQDBRYFSUFYABK-NSHDSACASA-N	1	1	305.382	1.883	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@@H](C)C[N@H+](C)CCCN(C)C	ZINC000596364610	356864515	/nfs/dbraw/zinc/86/45/15/356864515.db2.gz	PPQMUSGNWYLHDV-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@@H](C)C[N@@H+](C)CCCN(C)C	ZINC000596364610	356864518	/nfs/dbraw/zinc/86/45/18/356864518.db2.gz	PPQMUSGNWYLHDV-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
CCN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000596817663	356985134	/nfs/dbraw/zinc/98/51/34/356985134.db2.gz	PUYAZPDOGKZDOP-LLVKDONJSA-N	1	1	307.354	1.360	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)n1	ZINC000597860242	357362160	/nfs/dbraw/zinc/36/21/60/357362160.db2.gz	MLQOYVBJABVMFX-SNVBAGLBSA-N	1	1	309.370	1.414	20	5		DDBDMO
CCN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@H]1CC[N@@H+](C)C1	ZINC000597943877	357392127	/nfs/dbraw/zinc/39/21/27/357392127.db2.gz	ADFGMJKDGUNYRA-NSHDSACASA-N	1	1	321.333	1.490	20	5		DDBDMO
CCN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@@H]1CC[N@@H+](C)C1	ZINC000597943876	357393113	/nfs/dbraw/zinc/39/31/13/357393113.db2.gz	ADFGMJKDGUNYRA-LLVKDONJSA-N	1	1	321.333	1.490	20	5		DDBDMO
CCN(C(=O)c1nn(CC)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000598041415	357439265	/nfs/dbraw/zinc/43/92/65/357439265.db2.gz	UIMPTOBMYCURHW-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H](C)C[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000598626726	357661330	/nfs/dbraw/zinc/66/13/30/357661330.db2.gz	HHNRPKVIMDXJDY-SNVBAGLBSA-N	1	1	310.354	1.917	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000599937116	358085211	/nfs/dbraw/zinc/08/52/11/358085211.db2.gz	DTRFOQPGDIQBCH-TZMCWYRMSA-N	1	1	323.324	1.015	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH+](CCCF)CC1	ZINC000600076978	358117152	/nfs/dbraw/zinc/11/71/52/358117152.db2.gz	SLGALQRTGPDMHA-UHFFFAOYSA-N	1	1	309.341	1.641	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000600472386	358233639	/nfs/dbraw/zinc/23/36/39/358233639.db2.gz	XCNQZXWURXOHOL-GFCCVEGCSA-N	1	1	320.349	1.442	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000601009628	358380905	/nfs/dbraw/zinc/38/09/05/358380905.db2.gz	BIMZDNSWFNDNHD-LSDHHAIUSA-N	1	1	305.378	1.984	20	5		DDBDMO
CCCNC(=O)CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601105609	358404694	/nfs/dbraw/zinc/40/46/94/358404694.db2.gz	DVLQJRCLPPTRPL-UHFFFAOYSA-N	1	1	302.334	1.893	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000358914486	299279451	/nfs/dbraw/zinc/27/94/51/299279451.db2.gz	JIPASOZBPDUOSD-NSHDSACASA-N	1	1	311.386	1.013	20	5		DDBDMO
CC[N@H+]1CCCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1	ZINC000601116120	358409562	/nfs/dbraw/zinc/40/95/62/358409562.db2.gz	ONPHZBSZEDOECA-UHFFFAOYSA-N	1	1	321.303	1.879	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(CO)(CO)C3)c2c1	ZINC000601198247	358443957	/nfs/dbraw/zinc/44/39/57/358443957.db2.gz	SPCQBJFVBVOVJQ-UHFFFAOYSA-N	1	1	303.318	1.324	20	5		DDBDMO
C[C@H](CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)c1nncn1C	ZINC000601153972	358424089	/nfs/dbraw/zinc/42/40/89/358424089.db2.gz	VXBWCRRQYTWACP-SNVBAGLBSA-N	1	1	312.333	1.909	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@@H](CO)[C@H]3CCCOC3)c2c1	ZINC000601176873	358434610	/nfs/dbraw/zinc/43/46/10/358434610.db2.gz	SGVZNHMPAOSTDK-ZBEGNZNMSA-N	1	1	317.345	1.764	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601184713	358438263	/nfs/dbraw/zinc/43/82/63/358438263.db2.gz	MJUXHRBBHPCKPJ-NWDGAFQWSA-N	1	1	303.318	1.729	20	5		DDBDMO
CC[N@@H+](CC(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000601782222	358693101	/nfs/dbraw/zinc/69/31/01/358693101.db2.gz	XLHWYSVBWFSDBF-MRXNPFEDSA-N	1	1	321.377	1.403	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3C[C@@H]4COC[C@@H]4C3)n2)c1	ZINC000601973315	358760529	/nfs/dbraw/zinc/76/05/29/358760529.db2.gz	JXUHEMMTFYRJSX-TXEJJXNPSA-N	1	1	316.317	1.723	20	5		DDBDMO
CN1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1=O	ZINC000602526308	359026442	/nfs/dbraw/zinc/02/64/42/359026442.db2.gz	IZFSIQPNJBIRKF-SNVBAGLBSA-N	1	1	317.267	1.934	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000602488695	359012445	/nfs/dbraw/zinc/01/24/45/359012445.db2.gz	ZYHGBAGXYKZHMB-UHFFFAOYSA-N	1	1	313.304	1.727	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@]2(C)C(=O)NC(=O)[C@]2(C)C1	ZINC000602724370	359149899	/nfs/dbraw/zinc/14/98/99/359149899.db2.gz	KGKVDOUGHSENHS-IYBDPMFKSA-N	1	1	317.345	1.388	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@]1(C)C(=O)NC2=O	ZINC000602731567	359154072	/nfs/dbraw/zinc/15/40/72/359154072.db2.gz	NHPPDELJUKVNEZ-GASCZTMLSA-N	1	1	303.318	1.079	20	5		DDBDMO
CC1(C)CO[C@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)C1	ZINC000602837532	359227821	/nfs/dbraw/zinc/22/78/21/359227821.db2.gz	OOFRBGNXXDEEFE-ZDUSSCGKSA-N	1	1	320.393	1.927	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O	ZINC000602843194	359231300	/nfs/dbraw/zinc/23/13/00/359231300.db2.gz	WERNWIYYNUDZDW-MCIONIFRSA-N	1	1	308.382	1.725	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817621	359213446	/nfs/dbraw/zinc/21/34/46/359213446.db2.gz	USJQETZMWDBZPX-DYEKYZERSA-N	1	1	322.365	1.373	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817621	359213451	/nfs/dbraw/zinc/21/34/51/359213451.db2.gz	USJQETZMWDBZPX-DYEKYZERSA-N	1	1	322.365	1.373	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000603144063	359433242	/nfs/dbraw/zinc/43/32/42/359433242.db2.gz	SAYDYERMWWOVGB-BETUJISGSA-N	1	1	321.377	1.915	20	5		DDBDMO
Cc1nccc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000610447556	360438495	/nfs/dbraw/zinc/43/84/95/360438495.db2.gz	XIOWDHRTZQULRN-CYBMUJFWSA-N	1	1	316.365	1.769	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611255649	360681026	/nfs/dbraw/zinc/68/10/26/360681026.db2.gz	XIYXXHDOTCYQHG-SNVBAGLBSA-N	1	1	322.317	1.361	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611255649	360681032	/nfs/dbraw/zinc/68/10/32/360681032.db2.gz	XIYXXHDOTCYQHG-SNVBAGLBSA-N	1	1	322.317	1.361	20	5		DDBDMO
Nc1cc(N2CCC(c3[nH]cc[nH+]3)CC2)cc(CO)c1[N+](=O)[O-]	ZINC000611525905	360748152	/nfs/dbraw/zinc/74/81/52/360748152.db2.gz	ZTFKIHIEGGUAKA-UHFFFAOYSA-N	1	1	317.349	1.776	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000611704747	360799221	/nfs/dbraw/zinc/79/92/21/360799221.db2.gz	DLFNOUJRQIYARG-NSHDSACASA-N	1	1	317.349	1.671	20	5		DDBDMO
COCC[N@@H+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000611615837	360775773	/nfs/dbraw/zinc/77/57/73/360775773.db2.gz	CDYWEJSEGAYBTN-CYBMUJFWSA-N	1	1	308.382	1.764	20	5		DDBDMO
COCC[N@H+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000611615837	360775777	/nfs/dbraw/zinc/77/57/77/360775777.db2.gz	CDYWEJSEGAYBTN-CYBMUJFWSA-N	1	1	308.382	1.764	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)n1	ZINC000611616295	360777508	/nfs/dbraw/zinc/77/75/08/360777508.db2.gz	UVILJOULOFNASV-STQMWFEESA-N	1	1	308.382	1.498	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC[NH+](C)CC1	ZINC000613953749	361639992	/nfs/dbraw/zinc/63/99/92/361639992.db2.gz	IHUCOUKOIRAJLP-SNVBAGLBSA-N	1	1	307.350	1.761	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516992	364046844	/nfs/dbraw/zinc/04/68/44/364046844.db2.gz	SRJUTHBBAUVZFU-GXFFZTMASA-N	1	1	321.333	1.708	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516992	364046849	/nfs/dbraw/zinc/04/68/49/364046849.db2.gz	SRJUTHBBAUVZFU-GXFFZTMASA-N	1	1	321.333	1.708	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000359287957	299396999	/nfs/dbraw/zinc/39/69/99/299396999.db2.gz	JVXKRUHWHBXTHV-ZDUSSCGKSA-N	1	1	321.377	1.364	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)CCN1CCOCC1	ZINC000349958597	284119181	/nfs/dbraw/zinc/11/91/81/284119181.db2.gz	BGHNILMKQBTHHX-UHFFFAOYSA-N	1	1	323.393	1.030	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCN1CCOCC1	ZINC000264903825	204254918	/nfs/dbraw/zinc/25/49/18/204254918.db2.gz	ZWUSQCYXRVYNAW-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCN1CCOCC1	ZINC000264903825	204254921	/nfs/dbraw/zinc/25/49/21/204254921.db2.gz	ZWUSQCYXRVYNAW-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)c1	ZINC000266185634	205166990	/nfs/dbraw/zinc/16/69/90/205166990.db2.gz	CWNDUMWKTNONQB-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)c1	ZINC000266185634	205166992	/nfs/dbraw/zinc/16/69/92/205166992.db2.gz	CWNDUMWKTNONQB-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CC[N@H+]1C[C@@H](C)O	ZINC000266392083	205313613	/nfs/dbraw/zinc/31/36/13/205313613.db2.gz	OEAXAAZFFRTDEK-CHWSQXEVSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC(C)[N@H+](Cc1ccco1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266507271	205396115	/nfs/dbraw/zinc/39/61/15/205396115.db2.gz	CEPXAMRFKBBVKY-ZDUSSCGKSA-N	1	1	308.338	1.656	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc(C)c(F)c([N+](=O)[O-])c1	ZINC000154300255	248301144	/nfs/dbraw/zinc/30/11/44/248301144.db2.gz	SKLVUZJADFZOTR-UHFFFAOYSA-N	1	1	319.358	1.272	20	5		DDBDMO
Cn1c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)ccc1[N+](=O)[O-]	ZINC000336944002	249294521	/nfs/dbraw/zinc/29/45/21/249294521.db2.gz	LYTHAQRJNGWFSB-LLVKDONJSA-N	1	1	306.322	1.559	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000104831901	194045313	/nfs/dbraw/zinc/04/53/13/194045313.db2.gz	LIDJXVVKQQSYNO-LLVKDONJSA-N	1	1	306.366	1.700	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000285090708	218286743	/nfs/dbraw/zinc/28/67/43/218286743.db2.gz	DMCBIJLQIVNOMV-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc(C)ccc2[N+](=O)[O-])[N@@H+](C)C1	ZINC000285285535	218365367	/nfs/dbraw/zinc/36/53/67/218365367.db2.gz	QVOMBGUTAJIFDL-STQMWFEESA-N	1	1	321.377	1.694	20	5		DDBDMO
CC[NH+](CC)CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000109837339	194292058	/nfs/dbraw/zinc/29/20/58/194292058.db2.gz	ZTDXLWJMLRGCLF-UHFFFAOYSA-N	1	1	319.358	1.354	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000110994217	194378218	/nfs/dbraw/zinc/37/82/18/194378218.db2.gz	QWOLEIHLDBJRKO-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=C(NCC1CC1)[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157698273	197209029	/nfs/dbraw/zinc/20/90/29/197209029.db2.gz	HXBJSHOREQNDHV-ZDUSSCGKSA-N	1	1	321.381	1.030	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@@H]1O	ZINC000352657975	285202043	/nfs/dbraw/zinc/20/20/43/285202043.db2.gz	CPNFMVGJLPMTBJ-OLZOCXBDSA-N	1	1	318.333	1.990	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNCC[NH+]2CCC(O)CC2)c(Cl)c1	ZINC000294778854	224215572	/nfs/dbraw/zinc/21/55/72/224215572.db2.gz	GQDPBPZAXHAZJG-UHFFFAOYSA-N	1	1	313.785	1.795	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000352783386	285298347	/nfs/dbraw/zinc/29/83/47/285298347.db2.gz	XYLTUYKSUSAAAS-QWRGUYRKSA-N	1	1	309.341	1.827	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@H+]2CC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000569191592	304340007	/nfs/dbraw/zinc/34/00/07/304340007.db2.gz	JADXVSBRPYLQNY-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)C2	ZINC000073995312	406899465	/nfs/dbraw/zinc/89/94/65/406899465.db2.gz	WLZMRVLRXMVKON-WDEREUQCSA-N	1	1	322.340	1.625	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000090460472	407168367	/nfs/dbraw/zinc/16/83/67/407168367.db2.gz	IOUNPRDBBAKCEV-HUUCEWRRSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000090460472	407168369	/nfs/dbraw/zinc/16/83/69/407168369.db2.gz	IOUNPRDBBAKCEV-HUUCEWRRSA-N	1	1	319.361	1.578	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000067118876	407267340	/nfs/dbraw/zinc/26/73/40/407267340.db2.gz	CMEAPEWZXJZZIR-VIFPVBQESA-N	1	1	321.424	1.665	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@](C)(O)C1	ZINC000123941475	407343637	/nfs/dbraw/zinc/34/36/37/407343637.db2.gz	LFMJRECRFNCDEQ-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](C)(O)C1	ZINC000123941475	407343638	/nfs/dbraw/zinc/34/36/38/407343638.db2.gz	LFMJRECRFNCDEQ-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000265801723	407462827	/nfs/dbraw/zinc/46/28/27/407462827.db2.gz	XFMPXBZJJYAAKU-UHFFFAOYSA-N	1	1	321.362	1.352	20	5		DDBDMO
CC(C)[N@@H+](CCCS(N)(=O)=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000170913951	407555593	/nfs/dbraw/zinc/55/55/93/407555593.db2.gz	ZBFZLCWKGHBUPI-UHFFFAOYSA-N	1	1	315.395	1.484	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cncnc3)C2)nc1	ZINC000128897108	407581705	/nfs/dbraw/zinc/58/17/05/407581705.db2.gz	UPAFWZFKSHMWGZ-GFCCVEGCSA-N	1	1	300.322	1.466	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cncnc3)C2)nc1	ZINC000128897108	407581707	/nfs/dbraw/zinc/58/17/07/407581707.db2.gz	UPAFWZFKSHMWGZ-GFCCVEGCSA-N	1	1	300.322	1.466	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000129458243	407611727	/nfs/dbraw/zinc/61/17/27/407611727.db2.gz	QGZRAUNSPQGQBF-ZDUSSCGKSA-N	1	1	323.368	1.888	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000152404830	407628510	/nfs/dbraw/zinc/62/85/10/407628510.db2.gz	BDECBPOLLZTWIK-BQYQJAHWSA-N	1	1	321.377	1.693	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178873024	407637472	/nfs/dbraw/zinc/63/74/72/407637472.db2.gz	ADSHRAPYWOAJGN-OCCSQVGLSA-N	1	1	308.334	1.656	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000179148136	407736777	/nfs/dbraw/zinc/73/67/77/407736777.db2.gz	UODBSBRXOLKICN-GFCCVEGCSA-N	1	1	321.333	1.221	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000171665887	407736771	/nfs/dbraw/zinc/73/67/71/407736771.db2.gz	IWGMZDQSEQZIGT-LLVKDONJSA-N	1	1	323.397	1.731	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000267252124	407808349	/nfs/dbraw/zinc/80/83/49/407808349.db2.gz	GVWAWDJGTHYPKK-UHFFFAOYSA-N	1	1	303.322	1.502	20	5		DDBDMO
CN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000153493312	407834184	/nfs/dbraw/zinc/83/41/84/407834184.db2.gz	BEQJOTKGWPLPSF-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337971	407840545	/nfs/dbraw/zinc/84/05/45/407840545.db2.gz	KQNNCLBQOFLXCO-NHYWBVRUSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337971	407840547	/nfs/dbraw/zinc/84/05/47/407840547.db2.gz	KQNNCLBQOFLXCO-NHYWBVRUSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@@H+]1CCO	ZINC000187738998	407888737	/nfs/dbraw/zinc/88/87/37/407888737.db2.gz	VJOLOCDLVIATQQ-LLVKDONJSA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1CCO	ZINC000187738998	407888741	/nfs/dbraw/zinc/88/87/41/407888741.db2.gz	VJOLOCDLVIATQQ-LLVKDONJSA-N	1	1	320.349	1.234	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)C[C@H](C)O	ZINC000245725490	408053570	/nfs/dbraw/zinc/05/35/70/408053570.db2.gz	BNGSIJQWKLOQOQ-VHSXEESVSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)C[C@H](C)O	ZINC000245725490	408053577	/nfs/dbraw/zinc/05/35/77/408053577.db2.gz	BNGSIJQWKLOQOQ-VHSXEESVSA-N	1	1	311.338	1.243	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@H]2CCC[C@H]21	ZINC000273084926	408049695	/nfs/dbraw/zinc/04/96/95/408049695.db2.gz	YOOSLURCAYKTKK-NFAWXSAZSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@H]2CCC[C@H]21	ZINC000273084926	408049698	/nfs/dbraw/zinc/04/96/98/408049698.db2.gz	YOOSLURCAYKTKK-NFAWXSAZSA-N	1	1	322.361	1.588	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000272577422	407991885	/nfs/dbraw/zinc/99/18/85/407991885.db2.gz	GJQORMICQLVFOZ-DOMZBBRYSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000189663938	408073800	/nfs/dbraw/zinc/07/38/00/408073800.db2.gz	YFCCRSQYJXZUGB-HNNXBMFYSA-N	1	1	307.350	1.431	20	5		DDBDMO
Cc1nc(N2CC[NH+](CCOC(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000268524913	408084086	/nfs/dbraw/zinc/08/40/86/408084086.db2.gz	VTSZLEIQVCHOCT-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC1(O)CCOCC1	ZINC000189755413	408099819	/nfs/dbraw/zinc/09/98/19/408099819.db2.gz	YFCMFIUNTFKPIZ-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)C[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269330188	408270274	/nfs/dbraw/zinc/27/02/74/408270274.db2.gz	DYUBOUYKGAWOFI-JTQLQIEISA-N	1	1	309.370	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000269330188	408270283	/nfs/dbraw/zinc/27/02/83/408270283.db2.gz	DYUBOUYKGAWOFI-JTQLQIEISA-N	1	1	309.370	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269330188	408270288	/nfs/dbraw/zinc/27/02/88/408270288.db2.gz	DYUBOUYKGAWOFI-JTQLQIEISA-N	1	1	309.370	1.465	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269333255	408272803	/nfs/dbraw/zinc/27/28/03/408272803.db2.gz	AUCGKSRMPUCEEX-MNOVXSKESA-N	1	1	323.397	1.900	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000269338962	408274078	/nfs/dbraw/zinc/27/40/78/408274078.db2.gz	BOFAGCIDDGIGHX-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000269338962	408274083	/nfs/dbraw/zinc/27/40/83/408274083.db2.gz	BOFAGCIDDGIGHX-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
Cc1ccnc(N2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)c1	ZINC000166264847	162164937	/nfs/dbraw/zinc/16/49/37/162164937.db2.gz	ACWXFDITPMODBE-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
COCC[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccnc1	ZINC000191118702	408373971	/nfs/dbraw/zinc/37/39/71/408373971.db2.gz	DYEXQIHBYNCYKC-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccnc1	ZINC000191118702	408373973	/nfs/dbraw/zinc/37/39/73/408373973.db2.gz	DYEXQIHBYNCYKC-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000183646986	408460547	/nfs/dbraw/zinc/46/05/47/408460547.db2.gz	JZYVFDJWOQDEMM-NSHDSACASA-N	1	1	307.354	1.795	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000159724436	408429314	/nfs/dbraw/zinc/42/93/14/408429314.db2.gz	CGUGBZVAMQVDMN-UHFFFAOYSA-N	1	1	317.345	1.767	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000248541851	408585663	/nfs/dbraw/zinc/58/56/63/408585663.db2.gz	IIRBZIFUPCGPBY-WOPDTQHZSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000248541851	408585667	/nfs/dbraw/zinc/58/56/67/408585667.db2.gz	IIRBZIFUPCGPBY-WOPDTQHZSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H]([NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000264677132	408543937	/nfs/dbraw/zinc/54/39/37/408543937.db2.gz	NWEIAFMODPHHJM-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](C[C@H](C)O)[C@H](C)C1	ZINC000248662440	408611008	/nfs/dbraw/zinc/61/10/08/408611008.db2.gz	GWUPJDYTQFRAKD-MNOVXSKESA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](C[C@H](C)O)[C@H](C)C1	ZINC000248662440	408611015	/nfs/dbraw/zinc/61/10/15/408611015.db2.gz	GWUPJDYTQFRAKD-MNOVXSKESA-N	1	1	311.386	1.011	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1C1CC1	ZINC000184486910	408628123	/nfs/dbraw/zinc/62/81/23/408628123.db2.gz	NHFFPKODVWPKTA-VHSXEESVSA-N	1	1	304.350	1.532	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1O	ZINC000249542582	408738815	/nfs/dbraw/zinc/73/88/15/408738815.db2.gz	FJBBQDJVHUNRMA-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC000265539319	408687484	/nfs/dbraw/zinc/68/74/84/408687484.db2.gz	ONOHXILRDFYWHE-VIFPVBQESA-N	1	1	300.746	1.776	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC000265539319	408687492	/nfs/dbraw/zinc/68/74/92/408687492.db2.gz	ONOHXILRDFYWHE-VIFPVBQESA-N	1	1	300.746	1.776	20	5		DDBDMO
CCOC(=O)c1ccnc(N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000184785291	408687827	/nfs/dbraw/zinc/68/78/27/408687827.db2.gz	GCMOTBUQRYOJNQ-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000162380329	408697495	/nfs/dbraw/zinc/69/74/95/408697495.db2.gz	SZSKJWKDQGRHES-CYBMUJFWSA-N	1	1	305.378	1.904	20	5		DDBDMO
Nc1c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000178174447	408783405	/nfs/dbraw/zinc/78/34/05/408783405.db2.gz	KTRYHNZXIQNUHN-SNVBAGLBSA-N	1	1	304.350	1.391	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)[N@@H+](C)Cc1ccccc1	ZINC000285845340	408875199	/nfs/dbraw/zinc/87/51/99/408875199.db2.gz	HUEHMKNQMVPUBP-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
Cc1c(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000285953360	408895572	/nfs/dbraw/zinc/89/55/72/408895572.db2.gz	WHZJGQCERZADPG-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[C@H]1C[N@@H+](C2CCN(c3ncc([N+](=O)[O-])s3)CC2)CCO1	ZINC000190319550	163136304	/nfs/dbraw/zinc/13/63/04/163136304.db2.gz	KEWPAASJZNEZGU-JTQLQIEISA-N	1	1	312.395	1.741	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])s3)CC2)CCO1	ZINC000190319550	163136310	/nfs/dbraw/zinc/13/63/10/163136310.db2.gz	KEWPAASJZNEZGU-JTQLQIEISA-N	1	1	312.395	1.741	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000281842915	408941048	/nfs/dbraw/zinc/94/10/48/408941048.db2.gz	YPJZGIBJCQSNMP-GXFFZTMASA-N	1	1	307.350	1.693	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000277693893	408993224	/nfs/dbraw/zinc/99/32/24/408993224.db2.gz	ZWTCOLWLEMLUKP-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(CNC(=O)C2)C1	ZINC000278865666	409103842	/nfs/dbraw/zinc/10/38/42/409103842.db2.gz	LRSGUBJFWFIMEE-HNNXBMFYSA-N	1	1	305.334	1.315	20	5		DDBDMO
C[N@@H+]1CCC[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000294184058	409256595	/nfs/dbraw/zinc/25/65/95/409256595.db2.gz	PEORJGFOQZZQMN-INIZCTEOSA-N	1	1	319.361	1.858	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000294184058	409256598	/nfs/dbraw/zinc/25/65/98/409256598.db2.gz	PEORJGFOQZZQMN-INIZCTEOSA-N	1	1	319.361	1.858	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337178	409294332	/nfs/dbraw/zinc/29/43/32/409294332.db2.gz	HNWBZZUDHJAJQV-RCBQFDQVSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337178	409294336	/nfs/dbraw/zinc/29/43/36/409294336.db2.gz	HNWBZZUDHJAJQV-RCBQFDQVSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[N@H+](Cc1ccccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000295256181	409398664	/nfs/dbraw/zinc/39/86/64/409398664.db2.gz	ZUCGFNDPNTZDAW-AWEZNQCLSA-N	1	1	317.345	1.862	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@@H+]2CC=CCC2)ccc1[N+](=O)[O-]	ZINC000280511371	409335320	/nfs/dbraw/zinc/33/53/20/409335320.db2.gz	NEIAFKZFHSELPI-UHFFFAOYSA-N	1	1	319.361	1.660	20	5		DDBDMO
Cc1cccc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000285350952	409411514	/nfs/dbraw/zinc/41/15/14/409411514.db2.gz	ULYQQCFHADZPFB-ZIAGYGMSSA-N	1	1	319.361	1.448	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC=C(c3ccco3)C2)c1	ZINC000285405649	409432694	/nfs/dbraw/zinc/43/26/94/409432694.db2.gz	UJPNDHOZOHRXAE-AWEZNQCLSA-N	1	1	318.333	1.535	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000280751891	409440238	/nfs/dbraw/zinc/44/02/38/409440238.db2.gz	NJSKHLWOVPVUHQ-AWEZNQCLSA-N	1	1	304.306	1.433	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@](C)(F)C2)c1	ZINC000295333564	409440598	/nfs/dbraw/zinc/44/05/98/409440598.db2.gz	XTJFFXHUEZTAHQ-AWEZNQCLSA-N	1	1	311.313	1.377	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000317235058	164026793	/nfs/dbraw/zinc/02/67/93/164026793.db2.gz	LOVKYIJEMQTMMS-NEPJUHHUSA-N	1	1	304.350	1.534	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000317768843	164028698	/nfs/dbraw/zinc/02/86/98/164028698.db2.gz	QKAMYUGUZPNYOR-STQMWFEESA-N	1	1	307.350	1.879	20	5		DDBDMO
CS[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000296285332	409490098	/nfs/dbraw/zinc/49/00/98/409490098.db2.gz	MYQWMPKSCVSILQ-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
CS[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000296285332	409490105	/nfs/dbraw/zinc/49/01/05/409490105.db2.gz	MYQWMPKSCVSILQ-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1	ZINC000295454286	409490306	/nfs/dbraw/zinc/49/03/06/409490306.db2.gz	WULLYATUGVUAMH-NSHDSACASA-N	1	1	321.381	1.042	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356728517	409554485	/nfs/dbraw/zinc/55/44/85/409554485.db2.gz	FEOUQDHGNLNESO-ZYHUDNBSSA-N	1	1	307.350	1.816	20	5		DDBDMO
CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000356802288	409620718	/nfs/dbraw/zinc/62/07/18/409620718.db2.gz	JRLSSQVAZOVEDU-GFCCVEGCSA-N	1	1	305.334	1.609	20	5		DDBDMO
CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000356802288	409620724	/nfs/dbraw/zinc/62/07/24/409620724.db2.gz	JRLSSQVAZOVEDU-GFCCVEGCSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000342437224	409630052	/nfs/dbraw/zinc/63/00/52/409630052.db2.gz	OBCHWSIXNNKURJ-QPUJVOFHSA-N	1	1	302.327	1.257	20	5		DDBDMO
CN(c1nc2sccn2c1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000354079589	409636097	/nfs/dbraw/zinc/63/60/97/409636097.db2.gz	IXEXWCJLXITCFO-JTQLQIEISA-N	1	1	307.379	1.977	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CCC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717246	409639761	/nfs/dbraw/zinc/63/97/61/409639761.db2.gz	NLQOMXZSKVCMJJ-DOMZBBRYSA-N	1	1	319.361	1.404	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717246	409639769	/nfs/dbraw/zinc/63/97/69/409639769.db2.gz	NLQOMXZSKVCMJJ-DOMZBBRYSA-N	1	1	319.361	1.404	20	5		DDBDMO
COc1ccc(C[N@H+](C)CCNC(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000348930596	409593509	/nfs/dbraw/zinc/59/35/09/409593509.db2.gz	YWMRNNYBEOIDJD-UHFFFAOYSA-N	1	1	310.354	1.306	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCNC(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000348930596	409593519	/nfs/dbraw/zinc/59/35/19/409593519.db2.gz	YWMRNNYBEOIDJD-UHFFFAOYSA-N	1	1	310.354	1.306	20	5		DDBDMO
CC[C@@H](C)[NH+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])CC1	ZINC000296879109	409682329	/nfs/dbraw/zinc/68/23/29/409682329.db2.gz	JCGWUGKOHMWXIK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H](C)[NH+]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000296879109	409682339	/nfs/dbraw/zinc/68/23/39/409682339.db2.gz	JCGWUGKOHMWXIK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
COc1cc(C[N@H+](C)[C@H](C)C[S@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630493	409774256	/nfs/dbraw/zinc/77/42/56/409774256.db2.gz	FKWJIRCJPGGSPN-SBKAZYGRSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H](C)C[S@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630493	409774265	/nfs/dbraw/zinc/77/42/65/409774265.db2.gz	FKWJIRCJPGGSPN-SBKAZYGRSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC000356913443	409716958	/nfs/dbraw/zinc/71/69/58/409716958.db2.gz	YFCBZMPDAHMGLU-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000356913443	409716966	/nfs/dbraw/zinc/71/69/66/409716966.db2.gz	YFCBZMPDAHMGLU-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc(C[N@H+](C)[C@H]2CCSC2)n1	ZINC000350893561	410009820	/nfs/dbraw/zinc/00/98/20/410009820.db2.gz	WZKCTRRKCPKYDU-QMMMGPOBSA-N	1	1	324.366	1.316	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc(C[N@@H+](C)[C@H]2CCSC2)n1	ZINC000350893561	410009825	/nfs/dbraw/zinc/00/98/25/410009825.db2.gz	WZKCTRRKCPKYDU-QMMMGPOBSA-N	1	1	324.366	1.316	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229643	409998967	/nfs/dbraw/zinc/99/89/67/409998967.db2.gz	PNOCBPXJUQZSFQ-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229643	409998971	/nfs/dbraw/zinc/99/89/71/409998971.db2.gz	PNOCBPXJUQZSFQ-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1C	ZINC000298236617	410145076	/nfs/dbraw/zinc/14/50/76/410145076.db2.gz	IJHGZKDSSORGMO-MRXNPFEDSA-N	1	1	318.377	1.901	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000339399027	410161515	/nfs/dbraw/zinc/16/15/15/410161515.db2.gz	YNBATDFBURBILB-HZPDHXFCSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000351773560	410224322	/nfs/dbraw/zinc/22/43/22/410224322.db2.gz	HFFCSLWHRYPXEV-BXKDBHETSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000351773560	410224330	/nfs/dbraw/zinc/22/43/30/410224330.db2.gz	HFFCSLWHRYPXEV-BXKDBHETSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000347231568	410404668	/nfs/dbraw/zinc/40/46/68/410404668.db2.gz	ROYRXYWWWGKZLH-PHIMTYICSA-N	1	1	309.370	1.321	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1[C@@H](CO)CC[C@H]1CO	ZINC000347304792	410458450	/nfs/dbraw/zinc/45/84/50/410458450.db2.gz	LPQWHCXYRIHHQV-GASCZTMLSA-N	1	1	324.377	1.700	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1[C@@H](CO)CC[C@H]1CO	ZINC000347304792	410458458	/nfs/dbraw/zinc/45/84/58/410458458.db2.gz	LPQWHCXYRIHHQV-GASCZTMLSA-N	1	1	324.377	1.700	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(C)c2[nH+]ccn2c1	ZINC000355431063	410511474	/nfs/dbraw/zinc/51/14/74/410511474.db2.gz	HHOAPSVDHOJZMR-UHFFFAOYSA-N	1	1	314.305	1.695	20	5		DDBDMO
CC[N@@H+](CCNc1ncnc2cccc([N+](=O)[O-])c21)C1CC1	ZINC000347401294	410520927	/nfs/dbraw/zinc/52/09/27/410520927.db2.gz	CKYNOAIODKRPTC-UHFFFAOYSA-N	1	1	301.350	2.434	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2sccc2C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000299097189	410520159	/nfs/dbraw/zinc/52/01/59/410520159.db2.gz	LBNTUIFRWJGLMZ-UHFFFAOYSA-N	1	1	320.374	1.773	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2sccc2C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000299097189	410520162	/nfs/dbraw/zinc/52/01/62/410520162.db2.gz	LBNTUIFRWJGLMZ-UHFFFAOYSA-N	1	1	320.374	1.773	20	5		DDBDMO
CCC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000343555723	410530245	/nfs/dbraw/zinc/53/02/45/410530245.db2.gz	FMKMHTSCLACJOZ-GFCCVEGCSA-N	1	1	307.350	1.905	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000343555723	410530248	/nfs/dbraw/zinc/53/02/48/410530248.db2.gz	FMKMHTSCLACJOZ-GFCCVEGCSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000347662141	410661216	/nfs/dbraw/zinc/66/12/16/410661216.db2.gz	YYTVUFAVBCOGGT-NSHDSACASA-N	1	1	322.365	1.248	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330579872	410793747	/nfs/dbraw/zinc/79/37/47/410793747.db2.gz	IHOMCXCZHJJCMT-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000348174281	410837050	/nfs/dbraw/zinc/83/70/50/410837050.db2.gz	KIPJQQZEKGPNMA-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCC[C@@H](C)C1	ZINC000356150099	410864726	/nfs/dbraw/zinc/86/47/26/410864726.db2.gz	HTHWUJYCCXUDRA-GHMZBOCLSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000330836110	410897121	/nfs/dbraw/zinc/89/71/21/410897121.db2.gz	KMIAPKLTJKLNKR-MBNYWOFBSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000331294214	411063748	/nfs/dbraw/zinc/06/37/48/411063748.db2.gz	RHWFVLWIWJQEKD-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000331294214	411063752	/nfs/dbraw/zinc/06/37/52/411063752.db2.gz	RHWFVLWIWJQEKD-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)Cc1ccccc1	ZINC000356447183	411035649	/nfs/dbraw/zinc/03/56/49/411035649.db2.gz	NLKOQGDHZWSCDN-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
NC(=O)c1ccc(N2CC[N@H+]3CCCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000192510220	418523857	/nfs/dbraw/zinc/52/38/57/418523857.db2.gz	WWIRTXKAEIRAEB-GFCCVEGCSA-N	1	1	304.350	1.368	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)n1	ZINC000191814915	222110343	/nfs/dbraw/zinc/11/03/43/222110343.db2.gz	KYURIMWZMSHPGJ-WDEREUQCSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000375053030	418595650	/nfs/dbraw/zinc/59/56/50/418595650.db2.gz	DWUBOMYXJFZFGQ-UKRRQHHQSA-N	1	1	303.362	1.690	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[N@@H+](C)[C@H]2C1	ZINC000375053878	418596534	/nfs/dbraw/zinc/59/65/34/418596534.db2.gz	IJANSJJBAVLURK-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1CO	ZINC000361658078	418697578	/nfs/dbraw/zinc/69/75/78/418697578.db2.gz	XEWVWXRPWDWGSL-GXFFZTMASA-N	1	1	308.334	1.522	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](C[C@@H]2CCOC2)C1	ZINC000371446959	418791102	/nfs/dbraw/zinc/79/11/02/418791102.db2.gz	IENKFCGEZMSPCE-OLZOCXBDSA-N	1	1	308.382	1.967	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000371544171	418799226	/nfs/dbraw/zinc/79/92/26/418799226.db2.gz	DPLVYQAWWQXUDN-UKRRQHHQSA-N	1	1	303.362	1.690	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@H+](C3CCOCC3)CC2)nc1	ZINC000364927608	418823804	/nfs/dbraw/zinc/82/38/04/418823804.db2.gz	AGLWPKDCDMBUQG-UHFFFAOYSA-N	1	1	307.354	1.076	20	5		DDBDMO
CCc1nn(C)c(N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000372876349	418911705	/nfs/dbraw/zinc/91/17/05/418911705.db2.gz	HWAGKMNSWGXATO-UHFFFAOYSA-N	1	1	307.398	1.955	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420950420	419379633	/nfs/dbraw/zinc/37/96/33/419379633.db2.gz	WLNMYJIRUJFWIO-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)C[C@H]1CCC[N@H+]1C	ZINC000420993407	419428905	/nfs/dbraw/zinc/42/89/05/419428905.db2.gz	ATBYJVMNQOVPLL-SWLSCSKDSA-N	1	1	320.393	1.948	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000421237748	419534317	/nfs/dbraw/zinc/53/43/17/419534317.db2.gz	LBQFJLADEOKKBT-CYBMUJFWSA-N	1	1	320.349	1.086	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)n1	ZINC000418994795	420042233	/nfs/dbraw/zinc/04/22/33/420042233.db2.gz	IEJFYMGDEXZMRF-STQMWFEESA-N	1	1	308.382	1.498	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)CN1CCOCC1	ZINC000430232245	420093452	/nfs/dbraw/zinc/09/34/52/420093452.db2.gz	LPYSAKJUQBCELL-CYBMUJFWSA-N	1	1	323.393	1.756	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](C)CN1CCOCC1	ZINC000430232245	420093456	/nfs/dbraw/zinc/09/34/56/420093456.db2.gz	LPYSAKJUQBCELL-CYBMUJFWSA-N	1	1	323.393	1.756	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000430265355	420098099	/nfs/dbraw/zinc/09/80/99/420098099.db2.gz	UZISAMBOHPKNEI-HNNXBMFYSA-N	1	1	317.349	1.429	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000430265355	420098103	/nfs/dbraw/zinc/09/81/03/420098103.db2.gz	UZISAMBOHPKNEI-HNNXBMFYSA-N	1	1	317.349	1.429	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000415631664	420129276	/nfs/dbraw/zinc/12/92/76/420129276.db2.gz	NJXVXLLVCKNTFZ-CYBMUJFWSA-N	1	1	314.292	1.899	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]([NH3+])[C@H](C)C1	ZINC000430919278	420205102	/nfs/dbraw/zinc/20/51/02/420205102.db2.gz	PVUPFVBIAPJKON-OCCSQVGLSA-N	1	1	320.393	1.901	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1C(C)C	ZINC000453041967	420706450	/nfs/dbraw/zinc/70/64/50/420706450.db2.gz	SBRBRONHRZNGNX-KKUMJFAQSA-N	1	1	310.398	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@H](O)[C@H](CO)C2)o1	ZINC000459712823	420854913	/nfs/dbraw/zinc/85/49/13/420854913.db2.gz	RTXHBDLSVLIVMA-NHYWBVRUSA-N	1	1	318.329	1.640	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@](O)(CO)C1	ZINC000459727662	420859078	/nfs/dbraw/zinc/85/90/78/420859078.db2.gz	RADGWICRIFVNAM-RQPMMQJISA-N	1	1	306.362	1.817	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)[C@H](C)C1	ZINC000456045094	421093073	/nfs/dbraw/zinc/09/30/73/421093073.db2.gz	FHDLUUHCCQTDHR-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)[C@H](C)C1	ZINC000456045094	421093075	/nfs/dbraw/zinc/09/30/75/421093075.db2.gz	FHDLUUHCCQTDHR-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000449748070	421073964	/nfs/dbraw/zinc/07/39/64/421073964.db2.gz	ZFZKYBKTALZAMF-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000449748070	421073967	/nfs/dbraw/zinc/07/39/67/421073967.db2.gz	ZFZKYBKTALZAMF-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)C[C@@H]1[NH+]1CCOCC1	ZINC000450388646	421191787	/nfs/dbraw/zinc/19/17/87/421191787.db2.gz	IKMBISLBKFSKEU-JSGCOSHPSA-N	1	1	321.381	1.240	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ncc(C)cc1[N+](=O)[O-])C(C)C	ZINC000450593583	421214480	/nfs/dbraw/zinc/21/44/80/421214480.db2.gz	BDMZJYMRDQKIQF-ZDUSSCGKSA-N	1	1	324.381	1.887	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@]1(C)CO	ZINC000546103789	421285420	/nfs/dbraw/zinc/28/54/20/421285420.db2.gz	YTCNARAZFZTCBF-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@]1(C)CO	ZINC000546103789	421285423	/nfs/dbraw/zinc/28/54/23/421285423.db2.gz	YTCNARAZFZTCBF-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1nn(CCC(=O)NCC[N@@H+]2CC[C@@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000525291736	421285794	/nfs/dbraw/zinc/28/57/94/421285794.db2.gz	PMBMTQZXEKMUEH-LLVKDONJSA-N	1	1	323.397	1.256	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000548408047	421435841	/nfs/dbraw/zinc/43/58/41/421435841.db2.gz	FHXJSYIPSYCCTH-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
CNc1nccc(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000563375841	421496130	/nfs/dbraw/zinc/49/61/30/421496130.db2.gz	FWDPRPRPEOHNHM-UHFFFAOYSA-N	1	1	321.381	1.588	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CN[C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418845	421506706	/nfs/dbraw/zinc/50/67/06/421506706.db2.gz	QINQVXDWMRYTBR-IUODEOHRSA-N	1	1	304.394	1.418	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CN[C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418845	421506709	/nfs/dbraw/zinc/50/67/09/421506709.db2.gz	QINQVXDWMRYTBR-IUODEOHRSA-N	1	1	304.394	1.418	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000552418441	421586113	/nfs/dbraw/zinc/58/61/13/421586113.db2.gz	ZLXCUFZLTLQXQN-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000552418441	421586114	/nfs/dbraw/zinc/58/61/14/421586114.db2.gz	ZLXCUFZLTLQXQN-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000552418441	421586115	/nfs/dbraw/zinc/58/61/15/421586115.db2.gz	ZLXCUFZLTLQXQN-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000580901476	421861899	/nfs/dbraw/zinc/86/18/99/421861899.db2.gz	VHMNZSUFYQWMLG-UHFFFAOYSA-N	1	1	321.377	1.822	20	5		DDBDMO
CC[N@@H+](CCNc1ccc(N)c([N+](=O)[O-])n1)CCC(F)(F)F	ZINC000596210155	422370484	/nfs/dbraw/zinc/37/04/84/422370484.db2.gz	KOGWWGWPXMPPMU-UHFFFAOYSA-N	1	1	321.303	2.258	20	5		DDBDMO
C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@H]1C[N@H+](C)CCO1	ZINC000590694559	422322748	/nfs/dbraw/zinc/32/27/48/422322748.db2.gz	PHMSXOGQHWNILY-XHDPSFHLSA-N	1	1	316.361	2.274	20	5		DDBDMO
C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@H]1C[N@@H+](C)CCO1	ZINC000590694559	422322753	/nfs/dbraw/zinc/32/27/53/422322753.db2.gz	PHMSXOGQHWNILY-XHDPSFHLSA-N	1	1	316.361	2.274	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]2COCC[C@@H]21	ZINC000341583121	271127309	/nfs/dbraw/zinc/12/73/09/271127309.db2.gz	UISULLXAWUIHOU-JSGCOSHPSA-N	1	1	307.350	1.257	20	5		DDBDMO
Cc1cccc(NCCNc2cccc(C(N)=O)c2[N+](=O)[O-])[nH+]1	ZINC000342121203	271305562	/nfs/dbraw/zinc/30/55/62/271305562.db2.gz	CBAJMXCACRVRAG-UHFFFAOYSA-N	1	1	315.333	1.921	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000347367523	272674216	/nfs/dbraw/zinc/67/42/16/272674216.db2.gz	WVGBEEOSICRMHI-LLVKDONJSA-N	1	1	307.354	1.075	20	5		DDBDMO
COCC[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000153719366	274032029	/nfs/dbraw/zinc/03/20/29/274032029.db2.gz	DQYXNGHDYALSGQ-JTQLQIEISA-N	1	1	314.773	1.800	20	5		DDBDMO
COCC[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000153719366	274032030	/nfs/dbraw/zinc/03/20/30/274032030.db2.gz	DQYXNGHDYALSGQ-JTQLQIEISA-N	1	1	314.773	1.800	20	5		DDBDMO
CC(C)C[C@H](CNc1ncc([N+](=O)[O-])cn1)[NH+]1CCOCC1	ZINC000302077700	275596968	/nfs/dbraw/zinc/59/69/68/275596968.db2.gz	ANLCTQABXVHZMG-GFCCVEGCSA-N	1	1	309.370	1.544	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000273152699	276381203	/nfs/dbraw/zinc/38/12/03/276381203.db2.gz	IGQHTGFELDVGAI-CHWSQXEVSA-N	1	1	323.393	1.885	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[NH+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000299359963	277017172	/nfs/dbraw/zinc/01/71/72/277017172.db2.gz	UXWCAMJIFCOEFE-UHFFFAOYSA-N	1	1	304.350	1.239	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455657624	277044991	/nfs/dbraw/zinc/04/49/91/277044991.db2.gz	DILMAMPINKGBRY-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
COc1cc(C[NH2+][C@](C)(C(N)=O)C(C)C)c([N+](=O)[O-])cc1F	ZINC000297609250	277378361	/nfs/dbraw/zinc/37/83/61/277378361.db2.gz	KNDGFQMZPLQKGM-AWEZNQCLSA-N	1	1	313.329	1.732	20	5		DDBDMO
C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000179710525	278242031	/nfs/dbraw/zinc/24/20/31/278242031.db2.gz	ODCGDVVUYJLXJR-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000179710525	278242033	/nfs/dbraw/zinc/24/20/33/278242033.db2.gz	ODCGDVVUYJLXJR-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000179710525	278242034	/nfs/dbraw/zinc/24/20/34/278242034.db2.gz	ODCGDVVUYJLXJR-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cccc(OC)c1[N+](=O)[O-])C1CC1	ZINC000192515150	279205318	/nfs/dbraw/zinc/20/53/18/279205318.db2.gz	LUSICSHHCFEUIM-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1[C@@H](C)C[NH+](C)C[C@@H]1C	ZINC000127272628	281269838	/nfs/dbraw/zinc/26/98/38/281269838.db2.gz	MEPPICMXHSDOKR-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000362659647	300111188	/nfs/dbraw/zinc/11/11/88/300111188.db2.gz	WTTCJOJSTVKTHB-LBPRGKRZSA-N	1	1	308.382	1.641	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000362718761	300122272	/nfs/dbraw/zinc/12/22/72/300122272.db2.gz	AZIPGFODBMBENO-LSDHHAIUSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000362718761	300122274	/nfs/dbraw/zinc/12/22/74/300122274.db2.gz	AZIPGFODBMBENO-LSDHHAIUSA-N	1	1	319.361	1.578	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000363076709	300207255	/nfs/dbraw/zinc/20/72/55/300207255.db2.gz	WRTSNPWFVZZWGK-YHWZYXNKSA-N	1	1	321.381	1.089	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)cc([N+](=O)[O-])c1	ZINC000363125566	300215735	/nfs/dbraw/zinc/21/57/35/300215735.db2.gz	RFBOOHWYROVARE-DZGCQCFKSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C1NCCCC[C@@H]1[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012306	301119541	/nfs/dbraw/zinc/11/95/41/301119541.db2.gz	UWTKDQWGXVZDII-AAEUAGOBSA-N	1	1	307.354	1.097	20	5		DDBDMO
CCOC(=O)[C@@H](CC)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369670543	301208946	/nfs/dbraw/zinc/20/89/46/301208946.db2.gz	NTMBRNUCSOTJOL-GFCCVEGCSA-N	1	1	310.354	1.770	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000370081697	301272522	/nfs/dbraw/zinc/27/25/22/301272522.db2.gz	KAANNVZMXXCATI-MRXNPFEDSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H]2COC[C@H]21	ZINC000370223569	301297690	/nfs/dbraw/zinc/29/76/90/301297690.db2.gz	DHGZITCHKUVJBV-KCQAQPDRSA-N	1	1	322.361	1.445	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)c1	ZINC000370285627	301309394	/nfs/dbraw/zinc/30/93/94/301309394.db2.gz	ONIMVCQAXAVSMO-STQMWFEESA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)c1	ZINC000370285627	301309395	/nfs/dbraw/zinc/30/93/95/301309395.db2.gz	ONIMVCQAXAVSMO-STQMWFEESA-N	1	1	306.366	1.842	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000375994950	302021135	/nfs/dbraw/zinc/02/11/35/302021135.db2.gz	OJLALPCUDGNNMF-YRGRVCCFSA-N	1	1	308.382	1.844	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1	ZINC000377767456	302229403	/nfs/dbraw/zinc/22/94/03/302229403.db2.gz	MWILFINXCYXDFK-UONOGXRCSA-N	1	1	306.366	1.825	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000377856711	302243597	/nfs/dbraw/zinc/24/35/97/302243597.db2.gz	QUFGJMSOANHLTF-UHFFFAOYSA-N	1	1	311.386	1.185	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641908	302359866	/nfs/dbraw/zinc/35/98/66/302359866.db2.gz	XMMALNVQKMATHG-RYUDHWBXSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641908	302359868	/nfs/dbraw/zinc/35/98/68/302359868.db2.gz	XMMALNVQKMATHG-RYUDHWBXSA-N	1	1	307.350	1.484	20	5		DDBDMO
CC[C@H]1CC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000531026001	303225923	/nfs/dbraw/zinc/22/59/23/303225923.db2.gz	SHBZZADJFVZNDX-SMDDNHRTSA-N	1	1	317.345	1.959	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363398880	307027289	/nfs/dbraw/zinc/02/72/89/307027289.db2.gz	QBJWAAMWMCFAND-ZNMIVQPWSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccnc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363398880	307027290	/nfs/dbraw/zinc/02/72/90/307027290.db2.gz	QBJWAAMWMCFAND-ZNMIVQPWSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363398880	307027291	/nfs/dbraw/zinc/02/72/91/307027291.db2.gz	QBJWAAMWMCFAND-ZNMIVQPWSA-N	1	1	318.377	1.075	20	5		DDBDMO
C=Cn1cc(C[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000365336547	307065244	/nfs/dbraw/zinc/06/52/44/307065244.db2.gz	JMPIHJFSYYSYGP-ZDUSSCGKSA-N	1	1	302.338	1.925	20	5		DDBDMO
C=Cn1cc(C[N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000365336547	307065245	/nfs/dbraw/zinc/06/52/45/307065245.db2.gz	JMPIHJFSYYSYGP-ZDUSSCGKSA-N	1	1	302.338	1.925	20	5		DDBDMO
CSC[C@@H](O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372294467	307167731	/nfs/dbraw/zinc/16/77/31/307167731.db2.gz	JNMAYJPFDUZMTI-PWSUYJOCSA-N	1	1	300.384	1.152	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)n1	ZINC000373142418	307180387	/nfs/dbraw/zinc/18/03/87/307180387.db2.gz	TWHLPVPDYYFKIS-ZIAGYGMSSA-N	1	1	308.382	1.930	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000373269964	307183125	/nfs/dbraw/zinc/18/31/25/307183125.db2.gz	IPWYIMZGESAPDA-AWEZNQCLSA-N	1	1	307.306	1.850	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000373269964	307183126	/nfs/dbraw/zinc/18/31/26/307183126.db2.gz	IPWYIMZGESAPDA-AWEZNQCLSA-N	1	1	307.306	1.850	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373938065	307198197	/nfs/dbraw/zinc/19/81/97/307198197.db2.gz	MJVAOBUTAYURIQ-RYUDHWBXSA-N	1	1	304.350	1.655	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H](CO)C1	ZINC000374052573	307200834	/nfs/dbraw/zinc/20/08/34/307200834.db2.gz	VSRKLTILUHHPJM-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H](CO)C1	ZINC000374052573	307200835	/nfs/dbraw/zinc/20/08/35/307200835.db2.gz	VSRKLTILUHHPJM-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(Cc1ccccn1)[C@H]1CCC[NH2+]CC1	ZINC000375270752	307219997	/nfs/dbraw/zinc/21/99/97/307219997.db2.gz	VSNQKELPBSFYLM-ZNMIVQPWSA-N	1	1	318.377	1.218	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)C[C@@H]21	ZINC000376662927	307252307	/nfs/dbraw/zinc/25/23/07/307252307.db2.gz	DANQRIJTORCLAL-GWCFXTLKSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+](C)C	ZINC000514517485	307400153	/nfs/dbraw/zinc/40/01/53/307400153.db2.gz	XZDPZKQWMKVGTM-GFCCVEGCSA-N	1	1	306.322	1.559	20	5		DDBDMO
C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000535958036	307662388	/nfs/dbraw/zinc/66/23/88/307662388.db2.gz	ASLFZNNVNBLOEY-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000573705986	308249727	/nfs/dbraw/zinc/24/97/27/308249727.db2.gz	KWTPKWXLRUFQKN-NSHDSACASA-N	1	1	322.365	1.642	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000488736785	484216680	/nfs/dbraw/zinc/21/66/80/484216680.db2.gz	QYWDMGOFQQFENW-FRRDWIJNSA-N	1	1	310.350	1.037	20	5		DDBDMO
COC(=O)c1ccc(OC[C@@H](O)C[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000589583757	490359283	/nfs/dbraw/zinc/35/92/83/490359283.db2.gz	UMPARBKBZQQRTN-NSHDSACASA-N	1	1	324.333	1.215	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[NH+]2CCSCC2)c([N+](=O)[O-])c1	ZINC000226230286	490701450	/nfs/dbraw/zinc/70/14/50/490701450.db2.gz	ZNAOTTPPAWLLIN-UHFFFAOYSA-N	1	1	312.351	1.964	20	5		DDBDMO
C[C@@H](CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C[NH+](C)C	ZINC000292665474	534072995	/nfs/dbraw/zinc/07/29/95/534072995.db2.gz	OSGJTDITBIFJRS-VIFPVBQESA-N	1	1	319.358	1.210	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000445132748	527929696	/nfs/dbraw/zinc/92/96/96/527929696.db2.gz	GYHZMFCAICFXRB-VHSXEESVSA-N	1	1	308.338	1.250	20	5		DDBDMO
CCC[N@@H+](CC)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000299407646	527963255	/nfs/dbraw/zinc/96/32/55/527963255.db2.gz	YFBDYGASAUEYNW-UHFFFAOYSA-N	1	1	309.322	1.994	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000746236289	700012789	/nfs/dbraw/zinc/01/27/89/700012789.db2.gz	WJJKZIGJLDQAGR-JTQLQIEISA-N	1	1	311.313	1.323	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964246	696378951	/nfs/dbraw/zinc/37/89/51/696378951.db2.gz	UJZCOFAZXRSHMP-CHWSQXEVSA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964246	696378953	/nfs/dbraw/zinc/37/89/53/696378953.db2.gz	UJZCOFAZXRSHMP-CHWSQXEVSA-N	1	1	323.397	1.766	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC000153538795	696916936	/nfs/dbraw/zinc/91/69/36/696916936.db2.gz	XBESYVHINLJIHS-LLVKDONJSA-N	1	1	322.321	1.669	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCc2ccccc2)CC1	ZINC000981137435	697015436	/nfs/dbraw/zinc/01/54/36/697015436.db2.gz	VGBCCNMCWKLDJN-HZPDHXFCSA-N	1	1	317.389	1.429	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCc2ccccc2)CC1	ZINC000981137435	697015440	/nfs/dbraw/zinc/01/54/40/697015440.db2.gz	VGBCCNMCWKLDJN-HZPDHXFCSA-N	1	1	317.389	1.429	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCc2ccccc2)CC1	ZINC000981137435	697015443	/nfs/dbraw/zinc/01/54/43/697015443.db2.gz	VGBCCNMCWKLDJN-HZPDHXFCSA-N	1	1	317.389	1.429	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]CC2CC3(CCC3)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983656974	697287183	/nfs/dbraw/zinc/28/71/83/697287183.db2.gz	FUZKKFTWWCXAHY-NMFUWQPSSA-N	1	1	321.421	1.716	20	5		DDBDMO
CCC(=O)N1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274963	698090924	/nfs/dbraw/zinc/09/09/24/698090924.db2.gz	DZARDDBCJNKOAX-HNNXBMFYSA-N	1	1	321.377	1.573	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274963	698090928	/nfs/dbraw/zinc/09/09/28/698090928.db2.gz	DZARDDBCJNKOAX-HNNXBMFYSA-N	1	1	321.377	1.573	20	5		DDBDMO
COCCO[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594001	698124073	/nfs/dbraw/zinc/12/40/73/698124073.db2.gz	QQMCHLJJVMRAAH-CVEARBPZSA-N	1	1	324.377	1.756	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCSC[C@@H]2CCO)c1	ZINC000750095181	700203431	/nfs/dbraw/zinc/20/34/31/700203431.db2.gz	WHGSUHRSMZVIKW-KBPBESRZSA-N	1	1	312.391	1.428	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000752291758	700353389	/nfs/dbraw/zinc/35/33/89/700353389.db2.gz	DXGNRVDTWGWIPH-UHFFFAOYSA-N	1	1	318.377	1.631	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)CC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000752743946	700384091	/nfs/dbraw/zinc/38/40/91/700384091.db2.gz	BSYDWPQUQNCJIN-ZDUSSCGKSA-N	1	1	321.377	1.803	20	5		DDBDMO
O=c1[nH]ccc2c1C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000755208488	700556221	/nfs/dbraw/zinc/55/62/21/700556221.db2.gz	XWKUGUKDHQKDKC-HNNXBMFYSA-N	1	1	315.329	1.787	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OCCCn2cc[nH+]c2C)n1	ZINC000755565362	700570873	/nfs/dbraw/zinc/57/08/73/700570873.db2.gz	XIVGXIAMFOLCIY-UHFFFAOYSA-N	1	1	307.310	1.563	20	5		DDBDMO
Cc1cc2c(cc1[N+](=O)[O-])N(C[C@@H](O)C[N@H+](C)C1CC1)CC2	ZINC000809970534	701707796	/nfs/dbraw/zinc/70/77/96/701707796.db2.gz	CBKZUOAUHXFUFF-AWEZNQCLSA-N	1	1	305.378	1.721	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879318739	706648132	/nfs/dbraw/zinc/64/81/32/706648132.db2.gz	ZXQJKCVZBWBBBP-XNRPHZJLSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3nc4sccn4c3[N+](=O)[O-])CC[C@H]21	ZINC000866207487	706649251	/nfs/dbraw/zinc/64/92/51/706649251.db2.gz	PMBFWAWYQMDZMM-VHSXEESVSA-N	1	1	307.379	1.834	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC000816953655	702237938	/nfs/dbraw/zinc/23/79/38/702237938.db2.gz	LOOSPBQXZXQKGV-IAQYHMDHSA-N	1	1	318.377	1.437	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000842624161	702744728	/nfs/dbraw/zinc/74/47/28/702744728.db2.gz	NDDLFUFCAWFUFM-MRXNPFEDSA-N	1	1	316.361	1.823	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@]2(O)CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000842624161	702744729	/nfs/dbraw/zinc/74/47/29/702744729.db2.gz	NDDLFUFCAWFUFM-MRXNPFEDSA-N	1	1	316.361	1.823	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@]2(CC2(F)F)C1	ZINC000844441827	703032154	/nfs/dbraw/zinc/03/21/54/703032154.db2.gz	UJRPJMOVKOXMNE-CYBMUJFWSA-N	1	1	313.304	1.878	20	5		DDBDMO
C[N@H+]1CCN(Cn2nccc2[N+](=O)[O-])[C@@H](Cc2ccccc2)C1	ZINC000844743490	703067409	/nfs/dbraw/zinc/06/74/09/703067409.db2.gz	YMZBSWXSTSUGFG-HNNXBMFYSA-N	1	1	315.377	1.608	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485943	703556064	/nfs/dbraw/zinc/55/60/64/703556064.db2.gz	BEDOXGMMEVRBFL-WFASDCNBSA-N	1	1	321.377	1.835	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485943	703556066	/nfs/dbraw/zinc/55/60/66/703556066.db2.gz	BEDOXGMMEVRBFL-WFASDCNBSA-N	1	1	321.377	1.835	20	5		DDBDMO
COCC[N@@H+](CCF)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000852480199	704058086	/nfs/dbraw/zinc/05/80/86/704058086.db2.gz	PYBYDABIHBXPKO-UHFFFAOYSA-N	1	1	313.329	1.841	20	5		DDBDMO
COC[C@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870886300	704157939	/nfs/dbraw/zinc/15/79/39/704157939.db2.gz	CRFDFFPHGWWVQO-LRDDRELGSA-N	1	1	321.377	1.654	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000880304418	706934723	/nfs/dbraw/zinc/93/47/23/706934723.db2.gz	ZBYNYGHSROJGAJ-JTQLQIEISA-N	1	1	308.260	1.445	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000880304418	706934728	/nfs/dbraw/zinc/93/47/28/706934728.db2.gz	ZBYNYGHSROJGAJ-JTQLQIEISA-N	1	1	308.260	1.445	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179357	705163360	/nfs/dbraw/zinc/16/33/60/705163360.db2.gz	MBSPJRJIJYEQHA-HOTGVXAUSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179357	705163361	/nfs/dbraw/zinc/16/33/61/705163361.db2.gz	MBSPJRJIJYEQHA-HOTGVXAUSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179357	705163364	/nfs/dbraw/zinc/16/33/64/705163364.db2.gz	MBSPJRJIJYEQHA-HOTGVXAUSA-N	1	1	307.394	1.900	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825118403	705604065	/nfs/dbraw/zinc/60/40/65/705604065.db2.gz	SMTZNJCTSZGBEJ-RBSFLKMASA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825776604	705729671	/nfs/dbraw/zinc/72/96/71/705729671.db2.gz	JUIRMXGUFHTWHE-HIFRSBDPSA-N	1	1	319.361	1.229	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000827329451	705977035	/nfs/dbraw/zinc/97/70/35/705977035.db2.gz	GPTJISULARIDQJ-CHWSQXEVSA-N	1	1	319.361	1.770	20	5		DDBDMO
CCOC(=O)[C@H](C)C1C[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000871993204	707272659	/nfs/dbraw/zinc/27/26/59/707272659.db2.gz	MQTQIZYNXVNXQL-IAQYHMDHSA-N	1	1	322.361	1.759	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000828095282	706117591	/nfs/dbraw/zinc/11/75/91/706117591.db2.gz	LWXFGHNKNAAQTN-TYNCELHUSA-N	1	1	321.377	1.569	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@]3(CCSC3)C2)cc1	ZINC000829261953	706310953	/nfs/dbraw/zinc/31/09/53/706310953.db2.gz	QRXDTIZWXNGNJY-CABCVRRESA-N	1	1	324.402	1.836	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@]3(CCSC3)C2)cc1	ZINC000829261953	706310955	/nfs/dbraw/zinc/31/09/55/706310955.db2.gz	QRXDTIZWXNGNJY-CABCVRRESA-N	1	1	324.402	1.836	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@]1(O)CCc2ccccc21	ZINC000829337406	706320943	/nfs/dbraw/zinc/32/09/43/706320943.db2.gz	GTIXNJDWGJTBGY-MRXNPFEDSA-N	1	1	316.361	1.557	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000830015879	706438073	/nfs/dbraw/zinc/43/80/73/706438073.db2.gz	GFDYBIMLQOTUNX-XPTSAGLGSA-N	1	1	307.325	1.946	20	5		DDBDMO
Cn1nnnc1CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000878679149	706466732	/nfs/dbraw/zinc/46/67/32/706466732.db2.gz	UJQDLLHFIRTDMZ-ZDUSSCGKSA-N	1	1	316.365	1.540	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137798	706887388	/nfs/dbraw/zinc/88/73/88/706887388.db2.gz	KVMDWBWLQJUECK-ARFHVFGLSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137798	706887394	/nfs/dbraw/zinc/88/73/94/706887394.db2.gz	KVMDWBWLQJUECK-ARFHVFGLSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137798	706887399	/nfs/dbraw/zinc/88/73/99/706887399.db2.gz	KVMDWBWLQJUECK-ARFHVFGLSA-N	1	1	305.378	1.797	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000880148200	706892692	/nfs/dbraw/zinc/89/26/92/706892692.db2.gz	SYCXPVRGVVWPLU-CHWSQXEVSA-N	1	1	324.377	1.427	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880434018	706974457	/nfs/dbraw/zinc/97/44/57/706974457.db2.gz	VOMMNTDVPXIFIM-QLFBSQMISA-N	1	1	310.350	1.364	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC[C@H]21	ZINC000872726655	707574160	/nfs/dbraw/zinc/57/41/60/707574160.db2.gz	UEAOAUKBONLFGV-DZGCQCFKSA-N	1	1	315.377	1.928	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000837184906	707592916	/nfs/dbraw/zinc/59/29/16/707592916.db2.gz	PBXCTGNZFLQMPV-LBPRGKRZSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000872772923	707593898	/nfs/dbraw/zinc/59/38/98/707593898.db2.gz	CLYASZUFHAARQL-LLVKDONJSA-N	1	1	319.365	1.994	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000872772923	707593904	/nfs/dbraw/zinc/59/39/04/707593904.db2.gz	CLYASZUFHAARQL-LLVKDONJSA-N	1	1	319.365	1.994	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1nc2ccccn2c1[N+](=O)[O-]	ZINC000872781391	707597522	/nfs/dbraw/zinc/59/75/22/707597522.db2.gz	SNOOOTIVEXZASB-NEPJUHHUSA-N	1	1	301.350	1.915	20	5		DDBDMO
CC1CC[NH+](Cc2cn(CCn3cc([N+](=O)[O-])cn3)nn2)CC1	ZINC000883995581	708096422	/nfs/dbraw/zinc/09/64/22/708096422.db2.gz	SQXSAZPUPOTOFQ-UHFFFAOYSA-N	1	1	319.369	1.315	20	5		DDBDMO
Cc1cnc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897221609	708259262	/nfs/dbraw/zinc/25/92/62/708259262.db2.gz	NSDXAKLRZJVJLE-OLZOCXBDSA-N	1	1	306.366	1.334	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@@H](CO)C[C@H]3CCCO3)c2c1	ZINC000884614247	708339267	/nfs/dbraw/zinc/33/92/67/708339267.db2.gz	IITSMZHKAPYOBM-DGCLKSJQSA-N	1	1	317.345	1.907	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1C[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000897617867	708395152	/nfs/dbraw/zinc/39/51/52/708395152.db2.gz	FZIIZTVLGIPJGO-BETUJISGSA-N	1	1	324.402	1.688	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000897617867	708395156	/nfs/dbraw/zinc/39/51/56/708395156.db2.gz	FZIIZTVLGIPJGO-BETUJISGSA-N	1	1	324.402	1.688	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1	ZINC000887934918	709171231	/nfs/dbraw/zinc/17/12/31/709171231.db2.gz	ZQEMBTOGDZLXQJ-WBMJQRKESA-N	1	1	303.362	1.927	20	5		DDBDMO
Cc1c(NC(=O)C[C@]2(O)CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000899936072	709242906	/nfs/dbraw/zinc/24/29/06/709242906.db2.gz	PHZBTSGRNWHWMH-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2c3cc(F)ccc3ncc2[N+](=O)[O-])C1	ZINC000893186702	710568333	/nfs/dbraw/zinc/56/83/33/710568333.db2.gz	BBJCHRLMHFTBLK-OAHLLOKOSA-N	1	1	320.324	1.183	20	5		DDBDMO
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@H+]1C	ZINC000928560791	713227001	/nfs/dbraw/zinc/22/70/01/713227001.db2.gz	VLOUWVGMLIPRFL-ZFWWWQNUSA-N	1	1	305.378	1.984	20	5		DDBDMO
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@@H+]1C	ZINC000928569792	713232774	/nfs/dbraw/zinc/23/27/74/713232774.db2.gz	RGLXLMCQQFYNDL-PWSUYJOCSA-N	1	1	309.391	1.896	20	5		DDBDMO
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@H+]1C	ZINC000928569792	713232777	/nfs/dbraw/zinc/23/27/77/713232777.db2.gz	RGLXLMCQQFYNDL-PWSUYJOCSA-N	1	1	309.391	1.896	20	5		DDBDMO
CC(=O)c1ccc(N[C@H](C)[C@H]2C[N@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246142	711463807	/nfs/dbraw/zinc/46/38/07/711463807.db2.gz	LVWVGFMQPQAHIM-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246142	711463808	/nfs/dbraw/zinc/46/38/08/711463808.db2.gz	LVWVGFMQPQAHIM-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CN(C)CC[N@H+]1C	ZINC000895246827	711464632	/nfs/dbraw/zinc/46/46/32/711464632.db2.gz	QNLVKDDNNJISRN-IINYFYTJSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[N@H+](C)CCN1C	ZINC000895246827	711464635	/nfs/dbraw/zinc/46/46/35/711464635.db2.gz	QNLVKDDNNJISRN-IINYFYTJSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[N@@H+](C)CCN1C	ZINC000895246827	711464636	/nfs/dbraw/zinc/46/46/36/711464636.db2.gz	QNLVKDDNNJISRN-IINYFYTJSA-N	1	1	318.381	1.517	20	5		DDBDMO
Cc1cc(NC[C@H]2CC[N@@H+]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000895771042	711602092	/nfs/dbraw/zinc/60/20/92/711602092.db2.gz	FYMFXSRAIYMIBY-CQSZACIVSA-N	1	1	313.361	1.898	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[N@@H+](C)CCN1C	ZINC000896570061	711755056	/nfs/dbraw/zinc/75/50/56/711755056.db2.gz	XCFKTFONGULAJX-QMTHXVAHSA-N	1	1	324.356	1.098	20	5		DDBDMO
CCC[N@@H+](CC[N+](=O)[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000929526550	713630523	/nfs/dbraw/zinc/63/05/23/713630523.db2.gz	SHBQAMDDKSNGEP-GFCCVEGCSA-N	1	1	301.387	1.985	20	5		DDBDMO
CC(C)(C)OC(=O)NC[C@]12CCC[C@H]1C[N@@H+](CC[N+](=O)[O-])C2	ZINC000930848213	713936728	/nfs/dbraw/zinc/93/67/28/713936728.db2.gz	YWYDPDBTJGMAIO-WFASDCNBSA-N	1	1	313.398	1.890	20	5		DDBDMO
COc1cc(CN[C@H]2CC[N@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557439	714087759	/nfs/dbraw/zinc/08/77/59/714087759.db2.gz	OEOVQLIWOIYUAL-PWSUYJOCSA-N	1	1	309.366	1.794	20	5		DDBDMO
COc1cc(CN[C@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557439	714087760	/nfs/dbraw/zinc/08/77/60/714087760.db2.gz	OEOVQLIWOIYUAL-PWSUYJOCSA-N	1	1	309.366	1.794	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCc3nc[nH]c3C23CCC3)n1	ZINC000931678344	714158885	/nfs/dbraw/zinc/15/88/85/714158885.db2.gz	XXVNUTDLVQAOEJ-UHFFFAOYSA-N	1	1	302.338	1.452	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCc3nc[nH]c3C23CCC3)n1	ZINC000931678344	714158887	/nfs/dbraw/zinc/15/88/87/714158887.db2.gz	XXVNUTDLVQAOEJ-UHFFFAOYSA-N	1	1	302.338	1.452	20	5		DDBDMO
O=C1N[C@@H](C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)CO1	ZINC000932770793	714410220	/nfs/dbraw/zinc/41/02/20/714410220.db2.gz	RBZKDDOYIGFPHH-GFCCVEGCSA-N	1	1	306.322	1.310	20	5		DDBDMO
Cn1nccc1[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000933531149	714610426	/nfs/dbraw/zinc/61/04/26/714610426.db2.gz	LVFXMXXNZNGYNC-MRXNPFEDSA-N	1	1	316.361	1.944	20	5		DDBDMO
Cn1nccc1[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000933531149	714610427	/nfs/dbraw/zinc/61/04/27/714610427.db2.gz	LVFXMXXNZNGYNC-MRXNPFEDSA-N	1	1	316.361	1.944	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H]1CC[N@H+]1C	ZINC000925427316	714853340	/nfs/dbraw/zinc/85/33/40/714853340.db2.gz	ZXYAVHYVZNODNI-AWEZNQCLSA-N	1	1	306.366	1.483	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000934889911	714925108	/nfs/dbraw/zinc/92/51/08/714925108.db2.gz	KUJIQDSEROSXDY-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
O=[N+]([O-])c1ccnc(N2CC[NH+](CCc3ccccn3)CC2)c1	ZINC001165054700	722008457	/nfs/dbraw/zinc/00/84/57/722008457.db2.gz	YRAMDLABQMDYIN-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CCC1CC1	ZINC001039583641	735104341	/nfs/dbraw/zinc/10/43/41/735104341.db2.gz	SYHNUNMDKWWJIL-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CCC1CC1	ZINC001039583641	735104344	/nfs/dbraw/zinc/10/43/44/735104344.db2.gz	SYHNUNMDKWWJIL-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CCC1CC1	ZINC001039583641	735104346	/nfs/dbraw/zinc/10/43/46/735104346.db2.gz	SYHNUNMDKWWJIL-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
CC(=O)N1CCC(C[N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001029921176	741589748	/nfs/dbraw/zinc/58/97/48/741589748.db2.gz	RSOPWWUNVJEVPC-UHFFFAOYSA-N	1	1	309.370	1.019	20	5		DDBDMO
CC(=O)N1CCC(C[N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001029921176	741589750	/nfs/dbraw/zinc/58/97/50/741589750.db2.gz	RSOPWWUNVJEVPC-UHFFFAOYSA-N	1	1	309.370	1.019	20	5		DDBDMO
Cc1nc(NC(=O)c2cc(C[NH+](C)C)on2)ccc1[N+](=O)[O-]	ZINC001126706676	741790108	/nfs/dbraw/zinc/79/01/08/741790108.db2.gz	ACPHLXYKOFBDLU-UHFFFAOYSA-N	1	1	305.294	1.600	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(C2CCC2)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936250	742830699	/nfs/dbraw/zinc/83/06/99/742830699.db2.gz	CQWBTLYUZRGGBM-HZPDHXFCSA-N	1	1	317.389	1.825	20	5		DDBDMO
O=C(NC1CC[NH+](CCCC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002788970	743419209	/nfs/dbraw/zinc/41/92/09/743419209.db2.gz	QRUDWOPPVOEPKV-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001193897164	746230921	/nfs/dbraw/zinc/23/09/21/746230921.db2.gz	BKEPZGVATJVOPQ-GHMZBOCLSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C([C@@H]1CCCC[N@@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1)N1CCCC1	ZINC001169024988	762201794	/nfs/dbraw/zinc/20/17/94/762201794.db2.gz	IKACOTZHJRNTKI-ILXRZTDVSA-N	1	1	309.410	1.909	20	5		DDBDMO
CC(C)NC(=O)N[C@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169052516	762208282	/nfs/dbraw/zinc/20/82/82/762208282.db2.gz	GSFVCUQYRVUDRY-RDBSUJKOSA-N	1	1	312.414	1.604	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)c1	ZINC001169053572	762209235	/nfs/dbraw/zinc/20/92/35/762209235.db2.gz	ITPPFICTYNWZHF-VNHYZAJKSA-N	1	1	321.377	1.989	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@]3(C)C[NH+](C)C[C@@]3(C)C2)c1[N+](=O)[O-]	ZINC000823484733	758318860	/nfs/dbraw/zinc/31/88/60/758318860.db2.gz	SFZZBUBMNIXGRJ-GJZGRUSLSA-N	1	1	321.381	1.294	20	5		DDBDMO
[NH3+]Cc1ncn(-c2nc3ccccc3c(Cl)c2[N+](=O)[O-])n1	ZINC001157928157	767333526	/nfs/dbraw/zinc/33/35/26/767333526.db2.gz	DGOUSWWIEMMCIE-UHFFFAOYSA-N	1	1	304.697	1.836	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C12CCC(CC1)C2	ZINC001130291408	767413160	/nfs/dbraw/zinc/41/31/60/767413160.db2.gz	HVLFUTNYWLPYMV-UHFFFAOYSA-N	1	1	321.381	1.114	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC001096243571	768741345	/nfs/dbraw/zinc/74/13/45/768741345.db2.gz	YHSJPTHEBYJAMG-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
CCC1(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CCC1	ZINC001132576501	768997142	/nfs/dbraw/zinc/99/71/42/768997142.db2.gz	KOSSAILNFWBKHW-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
CCOCC[NH+]1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000216932515	770859346	/nfs/dbraw/zinc/85/93/46/770859346.db2.gz	MLDHACYSMUHHJJ-UHFFFAOYSA-N	1	1	311.357	1.888	20	5		DDBDMO
CNC(=O)C[N@H+](C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-]	ZINC001173183508	777035743	/nfs/dbraw/zinc/03/57/43/777035743.db2.gz	ZFOPACXRZOGJQF-SECBINFHSA-N	1	1	313.329	1.351	20	5		DDBDMO
CNC(=O)C[N@@H+](C)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-]	ZINC001173183508	777035750	/nfs/dbraw/zinc/03/57/50/777035750.db2.gz	ZFOPACXRZOGJQF-SECBINFHSA-N	1	1	313.329	1.351	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C[C@@H](O)CO)C(C)(C)C	ZINC001173222151	777055043	/nfs/dbraw/zinc/05/50/43/777055043.db2.gz	PNQWIGZJUBOLLT-SWLSCSKDSA-N	1	1	310.394	1.980	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CCNC(=O)[C@@H]2C1	ZINC001173235448	777064527	/nfs/dbraw/zinc/06/45/27/777064527.db2.gz	XENVBRJAJUWXLR-OSAQELSMSA-N	1	1	303.362	1.594	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCNc1ccccc1[N+](=O)[O-]	ZINC001101657547	777352588	/nfs/dbraw/zinc/35/25/88/777352588.db2.gz	CUCYMJSFOATKMH-UHFFFAOYSA-N	1	1	308.382	1.805	20	5		DDBDMO
Cc1cc(NCCN(C)C(=O)C[N@H+](C)C(C)C)ncc1[N+](=O)[O-]	ZINC001101657572	777352947	/nfs/dbraw/zinc/35/29/47/777352947.db2.gz	DUYOMWARAXNOIR-UHFFFAOYSA-N	1	1	323.397	1.509	20	5		DDBDMO
Cc1cc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])on1	ZINC001178458328	779058100	/nfs/dbraw/zinc/05/81/00/779058100.db2.gz	ATYCBBJOHQMPED-ZIAGYGMSSA-N	1	1	324.381	1.414	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001119444481	781455186	/nfs/dbraw/zinc/45/51/86/781455186.db2.gz	ZNNWWYYEQHIKAM-HNNXBMFYSA-N	1	1	318.377	1.757	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])ccc1C	ZINC001267194313	837510152	/nfs/dbraw/zinc/51/01/52/837510152.db2.gz	NHIKWCBVCCJHMC-ZIAGYGMSSA-N	1	1	321.377	1.217	20	5		DDBDMO
COc1cc(C[N@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])ccc1C	ZINC001267194313	837510159	/nfs/dbraw/zinc/51/01/59/837510159.db2.gz	NHIKWCBVCCJHMC-ZIAGYGMSSA-N	1	1	321.377	1.217	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])ccc1C	ZINC001267194313	837510166	/nfs/dbraw/zinc/51/01/66/837510166.db2.gz	NHIKWCBVCCJHMC-ZIAGYGMSSA-N	1	1	321.377	1.217	20	5		DDBDMO
O=C(NC/C=C/C[NH2+]CCc1ccccc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001268543987	840422444	/nfs/dbraw/zinc/42/24/44/840422444.db2.gz	YFWJYDZPARIGDR-PRXHZCDDSA-N	1	1	321.352	1.295	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](C2CCC2)C1	ZINC001161176206	859944832	/nfs/dbraw/zinc/94/48/32/859944832.db2.gz	SZOUPKKMLWWOCT-JTQLQIEISA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1nc(Cl)c([N+](=O)[O-])c(NCC[NH+]2CCSCC2)n1	ZINC001157044439	863536076	/nfs/dbraw/zinc/53/60/76/863536076.db2.gz	WBJJSIBCVBMKKJ-UHFFFAOYSA-N	1	1	317.802	1.807	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001329416372	863654245	/nfs/dbraw/zinc/65/42/45/863654245.db2.gz	LLEKPUMEEMDPAA-GXTWGEPZSA-N	1	1	307.350	1.229	20	5		DDBDMO
O=C(NCCC[NH2+]CCCc1ccsc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767469	864118107	/nfs/dbraw/zinc/11/81/07/864118107.db2.gz	NQTMCSOVLVLZEF-CHWSQXEVSA-N	1	1	311.407	1.442	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCN(C#N)CC2)ncc1[N+](=O)[O-]	ZINC001159101613	865106779	/nfs/dbraw/zinc/10/67/79/865106779.db2.gz	KQXWTXXZEMVDEI-ONEGZZNKSA-N	1	1	302.338	1.125	20	5		DDBDMO
C[N@@H+]1CCC[C@](C)(Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C1	ZINC001162338206	867469400	/nfs/dbraw/zinc/46/94/00/867469400.db2.gz	YRTMQLZCZVDNLP-LBPRGKRZSA-N	1	1	300.746	1.778	20	5		DDBDMO
C[N@H+]1CCC[C@](C)(Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C1	ZINC001162338206	867469408	/nfs/dbraw/zinc/46/94/08/867469408.db2.gz	YRTMQLZCZVDNLP-LBPRGKRZSA-N	1	1	300.746	1.778	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC001335422080	868286486	/nfs/dbraw/zinc/28/64/86/868286486.db2.gz	QPNBIYDLVCBQAI-UKRRQHHQSA-N	1	1	318.377	1.483	20	5		DDBDMO
COc1cc(NCC2(N(C)C)CC[NH+](C)CC2)cnc1[N+](=O)[O-]	ZINC001164213573	869022561	/nfs/dbraw/zinc/02/25/61/869022561.db2.gz	WVWQACSTAGMYBI-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CCN(CCC(N)=O)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001166590008	870081516	/nfs/dbraw/zinc/08/15/16/870081516.db2.gz	SHNVWOMBWWPIOL-FNORWQNLSA-N	1	1	307.354	1.224	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1[N+](=O)[O-]	ZINC001339998975	870830478	/nfs/dbraw/zinc/83/04/78/870830478.db2.gz	LEMQLKCQLXUNRB-ADEWGFFLSA-N	1	1	320.349	1.529	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC001340021301	870845587	/nfs/dbraw/zinc/84/55/87/870845587.db2.gz	RTJBFQCCISPCDV-OLZOCXBDSA-N	1	1	322.413	1.038	20	5		DDBDMO
C[C@@H](NC(=O)NCC[N@H+]1CC[C@H](O)C1)c1ccccc1[N+](=O)[O-]	ZINC001313241629	871784553	/nfs/dbraw/zinc/78/45/53/871784553.db2.gz	FRHGCICRFHQHGU-NEPJUHHUSA-N	1	1	322.365	1.022	20	5		DDBDMO
C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC2(CCC2)C1	ZINC001316824309	872119397	/nfs/dbraw/zinc/11/93/97/872119397.db2.gz	WOIOAEQWCQRPJV-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1	ZINC001316824309	872119404	/nfs/dbraw/zinc/11/94/04/872119404.db2.gz	WOIOAEQWCQRPJV-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1	ZINC001316824309	872119407	/nfs/dbraw/zinc/11/94/07/872119407.db2.gz	WOIOAEQWCQRPJV-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001348560408	874633455	/nfs/dbraw/zinc/63/34/55/874633455.db2.gz	FNHQBVVRUDVVGE-UHFFFAOYSA-N	1	1	300.265	1.214	20	5		DDBDMO
C[N@H+]1CCC[C@@H](Oc2n[nH]c(=O)c3cccc([N+](=O)[O-])c32)C1	ZINC001229375063	883949032	/nfs/dbraw/zinc/94/90/32/883949032.db2.gz	VREIYJBGCJMSBG-SECBINFHSA-N	1	1	304.306	1.717	20	5		DDBDMO
COCCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001231010924	885133076	/nfs/dbraw/zinc/13/30/76/885133076.db2.gz	UOJZSLBGEZMTKT-UHFFFAOYSA-N	1	1	309.366	1.569	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O[C@H]2CC[N@H+](C(C)C)C2)n1	ZINC001234910144	888247144	/nfs/dbraw/zinc/24/71/44/888247144.db2.gz	MOLWHZHOCWYXPE-NSHDSACASA-N	1	1	323.353	1.513	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2CCOC[C@@H]2C1	ZINC001254553569	896499289	/nfs/dbraw/zinc/49/92/89/896499289.db2.gz	XNNUYBXZUJOEPM-ZFWWWQNUSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC(=O)N1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1C	ZINC001254606854	896527191	/nfs/dbraw/zinc/52/71/91/896527191.db2.gz	IQWMVIYCBAQFNT-ZBEGNZNMSA-N	1	1	303.362	1.615	20	5		DDBDMO
CC(=O)N1CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1C	ZINC001254606854	896527197	/nfs/dbraw/zinc/52/71/97/896527197.db2.gz	IQWMVIYCBAQFNT-ZBEGNZNMSA-N	1	1	303.362	1.615	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc(C[N+](=O)[O-])n2CC(C)C)C[C@H]1C	ZINC001263414579	900604948	/nfs/dbraw/zinc/60/49/48/900604948.db2.gz	FKEBXLRZUIAVFS-GFCCVEGCSA-N	1	1	310.402	1.241	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCN(C)c1ncc(C)cc1[N+](=O)[O-]	ZINC001263681078	900669453	/nfs/dbraw/zinc/66/94/53/900669453.db2.gz	XZDCVJKDEGBYDO-UHFFFAOYSA-N	1	1	323.397	1.192	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)n1	ZINC000248668918	282098052	/nfs/dbraw/zinc/09/80/52/282098052.db2.gz	PDMPXYUYXRYKGZ-MNOVXSKESA-N	1	1	309.370	1.223	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000305816309	231064933	/nfs/dbraw/zinc/06/49/33/231064933.db2.gz	ADQQDBQSJZQXCX-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cc2)CCCO1	ZINC000278770459	214388169	/nfs/dbraw/zinc/38/81/69/214388169.db2.gz	XVMYURDGSUSPBS-ZDUSSCGKSA-N	1	1	321.377	1.826	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1CCC2)c1ccc([N+](=O)[O-])cc1	ZINC000452184213	231327983	/nfs/dbraw/zinc/32/79/83/231327983.db2.gz	RFGYLYCKLAEGKR-SWLSCSKDSA-N	1	1	318.377	1.162	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O	ZINC000305806502	529984633	/nfs/dbraw/zinc/98/46/33/529984633.db2.gz	KCGGJXJDSFVEFN-UKRRQHHQSA-N	1	1	321.377	1.677	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000279708062	215079438	/nfs/dbraw/zinc/07/94/38/215079438.db2.gz	HRPSJSAVIJIJMO-OCCSQVGLSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358417589	299147783	/nfs/dbraw/zinc/14/77/83/299147783.db2.gz	WWHRGKHIDSAFOD-UHFFFAOYSA-N	1	1	306.297	1.598	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000048428790	352539981	/nfs/dbraw/zinc/53/99/81/352539981.db2.gz	OHZROAPWCNSCHH-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C(N)=O)CC1	ZINC000021847343	352174771	/nfs/dbraw/zinc/17/47/71/352174771.db2.gz	IXRVXUICYBKVER-SNVBAGLBSA-N	1	1	320.349	1.119	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000028013114	352225967	/nfs/dbraw/zinc/22/59/67/352225967.db2.gz	VKVRQILRABDBTC-CYBMUJFWSA-N	1	1	321.377	1.681	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](O)C1	ZINC000041886271	352317416	/nfs/dbraw/zinc/31/74/16/352317416.db2.gz	KXTQGDIXDZKNRI-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
CS(=O)(=O)NC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000054146204	352680202	/nfs/dbraw/zinc/68/02/02/352680202.db2.gz	GAIVUBUCIZAOOL-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000491561348	234204641	/nfs/dbraw/zinc/20/46/41/234204641.db2.gz	JRXKHSIFJNDSNL-UJYKQDJBSA-N	1	1	301.346	1.961	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-]	ZINC000491577355	234207298	/nfs/dbraw/zinc/20/72/98/234207298.db2.gz	VRKSHLLSOWRYBQ-DUMNWFOQSA-N	1	1	307.325	1.910	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000064334047	352933717	/nfs/dbraw/zinc/93/37/17/352933717.db2.gz	YZGJWVLRKDKTSD-RYUDHWBXSA-N	1	1	305.334	1.188	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[C@@H]([NH+]2CC=CC2)C1	ZINC000173524195	198224026	/nfs/dbraw/zinc/22/40/26/198224026.db2.gz	WMBFFISTBZMPNB-GFCCVEGCSA-N	1	1	323.374	1.230	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C1	ZINC000174531263	198348192	/nfs/dbraw/zinc/34/81/92/198348192.db2.gz	DXTAZCXBYJHLBQ-ZDUSSCGKSA-N	1	1	323.397	1.290	20	5		DDBDMO
CNc1ccc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000075578238	353368591	/nfs/dbraw/zinc/36/85/91/353368591.db2.gz	CSAMOGBXVWTENF-SNVBAGLBSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[N@@H+](CCc1cccs1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075966663	353388621	/nfs/dbraw/zinc/38/86/21/353388621.db2.gz	LMBVKDVVQYGIIC-GFCCVEGCSA-N	1	1	310.379	1.388	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@](C)(O)C[NH+]2CCOCC2)c1	ZINC000088725772	353757821	/nfs/dbraw/zinc/75/78/21/353757821.db2.gz	DJHJPHFXXFFEFR-HNNXBMFYSA-N	1	1	309.366	1.398	20	5		DDBDMO
Cc1sc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833072	354222896	/nfs/dbraw/zinc/22/28/96/354222896.db2.gz	WIAREDSNPPBDEK-KWQFWETISA-N	1	1	313.379	1.414	20	5		DDBDMO
Cc1sc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833072	354222899	/nfs/dbraw/zinc/22/28/99/354222899.db2.gz	WIAREDSNPPBDEK-KWQFWETISA-N	1	1	313.379	1.414	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[N@H+](C)CCO1	ZINC000157514993	354225120	/nfs/dbraw/zinc/22/51/20/354225120.db2.gz	GGKZTTCZVMWCFS-RNCFNFMXSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[N@@H+](C)CCO1	ZINC000157514993	354225122	/nfs/dbraw/zinc/22/51/22/354225122.db2.gz	GGKZTTCZVMWCFS-RNCFNFMXSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000157813593	354226764	/nfs/dbraw/zinc/22/67/64/354226764.db2.gz	OLNGSEGAEQVKJF-TVQRCGJNSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000157813593	354226767	/nfs/dbraw/zinc/22/67/67/354226767.db2.gz	OLNGSEGAEQVKJF-TVQRCGJNSA-N	1	1	311.313	1.183	20	5		DDBDMO
NC(=O)N1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1	ZINC000255124641	354387548	/nfs/dbraw/zinc/38/75/48/354387548.db2.gz	JKQQLPCNERKTFS-UTCJRWHESA-N	1	1	304.350	1.694	20	5		DDBDMO
NC(=O)N1CCC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC1	ZINC000255124641	354387552	/nfs/dbraw/zinc/38/75/52/354387552.db2.gz	JKQQLPCNERKTFS-UTCJRWHESA-N	1	1	304.350	1.694	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2ccc([N+](=O)[O-])n2C)[nH+]1	ZINC000346269119	283042309	/nfs/dbraw/zinc/04/23/09/283042309.db2.gz	VOGMATLBOXFVOD-UHFFFAOYSA-N	1	1	303.322	1.479	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CCn1ccccc1=O	ZINC000586773416	354863686	/nfs/dbraw/zinc/86/36/86/354863686.db2.gz	UCFMUNBFYOUJRD-UHFFFAOYSA-N	1	1	301.346	1.931	20	5		DDBDMO
C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@H]1C[N@H+](C)CCO1	ZINC000588002840	354892260	/nfs/dbraw/zinc/89/22/60/354892260.db2.gz	VKCVGKITFHZQIL-PSASIEDQSA-N	1	1	323.378	1.731	20	5		DDBDMO
C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@H]1C[N@@H+](C)CCO1	ZINC000588002840	354892266	/nfs/dbraw/zinc/89/22/66/354892266.db2.gz	VKCVGKITFHZQIL-PSASIEDQSA-N	1	1	323.378	1.731	20	5		DDBDMO
COc1ccc(OCCN2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000590010310	355038954	/nfs/dbraw/zinc/03/89/54/355038954.db2.gz	AUZNHXZRCRARHM-SWLSCSKDSA-N	1	1	321.377	1.618	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC000590443745	355097431	/nfs/dbraw/zinc/09/74/31/355097431.db2.gz	GYHRDEWGBRZYHY-ZWNOBZJWSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000590445617	355098805	/nfs/dbraw/zinc/09/88/05/355098805.db2.gz	QZZRWDQHDMEHRP-CABZTGNLSA-N	1	1	319.317	1.100	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH3+])[C@@H](CC)C2)c1[N+](=O)[O-]	ZINC000592332240	355561281	/nfs/dbraw/zinc/56/12/81/355561281.db2.gz	IBHYNZFRMRFOPC-VHSXEESVSA-N	1	1	309.370	1.470	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000592533591	355618285	/nfs/dbraw/zinc/61/82/85/355618285.db2.gz	UMBNYLVHFREOQY-HXINVUTJSA-N	1	1	320.345	1.464	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000592533591	355618289	/nfs/dbraw/zinc/61/82/89/355618289.db2.gz	UMBNYLVHFREOQY-HXINVUTJSA-N	1	1	320.345	1.464	20	5		DDBDMO
CCn1cc(C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C(C)C)cn1	ZINC000593083069	355790276	/nfs/dbraw/zinc/79/02/76/355790276.db2.gz	YNSHOEIAANQNHW-UHFFFAOYSA-N	1	1	306.370	1.918	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2C[C@H]1C[S@@]2=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000593100115	355796549	/nfs/dbraw/zinc/79/65/49/355796549.db2.gz	CYJCOOKSANJNCT-MZFXBISCSA-N	1	1	323.374	1.129	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](C)[C@@H](C)[C@@H]2C)n1	ZINC000593188912	355820785	/nfs/dbraw/zinc/82/07/85/355820785.db2.gz	FGIUHUPMZOOEGL-VWYCJHECSA-N	1	1	309.370	1.364	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]2C)n1	ZINC000593188912	355820787	/nfs/dbraw/zinc/82/07/87/355820787.db2.gz	FGIUHUPMZOOEGL-VWYCJHECSA-N	1	1	309.370	1.364	20	5		DDBDMO
C[C@H](O)C[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000594062998	356104047	/nfs/dbraw/zinc/10/40/47/356104047.db2.gz	HNZPJQAWFBHXJY-NSHDSACASA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@H](O)C[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000594062998	356104052	/nfs/dbraw/zinc/10/40/52/356104052.db2.gz	HNZPJQAWFBHXJY-NSHDSACASA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H](O)C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000594064215	356104116	/nfs/dbraw/zinc/10/41/16/356104116.db2.gz	LMVISJBGXCYUIC-LLVKDONJSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000594064215	356104121	/nfs/dbraw/zinc/10/41/21/356104121.db2.gz	LMVISJBGXCYUIC-LLVKDONJSA-N	1	1	319.361	1.329	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(=O)NCC1CC1	ZINC000595035612	356375290	/nfs/dbraw/zinc/37/52/90/356375290.db2.gz	YCYUIZUUDFVXJO-JTQLQIEISA-N	1	1	307.350	1.780	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000595470276	356506137	/nfs/dbraw/zinc/50/61/37/356506137.db2.gz	SWJNAMGGXBDCDT-AWEZNQCLSA-N	1	1	320.393	1.921	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000081527545	192283862	/nfs/dbraw/zinc/28/38/62/192283862.db2.gz	TXNAAEADHMYQQJ-QWRGUYRKSA-N	1	1	322.365	1.236	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(Cc2onc(C)c2[N+](=O)[O-])CC1	ZINC000595550695	356545277	/nfs/dbraw/zinc/54/52/77/356545277.db2.gz	RWLRLECXOFFXSK-UHFFFAOYSA-N	1	1	312.370	1.434	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000081556903	192291218	/nfs/dbraw/zinc/29/12/18/192291218.db2.gz	CABBOCAVYDNVGV-SNVBAGLBSA-N	1	1	323.349	1.275	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595756961	356638548	/nfs/dbraw/zinc/63/85/48/356638548.db2.gz	JCBYJSKYENWWON-JRPNMDOOSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595756961	356638551	/nfs/dbraw/zinc/63/85/51/356638551.db2.gz	JCBYJSKYENWWON-JRPNMDOOSA-N	1	1	305.334	1.379	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC3(COC3)C2)cccc1[N+](=O)[O-]	ZINC000595832155	356668757	/nfs/dbraw/zinc/66/87/57/356668757.db2.gz	CQCWUBPFLIZVJV-GFCCVEGCSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC3(COC3)C2)cccc1[N+](=O)[O-]	ZINC000595832155	356668758	/nfs/dbraw/zinc/66/87/58/356668758.db2.gz	CQCWUBPFLIZVJV-GFCCVEGCSA-N	1	1	319.361	1.953	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNc2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC000596058040	356756110	/nfs/dbraw/zinc/75/61/10/356756110.db2.gz	BICKTEPHYLVGCW-LLVKDONJSA-N	1	1	310.354	1.464	20	5		DDBDMO
Nc1ccc(N2CC[NH+](Cc3ccsc3)CC2)nc1[N+](=O)[O-]	ZINC000596067060	356760551	/nfs/dbraw/zinc/76/05/51/356760551.db2.gz	JQZARLKBWMLTOB-UHFFFAOYSA-N	1	1	319.390	1.956	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596231110	356825523	/nfs/dbraw/zinc/82/55/23/356825523.db2.gz	IPXOQEINOZTXRS-LBPRGKRZSA-N	1	1	306.366	1.980	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000596815460	356984059	/nfs/dbraw/zinc/98/40/59/356984059.db2.gz	AJTQZUFRAYXIBV-LLVKDONJSA-N	1	1	321.381	1.654	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)n1	ZINC000597710894	357297509	/nfs/dbraw/zinc/29/75/09/357297509.db2.gz	PWZLBWNIGXGYAN-OAHLLOKOSA-N	1	1	321.381	1.369	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)c1	ZINC000597623878	357260483	/nfs/dbraw/zinc/26/04/83/357260483.db2.gz	CXXGIUJKUFBBPN-CYBMUJFWSA-N	1	1	318.377	1.023	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597855528	357358750	/nfs/dbraw/zinc/35/87/50/357358750.db2.gz	SFSOITPRPAABKW-LLVKDONJSA-N	1	1	323.397	1.487	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000597924830	357384418	/nfs/dbraw/zinc/38/44/18/357384418.db2.gz	LERFMYCKFFWOJZ-JTQLQIEISA-N	1	1	324.356	1.919	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000598600360	357648528	/nfs/dbraw/zinc/64/85/28/357648528.db2.gz	AVUSQFCIORDKOK-VHSXEESVSA-N	1	1	320.349	1.814	20	5		DDBDMO
CCC[N@H+]1CC[C@H](Nc2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000598632778	357662629	/nfs/dbraw/zinc/66/26/29/357662629.db2.gz	AVHCHJVHDCCVPJ-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(NCC[N@@H+]3CC[C@@H](O)C3)ccnc21	ZINC000599175508	357840549	/nfs/dbraw/zinc/84/05/49/357840549.db2.gz	DJRZHSQNWOPLFW-LLVKDONJSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000179396624	199028091	/nfs/dbraw/zinc/02/80/91/199028091.db2.gz	DRYJELRDPQEQBZ-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CCOC(=O)C[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000599412830	357925420	/nfs/dbraw/zinc/92/54/20/357925420.db2.gz	OWWAEGBLIQTIMQ-CYBMUJFWSA-N	1	1	310.350	1.383	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599644046	358004006	/nfs/dbraw/zinc/00/40/06/358004006.db2.gz	GXVUBBSHEIGVQM-GSJFWJNXSA-N	1	1	320.349	1.119	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000600472265	358233481	/nfs/dbraw/zinc/23/34/81/358233481.db2.gz	NMEXCWXHZFUUAV-LBPRGKRZSA-N	1	1	318.377	1.924	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(NCCC[NH+]3CCOCC3)c2c1	ZINC000601099114	358402245	/nfs/dbraw/zinc/40/22/45/358402245.db2.gz	SZXTULSLOAOYAK-UHFFFAOYSA-N	1	1	316.361	1.699	20	5		DDBDMO
C[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCS1(=O)=O	ZINC000601144584	358419015	/nfs/dbraw/zinc/41/90/15/358419015.db2.gz	VFJZELDAIYPJRY-SNVBAGLBSA-N	1	1	321.358	1.766	20	5		DDBDMO
Cc1cnn(C)c1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149164	358422529	/nfs/dbraw/zinc/42/25/29/358422529.db2.gz	KBOHWSPANIQUHP-OAHLLOKOSA-N	1	1	304.350	1.634	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601175891	358433792	/nfs/dbraw/zinc/43/37/92/358433792.db2.gz	RJFRCSYSFSARAW-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCO[C@@H](C(F)F)CC1	ZINC000601978649	358763653	/nfs/dbraw/zinc/76/36/53/358763653.db2.gz	ZPMJTWCVOOXDPB-LLVKDONJSA-N	1	1	317.292	1.113	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCO[C@@H](C(F)F)CC1	ZINC000601978649	358763655	/nfs/dbraw/zinc/76/36/55/358763655.db2.gz	ZPMJTWCVOOXDPB-LLVKDONJSA-N	1	1	317.292	1.113	20	5		DDBDMO
CN(C)C(=O)CC1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602596715	359061940	/nfs/dbraw/zinc/06/19/40/359061940.db2.gz	NONBLLGPQLXYNF-UHFFFAOYSA-N	1	1	309.370	1.019	20	5		DDBDMO
CO[C@@H](C[NH+]1CC(Oc2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCOC1	ZINC000602689097	359127307	/nfs/dbraw/zinc/12/73/07/359127307.db2.gz	QSPULLAVXWQNIN-LRDDRELGSA-N	1	1	322.361	1.709	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1	ZINC000602801075	359201412	/nfs/dbraw/zinc/20/14/12/359201412.db2.gz	LFFDODLLVLXTAS-STQMWFEESA-N	1	1	310.398	1.829	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@]2(C1)CCC[N@H+](C)C2	ZINC000602830968	359222234	/nfs/dbraw/zinc/22/22/34/359222234.db2.gz	DEIURDBUBAQLQJ-OAHLLOKOSA-N	1	1	307.398	1.517	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1	ZINC000602957756	359321728	/nfs/dbraw/zinc/32/17/28/359321728.db2.gz	PQZMTIJVSZGBKZ-LBPRGKRZSA-N	1	1	321.381	1.526	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000602959327	359323002	/nfs/dbraw/zinc/32/30/02/359323002.db2.gz	SUJPMPJAUBQYMH-NWDGAFQWSA-N	1	1	321.381	1.667	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CC1(CO)CC1	ZINC000186788048	200010090	/nfs/dbraw/zinc/01/00/90/200010090.db2.gz	VEKWPGOFGVSNQW-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(CO)CC1	ZINC000186788048	200010092	/nfs/dbraw/zinc/01/00/92/200010092.db2.gz	VEKWPGOFGVSNQW-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000189072010	200343968	/nfs/dbraw/zinc/34/39/68/200343968.db2.gz	ZOATZZNGEBCZKP-CQSZACIVSA-N	1	1	311.313	1.519	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000609383096	360302524	/nfs/dbraw/zinc/30/25/24/360302524.db2.gz	IZNVBMPHZPZDAV-ZDUSSCGKSA-N	1	1	319.361	1.818	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](CCCO)C2CC2)c1	ZINC000609848231	360355997	/nfs/dbraw/zinc/35/59/97/360355997.db2.gz	MPJGUSOVMNTSKN-CQSZACIVSA-N	1	1	310.350	1.181	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000610476249	360444536	/nfs/dbraw/zinc/44/45/36/360444536.db2.gz	ODPPFBUNTHNTLP-GFCCVEGCSA-N	1	1	321.381	1.067	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000610476249	360444542	/nfs/dbraw/zinc/44/45/42/360444542.db2.gz	ODPPFBUNTHNTLP-GFCCVEGCSA-N	1	1	321.381	1.067	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCCC[C@H]2C[NH+](C)C)c1[N+](=O)[O-]	ZINC000610922099	360572184	/nfs/dbraw/zinc/57/21/84/360572184.db2.gz	ANARYLPPRVJBAZ-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611088222	360619984	/nfs/dbraw/zinc/61/99/84/360619984.db2.gz	KECHXNDXINQTIZ-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](CCO)C(C)(C)C1	ZINC000619531885	364050321	/nfs/dbraw/zinc/05/03/21/364050321.db2.gz	KGWNAAALAPEXCP-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
O=C(NCC[C@@H]1CC[NH2+]C1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000262607920	203349636	/nfs/dbraw/zinc/34/96/36/203349636.db2.gz	ZRCPIRQUDURCDM-VIFPVBQESA-N	1	1	303.322	1.201	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3=CCCOC3)C2)nc1	ZINC000093534726	193266605	/nfs/dbraw/zinc/26/66/05/193266605.db2.gz	YRXHSAWVDPWVEX-ZDUSSCGKSA-N	1	1	304.350	1.823	20	5		DDBDMO
CC[NH2+][C@@H](C)CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000359308057	299407016	/nfs/dbraw/zinc/40/70/16/299407016.db2.gz	NWVDDZFROPBYRU-QMMMGPOBSA-N	1	1	305.331	1.010	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000264658927	204059310	/nfs/dbraw/zinc/05/93/10/204059310.db2.gz	HTLUXMCQMZXWBQ-UHFFFAOYSA-N	1	1	306.326	1.205	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2ccc([N+](=O)[O-])s2)n1C	ZINC000265088847	204389720	/nfs/dbraw/zinc/38/97/20/204389720.db2.gz	BZNWFDJZKIYYML-UHFFFAOYSA-N	1	1	309.351	1.386	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000271739693	209171341	/nfs/dbraw/zinc/17/13/41/209171341.db2.gz	WBGYIAIZVOOHLF-GFCCVEGCSA-N	1	1	324.381	1.533	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000282495214	217040201	/nfs/dbraw/zinc/04/02/01/217040201.db2.gz	MXTIWGWHJQHXDP-LBPRGKRZSA-N	1	1	311.357	1.886	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1	ZINC000282496771	217040649	/nfs/dbraw/zinc/04/06/49/217040649.db2.gz	NAPSMDDDCFBNAH-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCn1ccc([N+](=O)[O-])n1	ZINC000282508105	217050292	/nfs/dbraw/zinc/05/02/92/217050292.db2.gz	RPXMNJLAYFTRHZ-UHFFFAOYSA-N	1	1	319.321	1.874	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H](C[NH+]3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000266057621	205063291	/nfs/dbraw/zinc/06/32/91/205063291.db2.gz	AFCCMVZUEGIFCK-GFCCVEGCSA-N	1	1	321.381	1.574	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000266344534	205281691	/nfs/dbraw/zinc/28/16/91/205281691.db2.gz	IROOQQWDJBTCCX-VXGBXAGGSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@@H](NCC1([NH+](C)C)CCOCC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000283884239	217797136	/nfs/dbraw/zinc/79/71/36/217797136.db2.gz	CFNAEXQJGOIBRD-GFCCVEGCSA-N	1	1	322.409	1.938	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000104687149	194026842	/nfs/dbraw/zinc/02/68/42/194026842.db2.gz	NNJWAKFPACRTTN-SECBINFHSA-N	1	1	309.322	1.992	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000104687152	194026851	/nfs/dbraw/zinc/02/68/51/194026851.db2.gz	NNJWAKFPACRTTN-VIFPVBQESA-N	1	1	309.322	1.992	20	5		DDBDMO
O=C(CC[N@@H+]1CCOCC12CC2)Nc1ccccc1[N+](=O)[O-]	ZINC000338596450	250047688	/nfs/dbraw/zinc/04/76/88/250047688.db2.gz	KGAGFVSYWHSIGD-UHFFFAOYSA-N	1	1	305.334	1.788	20	5		DDBDMO
O=C(CC[N@H+]1CCOCC12CC2)Nc1ccccc1[N+](=O)[O-]	ZINC000338596450	250047690	/nfs/dbraw/zinc/04/76/90/250047690.db2.gz	KGAGFVSYWHSIGD-UHFFFAOYSA-N	1	1	305.334	1.788	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000285380472	218406817	/nfs/dbraw/zinc/40/68/17/218406817.db2.gz	WLXVHSFMWGBZFQ-KGLIPLIRSA-N	1	1	305.334	1.140	20	5		DDBDMO
COc1cc(OCC(=O)NC[C@@H]2CC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000110654045	194346488	/nfs/dbraw/zinc/34/64/88/194346488.db2.gz	HNOAWEWQONQIDY-NSHDSACASA-N	1	1	323.349	1.050	20	5		DDBDMO
CCc1nn(C)c(NCCC[N@@H+](C)CCN(C)C)c1[N+](=O)[O-]	ZINC000341054077	251356908	/nfs/dbraw/zinc/35/69/08/251356908.db2.gz	QOQRJJMKPCREOB-UHFFFAOYSA-N	1	1	312.418	1.186	20	5		DDBDMO
CCc1nn(C)c(NCCCN(C)CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000341054077	251356912	/nfs/dbraw/zinc/35/69/12/251356912.db2.gz	QOQRJJMKPCREOB-UHFFFAOYSA-N	1	1	312.418	1.186	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000414205053	532996863	/nfs/dbraw/zinc/99/68/63/532996863.db2.gz	IICZGLNKFQFUDQ-NSHDSACASA-N	1	1	307.350	1.541	20	5		DDBDMO
COCC[NH2+]CCN[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1	ZINC000423326009	285081462	/nfs/dbraw/zinc/08/14/62/285081462.db2.gz	IWSCJUDQULLFTD-OLZOCXBDSA-N	1	1	311.386	1.101	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000352657374	285201446	/nfs/dbraw/zinc/20/14/46/285201446.db2.gz	ACMSNRVTKOAGIH-UONOGXRCSA-N	1	1	307.350	1.403	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000289671717	221144389	/nfs/dbraw/zinc/14/43/89/221144389.db2.gz	UVIRLTGVXZBWCR-LLVKDONJSA-N	1	1	315.395	1.602	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ncc([N+](=O)[O-])s1)C(C)C	ZINC000294911109	224304121	/nfs/dbraw/zinc/30/41/21/224304121.db2.gz	IFXCLRXCDHJCQJ-JTQLQIEISA-N	1	1	316.383	1.641	20	5		DDBDMO
CCn1ccnc1C[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000568384615	304290054	/nfs/dbraw/zinc/29/00/54/304290054.db2.gz	SMWHCTYCJXWNEX-CYBMUJFWSA-N	1	1	320.349	1.341	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cnccn3)C2)nc1	ZINC000568723180	304307476	/nfs/dbraw/zinc/30/74/76/304307476.db2.gz	NXMVFZKXWUXZBY-LLVKDONJSA-N	1	1	300.322	1.466	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](Cc3cnccn3)C2)nc1	ZINC000568723180	304307477	/nfs/dbraw/zinc/30/74/77/304307477.db2.gz	NXMVFZKXWUXZBY-LLVKDONJSA-N	1	1	300.322	1.466	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)c1	ZINC000127153028	286381610	/nfs/dbraw/zinc/38/16/10/286381610.db2.gz	SHAPRFFPQXLGMI-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)c1	ZINC000127153028	286381612	/nfs/dbraw/zinc/38/16/12/286381612.db2.gz	SHAPRFFPQXLGMI-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC[NH+]1CCCC1	ZINC000012141583	406835573	/nfs/dbraw/zinc/83/55/73/406835573.db2.gz	BXLBHAAOBCTDIL-UHFFFAOYSA-N	1	1	313.379	1.277	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000089420721	407133505	/nfs/dbraw/zinc/13/35/05/407133505.db2.gz	FRBACXVXZJLOHB-UHFFFAOYSA-N	1	1	303.322	1.894	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000089420721	407133507	/nfs/dbraw/zinc/13/35/07/407133507.db2.gz	FRBACXVXZJLOHB-UHFFFAOYSA-N	1	1	303.322	1.894	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)cc1C	ZINC000054371042	407184096	/nfs/dbraw/zinc/18/40/96/407184096.db2.gz	SZVGLQHGXZIALG-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@H](c1ccccc1)[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(N)=O	ZINC000123821918	407339561	/nfs/dbraw/zinc/33/95/61/407339561.db2.gz	OXQASRQCAZNFQS-GFCCVEGCSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[C@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(N)=O	ZINC000123821918	407339562	/nfs/dbraw/zinc/33/95/62/407339562.db2.gz	OXQASRQCAZNFQS-GFCCVEGCSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000124139031	407349552	/nfs/dbraw/zinc/34/95/52/407349552.db2.gz	KRJWTAFBIUUUJA-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000124139031	407349553	/nfs/dbraw/zinc/34/95/53/407349553.db2.gz	KRJWTAFBIUUUJA-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000124138852	407349603	/nfs/dbraw/zinc/34/96/03/407349603.db2.gz	KRJWTAFBIUUUJA-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000124138852	407349605	/nfs/dbraw/zinc/34/96/05/407349605.db2.gz	KRJWTAFBIUUUJA-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000104747483	407351793	/nfs/dbraw/zinc/35/17/93/407351793.db2.gz	SZGLRKYDHLVHDU-LLVKDONJSA-N	1	1	313.379	1.167	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000124657097	407365752	/nfs/dbraw/zinc/36/57/52/407365752.db2.gz	QQFZDHFRQCDQDG-NSHDSACASA-N	1	1	307.354	1.795	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000108341542	407384877	/nfs/dbraw/zinc/38/48/77/407384877.db2.gz	GJQQWLLMPAUIDF-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000108406005	407385773	/nfs/dbraw/zinc/38/57/73/407385773.db2.gz	VKVPKPDLTCPHOU-SECBINFHSA-N	1	1	319.408	1.276	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000111267858	407404310	/nfs/dbraw/zinc/40/43/10/407404310.db2.gz	JSHPOGOMCWTHSP-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCn1cccn1	ZINC000111283340	407406316	/nfs/dbraw/zinc/40/63/16/407406316.db2.gz	IQVSQHUFMPZHEC-GFCCVEGCSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCn1cccn1	ZINC000111283340	407406317	/nfs/dbraw/zinc/40/63/17/407406317.db2.gz	IQVSQHUFMPZHEC-GFCCVEGCSA-N	1	1	317.349	1.750	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])cc1OC	ZINC000271038722	407482201	/nfs/dbraw/zinc/48/22/01/407482201.db2.gz	MJLVXMNXHDERHN-NSHDSACASA-N	1	1	324.381	1.270	20	5		DDBDMO
C[N@H+]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000271063463	407493112	/nfs/dbraw/zinc/49/31/12/407493112.db2.gz	TUTUCRVLOMYTLN-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000271063463	407493118	/nfs/dbraw/zinc/49/31/18/407493118.db2.gz	TUTUCRVLOMYTLN-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000271063463	407493124	/nfs/dbraw/zinc/49/31/24/407493124.db2.gz	TUTUCRVLOMYTLN-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)CC[N@H+]1CCOC	ZINC000114709541	407602230	/nfs/dbraw/zinc/60/22/30/407602230.db2.gz	DWLIASOEEWXZNS-LBPRGKRZSA-N	1	1	311.386	1.184	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000153191978	407774021	/nfs/dbraw/zinc/77/40/21/407774021.db2.gz	WWPGNGLGERCYGL-ZWNOBZJWSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[N@@H+](CC(=O)NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000132713377	407800312	/nfs/dbraw/zinc/80/03/12/407800312.db2.gz	OMXMFSFETZVKET-CQSZACIVSA-N	1	1	323.418	1.691	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000272408076	407906565	/nfs/dbraw/zinc/90/65/65/407906565.db2.gz	KVIWHHHEFIZSBQ-UHFFFAOYSA-N	1	1	318.289	1.258	20	5		DDBDMO
CCCNC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866547	407959537	/nfs/dbraw/zinc/95/95/37/407959537.db2.gz	PWUCKKXBDFVMKJ-NSHDSACASA-N	1	1	307.354	1.002	20	5		DDBDMO
CCCNC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866547	407959543	/nfs/dbraw/zinc/95/95/43/407959543.db2.gz	PWUCKKXBDFVMKJ-NSHDSACASA-N	1	1	307.354	1.002	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000268267073	407980441	/nfs/dbraw/zinc/98/04/41/407980441.db2.gz	VYHAHPSRJSOCGV-UHFFFAOYSA-N	1	1	314.773	1.999	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000268276225	407982021	/nfs/dbraw/zinc/98/20/21/407982021.db2.gz	WGHODFVLYIRGOD-NHYWBVRUSA-N	1	1	303.362	1.736	20	5		DDBDMO
CS[C@H]1CCCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000134616602	407917632	/nfs/dbraw/zinc/91/76/32/407917632.db2.gz	OZUOWPPISNWEDN-STQMWFEESA-N	1	1	314.411	1.370	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000181663503	408024704	/nfs/dbraw/zinc/02/47/04/408024704.db2.gz	NLAFWVDQLQAKAA-JTQLQIEISA-N	1	1	321.333	1.395	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000182227612	408098669	/nfs/dbraw/zinc/09/86/69/408098669.db2.gz	ZDUIWRIHDVMCGY-CYBMUJFWSA-N	1	1	320.349	1.200	20	5		DDBDMO
C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CC(C)(C)O	ZINC000189876854	408126445	/nfs/dbraw/zinc/12/64/45/408126445.db2.gz	IFWHNSMIVFVGIJ-ZDUSSCGKSA-N	1	1	307.394	1.872	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)[C@@H]2CO)cccc1[N+](=O)[O-]	ZINC000190419971	408238929	/nfs/dbraw/zinc/23/89/29/408238929.db2.gz	DCRGXLTXMQCLSY-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc([C@@H](CO)[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176243423	408321808	/nfs/dbraw/zinc/32/18/08/408321808.db2.gz	DTEQQFHKMMYYSI-CQSZACIVSA-N	1	1	320.349	1.465	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000134708972	162085179	/nfs/dbraw/zinc/08/51/79/162085179.db2.gz	IZMWMRJFHTVUOP-CYBMUJFWSA-N	1	1	307.398	1.740	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCn3cncn3)CC2)c1	ZINC000264163979	408387597	/nfs/dbraw/zinc/38/75/97/408387597.db2.gz	YVPIOWVWAXDQPV-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000247225090	408433587	/nfs/dbraw/zinc/43/35/87/408433587.db2.gz	VXMYHPBLYAPWAB-ZYHUDNBSSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000247225090	408433592	/nfs/dbraw/zinc/43/35/92/408433592.db2.gz	VXMYHPBLYAPWAB-ZYHUDNBSSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cccc([N+](=O)[O-])c1N)C2	ZINC000177006782	408495107	/nfs/dbraw/zinc/49/51/07/408495107.db2.gz	ZJLWCNGZJSSHQY-WDEREUQCSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177133907	408530271	/nfs/dbraw/zinc/53/02/71/408530271.db2.gz	FNIMYLZJIQDGDJ-NWDGAFQWSA-N	1	1	319.361	1.715	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(N)=O	ZINC000191717731	408474603	/nfs/dbraw/zinc/47/46/03/408474603.db2.gz	GSPZUXBMSUZBRT-UHFFFAOYSA-N	1	1	308.338	1.039	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000161400894	408596322	/nfs/dbraw/zinc/59/63/22/408596322.db2.gz	BPZHPKOFDGUVHB-DOMZBBRYSA-N	1	1	305.378	1.982	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177154598	408536480	/nfs/dbraw/zinc/53/64/80/408536480.db2.gz	XZBJJXOBUOCYFP-GXSJLCMTSA-N	1	1	304.350	1.532	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000274802680	408538806	/nfs/dbraw/zinc/53/88/06/408538806.db2.gz	KVKVASOYUOJXAR-CYBMUJFWSA-N	1	1	322.365	1.745	20	5		DDBDMO
C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCC[C@H](C)C1	ZINC000162085752	408669419	/nfs/dbraw/zinc/66/94/19/408669419.db2.gz	DGUGWEBIWSYPPM-QWRGUYRKSA-N	1	1	309.370	1.179	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000270848151	408707093	/nfs/dbraw/zinc/70/70/93/408707093.db2.gz	GGODDCBHAVZKGY-LALPHHSUSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000270848151	408707101	/nfs/dbraw/zinc/70/71/01/408707101.db2.gz	GGODDCBHAVZKGY-LALPHHSUSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1O	ZINC000249550063	408740473	/nfs/dbraw/zinc/74/04/73/408740473.db2.gz	HPDTXANIZJCYTP-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](CCO)C2CCC2)c1	ZINC000275801256	408683106	/nfs/dbraw/zinc/68/31/06/408683106.db2.gz	GFYKAQXAXLMCLJ-AWEZNQCLSA-N	1	1	310.350	1.181	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC000265539314	408686906	/nfs/dbraw/zinc/68/69/06/408686906.db2.gz	ONOHXILRDFYWHE-SECBINFHSA-N	1	1	300.746	1.776	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC000265539314	408686911	/nfs/dbraw/zinc/68/69/11/408686911.db2.gz	ONOHXILRDFYWHE-SECBINFHSA-N	1	1	300.746	1.776	20	5		DDBDMO
CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000194856067	408800961	/nfs/dbraw/zinc/80/09/61/408800961.db2.gz	CTYSKZMVCOZWDY-HNNXBMFYSA-N	1	1	324.381	1.703	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000185215760	408781224	/nfs/dbraw/zinc/78/12/24/408781224.db2.gz	UYTKYHJSMOFMBR-SNVBAGLBSA-N	1	1	307.354	1.128	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC000286072305	408918238	/nfs/dbraw/zinc/91/82/38/408918238.db2.gz	VHIPUAMACQNBNY-GFCCVEGCSA-N	1	1	321.381	1.845	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000192487129	163225758	/nfs/dbraw/zinc/22/57/58/163225758.db2.gz	QLYIJVWOAOMSGY-PHIMTYICSA-N	1	1	305.334	1.237	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+]3CCCC[C@H]23)n1	ZINC000286253069	408949837	/nfs/dbraw/zinc/94/98/37/408949837.db2.gz	IVIYAXOHVIJSHQ-CMPLNLGQSA-N	1	1	320.349	1.815	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000277567932	408966188	/nfs/dbraw/zinc/96/61/88/408966188.db2.gz	KWUKJXAVIGEOEJ-GHMZBOCLSA-N	1	1	319.361	1.958	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]2CO)cn1	ZINC000277795428	409012573	/nfs/dbraw/zinc/01/25/73/409012573.db2.gz	OXEMMTOYRLKHDZ-HOCLYGCPSA-N	1	1	316.361	1.536	20	5		DDBDMO
Cc1cc(N2CC[C@H]3OCC[N@H+](C)[C@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000292336549	409026587	/nfs/dbraw/zinc/02/65/87/409026587.db2.gz	BCPJIDISWIIAHN-LSDHHAIUSA-N	1	1	309.341	1.952	20	5		DDBDMO
C[N@@H+](CCCOC(=O)NC(N)=O)CCc1cccc([N+](=O)[O-])c1	ZINC000282383962	409045452	/nfs/dbraw/zinc/04/54/52/409045452.db2.gz	GEYRYGFGOYMGMS-UHFFFAOYSA-N	1	1	324.337	1.264	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000283456457	409160070	/nfs/dbraw/zinc/16/00/70/409160070.db2.gz	LHYHJXPHZJOFTG-VIFPVBQESA-N	1	1	322.340	1.530	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000280721293	409424993	/nfs/dbraw/zinc/42/49/93/409424993.db2.gz	IAYJDADTFAWPQV-ZFWWWQNUSA-N	1	1	307.350	1.086	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432672	409624281	/nfs/dbraw/zinc/62/42/81/409624281.db2.gz	PMDHQMOOWZFLDO-RISCZKNCSA-N	1	1	305.334	1.014	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432672	409624289	/nfs/dbraw/zinc/62/42/89/409624289.db2.gz	PMDHQMOOWZFLDO-RISCZKNCSA-N	1	1	305.334	1.014	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000342437223	409628703	/nfs/dbraw/zinc/62/87/03/409628703.db2.gz	OBCHWSIXNNKURJ-PRHODGIISA-N	1	1	302.327	1.257	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000331533976	409611102	/nfs/dbraw/zinc/61/11/02/409611102.db2.gz	POWVGFFLXBATOO-RNCFNFMXSA-N	1	1	307.325	1.946	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000356825726	409641061	/nfs/dbraw/zinc/64/10/61/409641061.db2.gz	VKLAKELKKOXWLV-LBPRGKRZSA-N	1	1	309.366	1.819	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858126	409670470	/nfs/dbraw/zinc/67/04/70/409670470.db2.gz	UALMXNIVYYVRTN-UONOGXRCSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858126	409670481	/nfs/dbraw/zinc/67/04/81/409670481.db2.gz	UALMXNIVYYVRTN-UONOGXRCSA-N	1	1	323.349	1.401	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357038011	409810476	/nfs/dbraw/zinc/81/04/76/409810476.db2.gz	MXMJGVPQAQTVDH-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
CN(C(=O)c1c(N)cccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000354479353	409882984	/nfs/dbraw/zinc/88/29/84/409882984.db2.gz	NQKIWLYTLJJYEW-LLVKDONJSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000332238811	410005017	/nfs/dbraw/zinc/00/50/17/410005017.db2.gz	UEXCPKNCNOOZAN-NWDGAFQWSA-N	1	1	321.377	1.986	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687671	410083378	/nfs/dbraw/zinc/08/33/78/410083378.db2.gz	MIAQHRZRLVQGLS-ZOWXZIJZSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687671	410083387	/nfs/dbraw/zinc/08/33/87/410083387.db2.gz	MIAQHRZRLVQGLS-ZOWXZIJZSA-N	1	1	319.361	1.689	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000332683011	410208235	/nfs/dbraw/zinc/20/82/35/410208235.db2.gz	KCXWUEQKTVRBGN-LLVKDONJSA-N	1	1	309.370	1.132	20	5		DDBDMO
C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCC[C@@H](C)C1	ZINC000298755314	410382779	/nfs/dbraw/zinc/38/27/79/410382779.db2.gz	YACISCNPJBTAGD-MNOVXSKESA-N	1	1	321.381	1.621	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000299121869	410533323	/nfs/dbraw/zinc/53/33/23/410533323.db2.gz	VCXYSSMMDPPWCK-GFCCVEGCSA-N	1	1	323.397	1.418	20	5		DDBDMO
COc1c(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000355639643	410620584	/nfs/dbraw/zinc/62/05/84/410620584.db2.gz	ZGEHRGSFXXCANR-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000340098174	410675440	/nfs/dbraw/zinc/67/54/40/410675440.db2.gz	VVPHIMVYLITDJU-OCCSQVGLSA-N	1	1	320.393	1.919	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@@H+](C3CC3)CCO2)ccc1[N+](=O)[O-]	ZINC000301406053	410714767	/nfs/dbraw/zinc/71/47/67/410714767.db2.gz	UQAVZHSXEQHLTD-ZDUSSCGKSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@H+](C3CC3)CCO2)ccc1[N+](=O)[O-]	ZINC000301406053	410714775	/nfs/dbraw/zinc/71/47/75/410714775.db2.gz	UQAVZHSXEQHLTD-ZDUSSCGKSA-N	1	1	307.350	1.879	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCN(C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331126544	410965189	/nfs/dbraw/zinc/96/51/89/410965189.db2.gz	HTGIQLWNOLWQDX-LBPRGKRZSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331126544	410965192	/nfs/dbraw/zinc/96/51/92/410965192.db2.gz	HTGIQLWNOLWQDX-LBPRGKRZSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331126544	410965195	/nfs/dbraw/zinc/96/51/95/410965195.db2.gz	HTGIQLWNOLWQDX-LBPRGKRZSA-N	1	1	323.397	1.683	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331189892	411006230	/nfs/dbraw/zinc/00/62/30/411006230.db2.gz	ZTTJHIQPUJUPRU-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331189892	411006245	/nfs/dbraw/zinc/00/62/45/411006245.db2.gz	ZTTJHIQPUJUPRU-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331189892	411006251	/nfs/dbraw/zinc/00/62/51/411006251.db2.gz	ZTTJHIQPUJUPRU-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(O)CCC1	ZINC000353484549	411021501	/nfs/dbraw/zinc/02/15/01/411021501.db2.gz	QPVRBGQVLLGUAT-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356448572	411035980	/nfs/dbraw/zinc/03/59/80/411035980.db2.gz	RVVFLJZOBNDURV-NSHDSACASA-N	1	1	323.397	1.569	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000305452868	533680607	/nfs/dbraw/zinc/68/06/07/533680607.db2.gz	RZSRBBZBFMRICC-DOMZBBRYSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000305452868	533680610	/nfs/dbraw/zinc/68/06/10/533680610.db2.gz	RZSRBBZBFMRICC-DOMZBBRYSA-N	1	1	321.377	1.650	20	5		DDBDMO
CNc1nccc(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600311704	416617960	/nfs/dbraw/zinc/61/79/60/416617960.db2.gz	CEDWRHYLTIJWEK-NSHDSACASA-N	1	1	321.381	1.493	20	5		DDBDMO
COc1cc(CN2C[C@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000419344560	226125483	/nfs/dbraw/zinc/12/54/83/226125483.db2.gz	SAOSHEOHHYWYNH-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cn3)CC[C@@H]21	ZINC000366295037	418452893	/nfs/dbraw/zinc/45/28/93/418452893.db2.gz	PTQVWUVAGRYZJA-RISCZKNCSA-N	1	1	304.350	1.546	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3ccco3)C2)c1	ZINC000374139252	418494007	/nfs/dbraw/zinc/49/40/07/418494007.db2.gz	ABKDLWAHKNDYTF-YPMHNXCESA-N	1	1	306.322	1.235	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCOC2)O1	ZINC000366597763	418494922	/nfs/dbraw/zinc/49/49/22/418494922.db2.gz	VDYMIOUNMVACLX-AWEZNQCLSA-N	1	1	310.354	1.061	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CC[N@@H+](C)C1	ZINC000360872535	418537609	/nfs/dbraw/zinc/53/76/09/418537609.db2.gz	ODPISLRYXPUYCK-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@@H]1CC[N@H+](C)C1	ZINC000360872535	418537610	/nfs/dbraw/zinc/53/76/10/418537610.db2.gz	ODPISLRYXPUYCK-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H]3C(=O)NC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000368063184	418682544	/nfs/dbraw/zinc/68/25/44/418682544.db2.gz	MLSLBHXJOMLPQM-STQMWFEESA-N	1	1	319.361	1.561	20	5		DDBDMO
Nc1cc2c(nn1)CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2	ZINC000375786671	418685800	/nfs/dbraw/zinc/68/58/00/418685800.db2.gz	FMNYAYWNXZTLBJ-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
Nc1cc2c(nn1)CC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C2	ZINC000375786671	418685803	/nfs/dbraw/zinc/68/58/03/418685803.db2.gz	FMNYAYWNXZTLBJ-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](CC(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000368134957	418693870	/nfs/dbraw/zinc/69/38/70/418693870.db2.gz	NRKSZIISJLEGLB-SNVBAGLBSA-N	1	1	323.349	1.309	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2csc([N+](=O)[O-])c2)CCOC1	ZINC000361740257	418704183	/nfs/dbraw/zinc/70/41/83/418704183.db2.gz	HBMUBVIUEBNYPZ-GFCCVEGCSA-N	1	1	300.336	1.468	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000371232284	418770705	/nfs/dbraw/zinc/77/07/05/418770705.db2.gz	ROBIQQXDXUMAES-QWHCGFSZSA-N	1	1	319.361	1.892	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000427324490	419638490	/nfs/dbraw/zinc/63/84/90/419638490.db2.gz	MWISOVJMMYOAGZ-MNOVXSKESA-N	1	1	307.354	1.168	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000421878607	419754781	/nfs/dbraw/zinc/75/47/81/419754781.db2.gz	VPXCYXKCXKNFCY-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCOCC1	ZINC000421878607	419754789	/nfs/dbraw/zinc/75/47/89/419754789.db2.gz	VPXCYXKCXKNFCY-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[NH2+]C[C@@H](C)CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414844967	419836263	/nfs/dbraw/zinc/83/62/63/419836263.db2.gz	RZNNYFGZLKXWMH-GFCCVEGCSA-N	1	1	317.393	1.940	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000432249306	229090348	/nfs/dbraw/zinc/09/03/48/229090348.db2.gz	CUTUUKFJVVFKQQ-QWHCGFSZSA-N	1	1	321.377	1.833	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000299470091	229136891	/nfs/dbraw/zinc/13/68/91/229136891.db2.gz	BHEQUHMMTZGVCE-OLZOCXBDSA-N	1	1	321.381	1.233	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C)C1	ZINC000429027300	419964192	/nfs/dbraw/zinc/96/41/92/419964192.db2.gz	DRMGBCUDPQHEQX-RDBSUJKOSA-N	1	1	307.398	1.453	20	5		DDBDMO
CSC[C@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000429295840	419999106	/nfs/dbraw/zinc/99/91/06/419999106.db2.gz	BGXDXQPPLUGMSP-AAEUAGOBSA-N	1	1	314.411	1.227	20	5		DDBDMO
CCOc1ccc([C@H](C)[NH2+]C[C@H]2CNCCO2)cc1[N+](=O)[O-]	ZINC000423550558	420079567	/nfs/dbraw/zinc/07/95/67/420079567.db2.gz	FQCURCUGPJNMRL-WCQYABFASA-N	1	1	309.366	1.633	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CSC[NH2+]1	ZINC000423854803	420228803	/nfs/dbraw/zinc/22/88/03/420228803.db2.gz	VZHSLNOCVHATPY-SNVBAGLBSA-N	1	1	301.755	1.527	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000433847085	420255228	/nfs/dbraw/zinc/25/52/28/420255228.db2.gz	CMMMJRVOHNNBAT-GHMZBOCLSA-N	1	1	321.381	1.798	20	5		DDBDMO
CC[C@H]([NH2+]CCC(=O)N1CCNCC1)c1cccc([N+](=O)[O-])c1	ZINC000420393952	420260413	/nfs/dbraw/zinc/26/04/13/420260413.db2.gz	CFCOYKMFYXEVST-HNNXBMFYSA-N	1	1	320.393	1.457	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)NCC(F)(F)C[NH3+])c1	ZINC000420429145	420279686	/nfs/dbraw/zinc/27/96/86/420279686.db2.gz	TWXXIFYYOUPOEZ-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000457091918	420607963	/nfs/dbraw/zinc/60/79/63/420607963.db2.gz	NCESVUBDLGOOMX-LBPRGKRZSA-N	1	1	307.350	1.855	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000457091918	420607965	/nfs/dbraw/zinc/60/79/65/420607965.db2.gz	NCESVUBDLGOOMX-LBPRGKRZSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450958712	420571417	/nfs/dbraw/zinc/57/14/17/420571417.db2.gz	WOBSRJXFFUXILI-VIFPVBQESA-N	1	1	300.746	1.146	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450958712	420571421	/nfs/dbraw/zinc/57/14/21/420571421.db2.gz	WOBSRJXFFUXILI-VIFPVBQESA-N	1	1	300.746	1.146	20	5		DDBDMO
CC(C)c1ncc(C[N@H+](C)CCn2cc([N+](=O)[O-])cn2)cn1	ZINC000440464230	420578938	/nfs/dbraw/zinc/57/89/38/420578938.db2.gz	QNUJHSDDQUNLCG-UHFFFAOYSA-N	1	1	304.354	1.837	20	5		DDBDMO
CC(C)c1ncc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cn1	ZINC000440464230	420578942	/nfs/dbraw/zinc/57/89/42/420578942.db2.gz	QNUJHSDDQUNLCG-UHFFFAOYSA-N	1	1	304.354	1.837	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000492724684	420642772	/nfs/dbraw/zinc/64/27/72/420642772.db2.gz	ZUZLXQKUEMCSLT-LLPBQKLSSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000492724684	420642776	/nfs/dbraw/zinc/64/27/76/420642776.db2.gz	ZUZLXQKUEMCSLT-LLPBQKLSSA-N	1	1	319.361	1.133	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCC[N@@H+]1CCCO	ZINC000452781828	420659717	/nfs/dbraw/zinc/65/97/17/420659717.db2.gz	ISQXBOGSYLMJOX-HNNXBMFYSA-N	1	1	321.377	1.100	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000443712890	420753787	/nfs/dbraw/zinc/75/37/87/420753787.db2.gz	XJYOUMTZYMSTRM-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000493153065	420771185	/nfs/dbraw/zinc/77/11/85/420771185.db2.gz	BFQBXIWOCWCFPM-GQCTYLIASA-N	1	1	307.325	1.956	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000454747711	420918920	/nfs/dbraw/zinc/91/89/20/420918920.db2.gz	CAXAUMQMJWENAA-PWSUYJOCSA-N	1	1	319.365	1.388	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456019966	421090157	/nfs/dbraw/zinc/09/01/57/421090157.db2.gz	IOKUWNFUAOTOEZ-JOYOIKCWSA-N	1	1	319.365	1.244	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000488357853	421084734	/nfs/dbraw/zinc/08/47/34/421084734.db2.gz	QFCSTNSJFLIXKU-WFASDCNBSA-N	1	1	305.378	1.793	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000456343864	421146325	/nfs/dbraw/zinc/14/63/25/421146325.db2.gz	GTTOMRXRMQFSBP-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000521839203	421801296	/nfs/dbraw/zinc/80/12/96/421801296.db2.gz	QMIIWNPEQWXBOE-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000521839203	421801301	/nfs/dbraw/zinc/80/13/01/421801301.db2.gz	QMIIWNPEQWXBOE-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
CCn1ncnc1C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000574565845	422132224	/nfs/dbraw/zinc/13/22/24/422132224.db2.gz	FEJVBWTUGHCIEN-UHFFFAOYSA-N	1	1	318.337	1.325	20	5		DDBDMO
CCCN(C(=O)c1ccnc(NC)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000594373841	422347529	/nfs/dbraw/zinc/34/75/29/422347529.db2.gz	INSAVPVLOLSJBK-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](O)[C@H]1C	ZINC000590762471	422323326	/nfs/dbraw/zinc/32/33/26/422323326.db2.gz	ZPFWRVHBWHLIPB-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000341717923	271185396	/nfs/dbraw/zinc/18/53/96/271185396.db2.gz	YHYYTXDXFNHWEJ-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2nc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000341934866	271251375	/nfs/dbraw/zinc/25/13/75/271251375.db2.gz	YCWAQMNBLZTNBF-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000345995706	272385387	/nfs/dbraw/zinc/38/53/87/272385387.db2.gz	UKJCQTJZEKFKLP-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@H]21	ZINC000408404820	277124248	/nfs/dbraw/zinc/12/42/48/277124248.db2.gz	JWRRITFUDABSQC-ZIAGYGMSSA-N	1	1	304.350	1.082	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H](C)CO	ZINC000276184954	278394353	/nfs/dbraw/zinc/39/43/53/278394353.db2.gz	KUUOSNRVLYCABC-NXEZZACHSA-N	1	1	302.758	1.812	20	5		DDBDMO
Cc1oncc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000129081340	281331069	/nfs/dbraw/zinc/33/10/69/281331069.db2.gz	RPQNKHORYFZPFY-GFCCVEGCSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1oncc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000129081340	281331070	/nfs/dbraw/zinc/33/10/70/281331070.db2.gz	RPQNKHORYFZPFY-GFCCVEGCSA-N	1	1	303.322	1.973	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3ncc(Cl)cc3[N+](=O)[O-])C[C@@H]21	ZINC000285012776	290088345	/nfs/dbraw/zinc/08/83/45/290088345.db2.gz	MKUFLZVNNGCLAT-NWDGAFQWSA-N	1	1	312.757	1.553	20	5		DDBDMO
COc1cccc(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000194771724	295287615	/nfs/dbraw/zinc/28/76/15/295287615.db2.gz	ALINHKKVEDEFLC-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1csc([N+](=O)[O-])c1	ZINC000363143934	300219401	/nfs/dbraw/zinc/21/94/01/300219401.db2.gz	OBEHSWREMNLQJW-MNOVXSKESA-N	1	1	311.363	1.249	20	5		DDBDMO
CCOC(=O)[C@H](CC)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369670544	301209273	/nfs/dbraw/zinc/20/92/73/301209273.db2.gz	NTMBRNUCSOTJOL-LBPRGKRZSA-N	1	1	310.354	1.770	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@@H]32)c([N+](=O)[O-])c(=O)[nH]1	ZINC000370263413	301304556	/nfs/dbraw/zinc/30/45/56/301304556.db2.gz	XOXPIIFZKQIUQI-PWSUYJOCSA-N	1	1	320.349	1.170	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@H]32)c([N+](=O)[O-])c(=O)[nH]1	ZINC000370263414	301304882	/nfs/dbraw/zinc/30/48/82/301304882.db2.gz	XOXPIIFZKQIUQI-ZYHUDNBSSA-N	1	1	320.349	1.170	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000377468634	302181964	/nfs/dbraw/zinc/18/19/64/302181964.db2.gz	CIDNPQDIYJATOW-ZIAGYGMSSA-N	1	1	305.334	1.188	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2ccccn2)c1	ZINC000530963068	303222663	/nfs/dbraw/zinc/22/26/63/303222663.db2.gz	BJBIZILWCHPDFY-ZFWWWQNUSA-N	1	1	317.349	1.384	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21	ZINC000532873517	303300339	/nfs/dbraw/zinc/30/03/39/303300339.db2.gz	PCRBDDJMHNKITI-WCQYABFASA-N	1	1	306.366	1.490	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@]2(C1)CCCOC2	ZINC000367075221	307084734	/nfs/dbraw/zinc/08/47/34/307084734.db2.gz	SZKFUXDBSCDRJF-OAHLLOKOSA-N	1	1	307.350	1.259	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N3CCC[N@H+]4CCC[C@@H]4C3)nn21	ZINC000367303906	307091451	/nfs/dbraw/zinc/09/14/51/307091451.db2.gz	ZKKIDGQLFXTFDD-LLVKDONJSA-N	1	1	302.338	1.312	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3ccncc3)C2)c1	ZINC000570118846	308159768	/nfs/dbraw/zinc/15/97/68/308159768.db2.gz	YWHNPMKLKOUCEF-ZFWWWQNUSA-N	1	1	317.349	1.037	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC[N@@H+]3CCOC[C@H]3C1)CCCC2	ZINC000572116228	308211914	/nfs/dbraw/zinc/21/19/14/308211914.db2.gz	PJKPUYGVWIPGIN-CYBMUJFWSA-N	1	1	318.377	1.389	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC[N@H+]3CCOC[C@H]3C1)CCCC2	ZINC000572116228	308211916	/nfs/dbraw/zinc/21/19/16/308211916.db2.gz	PJKPUYGVWIPGIN-CYBMUJFWSA-N	1	1	318.377	1.389	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@H]2CC[N@@H+](C)C[C@H]21	ZINC000584649406	337380493	/nfs/dbraw/zinc/38/04/93/337380493.db2.gz	INEGSBQGXVAGSR-NEPJUHHUSA-N	1	1	309.370	1.029	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](n3cncn3)C2)c1	ZINC000372370478	483932599	/nfs/dbraw/zinc/93/25/99/483932599.db2.gz	UBSAKUIZRVSRHK-UONOGXRCSA-N	1	1	303.322	1.167	20	5		DDBDMO
C[C@@H]1[C@H](C)N(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@@H+]1C	ZINC000444688245	534249948	/nfs/dbraw/zinc/24/99/48/534249948.db2.gz	IXNNWQYUAJKGKC-MNOVXSKESA-N	1	1	303.366	1.996	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000451900814	534480954	/nfs/dbraw/zinc/48/09/54/534480954.db2.gz	MGBFDXBGVUIBOV-INIZCTEOSA-N	1	1	319.361	1.696	20	5		DDBDMO
Cc1nc(NCCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000297616124	534489364	/nfs/dbraw/zinc/48/93/64/534489364.db2.gz	VZNVLUZVPQHFFN-TXEJJXNPSA-N	1	1	323.397	1.995	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000451946885	527786461	/nfs/dbraw/zinc/78/64/61/527786461.db2.gz	NJCZRWCTJYVQNR-CHWSQXEVSA-N	1	1	306.322	1.365	20	5		DDBDMO
CC(C)C[C@@H](CNc1ncc([N+](=O)[O-])cn1)[NH+]1CCOCC1	ZINC000302077701	528329968	/nfs/dbraw/zinc/32/99/68/528329968.db2.gz	ANLCTQABXVHZMG-LBPRGKRZSA-N	1	1	309.370	1.544	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000746001443	700002205	/nfs/dbraw/zinc/00/22/05/700002205.db2.gz	FQEUAKVMIAODCJ-LLVKDONJSA-N	1	1	318.377	1.945	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000746001443	700002208	/nfs/dbraw/zinc/00/22/08/700002208.db2.gz	FQEUAKVMIAODCJ-LLVKDONJSA-N	1	1	318.377	1.945	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000072501211	696394124	/nfs/dbraw/zinc/39/41/24/696394124.db2.gz	FCFGLPDCEZTAIE-ZDUSSCGKSA-N	1	1	320.393	1.875	20	5		DDBDMO
Cc1ncc(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)o1	ZINC000985433233	697510598	/nfs/dbraw/zinc/51/05/98/697510598.db2.gz	JPUFURRSELCJTG-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1ncc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)o1	ZINC000985433233	697510600	/nfs/dbraw/zinc/51/06/00/697510600.db2.gz	JPUFURRSELCJTG-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1ncc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)o1	ZINC000985433233	697510602	/nfs/dbraw/zinc/51/06/02/697510602.db2.gz	JPUFURRSELCJTG-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
CC[N@@H+](C[C@@H]1CCOC1)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000749953227	700194497	/nfs/dbraw/zinc/19/44/97/700194497.db2.gz	CJFAQWQAHJMRJY-LBPRGKRZSA-N	1	1	319.365	1.964	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776582443	698121603	/nfs/dbraw/zinc/12/16/03/698121603.db2.gz	QOYVJOBTSZLIDS-JSGCOSHPSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676954	699237821	/nfs/dbraw/zinc/23/78/21/699237821.db2.gz	BLUNENGNZDEQNR-GXFFZTMASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676954	699237824	/nfs/dbraw/zinc/23/78/24/699237824.db2.gz	BLUNENGNZDEQNR-GXFFZTMASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000761074703	700839551	/nfs/dbraw/zinc/83/95/51/700839551.db2.gz	FDRSQCOXOXFEPJ-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000761074703	700839554	/nfs/dbraw/zinc/83/95/54/700839554.db2.gz	FDRSQCOXOXFEPJ-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000761074703	700839557	/nfs/dbraw/zinc/83/95/57/700839557.db2.gz	FDRSQCOXOXFEPJ-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[NH+](CCCCO)CC1	ZINC000804501841	701196455	/nfs/dbraw/zinc/19/64/55/701196455.db2.gz	FMTNSBFQFWDSEO-UHFFFAOYSA-N	1	1	321.377	1.692	20	5		DDBDMO
CNc1ccc(C(=O)OCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000771857141	701334426	/nfs/dbraw/zinc/33/44/26/701334426.db2.gz	YIOXTXJKATWQMD-UHFFFAOYSA-N	1	1	304.306	1.998	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cnn(C)n1	ZINC000806166994	701428414	/nfs/dbraw/zinc/42/84/14/701428414.db2.gz	FTPQVNRXFSHGIH-SNVBAGLBSA-N	1	1	318.337	1.230	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCC(=O)N1	ZINC000839671027	701776100	/nfs/dbraw/zinc/77/61/00/701776100.db2.gz	XXRQWNAXSOWXOL-UKRRQHHQSA-N	1	1	321.377	1.617	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2[C@@H](O)c2ccccc2)c1	ZINC000879245408	706627600	/nfs/dbraw/zinc/62/76/00/706627600.db2.gz	XLWALMHTLCZDBB-CVEARBPZSA-N	1	1	316.361	1.989	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866206651	706648381	/nfs/dbraw/zinc/64/83/81/706648381.db2.gz	FDJOIRCKPAVCPR-ZYHUDNBSSA-N	1	1	320.349	1.307	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000879320868	706648781	/nfs/dbraw/zinc/64/87/81/706648781.db2.gz	JSHBEQYEORECAY-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000817371916	702359316	/nfs/dbraw/zinc/35/93/16/702359316.db2.gz	FNIXVRPDFFUDAJ-AWEZNQCLSA-N	1	1	303.366	1.928	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C[C@H]1C1CC1	ZINC000844761504	703070311	/nfs/dbraw/zinc/07/03/11/703070311.db2.gz	KWOVKQHGMFHALF-QWHCGFSZSA-N	1	1	322.365	1.497	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C[C@H]1C1CC1	ZINC000844761504	703070314	/nfs/dbraw/zinc/07/03/14/703070314.db2.gz	KWOVKQHGMFHALF-QWHCGFSZSA-N	1	1	322.365	1.497	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000845721301	703193572	/nfs/dbraw/zinc/19/35/72/703193572.db2.gz	RLRGJZSPCLWBQN-SECBINFHSA-N	1	1	315.732	1.643	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000845721301	703193573	/nfs/dbraw/zinc/19/35/73/703193573.db2.gz	RLRGJZSPCLWBQN-SECBINFHSA-N	1	1	315.732	1.643	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000846972304	703359228	/nfs/dbraw/zinc/35/92/28/703359228.db2.gz	MMWKJAPOBYVRCG-DZGCQCFKSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@H+]1CC[C@H](CCOC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000847829082	703474180	/nfs/dbraw/zinc/47/41/80/703474180.db2.gz	WGCFVLPKXWUWTN-SNVBAGLBSA-N	1	1	322.317	1.822	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000848659582	703572830	/nfs/dbraw/zinc/57/28/30/703572830.db2.gz	MPSLQAVJWCFHTJ-RYUDHWBXSA-N	1	1	307.350	1.879	20	5		DDBDMO
COC(=O)N(C)CC[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1	ZINC000852570620	704077210	/nfs/dbraw/zinc/07/72/10/704077210.db2.gz	WXDHQBIKIAHSEB-UHFFFAOYSA-N	1	1	311.338	1.733	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1	ZINC000852570620	704077212	/nfs/dbraw/zinc/07/72/12/704077212.db2.gz	WXDHQBIKIAHSEB-UHFFFAOYSA-N	1	1	311.338	1.733	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCc3cn[nH]c3C2)cc1	ZINC000819154239	704077611	/nfs/dbraw/zinc/07/76/11/704077611.db2.gz	GCTPNVCFSNXMEI-DOMZBBRYSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000853966060	704341780	/nfs/dbraw/zinc/34/17/80/704341780.db2.gz	OJKQAYIGDGTFDD-GFCCVEGCSA-N	1	1	309.341	1.769	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000854497611	704408163	/nfs/dbraw/zinc/40/81/63/704408163.db2.gz	RZEMNJJXDOZEIK-JTQLQIEISA-N	1	1	310.379	1.553	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000854497611	704408164	/nfs/dbraw/zinc/40/81/64/704408164.db2.gz	RZEMNJJXDOZEIK-JTQLQIEISA-N	1	1	310.379	1.553	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000880439806	706976959	/nfs/dbraw/zinc/97/69/59/706976959.db2.gz	KKKXJTYLJFOVQR-UPJWGTAASA-N	1	1	310.350	1.180	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000874299305	705001748	/nfs/dbraw/zinc/00/17/48/705001748.db2.gz	QWYGBTHJIWWNFZ-UHFFFAOYSA-N	1	1	309.366	1.520	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1	ZINC000859888696	705030728	/nfs/dbraw/zinc/03/07/28/705030728.db2.gz	JJPXQCLLLDAOGW-CQHMPISHSA-N	1	1	324.402	1.614	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000874850728	705203647	/nfs/dbraw/zinc/20/36/47/705203647.db2.gz	WFPULLZBCUORJU-LSDHHAIUSA-N	1	1	303.362	1.832	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)c1ccccc1[N+](=O)[O-]	ZINC000861033762	705353665	/nfs/dbraw/zinc/35/36/65/705353665.db2.gz	RLEDZVYICMAXDP-LBPRGKRZSA-N	1	1	308.334	1.862	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000861342994	705434617	/nfs/dbraw/zinc/43/46/17/705434617.db2.gz	FZEDVKNEXREHRF-RISCZKNCSA-N	1	1	311.338	1.199	20	5		DDBDMO
Nc1ccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-]	ZINC000863033760	705853060	/nfs/dbraw/zinc/85/30/60/705853060.db2.gz	MFORKNSZYOBRSN-ZDUSSCGKSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@H]1C[C@@H](C(N)=O)C1	ZINC000863321930	705901255	/nfs/dbraw/zinc/90/12/55/705901255.db2.gz	ITSVMUWOIJSXHD-WVSHTKLVSA-N	1	1	303.322	1.098	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C[C@@H]12	ZINC000863338079	705905955	/nfs/dbraw/zinc/90/59/55/705905955.db2.gz	NZGSCJUXLLSTOF-ZYHUDNBSSA-N	1	1	302.290	1.007	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C[C@@H]12	ZINC000863338079	705905957	/nfs/dbraw/zinc/90/59/57/705905957.db2.gz	NZGSCJUXLLSTOF-ZYHUDNBSSA-N	1	1	302.290	1.007	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000877764461	706201128	/nfs/dbraw/zinc/20/11/28/706201128.db2.gz	CQVJCKFTLVUKMX-QDPHKQGLSA-N	1	1	306.362	1.531	20	5		DDBDMO
CC(C)[C@@H](O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000878251194	706338996	/nfs/dbraw/zinc/33/89/96/706338996.db2.gz	HPDSOKAPRYAFNY-OCCSQVGLSA-N	1	1	308.382	1.883	20	5		DDBDMO
Cc1ccc(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)cc1[N+](=O)[O-]	ZINC000880073588	706871527	/nfs/dbraw/zinc/87/15/27/706871527.db2.gz	IUWJFGLFQFMORU-LSDHHAIUSA-N	1	1	305.378	1.544	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1	ZINC000880171050	706900633	/nfs/dbraw/zinc/90/06/33/706900633.db2.gz	TVPVFGFZKGUDCG-UHFFFAOYSA-N	1	1	319.361	1.718	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1onc(C)c1[N+](=O)[O-])C2	ZINC000880329232	706942149	/nfs/dbraw/zinc/94/21/49/706942149.db2.gz	MTRLUCSFKKIXDB-HZMBPMFUSA-N	1	1	309.322	1.666	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC=C[C@H]1CO	ZINC000880489716	706992758	/nfs/dbraw/zinc/99/27/58/706992758.db2.gz	HSWPUFANEYSJAF-ZDUSSCGKSA-N	1	1	305.334	1.465	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000882489178	707660294	/nfs/dbraw/zinc/66/02/94/707660294.db2.gz	NRYBVLLZPIOUPU-CYBMUJFWSA-N	1	1	316.361	1.829	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000882766823	707784165	/nfs/dbraw/zinc/78/41/65/707784165.db2.gz	RROJMYAHURGION-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000882766823	707784169	/nfs/dbraw/zinc/78/41/69/707784169.db2.gz	RROJMYAHURGION-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)c(F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000839412162	708047030	/nfs/dbraw/zinc/04/70/30/708047030.db2.gz	NCUGJJSTEIIIMI-OQPBUACISA-N	1	1	311.288	1.649	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000883898311	708079324	/nfs/dbraw/zinc/07/93/24/708079324.db2.gz	XDVUSYLYTFAYMS-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=S)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000884004342	708098525	/nfs/dbraw/zinc/09/85/25/708098525.db2.gz	SZJNDARHAXPXCX-NSHDSACASA-N	1	1	323.422	1.948	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1cccc([N+](=O)[O-])c1Cl	ZINC000912603854	713044249	/nfs/dbraw/zinc/04/42/49/713044249.db2.gz	ORZJJTFVYFPRMC-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886212843	708716217	/nfs/dbraw/zinc/71/62/17/708716217.db2.gz	GWRMCJKZERTTKF-CYBMUJFWSA-N	1	1	320.393	1.675	20	5		DDBDMO
CC[N@@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000910283415	709863971	/nfs/dbraw/zinc/86/39/71/709863971.db2.gz	ZHRKATIYLLXRTA-LLVKDONJSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000910283415	709863977	/nfs/dbraw/zinc/86/39/77/709863977.db2.gz	ZHRKATIYLLXRTA-LLVKDONJSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(O)c(OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000891993969	710348897	/nfs/dbraw/zinc/34/88/97/710348897.db2.gz	XSTLUYDQYPHEJK-NSHDSACASA-N	1	1	309.366	1.835	20	5		DDBDMO
CCOCC[NH+]1CCN(c2ccc3nonc3c2[N+](=O)[O-])CC1	ZINC000892354165	710422223	/nfs/dbraw/zinc/42/22/23/710422223.db2.gz	JIKCJYMZYMXBLH-UHFFFAOYSA-N	1	1	321.337	1.290	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000892417502	710434087	/nfs/dbraw/zinc/43/40/87/710434087.db2.gz	DMUWNEBBPSAKRJ-BETUJISGSA-N	1	1	304.350	1.298	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)c1[N+](=O)[O-]	ZINC000893418025	710644497	/nfs/dbraw/zinc/64/44/97/710644497.db2.gz	NZBVVBPIHICVAZ-GHMZBOCLSA-N	1	1	310.350	1.902	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@H]1CC[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317500	711095764	/nfs/dbraw/zinc/09/57/64/711095764.db2.gz	LRRAXEWTSGNXDW-HUUCEWRRSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@H]1CC[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317500	711095767	/nfs/dbraw/zinc/09/57/67/711095767.db2.gz	LRRAXEWTSGNXDW-HUUCEWRRSA-N	1	1	315.377	1.711	20	5		DDBDMO
[NH3+][C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@H]1C(F)(F)F	ZINC000903513290	711161610	/nfs/dbraw/zinc/16/16/10/711161610.db2.gz	GNWHLOJKLMNJFU-NXEZZACHSA-N	1	1	305.256	1.622	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])C[C@@H]1CO	ZINC000894881680	711307214	/nfs/dbraw/zinc/30/72/14/711307214.db2.gz	OTSUZLLBFPBHOR-GFCCVEGCSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])C[C@@H]1CO	ZINC000894881680	711307217	/nfs/dbraw/zinc/30/72/17/711307217.db2.gz	OTSUZLLBFPBHOR-GFCCVEGCSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894885141	711308451	/nfs/dbraw/zinc/30/84/51/711308451.db2.gz	OOVAZUBFBILKGL-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894885141	711308454	/nfs/dbraw/zinc/30/84/54/711308454.db2.gz	OOVAZUBFBILKGL-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
O=c1[nH]ccc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c1[N+](=O)[O-]	ZINC000895570434	711545462	/nfs/dbraw/zinc/54/54/62/711545462.db2.gz	SYKVXOBFCDZVIF-KOLCDFICSA-N	1	1	310.379	1.687	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000896282428	711700541	/nfs/dbraw/zinc/70/05/41/711700541.db2.gz	NLZLSFFHEUXVDV-AWEZNQCLSA-N	1	1	321.377	1.963	20	5		DDBDMO
[NH3+][C@H]1C[C@@H](CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000904341061	711843369	/nfs/dbraw/zinc/84/33/69/711843369.db2.gz	OIVPMCNXVYOBRY-XBXGTLAGSA-N	1	1	318.377	1.090	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C	ZINC000908052256	712672219	/nfs/dbraw/zinc/67/22/19/712672219.db2.gz	CAOPPTACMUFTSA-GDBMZVCRSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000908512386	712793389	/nfs/dbraw/zinc/79/33/89/712793389.db2.gz	LBZJLXMFZLQIGH-VZJVUDMVSA-N	1	1	307.350	1.227	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2[C@@H](C)CCC[C@H]2CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000914444058	713396196	/nfs/dbraw/zinc/39/61/96/713396196.db2.gz	OVIGKETXHXVVDD-JQWIXIFHSA-N	1	1	323.397	1.961	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCCC[N@@H+]1CCCC[C@H]1C	ZINC000929399842	713604001	/nfs/dbraw/zinc/60/40/01/713604001.db2.gz	VVSCVUFZJXBRLW-GFCCVEGCSA-N	1	1	323.397	1.480	20	5		DDBDMO
CCOC(=O)/C=C\C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985542	713728736	/nfs/dbraw/zinc/72/87/36/713728736.db2.gz	BUQSPQPDYJHYCX-VSQXVHSFSA-N	1	1	320.349	1.595	20	5		DDBDMO
CCOC(=O)/C=C\C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985542	713728738	/nfs/dbraw/zinc/72/87/38/713728738.db2.gz	BUQSPQPDYJHYCX-VSQXVHSFSA-N	1	1	320.349	1.595	20	5		DDBDMO
CC(C)(C)OC(=O)N1CCC[C@]2(CC[N@@H+](CC[N+](=O)[O-])C2)C1	ZINC000930360681	713813984	/nfs/dbraw/zinc/81/39/84/713813984.db2.gz	NMXZULWMOWPGGL-OAHLLOKOSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)C[C@H]2C1	ZINC000931609000	714137805	/nfs/dbraw/zinc/13/78/05/714137805.db2.gz	ALHDKJCWHHIUOY-AOOOYVTPSA-N	1	1	308.313	1.759	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](C4OCCO4)C3)nc2c1	ZINC000932005439	714231610	/nfs/dbraw/zinc/23/16/10/714231610.db2.gz	RMOASYLIGZYUAN-JTQLQIEISA-N	1	1	319.317	1.931	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000923312377	714307532	/nfs/dbraw/zinc/30/75/32/714307532.db2.gz	HQXLETDBNRQTPW-DZGCQCFKSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H]1C[C@H](C)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C[NH3+]	ZINC000923379845	714334901	/nfs/dbraw/zinc/33/49/01/714334901.db2.gz	ABGFVIVNJNLOMI-DSPQJCBJSA-N	1	1	307.394	1.933	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2C[C@@H]3CS(=O)(=O)C[C@@H]3C2)cc1	ZINC000933726266	714656284	/nfs/dbraw/zinc/65/62/84/714656284.db2.gz	LIFQLWRGJIFMOL-BETUJISGSA-N	1	1	310.375	1.114	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2C[C@@H]3CS(=O)(=O)C[C@@H]3C2)cc1	ZINC000933726266	714656286	/nfs/dbraw/zinc/65/62/86/714656286.db2.gz	LIFQLWRGJIFMOL-BETUJISGSA-N	1	1	310.375	1.114	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000925424517	714852077	/nfs/dbraw/zinc/85/20/77/714852077.db2.gz	MHRBUVQUWDHIDP-NSHDSACASA-N	1	1	306.366	1.833	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000934889906	714925140	/nfs/dbraw/zinc/92/51/40/714925140.db2.gz	KUJIQDSEROSXDY-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)CCCn1cc[nH+]c1C	ZINC000935010031	714955717	/nfs/dbraw/zinc/95/57/17/714955717.db2.gz	ARRRYBNSVBBFGT-UHFFFAOYSA-N	1	1	320.353	1.153	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncc([N+](=O)[O-])c4ccccc43)C[C@@H]21	ZINC001164668057	719389503	/nfs/dbraw/zinc/38/95/03/719389503.db2.gz	PUMXRXNIQFDKDI-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4c(cccc4[N+](=O)[O-])n3)C[C@H]21	ZINC001164666137	719391580	/nfs/dbraw/zinc/39/15/80/719391580.db2.gz	JJVUPWXEAOJVJT-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cccc(C(F)F)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936963	742845034	/nfs/dbraw/zinc/84/50/34/742845034.db2.gz	YWDQVFOAYFKMGK-VXGBXAGGSA-N	1	1	313.304	1.495	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2cnccn2)C1	ZINC001198157594	747394249	/nfs/dbraw/zinc/39/42/49/747394249.db2.gz	RFDOBYVIVPMCQA-GFCCVEGCSA-N	1	1	315.333	1.036	20	5		DDBDMO
Cc1cc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1	ZINC000996429327	749587984	/nfs/dbraw/zinc/58/79/84/749587984.db2.gz	PRHYJHXTLVYVJX-ZIAGYGMSSA-N	1	1	323.418	1.802	20	5		DDBDMO
O=C(C1CCC1)N1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169028401	762185295	/nfs/dbraw/zinc/18/52/95/762185295.db2.gz	RXQPQMCMDXHHPY-ZFWWWQNUSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2C[C@@H](OCC3CC3)[C@H]3COC[C@H]32)C1	ZINC001169030131	762186689	/nfs/dbraw/zinc/18/66/89/762186689.db2.gz	WUHQBOWUUZHXRJ-RFBLXINOSA-N	1	1	310.394	1.558	20	5		DDBDMO
CCc1ncnc2c1CC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169022089	762200552	/nfs/dbraw/zinc/20/05/52/762200552.db2.gz	MUIQWQQEPFJXOS-STQMWFEESA-N	1	1	304.394	1.885	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCNC(=O)CC2)c([N+](=O)[O-])c1	ZINC001170328677	766253970	/nfs/dbraw/zinc/25/39/70/766253970.db2.gz	LIYZEEMTGQCZCH-NSHDSACASA-N	1	1	307.350	1.356	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCNC(=O)CC2)c([N+](=O)[O-])c1	ZINC001170328677	766253972	/nfs/dbraw/zinc/25/39/72/766253972.db2.gz	LIYZEEMTGQCZCH-NSHDSACASA-N	1	1	307.350	1.356	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1N[C@H](N)CCC[NH3+]	ZINC001170903444	771901104	/nfs/dbraw/zinc/90/11/04/771901104.db2.gz	JVIIUOZPYXONNJ-NSHDSACASA-N	1	1	316.745	1.470	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001094517532	775975666	/nfs/dbraw/zinc/97/56/66/775975666.db2.gz	WGIOONFKMSZCCQ-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](C)(CO)[C@H](O)C1	ZINC001173223394	777056947	/nfs/dbraw/zinc/05/69/47/777056947.db2.gz	ZNSRRHMZRJZCMO-WQVCFCJDSA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001326482967	861400950	/nfs/dbraw/zinc/40/09/50/861400950.db2.gz	RPNNPAOIBDOEBH-DFBGVHRSSA-N	1	1	321.377	1.427	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCCN2CCCCO2)ncc1[N+](=O)[O-]	ZINC001155003682	861639948	/nfs/dbraw/zinc/63/99/48/861639948.db2.gz	WNQAQRFRQFWARZ-VMPITWQZSA-N	1	1	321.381	1.961	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001122030808	858667466	/nfs/dbraw/zinc/66/74/66/858667466.db2.gz	GMAZHVWVUMSMRI-CQSZACIVSA-N	1	1	304.350	1.367	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])cc(C)n1	ZINC001139628263	860441703	/nfs/dbraw/zinc/44/17/03/860441703.db2.gz	UTDPECWAYYJNFH-GFCCVEGCSA-N	1	1	306.366	1.855	20	5		DDBDMO
Cc1[nH+]c(N)ccc1CNc1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001156981263	863495746	/nfs/dbraw/zinc/49/57/46/863495746.db2.gz	WXMNMRFISUGBTA-UHFFFAOYSA-N	1	1	309.713	1.779	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001329416375	863655255	/nfs/dbraw/zinc/65/52/55/863655255.db2.gz	LLEKPUMEEMDPAA-OCCSQVGLSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cc1c(C)c(N2CC([N@H+](C)[C@H]3CCOC3)C2)ncc1[N+](=O)[O-]	ZINC001158731763	864868711	/nfs/dbraw/zinc/86/87/11/864868711.db2.gz	XVHIZNLWPLUEHA-LBPRGKRZSA-N	1	1	306.366	1.516	20	5		DDBDMO
CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ncccc3[N+](=O)[O-])C[C@H]1[N@H+]2C	ZINC001225598944	881932183	/nfs/dbraw/zinc/93/21/83/881932183.db2.gz	ZIZGTCBQTXCPES-CDGCEXEKSA-N	1	1	321.333	1.535	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@@H]1[NH+]1CCOCC1	ZINC001160720826	866060023	/nfs/dbraw/zinc/06/00/23/866060023.db2.gz	SSONVZDLKGRXTQ-KBPBESRZSA-N	1	1	306.366	1.963	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1cc(N)c([N+](=O)[O-])cn1	ZINC001162875568	867891821	/nfs/dbraw/zinc/89/18/21/867891821.db2.gz	GYXFKHWRGIDVJS-CYBMUJFWSA-N	1	1	323.397	1.731	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NCC2(N(C)C)CC[NH+](C)CC2)n1	ZINC001164206899	869014393	/nfs/dbraw/zinc/01/43/93/869014393.db2.gz	JRLZWMCULWWWGG-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CC(=O)c1cc(N[C@@H](C)[C@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727478	869112014	/nfs/dbraw/zinc/11/20/14/869112014.db2.gz	WLMFEQYQKCLRNX-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727478	869112020	/nfs/dbraw/zinc/11/20/20/869112020.db2.gz	WLMFEQYQKCLRNX-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
C[C@H](CCNC[C@H](O)COc1ccccc1[N+](=O)[O-])[NH+](C)C	ZINC001336754488	869125359	/nfs/dbraw/zinc/12/53/59/869125359.db2.gz	LRQAONLEWKGULJ-OLZOCXBDSA-N	1	1	311.382	1.264	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3	ZINC001338199195	869864955	/nfs/dbraw/zinc/86/49/55/869864955.db2.gz	DOWKHBPCDPCOSM-GASCZTMLSA-N	1	1	305.382	1.641	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2cc(C(=O)OC)c([N+](=O)[O-])cc2OC)C1	ZINC001226441553	882434426	/nfs/dbraw/zinc/43/44/26/882434426.db2.gz	RICWHBLAMLCOBC-JTQLQIEISA-N	1	1	324.333	1.863	20	5		DDBDMO
C[N@H+](CCNC(=O)c1ccccn1)Cc1cccc([N+](=O)[O-])c1	ZINC001317436909	870833606	/nfs/dbraw/zinc/83/36/06/870833606.db2.gz	LRHOAIAXXBVOQD-UHFFFAOYSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccccn1)Cc1cccc([N+](=O)[O-])c1	ZINC001317436909	870833612	/nfs/dbraw/zinc/83/36/12/870833612.db2.gz	LRHOAIAXXBVOQD-UHFFFAOYSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001303799180	871155573	/nfs/dbraw/zinc/15/55/73/871155573.db2.gz	DHFCYMBXQYIYGB-SKDRFNHKSA-N	1	1	311.769	2.000	20	5		DDBDMO
C[C@@H]1COCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC001341004481	871461611	/nfs/dbraw/zinc/46/16/11/871461611.db2.gz	HHWPXGALRIUCIH-NHYWBVRUSA-N	1	1	307.350	1.264	20	5		DDBDMO
CCc1ccc(C[N@@H+](CC)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC001317479074	871607184	/nfs/dbraw/zinc/60/71/84/871607184.db2.gz	AFBYCMCWMROMHE-HZPDHXFCSA-N	1	1	319.405	1.852	20	5		DDBDMO
CCc1ccc(C[N@H+](CC)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001317479074	871607188	/nfs/dbraw/zinc/60/71/88/871607188.db2.gz	AFBYCMCWMROMHE-HZPDHXFCSA-N	1	1	319.405	1.852	20	5		DDBDMO
CCc1ccc(C[N@@H+](CC)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001317479074	871607193	/nfs/dbraw/zinc/60/71/93/871607193.db2.gz	AFBYCMCWMROMHE-HZPDHXFCSA-N	1	1	319.405	1.852	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC001318153619	871785229	/nfs/dbraw/zinc/78/52/29/871785229.db2.gz	JYWCYJMYODYQNW-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC001316823661	871971347	/nfs/dbraw/zinc/97/13/47/871971347.db2.gz	OODFAUYKXWWOGO-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
COc1ccc(C[N@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001316823661	871971356	/nfs/dbraw/zinc/97/13/56/871971356.db2.gz	OODFAUYKXWWOGO-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001316823661	871971363	/nfs/dbraw/zinc/97/13/63/871971363.db2.gz	OODFAUYKXWWOGO-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC001349920776	875457248	/nfs/dbraw/zinc/45/72/48/875457248.db2.gz	KODXTBOHCLHUTD-SNVBAGLBSA-N	1	1	308.338	1.819	20	5		DDBDMO
CCOC(=O)c1cc(Nc2c[nH+]ncc2N)cc([N+](=O)[O-])c1	ZINC001211370069	875777695	/nfs/dbraw/zinc/77/76/95/875777695.db2.gz	USPROVFNXNLWHP-UHFFFAOYSA-N	1	1	303.278	1.887	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C	ZINC001351177302	876100817	/nfs/dbraw/zinc/10/08/17/876100817.db2.gz	PIRHQYMHAUDIHI-NWDGAFQWSA-N	1	1	323.397	1.479	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N1CCC(C[N@@H+](C)C(C)C)CC1	ZINC001352440417	876747776	/nfs/dbraw/zinc/74/77/76/876747776.db2.gz	NNSATLYYIYVNDI-UHFFFAOYSA-N	1	1	324.429	1.631	20	5		DDBDMO
C[C@H](NC(=O)C[NH+]1CCC(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC001353765794	877546389	/nfs/dbraw/zinc/54/63/89/877546389.db2.gz	LDNPFPSOSZATOG-LBPRGKRZSA-N	1	1	321.377	1.476	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)CCO	ZINC001219043247	877885745	/nfs/dbraw/zinc/88/57/45/877885745.db2.gz	HUNZVPZLULJHIA-UHFFFAOYSA-N	1	1	310.354	1.203	20	5		DDBDMO
CCc1ncc(CNc2ccc(C(=O)NC)cc2[N+](=O)[O-])[nH]1	ZINC001472889444	878332916	/nfs/dbraw/zinc/33/29/16/878332916.db2.gz	VZZNNTYQAMHNHK-UHFFFAOYSA-N	1	1	303.322	1.852	20	5		DDBDMO
[NH3+][C@H](c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1)C1CCOCC1	ZINC001249219505	893875971	/nfs/dbraw/zinc/87/59/71/893875971.db2.gz	WUURPBREOPQAHZ-JTQLQIEISA-N	1	1	323.284	1.605	20	5		DDBDMO
CCOC(=O)CC1([NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)COC1	ZINC001254574988	896508236	/nfs/dbraw/zinc/50/82/36/896508236.db2.gz	MRWMRQYYPWKFTP-CYBMUJFWSA-N	1	1	320.345	1.374	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCC[C@@H](n3ccnn3)C1)C2	ZINC001254610580	896529656	/nfs/dbraw/zinc/52/96/56/896529656.db2.gz	LHJAHDMAQCYOQT-CVEARBPZSA-N	1	1	313.361	1.991	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@@H]1C[N@H+](C)CCN1C	ZINC001262705526	900321387	/nfs/dbraw/zinc/32/13/87/900321387.db2.gz	LIMGDEHWRCWJDU-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001262705526	900321399	/nfs/dbraw/zinc/32/13/99/900321399.db2.gz	LIMGDEHWRCWJDU-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3F)[C@H]2C1	ZINC001263980100	900853692	/nfs/dbraw/zinc/85/36/92/900853692.db2.gz	NEVFFFPZJIZKOD-WFBYXXMGSA-N	1	1	307.325	1.804	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001263996119	900865306	/nfs/dbraw/zinc/86/53/06/900865306.db2.gz	STGZXTBJEIJNCO-PMOUVXMZSA-N	1	1	319.361	1.085	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@@H](C)C1	ZINC000286538461	219042219	/nfs/dbraw/zinc/04/22/19/219042219.db2.gz	OAYUQOLZHBLBGN-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000278453604	214163593	/nfs/dbraw/zinc/16/35/93/214163593.db2.gz	RDBVZNBEWGGPDU-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000278453604	214163597	/nfs/dbraw/zinc/16/35/97/214163597.db2.gz	RDBVZNBEWGGPDU-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000278453604	214163600	/nfs/dbraw/zinc/16/36/00/214163600.db2.gz	RDBVZNBEWGGPDU-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
NC(=O)[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000079192522	185161309	/nfs/dbraw/zinc/16/13/09/185161309.db2.gz	JJDJNAUJKCBEJH-CQSZACIVSA-N	1	1	307.350	1.704	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000278714465	214347956	/nfs/dbraw/zinc/34/79/56/214347956.db2.gz	OWEDLDITSDGYJV-LLVKDONJSA-N	1	1	319.365	1.281	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000278714465	214347960	/nfs/dbraw/zinc/34/79/60/214347960.db2.gz	OWEDLDITSDGYJV-LLVKDONJSA-N	1	1	319.365	1.281	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC2(CCCC2)C1	ZINC000090552604	185302693	/nfs/dbraw/zinc/30/26/93/185302693.db2.gz	FROVMRAUJOOHQG-UHFFFAOYSA-N	1	1	307.350	1.402	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC2(CCCC2)C1	ZINC000090552604	185302694	/nfs/dbraw/zinc/30/26/94/185302694.db2.gz	FROVMRAUJOOHQG-UHFFFAOYSA-N	1	1	307.350	1.402	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)COc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000457173493	529882880	/nfs/dbraw/zinc/88/28/80/529882880.db2.gz	LCLYKCMAEBCKDW-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)C1	ZINC000292976505	530059542	/nfs/dbraw/zinc/05/95/42/530059542.db2.gz	MRKKWAMWTUDXML-MRXNPFEDSA-N	1	1	320.393	1.174	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000458175579	530060941	/nfs/dbraw/zinc/06/09/41/530060941.db2.gz	CSYGQFXJFPLEGA-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)n1	ZINC000286752870	219146463	/nfs/dbraw/zinc/14/64/63/219146463.db2.gz	YVELIWOYXVZFRK-UWVGGRQHSA-N	1	1	322.287	1.284	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)CC[N@H+]1C	ZINC000330790359	232070984	/nfs/dbraw/zinc/07/09/84/232070984.db2.gz	AOGWGFBYFQORTF-UWVGGRQHSA-N	1	1	307.354	1.127	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1	ZINC000272662118	210066630	/nfs/dbraw/zinc/06/66/30/210066630.db2.gz	HCHQDRJIMCSVFH-NSHDSACASA-N	1	1	321.381	1.256	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000279708064	215079723	/nfs/dbraw/zinc/07/97/23/215079723.db2.gz	HRPSJSAVIJIJMO-TZMCWYRMSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000331383852	233256158	/nfs/dbraw/zinc/25/61/58/233256158.db2.gz	HNQDVPPOZQNSPO-JTQLQIEISA-N	1	1	307.354	1.373	20	5		DDBDMO
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000358468201	299162701	/nfs/dbraw/zinc/16/27/01/299162701.db2.gz	QDBMKPGCJSPCBS-CQSZACIVSA-N	1	1	321.352	1.972	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000617285157	363037713	/nfs/dbraw/zinc/03/77/13/363037713.db2.gz	CTDNZDZQJPMGQV-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000617285157	363037717	/nfs/dbraw/zinc/03/77/17/363037717.db2.gz	CTDNZDZQJPMGQV-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000057553942	352820078	/nfs/dbraw/zinc/82/00/78/352820078.db2.gz	JEIVVEOGSREHEI-LLVKDONJSA-N	1	1	305.334	1.327	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000063711076	352921223	/nfs/dbraw/zinc/92/12/23/352921223.db2.gz	GWURMKJEMIRIDW-CYBMUJFWSA-N	1	1	323.397	1.418	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1csc([N+](=O)[O-])c1	ZINC000061649248	352892052	/nfs/dbraw/zinc/89/20/52/352892052.db2.gz	OBEHSWREMNLQJW-QWRGUYRKSA-N	1	1	311.363	1.249	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000061649424	352892136	/nfs/dbraw/zinc/89/21/36/352892136.db2.gz	CIDNPQDIYJATOW-UONOGXRCSA-N	1	1	305.334	1.188	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000331908284	234263308	/nfs/dbraw/zinc/26/33/08/234263308.db2.gz	ALQZSRQGYVHPQL-ZJUUUORDSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000331908284	234263312	/nfs/dbraw/zinc/26/33/12/234263312.db2.gz	ALQZSRQGYVHPQL-ZJUUUORDSA-N	1	1	317.349	1.636	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000173552166	198226412	/nfs/dbraw/zinc/22/64/12/198226412.db2.gz	FTVFUSLAFCLJMY-UHFFFAOYSA-N	1	1	324.381	1.184	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000068550320	353119051	/nfs/dbraw/zinc/11/90/51/353119051.db2.gz	NFEBDGBPDMGLNN-UHFFFAOYSA-N	1	1	317.349	1.810	20	5		DDBDMO
CCC1(O)CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000072724050	353212387	/nfs/dbraw/zinc/21/23/87/353212387.db2.gz	UHJCRDMREPJUON-UHFFFAOYSA-N	1	1	321.377	1.795	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)CC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000074106280	353292680	/nfs/dbraw/zinc/29/26/80/353292680.db2.gz	YFQHWOFVDHBDHI-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000174511743	198343831	/nfs/dbraw/zinc/34/38/31/198343831.db2.gz	MXGYABOORIPLKP-CYBMUJFWSA-N	1	1	320.393	1.807	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000174539707	198349578	/nfs/dbraw/zinc/34/95/78/198349578.db2.gz	RTPQPLLRSVYIOA-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075838164	353382189	/nfs/dbraw/zinc/38/21/89/353382189.db2.gz	CFDLHPLGNGUOLU-OSRDXIQISA-N	1	1	308.382	1.805	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174654238	198365555	/nfs/dbraw/zinc/36/55/55/198365555.db2.gz	CRGOYXDNJYOEHV-CQSZACIVSA-N	1	1	320.349	1.163	20	5		DDBDMO
C[C@@H](c1ccco1)[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1	ZINC000086233757	353739712	/nfs/dbraw/zinc/73/97/12/353739712.db2.gz	SLEXFAUXMWGPQQ-SMDDNHRTSA-N	1	1	320.349	1.971	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000091676991	353834021	/nfs/dbraw/zinc/83/40/21/353834021.db2.gz	DQHFUNQBYVCOQC-NEPJUHHUSA-N	1	1	323.397	1.556	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000091676991	353834023	/nfs/dbraw/zinc/83/40/23/353834023.db2.gz	DQHFUNQBYVCOQC-NEPJUHHUSA-N	1	1	323.397	1.556	20	5		DDBDMO
Cc1nn(C)c(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145684	353791223	/nfs/dbraw/zinc/79/12/23/353791223.db2.gz	ZEUDTZFHPMEKEJ-NEPJUHHUSA-N	1	1	309.370	1.302	20	5		DDBDMO
Cc1nn(C)c(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145684	353791225	/nfs/dbraw/zinc/79/12/25/353791225.db2.gz	ZEUDTZFHPMEKEJ-NEPJUHHUSA-N	1	1	309.370	1.302	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@@H+]2CCCC[C@@H]2CO1	ZINC000090145724	353791392	/nfs/dbraw/zinc/79/13/92/353791392.db2.gz	UCQUJUMGMYWQBC-TZMCWYRMSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@H+]2CCCC[C@@H]2CO1	ZINC000090145724	353791393	/nfs/dbraw/zinc/79/13/93/353791393.db2.gz	UCQUJUMGMYWQBC-TZMCWYRMSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCC(CO)CC1	ZINC000090560661	353795773	/nfs/dbraw/zinc/79/57/73/353795773.db2.gz	GNIHHZYZFHYPRK-UHFFFAOYSA-N	1	1	309.366	1.239	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+](C[C@H]2CCOC2)CC1	ZINC000093817327	353905238	/nfs/dbraw/zinc/90/52/38/353905238.db2.gz	VNMNNKDNQAUPFY-CYBMUJFWSA-N	1	1	321.377	1.455	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000142316507	354144389	/nfs/dbraw/zinc/14/43/89/354144389.db2.gz	QTOISPKTXTYWLD-OAHLLOKOSA-N	1	1	303.362	1.834	20	5		DDBDMO
COc1cc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156798954	354221195	/nfs/dbraw/zinc/22/11/95/354221195.db2.gz	NOIQEBRKNSMXIU-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156798954	354221198	/nfs/dbraw/zinc/22/11/98/354221198.db2.gz	NOIQEBRKNSMXIU-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055885	354228487	/nfs/dbraw/zinc/22/84/87/354228487.db2.gz	CACLFRXXZRBNNI-DGCLKSJQSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055885	354228490	/nfs/dbraw/zinc/22/84/90/354228490.db2.gz	CACLFRXXZRBNNI-DGCLKSJQSA-N	1	1	307.350	1.352	20	5		DDBDMO
COc1cc(C[NH2+]Cc2cncn2C)c([N+](=O)[O-])cc1OC	ZINC000289436661	354439974	/nfs/dbraw/zinc/43/99/74/354439974.db2.gz	AFTDNMYRMCZKQI-UHFFFAOYSA-N	1	1	306.322	1.635	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC(F)(F)[C@H](CO)C1	ZINC000403826584	354670534	/nfs/dbraw/zinc/67/05/34/354670534.db2.gz	CGDNGOOHPKBLNL-JTQLQIEISA-N	1	1	304.297	1.049	20	5		DDBDMO
COc1cc(N(C)C[C@@H]2C[C@H](OC)C[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000585783525	354842193	/nfs/dbraw/zinc/84/21/93/354842193.db2.gz	RSSXWGXPKIDBRJ-STQMWFEESA-N	1	1	309.366	1.759	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000587862310	354886344	/nfs/dbraw/zinc/88/63/44/354886344.db2.gz	ZYLVHXOSICBFEU-JSGCOSHPSA-N	1	1	309.341	1.769	20	5		DDBDMO
CCOc1cc(C[N@@H+](CCO)C2CCOCC2)ccc1[N+](=O)[O-]	ZINC000276989229	213224405	/nfs/dbraw/zinc/22/44/05/213224405.db2.gz	ZSEZVJBFYBTXTB-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](CC(N)=O)C1	ZINC000588977177	354953714	/nfs/dbraw/zinc/95/37/14/354953714.db2.gz	HCDHIOKFWJTPQJ-LLVKDONJSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000588977177	354953719	/nfs/dbraw/zinc/95/37/19/354953719.db2.gz	HCDHIOKFWJTPQJ-LLVKDONJSA-N	1	1	320.349	1.039	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@](C)(O)C2)c1	ZINC000589501923	354997148	/nfs/dbraw/zinc/99/71/48/354997148.db2.gz	KHDXDJYYSHILJV-OAHLLOKOSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@](C)(O)C2)c1	ZINC000589501923	354997150	/nfs/dbraw/zinc/99/71/50/354997150.db2.gz	KHDXDJYYSHILJV-OAHLLOKOSA-N	1	1	308.334	1.728	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000590044131	355042427	/nfs/dbraw/zinc/04/24/27/355042427.db2.gz	HGHYQLITGDWLKP-AAEUAGOBSA-N	1	1	305.334	1.136	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590442837	355096443	/nfs/dbraw/zinc/09/64/43/355096443.db2.gz	HLYSCOOTNPVXSX-RISCZKNCSA-N	1	1	304.350	1.169	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590446357	355099788	/nfs/dbraw/zinc/09/97/88/355099788.db2.gz	UTPAZNMRFOSNOL-SMDDNHRTSA-N	1	1	321.402	1.849	20	5		DDBDMO
CCN1C[C@H]([NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1=O	ZINC000590659565	355139917	/nfs/dbraw/zinc/13/99/17/355139917.db2.gz	YHWITHFJWXSZJQ-LLVKDONJSA-N	1	1	321.333	1.076	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@@H]1[NH3+]	ZINC000592330546	355560514	/nfs/dbraw/zinc/56/05/14/355560514.db2.gz	BZQYOKKRKFFVJL-CABZTGNLSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000592746816	355673765	/nfs/dbraw/zinc/67/37/65/355673765.db2.gz	GVNCZTWFPZOKBB-VXGBXAGGSA-N	1	1	306.366	1.463	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1	ZINC000593019058	355771492	/nfs/dbraw/zinc/77/14/92/355771492.db2.gz	DGQLKQOJIFOPFB-RYUDHWBXSA-N	1	1	321.377	1.906	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](N2CCOCC2)C1	ZINC000593995888	356082324	/nfs/dbraw/zinc/08/23/24/356082324.db2.gz	DAGXSPRORDMQFX-OAHLLOKOSA-N	1	1	305.378	1.891	20	5		DDBDMO
CCS(=O)(=O)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000594992611	356369536	/nfs/dbraw/zinc/36/95/36/356369536.db2.gz	HNLVUHZZPNGRPV-UHFFFAOYSA-N	1	1	316.354	1.791	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c1[N+](=O)[O-]	ZINC000595527999	356534754	/nfs/dbraw/zinc/53/47/54/356534754.db2.gz	PYZVJSDWAHZNQM-IJLUTSLNSA-N	1	1	311.338	1.253	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CO)Cc1ccccc1	ZINC000595596530	356568765	/nfs/dbraw/zinc/56/87/65/356568765.db2.gz	NNNIOWTWJHDJHF-AWEZNQCLSA-N	1	1	304.350	1.327	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)c2cc[nH]c(=O)c2[N+](=O)[O-])C[C@H](C)O1	ZINC000596215163	356817897	/nfs/dbraw/zinc/81/78/97/356817897.db2.gz	RBKGSAFULQHSPT-PHIMTYICSA-N	1	1	310.354	1.241	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)c2cc[nH]c(=O)c2[N+](=O)[O-])C[C@H](C)O1	ZINC000596215163	356817902	/nfs/dbraw/zinc/81/79/02/356817902.db2.gz	RBKGSAFULQHSPT-PHIMTYICSA-N	1	1	310.354	1.241	20	5		DDBDMO
Cc1cc(N2CCC[C@H]([NH+]3CCOCC3)C2)ncc1[N+](=O)[O-]	ZINC000596246146	356831379	/nfs/dbraw/zinc/83/13/79/356831379.db2.gz	CBBDSUIALNLTMU-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H](C)C1	ZINC000596136090	356786523	/nfs/dbraw/zinc/78/65/23/356786523.db2.gz	HCUIDCOHBPWMAQ-BXUZGUMPSA-N	1	1	320.393	1.860	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596537450	356910102	/nfs/dbraw/zinc/91/01/02/356910102.db2.gz	GKYCPLREYSZHAI-ZDUSSCGKSA-N	1	1	323.397	1.155	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000347622522	283243426	/nfs/dbraw/zinc/24/34/26/283243426.db2.gz	JAFHLRBBDOVKCB-CYBMUJFWSA-N	1	1	309.370	1.030	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000597604825	357250120	/nfs/dbraw/zinc/25/01/20/357250120.db2.gz	KYDYMKLSRWRAFE-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597604825	357250126	/nfs/dbraw/zinc/25/01/26/357250126.db2.gz	KYDYMKLSRWRAFE-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000597857315	357360311	/nfs/dbraw/zinc/36/03/11/357360311.db2.gz	DBVIPDAFQVIQKB-NSHDSACASA-N	1	1	323.397	1.515	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000598343798	357546916	/nfs/dbraw/zinc/54/69/16/357546916.db2.gz	YFVCRRVMHXWLLJ-JTQLQIEISA-N	1	1	321.333	1.538	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1nccc(C(=O)OC)c1[N+](=O)[O-]	ZINC000598599780	357648524	/nfs/dbraw/zinc/64/85/24/357648524.db2.gz	FECPACTUSFFOOJ-UHFFFAOYSA-N	1	1	310.354	1.920	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000599015055	357794331	/nfs/dbraw/zinc/79/43/31/357794331.db2.gz	VJGYUBPFDLAEPN-LBPRGKRZSA-N	1	1	307.350	1.550	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000599015055	357794333	/nfs/dbraw/zinc/79/43/33/357794333.db2.gz	VJGYUBPFDLAEPN-LBPRGKRZSA-N	1	1	307.350	1.550	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599674069	358019853	/nfs/dbraw/zinc/01/98/53/358019853.db2.gz	WBSNPHCOVVKPEW-COPLHBTASA-N	1	1	307.350	1.625	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000599704806	358033265	/nfs/dbraw/zinc/03/32/65/358033265.db2.gz	UEEDGDSNYSOJJJ-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
COC(=O)c1cnc(N(C)C[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000276712125	213060482	/nfs/dbraw/zinc/06/04/82/213060482.db2.gz	JJYVVRSKWQBJCY-LLVKDONJSA-N	1	1	322.365	1.554	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@@H](O)CO)cs2)c1	ZINC000276705998	213058313	/nfs/dbraw/zinc/05/83/13/213058313.db2.gz	FYJRPHLAAHGELG-GFCCVEGCSA-N	1	1	309.347	1.161	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000600315919	358194998	/nfs/dbraw/zinc/19/49/98/358194998.db2.gz	XGGZBIUZOQUZIY-GFCCVEGCSA-N	1	1	323.397	1.375	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000600472387	358234026	/nfs/dbraw/zinc/23/40/26/358234026.db2.gz	XCNQZXWURXOHOL-LBPRGKRZSA-N	1	1	320.349	1.442	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180565494	199177052	/nfs/dbraw/zinc/17/70/52/199177052.db2.gz	DEBZACKUKOQYTB-LLVKDONJSA-N	1	1	321.381	1.566	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc3ncc([N+](=O)[O-])n3n2)C[C@@H]1C	ZINC000348109423	283372775	/nfs/dbraw/zinc/37/27/75/283372775.db2.gz	VLXMWIGSXGNZTM-QWRGUYRKSA-N	1	1	304.354	1.556	20	5		DDBDMO
CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCN(C)C1=O	ZINC000601120657	358410764	/nfs/dbraw/zinc/41/07/64/358410764.db2.gz	JKOGNQHNZCJSNJ-CQSZACIVSA-N	1	1	300.318	1.810	20	5		DDBDMO
CCc1nn(C)cc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149542	358422206	/nfs/dbraw/zinc/42/22/06/358422206.db2.gz	NXUKXUZYKOJOAC-INIZCTEOSA-N	1	1	318.377	1.888	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)C[C@@H]2C1	ZINC000601185475	358438624	/nfs/dbraw/zinc/43/86/24/358438624.db2.gz	VHQPJFHBMPJMHU-NEPJUHHUSA-N	1	1	313.361	1.926	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c([N+](=O)[O-])n1	ZINC000602429991	358970820	/nfs/dbraw/zinc/97/08/20/358970820.db2.gz	JIHANSPIFPDGTN-UHFFFAOYSA-N	1	1	321.381	1.163	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)c([N+](=O)[O-])n1	ZINC000602783336	359189107	/nfs/dbraw/zinc/18/91/07/359189107.db2.gz	LIRXCQJRRXFUQV-CQSZACIVSA-N	1	1	323.397	1.015	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)c([N+](=O)[O-])n1	ZINC000602783336	359189114	/nfs/dbraw/zinc/18/91/14/359189114.db2.gz	LIRXCQJRRXFUQV-CQSZACIVSA-N	1	1	323.397	1.015	20	5		DDBDMO
CN1C[C@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CCC1=O	ZINC000602715566	359144557	/nfs/dbraw/zinc/14/45/57/359144557.db2.gz	PPSIGOZTTLTEMR-LLVKDONJSA-N	1	1	318.333	1.789	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CCC1=O	ZINC000602715566	359144560	/nfs/dbraw/zinc/14/45/60/359144560.db2.gz	PPSIGOZTTLTEMR-LLVKDONJSA-N	1	1	318.333	1.789	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602838860	359229269	/nfs/dbraw/zinc/22/92/69/359229269.db2.gz	UHSAMPADSVZPNW-LBPRGKRZSA-N	1	1	323.397	1.013	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(CC(F)F)CC1	ZINC000602802289	359201312	/nfs/dbraw/zinc/20/13/12/359201312.db2.gz	XSAKCQWZAZAMPD-UHFFFAOYSA-N	1	1	317.340	1.373	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602929913	359299924	/nfs/dbraw/zinc/29/99/24/359299924.db2.gz	YSYMCNQBCIVWFJ-HZMBPMFUSA-N	1	1	310.354	1.231	20	5		DDBDMO
Cc1nn(CC[N@@H+]2CCO[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603325193	359570316	/nfs/dbraw/zinc/57/03/16/359570316.db2.gz	HMQVWFZINNILQJ-SNVBAGLBSA-N	1	1	305.338	1.369	20	5		DDBDMO
Cc1nn(CC[N@H+]2CCO[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603325193	359570320	/nfs/dbraw/zinc/57/03/20/359570320.db2.gz	HMQVWFZINNILQJ-SNVBAGLBSA-N	1	1	305.338	1.369	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CC(C)(C)O	ZINC000188682652	200286684	/nfs/dbraw/zinc/28/66/84/200286684.db2.gz	XESPLXDOICZCAF-LBPRGKRZSA-N	1	1	321.377	1.512	20	5		DDBDMO
COCC[N@@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000609269243	360286170	/nfs/dbraw/zinc/28/61/70/360286170.db2.gz	NMQARNAOPIDAIC-SNVBAGLBSA-N	1	1	313.379	1.497	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000609269243	360286173	/nfs/dbraw/zinc/28/61/73/360286173.db2.gz	NMQARNAOPIDAIC-SNVBAGLBSA-N	1	1	313.379	1.497	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C[C@H]1C	ZINC000359020299	299308781	/nfs/dbraw/zinc/30/87/81/299308781.db2.gz	PUAGKZAOZTWVGH-NEPJUHHUSA-N	1	1	321.381	1.748	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900750	360568067	/nfs/dbraw/zinc/56/80/67/360568067.db2.gz	KAQDYUUAGJOTTC-QMTHXVAHSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900750	360568074	/nfs/dbraw/zinc/56/80/74/360568074.db2.gz	KAQDYUUAGJOTTC-QMTHXVAHSA-N	1	1	322.365	1.085	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610931057	360574099	/nfs/dbraw/zinc/57/40/99/360574099.db2.gz	SNDBSIWPRJMYEW-JTQLQIEISA-N	1	1	321.333	1.063	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610931057	360574104	/nfs/dbraw/zinc/57/41/04/360574104.db2.gz	SNDBSIWPRJMYEW-JTQLQIEISA-N	1	1	321.333	1.063	20	5		DDBDMO
C[C@H]1COCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610990902	360592263	/nfs/dbraw/zinc/59/22/63/360592263.db2.gz	UFQGIZKERFOUGH-JSGCOSHPSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@H]3CCOC3)CC2)c1	ZINC000611104211	360624060	/nfs/dbraw/zinc/62/40/60/360624060.db2.gz	NFWQKBISIRSGSA-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO	ZINC000190812961	200588328	/nfs/dbraw/zinc/58/83/28/200588328.db2.gz	QCZUFQJSBNLLME-STQMWFEESA-N	1	1	312.366	1.427	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCC[C@H]1O	ZINC000611285735	360690053	/nfs/dbraw/zinc/69/00/53/360690053.db2.gz	KBFKHTJTMBTQGS-BXUZGUMPSA-N	1	1	322.361	1.959	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000271859726	209275039	/nfs/dbraw/zinc/27/50/39/209275039.db2.gz	KDOAFRRETUDURR-UHFFFAOYSA-N	1	1	305.334	1.352	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252431	363945230	/nfs/dbraw/zinc/94/52/30/363945230.db2.gz	LKXFTCIZXGATTF-CMPLNLGQSA-N	1	1	322.340	1.435	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619255004	363946840	/nfs/dbraw/zinc/94/68/40/363946840.db2.gz	SIMWKWIQUFEUSC-KBPBESRZSA-N	1	1	322.340	1.557	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)c1[N+](=O)[O-]	ZINC000619868432	364167685	/nfs/dbraw/zinc/16/76/85/364167685.db2.gz	FKUNJIAGCCCKFX-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[N@H+](CC3CCC3)CC2)c1[N+](=O)[O-]	ZINC000619868432	364167690	/nfs/dbraw/zinc/16/76/90/364167690.db2.gz	FKUNJIAGCCCKFX-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)c1[N+](=O)[O-]	ZINC000619868432	364167696	/nfs/dbraw/zinc/16/76/96/364167696.db2.gz	FKUNJIAGCCCKFX-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
C[C@H]1OCC[NH2+][C@@H]1C(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000262041143	203181465	/nfs/dbraw/zinc/18/14/65/203181465.db2.gz	YNOWTHRWAIWFQK-PELKAZGASA-N	1	1	313.741	1.241	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])C1	ZINC000264591765	204015524	/nfs/dbraw/zinc/01/55/24/204015524.db2.gz	WENAZKIYCPOVTB-GFCCVEGCSA-N	1	1	307.350	1.354	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000266057033	205062458	/nfs/dbraw/zinc/06/24/58/205062458.db2.gz	JNPINHIDEJNEAR-UHFFFAOYSA-N	1	1	302.334	1.849	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@@H+](C)CC2)cc([N+](=O)[O-])c1OC	ZINC000266123383	205116601	/nfs/dbraw/zinc/11/66/01/205116601.db2.gz	ZMKIYBDDMNZUKR-UHFFFAOYSA-N	1	1	323.349	1.390	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000274520377	211686229	/nfs/dbraw/zinc/68/62/29/211686229.db2.gz	SCQLHVBATIRFHN-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
COc1ccc(NC(=O)C[NH2+][C@H](C)c2cn[nH]c2)c([N+](=O)[O-])c1	ZINC000273963259	211217993	/nfs/dbraw/zinc/21/79/93/211217993.db2.gz	FYJHETUZECATMP-SECBINFHSA-N	1	1	319.321	1.616	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](CCn3ccc([N+](=O)[O-])n3)C[C@H]1CCCC2	ZINC000284765682	218169211	/nfs/dbraw/zinc/16/92/11/218169211.db2.gz	MJJLMVOKYNGXAS-IUODEOHRSA-N	1	1	322.365	1.457	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1ccccc1[N+](=O)[O-])C(C)C	ZINC000338766974	250127144	/nfs/dbraw/zinc/12/71/44/250127144.db2.gz	LMBAJJLULHFZMU-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ccncc2[N+](=O)[O-])CC1	ZINC000340871877	251253556	/nfs/dbraw/zinc/25/35/56/251253556.db2.gz	ORPUJQFUBGPZEA-UHFFFAOYSA-N	1	1	302.338	1.226	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](O)C[C@H]1C	ZINC000340907086	251269577	/nfs/dbraw/zinc/26/95/77/251269577.db2.gz	LEQGREUCZROMJL-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@H](C)C1	ZINC000288645820	220320007	/nfs/dbraw/zinc/32/00/07/220320007.db2.gz	ZLMKWPBDVAJDTF-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@H](C)C1	ZINC000288645820	220320013	/nfs/dbraw/zinc/32/00/13/220320013.db2.gz	ZLMKWPBDVAJDTF-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000272944068	210330554	/nfs/dbraw/zinc/33/05/54/210330554.db2.gz	MEKOGDSSZPPAPL-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
Cc1c(C(=O)NCCC[N@H+](C)CCN(C)C)cccc1[N+](=O)[O-]	ZINC000288748097	220389106	/nfs/dbraw/zinc/38/91/06/220389106.db2.gz	QKYRFRGFUYGCDO-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1c(C(=O)NCCCN(C)CC[NH+](C)C)cccc1[N+](=O)[O-]	ZINC000288748097	220389110	/nfs/dbraw/zinc/38/91/10/220389110.db2.gz	QKYRFRGFUYGCDO-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
[NH3+]C[C@H]1CCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000157647335	197204338	/nfs/dbraw/zinc/20/43/38/197204338.db2.gz	YRNOMQDDUCANHX-KCJUWKMLSA-N	1	1	303.322	1.328	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000352659518	285204222	/nfs/dbraw/zinc/20/42/22/285204222.db2.gz	NQFRHLXOIABREJ-JSGCOSHPSA-N	1	1	310.350	1.827	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@@H]3CC[NH2+]C3)CC2)c1[N+](=O)[O-]	ZINC000289855699	221270843	/nfs/dbraw/zinc/27/08/43/221270843.db2.gz	CKBJNBZRDIELAQ-LLVKDONJSA-N	1	1	307.354	1.088	20	5		DDBDMO
COc1ccc(CNC(=O)[C@H](C)[NH+]2CC(C)C2)cc1[N+](=O)[O-]	ZINC000568998304	304328926	/nfs/dbraw/zinc/32/89/26/304328926.db2.gz	TVQWXUBOFJCOQV-NSHDSACASA-N	1	1	307.350	1.560	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCS(=O)(=O)C2)c(Cl)c1	ZINC000069144506	406686359	/nfs/dbraw/zinc/68/63/59/406686359.db2.gz	UVCZJPKTCFPGRI-SNVBAGLBSA-N	1	1	318.782	1.915	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000106865791	407363924	/nfs/dbraw/zinc/36/39/24/407363924.db2.gz	GPYKWJJWLXWZFD-DUVNUKRYSA-N	1	1	324.377	1.570	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCOC1	ZINC000106884152	407364832	/nfs/dbraw/zinc/36/48/32/407364832.db2.gz	PJUANTUIJQVJGO-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000111263945	407403886	/nfs/dbraw/zinc/40/38/86/407403886.db2.gz	CDXXZQWHLZNYHW-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCn1cccn1	ZINC000111280177	407406031	/nfs/dbraw/zinc/40/60/31/407406031.db2.gz	UPDXSQMIEUSFOO-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCn1cccn1	ZINC000111280177	407406032	/nfs/dbraw/zinc/40/60/32/407406032.db2.gz	UPDXSQMIEUSFOO-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000270983950	407451390	/nfs/dbraw/zinc/45/13/90/407451390.db2.gz	XOXCUFLCPGPQHA-WDMOLILDSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000270983950	407451397	/nfs/dbraw/zinc/45/13/97/407451397.db2.gz	XOXCUFLCPGPQHA-WDMOLILDSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000270983938	407452003	/nfs/dbraw/zinc/45/20/03/407452003.db2.gz	XOXCUFLCPGPQHA-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000270983938	407452011	/nfs/dbraw/zinc/45/20/11/407452011.db2.gz	XOXCUFLCPGPQHA-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000185973939	407556328	/nfs/dbraw/zinc/55/63/28/407556328.db2.gz	PTKVMDNXRUNWII-DZGCQCFKSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000185973939	407556332	/nfs/dbraw/zinc/55/63/32/407556332.db2.gz	PTKVMDNXRUNWII-DZGCQCFKSA-N	1	1	307.350	1.358	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000128229630	407510745	/nfs/dbraw/zinc/51/07/45/407510745.db2.gz	YYTFZCYLYUTHMD-GFCCVEGCSA-N	1	1	323.397	1.426	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](c3ccccc3)C2)c1	ZINC000266528363	407546532	/nfs/dbraw/zinc/54/65/32/407546532.db2.gz	LCKZXHWNLNPITC-GOEBONIOSA-N	1	1	316.361	1.642	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000115443173	407680692	/nfs/dbraw/zinc/68/06/92/407680692.db2.gz	RURYAUDFKKENFS-JTQLQIEISA-N	1	1	324.356	1.730	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000171756283	407762460	/nfs/dbraw/zinc/76/24/60/407762460.db2.gz	XRYWMKUHTBHVAU-CYBMUJFWSA-N	1	1	306.366	1.736	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000267214647	407793760	/nfs/dbraw/zinc/79/37/60/407793760.db2.gz	IALYZZVJWWALTP-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1	ZINC000179910004	407842713	/nfs/dbraw/zinc/84/27/13/407842713.db2.gz	WRLDSFQKLAIYOK-UHFFFAOYSA-N	1	1	307.306	1.101	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H](C)O1	ZINC000268041056	407864989	/nfs/dbraw/zinc/86/49/89/407864989.db2.gz	XZQXSYICSFBCFK-TXEJJXNPSA-N	1	1	324.381	1.542	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+](CCCCO)C2CC2)c([N+](=O)[O-])c1	ZINC000118844221	407954442	/nfs/dbraw/zinc/95/44/42/407954442.db2.gz	ZWLOPZIZMFWKDT-UHFFFAOYSA-N	1	1	307.350	1.431	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1	ZINC000272528848	407966236	/nfs/dbraw/zinc/96/62/36/407966236.db2.gz	MHBZSHWHVNRPJA-MRVPVSSYSA-N	1	1	321.362	1.281	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCc3ccc(F)cc3C2)c1	ZINC000135138155	407980296	/nfs/dbraw/zinc/98/02/96/407980296.db2.gz	CYFBQBPJACTJEY-OAHLLOKOSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3ccc(F)cc3C2)c1	ZINC000135138155	407980303	/nfs/dbraw/zinc/98/03/03/407980303.db2.gz	CYFBQBPJACTJEY-OAHLLOKOSA-N	1	1	320.324	1.350	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c(N)c([N+](=O)[O-])c1	ZINC000273069356	408045435	/nfs/dbraw/zinc/04/54/35/408045435.db2.gz	ZJJTUTQJSZCCTF-NSHDSACASA-N	1	1	318.377	1.866	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000272570168	407988433	/nfs/dbraw/zinc/98/84/33/407988433.db2.gz	FTCDKOMRRXAYDK-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](C)(O)C1	ZINC000245962863	408108307	/nfs/dbraw/zinc/10/83/07/408108307.db2.gz	VCVGDZGAPWNQLO-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@](C)(O)C1	ZINC000245962863	408108310	/nfs/dbraw/zinc/10/83/10/408108310.db2.gz	VCVGDZGAPWNQLO-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000175583526	408165793	/nfs/dbraw/zinc/16/57/93/408165793.db2.gz	ZRFZUJIBJRDESQ-UHFFFAOYSA-N	1	1	309.366	1.380	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@H]2C1	ZINC000246383082	408237930	/nfs/dbraw/zinc/23/79/30/408237930.db2.gz	OTVMHRMIFUDWKR-STQMWFEESA-N	1	1	318.377	1.702	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000263791339	408258381	/nfs/dbraw/zinc/25/83/81/408258381.db2.gz	XLGAADRRDHPHRX-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])c1	ZINC000190401665	408236129	/nfs/dbraw/zinc/23/61/29/408236129.db2.gz	SKIBTXCYIIUYPB-BXUZGUMPSA-N	1	1	310.350	1.685	20	5		DDBDMO
COc1ccccc1CC[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000176231175	408318212	/nfs/dbraw/zinc/31/82/12/408318212.db2.gz	MCVBNXWUWOFUML-UHFFFAOYSA-N	1	1	304.350	1.974	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000171807612	162242523	/nfs/dbraw/zinc/24/25/23/162242523.db2.gz	FWNHPVVADIPLJZ-JTQLQIEISA-N	1	1	307.354	1.191	20	5		DDBDMO
C[C@@H]1OCC[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000248457135	408570933	/nfs/dbraw/zinc/57/09/33/408570933.db2.gz	MCVMPSLBXVRTED-RWMBFGLXSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1OCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000248457135	408570937	/nfs/dbraw/zinc/57/09/37/408570937.db2.gz	MCVMPSLBXVRTED-RWMBFGLXSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248470449	408573955	/nfs/dbraw/zinc/57/39/55/408573955.db2.gz	VCZWPRXSMCASAO-DOMZBBRYSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3ccc(Cl)cc3[N+](=O)[O-])C[C@H]2C1	ZINC000192527359	408602497	/nfs/dbraw/zinc/60/24/97/408602497.db2.gz	JXLJHLUYDCBTEC-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000177980428	408749579	/nfs/dbraw/zinc/74/95/79/408749579.db2.gz	GWYZBSVMSUTXLU-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CCN(C)C(=O)C[NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000185183705	408776812	/nfs/dbraw/zinc/77/68/12/408776812.db2.gz	UYLOJJWSSSTHKN-UHFFFAOYSA-N	1	1	311.338	1.180	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000250146521	408776958	/nfs/dbraw/zinc/77/69/58/408776958.db2.gz	ZXASDKLSINTJPX-ZWNOBZJWSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000250146521	408776961	/nfs/dbraw/zinc/77/69/61/408776961.db2.gz	ZXASDKLSINTJPX-ZWNOBZJWSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000281367907	408884277	/nfs/dbraw/zinc/88/42/77/408884277.db2.gz	OICSYSOMQITISU-NSHDSACASA-N	1	1	319.365	1.364	20	5		DDBDMO
C[C@H](CO)[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@H](C)O	ZINC000276184966	408824470	/nfs/dbraw/zinc/82/44/70/408824470.db2.gz	KUUOSNRVLYCABC-ZJUUUORDSA-N	1	1	302.758	1.812	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(OC[C@@H](O)C[N@@H+](C)C2CC2)c1	ZINC000290780821	408830573	/nfs/dbraw/zinc/83/05/73/408830573.db2.gz	MXICEMYAPLZDIB-LBPRGKRZSA-N	1	1	324.333	1.215	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1	ZINC000291614651	408895523	/nfs/dbraw/zinc/89/55/23/408895523.db2.gz	AJALGSFWMRNDGH-MRXNPFEDSA-N	1	1	318.377	1.486	20	5		DDBDMO
Cc1cnc(NCCN2CC[N@H+](C)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000281735020	408919541	/nfs/dbraw/zinc/91/95/41/408919541.db2.gz	WLVHAMWPPPOXGG-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c(Cl)c1	ZINC000227650793	163339078	/nfs/dbraw/zinc/33/90/78/163339078.db2.gz	JFLGLJUACKKVPX-MWLCHTKSSA-N	1	1	312.757	1.918	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000287310706	409017890	/nfs/dbraw/zinc/01/78/90/409017890.db2.gz	JKGPJECJYBQGSE-GXTWGEPZSA-N	1	1	312.366	1.427	20	5		DDBDMO
C[C@@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C1=CC[N@@H+](C)CC1	ZINC000283246637	409120885	/nfs/dbraw/zinc/12/08/85/409120885.db2.gz	UJYXDYAEQRZHCZ-SECBINFHSA-N	1	1	322.340	1.696	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]2OCCN(C)[C@H]2C1	ZINC000284328677	409320948	/nfs/dbraw/zinc/32/09/48/409320948.db2.gz	KOYJWIPLSYPJBD-JKSUJKDBSA-N	1	1	305.378	1.808	20	5		DDBDMO
Cc1nc(N[C@H](C)CC[NH+]2CCN(C)CC2)ncc1[N+](=O)[O-]	ZINC000295117094	409330601	/nfs/dbraw/zinc/33/06/01/409330601.db2.gz	WDYQQQWUWXUDEC-LLVKDONJSA-N	1	1	308.386	1.131	20	5		DDBDMO
C[N@@H+](C[C@H](O)CN1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C1CC1	ZINC000290493129	409421553	/nfs/dbraw/zinc/42/15/53/409421553.db2.gz	ABHJPSJNCPVFDR-AWEZNQCLSA-N	1	1	321.377	1.113	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290501280	409424175	/nfs/dbraw/zinc/42/41/75/409424175.db2.gz	ASWZBRGHZRGWAD-NSHDSACASA-N	1	1	321.381	1.399	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000318746113	164033622	/nfs/dbraw/zinc/03/36/22/164033622.db2.gz	YGRJQQHAHLLALN-SNVBAGLBSA-N	1	1	310.329	1.482	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000321888210	164046208	/nfs/dbraw/zinc/04/62/08/164046208.db2.gz	RMGHKINCVIRRAP-NEPJUHHUSA-N	1	1	318.377	1.993	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+](C)CCN2C)c1	ZINC000322499187	164047110	/nfs/dbraw/zinc/04/71/10/164047110.db2.gz	DAYWAOMJMLQIMJ-LBPRGKRZSA-N	1	1	322.365	1.039	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)C2(CO)CC2)c([N+](=O)[O-])c1	ZINC000285541914	409482730	/nfs/dbraw/zinc/48/27/30/409482730.db2.gz	PZZIZOXYCJKZLJ-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)C2(CO)CC2)c([N+](=O)[O-])c1	ZINC000285541914	409482734	/nfs/dbraw/zinc/48/27/34/409482734.db2.gz	PZZIZOXYCJKZLJ-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CCCC[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1	ZINC000285544126	409484599	/nfs/dbraw/zinc/48/45/99/409484599.db2.gz	LTFAWMFIKYHEBD-UHFFFAOYSA-N	1	1	323.397	1.902	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H](C)O	ZINC000304004249	409560469	/nfs/dbraw/zinc/56/04/69/409560469.db2.gz	SHSUFFFAIANROW-GFCCVEGCSA-N	1	1	321.377	1.575	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356728516	409554021	/nfs/dbraw/zinc/55/40/21/409554021.db2.gz	FEOUQDHGNLNESO-PWSUYJOCSA-N	1	1	307.350	1.816	20	5		DDBDMO
NC(=O)[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccccc1[N+](=O)[O-]	ZINC000342423409	409621478	/nfs/dbraw/zinc/62/14/78/409621478.db2.gz	RDXKGXZGFCKXER-CQSZACIVSA-N	1	1	317.320	1.920	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000354001356	409591723	/nfs/dbraw/zinc/59/17/23/409591723.db2.gz	OAEONKCSVDAKMX-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC000357029291	409808178	/nfs/dbraw/zinc/80/81/78/409808178.db2.gz	CSFDTOJKCUYDAP-QWHCGFSZSA-N	1	1	320.393	1.866	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)CCN12	ZINC000346490420	409986731	/nfs/dbraw/zinc/98/67/31/409986731.db2.gz	PKAULCXZMRVPSE-ZDUSSCGKSA-N	1	1	305.334	1.280	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CCN12	ZINC000346490420	409986737	/nfs/dbraw/zinc/98/67/37/409986737.db2.gz	PKAULCXZMRVPSE-ZDUSSCGKSA-N	1	1	305.334	1.280	20	5		DDBDMO
NC(=O)c1cccc(N[C@@H]2CCn3cc[nH+]c3C2)c1[N+](=O)[O-]	ZINC000343056653	410109734	/nfs/dbraw/zinc/10/97/34/410109734.db2.gz	VPIAWAPKEXGBOO-SECBINFHSA-N	1	1	301.306	1.317	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000332599259	410191486	/nfs/dbraw/zinc/19/14/86/410191486.db2.gz	IPGFPMLUOVHJEM-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000332599259	410191488	/nfs/dbraw/zinc/19/14/88/410191488.db2.gz	IPGFPMLUOVHJEM-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H](C)CO	ZINC000339628530	410341546	/nfs/dbraw/zinc/34/15/46/410341546.db2.gz	ZLZULTAGWZBONX-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000347367527	410498175	/nfs/dbraw/zinc/49/81/75/410498175.db2.gz	WVGBEEOSICRMHI-NSHDSACASA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC	ZINC000339883949	410529325	/nfs/dbraw/zinc/52/93/25/410529325.db2.gz	GYHVUZSMRQRZGM-LBPRGKRZSA-N	1	1	306.366	1.851	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+](C)C2CC2)cc([N+](=O)[O-])c1C	ZINC000359177615	410567407	/nfs/dbraw/zinc/56/74/07/410567407.db2.gz	ZBGLJAWKXRQCQV-UHFFFAOYSA-N	1	1	307.350	1.736	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c(Cl)c1	ZINC000300405247	410644220	/nfs/dbraw/zinc/64/42/20/410644220.db2.gz	JFLGLJUACKKVPX-ONGXEEELSA-N	1	1	312.757	1.918	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000330586577	410800034	/nfs/dbraw/zinc/80/00/34/410800034.db2.gz	LSOFUORHDRJYCT-STQMWFEESA-N	1	1	320.393	1.582	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@H]21	ZINC000301965063	410836067	/nfs/dbraw/zinc/83/60/67/410836067.db2.gz	NYLVWFLPOBHREF-NWDGAFQWSA-N	1	1	316.365	1.558	20	5		DDBDMO
CCOC(=O)c1ccnc(NCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000348184835	410842575	/nfs/dbraw/zinc/84/25/75/410842575.db2.gz	IUSOZJXTNWPYFS-UHFFFAOYSA-N	1	1	308.338	1.673	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344032848	410908266	/nfs/dbraw/zinc/90/82/66/410908266.db2.gz	DXYADTZBPRABOV-BVIHXZOGSA-N	1	1	319.361	1.625	20	5		DDBDMO
CC[N@@H+](CCCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000348349840	410928405	/nfs/dbraw/zinc/92/84/05/410928405.db2.gz	XSIOETIFWSUPDB-UHFFFAOYSA-N	1	1	323.349	1.597	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CO)C[C@@H]1C	ZINC000344143398	410987685	/nfs/dbraw/zinc/98/76/85/410987685.db2.gz	BQBAGPBVVZNXQB-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](CO)C[C@@H]1C	ZINC000344143398	410987693	/nfs/dbraw/zinc/98/76/93/410987693.db2.gz	BQBAGPBVVZNXQB-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1CCc1ccc([N+](=O)[O-])cc1	ZINC000419336574	226121865	/nfs/dbraw/zinc/12/18/65/226121865.db2.gz	XHRUDGNGMWGPDC-KGLIPLIRSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1CN(CCO)[C@@H](C)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000419336574	226121868	/nfs/dbraw/zinc/12/18/68/226121868.db2.gz	XHRUDGNGMWGPDC-KGLIPLIRSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1CN(CCO)[C@@H](C)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000419336574	226121871	/nfs/dbraw/zinc/12/18/71/226121871.db2.gz	XHRUDGNGMWGPDC-KGLIPLIRSA-N	1	1	307.394	1.524	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@@H]2[C@@H]1C(N)=O	ZINC000373737043	418454956	/nfs/dbraw/zinc/45/49/56/418454956.db2.gz	FMRWXBWBEOBUHG-AEGPPILISA-N	1	1	303.362	1.989	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373929505	418474669	/nfs/dbraw/zinc/47/46/69/418474669.db2.gz	ORJPRKPDEMNBOV-STQMWFEESA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1c(CN2CC[NH+]([C@@H]3CCOC3)CC2)cccc1[N+](=O)[O-]	ZINC000366510593	418483830	/nfs/dbraw/zinc/48/38/30/418483830.db2.gz	HCBBNGFVXDQOSM-OAHLLOKOSA-N	1	1	305.378	1.810	20	5		DDBDMO
COc1cc(N2CC[NH+]([C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000366851650	418526353	/nfs/dbraw/zinc/52/63/53/418526353.db2.gz	MNHPUZOVLRBBQG-CYBMUJFWSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000193200115	222146471	/nfs/dbraw/zinc/14/64/71/222146471.db2.gz	KPIQLLVZWKTPMG-LBPRGKRZSA-N	1	1	318.377	1.878	20	5		DDBDMO
CC1(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[NH2+]CC1	ZINC000193373581	222152153	/nfs/dbraw/zinc/15/21/53/222152153.db2.gz	VBMDRNQDTWVQCW-UHFFFAOYSA-N	1	1	303.322	1.343	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)OC)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000291348790	222330097	/nfs/dbraw/zinc/33/00/97/222330097.db2.gz	XQHMJHLNLMXWPD-TZMCWYRMSA-N	1	1	312.366	1.691	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375465873	418643817	/nfs/dbraw/zinc/64/38/17/418643817.db2.gz	RDCJRECYZAMPKC-JTQLQIEISA-N	1	1	318.337	1.578	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@H](c2nc(C3CC3)no2)C1	ZINC000375465873	418643820	/nfs/dbraw/zinc/64/38/20/418643820.db2.gz	RDCJRECYZAMPKC-JTQLQIEISA-N	1	1	318.337	1.578	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375610810	418661292	/nfs/dbraw/zinc/66/12/92/418661292.db2.gz	HDTQXXZUGZGHKB-KGLIPLIRSA-N	1	1	323.397	1.149	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@@H+](CCO)CCOc1cccc([N+](=O)[O-])c1	ZINC000361587115	418688216	/nfs/dbraw/zinc/68/82/16/418688216.db2.gz	UWNFTDBMEYHTSN-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(S(N)(=O)=O)CC1	ZINC000361744153	418704828	/nfs/dbraw/zinc/70/48/28/418704828.db2.gz	MGWVXCOUINEDQL-JTQLQIEISA-N	1	1	313.379	1.409	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000408182338	418791374	/nfs/dbraw/zinc/79/13/74/418791374.db2.gz	JJSXAAJFPIDZKI-NWDGAFQWSA-N	1	1	306.366	1.632	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[C@H](n2c[nH+]c3c2CCCC3)C1	ZINC000408386112	418800666	/nfs/dbraw/zinc/80/06/66/418800666.db2.gz	NPFRGCFYIJJTNM-NSHDSACASA-N	1	1	316.365	1.855	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411236189	418882990	/nfs/dbraw/zinc/88/29/90/418882990.db2.gz	KSFJBZXFJCZKTR-ZDUSSCGKSA-N	1	1	321.333	1.561	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411236189	418882992	/nfs/dbraw/zinc/88/29/92/418882992.db2.gz	KSFJBZXFJCZKTR-ZDUSSCGKSA-N	1	1	321.333	1.561	20	5		DDBDMO
O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC(c2cnc[nH]2)CC1	ZINC000365647244	418887261	/nfs/dbraw/zinc/88/72/61/418887261.db2.gz	CCUJVAGKXRWPJG-UHFFFAOYSA-N	1	1	317.305	1.438	20	5		DDBDMO
COC(=O)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000411357052	418896027	/nfs/dbraw/zinc/89/60/27/418896027.db2.gz	UXZPIKPGDOTXLF-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
COC(=O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000411357052	418896029	/nfs/dbraw/zinc/89/60/29/418896029.db2.gz	UXZPIKPGDOTXLF-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365840937	418915357	/nfs/dbraw/zinc/91/53/57/418915357.db2.gz	XBJOLLCGFALCMQ-MEDUHNTESA-N	1	1	319.361	1.769	20	5		DDBDMO
CN1C[C@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000365852769	418916153	/nfs/dbraw/zinc/91/61/53/418916153.db2.gz	XVZKOPSXLIVMEK-ZDUSSCGKSA-N	1	1	320.349	1.025	20	5		DDBDMO
CN1C[C@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000365852769	418916154	/nfs/dbraw/zinc/91/61/54/418916154.db2.gz	XVZKOPSXLIVMEK-ZDUSSCGKSA-N	1	1	320.349	1.025	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000365870514	418918469	/nfs/dbraw/zinc/91/84/69/418918469.db2.gz	PSHBIKQDZYWVIR-SNVBAGLBSA-N	1	1	311.363	1.451	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+](Cc2c([N+](=O)[O-])ncn2C)CC12CCC2	ZINC000373184762	418930957	/nfs/dbraw/zinc/93/09/57/418930957.db2.gz	XKQRDGBDSMYJOL-SNVBAGLBSA-N	1	1	308.338	1.103	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](Cc2c([N+](=O)[O-])ncn2C)CC12CCC2	ZINC000373184762	418930958	/nfs/dbraw/zinc/93/09/58/418930958.db2.gz	XKQRDGBDSMYJOL-SNVBAGLBSA-N	1	1	308.338	1.103	20	5		DDBDMO
CC1(C)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000420929042	419362749	/nfs/dbraw/zinc/36/27/49/419362749.db2.gz	CWIWUFXIQKVODG-CQSZACIVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000420929042	419362753	/nfs/dbraw/zinc/36/27/53/419362753.db2.gz	CWIWUFXIQKVODG-CQSZACIVSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000426481027	419483333	/nfs/dbraw/zinc/48/33/33/419483333.db2.gz	DKKVTVPHBPZAMK-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
CCOc1cc(C[N@@H+]2C[C@@H](O)C[C@H]2COC)ccc1[N+](=O)[O-]	ZINC000411916321	419484964	/nfs/dbraw/zinc/48/49/64/419484964.db2.gz	YGGCIHJJHWHZGH-STQMWFEESA-N	1	1	310.350	1.575	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](O)C[C@H]2COC)ccc1[N+](=O)[O-]	ZINC000411916321	419484973	/nfs/dbraw/zinc/48/49/73/419484973.db2.gz	YGGCIHJJHWHZGH-STQMWFEESA-N	1	1	310.350	1.575	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@]12CCOC2	ZINC000421010950	419448692	/nfs/dbraw/zinc/44/86/92/419448692.db2.gz	DBFUSZYEFKYTHY-WFASDCNBSA-N	1	1	308.334	1.199	20	5		DDBDMO
O=[N+]([O-])c1cnn(Cc2cccc(C[NH+]3CCOCC3)c2)c1	ZINC000421219353	419525283	/nfs/dbraw/zinc/52/52/83/419525283.db2.gz	UVWURPNBAJKRIN-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](C(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000411951940	419516729	/nfs/dbraw/zinc/51/67/29/419516729.db2.gz	PEZIPJGGACUOIU-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000412029100	419574013	/nfs/dbraw/zinc/57/40/13/419574013.db2.gz	COODFZNKXOBVAJ-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000412029100	419574023	/nfs/dbraw/zinc/57/40/23/419574023.db2.gz	COODFZNKXOBVAJ-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[N@@H+](C)[C@H]1C	ZINC000427058709	419589058	/nfs/dbraw/zinc/58/90/58/419589058.db2.gz	FIPLTUINBOLBGI-GXFFZTMASA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](CO)[C@H]1C	ZINC000412072592	419625340	/nfs/dbraw/zinc/62/53/40/419625340.db2.gz	HJLUJOKWROZUNS-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](CO)[C@H]1C	ZINC000412072592	419625344	/nfs/dbraw/zinc/62/53/44/419625344.db2.gz	HJLUJOKWROZUNS-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(Cc2c([N+](=O)[O-])ncn2C)C[C@@H](C)C1	ZINC000429005577	419961238	/nfs/dbraw/zinc/96/12/38/419961238.db2.gz	MNMRJNRJCPYETF-UPJWGTAASA-N	1	1	307.398	1.490	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC(F)(F)C[NH3+]	ZINC000415290269	420008874	/nfs/dbraw/zinc/00/88/74/420008874.db2.gz	CZQJIKNKWGIQCH-UHFFFAOYSA-N	1	1	302.281	1.927	20	5		DDBDMO
CC(=O)c1cc(N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000418991943	420039706	/nfs/dbraw/zinc/03/97/06/420039706.db2.gz	FFMVPCCEODGBFM-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000418991943	420039708	/nfs/dbraw/zinc/03/97/08/420039708.db2.gz	FFMVPCCEODGBFM-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000416289729	420306993	/nfs/dbraw/zinc/30/69/93/420306993.db2.gz	FVYPLCBYYBZAGA-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000416289729	420306998	/nfs/dbraw/zinc/30/69/98/420306998.db2.gz	FVYPLCBYYBZAGA-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC(C)[C@H]1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000420613906	420332128	/nfs/dbraw/zinc/33/21/28/420332128.db2.gz	UPGZTDIQWAYYGE-CYBMUJFWSA-N	1	1	306.366	1.470	20	5		DDBDMO
Cc1cccc(NC[C@](C)(O)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000302523193	230284175	/nfs/dbraw/zinc/28/41/75/230284175.db2.gz	YSGDEQRMLQARBS-HNNXBMFYSA-N	1	1	309.366	1.398	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@H](NC(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000492874499	420696741	/nfs/dbraw/zinc/69/67/41/420696741.db2.gz	PQUFSJKTSICSNE-LBPRGKRZSA-N	1	1	322.365	1.497	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](NC(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000492874499	420696744	/nfs/dbraw/zinc/69/67/44/420696744.db2.gz	PQUFSJKTSICSNE-LBPRGKRZSA-N	1	1	322.365	1.497	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000453038724	420706392	/nfs/dbraw/zinc/70/63/92/420706392.db2.gz	QNEVXAKTFKROCU-RISCZKNCSA-N	1	1	321.402	1.849	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@H](C)O)C[C@H]2C)n1	ZINC000444830512	420758538	/nfs/dbraw/zinc/75/85/38/420758538.db2.gz	WNTPDWJZGCATNH-OLZOCXBDSA-N	1	1	308.382	1.498	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@](O)(CO)C1	ZINC000459654246	420841525	/nfs/dbraw/zinc/84/15/25/420841525.db2.gz	YXTDVRKJQCTBOK-HNNXBMFYSA-N	1	1	310.350	1.313	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@](O)(CO)C1	ZINC000459654246	420841529	/nfs/dbraw/zinc/84/15/29/420841529.db2.gz	YXTDVRKJQCTBOK-HNNXBMFYSA-N	1	1	310.350	1.313	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000447816464	420803361	/nfs/dbraw/zinc/80/33/61/420803361.db2.gz	KYQMNOQDZMHFPG-GFCCVEGCSA-N	1	1	321.381	1.621	20	5		DDBDMO
COc1nccnc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000449288032	420983242	/nfs/dbraw/zinc/98/32/42/420983242.db2.gz	MEBIDULHONNOLZ-UHFFFAOYSA-N	1	1	318.337	1.427	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000488725756	421108457	/nfs/dbraw/zinc/10/84/57/421108457.db2.gz	BDKBKHIBIKDFHE-NEPJUHHUSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000564362040	421583851	/nfs/dbraw/zinc/58/38/51/421583851.db2.gz	GGUUZJVXJNHHOG-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000564362040	421583852	/nfs/dbraw/zinc/58/38/52/421583852.db2.gz	GGUUZJVXJNHHOG-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000572301298	421776481	/nfs/dbraw/zinc/77/64/81/421776481.db2.gz	ASCGHSFVYGHJLO-LBPRGKRZSA-N	1	1	303.362	1.821	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1	ZINC000587415712	422313885	/nfs/dbraw/zinc/31/38/85/422313885.db2.gz	CXVPGNLHSLTFFC-JTQLQIEISA-N	1	1	317.349	2.140	20	5		DDBDMO
Nc1n[nH]c(C2CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)n1	ZINC000595489421	422357890	/nfs/dbraw/zinc/35/78/90/422357890.db2.gz	RZZLJVHIKSERCN-UHFFFAOYSA-N	1	1	320.328	1.814	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000345573942	272281865	/nfs/dbraw/zinc/28/18/65/272281865.db2.gz	VNXGISYBOGFQRD-LLVKDONJSA-N	1	1	323.397	1.732	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12)C1CC1	ZINC000345660051	272298162	/nfs/dbraw/zinc/29/81/62/272298162.db2.gz	RWOOTRNCPRTPGY-UHFFFAOYSA-N	1	1	314.345	1.967	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)C1	ZINC000346229193	272439686	/nfs/dbraw/zinc/43/96/86/272439686.db2.gz	ROXQSCVDGWXFEA-QJPTWQEYSA-N	1	1	307.350	1.990	20	5		DDBDMO
COc1cc(N2CC[C@@H]([NH+]3CCOCC3)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000291128551	274097007	/nfs/dbraw/zinc/09/70/07/274097007.db2.gz	MXBKWFUZGXUWBM-TZMCWYRMSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275333431	274271397	/nfs/dbraw/zinc/27/13/97/274271397.db2.gz	GKGNAUPGRWGQCN-WDEREUQCSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275333431	274271398	/nfs/dbraw/zinc/27/13/98/274271398.db2.gz	GKGNAUPGRWGQCN-WDEREUQCSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1nccc2cc([N+](=O)[O-])ccc21	ZINC000450953398	274348839	/nfs/dbraw/zinc/34/88/39/274348839.db2.gz	KSILNOSYEAUHGU-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CC)C(=O)OCC	ZINC000276805861	276000247	/nfs/dbraw/zinc/00/02/47/276000247.db2.gz	MPDWFXUHUJMPKI-LBPRGKRZSA-N	1	1	312.370	1.845	20	5		DDBDMO
CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CC)C(=O)OCC	ZINC000276805861	276000251	/nfs/dbraw/zinc/00/02/51/276000251.db2.gz	MPDWFXUHUJMPKI-LBPRGKRZSA-N	1	1	312.370	1.845	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC23CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000408067468	280187668	/nfs/dbraw/zinc/18/76/68/280187668.db2.gz	CJMRCJROSMYFFF-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
Cc1c(CC(=O)NC[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000121834977	281145361	/nfs/dbraw/zinc/14/53/61/281145361.db2.gz	DCRGXJORCLALAC-CYBMUJFWSA-N	1	1	305.378	1.904	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](C2CCOCC2)C1	ZINC000362471779	300072144	/nfs/dbraw/zinc/07/21/44/300072144.db2.gz	SSNJAWXJCZQIKV-CQSZACIVSA-N	1	1	321.377	1.505	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000363616941	300287914	/nfs/dbraw/zinc/28/79/14/300287914.db2.gz	YRKJPJBDRCESJV-LSDHHAIUSA-N	1	1	321.352	1.572	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)C[C@@H]21	ZINC000364307974	300373288	/nfs/dbraw/zinc/37/32/88/300373288.db2.gz	NTTLXUNWYNSWHL-HZMBPMFUSA-N	1	1	304.350	1.343	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[NH+]([C@H]3CCOC3)CC1)CCN2	ZINC000365543897	300531526	/nfs/dbraw/zinc/53/15/26/300531526.db2.gz	GMNOXYGOOAPARD-LBPRGKRZSA-N	1	1	318.377	1.474	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000368952734	301109406	/nfs/dbraw/zinc/10/94/06/301109406.db2.gz	XEMHFXPZGJHAJE-UGFHNGPFSA-N	1	1	319.361	1.559	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368966166	301113001	/nfs/dbraw/zinc/11/30/01/301113001.db2.gz	NLCHNDLEPWJAMO-CZUORRHYSA-N	1	1	323.393	1.017	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000369695124	301213883	/nfs/dbraw/zinc/21/38/83/301213883.db2.gz	LDNPLAWWWAAUHD-UHFFFAOYSA-N	1	1	320.393	1.862	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(OC[C@H]2CCCO2)CC1	ZINC000370236437	301300314	/nfs/dbraw/zinc/30/03/14/301300314.db2.gz	RCEPAPPMULVAHJ-CYBMUJFWSA-N	1	1	324.381	1.488	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000398742308	302361803	/nfs/dbraw/zinc/36/18/03/302361803.db2.gz	WSYVZWMTDHNUPR-WDEREUQCSA-N	1	1	307.350	1.144	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000531143182	303232541	/nfs/dbraw/zinc/23/25/41/303232541.db2.gz	QEXJAYAZUAPYJQ-ZDUSSCGKSA-N	1	1	304.350	1.674	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@H]1CCCC[C@H]1[NH+]1CCOCC1	ZINC000531912026	303265544	/nfs/dbraw/zinc/26/55/44/303265544.db2.gz	QPXMKRKSUVLUTE-NWDGAFQWSA-N	1	1	309.370	1.384	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CC3=CCCOC3)CC2)cn1	ZINC000534336853	303331864	/nfs/dbraw/zinc/33/18/64/303331864.db2.gz	PDCIIHDHSNXPPP-UHFFFAOYSA-N	1	1	304.350	1.459	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000363939921	307038296	/nfs/dbraw/zinc/03/82/96/307038296.db2.gz	VKHWGRNMCGBCGF-OLZOCXBDSA-N	1	1	319.361	1.960	20	5		DDBDMO
CC[C@@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373248112	307182661	/nfs/dbraw/zinc/18/26/61/307182661.db2.gz	WIVKSSIRKSMZCN-LLVKDONJSA-N	1	1	309.370	1.343	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](O)C2(CC2)C1	ZINC000373514606	307189676	/nfs/dbraw/zinc/18/96/76/307189676.db2.gz	UYZVHVCRXBTXFZ-ZWNOBZJWSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](O)C2(CC2)C1	ZINC000373514606	307189677	/nfs/dbraw/zinc/18/96/77/307189677.db2.gz	UYZVHVCRXBTXFZ-ZWNOBZJWSA-N	1	1	305.334	1.379	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCN([C@H]2CCC[N@H+](C)C2)CC1	ZINC000374220998	307204198	/nfs/dbraw/zinc/20/41/98/307204198.db2.gz	TYMFFXVXVZLTPF-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000375505426	307227090	/nfs/dbraw/zinc/22/70/90/307227090.db2.gz	HBXSXRHXIBEXJV-NSHDSACASA-N	1	1	324.337	1.396	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000425059414	307301760	/nfs/dbraw/zinc/30/17/60/307301760.db2.gz	ROJXDTWQYLIMSY-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000572375681	308219835	/nfs/dbraw/zinc/21/98/35/308219835.db2.gz	SZUIAXPZCLGTBV-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000572375681	308219836	/nfs/dbraw/zinc/21/98/36/308219836.db2.gz	SZUIAXPZCLGTBV-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000572375681	308219837	/nfs/dbraw/zinc/21/98/37/308219837.db2.gz	SZUIAXPZCLGTBV-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=C1NCC[C@@H]1CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000575192652	308273283	/nfs/dbraw/zinc/27/32/83/308273283.db2.gz	JMIKJCRHCFVURF-NEPJUHHUSA-N	1	1	319.365	1.002	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nc(-c3ccccc3[N+](=O)[O-])oc2=O)C1	ZINC000577371152	308382906	/nfs/dbraw/zinc/38/29/06/308382906.db2.gz	QCUXFOWPIWFNHI-JTQLQIEISA-N	1	1	304.306	1.363	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CC[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000582530248	337105482	/nfs/dbraw/zinc/10/54/82/337105482.db2.gz	MEGHEPXOYKGIJW-JTQLQIEISA-N	1	1	307.354	1.103	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H](C)CN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000434699914	533790451	/nfs/dbraw/zinc/79/04/51/533790451.db2.gz	PCULDAGAXRRPHI-ZDUSSCGKSA-N	1	1	323.393	1.756	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[C@H]2CCC[N@@H+](C)C2)n1	ZINC000413448065	534245212	/nfs/dbraw/zinc/24/52/12/534245212.db2.gz	WIPSJWPFJVCANC-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000330973387	527852155	/nfs/dbraw/zinc/85/21/55/527852155.db2.gz	KUFMPEPZBBQCFZ-OAHLLOKOSA-N	1	1	320.393	1.805	20	5		DDBDMO
CC(C)[C@](C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(N)=O	ZINC000459473942	527950103	/nfs/dbraw/zinc/95/01/03/527950103.db2.gz	DPLXVKFZIJQAQS-AWEZNQCLSA-N	1	1	305.338	1.461	20	5		DDBDMO
C[C@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000736024923	598522576	/nfs/dbraw/zinc/52/25/76/598522576.db2.gz	CIPURFGQGBRUNO-SECBINFHSA-N	1	1	317.353	1.670	20	5		DDBDMO
C[N@@H+]1CC=C(CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC1	ZINC000826023091	608587138	/nfs/dbraw/zinc/58/71/38/608587138.db2.gz	XCSBFCSEXSPGGU-UHFFFAOYSA-N	1	1	315.337	1.449	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000153920745	696923524	/nfs/dbraw/zinc/92/35/24/696923524.db2.gz	WOEMMHMHEKODFY-NHYWBVRUSA-N	1	1	322.361	1.902	20	5		DDBDMO
CCOC[C@@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000177629425	697414495	/nfs/dbraw/zinc/41/44/95/697414495.db2.gz	JPZHQFUPNRQVLF-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000177629425	697414497	/nfs/dbraw/zinc/41/44/97/697414497.db2.gz	JPZHQFUPNRQVLF-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
COCCO[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000179333388	697436375	/nfs/dbraw/zinc/43/63/75/697436375.db2.gz	SYZLMZACQIPKTC-CVEARBPZSA-N	1	1	324.377	1.756	20	5		DDBDMO
COCC(=O)N1CCC([N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000985189318	697465003	/nfs/dbraw/zinc/46/50/03/697465003.db2.gz	LHYFLXGDPJELNL-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000194731297	697719049	/nfs/dbraw/zinc/71/90/49/697719049.db2.gz	VDNBNMMSYIWDFL-LLVKDONJSA-N	1	1	322.321	1.635	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](C3OCCO3)C2)cc1	ZINC000776582958	698121618	/nfs/dbraw/zinc/12/16/18/698121618.db2.gz	XSCFOWVCVMUPSE-ZFWWWQNUSA-N	1	1	322.361	1.713	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000776590431	698123526	/nfs/dbraw/zinc/12/35/26/698123526.db2.gz	DNNCWUIJMPFJST-HONMWMINSA-N	1	1	308.334	1.369	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776596662	698124699	/nfs/dbraw/zinc/12/46/99/698124699.db2.gz	HKDQJZHPLPYYDN-CQSZACIVSA-N	1	1	309.366	1.332	20	5		DDBDMO
O=C1OCC[C@@H]1CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246983604	698358854	/nfs/dbraw/zinc/35/88/54/698358854.db2.gz	QAGWSUMBXJLCBW-NWDGAFQWSA-N	1	1	320.349	1.429	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000783628718	698861984	/nfs/dbraw/zinc/86/19/84/698861984.db2.gz	LSDHOPSENFJARQ-GFCCVEGCSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000783628718	698861987	/nfs/dbraw/zinc/86/19/87/698861987.db2.gz	LSDHOPSENFJARQ-GFCCVEGCSA-N	1	1	312.801	1.584	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@H](CO)[C@H](CO)C2)c1	ZINC000704801727	699238271	/nfs/dbraw/zinc/23/82/71/699238271.db2.gz	KGWMTHYDMGQLJM-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2C[C@H](CO)[C@H](CO)C2)c1	ZINC000704801727	699238274	/nfs/dbraw/zinc/23/82/74/699238274.db2.gz	KGWMTHYDMGQLJM-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
CC(C)[C@@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+](C)C	ZINC000787960884	699260971	/nfs/dbraw/zinc/26/09/71/699260971.db2.gz	IWOIXXZWNAFLFV-AWEZNQCLSA-N	1	1	323.349	1.663	20	5		DDBDMO
C[N@H+](CCCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000788278130	699296621	/nfs/dbraw/zinc/29/66/21/699296621.db2.gz	CHNPRCDBCUAMLI-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[N@@H+](CCCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000788278130	699296624	/nfs/dbraw/zinc/29/66/24/699296624.db2.gz	CHNPRCDBCUAMLI-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3OC)C[C@@H]21	ZINC000794953208	699837660	/nfs/dbraw/zinc/83/76/60/699837660.db2.gz	PYNBRNKXYOSSLR-IMRBUKKESA-N	1	1	306.318	1.454	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3OC)C[C@@H]21	ZINC000794953208	699837663	/nfs/dbraw/zinc/83/76/63/699837663.db2.gz	PYNBRNKXYOSSLR-IMRBUKKESA-N	1	1	306.318	1.454	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CC[NH+]1CCOCC1	ZINC000801567963	700322771	/nfs/dbraw/zinc/32/27/71/700322771.db2.gz	OOTRKKLKFXPBAI-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)[C@H](C)C1	ZINC000761067603	700838069	/nfs/dbraw/zinc/83/80/69/700838069.db2.gz	FYWYKDJWQKISFF-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@@H+]1C	ZINC000761075716	700839736	/nfs/dbraw/zinc/83/97/36/700839736.db2.gz	LHYAAAOGCITWNF-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+]1C	ZINC000761075716	700839739	/nfs/dbraw/zinc/83/97/39/700839739.db2.gz	LHYAAAOGCITWNF-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@@H+](C)[C@@H](C)C1	ZINC000761079111	700840621	/nfs/dbraw/zinc/84/06/21/700840621.db2.gz	PSULDHKXYGXESO-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804460814	701191713	/nfs/dbraw/zinc/19/17/13/701191713.db2.gz	AFBNRVXYTHBGPN-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839718435	701795791	/nfs/dbraw/zinc/79/57/91/701795791.db2.gz	POWFVVJUBHXFIP-SJXGUFTOSA-N	1	1	317.389	1.773	20	5		DDBDMO
CC(C)(CCc1noc([C@H]2CCn3cc[nH+]c3C2)n1)[N+](=O)[O-]	ZINC000812815099	702246744	/nfs/dbraw/zinc/24/67/44/702246744.db2.gz	YLDLBZJUVLMXJI-JTQLQIEISA-N	1	1	305.338	1.984	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000817370097	702356394	/nfs/dbraw/zinc/35/63/94/702356394.db2.gz	GTDSQGRWKGPMSZ-LLVKDONJSA-N	1	1	317.349	1.278	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1	ZINC000844448729	703032897	/nfs/dbraw/zinc/03/28/97/703032897.db2.gz	GSFHVDIUPZWQGM-RTXFEEFZSA-N	1	1	314.288	1.531	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[N@H+]3CCCC[C@H]23)c1	ZINC000818959294	704035224	/nfs/dbraw/zinc/03/52/24/704035224.db2.gz	HQCBESFHOLHNNH-ARFHVFGLSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCN3CCCC[C@H]23)c1	ZINC000818959294	704035230	/nfs/dbraw/zinc/03/52/30/704035230.db2.gz	HQCBESFHOLHNNH-ARFHVFGLSA-N	1	1	305.378	1.845	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534770	704070132	/nfs/dbraw/zinc/07/01/32/704070132.db2.gz	PNXFOWLMAUMQOX-RISCZKNCSA-N	1	1	307.306	1.971	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534770	704070135	/nfs/dbraw/zinc/07/01/35/704070135.db2.gz	PNXFOWLMAUMQOX-RISCZKNCSA-N	1	1	307.306	1.971	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870861547	704148061	/nfs/dbraw/zinc/14/80/61/704148061.db2.gz	BPPDIXCZNGWPER-UKRRQHHQSA-N	1	1	307.350	1.406	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000856733290	704535922	/nfs/dbraw/zinc/53/59/22/704535922.db2.gz	WCRYVEJSIIWMFC-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@](O)(c3ccccc3)C2)n1	ZINC000859585812	704943660	/nfs/dbraw/zinc/94/36/60/704943660.db2.gz	CYNLNNOECVNSAF-MRXNPFEDSA-N	1	1	316.361	1.775	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)cc1	ZINC000859924611	705042566	/nfs/dbraw/zinc/04/25/66/705042566.db2.gz	MLZGCFTWNYKWNT-CWRNSKLLSA-N	1	1	306.362	1.723	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000874845928	705200889	/nfs/dbraw/zinc/20/08/89/705200889.db2.gz	YUROPSXLQFQSHA-GJZGRUSLSA-N	1	1	319.361	1.669	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000824221299	705402470	/nfs/dbraw/zinc/40/24/70/705402470.db2.gz	FRPCMBBPWOBEGM-GFCCVEGCSA-N	1	1	323.397	1.288	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000825682717	705713885	/nfs/dbraw/zinc/71/38/85/705713885.db2.gz	BHPMLWLCTXRDFF-AWEZNQCLSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(C3(C)OCCO3)CC2)c([N+](=O)[O-])n1	ZINC000876726682	705842045	/nfs/dbraw/zinc/84/20/45/705842045.db2.gz	NLIHJUXRRXXWGJ-UHFFFAOYSA-N	1	1	310.354	1.303	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c(N)c([N+](=O)[O-])c1	ZINC000827312339	705973494	/nfs/dbraw/zinc/97/34/94/705973494.db2.gz	UNMORWJSMQSIBG-WCQYABFASA-N	1	1	318.377	1.652	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827320513	705975051	/nfs/dbraw/zinc/97/50/51/705975051.db2.gz	RZBLQYDYIYZJMY-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000827675021	706047025	/nfs/dbraw/zinc/04/70/25/706047025.db2.gz	NHDQVPLWNOXMCS-RISCZKNCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000827675021	706047029	/nfs/dbraw/zinc/04/70/29/706047029.db2.gz	NHDQVPLWNOXMCS-RISCZKNCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000827808258	706070349	/nfs/dbraw/zinc/07/03/49/706070349.db2.gz	XULJHHRWXLKRDA-GFCCVEGCSA-N	1	1	321.377	1.841	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(C)(C)O)C2)c1	ZINC000877836273	706227623	/nfs/dbraw/zinc/22/76/23/706227623.db2.gz	SDDYOFMDYWTCHF-ZDUSSCGKSA-N	1	1	322.361	1.974	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CO)(CO)CC1	ZINC000879967129	706837134	/nfs/dbraw/zinc/83/71/34/706837134.db2.gz	LFXVQQDPOZAALH-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
COC(=O)CC[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000880042640	706861931	/nfs/dbraw/zinc/86/19/31/706861931.db2.gz	FOEFXJZKMMDECH-ZDUSSCGKSA-N	1	1	324.381	1.765	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@H](C(F)(F)F)O1	ZINC000880056154	706865697	/nfs/dbraw/zinc/86/56/97/706865697.db2.gz	CAELRYGIQQLFMN-NXEZZACHSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@H](C(F)(F)F)O1	ZINC000880056154	706865700	/nfs/dbraw/zinc/86/57/00/706865700.db2.gz	CAELRYGIQQLFMN-NXEZZACHSA-N	1	1	322.287	1.833	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832450857	706916949	/nfs/dbraw/zinc/91/69/49/706916949.db2.gz	POVCLOHFRFQGCJ-LSDHHAIUSA-N	1	1	321.377	1.619	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1CO	ZINC000880438292	706976338	/nfs/dbraw/zinc/97/63/38/706976338.db2.gz	AGZCQMCSYCZIKO-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1[C@H](C)CC[C@@H]1CO	ZINC000880438292	706976339	/nfs/dbraw/zinc/97/63/39/706976339.db2.gz	AGZCQMCSYCZIKO-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880526041	707003718	/nfs/dbraw/zinc/00/37/18/707003718.db2.gz	BIXFRWVOPSLYHB-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880526041	707003719	/nfs/dbraw/zinc/00/37/19/707003719.db2.gz	BIXFRWVOPSLYHB-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1nc2ccccn2c1[N+](=O)[O-]	ZINC000872781393	707597988	/nfs/dbraw/zinc/59/79/88/707597988.db2.gz	SNOOOTIVEXZASB-RYUDHWBXSA-N	1	1	301.350	1.915	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000837549119	707678724	/nfs/dbraw/zinc/67/87/24/707678724.db2.gz	ZGZIUDHJQSEHAV-UHFFFAOYSA-N	1	1	311.313	1.322	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)OCC[N@@H+](C)Cc2ccccc2)n1	ZINC000837611524	707695609	/nfs/dbraw/zinc/69/56/09/707695609.db2.gz	DHNZIYUOGOUIEI-UHFFFAOYSA-N	1	1	318.333	1.617	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)CN1CCN(C)CC1	ZINC000873045485	707707458	/nfs/dbraw/zinc/70/74/58/707707458.db2.gz	FVYUGOKFOSAJST-CQSZACIVSA-N	1	1	320.437	1.937	20	5		DDBDMO
C[C@H](CNC(=O)NC[C@@H]1CC[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000896619909	708099012	/nfs/dbraw/zinc/09/90/12/708099012.db2.gz	OMGMOUBJDIKLFS-NEPJUHHUSA-N	1	1	306.366	1.702	20	5		DDBDMO
COc1cc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221296	708259348	/nfs/dbraw/zinc/25/93/48/708259348.db2.gz	KYGCWZGFLOFPIZ-KGLIPLIRSA-N	1	1	321.377	1.639	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000893267418	710583028	/nfs/dbraw/zinc/58/30/28/710583028.db2.gz	YWGHRFYNGJDSBJ-CYBMUJFWSA-N	1	1	320.393	1.921	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000902425918	710750561	/nfs/dbraw/zinc/75/05/61/710750561.db2.gz	PJRFRINHKONPGF-NSHDSACASA-N	1	1	318.333	1.787	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000902425918	710750566	/nfs/dbraw/zinc/75/05/66/710750566.db2.gz	PJRFRINHKONPGF-NSHDSACASA-N	1	1	318.333	1.787	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000893941815	710894994	/nfs/dbraw/zinc/89/49/94/710894994.db2.gz	WWXPVMKHDVDUOZ-ZYHUDNBSSA-N	1	1	320.349	1.307	20	5		DDBDMO
COc1cc([C@H](C)[NH2+]CCS(C)(=O)=O)cc([N+](=O)[O-])c1	ZINC000903084057	711027244	/nfs/dbraw/zinc/02/72/44/711027244.db2.gz	ULDBKLCFNFOQFH-VIFPVBQESA-N	1	1	302.352	1.299	20	5		DDBDMO
CON(C)C(=O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000895040701	711380801	/nfs/dbraw/zinc/38/08/01/711380801.db2.gz	DHCNNKYPLQPAAA-UHFFFAOYSA-N	1	1	319.317	1.964	20	5		DDBDMO
COc1cc(C[NH2+]C[C@@H]2CC(C)=NO2)c([N+](=O)[O-])cc1OC	ZINC000895310487	711480575	/nfs/dbraw/zinc/48/05/75/711480575.db2.gz	IBDPOICAAMDLOJ-NSHDSACASA-N	1	1	309.322	1.866	20	5		DDBDMO
Nc1ccc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)nc1[N+](=O)[O-]	ZINC000895567635	711544477	/nfs/dbraw/zinc/54/44/77/711544477.db2.gz	GFEKGOCBMAVIJC-WDEREUQCSA-N	1	1	309.395	1.564	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000896257519	711697237	/nfs/dbraw/zinc/69/72/37/711697237.db2.gz	GSUBNGXWRSUAPB-ZDUSSCGKSA-N	1	1	321.377	1.662	20	5		DDBDMO
C[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCO1	ZINC000905740083	712135517	/nfs/dbraw/zinc/13/55/17/712135517.db2.gz	QOKGLQJXUDJCHC-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCO1	ZINC000905740083	712135520	/nfs/dbraw/zinc/13/55/20/712135520.db2.gz	QOKGLQJXUDJCHC-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1	ZINC000917228684	713488466	/nfs/dbraw/zinc/48/84/66/713488466.db2.gz	ZJMIPDVHVTWJMD-MRVPVSSYSA-N	1	1	316.155	1.613	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1	ZINC000917228684	713488468	/nfs/dbraw/zinc/48/84/68/713488468.db2.gz	ZJMIPDVHVTWJMD-MRVPVSSYSA-N	1	1	316.155	1.613	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000931380449	714079542	/nfs/dbraw/zinc/07/95/42/714079542.db2.gz	PLCMLEJVPJXDQH-NSHDSACASA-N	1	1	323.176	1.942	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000931380449	714079543	/nfs/dbraw/zinc/07/95/43/714079543.db2.gz	PLCMLEJVPJXDQH-NSHDSACASA-N	1	1	323.176	1.942	20	5		DDBDMO
C[C@@H]1[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000922556756	714087990	/nfs/dbraw/zinc/08/79/90/714087990.db2.gz	JKTKCGRYKMGLSF-PWSUYJOCSA-N	1	1	307.350	1.548	20	5		DDBDMO
C[C@@H]1[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000922556756	714087992	/nfs/dbraw/zinc/08/79/92/714087992.db2.gz	JKTKCGRYKMGLSF-PWSUYJOCSA-N	1	1	307.350	1.548	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@H+]2CCCOc1ccc([N+](=O)[O-])cc1	ZINC000932930543	714439399	/nfs/dbraw/zinc/43/93/99/714439399.db2.gz	CLHGXDZXMIJFIJ-UHFFFAOYSA-N	1	1	319.361	1.846	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2	ZINC000933756312	714665080	/nfs/dbraw/zinc/66/50/80/714665080.db2.gz	SHEFGWGIUFBGDN-BBRMVZONSA-N	1	1	303.362	1.725	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000934117985	714746174	/nfs/dbraw/zinc/74/61/74/714746174.db2.gz	QWTYMKBEIMBFFC-YRGRVCCFSA-N	1	1	310.350	1.444	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000934131116	714751541	/nfs/dbraw/zinc/75/15/41/714751541.db2.gz	KBRRFIBMVMTPOZ-AEGPPILISA-N	1	1	310.350	1.444	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000934131119	714751579	/nfs/dbraw/zinc/75/15/79/714751579.db2.gz	KBRRFIBMVMTPOZ-NWANDNLSSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3CCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025778044	736849542	/nfs/dbraw/zinc/84/95/42/736849542.db2.gz	PNDSMKGJUUBJDJ-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CCC3CCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025778044	736849546	/nfs/dbraw/zinc/84/95/46/736849546.db2.gz	PNDSMKGJUUBJDJ-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3CCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025778044	736849549	/nfs/dbraw/zinc/84/95/49/736849549.db2.gz	PNDSMKGJUUBJDJ-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(c2cc(N)c([N+](=O)[O-])cn2)C1	ZINC001120931191	782241829	/nfs/dbraw/zinc/24/18/29/782241829.db2.gz	DWHPTDQANAUNBR-UHFFFAOYSA-N	1	1	313.361	1.893	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC001121199297	782406059	/nfs/dbraw/zinc/40/60/59/782406059.db2.gz	NWIVISKYVGODAB-QCZZGDTMSA-N	1	1	307.325	1.804	20	5		DDBDMO
Cc1nsc(C)c1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001022063951	734368172	/nfs/dbraw/zinc/36/81/72/734368172.db2.gz	QNABSTYGPUJQLK-LSCVPOLPSA-N	1	1	324.406	1.162	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063698	734368299	/nfs/dbraw/zinc/36/82/99/734368299.db2.gz	HYCAIANXMRTFIT-LXTVHRRPSA-N	1	1	303.362	1.131	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C(F)F	ZINC001025643818	736807664	/nfs/dbraw/zinc/80/76/64/736807664.db2.gz	DWXYNLGOHLFKFW-IAZYJMLFSA-N	1	1	311.288	1.406	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CC(C)(C)C1CC1	ZINC001126716429	741803678	/nfs/dbraw/zinc/80/36/78/741803678.db2.gz	JDURXMUWRSDGFE-UHFFFAOYSA-N	1	1	323.397	1.360	20	5		DDBDMO
Cc1ccc(CC[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001031661769	747336299	/nfs/dbraw/zinc/33/62/99/747336299.db2.gz	HXFZXUWXDQLBJN-HZPDHXFCSA-N	1	1	317.389	1.251	20	5		DDBDMO
O=C(NCC1C[NH+](CCC2=CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031663117	747338647	/nfs/dbraw/zinc/33/86/47/747338647.db2.gz	VCNAOFJAZOZROM-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)/C=C/C(C)(C)C	ZINC001124884159	748595169	/nfs/dbraw/zinc/59/51/69/748595169.db2.gz	YBIUPJKCYGGLMY-AATRIKPKSA-N	1	1	309.370	1.136	20	5		DDBDMO
CC(=O)N1CCCC[C@]12CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169030351	762186756	/nfs/dbraw/zinc/18/67/56/762186756.db2.gz	YYQFHTZRXZOLFS-ARFHVFGLSA-N	1	1	309.410	1.909	20	5		DDBDMO
CCn1nnc2c1CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@@H]2COC	ZINC001169022284	762201011	/nfs/dbraw/zinc/20/10/11/762201011.db2.gz	RQTAVOGLFBBUGT-OUCADQQQSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1CC[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@@H]2COC	ZINC001169022284	762201015	/nfs/dbraw/zinc/20/10/15/762201015.db2.gz	RQTAVOGLFBBUGT-OUCADQQQSA-N	1	1	323.397	1.289	20	5		DDBDMO
COC[C@H]1Cn2nccc2C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169026721	762203418	/nfs/dbraw/zinc/20/34/18/762203418.db2.gz	NLIUFLOZFOOPOV-MGPQQGTHSA-N	1	1	308.382	1.407	20	5		DDBDMO
Cc1ccc(C)c(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001020138860	760612943	/nfs/dbraw/zinc/61/29/43/760612943.db2.gz	FHLCJGYUEJEFAD-KLHDSHLOSA-N	1	1	317.389	1.705	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC001170347547	766278221	/nfs/dbraw/zinc/27/82/21/766278221.db2.gz	RTRXKOKQNNSVKK-ZYHUDNBSSA-N	1	1	307.350	1.342	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1	ZINC001170900527	771898925	/nfs/dbraw/zinc/89/89/25/771898925.db2.gz	VKSVOVPJBCVIDZ-JTQLQIEISA-N	1	1	308.260	1.929	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ncc([N+](=O)[O-])cc1C	ZINC001093787371	775078444	/nfs/dbraw/zinc/07/84/44/775078444.db2.gz	AZIXQJXMWYVQIP-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(CC)c1ncccc1[N+](=O)[O-]	ZINC001100576554	776320681	/nfs/dbraw/zinc/32/06/81/776320681.db2.gz	IJCVMMSLTSAWJJ-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](CO)[C@@H](O)C1)CC2	ZINC001172902309	776915747	/nfs/dbraw/zinc/91/57/47/776915747.db2.gz	AKFINVJCANPYTF-INMHGKMJSA-N	1	1	320.389	1.517	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(N2CCC([NH+]3CC(O)C3)CC2)c(F)c1	ZINC001173010130	776960122	/nfs/dbraw/zinc/96/01/22/776960122.db2.gz	MRPBXFOHBRYOQE-UHFFFAOYSA-N	1	1	313.304	1.518	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2nncn2CC1	ZINC001173219955	777052551	/nfs/dbraw/zinc/05/25/51/777052551.db2.gz	ADLGVROIAJEPEF-LBPRGKRZSA-N	1	1	301.350	1.676	20	5		DDBDMO
CC1(C)CC(=O)N1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC001116816092	780563550	/nfs/dbraw/zinc/56/35/50/780563550.db2.gz	PBWVAJVOMPYWNP-UHFFFAOYSA-N	1	1	307.354	1.397	20	5		DDBDMO
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC001119386253	781430897	/nfs/dbraw/zinc/43/08/97/781430897.db2.gz	GWPQUSZFQMLOLU-WDEREUQCSA-N	1	1	324.312	1.017	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001119444482	781455377	/nfs/dbraw/zinc/45/53/77/781455377.db2.gz	ZNNWWYYEQHIKAM-OAHLLOKOSA-N	1	1	318.377	1.757	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC001119984888	781709466	/nfs/dbraw/zinc/70/94/66/781709466.db2.gz	WZNLULNCDVLPPQ-CHWSQXEVSA-N	1	1	306.366	1.334	20	5		DDBDMO
CN(C)c1[nH+]cc(CN2Cc3ccc([N+](=O)[O-])cc3C2)n1C	ZINC001326684631	861540320	/nfs/dbraw/zinc/54/03/20/861540320.db2.gz	ZXPJJCUYQPJODW-UHFFFAOYSA-N	1	1	301.350	1.910	20	5		DDBDMO
O=[N+]([O-])C[C@@H](OC[C@@H]1C[N@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961843	881612692	/nfs/dbraw/zinc/61/26/92/881612692.db2.gz	SBEBDIARCKVSJI-DLBZAZTESA-N	1	1	320.389	1.959	20	5		DDBDMO
O=[N+]([O-])C[C@@H](OC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961843	881612698	/nfs/dbraw/zinc/61/26/98/881612698.db2.gz	SBEBDIARCKVSJI-DLBZAZTESA-N	1	1	320.389	1.959	20	5		DDBDMO
CC/C=C(/C)C(=O)NCC1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001277013063	881658936	/nfs/dbraw/zinc/65/89/36/881658936.db2.gz	AVNBOXVVOVEORS-WZUFQYTHSA-N	1	1	321.381	1.423	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@@H]21	ZINC001157264856	863693046	/nfs/dbraw/zinc/69/30/46/863693046.db2.gz	GEPSZCIJDYKNPW-KOLCDFICSA-N	1	1	312.757	1.412	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@@H]21	ZINC001157264856	863693050	/nfs/dbraw/zinc/69/30/50/863693050.db2.gz	GEPSZCIJDYKNPW-KOLCDFICSA-N	1	1	312.757	1.412	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1NC1C[NH+](C(C)C)C1	ZINC001157531526	863894649	/nfs/dbraw/zinc/89/46/49/863894649.db2.gz	NDWYKDZOBAAVSD-UHFFFAOYSA-N	1	1	308.338	1.671	20	5		DDBDMO
COc1cc(C(=O)NCC[NH+]2CC=CC2)c([N+](=O)[O-])cc1OC	ZINC001330810268	864622787	/nfs/dbraw/zinc/62/27/87/864622787.db2.gz	TYMQPHVGCMGDSM-UHFFFAOYSA-N	1	1	321.333	1.214	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([NH2+]C3CCC3)CC2)c1[N+](=O)[O-]	ZINC001158566179	864732825	/nfs/dbraw/zinc/73/28/25/864732825.db2.gz	AYRXNIMNUFEXKB-UHFFFAOYSA-N	1	1	307.354	1.373	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC001160152792	865701812	/nfs/dbraw/zinc/70/18/12/865701812.db2.gz	GJVWUGCKOLYUEC-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1nc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160721463	866065551	/nfs/dbraw/zinc/06/55/51/866065551.db2.gz	YUSPWAUVMWAWBT-JSGCOSHPSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@H](O)[C@@H](F)CC2)ncc1[N+](=O)[O-]	ZINC001164237333	869046353	/nfs/dbraw/zinc/04/63/53/869046353.db2.gz	JHXOLOBMZRCXDI-XXAOMFGQSA-N	1	1	324.356	1.821	20	5		DDBDMO
[NH3+][C@@H]1CN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])CCC1(F)F	ZINC001164323901	869127588	/nfs/dbraw/zinc/12/75/88/869127588.db2.gz	ONDOFWXRJNPDAC-SSDOTTSWSA-N	1	1	308.672	1.054	20	5		DDBDMO
Cc1ncc(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)o1	ZINC001164494281	869231583	/nfs/dbraw/zinc/23/15/83/869231583.db2.gz	CYVXUPGRTPDPKC-CHWSQXEVSA-N	1	1	322.365	1.024	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)n1	ZINC001298101788	870278610	/nfs/dbraw/zinc/27/86/10/870278610.db2.gz	AJJNPSZBJPPSEO-MRXNPFEDSA-N	1	1	318.377	1.856	20	5		DDBDMO
COc1cccc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001339177414	870388542	/nfs/dbraw/zinc/38/85/42/870388542.db2.gz	YXOIZOKHOHPASY-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)n1	ZINC001339997520	870830746	/nfs/dbraw/zinc/83/07/46/870830746.db2.gz	CPOXNOCVLVEBJF-OUAUKWLOSA-N	1	1	320.349	1.529	20	5		DDBDMO
Cc1ccc(C[NH2+]CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1	ZINC001317584992	871143252	/nfs/dbraw/zinc/14/32/52/871143252.db2.gz	LSFZZKYNZFFMMG-HUUCEWRRSA-N	1	1	305.378	1.517	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(NCC[N@H+]2CCc3ccccc3C2)n1	ZINC001306925522	871381396	/nfs/dbraw/zinc/38/13/96/871381396.db2.gz	KVZJWOKKDXGZKZ-UHFFFAOYSA-N	1	1	301.350	1.799	20	5		DDBDMO
CC/C=C/CC[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001205224672	871442769	/nfs/dbraw/zinc/44/27/69/871442769.db2.gz	WEXJYHMMVRYBPO-LRPXVYOUSA-N	1	1	309.410	1.836	20	5		DDBDMO
C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCN1C	ZINC001345719711	873487763	/nfs/dbraw/zinc/48/77/63/873487763.db2.gz	PHZLXQIRIZAJEB-SMDDNHRTSA-N	1	1	321.381	1.351	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1	ZINC001349696120	875310284	/nfs/dbraw/zinc/31/02/84/875310284.db2.gz	ZFCMKJFTIVKZTG-LEWSCRJBSA-N	1	1	319.361	1.673	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001227465800	883033230	/nfs/dbraw/zinc/03/32/30/883033230.db2.gz	JSXVPMQJEYLEDI-LLVKDONJSA-N	1	1	311.294	1.603	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001300264569	877259510	/nfs/dbraw/zinc/25/95/10/877259510.db2.gz	JSLMUZSUJRXSQW-UHFFFAOYSA-N	1	1	308.382	1.885	20	5		DDBDMO
Cc1ccc(NC[C@@]2(CO)COC[C@@H]3CCC[N@H+]32)c([N+](=O)[O-])c1	ZINC001354397144	877948617	/nfs/dbraw/zinc/94/86/17/877948617.db2.gz	YMQRXWLWHFPAND-XJKSGUPXSA-N	1	1	321.377	1.541	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CO[C@@H](C)C[NH+]1CCOCC1	ZINC001223103608	880829835	/nfs/dbraw/zinc/82/98/35/880829835.db2.gz	CXDWMJKQVAGEPP-LBPRGKRZSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CO[C@@H](C)C[NH+]1CCOCC1	ZINC001223944144	881157562	/nfs/dbraw/zinc/15/75/62/881157562.db2.gz	XPELJJNZNVVRKS-LBPRGKRZSA-N	1	1	310.350	1.841	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nccc(Cl)c2[N+](=O)[O-])C1	ZINC001228018375	883290184	/nfs/dbraw/zinc/29/01/84/883290184.db2.gz	YDTDUGQQIVEVSQ-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCNC2(CC[NH2+]CC2)C1	ZINC001246606871	892732437	/nfs/dbraw/zinc/73/24/37/892732437.db2.gz	SPUFAHPDORJYJH-CQSZACIVSA-N	1	1	318.421	1.553	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(CCNC2=O)C1	ZINC001254553085	896498938	/nfs/dbraw/zinc/49/89/38/896498938.db2.gz	RWVQEIUHSFCQJW-LRDDRELGSA-N	1	1	303.362	1.738	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@@H]3C[C@H](CO)C[C@H]31)C2	ZINC001254594707	896520865	/nfs/dbraw/zinc/52/08/65/896520865.db2.gz	SPQVGZUGZHGYPP-GAEVZRCVSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@@H]3C[C@H](CO)C[C@H]31)C2	ZINC001254594707	896520878	/nfs/dbraw/zinc/52/08/78/896520878.db2.gz	SPQVGZUGZHGYPP-GAEVZRCVSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCO[C@@]3(CCOC3)C1)C2	ZINC001254593217	896521017	/nfs/dbraw/zinc/52/10/17/896521017.db2.gz	KAUNHDMLNPFOCF-HOTGVXAUSA-N	1	1	304.346	1.553	20	5		DDBDMO
O=C1C[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC2(CCCC2)N1	ZINC001254606155	896526710	/nfs/dbraw/zinc/52/67/10/896526710.db2.gz	FJOKBJGWPPUQSY-HNNXBMFYSA-N	1	1	315.373	1.807	20	5		DDBDMO
O=C1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC2(CCCC2)N1	ZINC001254606155	896526720	/nfs/dbraw/zinc/52/67/20/896526720.db2.gz	FJOKBJGWPPUQSY-HNNXBMFYSA-N	1	1	315.373	1.807	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC12CC2	ZINC001254611172	896534194	/nfs/dbraw/zinc/53/41/94/896534194.db2.gz	WPLVLYLUIDFOBV-HUUCEWRRSA-N	1	1	316.357	1.947	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1[NH2+]CCc2occc21	ZINC001263073234	900481845	/nfs/dbraw/zinc/48/18/45/900481845.db2.gz	WKKCOMYAEOJKDX-CQSZACIVSA-N	1	1	301.302	1.691	20	5		DDBDMO
CCC[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001280325478	903594454	/nfs/dbraw/zinc/59/44/54/903594454.db2.gz	UWTRFZGNTLQWFW-HUUCEWRRSA-N	1	1	305.378	1.810	20	5		DDBDMO
CCC[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280325478	903594460	/nfs/dbraw/zinc/59/44/60/903594460.db2.gz	UWTRFZGNTLQWFW-HUUCEWRRSA-N	1	1	305.378	1.810	20	5		DDBDMO
CCC[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280325478	903594467	/nfs/dbraw/zinc/59/44/67/903594467.db2.gz	UWTRFZGNTLQWFW-HUUCEWRRSA-N	1	1	305.378	1.810	20	5		DDBDMO
CC[C@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248476849	282086752	/nfs/dbraw/zinc/08/67/52/282086752.db2.gz	YJIAXYPPVILBFZ-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248476849	282086756	/nfs/dbraw/zinc/08/67/56/282086756.db2.gz	YJIAXYPPVILBFZ-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000358069430	299066593	/nfs/dbraw/zinc/06/65/93/299066593.db2.gz	STLAZIRADNYYRG-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
CC[C@]1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248985859	282123824	/nfs/dbraw/zinc/12/38/24/282123824.db2.gz	WGWXTUYPBZTOOJ-CZUORRHYSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248985859	282123828	/nfs/dbraw/zinc/12/38/28/282123828.db2.gz	WGWXTUYPBZTOOJ-CZUORRHYSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000495198953	529440123	/nfs/dbraw/zinc/44/01/23/529440123.db2.gz	DSXBYXUOQIFNCY-HNNXBMFYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000495198953	529440124	/nfs/dbraw/zinc/44/01/24/529440124.db2.gz	DSXBYXUOQIFNCY-HNNXBMFYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000458157496	529467358	/nfs/dbraw/zinc/46/73/58/529467358.db2.gz	CMMWQCHQDRZRMZ-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000495197629	529578160	/nfs/dbraw/zinc/57/81/60/529578160.db2.gz	YJPOVWAXXCQHNF-GOEBONIOSA-N	1	1	319.361	1.547	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	ZINC000251520159	282202106	/nfs/dbraw/zinc/20/21/06/282202106.db2.gz	CQHZVXHKBKFNJB-DOMZBBRYSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	ZINC000251520159	282202108	/nfs/dbraw/zinc/20/21/08/282202108.db2.gz	CQHZVXHKBKFNJB-DOMZBBRYSA-N	1	1	310.350	1.709	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC3(CCCC3)C2)c1	ZINC000615000826	362112647	/nfs/dbraw/zinc/11/26/47/362112647.db2.gz	WSMOYIYALHKBGK-CQSZACIVSA-N	1	1	308.382	1.808	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000090554612	185303129	/nfs/dbraw/zinc/30/31/29/185303129.db2.gz	XKLIMMWUUVNKCH-UKRRQHHQSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000090554612	185303134	/nfs/dbraw/zinc/30/31/34/185303134.db2.gz	XKLIMMWUUVNKCH-UKRRQHHQSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000090554612	185303135	/nfs/dbraw/zinc/30/31/35/185303135.db2.gz	XKLIMMWUUVNKCH-UKRRQHHQSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1	ZINC000181513528	199308654	/nfs/dbraw/zinc/30/86/54/199308654.db2.gz	BUAXPVIHJNKPTA-UHFFFAOYSA-N	1	1	321.333	1.491	20	5		DDBDMO
C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272670164	210074314	/nfs/dbraw/zinc/07/43/14/210074314.db2.gz	IRMJIGQWFFQMCZ-LBPRGKRZSA-N	1	1	303.362	1.904	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000272659322	210064073	/nfs/dbraw/zinc/06/40/73/210064073.db2.gz	HCOPAJYLOCJWAQ-XHDPSFHLSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@@H+]1CCC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000272659322	210064071	/nfs/dbraw/zinc/06/40/71/210064071.db2.gz	HCOPAJYLOCJWAQ-XHDPSFHLSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000279677533	215054063	/nfs/dbraw/zinc/05/40/63/215054063.db2.gz	DZPJWMIDIFDAMA-BXUZGUMPSA-N	1	1	321.377	1.819	20	5		DDBDMO
CC1(C)C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000279905610	215223849	/nfs/dbraw/zinc/22/38/49/215223849.db2.gz	VKISUZMBVHIWNW-AWEZNQCLSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC1(C)C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000279905610	215223851	/nfs/dbraw/zinc/22/38/51/215223851.db2.gz	VKISUZMBVHIWNW-AWEZNQCLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1COC[C@@H](C)[NH+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181905851	186217281	/nfs/dbraw/zinc/21/72/81/186217281.db2.gz	XUDAERMVVUVILN-UPJWGTAASA-N	1	1	310.350	1.444	20	5		DDBDMO
CC1(C)[C@@H]2C[N@@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000181914442	186218643	/nfs/dbraw/zinc/21/86/43/186218643.db2.gz	FDLFIALFQJQFIG-OKILXGFUSA-N	1	1	324.402	1.956	20	5		DDBDMO
CC1(C)[C@@H]2C[N@H+](CCS(=O)(=O)c3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000181914442	186218645	/nfs/dbraw/zinc/21/86/45/186218645.db2.gz	FDLFIALFQJQFIG-OKILXGFUSA-N	1	1	324.402	1.956	20	5		DDBDMO
COCC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000052940541	352633610	/nfs/dbraw/zinc/63/36/10/352633610.db2.gz	NQDQDDNECLQBFW-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
COCC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000052940541	352633614	/nfs/dbraw/zinc/63/36/14/352633614.db2.gz	NQDQDDNECLQBFW-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cc1c(C(=O)NCC[N@H+](C)C2CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000066924582	353025692	/nfs/dbraw/zinc/02/56/92/353025692.db2.gz	JCQRSNZOXRMCHN-UHFFFAOYSA-N	1	1	322.321	1.635	20	5		DDBDMO
O=[N+]([O-])c1cn(C[C@@H](O)C[N@H+]2CCc3ccccc3C2)cn1	ZINC000066482907	353000239	/nfs/dbraw/zinc/00/02/39/353000239.db2.gz	TZLXARHSSDNFIF-AWEZNQCLSA-N	1	1	302.334	1.211	20	5		DDBDMO
COc1ccc(OCC[N@@H+](CC(N)=O)C(C)C)c([N+](=O)[O-])c1	ZINC000173480634	198219265	/nfs/dbraw/zinc/21/92/65/198219265.db2.gz	RYSMCWLQXDAIGH-UHFFFAOYSA-N	1	1	311.338	1.178	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)C1CC1	ZINC000067701415	353062525	/nfs/dbraw/zinc/06/25/25/353062525.db2.gz	FPDFPHZKWSVPFR-UHFFFAOYSA-N	1	1	306.366	1.485	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000067912074	353074657	/nfs/dbraw/zinc/07/46/57/353074657.db2.gz	DNFSZHRNXIHWAO-UHFFFAOYSA-N	1	1	307.350	1.356	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000173567445	198228033	/nfs/dbraw/zinc/22/80/33/198228033.db2.gz	RRSUIGSWRFNYKB-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000173567445	198228035	/nfs/dbraw/zinc/22/80/35/198228035.db2.gz	RRSUIGSWRFNYKB-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000069000609	353140346	/nfs/dbraw/zinc/14/03/46/353140346.db2.gz	XSJKHEUVCWQUTN-GFCCVEGCSA-N	1	1	306.366	1.849	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C1	ZINC000174531277	198347954	/nfs/dbraw/zinc/34/79/54/198347954.db2.gz	DXTAZCXBYJHLBQ-CYBMUJFWSA-N	1	1	323.397	1.290	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000174654821	198365904	/nfs/dbraw/zinc/36/59/04/198365904.db2.gz	TYBPCSGCIUQPJF-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
CCC[N@H+](CC)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000174654821	198365906	/nfs/dbraw/zinc/36/59/06/198365906.db2.gz	TYBPCSGCIUQPJF-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000174654821	198365907	/nfs/dbraw/zinc/36/59/07/198365907.db2.gz	TYBPCSGCIUQPJF-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2nccc(C)c2[N+](=O)[O-])CC1	ZINC000078302326	353509869	/nfs/dbraw/zinc/50/98/69/353509869.db2.gz	LWVAZXYWEFPPAW-UHFFFAOYSA-N	1	1	308.382	1.847	20	5		DDBDMO
Cc1cnc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c([N+](=O)[O-])c1	ZINC000078662681	353527721	/nfs/dbraw/zinc/52/77/21/353527721.db2.gz	ANHPLOGXNNBDNW-CQSZACIVSA-N	1	1	320.393	1.847	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176070147	198543161	/nfs/dbraw/zinc/54/31/61/198543161.db2.gz	UPAZYYONJZVBIR-SNVBAGLBSA-N	1	1	317.349	1.748	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](C)CCO1	ZINC000129904021	354087482	/nfs/dbraw/zinc/08/74/82/354087482.db2.gz	ITJFZHNJHZWWOT-MFKMUULPSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCO1	ZINC000129904021	354087486	/nfs/dbraw/zinc/08/74/86/354087486.db2.gz	ITJFZHNJHZWWOT-MFKMUULPSA-N	1	1	308.338	1.435	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000143978784	354152242	/nfs/dbraw/zinc/15/22/42/354152242.db2.gz	ICARADYTZUZCBE-LLVKDONJSA-N	1	1	304.350	1.603	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000145704229	354157933	/nfs/dbraw/zinc/15/79/33/354157933.db2.gz	RAUQUTIQQYZGMZ-KGLIPLIRSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[NH+](C2CC2)CC1	ZINC000155989803	354216400	/nfs/dbraw/zinc/21/64/00/354216400.db2.gz	NJBSMXHQZLODCJ-UHFFFAOYSA-N	1	1	314.345	1.996	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H]1CCOC1	ZINC000494968480	235108822	/nfs/dbraw/zinc/10/88/22/235108822.db2.gz	CNBYCCQYPBLKFC-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000592533589	355618363	/nfs/dbraw/zinc/61/83/63/355618363.db2.gz	UMBNYLVHFREOQY-BVUKWYMNSA-N	1	1	320.345	1.464	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000592533589	355618366	/nfs/dbraw/zinc/61/83/66/355618366.db2.gz	UMBNYLVHFREOQY-BVUKWYMNSA-N	1	1	320.345	1.464	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2C[C@@H]3C[C@H]2C[S@@]3=O)cc1	ZINC000593103321	355799275	/nfs/dbraw/zinc/79/92/75/355799275.db2.gz	YTKLWFOTSNMACI-VUCVNMQBSA-N	1	1	310.375	1.569	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000593469044	355895160	/nfs/dbraw/zinc/89/51/60/355895160.db2.gz	VCCAUWPCPOCVPW-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000593469044	355895164	/nfs/dbraw/zinc/89/51/64/355895164.db2.gz	VCCAUWPCPOCVPW-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
CC1(C)[C@H](O)C[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000594003568	356084201	/nfs/dbraw/zinc/08/42/01/356084201.db2.gz	APOPJUAZDSBZJQ-NWDGAFQWSA-N	1	1	318.333	1.894	20	5		DDBDMO
C[C@@H](O)C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000594063656	356103198	/nfs/dbraw/zinc/10/31/98/356103198.db2.gz	KPTCBJILEYSDGF-LLVKDONJSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000594063656	356103202	/nfs/dbraw/zinc/10/32/02/356103202.db2.gz	KPTCBJILEYSDGF-LLVKDONJSA-N	1	1	319.361	1.329	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594419788	356204626	/nfs/dbraw/zinc/20/46/26/356204626.db2.gz	RLEVQTSVLOLULK-STQMWFEESA-N	1	1	318.377	1.924	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH+]1CC2(CC2(F)F)C1	ZINC000594570720	356252583	/nfs/dbraw/zinc/25/25/83/356252583.db2.gz	YCUJFPDYNZQVTG-SNVBAGLBSA-N	1	1	314.288	1.676	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594596964	356259942	/nfs/dbraw/zinc/25/99/42/356259942.db2.gz	BPNWVDFWHOWSND-RYUDHWBXSA-N	1	1	319.365	1.518	20	5		DDBDMO
CO[C@H](C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@H]1CCOC1	ZINC000595423140	356486604	/nfs/dbraw/zinc/48/66/04/356486604.db2.gz	JNELLYZVTAEFPK-XHDPSFHLSA-N	1	1	307.350	1.399	20	5		DDBDMO
CO[C@H](C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@H]1CCOC1	ZINC000595423140	356486606	/nfs/dbraw/zinc/48/66/06/356486606.db2.gz	JNELLYZVTAEFPK-XHDPSFHLSA-N	1	1	307.350	1.399	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1	ZINC000595607968	356574163	/nfs/dbraw/zinc/57/41/63/356574163.db2.gz	MDIBRYNZNAZYDG-ZDUSSCGKSA-N	1	1	317.349	1.587	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@@H](Cn3ccnn3)C2)c(F)c1	ZINC000595608712	356575641	/nfs/dbraw/zinc/57/56/41/356575641.db2.gz	UKCIEQYVCPJZGL-SNVBAGLBSA-N	1	1	323.303	1.987	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)c(F)c1	ZINC000595608712	356575646	/nfs/dbraw/zinc/57/56/46/356575646.db2.gz	UKCIEQYVCPJZGL-SNVBAGLBSA-N	1	1	323.303	1.987	20	5		DDBDMO
C[C@@]1(C2CC2)C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000595624734	356582271	/nfs/dbraw/zinc/58/22/71/356582271.db2.gz	FKGBOBYORKWEQO-HNNXBMFYSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[C@@]1(C2CC2)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000595624734	356582276	/nfs/dbraw/zinc/58/22/76/356582276.db2.gz	FKGBOBYORKWEQO-HNNXBMFYSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595752122	356635874	/nfs/dbraw/zinc/63/58/74/356635874.db2.gz	SLLQNSCWVHMDGP-MRXNPFEDSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595752122	356635878	/nfs/dbraw/zinc/63/58/78/356635878.db2.gz	SLLQNSCWVHMDGP-MRXNPFEDSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596091650	356768892	/nfs/dbraw/zinc/76/88/92/356768892.db2.gz	BJYBEUYKOFCROQ-LLVKDONJSA-N	1	1	306.366	1.836	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000276920198	213175986	/nfs/dbraw/zinc/17/59/86/213175986.db2.gz	OLSQZTOETSDQKG-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@H]21	ZINC000596170408	356800912	/nfs/dbraw/zinc/80/09/12/356800912.db2.gz	ZLDJJQKPHSKJST-SMDDNHRTSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@@H]2C1	ZINC000596189725	356806557	/nfs/dbraw/zinc/80/65/57/356806557.db2.gz	QGHLRECYVULPHF-QMTHXVAHSA-N	1	1	304.350	1.224	20	5		DDBDMO
COc1cc(NC[C@@]2(O)CC[N@@H+](C)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000596198045	356810337	/nfs/dbraw/zinc/81/03/37/356810337.db2.gz	PMDIYUXKIRAFIA-ZDUSSCGKSA-N	1	1	315.757	1.735	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C	ZINC000597859805	357362133	/nfs/dbraw/zinc/36/21/33/357362133.db2.gz	YHYYXJJETDVDPL-GFCCVEGCSA-N	1	1	323.397	1.479	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)n1	ZINC000597861450	357362214	/nfs/dbraw/zinc/36/22/14/357362214.db2.gz	UNMKCFBFTRCDTL-LLVKDONJSA-N	1	1	323.397	1.661	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](S(N)(=O)=O)C1	ZINC000372739196	307174176	/nfs/dbraw/zinc/17/41/76/307174176.db2.gz	KJBVTKPPWHQFGE-ZDUSSCGKSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](S(N)(=O)=O)C1	ZINC000372739196	307174177	/nfs/dbraw/zinc/17/41/77/307174177.db2.gz	KJBVTKPPWHQFGE-ZDUSSCGKSA-N	1	1	313.379	1.156	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000598342485	357545308	/nfs/dbraw/zinc/54/53/08/357545308.db2.gz	JBUZRGUUVCDAOP-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000598600361	357648599	/nfs/dbraw/zinc/64/85/99/357648599.db2.gz	AVUSQFCIORDKOK-ZJUUUORDSA-N	1	1	320.349	1.814	20	5		DDBDMO
CCc1nn(C)c(N2CCC([NH+]3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000599105813	357817539	/nfs/dbraw/zinc/81/75/39/357817539.db2.gz	QLNZGOMMQLAZRQ-UHFFFAOYSA-N	1	1	323.397	1.192	20	5		DDBDMO
O=c1ccc([C@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000599642453	358003627	/nfs/dbraw/zinc/00/36/27/358003627.db2.gz	UPNUXWDPYZCZRK-LLVKDONJSA-N	1	1	304.310	1.124	20	5		DDBDMO
O=c1ccc([C@H]2CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000599642453	358003630	/nfs/dbraw/zinc/00/36/30/358003630.db2.gz	UPNUXWDPYZCZRK-LLVKDONJSA-N	1	1	304.310	1.124	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H]1C[C@@H](O)C1	ZINC000599671902	358018169	/nfs/dbraw/zinc/01/81/69/358018169.db2.gz	KOGYQRBUCVLDAF-VDISTLRHSA-N	1	1	319.361	1.187	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](CCCF)CC1	ZINC000600076939	358116924	/nfs/dbraw/zinc/11/69/24/358116924.db2.gz	RFDXAYGRLZKOIQ-UHFFFAOYSA-N	1	1	310.329	1.294	20	5		DDBDMO
C[C@]1(CO)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000600204048	358155856	/nfs/dbraw/zinc/15/58/56/358155856.db2.gz	NYCZTDZRKLJQPL-VWEWPCDYSA-N	1	1	320.389	1.921	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CC[N@H+]1C1CCCCC1	ZINC000600229135	358163710	/nfs/dbraw/zinc/16/37/10/358163710.db2.gz	PWLAWDBKMXZPGW-ZDUSSCGKSA-N	1	1	321.381	1.315	20	5		DDBDMO
C[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@H](CO)O1	ZINC000601153501	358424212	/nfs/dbraw/zinc/42/42/12/358424212.db2.gz	PKDHRIZRXRFWSB-JQWIXIFHSA-N	1	1	303.318	1.729	20	5		DDBDMO
C[C@H](O)[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601176308	358434537	/nfs/dbraw/zinc/43/45/37/358434537.db2.gz	USUQYTQOSAPINB-ZUZCIYMTSA-N	1	1	303.318	1.729	20	5		DDBDMO
O=[N+]([O-])c1cn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cn1	ZINC000601953302	358751155	/nfs/dbraw/zinc/75/11/55/358751155.db2.gz	DXNQTOIYSIPRIM-HNNXBMFYSA-N	1	1	302.334	1.428	20	5		DDBDMO
CC(C)(O)CN1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000602553734	359042455	/nfs/dbraw/zinc/04/24/55/359042455.db2.gz	WWCNGUFEXVFYNN-UHFFFAOYSA-N	1	1	321.421	1.962	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000602769910	359178396	/nfs/dbraw/zinc/17/83/96/359178396.db2.gz	XIBOWZZJKUOYKO-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000603141042	359429572	/nfs/dbraw/zinc/42/95/72/359429572.db2.gz	AODNCYJTZYCRMV-PHIMTYICSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000603141042	359429576	/nfs/dbraw/zinc/42/95/76/359429576.db2.gz	AODNCYJTZYCRMV-PHIMTYICSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000603141042	359429580	/nfs/dbraw/zinc/42/95/80/359429580.db2.gz	AODNCYJTZYCRMV-PHIMTYICSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000603141042	359429583	/nfs/dbraw/zinc/42/95/83/359429583.db2.gz	AODNCYJTZYCRMV-PHIMTYICSA-N	1	1	323.397	1.825	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1C(C)(C)C	ZINC000603144150	359433330	/nfs/dbraw/zinc/43/33/30/359433330.db2.gz	WZWWQRVIGVBATK-CYBMUJFWSA-N	1	1	306.366	1.792	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1C(C)(C)C	ZINC000603144150	359433334	/nfs/dbraw/zinc/43/33/34/359433334.db2.gz	WZWWQRVIGVBATK-CYBMUJFWSA-N	1	1	306.366	1.792	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CC1(CO)CC1	ZINC000186800278	200012806	/nfs/dbraw/zinc/01/28/06/200012806.db2.gz	XTYAMHLEKSOYHN-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(CO)CC1	ZINC000186800278	200012807	/nfs/dbraw/zinc/01/28/07/200012807.db2.gz	XTYAMHLEKSOYHN-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000187123666	200064829	/nfs/dbraw/zinc/06/48/29/200064829.db2.gz	VWIIABPBVOHXGG-KOLCDFICSA-N	1	1	308.338	1.250	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000189375388	200390328	/nfs/dbraw/zinc/39/03/28/200390328.db2.gz	BQNHFKATTUJTNM-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCOCC1	ZINC000189375388	200390330	/nfs/dbraw/zinc/39/03/30/200390330.db2.gz	BQNHFKATTUJTNM-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000359029746	299311580	/nfs/dbraw/zinc/31/15/80/299311580.db2.gz	SOWIHTXJBXYJCS-NWDGAFQWSA-N	1	1	321.381	1.796	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1cccnc1[N+](=O)[O-]	ZINC000611031302	360607213	/nfs/dbraw/zinc/60/72/13/360607213.db2.gz	OEPHZHDMWFHVPX-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000611268420	360684311	/nfs/dbraw/zinc/68/43/11/360684311.db2.gz	LNIPCCMFWJOJDE-HZPDHXFCSA-N	1	1	321.377	1.331	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@@H](O)C2CC2)cccc1[N+](=O)[O-]	ZINC000611207336	360660430	/nfs/dbraw/zinc/66/04/30/360660430.db2.gz	ZWJLJSLNDFXJLZ-XHDPSFHLSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000618898194	363787580	/nfs/dbraw/zinc/78/75/80/363787580.db2.gz	ZYFLWGBOGOPOMC-ABAIWWIYSA-N	1	1	320.393	1.590	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000194913707	201309677	/nfs/dbraw/zinc/30/96/77/201309677.db2.gz	WNJWEJQFEBYLFK-LBPRGKRZSA-N	1	1	323.397	1.487	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000566115248	304119984	/nfs/dbraw/zinc/11/99/84/304119984.db2.gz	IHSSANDHDBUBME-MGPQQGTHSA-N	1	1	323.393	1.407	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275347800	212284781	/nfs/dbraw/zinc/28/47/81/212284781.db2.gz	JAPOOYRZSSNTPK-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275347800	212284783	/nfs/dbraw/zinc/28/47/83/212284783.db2.gz	JAPOOYRZSSNTPK-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](O)CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000293104440	223397701	/nfs/dbraw/zinc/39/77/01/223397701.db2.gz	LGYUMQQDLOLVQJ-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](O)CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000293104440	223397702	/nfs/dbraw/zinc/39/77/02/223397702.db2.gz	LGYUMQQDLOLVQJ-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
Cn1ccnc1[C@H]1C[NH2+]CCN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000261628184	203083755	/nfs/dbraw/zinc/08/37/55/203083755.db2.gz	AQPKFHNTJBFGGT-SNVBAGLBSA-N	1	1	321.362	1.177	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000261847102	203133197	/nfs/dbraw/zinc/13/31/97/203133197.db2.gz	UYQYBBSPEMYQPD-HNNXBMFYSA-N	1	1	312.329	1.777	20	5		DDBDMO
CN(CC(C)(C)C[NH3+])C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000262582146	203338381	/nfs/dbraw/zinc/33/83/81/203338381.db2.gz	KTTVXLCGGASETC-UHFFFAOYSA-N	1	1	305.338	1.528	20	5		DDBDMO
O=C(CCN1C[C@@H]2C[NH2+]C[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000359305962	299406386	/nfs/dbraw/zinc/40/63/86/299406386.db2.gz	MHMFQNWKKZXTNC-RYUDHWBXSA-N	1	1	304.350	1.075	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1=CC[N@H+](C)CC1	ZINC000274925104	212038774	/nfs/dbraw/zinc/03/87/74/212038774.db2.gz	MBFDLYUVHBXNLI-SNVBAGLBSA-N	1	1	305.334	1.681	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000274925104	212038776	/nfs/dbraw/zinc/03/87/76/212038776.db2.gz	MBFDLYUVHBXNLI-SNVBAGLBSA-N	1	1	305.334	1.681	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000134642095	284333492	/nfs/dbraw/zinc/33/34/92/284333492.db2.gz	HICPCRHKYROFKP-UHFFFAOYSA-N	1	1	304.350	1.687	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H](C[NH+]3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000266057629	205064235	/nfs/dbraw/zinc/06/42/35/205064235.db2.gz	AFCCMVZUEGIFCK-LBPRGKRZSA-N	1	1	321.381	1.574	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266445136	205352547	/nfs/dbraw/zinc/35/25/47/205352547.db2.gz	BGXIXVPMJRKZAG-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000266445136	205352551	/nfs/dbraw/zinc/35/25/51/205352551.db2.gz	BGXIXVPMJRKZAG-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266445136	205352555	/nfs/dbraw/zinc/35/25/55/205352555.db2.gz	BGXIXVPMJRKZAG-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266503631	205393500	/nfs/dbraw/zinc/39/35/00/205393500.db2.gz	XIGAYAMFTLLMKR-OAHLLOKOSA-N	1	1	304.350	1.327	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000285335509	218387022	/nfs/dbraw/zinc/38/70/22/218387022.db2.gz	OGAUQFCFERWNBS-INIZCTEOSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000285335509	218387024	/nfs/dbraw/zinc/38/70/24/218387024.db2.gz	OGAUQFCFERWNBS-INIZCTEOSA-N	1	1	322.361	1.855	20	5		DDBDMO
CN(C)[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000109805554	194288094	/nfs/dbraw/zinc/28/80/94/194288094.db2.gz	IIJQUVHRQCYENK-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(C)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000109805554	194288097	/nfs/dbraw/zinc/28/80/97/194288097.db2.gz	IIJQUVHRQCYENK-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CSc1ccc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000110653772	194346624	/nfs/dbraw/zinc/34/66/24/194346624.db2.gz	VGIDGPZWWIGNEB-JTQLQIEISA-N	1	1	309.391	1.998	20	5		DDBDMO
CCN1CCC([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000567680072	304233963	/nfs/dbraw/zinc/23/39/63/304233963.db2.gz	OMWGJJKQROWBHZ-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
COc1cc(N2CCC[N@@H+](CCO)CC2)c(F)cc1[N+](=O)[O-]	ZINC000119633608	195006693	/nfs/dbraw/zinc/00/66/93/195006693.db2.gz	ONQLDDGFXAWYJH-UHFFFAOYSA-N	1	1	313.329	1.247	20	5		DDBDMO
O=C(C[N@@H+](CCO)CC1CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000352489508	285086678	/nfs/dbraw/zinc/08/66/78/285086678.db2.gz	AXNBPBFGWJCIJX-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1	ZINC000272969451	210352875	/nfs/dbraw/zinc/35/28/75/210352875.db2.gz	BETPXVWPUCPMJR-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000158749109	197297942	/nfs/dbraw/zinc/29/79/42/197297942.db2.gz	HHIRCFUHZUXURE-OAHLLOKOSA-N	1	1	316.361	1.952	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@@H]2CCCCO2)CC1	ZINC000298027880	285166501	/nfs/dbraw/zinc/16/65/01/285166501.db2.gz	FMXRFYOFEPQVEA-ZDUSSCGKSA-N	1	1	306.366	1.681	20	5		DDBDMO
COC[C@H]1CCCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000452035169	533130380	/nfs/dbraw/zinc/13/03/80/533130380.db2.gz	GDRVOODIDLLGDF-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000157152723	197165934	/nfs/dbraw/zinc/16/59/34/197165934.db2.gz	SIUOQMCXZLWAGP-DGCLKSJQSA-N	1	1	318.377	1.733	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CCC[C@@H]1O	ZINC000352687915	285228358	/nfs/dbraw/zinc/22/83/58/285228358.db2.gz	ACFUCHFWQHXUSX-STQMWFEESA-N	1	1	323.349	1.387	20	5		DDBDMO
CC[N@H+](C)CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000271574124	209025245	/nfs/dbraw/zinc/02/52/45/209025245.db2.gz	CFJAHZPFMSGSHB-UHFFFAOYSA-N	1	1	307.397	1.423	20	5		DDBDMO
CC[N@@H+](C)CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000271574124	209025249	/nfs/dbraw/zinc/02/52/49/209025249.db2.gz	CFJAHZPFMSGSHB-UHFFFAOYSA-N	1	1	307.397	1.423	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc2ncccn2n1	ZINC000414259986	224316232	/nfs/dbraw/zinc/31/62/32/224316232.db2.gz	AOZZRSFDESFNTM-LLVKDONJSA-N	1	1	312.333	1.753	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444661221	533634753	/nfs/dbraw/zinc/63/47/53/533634753.db2.gz	UGVKHEOYCLKJJL-JTQLQIEISA-N	1	1	318.333	1.999	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444661221	533634758	/nfs/dbraw/zinc/63/47/58/533634758.db2.gz	UGVKHEOYCLKJJL-JTQLQIEISA-N	1	1	318.333	1.999	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000579731468	422823042	/nfs/dbraw/zinc/82/30/42/422823042.db2.gz	URULXVWATATJOB-UHFFFAOYSA-N	1	1	307.354	1.176	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000074104772	406903052	/nfs/dbraw/zinc/90/30/52/406903052.db2.gz	JIHCVMVFPQZHII-CYBMUJFWSA-N	1	1	321.377	1.364	20	5		DDBDMO
CCn1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000093534297	407198110	/nfs/dbraw/zinc/19/81/10/407198110.db2.gz	NTJHNDRUDUGJSU-ZDUSSCGKSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000093534297	407198112	/nfs/dbraw/zinc/19/81/12/407198112.db2.gz	NTJHNDRUDUGJSU-ZDUSSCGKSA-N	1	1	316.365	1.893	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000123246561	407323825	/nfs/dbraw/zinc/32/38/25/407323825.db2.gz	WHTUENXVUYFUOZ-NWDGAFQWSA-N	1	1	323.397	1.468	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCn1cccn1	ZINC000111280814	407405907	/nfs/dbraw/zinc/40/59/07/407405907.db2.gz	MWQTZAXLHFORSA-GFCCVEGCSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCn1cccn1	ZINC000111280814	407405908	/nfs/dbraw/zinc/40/59/08/407405908.db2.gz	MWQTZAXLHFORSA-GFCCVEGCSA-N	1	1	317.349	1.750	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000112310097	407425674	/nfs/dbraw/zinc/42/56/74/407425674.db2.gz	ZOXDXTMIFXQLHP-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(CCC[NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000271007252	407466848	/nfs/dbraw/zinc/46/68/48/407466848.db2.gz	WULFAFFHPVIZGR-UHFFFAOYSA-N	1	1	323.397	1.820	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)[C@H](C)C1	ZINC000185725536	407488587	/nfs/dbraw/zinc/48/85/87/407488587.db2.gz	HTXYQYWGNXIRSH-ABAIWWIYSA-N	1	1	320.393	1.979	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000265794801	407456732	/nfs/dbraw/zinc/45/67/32/407456732.db2.gz	MYMBIOUOXNCPSH-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000128548459	407548860	/nfs/dbraw/zinc/54/88/60/407548860.db2.gz	CLDIVELLORBZQE-WDEREUQCSA-N	1	1	323.397	1.487	20	5		DDBDMO
CC(C)(CC(N)=O)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000186220660	407609310	/nfs/dbraw/zinc/60/93/10/407609310.db2.gz	QPEDSHVSESXJOV-UHFFFAOYSA-N	1	1	319.321	1.388	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](C3OCCO3)C2)c1	ZINC000178859899	407630874	/nfs/dbraw/zinc/63/08/74/407630874.db2.gz	WGOPHAAYUSPEPK-DZGCQCFKSA-N	1	1	322.361	1.713	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1	ZINC000115436588	407681048	/nfs/dbraw/zinc/68/10/48/407681048.db2.gz	DEFCFJGWPWKJDD-CYBMUJFWSA-N	1	1	323.397	1.290	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000115577387	407697226	/nfs/dbraw/zinc/69/72/26/407697226.db2.gz	IUEVFRFEEPCCHE-JSGCOSHPSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000115577387	407697230	/nfs/dbraw/zinc/69/72/30/407697230.db2.gz	IUEVFRFEEPCCHE-JSGCOSHPSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC(=O)C1(O)CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1	ZINC000271476197	407699237	/nfs/dbraw/zinc/69/92/37/407699237.db2.gz	VEXUMBZJRUWGDA-LLVKDONJSA-N	1	1	308.334	1.656	20	5		DDBDMO
Cn1cc(C[N@@H+](CCO)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000153592120	407857797	/nfs/dbraw/zinc/85/77/97/407857797.db2.gz	CRRGFQHPEAFECC-UHFFFAOYSA-N	1	1	316.361	1.952	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)C[NH+]1CCOCC1	ZINC000134149071	407888977	/nfs/dbraw/zinc/88/89/77/407888977.db2.gz	XRAXVCYAXAUHLS-LBPRGKRZSA-N	1	1	307.350	1.293	20	5		DDBDMO
Cc1c(NC(=O)C(=O)NCC[N@H+](C)C(C)C)cccc1[N+](=O)[O-]	ZINC000118123365	407900029	/nfs/dbraw/zinc/90/00/29/407900029.db2.gz	PALMDZPEYULKQY-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000267599236	407849257	/nfs/dbraw/zinc/84/92/57/407849257.db2.gz	JBFABSXIDMFDPH-WCQYABFASA-N	1	1	320.393	1.731	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000268216224	407951427	/nfs/dbraw/zinc/95/14/27/407951427.db2.gz	PNXGBLYEUFLPCL-SKDRFNHKSA-N	1	1	304.350	1.390	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000268162933	407923114	/nfs/dbraw/zinc/92/31/14/407923114.db2.gz	ILSBHFSSDNCDSJ-GWCFXTLKSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCc1ccc(C(=O)NCC[N@@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000189460130	408024101	/nfs/dbraw/zinc/02/41/01/408024101.db2.gz	GZIJJHVEZQUEAW-UHFFFAOYSA-N	1	1	321.377	1.609	20	5		DDBDMO
CCc1ccc(C(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000189460130	408024110	/nfs/dbraw/zinc/02/41/10/408024110.db2.gz	GZIJJHVEZQUEAW-UHFFFAOYSA-N	1	1	321.377	1.609	20	5		DDBDMO
C[NH+](C)C[C@H](Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000137398995	408153883	/nfs/dbraw/zinc/15/38/83/408153883.db2.gz	HSXOLVZQDWWPKX-LBPRGKRZSA-N	1	1	317.349	1.221	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000190067103	408157129	/nfs/dbraw/zinc/15/71/29/408157129.db2.gz	RCGMBICRXCRSHD-SNVBAGLBSA-N	1	1	317.349	1.748	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000190215610	408191370	/nfs/dbraw/zinc/19/13/70/408191370.db2.gz	HDXPRSZIXSQWID-UHFFFAOYSA-N	1	1	302.281	1.107	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1	ZINC000190785775	408318531	/nfs/dbraw/zinc/31/85/31/408318531.db2.gz	BBFFXTNGPMYYAC-UHFFFAOYSA-N	1	1	323.393	1.762	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)N1CCCC1	ZINC000122272911	408277697	/nfs/dbraw/zinc/27/76/97/408277697.db2.gz	MZXWKCAEKXVJLA-LBPRGKRZSA-N	1	1	319.365	1.098	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)N1CCCC1	ZINC000122272911	408277702	/nfs/dbraw/zinc/27/77/02/408277702.db2.gz	MZXWKCAEKXVJLA-LBPRGKRZSA-N	1	1	319.365	1.098	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183197094	408348959	/nfs/dbraw/zinc/34/89/59/408348959.db2.gz	MVDYXJUNXOXCFN-RYUDHWBXSA-N	1	1	310.350	1.685	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000190924353	408343464	/nfs/dbraw/zinc/34/34/64/408343464.db2.gz	NHJIIEZLYDTUFR-RTXFEEFZSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000247369718	408458980	/nfs/dbraw/zinc/45/89/80/408458980.db2.gz	KRXSLTVHWKYVIE-CHWSQXEVSA-N	1	1	321.377	1.772	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2CC)n1	ZINC000191810810	408496743	/nfs/dbraw/zinc/49/67/43/408496743.db2.gz	DAIYWXXOYJGKTH-NSHDSACASA-N	1	1	309.370	1.415	20	5		DDBDMO
C[NH+](C)[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000264502049	408514324	/nfs/dbraw/zinc/51/43/24/408514324.db2.gz	YFARPEDMWLGIMG-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21	ZINC000274598734	408465046	/nfs/dbraw/zinc/46/50/46/408465046.db2.gz	WPHGTMAKDZRAPB-UHFFFAOYSA-N	1	1	320.349	1.120	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402014	408476502	/nfs/dbraw/zinc/47/65/02/408476502.db2.gz	HSGGWECHQXAKEF-WCQYABFASA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402014	408476510	/nfs/dbraw/zinc/47/65/10/408476510.db2.gz	HSGGWECHQXAKEF-WCQYABFASA-N	1	1	307.350	1.769	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184229411	408574266	/nfs/dbraw/zinc/57/42/66/408574266.db2.gz	PLGXTWGVGPYFOX-VIFPVBQESA-N	1	1	313.329	1.556	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000248479640	408577504	/nfs/dbraw/zinc/57/75/04/408577504.db2.gz	ZXVGBDRWWXNVCC-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)CCOc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000192469212	408593165	/nfs/dbraw/zinc/59/31/65/408593165.db2.gz	PGPMFEZOQWIYQS-BETUJISGSA-N	1	1	319.361	1.384	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000248609006	408597703	/nfs/dbraw/zinc/59/77/03/408597703.db2.gz	PTKVMDNXRUNWII-HIFRSBDPSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000248609006	408597707	/nfs/dbraw/zinc/59/77/07/408597707.db2.gz	PTKVMDNXRUNWII-HIFRSBDPSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[N@@H+]1CCCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000184082416	408544499	/nfs/dbraw/zinc/54/44/99/408544499.db2.gz	WVMJTYNNLUYYBQ-UHFFFAOYSA-N	1	1	313.379	1.062	20	5		DDBDMO
C[N@H+]1CCCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000184082416	408544502	/nfs/dbraw/zinc/54/45/02/408544502.db2.gz	WVMJTYNNLUYYBQ-UHFFFAOYSA-N	1	1	313.379	1.062	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248686021	408615552	/nfs/dbraw/zinc/61/55/52/408615552.db2.gz	HGOXBEFITKWLNQ-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000248686021	408615555	/nfs/dbraw/zinc/61/55/55/408615555.db2.gz	HGOXBEFITKWLNQ-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000248686021	408615561	/nfs/dbraw/zinc/61/55/61/408615561.db2.gz	HGOXBEFITKWLNQ-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1ccnc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000275628870	408626128	/nfs/dbraw/zinc/62/61/28/408626128.db2.gz	VQNLXHXGHZKLOH-LBPRGKRZSA-N	1	1	308.382	1.580	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000192660790	408628064	/nfs/dbraw/zinc/62/80/64/408628064.db2.gz	VVUVFHFFIKGMSZ-GFCCVEGCSA-N	1	1	313.379	1.357	20	5		DDBDMO
Cc1c(NC(=O)C(=O)N2CCC[N@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000162069262	408666918	/nfs/dbraw/zinc/66/69/18/408666918.db2.gz	NWQLVGFRUPHQLC-UHFFFAOYSA-N	1	1	320.349	1.006	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1O	ZINC000270855084	408709531	/nfs/dbraw/zinc/70/95/31/408709531.db2.gz	HGYXFZWRMWGFDJ-BXUZGUMPSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CO)C1	ZINC000249332379	408715584	/nfs/dbraw/zinc/71/55/84/408715584.db2.gz	XACGOWKGCQCUCE-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CO)C1	ZINC000249332379	408715590	/nfs/dbraw/zinc/71/55/90/408715590.db2.gz	XACGOWKGCQCUCE-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
CCC[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000270868121	408716646	/nfs/dbraw/zinc/71/66/46/408716646.db2.gz	BBFQEKKFVOBCHC-AWEZNQCLSA-N	1	1	308.382	1.927	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000265653650	408730915	/nfs/dbraw/zinc/73/09/15/408730915.db2.gz	XZLJFJJBDVHVBS-ZDUSSCGKSA-N	1	1	322.365	1.115	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190840395	163160767	/nfs/dbraw/zinc/16/07/67/163160767.db2.gz	AHQVSVJMRYQPRD-WOPDTQHZSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190840395	163160770	/nfs/dbraw/zinc/16/07/70/163160770.db2.gz	AHQVSVJMRYQPRD-WOPDTQHZSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[N@H+]1CCN(CCNc2ccc(N)cc2[N+](=O)[O-])CC1(C)C	ZINC000286347984	408967593	/nfs/dbraw/zinc/96/75/93/408967593.db2.gz	HEKRSCAMQZKCSW-UHFFFAOYSA-N	1	1	307.398	1.615	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[C@H]1O	ZINC000286454147	408987510	/nfs/dbraw/zinc/98/75/10/408987510.db2.gz	JZUVJRYQXCGMNN-NWANDNLSSA-N	1	1	310.350	1.180	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000282271347	409024137	/nfs/dbraw/zinc/02/41/37/409024137.db2.gz	HPWSVYHUXSHRAZ-VHDGCEQUSA-N	1	1	324.377	1.834	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@]3(CC[N@@H+](C)C3)C2)n1	ZINC000292364792	409027823	/nfs/dbraw/zinc/02/78/23/409027823.db2.gz	ROSAVQBQLCGLEG-HNNXBMFYSA-N	1	1	320.349	1.308	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](OCc3ccncc3)C2)c1	ZINC000287726292	409083305	/nfs/dbraw/zinc/08/33/05/409083305.db2.gz	KJHLIVVVWZCAFS-OAHLLOKOSA-N	1	1	317.349	1.477	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C	ZINC000293483540	409122829	/nfs/dbraw/zinc/12/28/29/409122829.db2.gz	VVKWNKJSUZFKKC-PHIMTYICSA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000293483540	409122830	/nfs/dbraw/zinc/12/28/30/409122830.db2.gz	VVKWNKJSUZFKKC-PHIMTYICSA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@@H](NC[C@@H]1C[N@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668332	409158009	/nfs/dbraw/zinc/15/80/09/409158009.db2.gz	JPMLFWIXVHELFN-DGCLKSJQSA-N	1	1	307.398	1.073	20	5		DDBDMO
C[C@@H](NC[C@@H]1C[N@@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668332	409158012	/nfs/dbraw/zinc/15/80/12/409158012.db2.gz	JPMLFWIXVHELFN-DGCLKSJQSA-N	1	1	307.398	1.073	20	5		DDBDMO
Cc1cnc(N(C)CCC[N@H+](C)CCN(C)C)c([N+](=O)[O-])c1	ZINC000289209050	409233206	/nfs/dbraw/zinc/23/32/06/409233206.db2.gz	YFDGVLXDWHVCKZ-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1cnc(N(C)CCCN(C)CC[NH+](C)C)c([N+](=O)[O-])c1	ZINC000289209050	409233208	/nfs/dbraw/zinc/23/32/08/409233208.db2.gz	YFDGVLXDWHVCKZ-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
C[C@@H](NCCC[NH+]1CCC(O)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000283891221	409234826	/nfs/dbraw/zinc/23/48/26/409234826.db2.gz	COVNKIMKJCWNJM-GFCCVEGCSA-N	1	1	322.409	1.674	20	5		DDBDMO
CN(C)CC[N@H+](C)CCCN(C)Cc1ccccc1[N+](=O)[O-]	ZINC000289388881	409260566	/nfs/dbraw/zinc/26/05/66/409260566.db2.gz	JVDMKOOLSQGEAG-UHFFFAOYSA-N	1	1	308.426	1.910	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)Cc1ccccc1[N+](=O)[O-]	ZINC000289388881	409260569	/nfs/dbraw/zinc/26/05/69/409260569.db2.gz	JVDMKOOLSQGEAG-UHFFFAOYSA-N	1	1	308.426	1.910	20	5		DDBDMO
C[C@H]1[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCS1(=O)=O	ZINC000293909078	409205635	/nfs/dbraw/zinc/20/56/35/409205635.db2.gz	LQFXCENGDTVEBV-KWQFWETISA-N	1	1	318.782	1.913	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000280673802	409403543	/nfs/dbraw/zinc/40/35/43/409403543.db2.gz	YDXBUHRNBKMWSK-UHFFFAOYSA-N	1	1	318.333	1.603	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000295425856	409475504	/nfs/dbraw/zinc/47/55/04/409475504.db2.gz	UJKSOZLRZBBUIA-VIFPVBQESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000295425856	409475508	/nfs/dbraw/zinc/47/55/08/409475508.db2.gz	UJKSOZLRZBBUIA-VIFPVBQESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000295425856	409475513	/nfs/dbraw/zinc/47/55/13/409475513.db2.gz	UJKSOZLRZBBUIA-VIFPVBQESA-N	1	1	307.354	1.183	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000344919658	409551995	/nfs/dbraw/zinc/55/19/95/409551995.db2.gz	CXBYFKRAGPWNFT-AGLBCWCQSA-N	1	1	304.350	1.611	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000344919658	409552002	/nfs/dbraw/zinc/55/20/02/409552002.db2.gz	CXBYFKRAGPWNFT-AGLBCWCQSA-N	1	1	304.350	1.611	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000354080689	409635841	/nfs/dbraw/zinc/63/58/41/409635841.db2.gz	WVVQOHZKOIOJKM-ZDUSSCGKSA-N	1	1	318.377	1.627	20	5		DDBDMO
COc1c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000331520071	409594255	/nfs/dbraw/zinc/59/42/55/409594255.db2.gz	NVPNIHAVQHHCIW-MFKMUULPSA-N	1	1	319.361	1.816	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@@H]1C	ZINC000342471208	409658721	/nfs/dbraw/zinc/65/87/21/409658721.db2.gz	WUPHNLZKBSKSRV-HZMBPMFUSA-N	1	1	319.361	1.816	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000342474126	409663025	/nfs/dbraw/zinc/66/30/25/409663025.db2.gz	NKYCPKNBIQTKAA-XPTSAGLGSA-N	1	1	307.325	1.946	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357038010	409809405	/nfs/dbraw/zinc/80/94/05/409809405.db2.gz	MXMJGVPQAQTVDH-GHMZBOCLSA-N	1	1	307.354	1.027	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357038015	409810815	/nfs/dbraw/zinc/81/08/15/409810815.db2.gz	MXMJGVPQAQTVDH-WDEREUQCSA-N	1	1	307.354	1.027	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000317099099	409861131	/nfs/dbraw/zinc/86/11/31/409861131.db2.gz	BIAQNKFBILJHQE-ZYHUDNBSSA-N	1	1	306.366	1.849	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000346244100	409870440	/nfs/dbraw/zinc/87/04/40/409870440.db2.gz	UNHIFFSBEGBRHS-HOSYDEDBSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000346244100	409870445	/nfs/dbraw/zinc/87/04/45/409870445.db2.gz	UNHIFFSBEGBRHS-HOSYDEDBSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000346244100	409870451	/nfs/dbraw/zinc/87/04/51/409870451.db2.gz	UNHIFFSBEGBRHS-HOSYDEDBSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1nocc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000351639857	410129488	/nfs/dbraw/zinc/12/94/88/410129488.db2.gz	FXAFKCMVSBTOLD-GFCCVEGCSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1nocc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000351639857	410129497	/nfs/dbraw/zinc/12/94/97/410129497.db2.gz	FXAFKCMVSBTOLD-GFCCVEGCSA-N	1	1	303.322	1.973	20	5		DDBDMO
CNc1c(C(=O)NCC[N@@H+]2CC=CCC2)cccc1[N+](=O)[O-]	ZINC000357621586	410142097	/nfs/dbraw/zinc/14/20/97/410142097.db2.gz	ODNSHSTWDNOUIB-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000351774286	410225717	/nfs/dbraw/zinc/22/57/17/410225717.db2.gz	LHMUFKMPQXOKHC-PKFCDNJMSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000351774286	410225723	/nfs/dbraw/zinc/22/57/23/410225723.db2.gz	LHMUFKMPQXOKHC-PKFCDNJMSA-N	1	1	323.349	1.243	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)N1C	ZINC000339617409	410331113	/nfs/dbraw/zinc/33/11/13/410331113.db2.gz	NIWCFUDNCHPELC-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1[C@@H](CO)CC[C@H]1CO	ZINC000347329319	410472516	/nfs/dbraw/zinc/47/25/16/410472516.db2.gz	IFNAJRGXBPLJCE-TXEJJXNPSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1[C@@H](CO)CC[C@H]1CO	ZINC000347329319	410472520	/nfs/dbraw/zinc/47/25/20/410472520.db2.gz	IFNAJRGXBPLJCE-TXEJJXNPSA-N	1	1	300.742	1.566	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cc(C(N)=O)no1	ZINC000347367289	410498241	/nfs/dbraw/zinc/49/82/41/410498241.db2.gz	FFYHXMHDVQMKQY-BJMVGYQFSA-N	1	1	316.317	1.875	20	5		DDBDMO
CC[N@@H+](C[C@H](C)O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000352187448	410534207	/nfs/dbraw/zinc/53/42/07/410534207.db2.gz	RVSQBMIKZPBOPA-SMDDNHRTSA-N	1	1	307.350	1.403	20	5		DDBDMO
COCC[NH+]1CCN(c2ncnc3cccc([N+](=O)[O-])c32)CC1	ZINC000347402193	410525748	/nfs/dbraw/zinc/52/57/48/410525748.db2.gz	FNFQHZVHKFFWLU-UHFFFAOYSA-N	1	1	317.349	1.306	20	5		DDBDMO
C[C@@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@@H+](C)C1CC1	ZINC000347443771	410549043	/nfs/dbraw/zinc/54/90/43/410549043.db2.gz	YVVHKDXWXNOGKY-JTQLQIEISA-N	1	1	301.350	2.433	20	5		DDBDMO
O=C1NCCN1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000343687563	410621267	/nfs/dbraw/zinc/62/12/67/410621267.db2.gz	KGJVCLNZSWLBBD-UHFFFAOYSA-N	1	1	304.350	1.584	20	5		DDBDMO
O=C1NCCN1CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000343687563	410621271	/nfs/dbraw/zinc/62/12/71/410621271.db2.gz	KGJVCLNZSWLBBD-UHFFFAOYSA-N	1	1	304.350	1.584	20	5		DDBDMO
NC(=O)C[NH+]1CCC(Nc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000301811115	410802199	/nfs/dbraw/zinc/80/21/99/410802199.db2.gz	XTDFMOCSRKANSX-UHFFFAOYSA-N	1	1	314.292	1.235	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000348207819	410855650	/nfs/dbraw/zinc/85/56/50/410855650.db2.gz	YRRHLJUOXJEEMF-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000330666680	410862685	/nfs/dbraw/zinc/86/26/85/410862685.db2.gz	WOZGRMFGWORLDC-SMDDNHRTSA-N	1	1	310.350	1.685	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330679537	410873902	/nfs/dbraw/zinc/87/39/02/410873902.db2.gz	XUKXPQRVZUZRBZ-LBPRGKRZSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCN(C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330679537	410873909	/nfs/dbraw/zinc/87/39/09/410873909.db2.gz	XUKXPQRVZUZRBZ-LBPRGKRZSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCN(C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330679537	410873916	/nfs/dbraw/zinc/87/39/16/410873916.db2.gz	XUKXPQRVZUZRBZ-LBPRGKRZSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000337622137	410902355	/nfs/dbraw/zinc/90/23/55/410902355.db2.gz	PJOGNMKQNMMKKM-UHFFFAOYSA-N	1	1	315.333	1.216	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@H]4C3)nc2c1	ZINC000344041294	410914695	/nfs/dbraw/zinc/91/46/95/410914695.db2.gz	IEIFVKSIBZPONF-XHVZSJERSA-N	1	1	303.318	1.939	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000331160268	410988094	/nfs/dbraw/zinc/98/80/94/410988094.db2.gz	COZMKLZQXXVUNJ-UHFFFAOYSA-N	1	1	309.370	1.297	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(O)CCC1	ZINC000353484651	411024305	/nfs/dbraw/zinc/02/43/05/411024305.db2.gz	KJAWONGSLRXSKF-LBPRGKRZSA-N	1	1	310.350	1.181	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c1C	ZINC000360180855	411090258	/nfs/dbraw/zinc/09/02/58/411090258.db2.gz	NVQPFMGRHHPTFR-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c1C	ZINC000360180855	411090262	/nfs/dbraw/zinc/09/02/62/411090262.db2.gz	NVQPFMGRHHPTFR-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cnn(CC[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1	ZINC000580339034	422920742	/nfs/dbraw/zinc/92/07/42/422920742.db2.gz	ISDLWNZBJZIACF-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
CCC[C@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000132470081	196257652	/nfs/dbraw/zinc/25/76/52/196257652.db2.gz	QFYKMKQBPCUQHZ-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000132470081	196257653	/nfs/dbraw/zinc/25/76/53/196257653.db2.gz	QFYKMKQBPCUQHZ-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1ccccc1CC[N@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000295605249	225037305	/nfs/dbraw/zinc/03/73/05/225037305.db2.gz	CQTCVBIBTKZOES-MRXNPFEDSA-N	1	1	318.377	1.635	20	5		DDBDMO
CC1(O)C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000366652866	418500501	/nfs/dbraw/zinc/50/05/01/418500501.db2.gz	GIWLDJGCCHOWKZ-OCZCAGDBSA-N	1	1	319.361	1.572	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](CCO)[C@H](C)C1	ZINC000188823639	222029398	/nfs/dbraw/zinc/02/93/98/222029398.db2.gz	XUBNRWRDDRFULA-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000188823639	222029400	/nfs/dbraw/zinc/02/94/00/222029400.db2.gz	XUBNRWRDDRFULA-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
CC(C)(O)C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000189895774	222060896	/nfs/dbraw/zinc/06/08/96/222060896.db2.gz	FFVMMNIORCYFQE-AWEZNQCLSA-N	1	1	324.377	1.570	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000361075666	418578289	/nfs/dbraw/zinc/57/82/89/418578289.db2.gz	CQBZEACTWVTGIC-MNOVXSKESA-N	1	1	306.366	1.849	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CCOc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000375028367	418589785	/nfs/dbraw/zinc/58/97/85/418589785.db2.gz	CJZVNEMITLNGDK-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1c(CN2CCC[N@H+]([C@@H](C)CO)CC2)cccc1[N+](=O)[O-]	ZINC000375487321	418646868	/nfs/dbraw/zinc/64/68/68/418646868.db2.gz	VSKKFGUQCOZBAB-ZDUSSCGKSA-N	1	1	307.394	1.792	20	5		DDBDMO
CO[C@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371878	418638838	/nfs/dbraw/zinc/63/88/38/418638838.db2.gz	JEAOLWLJVZJYHA-KBPBESRZSA-N	1	1	305.334	1.421	20	5		DDBDMO
CO[C@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371878	418638839	/nfs/dbraw/zinc/63/88/39/418638839.db2.gz	JEAOLWLJVZJYHA-KBPBESRZSA-N	1	1	305.334	1.421	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)s1	ZINC000375592096	418659906	/nfs/dbraw/zinc/65/99/06/418659906.db2.gz	QOOKXMYQNBRCHT-QWRGUYRKSA-N	1	1	312.395	1.964	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000364924587	418822351	/nfs/dbraw/zinc/82/23/51/418822351.db2.gz	AXJYWWQSPNTYKW-YUELXQCFSA-N	1	1	303.362	1.723	20	5		DDBDMO
Cc1cc(C(=O)N2CCC[N@H+]([C@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000364937290	418824402	/nfs/dbraw/zinc/82/44/02/418824402.db2.gz	QHHFNVAXVFZYLV-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
COC1(C[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)CCOCC1	ZINC000365426242	418859731	/nfs/dbraw/zinc/85/97/31/418859731.db2.gz	UXVYBMISGHFPKG-ZDUSSCGKSA-N	1	1	324.381	1.624	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](O)C[C@H]1C	ZINC000411413827	418901681	/nfs/dbraw/zinc/90/16/81/418901681.db2.gz	AONLDTWRLPHYJY-PWSUYJOCSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000372943698	418915034	/nfs/dbraw/zinc/91/50/34/418915034.db2.gz	CFPNLPUTFBOTBO-KBPBESRZSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044275	419590620	/nfs/dbraw/zinc/59/06/20/419590620.db2.gz	WPPMAFWQJZSQIP-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044275	419590626	/nfs/dbraw/zinc/59/06/26/419590626.db2.gz	WPPMAFWQJZSQIP-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
COC(=O)[C@H]1CSCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000412076228	419627878	/nfs/dbraw/zinc/62/78/78/419627878.db2.gz	IQXHISOIYHYLKA-GFCCVEGCSA-N	1	1	310.375	1.933	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@H]([NH3+])C1CC1	ZINC000414884727	419858599	/nfs/dbraw/zinc/85/85/99/419858599.db2.gz	FZHOVYGFGKOITK-HZMBPMFUSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H](N)C1CC1	ZINC000414884727	419858603	/nfs/dbraw/zinc/85/86/03/419858603.db2.gz	FZHOVYGFGKOITK-HZMBPMFUSA-N	1	1	306.366	1.639	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CC2)CC1	ZINC000299382067	229087353	/nfs/dbraw/zinc/08/73/53/229087353.db2.gz	VIIYCXFASDCTMB-FPYGCLRLSA-N	1	1	301.346	1.915	20	5		DDBDMO
CN1CCNC[C@H]1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423517858	420069570	/nfs/dbraw/zinc/06/95/70/420069570.db2.gz	OJFZKFMBVPZIDI-GOEBONIOSA-N	1	1	304.394	1.465	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000430433662	420118947	/nfs/dbraw/zinc/11/89/47/420118947.db2.gz	DBMUNVAQFRRCKH-UHFFFAOYSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420581446	420322403	/nfs/dbraw/zinc/32/24/03/420322403.db2.gz	GYJFMDNIKZYOLF-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[NH2+]C[C@@H]2c2ccccc2)c1[N+](=O)[O-]	ZINC000423992467	420296741	/nfs/dbraw/zinc/29/67/41/420296741.db2.gz	GFTFMJOCCDTLAD-GFCCVEGCSA-N	1	1	315.333	1.413	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000457093340	420610050	/nfs/dbraw/zinc/61/00/50/420610050.db2.gz	NYPGJWSLKWAJLB-NSHDSACASA-N	1	1	308.338	1.250	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000457103536	420615683	/nfs/dbraw/zinc/61/56/83/420615683.db2.gz	BCCOXQFXPYEDAL-CQSZACIVSA-N	1	1	321.377	1.915	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000440960646	420622618	/nfs/dbraw/zinc/62/26/18/420622618.db2.gz	RSDNCQPTSUYMEF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000440960646	420622621	/nfs/dbraw/zinc/62/26/21/420622621.db2.gz	RSDNCQPTSUYMEF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CCOc1cc(C[N@H+](C)CCNC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000492726096	420642171	/nfs/dbraw/zinc/64/21/71/420642171.db2.gz	ZCPTYLXEQHFSQS-UHFFFAOYSA-N	1	1	324.381	1.697	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)CCNC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000492726096	420642172	/nfs/dbraw/zinc/64/21/72/420642172.db2.gz	ZCPTYLXEQHFSQS-UHFFFAOYSA-N	1	1	324.381	1.697	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CC[NH3+])C1	ZINC000443063901	420742403	/nfs/dbraw/zinc/74/24/03/420742403.db2.gz	XISDSYYZYVVQII-STQMWFEESA-N	1	1	320.393	1.983	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000447994165	420831308	/nfs/dbraw/zinc/83/13/08/420831308.db2.gz	TTWINYWTFATHKT-CYBMUJFWSA-N	1	1	321.381	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)n1	ZINC000459785948	420871606	/nfs/dbraw/zinc/87/16/06/420871606.db2.gz	CPHHRPHAIRWGQY-UONOGXRCSA-N	1	1	308.382	1.664	20	5		DDBDMO
Cc1nc(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)ncc1[N+](=O)[O-]	ZINC000450384816	421191466	/nfs/dbraw/zinc/19/14/66/421191466.db2.gz	CEQIYBURPAHTQM-LBPRGKRZSA-N	1	1	316.365	1.886	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000561083112	421305153	/nfs/dbraw/zinc/30/51/53/421305153.db2.gz	NFRBHOGIKMBLPC-LLVKDONJSA-N	1	1	321.381	1.566	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000546810968	421310805	/nfs/dbraw/zinc/31/08/05/421310805.db2.gz	DRBANJHDLSYPCQ-SWLSCSKDSA-N	1	1	310.350	1.181	20	5		DDBDMO
CNc1nccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000563547531	421520637	/nfs/dbraw/zinc/52/06/37/421520637.db2.gz	VNYFWYKXLQCKLU-WDEREUQCSA-N	1	1	321.381	1.586	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000566867376	421609029	/nfs/dbraw/zinc/60/90/29/421609029.db2.gz	YTQLEYVDLVDROC-LLVKDONJSA-N	1	1	317.349	2.400	20	5		DDBDMO
CNc1nccc(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000566923421	421609846	/nfs/dbraw/zinc/60/98/46/421609846.db2.gz	IAPSDPPAUXJFHE-LLVKDONJSA-N	1	1	321.381	1.634	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H](C)C1	ZINC000554128840	421632577	/nfs/dbraw/zinc/63/25/77/421632577.db2.gz	SWZXXCGQGZBWGH-OUCADQQQSA-N	1	1	320.393	1.736	20	5		DDBDMO
CC(=O)NCC[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000570716104	421664565	/nfs/dbraw/zinc/66/45/65/421664565.db2.gz	ZKCLJXNAXJXZDE-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1CCOCC1	ZINC000533445609	421674259	/nfs/dbraw/zinc/67/42/59/421674259.db2.gz	YEHZNSOLWUQPKX-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000557556164	421778121	/nfs/dbraw/zinc/77/81/21/421778121.db2.gz	VBGTZWDTCATVDI-NSHDSACASA-N	1	1	306.366	1.836	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc4nc[nH]c(=O)c4cc3[N+](=O)[O-])C[C@@H]21	ZINC000574999801	422234464	/nfs/dbraw/zinc/23/44/64/422234464.db2.gz	SDAGXBYHKDJLDT-OTYXRUKQSA-N	1	1	315.333	1.384	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000578587013	422602404	/nfs/dbraw/zinc/60/24/04/422602404.db2.gz	QWSQTLNOEYRZNS-LLVKDONJSA-N	1	1	305.334	1.268	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000341577686	271126311	/nfs/dbraw/zinc/12/63/11/271126311.db2.gz	RYVFUWJXDHBKGM-KBPBESRZSA-N	1	1	322.409	1.561	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000345938382	272370027	/nfs/dbraw/zinc/37/00/27/272370027.db2.gz	WMMSORNREDMMFW-BETUJISGSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[C@@H](CN1CCN(C)CC1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000155085874	274218783	/nfs/dbraw/zinc/21/87/83/274218783.db2.gz	RENGXNFUOGPKPP-KBPBESRZSA-N	1	1	306.410	1.881	20	5		DDBDMO
C[C@@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1CCO	ZINC000450452365	274369956	/nfs/dbraw/zinc/36/99/56/274369956.db2.gz	MIZOZAXEHKOIAU-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000193822169	276167689	/nfs/dbraw/zinc/16/76/89/276167689.db2.gz	RVOSCMSUFBJPTH-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000193822169	276167690	/nfs/dbraw/zinc/16/76/90/276167690.db2.gz	RVOSCMSUFBJPTH-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
C[C@@H]1Cc2ccccc2C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000247347530	282047678	/nfs/dbraw/zinc/04/76/78/282047678.db2.gz	GLQMLHMIUYTUQV-MLGOLLRUSA-N	1	1	316.361	1.599	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@H](C3CC3)C2)c1	ZINC000362579777	300101371	/nfs/dbraw/zinc/10/13/71/300101371.db2.gz	XRVFWAOSSOQKTB-ZBFHGGJFSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@H](C3CC3)C2)c1	ZINC000362579777	300101372	/nfs/dbraw/zinc/10/13/72/300101372.db2.gz	XRVFWAOSSOQKTB-ZBFHGGJFSA-N	1	1	322.361	1.445	20	5		DDBDMO
CN(c1ncccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000363063830	300205380	/nfs/dbraw/zinc/20/53/80/300205380.db2.gz	MGCJALGHSIOWME-AWEZNQCLSA-N	1	1	319.409	1.595	20	5		DDBDMO
CN(c1ncccc1[N+](=O)[O-])[C@H]1CCN(C2CC[NH+](C)CC2)C1	ZINC000363063830	300205382	/nfs/dbraw/zinc/20/53/82/300205382.db2.gz	MGCJALGHSIOWME-AWEZNQCLSA-N	1	1	319.409	1.595	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000363379681	300259867	/nfs/dbraw/zinc/25/98/67/300259867.db2.gz	VHWKUBSIHYSSNX-UHFFFAOYSA-N	1	1	323.349	1.654	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000364350382	300382246	/nfs/dbraw/zinc/38/22/46/300382246.db2.gz	XTEZEFSDJIXDSR-CABCVRRESA-N	1	1	321.381	1.267	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](OCC3CC3)C2)c1	ZINC000364451244	300398864	/nfs/dbraw/zinc/39/88/64/300398864.db2.gz	XOMNTTZCINUWGM-CABCVRRESA-N	1	1	324.381	1.043	20	5		DDBDMO
Cc1nn(C)c(N2CCC[C@H](c3[nH+]ccn3C)C2)c1[N+](=O)[O-]	ZINC000369361438	301172502	/nfs/dbraw/zinc/17/25/02/301172502.db2.gz	DOOUWPZYEHTIDV-NSHDSACASA-N	1	1	304.354	1.754	20	5		DDBDMO
Cc1cc(C2=CC[N@H+]([C@@H](C)C(N)=O)CC2)cc([N+](=O)[O-])c1N	ZINC000369906049	301237513	/nfs/dbraw/zinc/23/75/13/301237513.db2.gz	KTKJTXYZGRQJPL-JTQLQIEISA-N	1	1	304.350	1.448	20	5		DDBDMO
Cc1cc(C2=CC[N@@H+]([C@@H](C)C(N)=O)CC2)cc([N+](=O)[O-])c1N	ZINC000369906049	301237515	/nfs/dbraw/zinc/23/75/15/301237515.db2.gz	KTKJTXYZGRQJPL-JTQLQIEISA-N	1	1	304.350	1.448	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000377120687	302145935	/nfs/dbraw/zinc/14/59/35/302145935.db2.gz	PWRLTOJAHNFMDV-QMMMGPOBSA-N	1	1	309.351	1.342	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000377120687	302145937	/nfs/dbraw/zinc/14/59/37/302145937.db2.gz	PWRLTOJAHNFMDV-QMMMGPOBSA-N	1	1	309.351	1.342	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@](O)(C2CC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000377260446	302160663	/nfs/dbraw/zinc/16/06/63/302160663.db2.gz	DUQRMUCZLJJDHM-INIZCTEOSA-N	1	1	319.361	1.404	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000362582531	307020923	/nfs/dbraw/zinc/02/09/23/307020923.db2.gz	ZMLNMHIDHROUOH-SECBINFHSA-N	1	1	313.304	1.483	20	5		DDBDMO
O=C(CC[N@H+]1C[C@H]2CC[C@@H](C1)O2)Nc1cc([N+](=O)[O-])ccc1F	ZINC000364642052	307049216	/nfs/dbraw/zinc/04/92/16/307049216.db2.gz	ZIZLQQJDTOHGCH-TXEJJXNPSA-N	1	1	323.324	1.926	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2CC[C@@H](C1)O2)Nc1cc([N+](=O)[O-])ccc1F	ZINC000364642052	307049217	/nfs/dbraw/zinc/04/92/17/307049217.db2.gz	ZIZLQQJDTOHGCH-TXEJJXNPSA-N	1	1	323.324	1.926	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]12	ZINC000366325109	307070989	/nfs/dbraw/zinc/07/09/89/307070989.db2.gz	JEPKZPDASJPCHW-WDEREUQCSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]12	ZINC000366325109	307070990	/nfs/dbraw/zinc/07/09/90/307070990.db2.gz	JEPKZPDASJPCHW-WDEREUQCSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2ccco2)C1	ZINC000367142449	307087031	/nfs/dbraw/zinc/08/70/31/307087031.db2.gz	WRUWXULKRUQLLF-LBPRGKRZSA-N	1	1	303.318	1.839	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000372358655	307168506	/nfs/dbraw/zinc/16/85/06/307168506.db2.gz	NUEHCSSKQJCHBP-CQSZACIVSA-N	1	1	319.361	1.689	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(Cc1ccccn1)[C@@H]1CCC[NH2+]CC1	ZINC000375270749	307219965	/nfs/dbraw/zinc/21/99/65/307219965.db2.gz	VSNQKELPBSFYLM-RBSFLKMASA-N	1	1	318.377	1.218	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]12	ZINC000377683739	307275853	/nfs/dbraw/zinc/27/58/53/307275853.db2.gz	UZVIEAWEUMLMOZ-NWDGAFQWSA-N	1	1	305.334	1.042	20	5		DDBDMO
Cn1c[nH+]cc1CCNc1ncnc2sc([N+](=O)[O-])cc21	ZINC000401885857	307297049	/nfs/dbraw/zinc/29/70/49/307297049.db2.gz	TWWOZYIZSKNKDM-UHFFFAOYSA-N	1	1	304.335	1.988	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCc2c[nH+]c3n2CCCC3)c1[N+](=O)[O-]	ZINC000551975421	307813059	/nfs/dbraw/zinc/81/30/59/307813059.db2.gz	WDBYXYDGUMDWCK-UHFFFAOYSA-N	1	1	318.337	1.100	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[NH+](C)CC1	ZINC000570164202	308161031	/nfs/dbraw/zinc/16/10/31/308161031.db2.gz	CILKVBRRBHDTGT-NSHDSACASA-N	1	1	321.381	1.211	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000571263522	308192877	/nfs/dbraw/zinc/19/28/77/308192877.db2.gz	FLZDGTPQOAMEIC-GWCFXTLKSA-N	1	1	319.365	1.407	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000575384152	308275953	/nfs/dbraw/zinc/27/59/53/308275953.db2.gz	GMFYCFXZOOUOFS-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000575384152	308275954	/nfs/dbraw/zinc/27/59/54/308275954.db2.gz	GMFYCFXZOOUOFS-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000575384152	308275956	/nfs/dbraw/zinc/27/59/56/308275956.db2.gz	GMFYCFXZOOUOFS-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000578156816	308442159	/nfs/dbraw/zinc/44/21/59/308442159.db2.gz	GVBAQEPXBSEVIS-OAHLLOKOSA-N	1	1	312.329	1.777	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]1COCC2	ZINC000375681024	483952197	/nfs/dbraw/zinc/95/21/97/483952197.db2.gz	XCGDDSMIFWPQFI-XJKSGUPXSA-N	1	1	320.345	1.606	20	5		DDBDMO
[NH3+]C1CCN(CCCC(=O)NCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000433131815	534566194	/nfs/dbraw/zinc/56/61/94/534566194.db2.gz	LHGRUGGBLMYACJ-UHFFFAOYSA-N	1	1	320.393	1.414	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[N@@H+](C3CC3)CCO1)CCN2	ZINC000302483512	534884565	/nfs/dbraw/zinc/88/45/65/534884565.db2.gz	XAXPIRQEDRDPAR-GFCCVEGCSA-N	1	1	318.377	1.838	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[N@H+](C3CC3)CCO1)CCN2	ZINC000302483512	534884567	/nfs/dbraw/zinc/88/45/67/534884567.db2.gz	XAXPIRQEDRDPAR-GFCCVEGCSA-N	1	1	318.377	1.838	20	5		DDBDMO
CC(C)[C@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000292873493	527731428	/nfs/dbraw/zinc/73/14/28/527731428.db2.gz	HVBRQFVAFYDCIO-OAHLLOKOSA-N	1	1	321.377	1.370	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000434062955	527895874	/nfs/dbraw/zinc/89/58/74/527895874.db2.gz	PIDWIYZNIOZQER-NEPJUHHUSA-N	1	1	306.366	1.632	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000331744405	528548142	/nfs/dbraw/zinc/54/81/42/528548142.db2.gz	YFZFDLCICWNKPK-PWSUYJOCSA-N	1	1	321.381	1.627	20	5		DDBDMO
CC(C)[N@H+](Cc1cccnc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000305712143	528956745	/nfs/dbraw/zinc/95/67/45/528956745.db2.gz	YFLOAENFMACBBY-HNNXBMFYSA-N	1	1	319.365	1.458	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C1CC1	ZINC000101958618	696609472	/nfs/dbraw/zinc/60/94/72/696609472.db2.gz	RKGJKXRKPQAGMZ-UHFFFAOYSA-N	1	1	322.321	1.717	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C1CC1	ZINC000102653124	696611255	/nfs/dbraw/zinc/61/12/55/696611255.db2.gz	PJZDNQWIHOWYCO-VIFPVBQESA-N	1	1	310.354	1.639	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C1CC1	ZINC000102653124	696611256	/nfs/dbraw/zinc/61/12/56/696611256.db2.gz	PJZDNQWIHOWYCO-VIFPVBQESA-N	1	1	310.354	1.639	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000108342956	696633748	/nfs/dbraw/zinc/63/37/48/696633748.db2.gz	NOQQHHRJWJYGMF-SNVBAGLBSA-N	1	1	322.321	1.575	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@H]1CCCS1(=O)=O	ZINC000127001747	696767181	/nfs/dbraw/zinc/76/71/81/696767181.db2.gz	VSPMIRXRCBAVBF-LLVKDONJSA-N	1	1	318.782	1.915	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3ccccn3)C2)c1	ZINC000799191556	700127706	/nfs/dbraw/zinc/12/77/06/700127706.db2.gz	NAELIFJNSVYBRE-OCCSQVGLSA-N	1	1	317.349	1.037	20	5		DDBDMO
Cc1c(NC(=O)CC[NH+]2CC(O)(C(C)C)C2)cccc1[N+](=O)[O-]	ZINC000773892152	697819382	/nfs/dbraw/zinc/81/93/82/697819382.db2.gz	FFADVGSISWNNJK-UHFFFAOYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@H]2CCCOC2)c2ncc([N+](=O)[O-])cc12	ZINC000749951792	700193713	/nfs/dbraw/zinc/19/37/13/700193713.db2.gz	CVHUJLKVBKSUPM-LBPRGKRZSA-N	1	1	319.365	1.964	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC3(C2)OCCO3)cc1	ZINC000776590555	698123570	/nfs/dbraw/zinc/12/35/70/698123570.db2.gz	HXRIEMHAGDTDMN-AWEZNQCLSA-N	1	1	308.334	1.467	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC3(C2)OCCO3)cc1	ZINC000776590555	698123573	/nfs/dbraw/zinc/12/35/73/698123573.db2.gz	HXRIEMHAGDTDMN-AWEZNQCLSA-N	1	1	308.334	1.467	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776590327	698123862	/nfs/dbraw/zinc/12/38/62/698123862.db2.gz	ZNRKORDBTXXAMA-XJKSGUPXSA-N	1	1	324.377	1.613	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1	ZINC000778264323	698254826	/nfs/dbraw/zinc/25/48/26/698254826.db2.gz	XHGUDTMRFGLGFF-LLVKDONJSA-N	1	1	313.304	1.897	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1	ZINC000778264323	698254828	/nfs/dbraw/zinc/25/48/28/698254828.db2.gz	XHGUDTMRFGLGFF-LLVKDONJSA-N	1	1	313.304	1.897	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000741721810	699848841	/nfs/dbraw/zinc/84/88/41/699848841.db2.gz	CQUXNWNRGOJRKG-NWDGAFQWSA-N	1	1	320.393	1.873	20	5		DDBDMO
COC[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1	ZINC000742153834	699861850	/nfs/dbraw/zinc/86/18/50/699861850.db2.gz	VXPGLBKSPOTYJO-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1	ZINC000742153834	699861853	/nfs/dbraw/zinc/86/18/53/699861853.db2.gz	VXPGLBKSPOTYJO-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000801939519	700358378	/nfs/dbraw/zinc/35/83/78/700358378.db2.gz	FNPHLGVIWLEHOA-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@@H+]1C	ZINC000801939519	700358381	/nfs/dbraw/zinc/35/83/81/700358381.db2.gz	FNPHLGVIWLEHOA-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000767430305	701106308	/nfs/dbraw/zinc/10/63/08/701106308.db2.gz	QSLHBVRFYPMORQ-LBPRGKRZSA-N	1	1	304.350	1.845	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)OCCCn1cc[nH+]c1C	ZINC000767618638	701123540	/nfs/dbraw/zinc/12/35/40/701123540.db2.gz	VDCDSPPIQOOAEL-UHFFFAOYSA-N	1	1	307.310	1.238	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000771995546	701339688	/nfs/dbraw/zinc/33/96/88/701339688.db2.gz	RMUZQASPPKJGHW-UHFFFAOYSA-N	1	1	308.269	1.678	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@@H](C(=O)N3CCCC3)C2)c(C)c1[N+](=O)[O-]	ZINC000808205399	701507368	/nfs/dbraw/zinc/50/73/68/701507368.db2.gz	DATVLOJZKCRZGX-CYBMUJFWSA-N	1	1	321.381	1.310	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](C(=O)N3CCCC3)C2)c(C)c1[N+](=O)[O-]	ZINC000808205399	701507370	/nfs/dbraw/zinc/50/73/70/701507370.db2.gz	DATVLOJZKCRZGX-CYBMUJFWSA-N	1	1	321.381	1.310	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)NCc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000868062298	701920744	/nfs/dbraw/zinc/92/07/44/701920744.db2.gz	KJWFUVRYWCCNCI-UONOGXRCSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@@H]21	ZINC000866208676	706649256	/nfs/dbraw/zinc/64/92/56/706649256.db2.gz	KJNKXKOGPUMAFU-GWCFXTLKSA-N	1	1	304.350	1.224	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H](CO)C[NH+]2CCCCC2)c1	ZINC000843113557	702821624	/nfs/dbraw/zinc/82/16/24/702821624.db2.gz	WZPCSHJMYZXRBC-HOCLYGCPSA-N	1	1	323.393	1.065	20	5		DDBDMO
C[C@@H]([NH3+])[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843365767	702867312	/nfs/dbraw/zinc/86/73/12/702867312.db2.gz	RPCIXLZEMSHCPG-MNOVXSKESA-N	1	1	324.356	1.732	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)CCN1c1cccc([N+](=O)[O-])c1	ZINC000844457772	703034076	/nfs/dbraw/zinc/03/40/76/703034076.db2.gz	ZPQBAURUDNIEEH-XQQFMLRXSA-N	1	1	323.299	1.897	20	5		DDBDMO
O=C1[C@@H]([N@H+]2C[C@H]3[C@@H](C2)C3(F)F)CCN1c1cccc([N+](=O)[O-])c1	ZINC000844457772	703034078	/nfs/dbraw/zinc/03/40/78/703034078.db2.gz	ZPQBAURUDNIEEH-XQQFMLRXSA-N	1	1	323.299	1.897	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCC[C@@H]1CC[N@H+](C)C1	ZINC000847827375	703473765	/nfs/dbraw/zinc/47/37/65/703473765.db2.gz	PFULRFHUMFBASK-LBPRGKRZSA-N	1	1	310.354	1.375	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848582255	703565596	/nfs/dbraw/zinc/56/55/96/703565596.db2.gz	JSPHDHUJEPBRDE-SECBINFHSA-N	1	1	315.276	1.387	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848582255	703565598	/nfs/dbraw/zinc/56/55/98/703565598.db2.gz	JSPHDHUJEPBRDE-SECBINFHSA-N	1	1	315.276	1.387	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)N1	ZINC000852300236	704001893	/nfs/dbraw/zinc/00/18/93/704001893.db2.gz	MFKPPRQTPOEBNL-UHFFFAOYSA-N	1	1	317.345	1.843	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](Cn2ccnn2)C1	ZINC000852316929	704010307	/nfs/dbraw/zinc/01/03/07/704010307.db2.gz	ISGARTCVTFGWAE-NSHDSACASA-N	1	1	305.313	1.848	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852412705	704038248	/nfs/dbraw/zinc/03/82/48/704038248.db2.gz	YDVZQMQTBDHKNW-HUUCEWRRSA-N	1	1	310.350	1.102	20	5		DDBDMO
CCC[N@@H+]1CC[C@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981752	704042024	/nfs/dbraw/zinc/04/20/24/704042024.db2.gz	YFTGFRGSOQYMPU-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981752	704042027	/nfs/dbraw/zinc/04/20/27/704042027.db2.gz	YFTGFRGSOQYMPU-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@](O)(C3CC3)C2)c1	ZINC000852500985	704064491	/nfs/dbraw/zinc/06/44/91/704064491.db2.gz	HFWBVBZQQYVKLA-JKSUJKDBSA-N	1	1	306.362	1.865	20	5		DDBDMO
C[N@@H+](C[C@H](O)CNCc1cc([N+](=O)[O-])ccc1Cl)C1CC1	ZINC000819149149	704076324	/nfs/dbraw/zinc/07/63/24/704076324.db2.gz	HSCSTNCHXDUMJB-CYBMUJFWSA-N	1	1	313.785	1.793	20	5		DDBDMO
Cn1cc(Cl)c(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819346626	704111085	/nfs/dbraw/zinc/11/10/85/704111085.db2.gz	HABLMQURBPQTBT-ZDUSSCGKSA-N	1	1	310.741	1.805	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CCC1(C)C	ZINC000871153715	704232505	/nfs/dbraw/zinc/23/25/05/704232505.db2.gz	SEYNFMUPKKLRSH-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCCN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000853540924	704263511	/nfs/dbraw/zinc/26/35/11/704263511.db2.gz	NABGZEHPLIHRSI-JTQLQIEISA-N	1	1	302.338	1.690	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cn1ncc3ccc([N+](=O)[O-])cc31)C2	ZINC000853565929	704271684	/nfs/dbraw/zinc/27/16/84/704271684.db2.gz	KQZQQFKFJRNRFM-WFASDCNBSA-N	1	1	302.334	1.870	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000854497612	704408089	/nfs/dbraw/zinc/40/80/89/704408089.db2.gz	RZEMNJJXDOZEIK-SNVBAGLBSA-N	1	1	310.379	1.553	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000854497612	704408091	/nfs/dbraw/zinc/40/80/91/704408091.db2.gz	RZEMNJJXDOZEIK-SNVBAGLBSA-N	1	1	310.379	1.553	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000855163810	704471791	/nfs/dbraw/zinc/47/17/91/704471791.db2.gz	GIXVDKDEPLLODO-NSHDSACASA-N	1	1	306.366	1.780	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000832455869	706917986	/nfs/dbraw/zinc/91/79/86/706917986.db2.gz	REHSAVYATGEDOV-DGCLKSJQSA-N	1	1	311.294	1.397	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000874834924	705191976	/nfs/dbraw/zinc/19/19/76/705191976.db2.gz	VSDQGCGDVDSDSB-NWDGAFQWSA-N	1	1	304.350	1.486	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000861352440	705441482	/nfs/dbraw/zinc/44/14/82/705441482.db2.gz	JDISQSIEPGTBPT-SMDDNHRTSA-N	1	1	302.371	1.474	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000893877130	710871125	/nfs/dbraw/zinc/87/11/25/710871125.db2.gz	UNAMCPZWJXPKNV-ZDUSSCGKSA-N	1	1	320.393	1.921	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)c(N)c([N+](=O)[O-])c1	ZINC000827312337	705973366	/nfs/dbraw/zinc/97/33/66/705973366.db2.gz	UNMORWJSMQSIBG-AAEUAGOBSA-N	1	1	318.377	1.652	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)CC[C@H]21	ZINC000827328220	705976357	/nfs/dbraw/zinc/97/63/57/705976357.db2.gz	DFQWIIHZFAYDNH-WCQYABFASA-N	1	1	321.381	1.079	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827338669	705979587	/nfs/dbraw/zinc/97/95/87/705979587.db2.gz	PZSGNMIGLFJPAO-OCCSQVGLSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000827363509	705985576	/nfs/dbraw/zinc/98/55/76/705985576.db2.gz	BBEAWCZSVYSKJX-WFASDCNBSA-N	1	1	319.361	1.526	20	5		DDBDMO
CCCN1CCC([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CC1	ZINC000877143096	705995589	/nfs/dbraw/zinc/99/55/89/705995589.db2.gz	DKLKYGQFCNFXJB-UHFFFAOYSA-N	1	1	307.398	1.959	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@H]2CCC[N@H+](CCCO)C2)nc2ccccn21	ZINC000828461380	706184186	/nfs/dbraw/zinc/18/41/86/706184186.db2.gz	VHIYYYYQFSFHEG-LBPRGKRZSA-N	1	1	319.365	1.501	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](CO)[C@H](CO)C2)cc1Cl	ZINC000877765073	706202170	/nfs/dbraw/zinc/20/21/70/706202170.db2.gz	SQWCJLIINCGXML-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](CO)[C@H](CO)C2)cc1Cl	ZINC000877765073	706202172	/nfs/dbraw/zinc/20/21/72/706202172.db2.gz	SQWCJLIINCGXML-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)O)C1	ZINC000880146548	706892163	/nfs/dbraw/zinc/89/21/63/706892163.db2.gz	UOIKTJDBTOGWEX-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)O)C1	ZINC000880146548	706892166	/nfs/dbraw/zinc/89/21/66/706892166.db2.gz	UOIKTJDBTOGWEX-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000880311478	706937537	/nfs/dbraw/zinc/93/75/37/706937537.db2.gz	IDPVNZGVHSDACN-IJEWVQPXSA-N	1	1	319.361	1.038	20	5		DDBDMO
O=C(NCC[N@@H+]1CCCOCC1)c1cc([N+](=O)[O-])ccc1F	ZINC000832708512	706967743	/nfs/dbraw/zinc/96/77/43/706967743.db2.gz	LQHBNJZSLHKCOG-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)c1cc([N+](=O)[O-])ccc1F	ZINC000832708512	706967745	/nfs/dbraw/zinc/96/77/45/706967745.db2.gz	LQHBNJZSLHKCOG-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCOC[C@H]1OC	ZINC000880436983	706975540	/nfs/dbraw/zinc/97/55/40/706975540.db2.gz	DWCBGRPFGQCERA-DZGCQCFKSA-N	1	1	310.350	1.839	20	5		DDBDMO
O=[N+]([O-])c1ccc([O-])cc1C[N@@H+]1C[C@@H](O)CC2(CCOCC2)C1	ZINC000880581102	707025639	/nfs/dbraw/zinc/02/56/39/707025639.db2.gz	WPWVSWRUGHOGKO-AWEZNQCLSA-N	1	1	322.361	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc([O-])cc1CN1C[C@@H](O)CC2(CCOCC2)C1	ZINC000880581102	707025641	/nfs/dbraw/zinc/02/56/41/707025641.db2.gz	WPWVSWRUGHOGKO-AWEZNQCLSA-N	1	1	322.361	1.664	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C	ZINC000880613189	707041347	/nfs/dbraw/zinc/04/13/47/707041347.db2.gz	NTXCVIFWUWIVKB-CQSZACIVSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)[N+](=O)[O-]	ZINC000834591782	707090805	/nfs/dbraw/zinc/09/08/05/707090805.db2.gz	DMTSSYMXDJAHGX-RYUDHWBXSA-N	1	1	301.362	1.467	20	5		DDBDMO
C[C@H]1CN(c2ccnc(F)c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000882232814	707550649	/nfs/dbraw/zinc/55/06/49/707550649.db2.gz	AVKLDDQLKJYEPD-JTQLQIEISA-N	1	1	312.345	1.410	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](C)N1CCN(C)CC1	ZINC000873044068	707706020	/nfs/dbraw/zinc/70/60/20/707706020.db2.gz	ASJQGEZKZQDMJT-CQSZACIVSA-N	1	1	320.437	1.937	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000838149916	707855196	/nfs/dbraw/zinc/85/51/96/707855196.db2.gz	QVFGMSBKQPIDNR-SWLSCSKDSA-N	1	1	321.377	1.476	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCCO3)C2)c([N+](=O)[O-])c1	ZINC000886827925	708855622	/nfs/dbraw/zinc/85/56/22/708855622.db2.gz	UFWDTHKRSMIRMS-ZFWWWQNUSA-N	1	1	319.361	1.695	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCCN2Cc2cccnc2[N+](=O)[O-])C1	ZINC000886841648	708859292	/nfs/dbraw/zinc/85/92/92/708859292.db2.gz	RLAJDBNPGDCLFN-QLFBSQMISA-N	1	1	320.393	1.851	20	5		DDBDMO
C[C@H](CNC(=O)[C@@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402449	709037354	/nfs/dbraw/zinc/03/73/54/709037354.db2.gz	CDMRAWQHEIGACO-RISCZKNCSA-N	1	1	307.350	1.145	20	5		DDBDMO
C[C@H](CNC(=O)[C@@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402449	709037356	/nfs/dbraw/zinc/03/73/56/709037356.db2.gz	CDMRAWQHEIGACO-RISCZKNCSA-N	1	1	307.350	1.145	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000910281354	709863258	/nfs/dbraw/zinc/86/32/58/709863258.db2.gz	WUBRYEMGKNMRRW-SNVBAGLBSA-N	1	1	308.338	1.252	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1	ZINC000893374735	710622544	/nfs/dbraw/zinc/62/25/44/710622544.db2.gz	QSMXOVZJRRTJGU-LLVKDONJSA-N	1	1	324.381	1.280	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1C	ZINC000928444783	713198839	/nfs/dbraw/zinc/19/88/39/713198839.db2.gz	MLGGHNJTRINTNB-GXSJLCMTSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@H+]1C	ZINC000928450122	713202314	/nfs/dbraw/zinc/20/23/14/713202314.db2.gz	SHNDEZSYVZZIEP-CABZTGNLSA-N	1	1	321.333	1.188	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000913533604	713247874	/nfs/dbraw/zinc/24/78/74/713247874.db2.gz	UISBWEYGURZIFI-BETUJISGSA-N	1	1	307.325	1.581	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895249673	711466238	/nfs/dbraw/zinc/46/62/38/711466238.db2.gz	WOFKARMZULHBHF-NWDGAFQWSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1CN(C)CC[N@@H+]1C	ZINC000895249673	711466240	/nfs/dbraw/zinc/46/62/40/711466240.db2.gz	WOFKARMZULHBHF-NWDGAFQWSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1CN(C)CC[N@H+]1C	ZINC000895249673	711466242	/nfs/dbraw/zinc/46/62/42/711466242.db2.gz	WOFKARMZULHBHF-NWDGAFQWSA-N	1	1	318.381	1.289	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1	ZINC000895708878	711584768	/nfs/dbraw/zinc/58/47/68/711584768.db2.gz	WROMTKCVXLZSKZ-INIZCTEOSA-N	1	1	322.361	1.828	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1	ZINC000895708878	711584770	/nfs/dbraw/zinc/58/47/70/711584770.db2.gz	WROMTKCVXLZSKZ-INIZCTEOSA-N	1	1	322.361	1.828	20	5		DDBDMO
Cc1cc(NC[C@@H]2CC[N@@H+]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000895771039	711602044	/nfs/dbraw/zinc/60/20/44/711602044.db2.gz	FYMFXSRAIYMIBY-AWEZNQCLSA-N	1	1	313.361	1.898	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000896554422	711749980	/nfs/dbraw/zinc/74/99/80/711749980.db2.gz	FLPQDDBXTWJUFP-IINYFYTJSA-N	1	1	324.356	1.098	20	5		DDBDMO
Cn1cc(C[NH2+]CC2(N)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000904444304	711859547	/nfs/dbraw/zinc/85/95/47/711859547.db2.gz	PZLCYNVXVSSCLN-UHFFFAOYSA-N	1	1	301.350	1.576	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[NH+](Cc3cccs3)CC2)c1	ZINC000914566570	713397282	/nfs/dbraw/zinc/39/72/82/713397282.db2.gz	UINBMJVRVBNRTR-UHFFFAOYSA-N	1	1	307.379	1.628	20	5		DDBDMO
COc1cc(OC)cc(N2CCC[N@H+](CC[N+](=O)[O-])CC2)c1	ZINC000929829775	713699622	/nfs/dbraw/zinc/69/96/22/713699622.db2.gz	VIUJBBIBINJBGF-UHFFFAOYSA-N	1	1	309.366	1.493	20	5		DDBDMO
COc1cc(OC)cc(N2CCC[N@@H+](CC[N+](=O)[O-])CC2)c1	ZINC000929829775	713699623	/nfs/dbraw/zinc/69/96/23/713699623.db2.gz	VIUJBBIBINJBGF-UHFFFAOYSA-N	1	1	309.366	1.493	20	5		DDBDMO
COC/C(C)=C\C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000930681229	713894464	/nfs/dbraw/zinc/89/44/64/713894464.db2.gz	UKJUGHWQAUTBOS-ACAGNQJTSA-N	1	1	306.366	1.705	20	5		DDBDMO
Cc1c(CNC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000922167839	713980928	/nfs/dbraw/zinc/98/09/28/713980928.db2.gz	GYRKRBHXFFHQOL-AAEUAGOBSA-N	1	1	306.366	1.795	20	5		DDBDMO
C[C@H]1[C@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043574	713989311	/nfs/dbraw/zinc/98/93/11/713989311.db2.gz	QQULNZKQEVDCKO-GXTWGEPZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043574	713989315	/nfs/dbraw/zinc/98/93/15/713989315.db2.gz	QQULNZKQEVDCKO-GXTWGEPZSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1c(CN2CCC(O)(C[NH+](C)C)CC2)cccc1[N+](=O)[O-]	ZINC000931485958	714109101	/nfs/dbraw/zinc/10/91/01/714109101.db2.gz	IJDUSPMNYBCTRF-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCn2cc[nH+]c21	ZINC000931523937	714119013	/nfs/dbraw/zinc/11/90/13/714119013.db2.gz	KUSMTZALERNPQH-UHFFFAOYSA-N	1	1	301.306	1.558	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@H]1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923369575	714330454	/nfs/dbraw/zinc/33/04/54/714330454.db2.gz	KZNCDGMDVNUSMO-IUODEOHRSA-N	1	1	323.393	1.312	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@@H+]2CCOc1cccc([N+](=O)[O-])c1	ZINC000932931960	714439714	/nfs/dbraw/zinc/43/97/14/714439714.db2.gz	QNJXTYWWHVEPQL-UHFFFAOYSA-N	1	1	305.334	1.456	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@H+]2CCOc1cccc([N+](=O)[O-])c1	ZINC000932931960	714439715	/nfs/dbraw/zinc/43/97/15/714439715.db2.gz	QNJXTYWWHVEPQL-UHFFFAOYSA-N	1	1	305.334	1.456	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000933040817	714506290	/nfs/dbraw/zinc/50/62/90/714506290.db2.gz	LLIQHOWCSZUEEN-ZDUSSCGKSA-N	1	1	323.324	1.119	20	5		DDBDMO
C[C@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000933557984	714615750	/nfs/dbraw/zinc/61/57/50/714615750.db2.gz	HSVQRFYSTRMOQT-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000933557984	714615752	/nfs/dbraw/zinc/61/57/52/714615752.db2.gz	HSVQRFYSTRMOQT-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
O=C1NCCN1CC1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1	ZINC000933591580	714626300	/nfs/dbraw/zinc/62/63/00/714626300.db2.gz	HJZNZOGXEKYBGW-UHFFFAOYSA-N	1	1	324.406	1.894	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(CCOc3ccccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000933745564	714661625	/nfs/dbraw/zinc/66/16/25/714661625.db2.gz	REEJUTKIDHWOKE-CJNGLKHVSA-N	1	1	305.378	1.857	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933967802	714710808	/nfs/dbraw/zinc/71/08/08/714710808.db2.gz	PMSBHPRTTJUNQF-SOUVJXGZSA-N	1	1	308.334	1.118	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933967802	714710810	/nfs/dbraw/zinc/71/08/10/714710810.db2.gz	PMSBHPRTTJUNQF-SOUVJXGZSA-N	1	1	308.334	1.118	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CC[N@H+]1C	ZINC000925333470	714815585	/nfs/dbraw/zinc/81/55/85/714815585.db2.gz	FCMYAZQJCBSDHA-SMDDNHRTSA-N	1	1	318.377	1.755	20	5		DDBDMO
C[C@]12CSC[C@H]1C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2	ZINC000934770249	714897980	/nfs/dbraw/zinc/89/79/80/714897980.db2.gz	JOOGOZOEIFBWJO-RISCZKNCSA-N	1	1	309.391	1.441	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000934832074	714912713	/nfs/dbraw/zinc/91/27/13/714912713.db2.gz	NIFDRDMJQCTBSO-CHWSQXEVSA-N	1	1	308.382	1.967	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21	ZINC000934951501	714937263	/nfs/dbraw/zinc/93/72/63/714937263.db2.gz	OUSWEQNSECMHQU-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000935663226	715112639	/nfs/dbraw/zinc/11/26/39/715112639.db2.gz	PTQBLFVXBLGYAW-ZDUSSCGKSA-N	1	1	321.381	1.233	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3cnc4cc([N+](=O)[O-])ccc4n3)C[C@H]21	ZINC001164669130	719379593	/nfs/dbraw/zinc/37/95/93/719379593.db2.gz	QBKCUQXSDZXWPF-ZIAGYGMSSA-N	1	1	315.333	1.057	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC001165039388	721907147	/nfs/dbraw/zinc/90/71/47/721907147.db2.gz	SKLLZQKMNSWGCW-GFCCVEGCSA-N	1	1	322.365	1.299	20	5		DDBDMO
Cc1ccccc1OCCC[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126948847	742989077	/nfs/dbraw/zinc/98/90/77/742989077.db2.gz	JLMCDXLFAILGRH-ZIAGYGMSSA-N	1	1	321.377	1.135	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001193897167	746231006	/nfs/dbraw/zinc/23/10/06/746231006.db2.gz	BKEPZGVATJVOPQ-WDEREUQCSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1C1CCCC1	ZINC001197798468	747268029	/nfs/dbraw/zinc/26/80/29/747268029.db2.gz	MRXIVLYEKUMLCD-ZDUSSCGKSA-N	1	1	307.398	1.740	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CC2=CCCCC2)CC1	ZINC000996428386	749586108	/nfs/dbraw/zinc/58/61/08/749586108.db2.gz	AKXOCIMZUYPDNV-HUUCEWRRSA-N	1	1	307.394	1.733	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CC2CCCC2)CC1	ZINC001005380757	749949767	/nfs/dbraw/zinc/94/97/67/749949767.db2.gz	GHGBALZHJDLMHQ-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001095625494	750092667	/nfs/dbraw/zinc/09/26/67/750092667.db2.gz	SUVUKORDNMWTLD-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
CC(C)[N@@H+](C)[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001157011151	764294599	/nfs/dbraw/zinc/29/45/99/764294599.db2.gz	XHJFJNPCEFXKHV-SNVBAGLBSA-N	1	1	309.326	1.817	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C[N@H+]1C1CC1	ZINC001137492696	766350128	/nfs/dbraw/zinc/35/01/28/766350128.db2.gz	XKJYELPGUCOFHQ-RNFRBKRXSA-N	1	1	313.745	1.326	20	5		DDBDMO
C[NH+](C)CC1(C(=O)NCCNCc2ccccc2[N+](=O)[O-])CC1	ZINC001132993494	769401737	/nfs/dbraw/zinc/40/17/37/769401737.db2.gz	WURSMINDUVDPSJ-UHFFFAOYSA-N	1	1	320.393	1.142	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001093771092	775068340	/nfs/dbraw/zinc/06/83/40/775068340.db2.gz	XJXZWILZFHJJKM-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
Cc1nc(NCCCNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC001094456936	775895945	/nfs/dbraw/zinc/89/59/45/775895945.db2.gz	VJQMMURAMFDJBS-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
C[C@@H]1C(=O)NCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908136	776917766	/nfs/dbraw/zinc/91/77/66/776917766.db2.gz	BCKJZTCGPQFMBT-RISCZKNCSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H]1C(=O)NCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908136	776917768	/nfs/dbraw/zinc/91/77/68/776917768.db2.gz	BCKJZTCGPQFMBT-RISCZKNCSA-N	1	1	303.362	1.663	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172918259	776931106	/nfs/dbraw/zinc/93/11/06/776931106.db2.gz	ZXDRJSBERIRREM-AWEZNQCLSA-N	1	1	305.378	1.910	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)N(C)C)CC1	ZINC001173229406	777063737	/nfs/dbraw/zinc/06/37/37/777063737.db2.gz	UJYDXJXLWBRFSG-CYBMUJFWSA-N	1	1	320.393	1.825	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101634615	777331126	/nfs/dbraw/zinc/33/11/26/777331126.db2.gz	FJAXGOUXQTULSZ-UHFFFAOYSA-N	1	1	318.337	1.065	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ncc([N+](=O)[O-])cc1C	ZINC001101705841	777416379	/nfs/dbraw/zinc/41/63/79/777416379.db2.gz	ZPWWBGFMXCCKDQ-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
COc1cc(C[NH2+]CC(=O)NCC(C)C)c([N+](=O)[O-])cc1O	ZINC001177712374	778710185	/nfs/dbraw/zinc/71/01/85/778710185.db2.gz	JJNRBKAXVRFVBS-UHFFFAOYSA-N	1	1	311.338	1.171	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC001116009681	780467137	/nfs/dbraw/zinc/46/71/37/780467137.db2.gz	OSYZHQCKEPXUBH-LBPRGKRZSA-N	1	1	318.377	1.851	20	5		DDBDMO
Cc1c(-c2nnc(C[NH+](C)C)o2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC001118070289	781015690	/nfs/dbraw/zinc/01/56/90/781015690.db2.gz	BXGIFLXXTPQIQZ-UHFFFAOYSA-N	1	1	307.266	1.923	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC001122253110	858725874	/nfs/dbraw/zinc/72/58/74/858725874.db2.gz	JPEWXZSXYKDPDM-IAQYHMDHSA-N	1	1	307.350	1.406	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCN1C	ZINC001123318758	859173294	/nfs/dbraw/zinc/17/32/94/859173294.db2.gz	SGLIXIFVRFAHAZ-RISCZKNCSA-N	1	1	321.381	1.351	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@@H]([N@@H+](C)C(C)C)C1	ZINC001157002495	863510804	/nfs/dbraw/zinc/51/08/04/863510804.db2.gz	ZMWPYRXBUPYQRY-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1ccc(-c2ccc(-n3cnc(C[NH3+])n3)nn2)cc1[N+](=O)[O-]	ZINC001157928857	864272863	/nfs/dbraw/zinc/27/28/63/864272863.db2.gz	XURJUGJYAOXLPK-UHFFFAOYSA-N	1	1	311.305	1.400	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@@H+](C(C)C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC001158494957	864688618	/nfs/dbraw/zinc/68/86/18/864688618.db2.gz	TWFKNBRYSKAGDN-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1N[C@@H]1C[C@H]2CCC[C@@H](C1)[N@@H+]2C	ZINC001160472390	865867973	/nfs/dbraw/zinc/86/79/73/865867973.db2.gz	CTCWNKXOGCFYKF-XYYAHUGASA-N	1	1	306.366	1.964	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2ncc([N+](=O)[O-])c(C)c2C)CC1	ZINC001161135625	866399016	/nfs/dbraw/zinc/39/90/16/866399016.db2.gz	INYHQAKYTQVCJF-UHFFFAOYSA-N	1	1	321.381	1.229	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC001320576756	866850071	/nfs/dbraw/zinc/85/00/71/866850071.db2.gz	ZOKZOIBGIOBMSB-ZDUSSCGKSA-N	1	1	306.366	1.457	20	5		DDBDMO
COCCOCC[N@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC001335062343	868037568	/nfs/dbraw/zinc/03/75/68/868037568.db2.gz	QGZKOGQCPBXWIK-UHFFFAOYSA-N	1	1	314.338	1.404	20	5		DDBDMO
COCCOCC[N@@H+](C)Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC001335062343	868037587	/nfs/dbraw/zinc/03/75/87/868037587.db2.gz	QGZKOGQCPBXWIK-UHFFFAOYSA-N	1	1	314.338	1.404	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@@H](F)[C@@H](O)CC2)ncc1[N+](=O)[O-]	ZINC001164237330	869045149	/nfs/dbraw/zinc/04/51/49/869045149.db2.gz	JHXOLOBMZRCXDI-CIYRCRHJSA-N	1	1	324.356	1.821	20	5		DDBDMO
CCN(c1cc(/C=C\[NH+](C)C)c([N+](=O)[O-])cn1)C1CN(C)C1	ZINC001165190187	869420919	/nfs/dbraw/zinc/42/09/19/869420919.db2.gz	SABZBGQLVUQUOQ-SREVYHEPSA-N	1	1	305.382	1.662	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1	ZINC001337678384	869592349	/nfs/dbraw/zinc/59/23/49/869592349.db2.gz	HTXRCCITBIOMGR-ABAIWWIYSA-N	1	1	308.382	1.650	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc(-c3c[nH]c([N+](=O)[O-])c3)n2C)C[C@H]1C	ZINC001338461282	869990670	/nfs/dbraw/zinc/99/06/70/869990670.db2.gz	KXYDTMACCSGZMN-SNVBAGLBSA-N	1	1	319.369	1.249	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001303799175	871155540	/nfs/dbraw/zinc/15/55/40/871155540.db2.gz	DHFCYMBXQYIYGB-CABZTGNLSA-N	1	1	311.769	2.000	20	5		DDBDMO
Cc1noc(C[NH2+][C@@H]2CCO[C@H]2c2ccc(=O)[nH]c2)c1[N+](=O)[O-]	ZINC001307992686	871461662	/nfs/dbraw/zinc/46/16/62/871461662.db2.gz	MMXUQQZNPQUSKI-YGRLFVJLSA-N	1	1	320.305	1.612	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C(=O)N(C)C)C1	ZINC001308108818	871471986	/nfs/dbraw/zinc/47/19/86/871471986.db2.gz	MKFPHSMQZMAEDC-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@]23CCCOC3)c1	ZINC001308171584	871478143	/nfs/dbraw/zinc/47/81/43/871478143.db2.gz	VKCLWKIADIORFB-HUUCEWRRSA-N	1	1	324.381	1.187	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC001343401438	872610819	/nfs/dbraw/zinc/61/08/19/872610819.db2.gz	UIFPXGPEYQBEJQ-MEDUHNTESA-N	1	1	318.377	1.660	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1N(C)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC001345464656	873412652	/nfs/dbraw/zinc/41/26/52/873412652.db2.gz	AJSKPXZKMPDTEP-GZBFAFLISA-N	1	1	307.350	1.405	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC001350606268	875782180	/nfs/dbraw/zinc/78/21/80/875782180.db2.gz	RJITZYHAESPYMA-LLVKDONJSA-N	1	1	307.354	1.783	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000175249149	875871194	/nfs/dbraw/zinc/87/11/94/875871194.db2.gz	IVONJECVJHBZHT-ZDUSSCGKSA-N	1	1	321.377	1.951	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@@H]2C1	ZINC001353381044	877289873	/nfs/dbraw/zinc/28/98/73/877289873.db2.gz	VCZPPKUIGIVHSD-SCRDCRAPSA-N	1	1	321.352	1.733	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C(C)(C)C1	ZINC001472059017	877631619	/nfs/dbraw/zinc/63/16/19/877631619.db2.gz	RQPYGYMVEUITRT-CYBMUJFWSA-N	1	1	306.366	1.637	20	5		DDBDMO
O=[N+]([O-])c1c[n+]([O-])ccc1O[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC001229454844	883993086	/nfs/dbraw/zinc/99/30/86/883993086.db2.gz	RGEWWXDICQYJOG-CQSZACIVSA-N	1	1	315.329	1.882	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(CO)[C@H](O)C1	ZINC001254553294	896499357	/nfs/dbraw/zinc/49/93/57/896499357.db2.gz	UQIKMOKMRJMVPR-DAXOMENPSA-N	1	1	308.378	1.591	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CCCC2CCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001263832679	900748565	/nfs/dbraw/zinc/74/85/65/900748565.db2.gz	VQQCGXSPGNDHQI-LXTVHRRPSA-N	1	1	309.410	1.716	20	5		DDBDMO
C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCc1ccccc1F	ZINC001265844992	902482184	/nfs/dbraw/zinc/48/21/84/902482184.db2.gz	ABXCKNYPVHOZQI-UKRRQHHQSA-N	1	1	323.368	1.472	20	5		DDBDMO
C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CCc1ccccc1F	ZINC001265844992	902482191	/nfs/dbraw/zinc/48/21/91/902482191.db2.gz	ABXCKNYPVHOZQI-UKRRQHHQSA-N	1	1	323.368	1.472	20	5		DDBDMO
C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CCc1ccccc1F	ZINC001265844992	902482197	/nfs/dbraw/zinc/48/21/97/902482197.db2.gz	ABXCKNYPVHOZQI-UKRRQHHQSA-N	1	1	323.368	1.472	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000249008425	282127171	/nfs/dbraw/zinc/12/71/71/282127171.db2.gz	ZWDVSFFSCBOUHW-MFKMUULPSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000249008425	282127174	/nfs/dbraw/zinc/12/71/74/282127174.db2.gz	ZWDVSFFSCBOUHW-MFKMUULPSA-N	1	1	323.349	1.245	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCC2	ZINC000451864617	231216053	/nfs/dbraw/zinc/21/60/53/231216053.db2.gz	ZXEVRKUAACTEAM-KGLIPLIRSA-N	1	1	321.377	1.646	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000452106356	231303574	/nfs/dbraw/zinc/30/35/74/231303574.db2.gz	ZZRYPORAAGHOSH-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000452106356	231303576	/nfs/dbraw/zinc/30/35/76/231303576.db2.gz	ZZRYPORAAGHOSH-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2CCCC[N@H+]2CCO)cccc1[N+](=O)[O-]	ZINC000452391797	231375688	/nfs/dbraw/zinc/37/56/88/231375688.db2.gz	QKEFCNSDQXJTLT-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1cccc(NCCNc2ncc([N+](=O)[O-])cc2C(N)=O)[nH+]1	ZINC000358193592	299097193	/nfs/dbraw/zinc/09/71/93/299097193.db2.gz	NGABRHCCBLSULB-UHFFFAOYSA-N	1	1	316.321	1.316	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nccc2ccc([N+](=O)[O-])cc21	ZINC000413149590	530070272	/nfs/dbraw/zinc/07/02/72/530070272.db2.gz	VAHCVMPHWOXKCH-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413149590	530070274	/nfs/dbraw/zinc/07/02/74/530070274.db2.gz	VAHCVMPHWOXKCH-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413149590	530070275	/nfs/dbraw/zinc/07/02/75/530070275.db2.gz	VAHCVMPHWOXKCH-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=[N+]([O-])c1nn(CCC[NH+]2CCOCC2)cc1Br	ZINC000330767476	232053748	/nfs/dbraw/zinc/05/37/48/232053748.db2.gz	WMQRTTWZWHMBMM-UHFFFAOYSA-N	1	1	319.159	1.276	20	5		DDBDMO
C[C@H](O)C[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000279677537	215053119	/nfs/dbraw/zinc/05/31/19/215053119.db2.gz	DZPJWMIDIFDAMA-SMDDNHRTSA-N	1	1	321.377	1.819	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)C[NH+]1CCOCC1	ZINC000150726838	186060843	/nfs/dbraw/zinc/06/08/43/186060843.db2.gz	PYXIQNHBHHSKTL-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C1CC1	ZINC000063116542	352905632	/nfs/dbraw/zinc/90/56/32/352905632.db2.gz	JHXUXSDRPXVHBT-UHFFFAOYSA-N	1	1	302.334	1.900	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000069137843	353147318	/nfs/dbraw/zinc/14/73/18/353147318.db2.gz	TUBMIAMPHDXFNI-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[C@@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000173868688	198261717	/nfs/dbraw/zinc/26/17/17/198261717.db2.gz	JNSJNBKBZXSGJD-ZDUSSCGKSA-N	1	1	321.377	1.222	20	5		DDBDMO
CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@H]1CCC[N@@H+](C)C1	ZINC000182168394	199397230	/nfs/dbraw/zinc/39/72/30/199397230.db2.gz	YXIUUOMAPFVKPA-NSHDSACASA-N	1	1	321.333	1.490	20	5		DDBDMO
Cc1cc(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)ncc1[N+](=O)[O-]	ZINC000090146575	353791232	/nfs/dbraw/zinc/79/12/32/353791232.db2.gz	FUZISWZFDOCUMR-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)ncc1[N+](=O)[O-]	ZINC000090146575	353791234	/nfs/dbraw/zinc/79/12/34/353791234.db2.gz	FUZISWZFDOCUMR-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(S(=O)(=O)NCC[NH+]2CCCC2)c([N+](=O)[O-])s1	ZINC000601292968	358481303	/nfs/dbraw/zinc/48/13/03/358481303.db2.gz	ZSABKFTUYRYQAA-UHFFFAOYSA-N	1	1	319.408	1.339	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369706	354224385	/nfs/dbraw/zinc/22/43/85/354224385.db2.gz	LVHPFGXRKVIJEU-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369706	354224388	/nfs/dbraw/zinc/22/43/88/354224388.db2.gz	LVHPFGXRKVIJEU-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000278830125	354416037	/nfs/dbraw/zinc/41/60/37/354416037.db2.gz	IFWVELFHWDNLFG-MRXNPFEDSA-N	1	1	319.361	1.576	20	5		DDBDMO
C[NH+](C)C1(CS(=O)(=O)NCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000601310201	358490172	/nfs/dbraw/zinc/49/01/72/358490172.db2.gz	NJVQXCANQTWBCI-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H]2OCC[N@@H+](C)[C@@H]2C1	ZINC000588838637	354940998	/nfs/dbraw/zinc/94/09/98/354940998.db2.gz	XHSOQWCGNKXCOZ-NEPJUHHUSA-N	1	1	309.370	1.029	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1	ZINC000590377837	355078364	/nfs/dbraw/zinc/07/83/64/355078364.db2.gz	YVXHXVRGULUMKS-TXEJJXNPSA-N	1	1	321.377	1.906	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000590141912	355053239	/nfs/dbraw/zinc/05/32/39/355053239.db2.gz	JDIWNYZSVIIZLW-OAHLLOKOSA-N	1	1	307.398	1.813	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC(C[NH+]2CCOCC2)C1	ZINC000590558066	355114155	/nfs/dbraw/zinc/11/41/55/355114155.db2.gz	MZCGNVLWLICBSA-UHFFFAOYSA-N	1	1	323.324	1.138	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000590446354	355099800	/nfs/dbraw/zinc/09/98/00/355099800.db2.gz	UTPAZNMRFOSNOL-RISCZKNCSA-N	1	1	321.402	1.849	20	5		DDBDMO
C[C@@H]1CC2(C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CCOCC2	ZINC000592183078	355527504	/nfs/dbraw/zinc/52/75/04/355527504.db2.gz	QZAUSFSTTUEVCZ-TZMCWYRMSA-N	1	1	324.381	1.043	20	5		DDBDMO
CCOc1cc(C[N@@H+]2C[C@H](O)C[C@@H]2COC)ccc1[N+](=O)[O-]	ZINC000593067654	355785447	/nfs/dbraw/zinc/78/54/47/355785447.db2.gz	YGGCIHJJHWHZGH-CHWSQXEVSA-N	1	1	310.350	1.575	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](O)C[C@@H]2COC)ccc1[N+](=O)[O-]	ZINC000593067654	355785450	/nfs/dbraw/zinc/78/54/50/355785450.db2.gz	YGGCIHJJHWHZGH-CHWSQXEVSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593392999	355871390	/nfs/dbraw/zinc/87/13/90/355871390.db2.gz	XNIDTGJGLDMQFM-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c2ncccc12	ZINC000593507855	355908326	/nfs/dbraw/zinc/90/83/26/355908326.db2.gz	NMQWAGLCNFKZPB-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1	ZINC000594056509	356101572	/nfs/dbraw/zinc/10/15/72/356101572.db2.gz	WJQQRSWUGZKUAB-SNVBAGLBSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1	ZINC000594056509	356101576	/nfs/dbraw/zinc/10/15/76/356101576.db2.gz	WJQQRSWUGZKUAB-SNVBAGLBSA-N	1	1	318.333	1.990	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594198110	356137120	/nfs/dbraw/zinc/13/71/20/356137120.db2.gz	CXFPOGWXZNSHNF-KGLIPLIRSA-N	1	1	321.381	1.315	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000594731223	356299981	/nfs/dbraw/zinc/29/99/81/356299981.db2.gz	GUAJIIITSFZYDI-LBPRGKRZSA-N	1	1	319.365	1.554	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@]1(O)CC[N@@H+](C)C1	ZINC000595032294	356374395	/nfs/dbraw/zinc/37/43/95/356374395.db2.gz	MCVGCLPUDOIYEC-XHDPSFHLSA-N	1	1	309.366	1.321	20	5		DDBDMO
CCOCC[NH+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000595306716	356442917	/nfs/dbraw/zinc/44/29/17/356442917.db2.gz	WHJUOZHZDYTRSP-UHFFFAOYSA-N	1	1	311.357	1.888	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421669	356485839	/nfs/dbraw/zinc/48/58/39/356485839.db2.gz	AHJRNGNZACRKRO-BETUJISGSA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421669	356485840	/nfs/dbraw/zinc/48/58/40/356485840.db2.gz	AHJRNGNZACRKRO-BETUJISGSA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421669	356485843	/nfs/dbraw/zinc/48/58/43/356485843.db2.gz	AHJRNGNZACRKRO-BETUJISGSA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421669	356485847	/nfs/dbraw/zinc/48/58/47/356485847.db2.gz	AHJRNGNZACRKRO-BETUJISGSA-N	1	1	320.393	1.457	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1	ZINC000595608710	356574976	/nfs/dbraw/zinc/57/49/76/356574976.db2.gz	UJQLQTQYOJDKOQ-CQSZACIVSA-N	1	1	301.350	1.751	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595762099	356641879	/nfs/dbraw/zinc/64/18/79/356641879.db2.gz	ZYDPHSWCRAVKSJ-BLLLJJGKSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595762099	356641880	/nfs/dbraw/zinc/64/18/80/356641880.db2.gz	ZYDPHSWCRAVKSJ-BLLLJJGKSA-N	1	1	319.361	1.810	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000595824915	356664508	/nfs/dbraw/zinc/66/45/08/356664508.db2.gz	AELLCGSNQNJQGK-AWEZNQCLSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000595824915	356664511	/nfs/dbraw/zinc/66/45/11/356664511.db2.gz	AELLCGSNQNJQGK-AWEZNQCLSA-N	1	1	306.366	1.783	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000595828451	356666825	/nfs/dbraw/zinc/66/68/25/356666825.db2.gz	FASTVKPTQAMWQI-CHWSQXEVSA-N	1	1	305.334	1.162	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000595872680	356687368	/nfs/dbraw/zinc/68/73/68/356687368.db2.gz	KQFWZSHIPVPKLP-LRDDRELGSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000595872680	356687372	/nfs/dbraw/zinc/68/73/72/356687372.db2.gz	KQFWZSHIPVPKLP-LRDDRELGSA-N	1	1	321.377	1.508	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c1	ZINC000595860917	356681227	/nfs/dbraw/zinc/68/12/27/356681227.db2.gz	NBEQAVFLSDIWMR-BDJLRTHQSA-N	1	1	322.361	1.832	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])c1	ZINC000595872663	356686855	/nfs/dbraw/zinc/68/68/55/356686855.db2.gz	KLOYHUHEBMQXKW-LRDDRELGSA-N	1	1	324.377	1.933	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596537466	356910348	/nfs/dbraw/zinc/91/03/48/356910348.db2.gz	GRLYCYZYOPBORJ-CYBMUJFWSA-N	1	1	309.341	1.769	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598646910	357668787	/nfs/dbraw/zinc/66/87/87/357668787.db2.gz	AVPAXNZJYHFJBK-GXFFZTMASA-N	1	1	307.350	1.144	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[N@@H+]1CC[C@H](O)C1	ZINC000599093322	357813369	/nfs/dbraw/zinc/81/33/69/357813369.db2.gz	ORZYPVSBWGZMAV-YPMHNXCESA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[N@H+]1CC[C@H](O)C1	ZINC000599093322	357813372	/nfs/dbraw/zinc/81/33/72/357813372.db2.gz	ORZYPVSBWGZMAV-YPMHNXCESA-N	1	1	309.366	1.321	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1(C)COC1	ZINC000599571382	357979762	/nfs/dbraw/zinc/97/97/62/357979762.db2.gz	FKOPQXVNNJPGOC-UHFFFAOYSA-N	1	1	319.361	1.452	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1(C)COC1	ZINC000599571382	357979765	/nfs/dbraw/zinc/97/97/65/357979765.db2.gz	FKOPQXVNNJPGOC-UHFFFAOYSA-N	1	1	319.361	1.452	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000600315468	358194583	/nfs/dbraw/zinc/19/45/83/358194583.db2.gz	TVRDUTYDWMIBLM-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
CC[N@H+](CCN)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000600717863	358293495	/nfs/dbraw/zinc/29/34/95/358293495.db2.gz	SSEYIIIQCOXSCB-UHFFFAOYSA-N	1	1	310.354	1.213	20	5		DDBDMO
CC[N@@H+](CCN)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000600717863	358293501	/nfs/dbraw/zinc/29/35/01/358293501.db2.gz	SSEYIIIQCOXSCB-UHFFFAOYSA-N	1	1	310.354	1.213	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000600693791	358285086	/nfs/dbraw/zinc/28/50/86/358285086.db2.gz	RQLGJUXIEXLIDA-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CN1CCOC[C@H]1CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601203504	358446227	/nfs/dbraw/zinc/44/62/27/358446227.db2.gz	RRNBGNZLDLWQAH-GFCCVEGCSA-N	1	1	302.334	1.307	20	5		DDBDMO
O=C1NC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CCN12	ZINC000601125524	358412504	/nfs/dbraw/zinc/41/25/04/358412504.db2.gz	HQYMPIZVHSIYAC-NSHDSACASA-N	1	1	313.317	1.357	20	5		DDBDMO
Cn1cc(C[NH2+][C@H](CCCO)c2ccccc2)c([N+](=O)[O-])n1	ZINC000602550950	359040532	/nfs/dbraw/zinc/04/05/32/359040532.db2.gz	GBHSAABTWIPAPY-CQSZACIVSA-N	1	1	304.350	1.932	20	5		DDBDMO
Cn1cc(C[N@H+](C)[C@@H](CCO)c2ccccc2)c([N+](=O)[O-])n1	ZINC000602469222	358999589	/nfs/dbraw/zinc/99/95/89/358999589.db2.gz	CCAIRXUVDGXJEG-AWEZNQCLSA-N	1	1	304.350	1.884	20	5		DDBDMO
Cn1cc(C[N@@H+](C)[C@@H](CCO)c2ccccc2)c([N+](=O)[O-])n1	ZINC000602469222	358999591	/nfs/dbraw/zinc/99/95/91/358999591.db2.gz	CCAIRXUVDGXJEG-AWEZNQCLSA-N	1	1	304.350	1.884	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c([N+](=O)[O-])n1	ZINC000602664762	359111196	/nfs/dbraw/zinc/11/11/96/359111196.db2.gz	VEFRMBUKOUCIEN-LLVKDONJSA-N	1	1	322.287	1.608	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c([N+](=O)[O-])n1	ZINC000602664762	359111197	/nfs/dbraw/zinc/11/11/97/359111197.db2.gz	VEFRMBUKOUCIEN-LLVKDONJSA-N	1	1	322.287	1.608	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](N2CCCC2=O)C1	ZINC000602780653	359186308	/nfs/dbraw/zinc/18/63/08/359186308.db2.gz	BHBWLTQHYLKEFO-ZDUSSCGKSA-N	1	1	321.381	1.187	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCc2c(cnn2C)C1	ZINC000602841042	359229866	/nfs/dbraw/zinc/22/98/66/359229866.db2.gz	QLKRTDMUCPJKRR-UHFFFAOYSA-N	1	1	304.354	1.282	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](c2cccnc2)C1	ZINC000602851496	359238356	/nfs/dbraw/zinc/23/83/56/359238356.db2.gz	KRRFVMFIYYBNJR-AWEZNQCLSA-N	1	1	301.350	1.984	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1	ZINC000602796887	359198811	/nfs/dbraw/zinc/19/88/11/359198811.db2.gz	ALCHBFJFLALGSF-UONOGXRCSA-N	1	1	308.382	1.848	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C[C@@]1(C)C(=O)NC2=O	ZINC000602934739	359304280	/nfs/dbraw/zinc/30/42/80/359304280.db2.gz	JHJRYDDKHIYJOY-GASCZTMLSA-N	1	1	321.308	1.219	20	5		DDBDMO
C[C@H]1CC[C@](CO)([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000187982218	200186657	/nfs/dbraw/zinc/18/66/57/200186657.db2.gz	VYNUQHZYQBGADJ-ZBEGNZNMSA-N	1	1	321.377	1.677	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCCO)C1CC1	ZINC000610132934	360384920	/nfs/dbraw/zinc/38/49/20/360384920.db2.gz	HKCYCIGMCVFJSJ-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCCO)C1CC1	ZINC000610132934	360384923	/nfs/dbraw/zinc/38/49/23/360384923.db2.gz	HKCYCIGMCVFJSJ-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[NH+]1CCN(CC(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000610637328	360487614	/nfs/dbraw/zinc/48/76/14/360487614.db2.gz	YDWOZAIVWTVWPD-UHFFFAOYSA-N	1	1	320.393	1.194	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1C	ZINC000611091852	360620932	/nfs/dbraw/zinc/62/09/32/360620932.db2.gz	AFNPTAZZDAAUEG-LBPRGKRZSA-N	1	1	321.377	1.987	20	5		DDBDMO
CO[C@H]1CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611258806	360681592	/nfs/dbraw/zinc/68/15/92/360681592.db2.gz	OOSOTWZSHYFJNR-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611258806	360681595	/nfs/dbraw/zinc/68/15/95/360681595.db2.gz	OOSOTWZSHYFJNR-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1C	ZINC000611271193	360685936	/nfs/dbraw/zinc/68/59/36/360685936.db2.gz	UQVLJTFLXLWSBS-GFCCVEGCSA-N	1	1	321.377	1.892	20	5		DDBDMO
Cc1cc(C[NH2+]CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000612591567	361075786	/nfs/dbraw/zinc/07/57/86/361075786.db2.gz	AHNJEDJCIUWXME-UHFFFAOYSA-N	1	1	324.362	1.190	20	5		DDBDMO
COc1cc(C[NH2+][C@@H]2C(=O)NCC[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000193651837	201096318	/nfs/dbraw/zinc/09/63/18/201096318.db2.gz	XMFHCHKRELALFN-SDBXPKJASA-N	1	1	311.313	1.357	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000349876667	284090349	/nfs/dbraw/zinc/09/03/49/284090349.db2.gz	RERGZJGAGNXRDF-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
Nc1c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc(F)cc1[N+](=O)[O-]	ZINC000264667574	204064503	/nfs/dbraw/zinc/06/45/03/204064503.db2.gz	VMABBIJFNMVYTN-SECBINFHSA-N	1	1	322.340	1.530	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)c1ccc([N+](=O)[O-])cc1F	ZINC000264777048	204149042	/nfs/dbraw/zinc/14/90/42/204149042.db2.gz	HQHXVRCALMUQBH-UHFFFAOYSA-N	1	1	313.354	1.513	20	5		DDBDMO
COCCCNC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338383397	249937816	/nfs/dbraw/zinc/93/78/16/249937816.db2.gz	RGMVDNZMULMPLJ-ZDUSSCGKSA-N	1	1	323.393	1.610	20	5		DDBDMO
O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1ccccc1[N+](=O)[O-]	ZINC000352034073	284726894	/nfs/dbraw/zinc/72/68/94/284726894.db2.gz	XZRCCJBHIWOHQQ-GFCCVEGCSA-N	1	1	321.358	1.918	20	5		DDBDMO
COc1cc(C[N@@H+](CCOCCO)C(C)C)ccc1[N+](=O)[O-]	ZINC000338590856	250044983	/nfs/dbraw/zinc/04/49/83/250044983.db2.gz	FOQRXVIFCADKKO-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
CC(C)(C)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(N)=O	ZINC000109329985	194257766	/nfs/dbraw/zinc/25/77/66/194257766.db2.gz	NRTVXNFPFOWRNS-ZDUSSCGKSA-N	1	1	323.349	1.451	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000110695933	194350245	/nfs/dbraw/zinc/35/02/45/194350245.db2.gz	UBRFXKAASZQNPM-MRVPVSSYSA-N	1	1	312.757	1.607	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000110695933	194350247	/nfs/dbraw/zinc/35/02/47/194350247.db2.gz	UBRFXKAASZQNPM-MRVPVSSYSA-N	1	1	312.757	1.607	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000340921167	251277536	/nfs/dbraw/zinc/27/75/36/251277536.db2.gz	XLEBANITEIXGNR-JQWIXIFHSA-N	1	1	321.333	1.348	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](CCO)CC2CC2)cccc1[N+](=O)[O-]	ZINC000352467717	285072066	/nfs/dbraw/zinc/07/20/66/285072066.db2.gz	NAEDKTIKRMRDQN-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC=C(C(F)(F)F)CC2)c1	ZINC000270158589	208218307	/nfs/dbraw/zinc/21/83/07/208218307.db2.gz	ICQMSCSCKCBVID-LLVKDONJSA-N	1	1	320.271	1.347	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000352546495	285131345	/nfs/dbraw/zinc/13/13/45/285131345.db2.gz	WCQCUGSKJXQUIW-OAHLLOKOSA-N	1	1	308.334	1.988	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC2(CCOCC2)C1	ZINC000270613916	285221276	/nfs/dbraw/zinc/22/12/76/285221276.db2.gz	ZXSKSFPVXZMHFH-UHFFFAOYSA-N	1	1	321.377	1.649	20	5		DDBDMO
CCN(C)C(=O)CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352707786	285244028	/nfs/dbraw/zinc/24/40/28/285244028.db2.gz	SUIWKOXZFGRMRA-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
CCN(C)C(=O)CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352707786	285244034	/nfs/dbraw/zinc/24/40/34/285244034.db2.gz	SUIWKOXZFGRMRA-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
COCCCNC(=O)[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000271646964	209092312	/nfs/dbraw/zinc/09/23/12/209092312.db2.gz	TYLHWYRXVLBWPM-NEPJUHHUSA-N	1	1	309.366	1.787	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC[N@@H+](C)C1CC1	ZINC000352741082	285268405	/nfs/dbraw/zinc/26/84/05/285268405.db2.gz	VRLZVCBUIMTQJZ-UHFFFAOYSA-N	1	1	306.366	1.830	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000352820993	285320774	/nfs/dbraw/zinc/32/07/74/285320774.db2.gz	RPDFTKVLHXIVLU-NXEZZACHSA-N	1	1	309.370	1.477	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc(C)cc([N+](=O)[O-])c1	ZINC000122022324	195392250	/nfs/dbraw/zinc/39/22/50/195392250.db2.gz	NSSGADMKGDNZRH-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
COc1cccc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000444366718	533415337	/nfs/dbraw/zinc/41/53/37/533415337.db2.gz	YBHCDAWBFGPAFJ-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
C[C@@H](O)CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000353520548	285781742	/nfs/dbraw/zinc/78/17/42/285781742.db2.gz	PMLJMNZEVFRHLV-RISCZKNCSA-N	1	1	304.350	1.778	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000068127849	406618071	/nfs/dbraw/zinc/61/80/71/406618071.db2.gz	PXQVEQBGPKIUSP-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)C2	ZINC000073993006	406900052	/nfs/dbraw/zinc/90/00/52/406900052.db2.gz	USSRZZIUZHQKMZ-GXTWGEPZSA-N	1	1	319.361	1.669	20	5		DDBDMO
CC(C)[N@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000078681728	407041446	/nfs/dbraw/zinc/04/14/46/407041446.db2.gz	IHEXAJSSWIGTTP-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000078681728	407041448	/nfs/dbraw/zinc/04/14/48/407041448.db2.gz	IHEXAJSSWIGTTP-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1nn(C)c(NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000051649966	407142999	/nfs/dbraw/zinc/14/29/99/407142999.db2.gz	SVILUDKIEIQYDL-PHIMTYICSA-N	1	1	311.386	1.548	20	5		DDBDMO
CCNC(=O)C[N@@H+](CC)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000055901130	407207845	/nfs/dbraw/zinc/20/78/45/407207845.db2.gz	NAZPSFBTOTYNKP-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
[NH3+][C@@H]1CCCC[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000123282182	407324361	/nfs/dbraw/zinc/32/43/61/407324361.db2.gz	MQGXZMJDOWPCJS-NXEZZACHSA-N	1	1	317.342	1.282	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@H](C)C[S@](C)=O)cc1[N+](=O)[O-]	ZINC000126103154	407405637	/nfs/dbraw/zinc/40/56/37/407405637.db2.gz	GQJZUEIPCGIYDZ-CFMSYZGJSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H](C)C[S@](C)=O)cc1[N+](=O)[O-]	ZINC000126103154	407405639	/nfs/dbraw/zinc/40/56/39/407405639.db2.gz	GQJZUEIPCGIYDZ-CFMSYZGJSA-N	1	1	300.380	1.802	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c1	ZINC000111321319	407407370	/nfs/dbraw/zinc/40/73/70/407407370.db2.gz	HUAFIPJOXJLXGC-BNGAQMRFSA-N	1	1	322.361	1.322	20	5		DDBDMO
NC(=O)N1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000111688649	407415217	/nfs/dbraw/zinc/41/52/17/407415217.db2.gz	VUBHOAQRWKDUMT-UHFFFAOYSA-N	1	1	322.365	1.450	20	5		DDBDMO
C[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1)[NH+]1CCSCC1	ZINC000151784052	407498240	/nfs/dbraw/zinc/49/82/40/407498240.db2.gz	FSJVKZHXWPCJKR-NSHDSACASA-N	1	1	309.391	1.648	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000170768231	407500022	/nfs/dbraw/zinc/50/00/22/407500022.db2.gz	OWUCDDOSKZKTFU-JSGCOSHPSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271177869	407555686	/nfs/dbraw/zinc/55/56/86/407555686.db2.gz	YEXPEKQAYFVDTO-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
CC[C@@H]1CN(c2ncc(C)cc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000266225987	407535347	/nfs/dbraw/zinc/53/53/47/407535347.db2.gz	RODHGCRBOYKLJS-QWHCGFSZSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](CO)C1	ZINC000260675607	407538065	/nfs/dbraw/zinc/53/80/65/407538065.db2.gz	YBGFALMGHNWEKR-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](CO)C1	ZINC000260675607	407538071	/nfs/dbraw/zinc/53/80/71/407538071.db2.gz	YBGFALMGHNWEKR-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
CC(C)N(CC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000151967961	407538394	/nfs/dbraw/zinc/53/83/94/407538394.db2.gz	OTQRHXBOUXIMCQ-UHFFFAOYSA-N	1	1	319.365	1.883	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2[C@@H](O)C(F)(F)F)c1	ZINC000266907310	407671737	/nfs/dbraw/zinc/67/17/37/407671737.db2.gz	BOLNDTIPIMBBNL-VHSXEESVSA-N	1	1	308.260	1.179	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271411915	407673409	/nfs/dbraw/zinc/67/34/09/407673409.db2.gz	YZAFYWMULBOCTJ-HNNXBMFYSA-N	1	1	302.334	1.593	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000115433359	407679195	/nfs/dbraw/zinc/67/91/95/407679195.db2.gz	SPZKTZXODZYNCI-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
C[C@@]1(O)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000267168583	407774826	/nfs/dbraw/zinc/77/48/26/407774826.db2.gz	ACNJRGXWGMOMCJ-CYBMUJFWSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000267168583	407774831	/nfs/dbraw/zinc/77/48/31/407774831.db2.gz	ACNJRGXWGMOMCJ-CYBMUJFWSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+]1CCCN(c2ncc([N+](=O)[O-])cc2Br)CC1	ZINC000267191656	407783361	/nfs/dbraw/zinc/78/33/61/407783361.db2.gz	DKBROJNPYTWPBZ-UHFFFAOYSA-N	1	1	315.171	1.894	20	5		DDBDMO
C[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2Br)CC1	ZINC000267191656	407783364	/nfs/dbraw/zinc/78/33/64/407783364.db2.gz	DKBROJNPYTWPBZ-UHFFFAOYSA-N	1	1	315.171	1.894	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)c1ccco1	ZINC000180496376	407894649	/nfs/dbraw/zinc/89/46/49/407894649.db2.gz	LPLGXFAECPPLJR-LLVKDONJSA-N	1	1	319.321	1.198	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000268233465	407961340	/nfs/dbraw/zinc/96/13/40/407961340.db2.gz	SPFXCJDDDMBGAL-SMDDNHRTSA-N	1	1	318.377	1.606	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccccc1	ZINC000245419090	407969970	/nfs/dbraw/zinc/96/99/70/407969970.db2.gz	GWEXASAPDQAIKV-DAXOMENPSA-N	1	1	316.361	1.845	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000268177649	407930567	/nfs/dbraw/zinc/93/05/67/407930567.db2.gz	KWSHIZRJLPPIEF-ABAIWWIYSA-N	1	1	319.361	1.573	20	5		DDBDMO
CC[C@]1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000135700810	408049158	/nfs/dbraw/zinc/04/91/58/408049158.db2.gz	WGWXTUYPBZTOOJ-XJKSGUPXSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000135700810	408049165	/nfs/dbraw/zinc/04/91/65/408049165.db2.gz	WGWXTUYPBZTOOJ-XJKSGUPXSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000136089224	408075423	/nfs/dbraw/zinc/07/54/23/408075423.db2.gz	WMRPGBCLQAPHNP-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@H]1CCCC[N@@H+]1CCCCNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000136089224	408075429	/nfs/dbraw/zinc/07/54/29/408075429.db2.gz	WMRPGBCLQAPHNP-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000136089224	408075436	/nfs/dbraw/zinc/07/54/36/408075436.db2.gz	WMRPGBCLQAPHNP-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC1(O)CCOCC1	ZINC000189786767	408107930	/nfs/dbraw/zinc/10/79/30/408107930.db2.gz	RIQXNXKCGRRDPE-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CCN1CC[NH+](C[C@H](C)CNc2ncc([N+](=O)[O-])cn2)CC1	ZINC000273587491	408257073	/nfs/dbraw/zinc/25/70/73/408257073.db2.gz	GTGAEZVOYRTFHY-GFCCVEGCSA-N	1	1	308.386	1.070	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H]1CO	ZINC000190348810	408225391	/nfs/dbraw/zinc/22/53/91/408225391.db2.gz	KMNGYYFUMPTGDA-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)n1	ZINC000246518874	408279738	/nfs/dbraw/zinc/27/97/38/408279738.db2.gz	IPUKQCNMPHFQGS-ZFWWWQNUSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)n1	ZINC000246518874	408279777	/nfs/dbraw/zinc/27/97/77/408279777.db2.gz	IPUKQCNMPHFQGS-ZFWWWQNUSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H]3[C@@H](CCCN3C3CC3)C2)n1	ZINC000246518874	408279782	/nfs/dbraw/zinc/27/97/82/408279782.db2.gz	IPUKQCNMPHFQGS-ZFWWWQNUSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@H]2C[NH+]3CCN2CC3)c2ncccc12	ZINC000269496672	408331643	/nfs/dbraw/zinc/33/16/43/408331643.db2.gz	PCKFJKCJIOOHMP-LBPRGKRZSA-N	1	1	313.361	1.555	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000176086449	408283519	/nfs/dbraw/zinc/28/35/19/408283519.db2.gz	VQQQHQIITQYYLO-JTQLQIEISA-N	1	1	308.338	1.109	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1	ZINC000269399817	408296114	/nfs/dbraw/zinc/29/61/14/408296114.db2.gz	URUFPLWWCPLIHL-SNVBAGLBSA-N	1	1	300.746	1.776	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000269406731	408296545	/nfs/dbraw/zinc/29/65/45/408296545.db2.gz	UPQBLPBJSMJJBC-SNVBAGLBSA-N	1	1	321.381	1.655	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)n1	ZINC000191627767	408458471	/nfs/dbraw/zinc/45/84/71/408458471.db2.gz	HQZPCCQHNFPMGY-LLVKDONJSA-N	1	1	309.370	1.223	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)n1	ZINC000191627767	408458477	/nfs/dbraw/zinc/45/84/77/408458477.db2.gz	HQZPCCQHNFPMGY-LLVKDONJSA-N	1	1	309.370	1.223	20	5		DDBDMO
C[C@@H]1CC(O)C[C@H](C)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000191258727	408394107	/nfs/dbraw/zinc/39/41/07/408394107.db2.gz	COLOPABOEDCHGX-ODOQXGPZSA-N	1	1	321.377	1.791	20	5		DDBDMO
C[C@@H]1CC(O)C[C@H](C)[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000191258727	408394110	/nfs/dbraw/zinc/39/41/10/408394110.db2.gz	COLOPABOEDCHGX-ODOQXGPZSA-N	1	1	321.377	1.791	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000159445907	408407597	/nfs/dbraw/zinc/40/75/97/408407597.db2.gz	JEZKNLTWQLCCKI-UWVGGRQHSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000159445907	408407600	/nfs/dbraw/zinc/40/76/00/408407600.db2.gz	JEZKNLTWQLCCKI-UWVGGRQHSA-N	1	1	311.338	1.243	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000274472955	408420247	/nfs/dbraw/zinc/42/02/47/408420247.db2.gz	LMBIUZJERMMEHH-CYBMUJFWSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000247534428	408490090	/nfs/dbraw/zinc/49/00/90/408490090.db2.gz	XNRBTZVELILIHX-JQWIXIFHSA-N	1	1	306.366	1.853	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000264499658	408514562	/nfs/dbraw/zinc/51/45/62/408514562.db2.gz	KDWHRFQFTOVDNU-SNVBAGLBSA-N	1	1	311.313	1.184	20	5		DDBDMO
Cc1cc(NC(=O)NC[C@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000274861413	408559065	/nfs/dbraw/zinc/55/90/65/408559065.db2.gz	ZDQBSRZCUHXKPS-ZDUSSCGKSA-N	1	1	321.381	1.271	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCC[C@@H](C)C1	ZINC000248438758	408566667	/nfs/dbraw/zinc/56/66/67/408566667.db2.gz	TWUVZLYIPOEJHV-GHMZBOCLSA-N	1	1	321.381	1.422	20	5		DDBDMO
COc1cc(C[NH2+][C@@H](C(N)=O)C(C)(C)C)c([N+](=O)[O-])cc1F	ZINC000184255777	408578924	/nfs/dbraw/zinc/57/89/24/408578924.db2.gz	DZDMIVYSYIFENA-LBPRGKRZSA-N	1	1	313.329	1.732	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1O	ZINC000275544145	408595376	/nfs/dbraw/zinc/59/53/76/408595376.db2.gz	ZLRIYRBXYMLJQS-UKRRQHHQSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1O	ZINC000275544134	408596634	/nfs/dbraw/zinc/59/66/34/408596634.db2.gz	ZLRIYRBXYMLJQS-DZGCQCFKSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cn1cc([C@@H]2C[NH2+]CCN2C(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000181389842	162789982	/nfs/dbraw/zinc/78/99/82/162789982.db2.gz	RKKWXNARCDVBRN-AWEZNQCLSA-N	1	1	315.333	1.115	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000249109920	408690951	/nfs/dbraw/zinc/69/09/51/408690951.db2.gz	AZZNSTXUYBMNIT-JQWIXIFHSA-N	1	1	322.365	1.498	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000249109918	408691368	/nfs/dbraw/zinc/69/13/68/408691368.db2.gz	AZZNSTXUYBMNIT-CMPLNLGQSA-N	1	1	322.365	1.498	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NCC[N@@H+](C)Cc1ccccc1	ZINC000163595912	408782559	/nfs/dbraw/zinc/78/25/59/408782559.db2.gz	RMRCDAFBKKHYEU-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
NS(=O)(=O)CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000178001530	408754654	/nfs/dbraw/zinc/75/46/54/408754654.db2.gz	GEVVBCFZQJPLAM-UHFFFAOYSA-N	1	1	313.379	1.238	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@](C)(O)C1	ZINC000178003520	408754898	/nfs/dbraw/zinc/75/48/98/408754898.db2.gz	KRZAXVZVOADKEB-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000251477744	408781355	/nfs/dbraw/zinc/78/13/55/408781355.db2.gz	CTDNJNKHJHUNAT-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000251477744	408781358	/nfs/dbraw/zinc/78/13/58/408781358.db2.gz	CTDNJNKHJHUNAT-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)[N@@H+](C)C1CC1	ZINC000277403683	408934188	/nfs/dbraw/zinc/93/41/88/408934188.db2.gz	HGBSJXOSWCHGSQ-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000277920422	409035558	/nfs/dbraw/zinc/03/55/58/409035558.db2.gz	XYDKHAHFGNZYAC-HNNXBMFYSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCC[C@@]1(C(=O)OCC)CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000277920422	409035560	/nfs/dbraw/zinc/03/55/60/409035560.db2.gz	XYDKHAHFGNZYAC-HNNXBMFYSA-N	1	1	324.381	1.989	20	5		DDBDMO
COCCO[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000278037452	409055515	/nfs/dbraw/zinc/05/55/15/409055515.db2.gz	BZOGZTXUHWQUBM-GOEBONIOSA-N	1	1	324.377	1.441	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000293578273	409141879	/nfs/dbraw/zinc/14/18/79/409141879.db2.gz	AYPICKHIBXWTIC-SNVBAGLBSA-N	1	1	321.381	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000293578273	409141883	/nfs/dbraw/zinc/14/18/83/409141883.db2.gz	AYPICKHIBXWTIC-SNVBAGLBSA-N	1	1	321.381	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000293578273	409141886	/nfs/dbraw/zinc/14/18/86/409141886.db2.gz	AYPICKHIBXWTIC-SNVBAGLBSA-N	1	1	321.381	1.573	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC[N@H+](C2CCC2)C1	ZINC000293716415	409167537	/nfs/dbraw/zinc/16/75/37/409167537.db2.gz	PBBIMZAVFRBVOD-GFCCVEGCSA-N	1	1	321.381	1.124	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000293935695	409209985	/nfs/dbraw/zinc/20/99/85/409209985.db2.gz	IIFMPXLCLJJLGA-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000293935695	409209988	/nfs/dbraw/zinc/20/99/88/409209988.db2.gz	IIFMPXLCLJJLGA-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)CN1	ZINC000279364387	409199404	/nfs/dbraw/zinc/19/94/04/409199404.db2.gz	HKOHEUFVBHZWMF-WMHVBEDNSA-N	1	1	301.346	1.820	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000321307594	164043784	/nfs/dbraw/zinc/04/37/84/164043784.db2.gz	CRQAVIMZPOZAPU-DGCLKSJQSA-N	1	1	318.377	1.876	20	5		DDBDMO
CNc1c(C(=O)NCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000321625669	164044462	/nfs/dbraw/zinc/04/44/62/164044462.db2.gz	JEPWYBCSVQFOMG-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@@H](C)C[N@@H+]1C	ZINC000408073600	164218735	/nfs/dbraw/zinc/21/87/35/164218735.db2.gz	QSZLWEPKKSPGMY-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@@H](C)C[N@H+]1C	ZINC000408073600	164218739	/nfs/dbraw/zinc/21/87/39/164218739.db2.gz	QSZLWEPKKSPGMY-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C[N@@H+]1C	ZINC000408075848	164220032	/nfs/dbraw/zinc/22/00/32/164220032.db2.gz	ZYLWWTSLUVZGDQ-ZJUUUORDSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@@H](C)C[N@H+]1C	ZINC000408075848	164220033	/nfs/dbraw/zinc/22/00/33/164220033.db2.gz	ZYLWWTSLUVZGDQ-ZJUUUORDSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H](C)O	ZINC000304000677	409562852	/nfs/dbraw/zinc/56/28/52/409562852.db2.gz	RCGKAGFNSRCILD-LBPRGKRZSA-N	1	1	321.377	1.575	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000356793551	409612295	/nfs/dbraw/zinc/61/22/95/409612295.db2.gz	MFDVNPIRHISQSJ-WDEREUQCSA-N	1	1	306.366	1.483	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000342558959	409722732	/nfs/dbraw/zinc/72/27/32/409722732.db2.gz	DSUYZFLCFPZAEQ-ZWNOBZJWSA-N	1	1	306.366	1.834	20	5		DDBDMO
CCOC(=O)CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000342717944	409843539	/nfs/dbraw/zinc/84/35/39/409843539.db2.gz	DWZMWYDIWBSMDC-LBPRGKRZSA-N	1	1	322.365	1.819	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000346185045	409848626	/nfs/dbraw/zinc/84/86/26/409848626.db2.gz	GNBHNVMYNZQDTE-STQMWFEESA-N	1	1	308.382	1.171	20	5		DDBDMO
COc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-]	ZINC000297087442	409799187	/nfs/dbraw/zinc/79/91/87/409799187.db2.gz	QTVSHUDDJVGIKS-YHWZYXNKSA-N	1	1	319.361	1.958	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000338422427	409976702	/nfs/dbraw/zinc/97/67/02/409976702.db2.gz	AANRHAQWOIAZEP-ZDUSSCGKSA-N	1	1	323.397	1.562	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000332394032	410123259	/nfs/dbraw/zinc/12/32/59/410123259.db2.gz	WGXIXJWZDAEUKU-JKSUJKDBSA-N	1	1	305.378	1.542	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](CO)C1	ZINC000298626046	410318448	/nfs/dbraw/zinc/31/84/48/410318448.db2.gz	DGODCZSNIXGGQS-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](CO)C1	ZINC000298626046	410318454	/nfs/dbraw/zinc/31/84/54/410318454.db2.gz	DGODCZSNIXGGQS-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)[C@@H](O)C1	ZINC000351945777	410356503	/nfs/dbraw/zinc/35/65/03/410356503.db2.gz	ULEJACICEDUGJC-MFKMUULPSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000351959189	410372901	/nfs/dbraw/zinc/37/29/01/410372901.db2.gz	NVEPXUQRWPCOJR-BXKDBHETSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000351959189	410372908	/nfs/dbraw/zinc/37/29/08/410372908.db2.gz	NVEPXUQRWPCOJR-BXKDBHETSA-N	1	1	304.306	1.457	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])[C@H]1CC[NH2+]CC1(F)F	ZINC000343446739	410458306	/nfs/dbraw/zinc/45/83/06/410458306.db2.gz	BTJINMSUCSXYKB-LLVKDONJSA-N	1	1	313.304	1.498	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343464889	410475079	/nfs/dbraw/zinc/47/50/79/410475079.db2.gz	YVUPJVFNUCZCRI-RYUDHWBXSA-N	1	1	307.350	1.573	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000343414691	410432939	/nfs/dbraw/zinc/43/29/39/410432939.db2.gz	BJRXUVVWMDTUDA-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000343414691	410432945	/nfs/dbraw/zinc/43/29/45/410432945.db2.gz	BJRXUVVWMDTUDA-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H](C)O	ZINC000352195718	410537608	/nfs/dbraw/zinc/53/76/08/410537608.db2.gz	SVSSYRBWSVTPRG-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@@H](C)O	ZINC000352195718	410537612	/nfs/dbraw/zinc/53/76/12/410537612.db2.gz	SVSSYRBWSVTPRG-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337478267	410815582	/nfs/dbraw/zinc/81/55/82/410815582.db2.gz	UFCUVYKRIREALX-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)CC1(C)C	ZINC000330583429	410799221	/nfs/dbraw/zinc/79/92/21/410799221.db2.gz	VRJXINLTGDQKKC-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@H]21	ZINC000301965065	410836276	/nfs/dbraw/zinc/83/62/76/410836276.db2.gz	NYLVWFLPOBHREF-VXGBXAGGSA-N	1	1	316.365	1.558	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000344121278	410970745	/nfs/dbraw/zinc/97/07/45/410970745.db2.gz	DWVZTYJUKVMUTE-MNOVXSKESA-N	1	1	307.350	1.287	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000331208986	411019873	/nfs/dbraw/zinc/01/98/73/411019873.db2.gz	WHJBVOMOGOBAQI-STQMWFEESA-N	1	1	321.377	1.833	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000331212626	411020908	/nfs/dbraw/zinc/02/09/08/411020908.db2.gz	KKOMFMIHXGFSAX-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H](C)CN2CCOCC2)cc1[N+](=O)[O-]	ZINC000271634991	209079110	/nfs/dbraw/zinc/07/91/10/209079110.db2.gz	PXBHSJITOYZJDH-CYBMUJFWSA-N	1	1	323.393	1.756	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1CCOc1cccc([N+](=O)[O-])c1	ZINC000419331829	226120549	/nfs/dbraw/zinc/12/05/49/226120549.db2.gz	RXEGQPRARFJCJK-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000419350878	226127206	/nfs/dbraw/zinc/12/72/06/226127206.db2.gz	ZYWFAGMMRKAWIR-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C1	ZINC000360536603	418458556	/nfs/dbraw/zinc/45/85/56/418458556.db2.gz	LDIRKRFIELDXBU-GFCCVEGCSA-N	1	1	322.365	1.040	20	5		DDBDMO
O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933507	418474504	/nfs/dbraw/zinc/47/45/04/418474504.db2.gz	MPPRPDAPADBXQF-CABCVRRESA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2)CC1	ZINC000373933507	418474508	/nfs/dbraw/zinc/47/45/08/418474508.db2.gz	MPPRPDAPADBXQF-CABCVRRESA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933507	418474512	/nfs/dbraw/zinc/47/45/12/418474512.db2.gz	MPPRPDAPADBXQF-CABCVRRESA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933610	418474688	/nfs/dbraw/zinc/47/46/88/418474688.db2.gz	MPPRPDAPADBXQF-LSDHHAIUSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2)CC1	ZINC000373933610	418474690	/nfs/dbraw/zinc/47/46/90/418474690.db2.gz	MPPRPDAPADBXQF-LSDHHAIUSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933610	418474693	/nfs/dbraw/zinc/47/46/93/418474693.db2.gz	MPPRPDAPADBXQF-LSDHHAIUSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C1CO[C@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2N1	ZINC000366784193	418518046	/nfs/dbraw/zinc/51/80/46/418518046.db2.gz	UKSZQTFYRKLPCA-YTRREALPSA-N	1	1	317.345	1.197	20	5		DDBDMO
O=C1CO[C@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2N1	ZINC000366784193	418518049	/nfs/dbraw/zinc/51/80/49/418518049.db2.gz	UKSZQTFYRKLPCA-YTRREALPSA-N	1	1	317.345	1.197	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@@H]1CO	ZINC000194361029	418543417	/nfs/dbraw/zinc/54/34/17/418543417.db2.gz	BZMPORYJMHIJSV-CHWSQXEVSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)CCO1	ZINC000367049123	418554905	/nfs/dbraw/zinc/55/49/05/418554905.db2.gz	CDRHCSVDMYKJBM-KGLIPLIRSA-N	1	1	323.397	1.149	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)n1	ZINC000191578132	222105287	/nfs/dbraw/zinc/10/52/87/222105287.db2.gz	XGVUUMKLQRWSDV-NSHDSACASA-N	1	1	307.354	1.122	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)n1	ZINC000191578132	222105289	/nfs/dbraw/zinc/10/52/89/222105289.db2.gz	XGVUUMKLQRWSDV-NSHDSACASA-N	1	1	307.354	1.122	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000361385457	418641195	/nfs/dbraw/zinc/64/11/95/418641195.db2.gz	QCEJCVUXWNBXSE-LBPRGKRZSA-N	1	1	321.333	1.614	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000367840318	418643934	/nfs/dbraw/zinc/64/39/34/418643934.db2.gz	QDSKXAXHFFTWHW-GHMZBOCLSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000367840318	418643938	/nfs/dbraw/zinc/64/39/38/418643938.db2.gz	QDSKXAXHFFTWHW-GHMZBOCLSA-N	1	1	323.736	1.343	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C2)C1	ZINC000368299409	418716793	/nfs/dbraw/zinc/71/67/93/418716793.db2.gz	OHZPRWDFONGXRI-AWEZNQCLSA-N	1	1	302.338	1.170	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1CO	ZINC000361658079	418697425	/nfs/dbraw/zinc/69/74/25/418697425.db2.gz	XEWVWXRPWDWGSL-ZWNOBZJWSA-N	1	1	308.334	1.522	20	5		DDBDMO
CCc1n[nH]c(C2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)n1	ZINC000364587567	418789387	/nfs/dbraw/zinc/78/93/87/418789387.db2.gz	DFQUUXIVTMEXCV-UHFFFAOYSA-N	1	1	319.369	1.388	20	5		DDBDMO
CCc1nnc(C2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)[nH]1	ZINC000364587567	418789389	/nfs/dbraw/zinc/78/93/89/418789389.db2.gz	DFQUUXIVTMEXCV-UHFFFAOYSA-N	1	1	319.369	1.388	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000372470062	418874283	/nfs/dbraw/zinc/87/42/83/418874283.db2.gz	CZNCTTYBUZLTBH-QWRGUYRKSA-N	1	1	305.334	1.657	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC[N@@H+](CC(C)(C)O)CC2)n1	ZINC000372590953	418886353	/nfs/dbraw/zinc/88/63/53/418886353.db2.gz	DQFKOSHISCXFEY-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
Nc1cc(C[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)ccn1	ZINC000365880432	418919153	/nfs/dbraw/zinc/91/91/53/418919153.db2.gz	QSMORTDAXIHOAI-LBPRGKRZSA-N	1	1	302.338	1.606	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000412042131	419581071	/nfs/dbraw/zinc/58/10/71/419581071.db2.gz	TWVVAQHRBWQYIP-FRRDWIJNSA-N	1	1	310.350	1.037	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](O)[C@H](CO)C1	ZINC000412108267	419670317	/nfs/dbraw/zinc/67/03/17/419670317.db2.gz	SAXOHZSAIZXSPY-JSGCOSHPSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](O)[C@H](CO)C1	ZINC000412108267	419670319	/nfs/dbraw/zinc/67/03/19/419670319.db2.gz	SAXOHZSAIZXSPY-JSGCOSHPSA-N	1	1	310.350	1.169	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CNCC[C@H]1C	ZINC000423355970	420025140	/nfs/dbraw/zinc/02/51/40/420025140.db2.gz	GCHPJJCJACRMQK-JMSVASOKSA-N	1	1	320.393	1.900	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](CO)COC(C)C	ZINC000430237130	420094792	/nfs/dbraw/zinc/09/47/92/420094792.db2.gz	OOGQLSFSZWMLSU-AWEZNQCLSA-N	1	1	312.366	1.821	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](CO)COC(C)C	ZINC000430237130	420094796	/nfs/dbraw/zinc/09/47/96/420094796.db2.gz	OOGQLSFSZWMLSU-AWEZNQCLSA-N	1	1	312.366	1.821	20	5		DDBDMO
C[C@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](CN)C1	ZINC000420324820	420211010	/nfs/dbraw/zinc/21/10/10/420211010.db2.gz	BCNVERRSGCYPSH-SWLSCSKDSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](CN)C1	ZINC000420324820	420211014	/nfs/dbraw/zinc/21/10/14/420211014.db2.gz	BCNVERRSGCYPSH-SWLSCSKDSA-N	1	1	320.393	1.983	20	5		DDBDMO
COc1cccc(C(=O)NCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000444336937	230084714	/nfs/dbraw/zinc/08/47/14/230084714.db2.gz	BVLPIAXKFXUVAP-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@]2(CCSC2)C1	ZINC000451986026	420618982	/nfs/dbraw/zinc/61/89/82/420618982.db2.gz	XDPNTZHYTRKKNM-OAHLLOKOSA-N	1	1	323.418	1.976	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000452068542	420620339	/nfs/dbraw/zinc/62/03/39/420620339.db2.gz	OSUXFJMZOKOXFF-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000443198227	420748121	/nfs/dbraw/zinc/74/81/21/420748121.db2.gz	MZWHPYGZRKIPFT-UHFFFAOYSA-N	1	1	315.395	1.603	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-]	ZINC000493085673	420753316	/nfs/dbraw/zinc/75/33/16/420753316.db2.gz	POVAVVFRPOUYAQ-DUXPYHPUSA-N	1	1	303.240	1.457	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000454131237	420804111	/nfs/dbraw/zinc/80/41/11/420804111.db2.gz	CREKNEVNRCVGEW-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000454131237	420804112	/nfs/dbraw/zinc/80/41/12/420804112.db2.gz	CREKNEVNRCVGEW-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000488721173	421107697	/nfs/dbraw/zinc/10/76/97/421107697.db2.gz	RNJVJSBHPMSJNV-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000524719957	421266016	/nfs/dbraw/zinc/26/60/16/421266016.db2.gz	RQFZKPPPLZPECW-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000524775234	421271168	/nfs/dbraw/zinc/27/11/68/421271168.db2.gz	AVQPTVZHVZSXRG-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](CCO)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641939	421441294	/nfs/dbraw/zinc/44/12/94/421441294.db2.gz	RHHHKVXYMYQRGN-STQMWFEESA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](CCO)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641939	421441295	/nfs/dbraw/zinc/44/12/95/421441295.db2.gz	RHHHKVXYMYQRGN-STQMWFEESA-N	1	1	321.377	1.223	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ncccc3O)CC2)cn1	ZINC000514830365	421458365	/nfs/dbraw/zinc/45/83/65/421458365.db2.gz	BTICQZGBROWXSA-UHFFFAOYSA-N	1	1	315.333	1.413	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000548718360	421465373	/nfs/dbraw/zinc/46/53/73/421465373.db2.gz	NWAOQDTYWYMBJY-UHFFFAOYSA-N	1	1	301.306	1.280	20	5		DDBDMO
CNc1nccc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000566467335	421606134	/nfs/dbraw/zinc/60/61/34/421606134.db2.gz	VVEUIIFKMWEJEA-NSHDSACASA-N	1	1	321.381	1.586	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000558589560	421815375	/nfs/dbraw/zinc/81/53/75/421815375.db2.gz	LCVBNUQQZWMLHE-SNVBAGLBSA-N	1	1	307.354	1.231	20	5		DDBDMO
C[C@H](C(=O)NCC[NH+]1CCSCC1)c1cccc([N+](=O)[O-])c1	ZINC000581106174	421898440	/nfs/dbraw/zinc/89/84/40/421898440.db2.gz	AERICMCXUZLTQW-LBPRGKRZSA-N	1	1	323.418	1.863	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000559637071	421836879	/nfs/dbraw/zinc/83/68/79/421836879.db2.gz	HRRYKFUKXAEJBR-INIZCTEOSA-N	1	1	322.409	1.029	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000543580425	421838785	/nfs/dbraw/zinc/83/87/85/421838785.db2.gz	BLQOTUPONTYYMR-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
CN(CC(=O)N1CC[N@@H+](C)C(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000581157666	421910296	/nfs/dbraw/zinc/91/02/96/421910296.db2.gz	DERCBKQHIXQMHW-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+](C2CC2)C1	ZINC000581232822	421927518	/nfs/dbraw/zinc/92/75/18/421927518.db2.gz	RTOWWDVZVMSBLY-NSHDSACASA-N	1	1	306.366	1.490	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@H]([NH+]3CCOCC3)CC2)s1	ZINC000573338432	421950367	/nfs/dbraw/zinc/95/03/67/421950367.db2.gz	NDGLHCTUYGVIJK-NSHDSACASA-N	1	1	312.395	1.742	20	5		DDBDMO
Nc1nccc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594418494	422347475	/nfs/dbraw/zinc/34/74/75/422347475.db2.gz	JMOKFPHYETVWSR-VXGBXAGGSA-N	1	1	319.365	1.319	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000577864933	422444191	/nfs/dbraw/zinc/44/41/91/422444191.db2.gz	YWVFWZYKBPFAET-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000577864933	422444196	/nfs/dbraw/zinc/44/41/96/422444196.db2.gz	YWVFWZYKBPFAET-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCO1	ZINC000344436035	272026493	/nfs/dbraw/zinc/02/64/93/272026493.db2.gz	PENZSQJQANXWGD-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCC[N@H+]([C@@H](C)CO)CC2)n1	ZINC000345044331	272162680	/nfs/dbraw/zinc/16/26/80/272162680.db2.gz	OIGMNGLTSBWUDT-ZDUSSCGKSA-N	1	1	308.382	1.500	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2c([N+](=O)[O-])c(C)nn2C)C1	ZINC000345595113	272287656	/nfs/dbraw/zinc/28/76/56/272287656.db2.gz	MWJZELKJMAVLQA-NSHDSACASA-N	1	1	309.370	1.098	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)n1	ZINC000281079589	274004606	/nfs/dbraw/zinc/00/46/06/274004606.db2.gz	BPZAMPZUYZIBOP-MNOVXSKESA-N	1	1	320.349	1.449	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000130916281	276071370	/nfs/dbraw/zinc/07/13/70/276071370.db2.gz	OPTVNERQISDTSH-UHFFFAOYSA-N	1	1	321.786	1.478	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000269451268	276306760	/nfs/dbraw/zinc/30/67/60/276306760.db2.gz	GILOLGJBIFUTGS-NSHDSACASA-N	1	1	323.397	1.855	20	5		DDBDMO
CC[N@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1	ZINC000269451268	276306762	/nfs/dbraw/zinc/30/67/62/276306762.db2.gz	GILOLGJBIFUTGS-NSHDSACASA-N	1	1	323.397	1.855	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1	ZINC000269451268	276306763	/nfs/dbraw/zinc/30/67/63/276306763.db2.gz	GILOLGJBIFUTGS-NSHDSACASA-N	1	1	323.397	1.855	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@H]1C(C)C	ZINC000429391283	277394637	/nfs/dbraw/zinc/39/46/37/277394637.db2.gz	CGTZQISRJOMJNO-AAEUAGOBSA-N	1	1	310.354	1.311	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000129138991	281333776	/nfs/dbraw/zinc/33/37/76/281333776.db2.gz	WNHBZFAARYJDML-ZDUSSCGKSA-N	1	1	318.377	1.878	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246745540	282011936	/nfs/dbraw/zinc/01/19/36/282011936.db2.gz	PTXFMOQIANTXKX-GZBFAFLISA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H]2CCCN2c2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000408361175	297027643	/nfs/dbraw/zinc/02/76/43/297027643.db2.gz	CWTZINGHSUPRHL-FRRDWIJNSA-N	1	1	323.397	1.406	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H]2CCCN2c2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000408361175	297027645	/nfs/dbraw/zinc/02/76/45/297027645.db2.gz	CWTZINGHSUPRHL-FRRDWIJNSA-N	1	1	323.397	1.406	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+](CCO)CC1CCCCC1	ZINC000362578740	300101261	/nfs/dbraw/zinc/10/12/61/300101261.db2.gz	GBGHYCIIQYPOOH-UHFFFAOYSA-N	1	1	323.393	1.631	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)Nc1cccc([N+](=O)[O-])c1	ZINC000363094693	300209590	/nfs/dbraw/zinc/20/95/90/300209590.db2.gz	HJUNASPVYGGADS-KBPBESRZSA-N	1	1	320.349	1.580	20	5		DDBDMO
CCc1[nH+]ccn1[C@H]1CCCN(Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000363451148	300270099	/nfs/dbraw/zinc/27/00/99/300270099.db2.gz	WQPIUXHIKXQXOO-LBPRGKRZSA-N	1	1	318.381	1.924	20	5		DDBDMO
CC(C)NC(=O)CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000364322583	300376078	/nfs/dbraw/zinc/37/60/78/300376078.db2.gz	GRIWGSLDIYEUDT-GFCCVEGCSA-N	1	1	309.370	1.343	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000364350383	300381874	/nfs/dbraw/zinc/38/18/74/300381874.db2.gz	XTEZEFSDJIXDSR-GJZGRUSLSA-N	1	1	321.381	1.267	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[NH+]([C@@H]3CCOC3)CC1)CCN2	ZINC000365543896	300531284	/nfs/dbraw/zinc/53/12/84/300531284.db2.gz	GMNOXYGOOAPARD-GFCCVEGCSA-N	1	1	318.377	1.474	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2CC[N@H+](C)[C@@H]2C1	ZINC000368595222	301061101	/nfs/dbraw/zinc/06/11/01/301061101.db2.gz	SIERBSLNASWEIP-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1cccc(C(=O)N2CCC[N@H+]([C@H](C)CO)CC2)c1[N+](=O)[O-]	ZINC000368976309	301115551	/nfs/dbraw/zinc/11/55/51/301115551.db2.gz	VKUPXPBBCQWQOT-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000368976931	301116256	/nfs/dbraw/zinc/11/62/56/301116256.db2.gz	ZVOQIXYJCRFJCJ-NGFQHRJXSA-N	1	1	319.361	1.214	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000370163939	301286702	/nfs/dbraw/zinc/28/67/02/301286702.db2.gz	UURHDVPYWKHEFK-OJLVUWQFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000370163939	301286703	/nfs/dbraw/zinc/28/67/03/301286703.db2.gz	UURHDVPYWKHEFK-OJLVUWQFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000370163939	301286705	/nfs/dbraw/zinc/28/67/05/301286705.db2.gz	UURHDVPYWKHEFK-OJLVUWQFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)[C@@H]2C1	ZINC000376729421	302093332	/nfs/dbraw/zinc/09/33/32/302093332.db2.gz	PXEDNAJFFKGDME-GXFFZTMASA-N	1	1	307.325	1.900	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]12	ZINC000377715116	302218268	/nfs/dbraw/zinc/21/82/68/302218268.db2.gz	CTYOYUXHKQJIHC-ONGXEEELSA-N	1	1	316.317	1.304	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]12	ZINC000377715116	302218271	/nfs/dbraw/zinc/21/82/71/302218271.db2.gz	CTYOYUXHKQJIHC-ONGXEEELSA-N	1	1	316.317	1.304	20	5		DDBDMO
Cc1[nH+]cc2n1CC[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1)C2	ZINC000516354495	302789365	/nfs/dbraw/zinc/78/93/65/302789365.db2.gz	PNFQNGSAKFNURZ-CYBMUJFWSA-N	1	1	314.345	1.979	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000531878013	303262841	/nfs/dbraw/zinc/26/28/41/303262841.db2.gz	CCDYWVUAYPCOHL-JTQLQIEISA-N	1	1	303.322	1.561	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CC[NH+](Cc3ccsc3)CC2)c1	ZINC000536021200	303353984	/nfs/dbraw/zinc/35/39/84/303353984.db2.gz	BXNJPRXCKKRQHW-UHFFFAOYSA-N	1	1	321.406	1.671	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000371511976	307151889	/nfs/dbraw/zinc/15/18/89/307151889.db2.gz	ULRSRLPAANYTGF-QWHCGFSZSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000372658338	307172698	/nfs/dbraw/zinc/17/26/98/307172698.db2.gz	YAFABQJYWLYJIZ-SOUVJXGZSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000372658338	307172699	/nfs/dbraw/zinc/17/26/99/307172699.db2.gz	YAFABQJYWLYJIZ-SOUVJXGZSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000372658338	307172700	/nfs/dbraw/zinc/17/27/00/307172700.db2.gz	YAFABQJYWLYJIZ-SOUVJXGZSA-N	1	1	303.362	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(CNC(=O)O2)C1	ZINC000375556965	307228001	/nfs/dbraw/zinc/22/80/01/307228001.db2.gz	JOYQBGGLQJPEIC-HNNXBMFYSA-N	1	1	305.334	1.978	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])C[C@H]2[C@H]1c1ccccc1	ZINC000377824620	307276365	/nfs/dbraw/zinc/27/63/65/307276365.db2.gz	UNSLJPGVCHRREJ-DGXTUMSLSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2[C@H]1c1ccccc1	ZINC000377824620	307276366	/nfs/dbraw/zinc/27/63/66/307276366.db2.gz	UNSLJPGVCHRREJ-DGXTUMSLSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2[C@H]1c1ccccc1	ZINC000377824620	307276367	/nfs/dbraw/zinc/27/63/67/307276367.db2.gz	UNSLJPGVCHRREJ-DGXTUMSLSA-N	1	1	315.373	1.413	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CCCCCO	ZINC000434678091	307304031	/nfs/dbraw/zinc/30/40/31/307304031.db2.gz	BYRJHZAWPUXHLX-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000567016852	308068620	/nfs/dbraw/zinc/06/86/20/308068620.db2.gz	JAPAFODNMIZBCJ-CYBMUJFWSA-N	1	1	323.397	1.351	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1NCc1c[nH+]c2n1CCCC2	ZINC000568853531	308131505	/nfs/dbraw/zinc/13/15/05/308131505.db2.gz	PIBYXMDATPZLQL-UHFFFAOYSA-N	1	1	315.333	1.839	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](c3nnc[nH]3)C2)cc1	ZINC000374528168	483939167	/nfs/dbraw/zinc/93/91/67/483939167.db2.gz	ATYTZKUHILKRFL-GFCCVEGCSA-N	1	1	317.349	1.971	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000452136164	533810230	/nfs/dbraw/zinc/81/02/30/533810230.db2.gz	XMFXCRPNSWORDN-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010075	533914560	/nfs/dbraw/zinc/91/45/60/533914560.db2.gz	YFVAZCJARKURGQ-NEPJUHHUSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1cc(N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010075	533914570	/nfs/dbraw/zinc/91/45/70/533914570.db2.gz	YFVAZCJARKURGQ-NEPJUHHUSA-N	1	1	311.357	1.934	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOCC12CCCCC2	ZINC000451812924	534320465	/nfs/dbraw/zinc/32/04/65/534320465.db2.gz	HTNYAKBSHGTVLI-UHFFFAOYSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOCC12CCCCC2	ZINC000451812924	534320472	/nfs/dbraw/zinc/32/04/72/534320472.db2.gz	HTNYAKBSHGTVLI-UHFFFAOYSA-N	1	1	321.377	1.792	20	5		DDBDMO
CN(C(=O)C[N@@H+](CCCCO)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000152550971	523814016	/nfs/dbraw/zinc/81/40/16/523814016.db2.gz	AAVQMOLUOZWNQO-UHFFFAOYSA-N	1	1	321.377	1.795	20	5		DDBDMO
CCO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000451546093	527763763	/nfs/dbraw/zinc/76/37/63/527763763.db2.gz	RUWREUVSSJMUOK-IAQYHMDHSA-N	1	1	321.377	1.941	20	5		DDBDMO
CCOCCOCC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444715326	528802413	/nfs/dbraw/zinc/80/24/13/528802413.db2.gz	MLGBGCSOLMDRNI-UHFFFAOYSA-N	1	1	322.365	1.956	20	5		DDBDMO
CCOCCOCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444715326	528802420	/nfs/dbraw/zinc/80/24/20/528802420.db2.gz	MLGBGCSOLMDRNI-UHFFFAOYSA-N	1	1	322.365	1.956	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCS(=O)(=O)C1	ZINC000050443030	696231832	/nfs/dbraw/zinc/23/18/32/696231832.db2.gz	YBPCQTAXAQTDND-SNVBAGLBSA-N	1	1	304.755	1.525	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000748349065	700112069	/nfs/dbraw/zinc/11/20/69/700112069.db2.gz	APIAFNCZHNBNRB-SECBINFHSA-N	1	1	322.321	1.588	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000748349065	700112070	/nfs/dbraw/zinc/11/20/70/700112070.db2.gz	APIAFNCZHNBNRB-SECBINFHSA-N	1	1	322.321	1.588	20	5		DDBDMO
CC[NH+]1CCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1	ZINC000193509019	697670041	/nfs/dbraw/zinc/67/00/41/697670041.db2.gz	LBJMMCGIIMTSKI-UHFFFAOYSA-N	1	1	304.350	1.621	20	5		DDBDMO
Cc1nn(C[NH+]2CCC3(CCN(C)C3=O)CC2)c(C)c1[N+](=O)[O-]	ZINC000773325661	697745094	/nfs/dbraw/zinc/74/50/94/697745094.db2.gz	GIWAJTYZRWFFAR-UHFFFAOYSA-N	1	1	321.381	1.310	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]1C	ZINC000775100188	697962803	/nfs/dbraw/zinc/96/28/03/697962803.db2.gz	BMGVMDGDFXPSAY-JOYOIKCWSA-N	1	1	323.305	1.886	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]1C	ZINC000775100188	697962807	/nfs/dbraw/zinc/96/28/07/697962807.db2.gz	BMGVMDGDFXPSAY-JOYOIKCWSA-N	1	1	323.305	1.886	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000750053817	700201427	/nfs/dbraw/zinc/20/14/27/700201427.db2.gz	UPLYFANXJRGWGU-JSGCOSHPSA-N	1	1	307.350	1.358	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000800853448	700249060	/nfs/dbraw/zinc/24/90/60/700249060.db2.gz	QWTKJUCOEULHOY-UHFFFAOYSA-N	1	1	302.338	1.237	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000786193002	699133649	/nfs/dbraw/zinc/13/36/49/699133649.db2.gz	VYNCWUNIDXTWLO-CABCVRRESA-N	1	1	310.350	1.366	20	5		DDBDMO
[NH2+]=C(Cn1cccn1)NOCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000789589662	699397492	/nfs/dbraw/zinc/39/74/92/699397492.db2.gz	FWYOYKCEOQRCKO-UHFFFAOYSA-N	1	1	320.265	1.398	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1nnnn1C1CC1	ZINC000790533073	699465677	/nfs/dbraw/zinc/46/56/77/699465677.db2.gz	JLZRTUIPDDUMDO-TVQRCGJNSA-N	1	1	318.337	1.300	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1	ZINC000742058395	699858870	/nfs/dbraw/zinc/85/88/70/699858870.db2.gz	BDMDYHXZBOONGU-CHWSQXEVSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1	ZINC000743375606	699909894	/nfs/dbraw/zinc/90/98/94/699909894.db2.gz	IUQLOXWXVRYZHP-HNNXBMFYSA-N	1	1	315.377	1.955	20	5		DDBDMO
CC1(C)CN(Cc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1CCO	ZINC000801547287	700319544	/nfs/dbraw/zinc/31/95/44/700319544.db2.gz	MAUDDZNOEIVNEK-UHFFFAOYSA-N	1	1	311.357	1.622	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000761082509	700841651	/nfs/dbraw/zinc/84/16/51/700841651.db2.gz	QDLZHEHGUXUWGT-GFCCVEGCSA-N	1	1	306.366	1.194	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)CC[NH+]1CCOCC1	ZINC000804176658	701169675	/nfs/dbraw/zinc/16/96/75/701169675.db2.gz	RRWUNPXWLSLOLM-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O	ZINC000768770137	701201302	/nfs/dbraw/zinc/20/13/02/701201302.db2.gz	SEHCUZDMDSHCMF-PELKAZGASA-N	1	1	313.741	1.499	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O	ZINC000768770137	701201299	/nfs/dbraw/zinc/20/12/99/701201299.db2.gz	SEHCUZDMDSHCMF-PELKAZGASA-N	1	1	313.741	1.499	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000808049737	701495603	/nfs/dbraw/zinc/49/56/03/701495603.db2.gz	BXROIDUVPRVMPT-UHFFFAOYSA-N	1	1	318.293	1.553	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839636467	701761510	/nfs/dbraw/zinc/76/15/10/701761510.db2.gz	SPONLTJVRYZFJT-JSGCOSHPSA-N	1	1	307.350	1.038	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CCC1(C)C	ZINC000866112942	706621993	/nfs/dbraw/zinc/62/19/93/706621993.db2.gz	OHXVZNQIEUDRNR-UHFFFAOYSA-N	1	1	304.354	1.558	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C[C@H]1C	ZINC000840123112	701981794	/nfs/dbraw/zinc/98/17/94/701981794.db2.gz	KRTSZPWPDZINSY-QMTHXVAHSA-N	1	1	319.365	1.962	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C[C@@H]1C	ZINC000840123104	701981890	/nfs/dbraw/zinc/98/18/90/701981890.db2.gz	KRTSZPWPDZINSY-HZMBPMFUSA-N	1	1	319.365	1.962	20	5		DDBDMO
Cc1nn(CN2C[C@H]3CC[N@H+](C)[C@H]3C2)c2ccc([N+](=O)[O-])cc12	ZINC000840134623	701989636	/nfs/dbraw/zinc/98/96/36/701989636.db2.gz	YUHYEIQRXWLVIN-WBMJQRKESA-N	1	1	315.377	1.846	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@H](CO)CC1)OCCO2	ZINC000816666501	702138233	/nfs/dbraw/zinc/13/82/33/702138233.db2.gz	OMAUQFOCQZYDLT-LBPRGKRZSA-N	1	1	322.361	1.960	20	5		DDBDMO
Cc1sc(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000812321514	702147134	/nfs/dbraw/zinc/14/71/34/702147134.db2.gz	DMDYEOITZNMYEA-MNOVXSKESA-N	1	1	309.391	1.988	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC(F)(F)[C@H](CO)C2)cc1	ZINC000812860197	702252601	/nfs/dbraw/zinc/25/26/01/702252601.db2.gz	XPGYTMJWWFGZPB-AAEUAGOBSA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC(F)(F)[C@H](CO)C2)cc1	ZINC000812860197	702252604	/nfs/dbraw/zinc/25/26/04/702252604.db2.gz	XPGYTMJWWFGZPB-AAEUAGOBSA-N	1	1	316.304	1.578	20	5		DDBDMO
CC(C)[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@H](O)CO	ZINC000817417829	702376422	/nfs/dbraw/zinc/37/64/22/702376422.db2.gz	RQANTAJKHDDSQN-LLVKDONJSA-N	1	1	302.758	1.812	20	5		DDBDMO
Nc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cn1	ZINC000843058950	702809980	/nfs/dbraw/zinc/80/99/80/702809980.db2.gz	AATAZXFTXPMEEN-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2CC[N@H+]2C(C)(C)C)n1	ZINC000845735917	703194987	/nfs/dbraw/zinc/19/49/87/703194987.db2.gz	MZWRWFVBVVNPRN-JTQLQIEISA-N	1	1	310.354	1.841	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000879580626	706727027	/nfs/dbraw/zinc/72/70/27/706727027.db2.gz	IPUKDFVUHYLSFV-BMFZPTHFSA-N	1	1	305.378	1.654	20	5		DDBDMO
C[C@@H]1C[C@@H]1C(N)=[NH+]OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000848520491	703560430	/nfs/dbraw/zinc/56/04/30/703560430.db2.gz	QOUIKTOMIJYDPN-SKDRFNHKSA-N	1	1	318.333	1.638	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)cc1	ZINC000852345806	704019403	/nfs/dbraw/zinc/01/94/03/704019403.db2.gz	JRWHDFDVFYUKGO-XRGAULLZSA-N	1	1	306.362	1.721	20	5		DDBDMO
C[C@@H](C[C@H]1CCCC[N@H+]1C)OC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000870789996	704132967	/nfs/dbraw/zinc/13/29/67/704132967.db2.gz	LXJYCTUEUGYULM-NWDGAFQWSA-N	1	1	310.354	1.597	20	5		DDBDMO
Nc1ccc(NC(=O)Cn2c[nH+]c3c2CCCC3)cc1[N+](=O)[O-]	ZINC000854496498	704407879	/nfs/dbraw/zinc/40/78/79/704407879.db2.gz	HFPYRDWIZSJOBU-UHFFFAOYSA-N	1	1	315.333	1.891	20	5		DDBDMO
CCN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000855360250	704480586	/nfs/dbraw/zinc/48/05/86/704480586.db2.gz	DFCZGCNYHHGSFU-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
COc1cc(NCC[N@H+]2CC[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000858866867	704766244	/nfs/dbraw/zinc/76/62/44/704766244.db2.gz	IQFKEUJNFMSMOL-JTQLQIEISA-N	1	1	311.338	1.091	20	5		DDBDMO
Cn1cc(CC[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nn1	ZINC000859056275	704792022	/nfs/dbraw/zinc/79/20/22/704792022.db2.gz	VVWCVJUZPOFFHV-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000874836666	705193537	/nfs/dbraw/zinc/19/35/37/705193537.db2.gz	GJWXXFVAYULFIT-HUUCEWRRSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000824002748	705352678	/nfs/dbraw/zinc/35/26/78/705352678.db2.gz	HAMAOQHRSSAJGL-JTQLQIEISA-N	1	1	307.354	1.640	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000824658083	705500767	/nfs/dbraw/zinc/50/07/67/705500767.db2.gz	IHRIOANFWJBDNE-GFCCVEGCSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000825722252	705722189	/nfs/dbraw/zinc/72/21/89/705722189.db2.gz	VSJFELKXXCTGTQ-OAHLLOKOSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000862794085	705799633	/nfs/dbraw/zinc/79/96/33/705799633.db2.gz	WHCSEKRSFCUHTG-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000863319842	705900073	/nfs/dbraw/zinc/90/00/73/705900073.db2.gz	QBMUFEZIHUGANZ-HBIYDYFMSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827346625	705982198	/nfs/dbraw/zinc/98/21/98/705982198.db2.gz	PSBOFNCFIKVFKU-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CC[N@@H+]2C)C1	ZINC000827358354	705984900	/nfs/dbraw/zinc/98/49/00/705984900.db2.gz	XRYPVLAMQDANTA-RISCZKNCSA-N	1	1	304.350	1.464	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)cc1	ZINC000877789307	706213718	/nfs/dbraw/zinc/21/37/18/706213718.db2.gz	IENXCGBOHLGGCA-KBPBESRZSA-N	1	1	324.402	1.504	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]3CS(=O)(=O)C[C@@H]3C2)cc1	ZINC000877789307	706213719	/nfs/dbraw/zinc/21/37/19/706213719.db2.gz	IENXCGBOHLGGCA-KBPBESRZSA-N	1	1	324.402	1.504	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000865605340	706475407	/nfs/dbraw/zinc/47/54/07/706475407.db2.gz	SMVKPJRZIDHRHP-CYBMUJFWSA-N	1	1	321.352	1.877	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(N[C@H]2CCc3c[nH+]cn3C2)cc1F	ZINC000865793943	706528184	/nfs/dbraw/zinc/52/81/84/706528184.db2.gz	GAGJDHMINCSBEX-JTQLQIEISA-N	1	1	306.297	1.850	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@@H](C(F)(F)F)O1	ZINC000880056157	706865674	/nfs/dbraw/zinc/86/56/74/706865674.db2.gz	CAELRYGIQQLFMN-ZJUUUORDSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@@H](C(F)(F)F)O1	ZINC000880056157	706865675	/nfs/dbraw/zinc/86/56/75/706865675.db2.gz	CAELRYGIQQLFMN-ZJUUUORDSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C(C)(C)C1	ZINC000867123252	706903563	/nfs/dbraw/zinc/90/35/63/706903563.db2.gz	YMIOZFULWYXHCK-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@@H]2CCOC[C@H]2OC)cc1[N+](=O)[O-]	ZINC000880425585	706970410	/nfs/dbraw/zinc/97/04/10/706970410.db2.gz	GHAWSLYHBHVUPG-IUODEOHRSA-N	1	1	310.350	1.839	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC=C[C@@H]1CO	ZINC000880490414	706992679	/nfs/dbraw/zinc/99/26/79/706992679.db2.gz	QLSRBPKTHHPUAS-CYBMUJFWSA-N	1	1	305.334	1.465	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1	ZINC000882482886	707652981	/nfs/dbraw/zinc/65/29/81/707652981.db2.gz	OQVSQVBOQQXVPF-UHFFFAOYSA-N	1	1	312.345	1.676	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000882482576	707653445	/nfs/dbraw/zinc/65/34/45/707653445.db2.gz	RZPZWZJWYIJTRY-LBPRGKRZSA-N	1	1	306.366	1.607	20	5		DDBDMO
Cc1nc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221119	708258723	/nfs/dbraw/zinc/25/87/23/708258723.db2.gz	HLOXKMMTJRIJSF-KBPBESRZSA-N	1	1	306.366	1.334	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(Cc3cccnc3[N+](=O)[O-])CC2)C1	ZINC000886067791	708691958	/nfs/dbraw/zinc/69/19/58/708691958.db2.gz	OXGMZINZUUOLIQ-HNNXBMFYSA-N	1	1	319.409	1.202	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000886285641	708735811	/nfs/dbraw/zinc/73/58/11/708735811.db2.gz	OQXSUKGFQBRCLE-CQSZACIVSA-N	1	1	306.366	1.021	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CCOCC1	ZINC000887091828	708952902	/nfs/dbraw/zinc/95/29/02/708952902.db2.gz	XTDVDCYDMYZLIK-UHFFFAOYSA-N	1	1	311.313	1.119	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)C[C@H]1CO	ZINC000912739802	713079561	/nfs/dbraw/zinc/07/95/61/713079561.db2.gz	HQIDKFGNWOXHQI-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C[C@H]1CO	ZINC000912739802	713079564	/nfs/dbraw/zinc/07/95/64/713079564.db2.gz	HQIDKFGNWOXHQI-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@@H+](C)C[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739942	713080226	/nfs/dbraw/zinc/08/02/26/713080226.db2.gz	KSLCERPVUGYWPH-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@H+](C)C[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739942	713080228	/nfs/dbraw/zinc/08/02/28/713080228.db2.gz	KSLCERPVUGYWPH-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC(C)(C)CC[NH+]1CCOCC1	ZINC000912954600	713134468	/nfs/dbraw/zinc/13/44/68/713134468.db2.gz	RBLAPFTXIRIJKB-UHFFFAOYSA-N	1	1	324.381	1.164	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NCC[N@H+]1CCc2ccccc2C1	ZINC000891715832	710273765	/nfs/dbraw/zinc/27/37/65/710273765.db2.gz	HTQINDMGDQOVLD-UHFFFAOYSA-N	1	1	301.350	1.799	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000893266468	710583175	/nfs/dbraw/zinc/58/31/75/710583175.db2.gz	RDDPMBWBZVTTQQ-ZDUSSCGKSA-N	1	1	320.393	1.778	20	5		DDBDMO
CC(C)Oc1nc(N2CC[C@@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000893933532	710891655	/nfs/dbraw/zinc/89/16/55/710891655.db2.gz	AQNYLQMMVITDOE-DGCLKSJQSA-N	1	1	306.366	1.917	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ncc([N+](=O)[O-])c2ccccc21	ZINC000894590499	711198437	/nfs/dbraw/zinc/19/84/37/711198437.db2.gz	CQGRFECCARESIB-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895246341	711463857	/nfs/dbraw/zinc/46/38/57/711463857.db2.gz	NBFHJVGEASGMPJ-PWSUYJOCSA-N	1	1	310.402	1.166	20	5		DDBDMO
O=[N+]([O-])CC[NH2+]CCCN1CCN(Cc2ccccc2)CC1	ZINC000905035775	711915073	/nfs/dbraw/zinc/91/50/73/711915073.db2.gz	QAJKMIKTUCHVET-UHFFFAOYSA-N	1	1	306.410	1.061	20	5		DDBDMO
O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(Cl)c(Cl)c1	ZINC000905203303	711967151	/nfs/dbraw/zinc/96/71/51/711967151.db2.gz	QXYJWRWPWNUMPF-NSHDSACASA-N	1	1	318.160	1.965	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)c1C	ZINC000908347226	712748116	/nfs/dbraw/zinc/74/81/16/712748116.db2.gz	KRPHHXCWHVBQRK-JSGCOSHPSA-N	1	1	303.362	1.988	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000908512390	712793372	/nfs/dbraw/zinc/79/33/72/712793372.db2.gz	LBZJLXMFZLQIGH-ZBINZKHDSA-N	1	1	307.350	1.227	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1C[C@H]3COC[C@H]3O1)C2	ZINC000930100362	713756168	/nfs/dbraw/zinc/75/61/68/713756168.db2.gz	SVKMPGIGTSXUDK-HEHGZKQESA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1C[C@H]3COC[C@H]3O1)C2	ZINC000930100362	713756170	/nfs/dbraw/zinc/75/61/70/713756170.db2.gz	SVKMPGIGTSXUDK-HEHGZKQESA-N	1	1	304.346	1.757	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931393145	714082842	/nfs/dbraw/zinc/08/28/42/714082842.db2.gz	DKJNWPQPRZUAON-GASCZTMLSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CCn3cc[nH+]c32)c2c(c1)COCO2	ZINC000931528235	714120284	/nfs/dbraw/zinc/12/02/84/714120284.db2.gz	BVNJXVLVEQVZCC-UHFFFAOYSA-N	1	1	302.290	1.678	20	5		DDBDMO
Cn1ccc(C2CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)n1	ZINC000932141894	714270068	/nfs/dbraw/zinc/27/00/68/714270068.db2.gz	ZHRDQLHDWMXBRL-UHFFFAOYSA-N	1	1	304.354	1.441	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@H]1[NH2+]Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000933036816	714505844	/nfs/dbraw/zinc/50/58/44/714505844.db2.gz	UMSDIAMBKZRUKN-ZDUSSCGKSA-N	1	1	323.324	1.119	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)cc1	ZINC000934255065	714775815	/nfs/dbraw/zinc/77/58/15/714775815.db2.gz	OJJICVSFFDOSSH-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3[C@@H]2CCCN3CCO)cc1	ZINC000934255065	714775816	/nfs/dbraw/zinc/77/58/16/714775816.db2.gz	OJJICVSFFDOSSH-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H]3[C@@H]2CCCN3CCO)cc1	ZINC000934255065	714775817	/nfs/dbraw/zinc/77/58/17/714775817.db2.gz	OJJICVSFFDOSSH-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c(F)c1	ZINC001164966775	722070694	/nfs/dbraw/zinc/07/06/94/722070694.db2.gz	BVOLHDAXIPRXOO-BETUJISGSA-N	1	1	322.340	1.428	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(Cl)s1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932088	742776059	/nfs/dbraw/zinc/77/60/59/742776059.db2.gz	HVZRBDLIFNSMBR-RKDXNWHRSA-N	1	1	303.771	1.273	20	5		DDBDMO
Cc1cc(C[NH+]2CCC(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)sn1	ZINC001002789620	743419374	/nfs/dbraw/zinc/41/93/74/743419374.db2.gz	WGWLMRJPQIVTRJ-CHWSQXEVSA-N	1	1	324.406	1.197	20	5		DDBDMO
O=[N+]([O-])c1cnc2cccc(NCC3([NH+]4CCCC4)COC3)n21	ZINC001168450399	745106411	/nfs/dbraw/zinc/10/64/11/745106411.db2.gz	OQTHERMLTISSPN-UHFFFAOYSA-N	1	1	317.349	1.519	20	5		DDBDMO
CCOC(=O)N1CCC([N@@H+](C)[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169038632	762193508	/nfs/dbraw/zinc/19/35/08/762193508.db2.gz	JMBWXFDHYSRBNK-TZMCWYRMSA-N	1	1	313.398	1.985	20	5		DDBDMO
COc1cc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)ccn1	ZINC001169056367	762211200	/nfs/dbraw/zinc/21/12/00/762211200.db2.gz	SLESEXBMHIKDRB-UMVBOHGHSA-N	1	1	321.377	1.989	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001017544081	758011679	/nfs/dbraw/zinc/01/16/79/758011679.db2.gz	KFJNDZJEHHTEQT-XJFOESAGSA-N	1	1	309.410	1.763	20	5		DDBDMO
CC(C)(C)CC[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001017544081	758011691	/nfs/dbraw/zinc/01/16/91/758011691.db2.gz	KFJNDZJEHHTEQT-XJFOESAGSA-N	1	1	309.410	1.763	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001017544081	758011703	/nfs/dbraw/zinc/01/17/03/758011703.db2.gz	KFJNDZJEHHTEQT-XJFOESAGSA-N	1	1	309.410	1.763	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)nc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139332	760613975	/nfs/dbraw/zinc/61/39/75/760613975.db2.gz	YAHMUJIAOVBVOF-DDHJBXDOSA-N	1	1	324.768	1.137	20	5		DDBDMO
Cc1cccc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001086363290	761493066	/nfs/dbraw/zinc/49/30/66/761493066.db2.gz	MATZITRMXOLEOR-KLHDSHLOSA-N	1	1	317.389	1.645	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccsc2)CC1	ZINC001045437642	766306461	/nfs/dbraw/zinc/30/64/61/766306461.db2.gz	WQKOFXAPABEFLZ-CHWSQXEVSA-N	1	1	323.418	1.884	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CC1CC(C)(C)C1	ZINC001132771550	769176951	/nfs/dbraw/zinc/17/69/51/769176951.db2.gz	VBPFAYQULZQRRU-UHFFFAOYSA-N	1	1	323.397	1.360	20	5		DDBDMO
Cc1cc(NCCNC(=O)C[N@H+](C)C(C)C)ncc1[N+](=O)[O-]	ZINC001093674053	774989026	/nfs/dbraw/zinc/98/90/26/774989026.db2.gz	LWFSVPRRILUITB-UHFFFAOYSA-N	1	1	309.370	1.167	20	5		DDBDMO
Cc1nc(N(C)CCNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC001100149803	775735172	/nfs/dbraw/zinc/73/51/72/775735172.db2.gz	QPXAVAIAUDGFNE-UHFFFAOYSA-N	1	1	323.397	1.191	20	5		DDBDMO
CCN(CCNC(=O)CC[N@@H+](C)CC)c1ncccc1[N+](=O)[O-]	ZINC001100607394	776359393	/nfs/dbraw/zinc/35/93/93/776359393.db2.gz	YQFIJCKILGYJGO-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C[C@@H](O)CO)C(C)(C)C	ZINC001173222150	777055148	/nfs/dbraw/zinc/05/51/48/777055148.db2.gz	PNQWIGZJUBOLLT-IUODEOHRSA-N	1	1	310.394	1.980	20	5		DDBDMO
COC(=O)CO[C@H]1CC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001173232453	777063537	/nfs/dbraw/zinc/06/35/37/777063537.db2.gz	BLYAJHCEVDEJJQ-DOMZBBRYSA-N	1	1	322.361	1.790	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C(C)(C)C1	ZINC001178860599	779214472	/nfs/dbraw/zinc/21/44/72/779214472.db2.gz	GFNDWRYQWJKZDM-LLVKDONJSA-N	1	1	308.338	1.156	20	5		DDBDMO
COC(=O)c1cc(NC(=O)Cn2c[nH+]cc2C)cc([N+](=O)[O-])c1	ZINC001360572354	881380708	/nfs/dbraw/zinc/38/07/08/881380708.db2.gz	CSKOESLLZYTERI-UHFFFAOYSA-N	1	1	318.289	1.525	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1C[C@@H]2C)c1ccc([N+](=O)[O-])cc1	ZINC001124020136	859530147	/nfs/dbraw/zinc/53/01/47/859530147.db2.gz	OOAJUAZQBRSMDJ-HUBLWGQQSA-N	1	1	318.377	1.160	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C2(CCCC2)C1	ZINC001158408441	864634249	/nfs/dbraw/zinc/63/42/49/864634249.db2.gz	JIYGQWOHSQEYNH-UHFFFAOYSA-N	1	1	321.337	1.963	20	5		DDBDMO
Cc1ccc(C[N@H+](C)CCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c(C)c1	ZINC001320000597	866425100	/nfs/dbraw/zinc/42/51/00/866425100.db2.gz	VCLOHUDHFZKDDF-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1	ZINC001320000597	866425114	/nfs/dbraw/zinc/42/51/14/866425114.db2.gz	VCLOHUDHFZKDDF-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1ccc(C[N@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1	ZINC001320000597	866425124	/nfs/dbraw/zinc/42/51/24/866425124.db2.gz	VCLOHUDHFZKDDF-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
COc1nc(N[C@]2(C)CCC[N@@H+](C)C2)nc(OC)c1[N+](=O)[O-]	ZINC001162341389	867473846	/nfs/dbraw/zinc/47/38/46/867473846.db2.gz	MARDQGXSGPMDQR-CYBMUJFWSA-N	1	1	311.342	1.298	20	5		DDBDMO
Cc1ccnc(N2CC([C@H]([NH3+])C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-]	ZINC001163118340	868117972	/nfs/dbraw/zinc/11/79/72/868117972.db2.gz	XERMYRYPQFVLCW-NSHDSACASA-N	1	1	322.365	1.403	20	5		DDBDMO
COC(=O)/C(C)=C/C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001307999815	871463216	/nfs/dbraw/zinc/46/32/16/871463216.db2.gz	OTXNXEJAUUIDTA-XKOZXHHJSA-N	1	1	308.334	1.511	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC001310993119	871667526	/nfs/dbraw/zinc/66/75/26/871667526.db2.gz	WWHAWJNIEZZPSV-NDMJEZRESA-N	1	1	319.365	1.639	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC001348747747	874757691	/nfs/dbraw/zinc/75/76/91/874757691.db2.gz	PBKDVQJZQYUTPO-YNEHKIRRSA-N	1	1	318.377	1.463	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+]1C1CCCC1	ZINC001350603643	875782112	/nfs/dbraw/zinc/78/21/12/875782112.db2.gz	WIPJIKGJGNQGND-SNVBAGLBSA-N	1	1	307.354	1.407	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(C(=O)c4cc([N+](=O)[O-])n[nH]4)C[C@]2(C1)CCCC3	ZINC001353956116	877662832	/nfs/dbraw/zinc/66/28/32/877662832.db2.gz	UUMCTQXSYUECMP-GASCZTMLSA-N	1	1	319.365	1.266	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](OCCc3ccc([N+](=O)[O-])cc3)[C@H]1CC(=O)C2	ZINC001224331282	881331573	/nfs/dbraw/zinc/33/15/73/881331573.db2.gz	ONZDRETXIYNMIX-NUEKZKHPSA-N	1	1	304.346	1.958	20	5		DDBDMO
C[N@H+]1CC[C@H](Oc2cc(Br)cnc2[N+](=O)[O-])C1	ZINC001229562773	884049361	/nfs/dbraw/zinc/04/93/61/884049361.db2.gz	IDAAMETVTURVOD-QMMMGPOBSA-N	1	1	302.128	1.835	20	5		DDBDMO
C[C@@H](CNC(=O)c1cnc(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1	ZINC001290900461	913536549	/nfs/dbraw/zinc/53/65/49/913536549.db2.gz	UYGRNIOCIRWHMR-MNOVXSKESA-N	1	1	321.381	1.422	20	5		DDBDMO
CCN(CC)CCNC(=[NH2+])N[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254550243	896498765	/nfs/dbraw/zinc/49/87/65/896498765.db2.gz	GIYBPKIPBLLYBC-CYBMUJFWSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](O)[C@](C)(CO)C1	ZINC001254553819	896499329	/nfs/dbraw/zinc/49/93/29/896499329.db2.gz	ZQALIKTUIKTVQP-KCXAZCMYSA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001254564401	896501631	/nfs/dbraw/zinc/50/16/31/896501631.db2.gz	LNDLKGKDQROGFX-OCCSQVGLSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001254564401	896501643	/nfs/dbraw/zinc/50/16/43/896501643.db2.gz	LNDLKGKDQROGFX-OCCSQVGLSA-N	1	1	319.361	1.069	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254605018	896528029	/nfs/dbraw/zinc/52/80/29/896528029.db2.gz	ZTGIHZHPVJIJNU-WFASDCNBSA-N	1	1	304.346	1.947	20	5		DDBDMO
Cc1cc(NC(=O)[C@@H]2C[N@@H+]3CCN2C[C@H]3C)cc([N+](=O)[O-])c1	ZINC001264010943	900870853	/nfs/dbraw/zinc/87/08/53/900870853.db2.gz	QHRXEGHCDZKFKE-RISCZKNCSA-N	1	1	304.350	1.230	20	5		DDBDMO
CCc1onc(C)c1C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001265843205	902478069	/nfs/dbraw/zinc/47/80/69/902478069.db2.gz	WVOFWAWXHANOSC-DGCLKSJQSA-N	1	1	324.381	1.149	20	5		DDBDMO
CCc1onc(C)c1C[N@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001265843205	902478079	/nfs/dbraw/zinc/47/80/79/902478079.db2.gz	WVOFWAWXHANOSC-DGCLKSJQSA-N	1	1	324.381	1.149	20	5		DDBDMO
CCc1onc(C)c1C[N@@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001265843205	902478089	/nfs/dbraw/zinc/47/80/89/902478089.db2.gz	WVOFWAWXHANOSC-DGCLKSJQSA-N	1	1	324.381	1.149	20	5		DDBDMO
CC(C)n1ccc(CN(C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])n1	ZINC001265843014	902478784	/nfs/dbraw/zinc/47/87/84/902478784.db2.gz	SSJBYWPSFGWHAD-ZIAGYGMSSA-N	1	1	323.397	1.067	20	5		DDBDMO
COCCCC[NH+]1CCC(N(C)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001266181827	903074185	/nfs/dbraw/zinc/07/41/85/903074185.db2.gz	RCOBVLKCIHMRFX-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC001297105294	916729270	/nfs/dbraw/zinc/72/92/70/916729270.db2.gz	SUWDZPGXBLHUEC-UHFFFAOYSA-N	1	1	314.305	1.292	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O	ZINC000305361550	231003836	/nfs/dbraw/zinc/00/38/36/231003836.db2.gz	UEYDNHKERNMGSR-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1	ZINC000249478133	282159002	/nfs/dbraw/zinc/15/90/02/282159002.db2.gz	AKILFUQAIZUYFN-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000319016653	231179052	/nfs/dbraw/zinc/17/90/52/231179052.db2.gz	CPKLVXMJPCGWLS-WCBMZHEXSA-N	1	1	310.329	1.529	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCCC3(C2)OCCO3)cc1	ZINC000090562885	185303939	/nfs/dbraw/zinc/30/39/39/185303939.db2.gz	WSMXXARGADBZBR-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCCC3(C2)OCCO3)cc1	ZINC000090562885	185303940	/nfs/dbraw/zinc/30/39/40/185303940.db2.gz	WSMXXARGADBZBR-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413105326	529790057	/nfs/dbraw/zinc/79/00/57/529790057.db2.gz	NNNICOXQNNRSTC-CYBMUJFWSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413105326	529790058	/nfs/dbraw/zinc/79/00/58/529790058.db2.gz	NNNICOXQNNRSTC-CYBMUJFWSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985270	529809733	/nfs/dbraw/zinc/80/97/33/529809733.db2.gz	TZOSZQQBOBTPFZ-CVEARBPZSA-N	1	1	305.378	1.628	20	5		DDBDMO
CN1CC[C@](O)(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985270	529809734	/nfs/dbraw/zinc/80/97/34/529809734.db2.gz	TZOSZQQBOBTPFZ-CVEARBPZSA-N	1	1	305.378	1.628	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286654072	219105797	/nfs/dbraw/zinc/10/57/97/219105797.db2.gz	UHYODYGAFIUJQW-ZLKJLUDKSA-N	1	1	307.350	1.767	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444669938	529852172	/nfs/dbraw/zinc/85/21/72/529852172.db2.gz	XIEBLQXWUCZSBY-UHFFFAOYSA-N	1	1	305.338	1.429	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])c[nH]c3=O)C2)C1	ZINC000295642027	530065196	/nfs/dbraw/zinc/06/51/96/530065196.db2.gz	QUZPNDQGUFOSSN-HNNXBMFYSA-N	1	1	320.349	1.253	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1cccc(F)c1	ZINC000358278069	299112408	/nfs/dbraw/zinc/11/24/08/299112408.db2.gz	UGRTVRGUXSHNQV-UHFFFAOYSA-N	1	1	321.312	1.501	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1cccc(F)c1	ZINC000358278069	299112409	/nfs/dbraw/zinc/11/24/09/299112409.db2.gz	UGRTVRGUXSHNQV-UHFFFAOYSA-N	1	1	321.312	1.501	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(c2[nH]cc[nH+]2)CC1	ZINC000299482667	282379416	/nfs/dbraw/zinc/37/94/16/282379416.db2.gz	DBMMJMDLMBIHIA-UHFFFAOYSA-N	1	1	316.321	1.196	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649278	210054466	/nfs/dbraw/zinc/05/44/66/210054466.db2.gz	ZAFAHVRAPVPCEE-YPMHNXCESA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649278	210054470	/nfs/dbraw/zinc/05/44/70/210054470.db2.gz	ZAFAHVRAPVPCEE-YPMHNXCESA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](O)C(C)(C)C1	ZINC000279790386	215148436	/nfs/dbraw/zinc/14/84/36/215148436.db2.gz	OGTRKTFUTSUYRQ-AWEZNQCLSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)N1CCCC1	ZINC000055900137	352749415	/nfs/dbraw/zinc/74/94/15/352749415.db2.gz	VMYREODTRQFECT-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCCC[NH+]2CCOCC2)c1	ZINC000060064461	352864547	/nfs/dbraw/zinc/86/45/47/352864547.db2.gz	MXFLHOZCADJFCB-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000064334022	352933802	/nfs/dbraw/zinc/93/38/02/352933802.db2.gz	CFPNLPUTFBOTBO-UONOGXRCSA-N	1	1	319.361	1.496	20	5		DDBDMO
COCCC[N@@H+](CCOC)CCOc1ccc([N+](=O)[O-])cc1	ZINC000065535869	352954410	/nfs/dbraw/zinc/95/44/10/352954410.db2.gz	XYJXKOPEKMZPTP-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000069502707	353164023	/nfs/dbraw/zinc/16/40/23/353164023.db2.gz	XIQBPKSNGCSNLQ-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C[C@@H](C)O	ZINC000174613051	198359357	/nfs/dbraw/zinc/35/93/57/198359357.db2.gz	XWXODMWXNBECOU-OLZOCXBDSA-N	1	1	321.377	1.512	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000174613051	198359358	/nfs/dbraw/zinc/35/93/58/198359358.db2.gz	XWXODMWXNBECOU-OLZOCXBDSA-N	1	1	321.377	1.512	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[NH+](Cc2cccs2)CC1	ZINC000355791901	291008663	/nfs/dbraw/zinc/00/86/63/291008663.db2.gz	ILMSACBXVCNRDX-UHFFFAOYSA-N	1	1	321.406	1.708	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCN1CCCC1=O	ZINC000112703456	353973863	/nfs/dbraw/zinc/97/38/63/353973863.db2.gz	SCHZYEKRNHQHRV-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000124876557	354042065	/nfs/dbraw/zinc/04/20/65/354042065.db2.gz	FFKVGDUWMIBWBY-RKDXNWHRSA-N	1	1	317.342	1.282	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC000142296427	354144052	/nfs/dbraw/zinc/14/40/52/354144052.db2.gz	VLAJBSFQLIVREI-AWEZNQCLSA-N	1	1	303.362	1.834	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739852	354201221	/nfs/dbraw/zinc/20/12/21/354201221.db2.gz	DYOOXXGQBNOPRR-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739852	354201223	/nfs/dbraw/zinc/20/12/23/354201223.db2.gz	DYOOXXGQBNOPRR-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C[C@@H](O)C2CC2)c([N+](=O)[O-])c1	ZINC000156639114	354220781	/nfs/dbraw/zinc/22/07/81/354220781.db2.gz	OWJUIELAOGZCLH-CQSZACIVSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@@H](O)C2CC2)c([N+](=O)[O-])c1	ZINC000156639114	354220783	/nfs/dbraw/zinc/22/07/83/354220783.db2.gz	OWJUIELAOGZCLH-CQSZACIVSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H](O)C[C@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157105236	354223154	/nfs/dbraw/zinc/22/31/54/354223154.db2.gz	SINQPIQYFFDDFG-HIFRSBDPSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H](O)C[C@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157105236	354223157	/nfs/dbraw/zinc/22/31/57/354223157.db2.gz	SINQPIQYFFDDFG-HIFRSBDPSA-N	1	1	324.377	1.835	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587986644	354888956	/nfs/dbraw/zinc/88/89/56/354888956.db2.gz	FLIKTCIWMYSKKA-CYBMUJFWSA-N	1	1	322.409	1.980	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](OC)C2)c1	ZINC000589495778	354996268	/nfs/dbraw/zinc/99/62/68/354996268.db2.gz	LWPMAFMIKQRKIA-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](OC)C2)c1	ZINC000589495778	354996271	/nfs/dbraw/zinc/99/62/71/354996271.db2.gz	LWPMAFMIKQRKIA-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H]2CCOC2)c1	ZINC000589502768	354996912	/nfs/dbraw/zinc/99/69/12/354996912.db2.gz	JLAOVMRCWFRITN-LLVKDONJSA-N	1	1	308.334	1.850	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]([C@@H](C)O)C2)c1	ZINC000589510901	354997627	/nfs/dbraw/zinc/99/76/27/354997627.db2.gz	UNJXPNISUIDLIX-PWSUYJOCSA-N	1	1	308.334	1.584	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000590046695	355043393	/nfs/dbraw/zinc/04/33/93/355043393.db2.gz	MMNCGAYGBVSGDE-UKRRQHHQSA-N	1	1	303.362	1.608	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590441567	355095477	/nfs/dbraw/zinc/09/54/77/355095477.db2.gz	DAKPKNWYHNDAFA-BXUZGUMPSA-N	1	1	304.350	1.413	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000590443455	355097487	/nfs/dbraw/zinc/09/74/87/355097487.db2.gz	KKVUJZJVTKDJAD-GWCFXTLKSA-N	1	1	304.350	1.413	20	5		DDBDMO
[NH3+]CC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000592424741	355579323	/nfs/dbraw/zinc/57/93/23/355579323.db2.gz	WPGOMLMSVIVUHF-UHFFFAOYSA-N	1	1	307.350	1.537	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](CC)CO1	ZINC000593058259	355782950	/nfs/dbraw/zinc/78/29/50/355782950.db2.gz	KBGSRWKILUBZRK-JSGCOSHPSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](CC)CO1	ZINC000593058259	355782954	/nfs/dbraw/zinc/78/29/54/355782954.db2.gz	KBGSRWKILUBZRK-JSGCOSHPSA-N	1	1	309.366	1.646	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000593066743	355785517	/nfs/dbraw/zinc/78/55/17/355785517.db2.gz	REPBQTHQZQZQRY-VXGBXAGGSA-N	1	1	300.742	1.830	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000593066743	355785518	/nfs/dbraw/zinc/78/55/18/355785518.db2.gz	REPBQTHQZQZQRY-VXGBXAGGSA-N	1	1	300.742	1.830	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)CCO	ZINC000593108186	355801111	/nfs/dbraw/zinc/80/11/11/355801111.db2.gz	URBKETARKJQCOP-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)CCO	ZINC000593108186	355801115	/nfs/dbraw/zinc/80/11/15/355801115.db2.gz	URBKETARKJQCOP-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C2)C1	ZINC000593161975	355814996	/nfs/dbraw/zinc/81/49/96/355814996.db2.gz	FUUCGSMJOISTBE-MRXNPFEDSA-N	1	1	321.352	1.831	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000593519260	355911367	/nfs/dbraw/zinc/91/13/67/355911367.db2.gz	YCJKUDSCFYYYHG-UHFFFAOYSA-N	1	1	323.393	1.688	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])C1CC1	ZINC000593450254	355888718	/nfs/dbraw/zinc/88/87/18/355888718.db2.gz	JLONAKFRJWLQFE-UHFFFAOYSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000593485964	355900451	/nfs/dbraw/zinc/90/04/51/355900451.db2.gz	DRZSJBMUUCYXHG-GWCFXTLKSA-N	1	1	309.341	1.875	20	5		DDBDMO
C[C@H](CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])[NH+](C)C	ZINC000594817379	356326210	/nfs/dbraw/zinc/32/62/10/356326210.db2.gz	QLSSNXZGFXLQKX-SECBINFHSA-N	1	1	319.358	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)CC1C[NH+](C)C1	ZINC000594846476	356335137	/nfs/dbraw/zinc/33/51/37/356335137.db2.gz	JNHWFUVNBWUCAQ-UHFFFAOYSA-N	1	1	313.379	1.085	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)CN1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000595425013	356487308	/nfs/dbraw/zinc/48/73/08/356487308.db2.gz	QUUPAXKJVJIZLP-CQSZACIVSA-N	1	1	308.382	1.049	20	5		DDBDMO
COC[C@](C)(CC(=O)OC)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595384343	356473644	/nfs/dbraw/zinc/47/36/44/356473644.db2.gz	JBSLOGKHDREVAE-AWEZNQCLSA-N	1	1	314.313	1.792	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595742434	356631126	/nfs/dbraw/zinc/63/11/26/356631126.db2.gz	GMDNDLJIJKUQOS-IJLUTSLNSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@H]1COCCO1	ZINC000595742127	356631567	/nfs/dbraw/zinc/63/15/67/356631567.db2.gz	ODPMDWFNFBDSCN-CQSZACIVSA-N	1	1	324.333	1.309	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@H]1COCCO1	ZINC000595742127	356631572	/nfs/dbraw/zinc/63/15/72/356631572.db2.gz	ODPMDWFNFBDSCN-CQSZACIVSA-N	1	1	324.333	1.309	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H]3NC(=O)CC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000595728781	356625178	/nfs/dbraw/zinc/62/51/78/356625178.db2.gz	OWHMWUFJAAJYAS-CHWSQXEVSA-N	1	1	319.361	1.704	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595766830	356643825	/nfs/dbraw/zinc/64/38/25/356643825.db2.gz	RSELMDFXVOYNNE-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595766830	356643830	/nfs/dbraw/zinc/64/38/30/356643830.db2.gz	RSELMDFXVOYNNE-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595760050	356640971	/nfs/dbraw/zinc/64/09/71/356640971.db2.gz	RWXVRWRSACDOHN-MLGOLLRUSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595760050	356640976	/nfs/dbraw/zinc/64/09/76/356640976.db2.gz	RWXVRWRSACDOHN-MLGOLLRUSA-N	1	1	319.361	1.810	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H]2C[C@@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595807864	356658619	/nfs/dbraw/zinc/65/86/19/356658619.db2.gz	BGQWFPWGPWOGTK-DGCLKSJQSA-N	1	1	301.346	1.826	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]2C[C@@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595807864	356658620	/nfs/dbraw/zinc/65/86/20/356658620.db2.gz	BGQWFPWGPWOGTK-DGCLKSJQSA-N	1	1	301.346	1.826	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595868888	356684972	/nfs/dbraw/zinc/68/49/72/356684972.db2.gz	BYLHVNQMQXXRLP-HWWQOWPSSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595868888	356684977	/nfs/dbraw/zinc/68/49/77/356684977.db2.gz	BYLHVNQMQXXRLP-HWWQOWPSSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[NH2+]C[C@@H]1CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237127765	202160658	/nfs/dbraw/zinc/16/06/58/202160658.db2.gz	YEQZPKHDFGSMRS-JTQLQIEISA-N	1	1	303.322	1.295	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC(C[NH+]3CCOCC3)C2)n1	ZINC000596239473	356829068	/nfs/dbraw/zinc/82/90/68/356829068.db2.gz	ITJPCFBRAIVTJF-UHFFFAOYSA-N	1	1	306.366	1.375	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596133999	356785625	/nfs/dbraw/zinc/78/56/25/356785625.db2.gz	BSUIZJBFIPJYAB-AWEZNQCLSA-N	1	1	306.366	1.470	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000596137430	356787153	/nfs/dbraw/zinc/78/71/53/356787153.db2.gz	UUXQUAMKBYKPCS-UHFFFAOYSA-N	1	1	322.756	1.703	20	5		DDBDMO
Cn1c(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-]	ZINC000597714734	357298686	/nfs/dbraw/zinc/29/86/86/357298686.db2.gz	ISDRSLTUWYUEKA-OAHLLOKOSA-N	1	1	306.366	1.491	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597714170	357298870	/nfs/dbraw/zinc/29/88/70/357298870.db2.gz	HAIGTEOVKIDQSW-AWEZNQCLSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597714170	357298875	/nfs/dbraw/zinc/29/88/75/357298875.db2.gz	HAIGTEOVKIDQSW-AWEZNQCLSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597714170	357298878	/nfs/dbraw/zinc/29/88/78/357298878.db2.gz	HAIGTEOVKIDQSW-AWEZNQCLSA-N	1	1	307.354	1.184	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000598451608	357588099	/nfs/dbraw/zinc/58/80/99/357588099.db2.gz	CCBLCBLYKMEMCV-CYBMUJFWSA-N	1	1	319.361	1.266	20	5		DDBDMO
[NH3+][C@]12CCC[C@H]1CN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2	ZINC000598668055	357678172	/nfs/dbraw/zinc/67/81/72/357678172.db2.gz	OOELQRKTFWLWFA-VFZGTOFNSA-N	1	1	315.333	1.425	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000598600354	357648705	/nfs/dbraw/zinc/64/87/05/357648705.db2.gz	AVUSQFCIORDKOK-NXEZZACHSA-N	1	1	320.349	1.814	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599674127	358019521	/nfs/dbraw/zinc/01/95/21/358019521.db2.gz	YUTVNKOZJXRCHM-XBXGTLAGSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000180006528	199105441	/nfs/dbraw/zinc/10/54/41/199105441.db2.gz	JKGBWKCROZKPNB-LLVKDONJSA-N	1	1	321.333	1.538	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000599937114	358085156	/nfs/dbraw/zinc/08/51/56/358085156.db2.gz	DTRFOQPGDIQBCH-JSGCOSHPSA-N	1	1	323.324	1.015	20	5		DDBDMO
NC(=O)[C@H]1CN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[NH2+]1	ZINC000274563506	283355685	/nfs/dbraw/zinc/35/56/85/283355685.db2.gz	BSVUJJSGNQSMQH-SECBINFHSA-N	1	1	319.148	1.165	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000600836793	358329399	/nfs/dbraw/zinc/32/93/99/358329399.db2.gz	CFALFRGMLKDFCU-NSHDSACASA-N	1	1	320.349	1.442	20	5		DDBDMO
CC(C)[NH+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1	ZINC000601102667	358402582	/nfs/dbraw/zinc/40/25/82/358402582.db2.gz	CNKJORODNHLUEN-UHFFFAOYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CN1CCOC[C@@H]1CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601203505	358445874	/nfs/dbraw/zinc/44/58/74/358445874.db2.gz	RRNBGNZLDLWQAH-LBPRGKRZSA-N	1	1	302.334	1.307	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[C@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601136387	358416958	/nfs/dbraw/zinc/41/69/58/358416958.db2.gz	QNCCGBFQAOPMAV-BXUZGUMPSA-N	1	1	314.345	1.892	20	5		DDBDMO
C=Cn1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC000601149134	358422275	/nfs/dbraw/zinc/42/22/75/358422275.db2.gz	JFZJWUJUXIQJKC-OAHLLOKOSA-N	1	1	302.334	1.889	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601158491	358426096	/nfs/dbraw/zinc/42/60/96/358426096.db2.gz	UBDLUOJVHBHYGZ-UHFFFAOYSA-N	1	1	313.354	1.513	20	5		DDBDMO
COC[C@]1(CO)CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1	ZINC000601172130	358432194	/nfs/dbraw/zinc/43/21/94/358432194.db2.gz	VLXHNBMZHJZGSE-MRXNPFEDSA-N	1	1	317.345	1.978	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@H](CO)C1	ZINC000601980391	358764849	/nfs/dbraw/zinc/76/48/49/358764849.db2.gz	VCMYZAOQJUVPOE-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@H](CO)C1	ZINC000601980391	358764852	/nfs/dbraw/zinc/76/48/52/358764852.db2.gz	VCMYZAOQJUVPOE-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
COc1ccc(CNC(=O)C[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000602080590	358803671	/nfs/dbraw/zinc/80/36/71/358803671.db2.gz	PYFUYWQILCYTSC-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)CC(C)(C)C	ZINC000602135231	358836619	/nfs/dbraw/zinc/83/66/19/358836619.db2.gz	YXFPHVWVEUBXNM-UHFFFAOYSA-N	1	1	320.393	1.852	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])n1	ZINC000602476911	359003896	/nfs/dbraw/zinc/00/38/96/359003896.db2.gz	XTHGIVIPWASGJC-LBPRGKRZSA-N	1	1	321.381	1.163	20	5		DDBDMO
COC(=O)COc1ccc(C[NH2+]C2(C)COC2)cc1[N+](=O)[O-]	ZINC000602739962	359159432	/nfs/dbraw/zinc/15/94/32/359159432.db2.gz	OGGYGUGSKNZRSV-UHFFFAOYSA-N	1	1	310.306	1.025	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817620	359212992	/nfs/dbraw/zinc/21/29/92/359212992.db2.gz	USJQETZMWDBZPX-BZPMIXESSA-N	1	1	322.365	1.373	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817620	359212996	/nfs/dbraw/zinc/21/29/96/359212996.db2.gz	USJQETZMWDBZPX-BZPMIXESSA-N	1	1	322.365	1.373	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](CO)C1	ZINC000602931189	359300509	/nfs/dbraw/zinc/30/05/09/359300509.db2.gz	MJZOEUBALIEKHX-VHDGCEQUSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000602959328	359322790	/nfs/dbraw/zinc/32/27/90/359322790.db2.gz	SUJPMPJAUBQYMH-RYUDHWBXSA-N	1	1	321.381	1.667	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000187152956	200069017	/nfs/dbraw/zinc/06/90/17/200069017.db2.gz	YMTUUGVSDHYAAQ-SNVBAGLBSA-N	1	1	308.338	1.109	20	5		DDBDMO
CCO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000604436832	359750759	/nfs/dbraw/zinc/75/07/59/359750759.db2.gz	ASQVPBYQBVPZDN-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(=O)c1ccc(NCC[N@@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000188490099	200255051	/nfs/dbraw/zinc/25/50/51/200255051.db2.gz	WCEBFDXGWTXUQI-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CC(=O)c1ccc(NCC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000188490099	200255052	/nfs/dbraw/zinc/25/50/52/200255052.db2.gz	WCEBFDXGWTXUQI-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
COc1ccc(CC(=O)NCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000609044868	360257968	/nfs/dbraw/zinc/25/79/68/360257968.db2.gz	YTDGIKCIIINLBG-UHFFFAOYSA-N	1	1	318.333	1.467	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000189655515	200433483	/nfs/dbraw/zinc/43/34/83/200433483.db2.gz	XXJNXROHGCNSKT-HOCLYGCPSA-N	1	1	324.377	1.571	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000609269196	360285961	/nfs/dbraw/zinc/28/59/61/360285961.db2.gz	NABOLXQAHSWWKM-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000609594379	360331046	/nfs/dbraw/zinc/33/10/46/360331046.db2.gz	IWPJLKXTMGJXSH-GFCCVEGCSA-N	1	1	308.382	1.928	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])s3)CC2)C1	ZINC000609675065	360343051	/nfs/dbraw/zinc/34/30/51/360343051.db2.gz	RFMBUGPEENNJKI-GFCCVEGCSA-N	1	1	310.423	1.873	20	5		DDBDMO
Cc1cnc(N2CCC([N@@H+](C)CCCO)CC2)c([N+](=O)[O-])c1	ZINC000610283985	360408909	/nfs/dbraw/zinc/40/89/09/360408909.db2.gz	LREILMQQVXALGS-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H](C(F)F)C2)c1	ZINC000611180230	360651952	/nfs/dbraw/zinc/65/19/52/360651952.db2.gz	VGILWVDWTVSJCA-ZYHUDNBSSA-N	1	1	316.304	1.922	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1C	ZINC000611087679	360619025	/nfs/dbraw/zinc/61/90/25/360619025.db2.gz	CEWKGZYAPWDYHL-LBPRGKRZSA-N	1	1	305.378	1.998	20	5		DDBDMO
CC[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611092572	360621502	/nfs/dbraw/zinc/62/15/02/360621502.db2.gz	ZXWZEJLEPRSPTL-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611092572	360621506	/nfs/dbraw/zinc/62/15/06/360621506.db2.gz	ZXWZEJLEPRSPTL-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611092572	360621510	/nfs/dbraw/zinc/62/15/10/360621510.db2.gz	ZXWZEJLEPRSPTL-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[N@H+]1CCN([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611092297	360621962	/nfs/dbraw/zinc/62/19/62/360621962.db2.gz	ODQPXSBFMFBKHQ-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
CCOCC[NH+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000611616154	360777302	/nfs/dbraw/zinc/77/73/02/360777302.db2.gz	QXZMKCZXDFARRI-UHFFFAOYSA-N	1	1	308.382	1.765	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1	ZINC000292596651	223164642	/nfs/dbraw/zinc/16/46/42/223164642.db2.gz	RIQXUGDPVHDKBY-OAHLLOKOSA-N	1	1	321.381	1.044	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619253068	363946666	/nfs/dbraw/zinc/94/66/66/363946666.db2.gz	QYEQFLJPDWXFFL-UONOGXRCSA-N	1	1	307.325	1.853	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000264593105	204014694	/nfs/dbraw/zinc/01/46/94/204014694.db2.gz	LUHWOTJXLCGPDA-LBPRGKRZSA-N	1	1	308.338	1.437	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000264675708	204071962	/nfs/dbraw/zinc/07/19/62/204071962.db2.gz	NJQPREXYZTUGOQ-UHFFFAOYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000264675708	204071965	/nfs/dbraw/zinc/07/19/65/204071965.db2.gz	NJQPREXYZTUGOQ-UHFFFAOYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc([N+](=O)[O-])c2cccnc12	ZINC000264821338	204183949	/nfs/dbraw/zinc/18/39/49/204183949.db2.gz	XUCLYZWBXHSKLE-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000264821338	204183951	/nfs/dbraw/zinc/18/39/51/204183951.db2.gz	XUCLYZWBXHSKLE-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000264821338	204183954	/nfs/dbraw/zinc/18/39/54/204183954.db2.gz	XUCLYZWBXHSKLE-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=C(N[C@@H](CO)C[NH+]1CCCCC1)c1ccc([N+](=O)[O-])s1	ZINC000288499352	220182242	/nfs/dbraw/zinc/18/22/42/220182242.db2.gz	MJFGACROHXRHEX-SNVBAGLBSA-N	1	1	313.379	1.233	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000267660626	206202879	/nfs/dbraw/zinc/20/28/79/206202879.db2.gz	ZKFPPDTWCDGLCT-UONOGXRCSA-N	1	1	323.393	1.281	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCC2)CC1	ZINC000566960567	304189638	/nfs/dbraw/zinc/18/96/38/304189638.db2.gz	QAUGPVQYHJKMRP-UHFFFAOYSA-N	1	1	307.354	1.266	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc([N+](=O)[O-])cc2C)[N@@H+](C)C1	ZINC000284569737	218081985	/nfs/dbraw/zinc/08/19/85/218081985.db2.gz	HRZFEQSRBSLGQL-KBPBESRZSA-N	1	1	321.377	1.694	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc([N+](=O)[O-])s2)[N@H+](C)C1	ZINC000284747219	218161184	/nfs/dbraw/zinc/16/11/84/218161184.db2.gz	VGVKQPNCOCSGPH-UWVGGRQHSA-N	1	1	313.379	1.447	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc([N+](=O)[O-])s2)[N@@H+](C)C1	ZINC000284747219	218161186	/nfs/dbraw/zinc/16/11/86/218161186.db2.gz	VGVKQPNCOCSGPH-UWVGGRQHSA-N	1	1	313.379	1.447	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000284794152	218180234	/nfs/dbraw/zinc/18/02/34/218180234.db2.gz	OERPLHXNHHGJDD-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000105825723	194138085	/nfs/dbraw/zinc/13/80/85/194138085.db2.gz	XGLYJJYLFLZQPJ-UKRRQHHQSA-N	1	1	307.394	1.872	20	5		DDBDMO
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)[C@H]1CSC[NH2+]1	ZINC000269071101	207219917	/nfs/dbraw/zinc/21/99/17/207219917.db2.gz	FHOOCIIVLCFYFP-SNVBAGLBSA-N	1	1	301.755	1.527	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269110142	207249541	/nfs/dbraw/zinc/24/95/41/207249541.db2.gz	IESJCWOIFWESRD-QWRGUYRKSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269110142	207249544	/nfs/dbraw/zinc/24/95/44/207249544.db2.gz	IESJCWOIFWESRD-QWRGUYRKSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269110142	207249548	/nfs/dbraw/zinc/24/95/48/207249548.db2.gz	IESJCWOIFWESRD-QWRGUYRKSA-N	1	1	307.354	1.183	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@@H]1[NH3+]	ZINC000269175281	207296665	/nfs/dbraw/zinc/29/66/65/207296665.db2.gz	BMJWXEPDFSPFTO-KCJUWKMLSA-N	1	1	303.322	1.280	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](CCO)CC2CC2)cccc1[N+](=O)[O-]	ZINC000352468814	285073204	/nfs/dbraw/zinc/07/32/04/285073204.db2.gz	VBJDIYPMSQTOLY-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000120177638	195111760	/nfs/dbraw/zinc/11/17/60/195111760.db2.gz	QXMPJEHRCLPCLP-UHFFFAOYSA-N	1	1	318.337	1.120	20	5		DDBDMO
C[C@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000288629308	220303533	/nfs/dbraw/zinc/30/35/33/220303533.db2.gz	SKVXXMAYMJRCQB-QPUJVOFHSA-N	1	1	318.782	1.771	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000157019864	197156301	/nfs/dbraw/zinc/15/63/01/197156301.db2.gz	PBCGEQMXEZFIFI-TZMCWYRMSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@@H]1O	ZINC000352657689	285201763	/nfs/dbraw/zinc/20/17/63/285201763.db2.gz	BYTRMFTTXVUSFK-KBPBESRZSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000120824618	195244959	/nfs/dbraw/zinc/24/49/59/195244959.db2.gz	ISKSAPBSEQVQAI-LLVKDONJSA-N	1	1	322.365	1.546	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1cc(C)c([N+](=O)[O-])cn1)C(C)C	ZINC000294970200	224349224	/nfs/dbraw/zinc/34/92/24/224349224.db2.gz	NZOCSNJWYBKSFW-AWEZNQCLSA-N	1	1	324.381	1.887	20	5		DDBDMO
CCS(=O)(=O)C[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC	ZINC000121050512	195287717	/nfs/dbraw/zinc/28/77/17/195287717.db2.gz	XZNJMDSYPGPRAK-JTQLQIEISA-N	1	1	316.379	1.516	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[NH+](C)CC1	ZINC000121122169	195295937	/nfs/dbraw/zinc/29/59/37/195295937.db2.gz	IIBRPTDJDUMYMC-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000360985588	299787577	/nfs/dbraw/zinc/78/75/77/299787577.db2.gz	PGQIZOMNZUFCKT-CYBMUJFWSA-N	1	1	323.397	1.278	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000073991418	406898166	/nfs/dbraw/zinc/89/81/66/406898166.db2.gz	WHVJUKOBDKNFMQ-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000073991418	406898169	/nfs/dbraw/zinc/89/81/69/406898169.db2.gz	WHVJUKOBDKNFMQ-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000073991418	406898170	/nfs/dbraw/zinc/89/81/70/406898170.db2.gz	WHVJUKOBDKNFMQ-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
COCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)C	ZINC000026450232	406904824	/nfs/dbraw/zinc/90/48/24/406904824.db2.gz	JOJYPJAYVTVHJL-UHFFFAOYSA-N	1	1	309.366	1.798	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000090458479	407166982	/nfs/dbraw/zinc/16/69/82/407166982.db2.gz	AZIPGFODBMBENO-HUUCEWRRSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000090458479	407166985	/nfs/dbraw/zinc/16/69/85/407166985.db2.gz	AZIPGFODBMBENO-HUUCEWRRSA-N	1	1	319.361	1.578	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000123246790	407323782	/nfs/dbraw/zinc/32/37/82/407323782.db2.gz	WHTUENXVUYFUOZ-NEPJUHHUSA-N	1	1	323.397	1.468	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[NH+](C)CC1	ZINC000102677328	407325836	/nfs/dbraw/zinc/32/58/36/407325836.db2.gz	YVWFRDTVOUYCNB-NSHDSACASA-N	1	1	317.349	1.953	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271357146	407649656	/nfs/dbraw/zinc/64/96/56/407649656.db2.gz	FVTFYVODFCOMRK-GFCCVEGCSA-N	1	1	323.397	1.426	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000171402375	407678526	/nfs/dbraw/zinc/67/85/26/407678526.db2.gz	GPXQTIALDHCBTF-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000171402375	407678533	/nfs/dbraw/zinc/67/85/33/407678533.db2.gz	GPXQTIALDHCBTF-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
COc1ccc(C(=O)N(C)CC[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000186715202	407752725	/nfs/dbraw/zinc/75/27/25/407752725.db2.gz	YVNFKNOKBXMHBN-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000171651752	407733322	/nfs/dbraw/zinc/73/33/22/407733322.db2.gz	KFYBSRSFPXVESE-NSHDSACASA-N	1	1	313.379	1.185	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000171756289	407762403	/nfs/dbraw/zinc/76/24/03/407762403.db2.gz	XRYWMKUHTBHVAU-ZDUSSCGKSA-N	1	1	306.366	1.736	20	5		DDBDMO
COCC[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000117336216	407830509	/nfs/dbraw/zinc/83/05/09/407830509.db2.gz	WLGFQWUZOHLDAX-UHFFFAOYSA-N	1	1	309.322	1.471	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000187681835	407876277	/nfs/dbraw/zinc/87/62/77/407876277.db2.gz	GAVVBQOOGJOHDK-KGLIPLIRSA-N	1	1	307.394	1.963	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@H]1CCC[N@@H+]1C	ZINC000118107033	407891118	/nfs/dbraw/zinc/89/11/18/407891118.db2.gz	KIBXOIJXNGMCCE-GFCCVEGCSA-N	1	1	320.349	1.052	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)C[C@H]1C(C)C	ZINC000153770678	407897830	/nfs/dbraw/zinc/89/78/30/407897830.db2.gz	RGUCPRBJQNBCNY-ZDUSSCGKSA-N	1	1	323.397	1.288	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000153784860	407900419	/nfs/dbraw/zinc/90/04/19/407900419.db2.gz	WDIVRPSSFFXETD-BBRMVZONSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[C@H]1C[NH2+]CC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000262878594	407960740	/nfs/dbraw/zinc/96/07/40/407960740.db2.gz	VRYIFOJOOFWTRW-KWQFWETISA-N	1	1	303.322	1.199	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CCC(C[NH+]3CCCC3)CC2)c1	ZINC000174845265	407994328	/nfs/dbraw/zinc/99/43/28/407994328.db2.gz	QPMDJVUSLADMBZ-UHFFFAOYSA-N	1	1	307.398	1.599	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000272601489	408000131	/nfs/dbraw/zinc/00/01/31/408000131.db2.gz	HERRHLAHXCIDNP-SKDRFNHKSA-N	1	1	304.350	1.390	20	5		DDBDMO
Cc1c(C[NH+]2CCN(c3cnn(C)c3)CC2)cccc1[N+](=O)[O-]	ZINC000174906556	408003680	/nfs/dbraw/zinc/00/36/80/408003680.db2.gz	CFFPGHYWKYNWPP-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000273121060	408064116	/nfs/dbraw/zinc/06/41/16/408064116.db2.gz	HMMOILAFVIHNSM-MBNYWOFBSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000245764861	408064224	/nfs/dbraw/zinc/06/42/24/408064224.db2.gz	JEZKNLTWQLCCKI-NXEZZACHSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000245764861	408064229	/nfs/dbraw/zinc/06/42/29/408064229.db2.gz	JEZKNLTWQLCCKI-NXEZZACHSA-N	1	1	311.338	1.243	20	5		DDBDMO
COC(=O)c1cc(N2CCC[N@@H+](C)CC2)cc(C)c1[N+](=O)[O-]	ZINC000268518329	408081237	/nfs/dbraw/zinc/08/12/37/408081237.db2.gz	ZBQQDHXYAGQEQN-UHFFFAOYSA-N	1	1	307.350	1.832	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000154833232	408091141	/nfs/dbraw/zinc/09/11/41/408091141.db2.gz	QYKAKFJFIFGRCA-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000119581599	408099534	/nfs/dbraw/zinc/09/95/34/408099534.db2.gz	VLMKQDMUEHLALU-ZDUSSCGKSA-N	1	1	323.397	1.276	20	5		DDBDMO
CC(C)[N@H+](C)CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000155604293	408185650	/nfs/dbraw/zinc/18/56/50/408185650.db2.gz	HYSNCUWWFBGOFT-UHFFFAOYSA-N	1	1	319.358	1.352	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000155604293	408185655	/nfs/dbraw/zinc/18/56/55/408185655.db2.gz	HYSNCUWWFBGOFT-UHFFFAOYSA-N	1	1	319.358	1.352	20	5		DDBDMO
CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000151100592	408255307	/nfs/dbraw/zinc/25/53/07/408255307.db2.gz	YPRSQQCYOKACRS-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[NH+](C)C1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000273610056	408263533	/nfs/dbraw/zinc/26/35/33/408263533.db2.gz	TWIZKMUKRPYRKQ-UHFFFAOYSA-N	1	1	319.770	1.183	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC000263739977	408235956	/nfs/dbraw/zinc/23/59/56/408235956.db2.gz	OHBKVVRMCCAVGW-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488370	408326666	/nfs/dbraw/zinc/32/66/66/408326666.db2.gz	YCYXKXZYWNMJAA-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488370	408326669	/nfs/dbraw/zinc/32/66/69/408326669.db2.gz	YCYXKXZYWNMJAA-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000190851721	408330580	/nfs/dbraw/zinc/33/05/80/408330580.db2.gz	CPMRGUWYRXHPAV-NEPJUHHUSA-N	1	1	307.350	1.118	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1	ZINC000269330932	408270509	/nfs/dbraw/zinc/27/05/09/408270509.db2.gz	AFWMUINFLLNOMD-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CN1CC[NH+](CCCNc2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000269349992	408279113	/nfs/dbraw/zinc/27/91/13/408279113.db2.gz	FUAHLOUBCRSUJP-UHFFFAOYSA-N	1	1	313.789	1.693	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000246641601	408310267	/nfs/dbraw/zinc/31/02/67/408310267.db2.gz	FRZJXCDJLKYKBR-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000246810256	408344633	/nfs/dbraw/zinc/34/46/33/408344633.db2.gz	DGQAWKPSBNGHOA-ZYHUDNBSSA-N	1	1	306.366	1.636	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000269686489	408391688	/nfs/dbraw/zinc/39/16/88/408391688.db2.gz	JDZLSORYWPVDCD-UHFFFAOYSA-N	1	1	302.334	1.767	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000274466379	408415299	/nfs/dbraw/zinc/41/52/99/408415299.db2.gz	KRKSQUOFAIIPAE-LBPRGKRZSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)[N@H+](CCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000177035275	408502526	/nfs/dbraw/zinc/50/25/26/408502526.db2.gz	BYYNIGXZVICNKV-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC(C)[N@@H+](CCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000177035275	408502528	/nfs/dbraw/zinc/50/25/28/408502528.db2.gz	BYYNIGXZVICNKV-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000270361299	408502565	/nfs/dbraw/zinc/50/25/65/408502565.db2.gz	JEOCTXZMSQMBLA-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[N@H+]2CCC[C@H]2C1	ZINC000248374872	408553033	/nfs/dbraw/zinc/55/30/33/408553033.db2.gz	USQXRHZWBVNUCK-KBPBESRZSA-N	1	1	321.377	1.115	20	5		DDBDMO
CC1(C)[C@@H]2C[N@H+](C[C@@H](O)COc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000248450626	408569325	/nfs/dbraw/zinc/56/93/25/408569325.db2.gz	IRFXERZWUUJQAI-UPJWGTAASA-N	1	1	306.362	1.922	20	5		DDBDMO
Nc1ccc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)c[nH+]1	ZINC000264598925	408541200	/nfs/dbraw/zinc/54/12/00/408541200.db2.gz	AWDLCDVOWKXWDB-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000270748579	408663772	/nfs/dbraw/zinc/66/37/72/408663772.db2.gz	IBOXBPLCIMFWFE-TXEJJXNPSA-N	1	1	323.397	1.426	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000249541356	408738998	/nfs/dbraw/zinc/73/89/98/408738998.db2.gz	DZQTUDSYOUPWEN-IUODEOHRSA-N	1	1	321.377	1.950	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249601784	408748745	/nfs/dbraw/zinc/74/87/45/408748745.db2.gz	YNTVMQWAUQGVFC-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249601784	408748747	/nfs/dbraw/zinc/74/87/47/408748747.db2.gz	YNTVMQWAUQGVFC-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@]1(O)CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000178025283	408759652	/nfs/dbraw/zinc/75/96/52/408759652.db2.gz	XXYVXOHCOWLMPD-AWEZNQCLSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@]1(O)CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000178025283	408759655	/nfs/dbraw/zinc/75/96/55/408759655.db2.gz	XXYVXOHCOWLMPD-AWEZNQCLSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)c1ccco1	ZINC000178148417	408781190	/nfs/dbraw/zinc/78/11/90/408781190.db2.gz	VPPSDFZYAUNMST-LBPRGKRZSA-N	1	1	318.333	1.803	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000276134220	408822232	/nfs/dbraw/zinc/82/22/32/408822232.db2.gz	BQFQEEXKUPHLOA-SNVBAGLBSA-N	1	1	313.379	1.362	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccccc2[N+](=O)[O-])CCCO1	ZINC000277343462	408922973	/nfs/dbraw/zinc/92/29/73/408922973.db2.gz	BDMHSISYKDYSSX-CYBMUJFWSA-N	1	1	321.377	1.826	20	5		DDBDMO
CN1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1=O	ZINC000191131572	163173548	/nfs/dbraw/zinc/17/35/48/163173548.db2.gz	AJRBNTFULCVKES-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
CN1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1=O	ZINC000191131572	163173550	/nfs/dbraw/zinc/17/35/50/163173550.db2.gz	AJRBNTFULCVKES-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
COC[C@@H](Cc1ccccc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000191482912	163188888	/nfs/dbraw/zinc/18/88/88/163188888.db2.gz	SSDLEKAQTBOUDK-OAHLLOKOSA-N	1	1	318.377	1.981	20	5		DDBDMO
COC(=O)CNC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000193842874	163269590	/nfs/dbraw/zinc/26/95/90/163269590.db2.gz	FENGECKBHAWVIH-UHFFFAOYSA-N	1	1	323.349	1.094	20	5		DDBDMO
COC(=O)CNC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000193842874	163269593	/nfs/dbraw/zinc/26/95/93/163269593.db2.gz	FENGECKBHAWVIH-UHFFFAOYSA-N	1	1	323.349	1.094	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)[C@H]2C)c1[N+](=O)[O-]	ZINC000286989438	409002965	/nfs/dbraw/zinc/00/29/65/409002965.db2.gz	GXVHQJYVZHKGAX-GHMZBOCLSA-N	1	1	307.354	1.325	20	5		DDBDMO
CCNC(=O)[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C	ZINC000293301618	409085863	/nfs/dbraw/zinc/08/58/63/409085863.db2.gz	POHWZVSTPPTBOQ-AWEZNQCLSA-N	1	1	322.365	1.284	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C2)C1	ZINC000293861864	409196099	/nfs/dbraw/zinc/19/60/99/409196099.db2.gz	KQOLGHFJYFBELY-OAHLLOKOSA-N	1	1	304.350	1.345	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[NH+](CC2CC2)CC1	ZINC000279153278	409160406	/nfs/dbraw/zinc/16/04/06/409160406.db2.gz	FLDXVQMFTSEHAC-UHFFFAOYSA-N	1	1	322.340	1.484	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@H](C)[N@H+]1C	ZINC000294000491	409222593	/nfs/dbraw/zinc/22/25/93/409222593.db2.gz	OUEGRYGCYHKLEH-TXEJJXNPSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@H](C)[N@@H+]1C	ZINC000294000491	409222597	/nfs/dbraw/zinc/22/25/97/409222597.db2.gz	OUEGRYGCYHKLEH-TXEJJXNPSA-N	1	1	320.393	1.825	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)NCC(F)F	ZINC000280370992	409300002	/nfs/dbraw/zinc/30/00/02/409300002.db2.gz	USXKWWMJCWFFQO-UHFFFAOYSA-N	1	1	317.292	1.464	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000294908298	409306548	/nfs/dbraw/zinc/30/65/48/409306548.db2.gz	SCBNOVICCTYEFS-JTQLQIEISA-N	1	1	324.356	1.624	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422416	409309757	/nfs/dbraw/zinc/30/97/57/409309757.db2.gz	LYDYQVQSSKOKNT-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422416	409309759	/nfs/dbraw/zinc/30/97/59/409309759.db2.gz	LYDYQVQSSKOKNT-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]([N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C(C)(C)O	ZINC000295225032	409386039	/nfs/dbraw/zinc/38/60/39/409386039.db2.gz	WCUYLEZGANTFAM-LLVKDONJSA-N	1	1	309.366	1.649	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285176790	409403212	/nfs/dbraw/zinc/40/32/12/409403212.db2.gz	BLASBPBJJFAWBI-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H]2CCC[N@@H+](CCCO)C2)c1[N+](=O)[O-]	ZINC000295304706	409424218	/nfs/dbraw/zinc/42/42/18/409424218.db2.gz	BGBLOPFIFJZDIP-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1	ZINC000290537584	409435951	/nfs/dbraw/zinc/43/59/51/409435951.db2.gz	DTQIQFVJXBSAIV-INIZCTEOSA-N	1	1	316.361	1.913	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000280751904	409438865	/nfs/dbraw/zinc/43/88/65/409438865.db2.gz	NJSKHLWOVPVUHQ-CQSZACIVSA-N	1	1	304.306	1.433	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1ccccc1[N+](=O)[O-]	ZINC000295339791	409443134	/nfs/dbraw/zinc/44/31/34/409443134.db2.gz	DPDKKVZKOWWJOO-GFCCVEGCSA-N	1	1	307.350	1.171	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000408068535	164215624	/nfs/dbraw/zinc/21/56/24/164215624.db2.gz	IONRIVIXBLOTBE-GRYCIOLGSA-N	1	1	321.381	1.795	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H](CO)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000303040567	409525435	/nfs/dbraw/zinc/52/54/35/409525435.db2.gz	NLZMPNDHFPSUKG-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)C[C@H]1C	ZINC000354439058	409854951	/nfs/dbraw/zinc/85/49/51/409854951.db2.gz	UXKSYRABUQQWQD-NEPJUHHUSA-N	1	1	308.382	1.878	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000357058329	409829334	/nfs/dbraw/zinc/82/93/34/409829334.db2.gz	ZTVGJOZOXNFDBN-NSHDSACASA-N	1	1	309.370	1.132	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000332114507	409896983	/nfs/dbraw/zinc/89/69/83/409896983.db2.gz	WTQIKLZOJNIETN-OAHLLOKOSA-N	1	1	318.377	1.627	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000339393323	410152555	/nfs/dbraw/zinc/15/25/55/410152555.db2.gz	FOCNWHNXAFSCCW-SJORKVTESA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@@H]([NH3+])[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000351753340	410210981	/nfs/dbraw/zinc/21/09/81/410210981.db2.gz	FDSJLQOFXHIFOL-BDAKNGLRSA-N	1	1	303.322	1.280	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C(N)=O	ZINC000298363002	410195839	/nfs/dbraw/zinc/19/58/39/410195839.db2.gz	NCOUHVGNZLLPPL-UHFFFAOYSA-N	1	1	308.338	1.119	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCC[N@@H+](C)[C@H]1C	ZINC000343444143	410458832	/nfs/dbraw/zinc/45/88/32/410458832.db2.gz	BACASZCRRBFRGP-CMPLNLGQSA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000343459879	410469925	/nfs/dbraw/zinc/46/99/25/410469925.db2.gz	WTJNRUXNCSIALK-AAEUAGOBSA-N	1	1	323.397	1.397	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000343415858	410432143	/nfs/dbraw/zinc/43/21/43/410432143.db2.gz	LPVLZNPDNXGZJM-VNHYZAJKSA-N	1	1	324.377	1.427	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000299101133	410521800	/nfs/dbraw/zinc/52/18/00/410521800.db2.gz	ZPXWNKGSSDBAKB-KGLIPLIRSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1[nH]nc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)c1[N+](=O)[O-]	ZINC000355477354	410537563	/nfs/dbraw/zinc/53/75/63/410537563.db2.gz	SWSDFNUHNJEKLJ-UHFFFAOYSA-N	1	1	300.278	1.835	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000334042895	410627002	/nfs/dbraw/zinc/62/70/02/410627002.db2.gz	ZJOOVADPLCQLMS-MNOVXSKESA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1cc(C)n(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)n1	ZINC000347778390	410714038	/nfs/dbraw/zinc/71/40/38/410714038.db2.gz	CROPJKPKZPWFGC-UHFFFAOYSA-N	1	1	301.350	1.861	20	5		DDBDMO
CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000343807242	410716474	/nfs/dbraw/zinc/71/64/74/410716474.db2.gz	TURNZJDZRXJHQL-NWDGAFQWSA-N	1	1	323.397	1.948	20	5		DDBDMO
Cn1c(C(=O)NCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-]	ZINC000330529165	410751927	/nfs/dbraw/zinc/75/19/27/410751927.db2.gz	QUDLHIZSIUCCAF-UHFFFAOYSA-N	1	1	308.382	1.928	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000337409950	410763172	/nfs/dbraw/zinc/76/31/72/410763172.db2.gz	LCCGQADXXQZTFB-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CN(C)c1cc[nH+]c(NCCNc2ccc([N+](=O)[O-])cc2)n1	ZINC000301746059	410788021	/nfs/dbraw/zinc/78/80/21/410788021.db2.gz	XTAXYJVZWRBSOC-UHFFFAOYSA-N	1	1	302.338	1.975	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2[nH]ncc2[N+](=O)[O-])CC1	ZINC000330610470	410824971	/nfs/dbraw/zinc/82/49/71/410824971.db2.gz	UPEOCZUUGXPFHJ-UHFFFAOYSA-N	1	1	321.381	1.726	20	5		DDBDMO
CC(C)(C)C1=CC[N@H+](CCNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000330610470	410824989	/nfs/dbraw/zinc/82/49/89/410824989.db2.gz	UPEOCZUUGXPFHJ-UHFFFAOYSA-N	1	1	321.381	1.726	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000330610470	410824995	/nfs/dbraw/zinc/82/49/95/410824995.db2.gz	UPEOCZUUGXPFHJ-UHFFFAOYSA-N	1	1	321.381	1.726	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000330618869	410833572	/nfs/dbraw/zinc/83/35/72/410833572.db2.gz	YUJMBMKAWQWJLW-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC000330618869	410833577	/nfs/dbraw/zinc/83/35/77/410833577.db2.gz	YUJMBMKAWQWJLW-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(NC(=O)CN2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000330661461	410860500	/nfs/dbraw/zinc/86/05/00/410860500.db2.gz	CJULUEGOVDQBKA-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344055660	410923954	/nfs/dbraw/zinc/92/39/54/410923954.db2.gz	KUSVPNXLTQARLO-FDRIWYBQSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C2)C1	ZINC000356294371	410950791	/nfs/dbraw/zinc/95/07/91/410950791.db2.gz	SJMWREFAEPGLKD-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000419322453	226113818	/nfs/dbraw/zinc/11/38/18/226113818.db2.gz	HKDGQTWFYUWDMQ-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933609	418474569	/nfs/dbraw/zinc/47/45/69/418474569.db2.gz	MPPRPDAPADBXQF-HUUCEWRRSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2)CC1	ZINC000373933609	418474571	/nfs/dbraw/zinc/47/45/71/418474571.db2.gz	MPPRPDAPADBXQF-HUUCEWRRSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933609	418474572	/nfs/dbraw/zinc/47/45/72/418474572.db2.gz	MPPRPDAPADBXQF-HUUCEWRRSA-N	1	1	303.362	1.386	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@@H](Nc3ncccc3[N+](=O)[O-])C2)CC1	ZINC000361029340	418569250	/nfs/dbraw/zinc/56/92/50/418569250.db2.gz	AOUGICQIIVVVPA-GFCCVEGCSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3ncccc3[N+](=O)[O-])C2)CC1	ZINC000361029340	418569253	/nfs/dbraw/zinc/56/92/53/418569253.db2.gz	AOUGICQIIVVVPA-GFCCVEGCSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[C@H]1c2ccccc2C[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000361044807	418572098	/nfs/dbraw/zinc/57/20/98/418572098.db2.gz	JPOHSSPNVXSZEB-SMDDNHRTSA-N	1	1	302.334	1.729	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000367146275	418563834	/nfs/dbraw/zinc/56/38/34/418563834.db2.gz	ATIJBDIQDRTQCJ-UHFFFAOYSA-N	1	1	322.409	1.420	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)n1	ZINC000191633139	222106411	/nfs/dbraw/zinc/10/64/11/222106411.db2.gz	TWCQAYSQYPHLMQ-MNOVXSKESA-N	1	1	309.370	1.366	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CC[N@H+]1CCCOCC1)CC2	ZINC000361313272	418623988	/nfs/dbraw/zinc/62/39/88/418623988.db2.gz	IICJEUFLZJOTKW-UHFFFAOYSA-N	1	1	305.378	1.675	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](CC2CC2)CC2CCC2)c1	ZINC000361557811	418677768	/nfs/dbraw/zinc/67/77/68/418677768.db2.gz	STQVQNFRGDYRLD-HNNXBMFYSA-N	1	1	308.382	1.664	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc(NC)c([N+](=O)[O-])c1)C1CC1	ZINC000389805275	418751411	/nfs/dbraw/zinc/75/14/11/418751411.db2.gz	LECDEPQVKUTNJB-UHFFFAOYSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000372125447	418838438	/nfs/dbraw/zinc/83/84/38/418838438.db2.gz	KBCVMYVNGCFKNW-DFBGVHRSSA-N	1	1	318.377	1.388	20	5		DDBDMO
NC(=O)c1ccc(N2CCC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000372945098	418915237	/nfs/dbraw/zinc/91/52/37/418915237.db2.gz	CXYOELFSFUQRHN-GFCCVEGCSA-N	1	1	304.350	1.368	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411745434	419396208	/nfs/dbraw/zinc/39/62/08/419396208.db2.gz	MFXWUPZIRWMTAL-ZDUSSCGKSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411656133	419372649	/nfs/dbraw/zinc/37/26/49/419372649.db2.gz	PJPSQIHSGCPQHB-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@H](C)C1	ZINC000299262766	229014268	/nfs/dbraw/zinc/01/42/68/229014268.db2.gz	HDUTYEPVCRTIJZ-QWHCGFSZSA-N	1	1	323.397	1.418	20	5		DDBDMO
C[C@]12CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1C2(F)F	ZINC000428711734	419919316	/nfs/dbraw/zinc/91/93/16/419919316.db2.gz	LWUXKMKWCJRREG-UTUOFQBUSA-N	1	1	316.308	1.129	20	5		DDBDMO
C[C@H]1CC[C@@H]([N@@H+](CCO)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000429794233	420049058	/nfs/dbraw/zinc/04/90/58/420049058.db2.gz	WTQKGLWUFBGJIV-SMDDNHRTSA-N	1	1	321.377	1.677	20	5		DDBDMO
COc1ccc(OCCN(C)CC(C)(C)C[NH3+])c([N+](=O)[O-])c1	ZINC000430577529	420142764	/nfs/dbraw/zinc/14/27/64/420142764.db2.gz	NYNXBNWTVYWHCY-UHFFFAOYSA-N	1	1	311.382	1.899	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+](C)[C@H](C)CN)c([N+](=O)[O-])c1	ZINC000420293665	420187084	/nfs/dbraw/zinc/18/70/84/420187084.db2.gz	ROGZOCVIYXAGRO-SNVBAGLBSA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)[C@H](C)CN)c([N+](=O)[O-])c1	ZINC000420293665	420187088	/nfs/dbraw/zinc/18/70/88/420187088.db2.gz	ROGZOCVIYXAGRO-SNVBAGLBSA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1ccc(NC(=O)CCN(C)C2CC([NH3+])C2)c([N+](=O)[O-])c1	ZINC000420330719	420214144	/nfs/dbraw/zinc/21/41/44/420214144.db2.gz	LRNYUDQUKGAUPA-UHFFFAOYSA-N	1	1	322.365	1.354	20	5		DDBDMO
O=C(NC1CCC([NH+]2CCNCC2)CC1)c1ccc([N+](=O)[O-])o1	ZINC000423943198	420277965	/nfs/dbraw/zinc/27/79/65/420277965.db2.gz	CAYNHFAAAYHUDT-UHFFFAOYSA-N	1	1	322.365	1.134	20	5		DDBDMO
Cn1c[nH+]cc1CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000302149443	230126505	/nfs/dbraw/zinc/12/65/05/230126505.db2.gz	SSGWYHZZTNWXRN-UHFFFAOYSA-N	1	1	324.362	1.386	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000302368098	230224504	/nfs/dbraw/zinc/22/45/04/230224504.db2.gz	DSIOHCGWYDUATR-GFCCVEGCSA-N	1	1	309.366	1.244	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000439358395	420508598	/nfs/dbraw/zinc/50/85/98/420508598.db2.gz	XXWWRZQHSXMRGG-LLVKDONJSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000452068433	420620398	/nfs/dbraw/zinc/62/03/98/420620398.db2.gz	NYJKOKVLTPWQKH-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H](O)C1	ZINC000452068836	420621334	/nfs/dbraw/zinc/62/13/34/420621334.db2.gz	PEASLJKCXMQBOJ-GWCFXTLKSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H](O)C1	ZINC000452068836	420621336	/nfs/dbraw/zinc/62/13/36/420621336.db2.gz	PEASLJKCXMQBOJ-GWCFXTLKSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C1	ZINC000493046672	420742689	/nfs/dbraw/zinc/74/26/89/420742689.db2.gz	KJVNOAOTUOMQJW-IYKSTZQJSA-N	1	1	307.325	1.768	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)n1	ZINC000444830511	420760359	/nfs/dbraw/zinc/76/03/59/420760359.db2.gz	WNTPDWJZGCATNH-CHWSQXEVSA-N	1	1	308.382	1.498	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455657474	421049358	/nfs/dbraw/zinc/04/93/58/421049358.db2.gz	MFEZJUZEXLUVAZ-QWRGUYRKSA-N	1	1	319.365	1.340	20	5		DDBDMO
O=C1OCC[C@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000494132448	420996854	/nfs/dbraw/zinc/99/68/54/420996854.db2.gz	JAWKBAMGGVDGOQ-AWEZNQCLSA-N	1	1	305.334	1.664	20	5		DDBDMO
O=C1OCC[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000494132448	420996856	/nfs/dbraw/zinc/99/68/56/420996856.db2.gz	JAWKBAMGGVDGOQ-AWEZNQCLSA-N	1	1	305.334	1.664	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000487071804	421002182	/nfs/dbraw/zinc/00/21/82/421002182.db2.gz	BPLWRDVXBHNDMZ-HNNXBMFYSA-N	1	1	320.393	1.731	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000524590596	421262898	/nfs/dbraw/zinc/26/28/98/421262898.db2.gz	MERNYVKTGRQZOY-GFCCVEGCSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000524783284	421272830	/nfs/dbraw/zinc/27/28/30/421272830.db2.gz	FTGMFNKPELCJOC-DGCLKSJQSA-N	1	1	306.366	1.877	20	5		DDBDMO
Cc1cc(N(C)S(=O)(=O)c2cccnc2[N+](=O)[O-])cc[nH+]1	ZINC000547331108	421323097	/nfs/dbraw/zinc/32/30/97/421323097.db2.gz	QVSZYAMNRVHRNQ-UHFFFAOYSA-N	1	1	308.319	1.518	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000548442487	421439738	/nfs/dbraw/zinc/43/97/38/421439738.db2.gz	AIPCYKFBIHBBSO-HNNXBMFYSA-N	1	1	308.334	1.267	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000548442487	421439740	/nfs/dbraw/zinc/43/97/40/421439740.db2.gz	AIPCYKFBIHBBSO-HNNXBMFYSA-N	1	1	308.334	1.267	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](CCO)[C@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641937	421441380	/nfs/dbraw/zinc/44/13/80/421441380.db2.gz	RHHHKVXYMYQRGN-OLZOCXBDSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](CCO)[C@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641937	421441382	/nfs/dbraw/zinc/44/13/82/421441382.db2.gz	RHHHKVXYMYQRGN-OLZOCXBDSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000517456855	421614856	/nfs/dbraw/zinc/61/48/56/421614856.db2.gz	AROHNCIZNBEXQR-JTQLQIEISA-N	1	1	321.333	1.395	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCC[C@@H](C)C1	ZINC000518772206	421667407	/nfs/dbraw/zinc/66/74/07/421667407.db2.gz	ZYNLXLMVKZXSSG-VXGBXAGGSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1	ZINC000520164644	421738487	/nfs/dbraw/zinc/73/84/87/421738487.db2.gz	YXZLVSKWTMVQGJ-UHFFFAOYSA-N	1	1	322.365	1.642	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000572760743	421857158	/nfs/dbraw/zinc/85/71/58/421857158.db2.gz	YIIPZJHKEQOMKG-OAHLLOKOSA-N	1	1	316.361	1.829	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H](C)CO	ZINC000276184962	274266776	/nfs/dbraw/zinc/26/67/76/274266776.db2.gz	KUUOSNRVLYCABC-VHSXEESVSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCOC1	ZINC000181957023	263371588	/nfs/dbraw/zinc/37/15/88/263371588.db2.gz	VLNAJDIMKOYKAO-STQMWFEESA-N	1	1	310.350	1.303	20	5		DDBDMO
CC(=O)[C@H](NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000342283350	271366460	/nfs/dbraw/zinc/36/64/60/271366460.db2.gz	QVXIHJKLOCDFST-MEDUHNTESA-N	1	1	321.377	1.975	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C	ZINC000344650266	272079652	/nfs/dbraw/zinc/07/96/52/272079652.db2.gz	WSCPQTMEOUJZFR-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
COCC[NH+]1CCN(c2cc(OC)cc(F)c2[N+](=O)[O-])CC1	ZINC000301459389	274030710	/nfs/dbraw/zinc/03/07/10/274030710.db2.gz	YGCGEIYYNKIBFV-UHFFFAOYSA-N	1	1	313.329	1.511	20	5		DDBDMO
C[C@@H]1CCNC(=O)[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000193567014	274305400	/nfs/dbraw/zinc/30/54/00/274305400.db2.gz	CHLSMWBPIZPQFM-RNCFNFMXSA-N	1	1	321.333	1.076	20	5		DDBDMO
CCOC(=O)[C@@H]1NCC[C@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000423017458	276289991	/nfs/dbraw/zinc/28/99/91/276289991.db2.gz	ORDBLJNXCCSDEL-ZKYQVNSYSA-N	1	1	307.350	1.539	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C1	ZINC000301285353	277053738	/nfs/dbraw/zinc/05/37/38/277053738.db2.gz	LNMLZXQKTZWBOO-CYBMUJFWSA-N	1	1	322.384	1.950	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc(N)cc1[N+](=O)[O-]	ZINC000286281620	297266557	/nfs/dbraw/zinc/26/65/57/297266557.db2.gz	IBWNSJVEFAXPOF-DGCLKSJQSA-N	1	1	306.366	1.476	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@@H]2C[N@@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000362804441	300145119	/nfs/dbraw/zinc/14/51/19/300145119.db2.gz	FLZNSQKZLGNWCZ-TVQRCGJNSA-N	1	1	321.333	1.518	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000363395151	300261865	/nfs/dbraw/zinc/26/18/65/300261865.db2.gz	HUFOSTVISIAWJY-UHFFFAOYSA-N	1	1	317.349	1.639	20	5		DDBDMO
CC[N@@H+]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000363395151	300261869	/nfs/dbraw/zinc/26/18/69/300261869.db2.gz	HUFOSTVISIAWJY-UHFFFAOYSA-N	1	1	317.349	1.639	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000363395151	300261871	/nfs/dbraw/zinc/26/18/71/300261871.db2.gz	HUFOSTVISIAWJY-UHFFFAOYSA-N	1	1	317.349	1.639	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000364082711	300341922	/nfs/dbraw/zinc/34/19/22/300341922.db2.gz	JVISESNRMSOMRT-OLZOCXBDSA-N	1	1	318.377	1.750	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000368007799	300932210	/nfs/dbraw/zinc/93/22/10/300932210.db2.gz	RKVPVNNLSWOUKY-LLVKDONJSA-N	1	1	315.276	1.039	20	5		DDBDMO
COc1cc(N2CCC[N@@H+](CC(C)(C)O)CC2)ccc1[N+](=O)[O-]	ZINC000368722233	301081265	/nfs/dbraw/zinc/08/12/65/301081265.db2.gz	NZTULLULPGOPOZ-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccncc2)CC1	ZINC000368818581	301092482	/nfs/dbraw/zinc/09/24/82/301092482.db2.gz	UIKMNBHQDOIQGO-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000370215045	301296064	/nfs/dbraw/zinc/29/60/64/301296064.db2.gz	JIUGHIHINDJBTI-DTZQCDIJSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000370215045	301296067	/nfs/dbraw/zinc/29/60/67/301296067.db2.gz	JIUGHIHINDJBTI-DTZQCDIJSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000370215045	301296069	/nfs/dbraw/zinc/29/60/69/301296069.db2.gz	JIUGHIHINDJBTI-DTZQCDIJSA-N	1	1	317.389	1.821	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000370465579	301344523	/nfs/dbraw/zinc/34/45/23/301344523.db2.gz	TWVADDFRNRVSHC-NEPJUHHUSA-N	1	1	323.324	1.327	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000398742306	302361793	/nfs/dbraw/zinc/36/17/93/302361793.db2.gz	WSYVZWMTDHNUPR-QWRGUYRKSA-N	1	1	307.350	1.144	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H](OCC(F)(F)F)C2)n1	ZINC000530905035	303220085	/nfs/dbraw/zinc/22/00/85/303220085.db2.gz	KWOWICGQEKQCFN-SNVBAGLBSA-N	1	1	322.287	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](OCC(F)(F)F)C2)n1	ZINC000530905035	303220086	/nfs/dbraw/zinc/22/00/86/303220086.db2.gz	KWOWICGQEKQCFN-SNVBAGLBSA-N	1	1	322.287	1.835	20	5		DDBDMO
COc1cc(C[NH2+]C(C)(C)C(=O)N(C)C)c([N+](=O)[O-])cc1F	ZINC000545223247	303485078	/nfs/dbraw/zinc/48/50/78/303485078.db2.gz	RJESOLOTEIMDFW-UHFFFAOYSA-N	1	1	313.329	1.699	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)N(CC[N@@H+]1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000364640286	307049050	/nfs/dbraw/zinc/04/90/50/307049050.db2.gz	GUWOKQXTUSYDKQ-GASCZTMLSA-N	1	1	303.362	1.821	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[NH2+]CC1	ZINC000364643462	307049380	/nfs/dbraw/zinc/04/93/80/307049380.db2.gz	VWMWPULNOURMIP-SNVBAGLBSA-N	1	1	317.349	1.685	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@H]([NH3+])[C@H]3C2)c1[N+](=O)[O-]	ZINC000368615217	307106474	/nfs/dbraw/zinc/10/64/74/307106474.db2.gz	UBACVBSOXWMGML-DCAQKATOSA-N	1	1	321.381	1.470	20	5		DDBDMO
Cc1nc(N2CCC[N@@H+](CC(C)(C)O)CC2)ccc1[N+](=O)[O-]	ZINC000368724224	307108753	/nfs/dbraw/zinc/10/87/53/307108753.db2.gz	ZBSFHLWUFLBOLE-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
CC(=O)N(C[C@@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C)C1CC1	ZINC000370647397	307131668	/nfs/dbraw/zinc/13/16/68/307131668.db2.gz	HABNVASFWVSKEK-ZDUSSCGKSA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N(C[C@@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C)C1CC1	ZINC000370647397	307131669	/nfs/dbraw/zinc/13/16/69/307131669.db2.gz	HABNVASFWVSKEK-ZDUSSCGKSA-N	1	1	321.381	1.304	20	5		DDBDMO
CN1C[C@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373242925	307182069	/nfs/dbraw/zinc/18/20/69/307182069.db2.gz	MMCUXCQNVHFRSK-AWEZNQCLSA-N	1	1	304.350	1.189	20	5		DDBDMO
CN1C[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373242925	307182070	/nfs/dbraw/zinc/18/20/70/307182070.db2.gz	MMCUXCQNVHFRSK-AWEZNQCLSA-N	1	1	304.350	1.189	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[N@H+](C)[C@H]2C1	ZINC000376643033	307251225	/nfs/dbraw/zinc/25/12/25/307251225.db2.gz	MSTRXQXZQSUFFX-RISCZKNCSA-N	1	1	304.350	1.464	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377647623	307275620	/nfs/dbraw/zinc/27/56/20/307275620.db2.gz	FSEYZLZFOIDPIT-ZYHUDNBSSA-N	1	1	320.305	1.071	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377647623	307275621	/nfs/dbraw/zinc/27/56/21/307275621.db2.gz	FSEYZLZFOIDPIT-ZYHUDNBSSA-N	1	1	320.305	1.071	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000378490000	307289460	/nfs/dbraw/zinc/28/94/60/307289460.db2.gz	CEJKPQKVTXHWNH-RISCZKNCSA-N	1	1	304.350	1.464	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](CO)[C@@H](O)C1	ZINC000574228352	308266041	/nfs/dbraw/zinc/26/60/41/308266041.db2.gz	ZBXWQMNEJKGHPQ-WFASDCNBSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CO)[C@@H](O)C1	ZINC000574228352	308266042	/nfs/dbraw/zinc/26/60/42/308266042.db2.gz	ZBXWQMNEJKGHPQ-WFASDCNBSA-N	1	1	324.377	1.557	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000577437248	308387819	/nfs/dbraw/zinc/38/78/19/308387819.db2.gz	NILBGSTYDIHPSV-ZDUSSCGKSA-N	1	1	323.393	1.783	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])CC2	ZINC000582742793	337128405	/nfs/dbraw/zinc/12/84/05/337128405.db2.gz	MZEITVOIWYWCHF-CYBMUJFWSA-N	1	1	314.345	1.979	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1ncccc1F	ZINC000583079961	337236770	/nfs/dbraw/zinc/23/67/70/337236770.db2.gz	SMQYPEGWUZEKEU-NSHDSACASA-N	1	1	321.308	1.658	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000295641932	533761923	/nfs/dbraw/zinc/76/19/23/533761923.db2.gz	YNCGQDDXNPYBKN-LBPRGKRZSA-N	1	1	307.350	1.816	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCSC[C@H]1C1CCC1	ZINC000419376547	534321916	/nfs/dbraw/zinc/32/19/16/534321916.db2.gz	SDKSMQDYNPGRER-AWEZNQCLSA-N	1	1	323.418	1.974	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CCCO)C1	ZINC000452130257	534338978	/nfs/dbraw/zinc/33/89/78/534338978.db2.gz	NQOUYPBXCGVJHQ-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
[NH3+]C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])C2CC3CC(C2)CC1C3	ZINC000424032286	534548263	/nfs/dbraw/zinc/54/82/63/534548263.db2.gz	COBXQXLVQUTWTA-UHFFFAOYSA-N	1	1	319.365	1.201	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1	ZINC000451341750	534889026	/nfs/dbraw/zinc/88/90/26/534889026.db2.gz	LQYRKOANRNAYGL-KFWWJZLASA-N	1	1	308.382	1.807	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)[C@@]2(CO)CCOC2)ccc1[N+](=O)[O-]	ZINC000491606735	528260866	/nfs/dbraw/zinc/26/08/66/528260866.db2.gz	IJGSDUAODRQTCX-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000299391969	529025114	/nfs/dbraw/zinc/02/51/14/529025114.db2.gz	RTAMYRHOPVVQDK-LLVKDONJSA-N	1	1	321.381	1.621	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@H]1CCC[N@@H+](C)C1	ZINC000736856697	599120083	/nfs/dbraw/zinc/12/00/83/599120083.db2.gz	LZJVAEODYQMBCM-NSHDSACASA-N	1	1	317.353	1.305	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000736324697	598420576	/nfs/dbraw/zinc/42/05/76/598420576.db2.gz	HPRQLMWGUMSUQN-SNVBAGLBSA-N	1	1	319.369	1.917	20	5		DDBDMO
CC[N@@H+](CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1)C1CC1	ZINC000736537478	598500856	/nfs/dbraw/zinc/50/08/56/598500856.db2.gz	TYCMRQYZGWWWHY-UHFFFAOYSA-N	1	1	318.341	1.066	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000155591417	696950613	/nfs/dbraw/zinc/95/06/13/696950613.db2.gz	DIFXFPSRAUGFEX-AOOOYVTPSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000155591417	696950614	/nfs/dbraw/zinc/95/06/14/696950614.db2.gz	DIFXFPSRAUGFEX-AOOOYVTPSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCC1CC1)C2	ZINC000982278563	697081882	/nfs/dbraw/zinc/08/18/82/697081882.db2.gz	IWAZOFFTJNRGFI-SRABZTEZSA-N	1	1	321.421	1.622	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CCC1CC1)C2	ZINC000982278563	697081884	/nfs/dbraw/zinc/08/18/84/697081884.db2.gz	IWAZOFFTJNRGFI-SRABZTEZSA-N	1	1	321.421	1.622	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCC1CC1)C2	ZINC000982278563	697081886	/nfs/dbraw/zinc/08/18/86/697081886.db2.gz	IWAZOFFTJNRGFI-SRABZTEZSA-N	1	1	321.421	1.622	20	5		DDBDMO
COCCO[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000179333400	697436416	/nfs/dbraw/zinc/43/64/16/697436416.db2.gz	SYZLMZACQIPKTC-HOTGVXAUSA-N	1	1	324.377	1.756	20	5		DDBDMO
CCOC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776271806	698090190	/nfs/dbraw/zinc/09/01/90/698090190.db2.gz	HKHOOXMNMGWFGO-UKRRQHHQSA-N	1	1	322.361	1.903	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776599210	698125529	/nfs/dbraw/zinc/12/55/29/698125529.db2.gz	XDFSXOWFLUABFD-HNNXBMFYSA-N	1	1	302.334	1.593	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@@H+]1C	ZINC000779219834	698403105	/nfs/dbraw/zinc/40/31/05/698403105.db2.gz	LMTUFKRUSGXXKP-VIFPVBQESA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000779219834	698403107	/nfs/dbraw/zinc/40/31/07/698403107.db2.gz	LMTUFKRUSGXXKP-VIFPVBQESA-N	1	1	307.306	1.100	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)OCCC[NH+]1CCOCC1	ZINC000750881866	700254006	/nfs/dbraw/zinc/25/40/06/700254006.db2.gz	ODWBYDYUBMJDOW-UHFFFAOYSA-N	1	1	324.333	1.239	20	5		DDBDMO
O=C(OCCn1ccc([N+](=O)[O-])n1)[C@H]1CCC[N@H+]1C1CCCC1	ZINC000786893829	699177306	/nfs/dbraw/zinc/17/73/06/699177306.db2.gz	XKCGNMCHYNBHNW-CYBMUJFWSA-N	1	1	322.365	1.742	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000794703008	699825372	/nfs/dbraw/zinc/82/53/72/699825372.db2.gz	HALLPESKZSNYEL-AWEZNQCLSA-N	1	1	303.322	1.099	20	5		DDBDMO
C[N@@H+](CCc1ccccc1F)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000743849640	699929135	/nfs/dbraw/zinc/92/91/35/699929135.db2.gz	YAPFSZUWGODOAL-CQSZACIVSA-N	1	1	322.340	1.466	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000796575373	699939807	/nfs/dbraw/zinc/93/98/07/699939807.db2.gz	OILNKEAFOLEXGZ-TUKIKUTGSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)Cc2ccccc21	ZINC000744385203	699947479	/nfs/dbraw/zinc/94/74/79/699947479.db2.gz	MZKFFYHYVHAYNT-WFASDCNBSA-N	1	1	316.361	1.772	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000801886562	700350749	/nfs/dbraw/zinc/35/07/49/700350749.db2.gz	CGFKTDKECKPRNX-JTQLQIEISA-N	1	1	322.340	1.530	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CC[N@H+](C2CC2)C1	ZINC000801891053	700351284	/nfs/dbraw/zinc/35/12/84/700351284.db2.gz	GNAYFLQWFZVQBI-JTQLQIEISA-N	1	1	322.340	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@@H](C)C1	ZINC000761077381	700840816	/nfs/dbraw/zinc/84/08/16/700840816.db2.gz	RTSBDVIZGKKQQU-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)n1	ZINC000765461401	701013933	/nfs/dbraw/zinc/01/39/33/701013933.db2.gz	ABMLHTWCGHEQGL-CQSZACIVSA-N	1	1	320.393	1.989	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@@H]2CCO)cc1	ZINC000767586131	701118428	/nfs/dbraw/zinc/11/84/28/701118428.db2.gz	FTPMPKFIQZOZHN-AWEZNQCLSA-N	1	1	310.350	1.447	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCOC[C@@H]2CCO)cc1	ZINC000767586131	701118429	/nfs/dbraw/zinc/11/84/29/701118429.db2.gz	FTPMPKFIQZOZHN-AWEZNQCLSA-N	1	1	310.350	1.447	20	5		DDBDMO
COc1cc(C(=O)OCCn2cc[nH+]c2C)ccc1[N+](=O)[O-]	ZINC000771943322	701337908	/nfs/dbraw/zinc/33/79/08/701337908.db2.gz	LOUZORSLBCTNIP-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
COCCOCC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000808237213	701510409	/nfs/dbraw/zinc/51/04/09/701510409.db2.gz	GUBDSZGXZWNIRL-UHFFFAOYSA-N	1	1	308.338	1.497	20	5		DDBDMO
COCCOCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000808237213	701510410	/nfs/dbraw/zinc/51/04/10/701510410.db2.gz	GUBDSZGXZWNIRL-UHFFFAOYSA-N	1	1	308.338	1.497	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839568223	701738743	/nfs/dbraw/zinc/73/87/43/701738743.db2.gz	OBYUGTCXURKAEV-ZGKBOVNRSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568223	701738746	/nfs/dbraw/zinc/73/87/46/701738746.db2.gz	OBYUGTCXURKAEV-ZGKBOVNRSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568223	701738751	/nfs/dbraw/zinc/73/87/51/701738751.db2.gz	OBYUGTCXURKAEV-ZGKBOVNRSA-N	1	1	303.362	1.603	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839636468	701761562	/nfs/dbraw/zinc/76/15/62/701761562.db2.gz	SPONLTJVRYZFJT-OCCSQVGLSA-N	1	1	307.350	1.038	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)[nH]1	ZINC000839658319	701769142	/nfs/dbraw/zinc/76/91/42/701769142.db2.gz	FAMHGQDRLDNQOP-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658319	701769145	/nfs/dbraw/zinc/76/91/45/701769145.db2.gz	FAMHGQDRLDNQOP-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658319	701769147	/nfs/dbraw/zinc/76/91/47/701769147.db2.gz	FAMHGQDRLDNQOP-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658319	701769149	/nfs/dbraw/zinc/76/91/49/701769149.db2.gz	FAMHGQDRLDNQOP-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658319	701769152	/nfs/dbraw/zinc/76/91/52/701769152.db2.gz	FAMHGQDRLDNQOP-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
C[C@@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000839683811	701782522	/nfs/dbraw/zinc/78/25/22/701782522.db2.gz	PSKYWIGMEZPYDL-APHBMKBZSA-N	1	1	317.389	1.993	20	5		DDBDMO
Cc1ccccc1[C@H]([C@H](C)NC(=O)[C@@H]1CC1[N+](=O)[O-])[NH+](C)C	ZINC000839761212	701814361	/nfs/dbraw/zinc/81/43/61/701814361.db2.gz	LYPMYJQNMIXRSA-MYPMTAMASA-N	1	1	305.378	1.768	20	5		DDBDMO
Nc1ccc(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000810850732	701861545	/nfs/dbraw/zinc/86/15/45/701861545.db2.gz	NXBIWAGIPBWRCM-RYUDHWBXSA-N	1	1	305.334	1.961	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cc([N+](=O)[O-])c1	ZINC000812325283	702150688	/nfs/dbraw/zinc/15/06/88/702150688.db2.gz	OSTGSBPDGSROGQ-OCCSQVGLSA-N	1	1	303.362	1.927	20	5		DDBDMO
N[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1	ZINC000841051026	702325413	/nfs/dbraw/zinc/32/54/13/702325413.db2.gz	MSWDPBVLYZDAEM-INIZCTEOSA-N	1	1	304.394	1.891	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC000842625255	702744737	/nfs/dbraw/zinc/74/47/37/702744737.db2.gz	ICCVOQWSTPQTFV-RISCZKNCSA-N	1	1	317.349	1.716	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000879534845	706711580	/nfs/dbraw/zinc/71/15/80/706711580.db2.gz	YXNWXTUQXWJGDI-HONMWMINSA-N	1	1	317.345	1.511	20	5		DDBDMO
O=C1O[C@H](C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1C1CC1	ZINC000844310614	703010738	/nfs/dbraw/zinc/01/07/38/703010738.db2.gz	VIIYJGFZSWDQHV-CYBMUJFWSA-N	1	1	317.345	1.936	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1C1CC1	ZINC000844310614	703010740	/nfs/dbraw/zinc/01/07/40/703010740.db2.gz	VIIYJGFZSWDQHV-CYBMUJFWSA-N	1	1	317.345	1.936	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000845736059	703195099	/nfs/dbraw/zinc/19/50/99/703195099.db2.gz	RHGDHDLHLZRSJK-NSHDSACASA-N	1	1	324.381	1.942	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC[C@@H]21	ZINC000879583215	706727657	/nfs/dbraw/zinc/72/76/57/706727657.db2.gz	WQDKDLMIMHYUNA-ABAIWWIYSA-N	1	1	315.377	1.997	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000846920832	703352028	/nfs/dbraw/zinc/35/20/28/703352028.db2.gz	OHDNONXBUJAWFG-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000846972750	703359181	/nfs/dbraw/zinc/35/91/81/703359181.db2.gz	MMWKJAPOBYVRCG-UKRRQHHQSA-N	1	1	321.377	1.571	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCS(C)(=O)=O	ZINC000850431471	703730798	/nfs/dbraw/zinc/73/07/98/703730798.db2.gz	XMQNDPDTDMRSDN-SECBINFHSA-N	1	1	302.352	1.299	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(Cc2onc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000852205498	703966723	/nfs/dbraw/zinc/96/67/23/703966723.db2.gz	NFDWXLVHGBDIOY-PHIMTYICSA-N	1	1	312.370	1.432	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(Cc2onc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000852205498	703966725	/nfs/dbraw/zinc/96/67/25/703966725.db2.gz	NFDWXLVHGBDIOY-PHIMTYICSA-N	1	1	312.370	1.432	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](CCOCCO)C2CCC2)c1	ZINC000852291382	703998584	/nfs/dbraw/zinc/99/85/84/703998584.db2.gz	WBLRVJPBMPZDJU-INIZCTEOSA-N	1	1	324.377	1.492	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000852570434	704077257	/nfs/dbraw/zinc/07/72/57/704077257.db2.gz	COBIHDXTGXYYFT-UHFFFAOYSA-N	1	1	311.338	1.604	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)[C@@](C)(N)c1cccc([N+](=O)[O-])c1	ZINC000870928105	704172353	/nfs/dbraw/zinc/17/23/53/704172353.db2.gz	DXGVAHGXBNLCKV-INIZCTEOSA-N	1	1	320.393	1.321	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000853587966	704277226	/nfs/dbraw/zinc/27/72/26/704277226.db2.gz	OZXYYWZDBUJWDI-QWRGUYRKSA-N	1	1	319.317	1.429	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000853587966	704277229	/nfs/dbraw/zinc/27/72/29/704277229.db2.gz	OZXYYWZDBUJWDI-QWRGUYRKSA-N	1	1	319.317	1.429	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000832783215	706983585	/nfs/dbraw/zinc/98/35/85/706983585.db2.gz	PEYFLYLBOHMJDS-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000859556022	704936330	/nfs/dbraw/zinc/93/63/30/704936330.db2.gz	CDFJCNQGZRAOPV-CQSZACIVSA-N	1	1	312.297	1.498	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000859556022	704936333	/nfs/dbraw/zinc/93/63/33/704936333.db2.gz	CDFJCNQGZRAOPV-CQSZACIVSA-N	1	1	312.297	1.498	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1	ZINC000859888395	705030588	/nfs/dbraw/zinc/03/05/88/705030588.db2.gz	CTVTWRWJGBRGTR-SGRMJCNGSA-N	1	1	324.402	1.614	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2C	ZINC000874827076	705185566	/nfs/dbraw/zinc/18/55/66/705185566.db2.gz	AXDOFSOVTYSJAD-KGLIPLIRSA-N	1	1	319.361	1.912	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cccc([N+](=O)[O-])c1Cl	ZINC000860894339	705312852	/nfs/dbraw/zinc/31/28/52/705312852.db2.gz	QCZCMXRFETVYGQ-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000861343129	705434739	/nfs/dbraw/zinc/43/47/39/705434739.db2.gz	YYEATNIWWZEMQO-ABAIWWIYSA-N	1	1	323.349	1.443	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000861385949	705453143	/nfs/dbraw/zinc/45/31/43/705453143.db2.gz	ZEVOPVMSYAVTMI-UHFFFAOYSA-N	1	1	316.317	1.643	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000825688495	705714430	/nfs/dbraw/zinc/71/44/30/705714430.db2.gz	MIENZSOVSVJXOH-AWEZNQCLSA-N	1	1	307.350	1.182	20	5		DDBDMO
C[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)CC1(C)COC1	ZINC000863298458	705894454	/nfs/dbraw/zinc/89/44/54/705894454.db2.gz	FAGYCOXJBXUNET-UHFFFAOYSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827320512	705975027	/nfs/dbraw/zinc/97/50/27/705975027.db2.gz	RZBLQYDYIYZJMY-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828249358	706146363	/nfs/dbraw/zinc/14/63/63/706146363.db2.gz	ZZZUWWDCXBVOAY-JTNHKYCSSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828249358	706146365	/nfs/dbraw/zinc/14/63/65/706146365.db2.gz	ZZZUWWDCXBVOAY-JTNHKYCSSA-N	1	1	307.350	1.179	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2CCO)c([N+](=O)[O-])c1	ZINC000828461508	706184047	/nfs/dbraw/zinc/18/40/47/706184047.db2.gz	ZWBPZQIQQXBPRG-LBPRGKRZSA-N	1	1	324.337	1.762	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000829449525	706335001	/nfs/dbraw/zinc/33/50/01/706335001.db2.gz	CEDNZBPSZOMRCU-KFWWJZLASA-N	1	1	303.362	1.909	20	5		DDBDMO
CN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000865718305	706505088	/nfs/dbraw/zinc/50/50/88/706505088.db2.gz	XXVAVMNAPLHXSH-CYBMUJFWSA-N	1	1	321.352	1.972	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510072	706527855	/nfs/dbraw/zinc/52/78/55/706527855.db2.gz	QSOZCALVQHWYFH-KGLIPLIRSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510072	706527857	/nfs/dbraw/zinc/52/78/57/706527857.db2.gz	QSOZCALVQHWYFH-KGLIPLIRSA-N	1	1	323.349	1.401	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880434021	706974835	/nfs/dbraw/zinc/97/48/35/706974835.db2.gz	VOMMNTDVPXIFIM-SOUVJXGZSA-N	1	1	310.350	1.364	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+][C@H]1C[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000927147327	712946920	/nfs/dbraw/zinc/94/69/20/712946920.db2.gz	KQRHMNTXMFXBEY-UXIGCNINSA-N	1	1	316.361	1.778	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000882476846	707648404	/nfs/dbraw/zinc/64/84/04/707648404.db2.gz	DVQQFFQCFSEFRR-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000882489549	707660205	/nfs/dbraw/zinc/66/02/05/707660205.db2.gz	DBEQHIJKPLAMSB-GFCCVEGCSA-N	1	1	313.304	1.897	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000882489549	707660208	/nfs/dbraw/zinc/66/02/08/707660208.db2.gz	DBEQHIJKPLAMSB-GFCCVEGCSA-N	1	1	313.304	1.897	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000882489197	707660825	/nfs/dbraw/zinc/66/08/25/707660825.db2.gz	NXXXPUCWELWXRP-SNVBAGLBSA-N	1	1	302.334	1.900	20	5		DDBDMO
CON1CCC([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000839132347	708028782	/nfs/dbraw/zinc/02/87/82/708028782.db2.gz	ZMPRYHDPQHWBPE-HNNXBMFYSA-N	1	1	309.366	1.586	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897216830	708256071	/nfs/dbraw/zinc/25/60/71/708256071.db2.gz	VTKMGRUDZGWOLA-QWHCGFSZSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897220529	708258907	/nfs/dbraw/zinc/25/89/07/708258907.db2.gz	XCDXIFYUDIIXLQ-LSDHHAIUSA-N	1	1	309.341	1.769	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1	ZINC000886026569	708684034	/nfs/dbraw/zinc/68/40/34/708684034.db2.gz	YKNNQKSCJFFEAK-OAHLLOKOSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCCC[C@@H]1CN1CCOCC1	ZINC000886026569	708684036	/nfs/dbraw/zinc/68/40/36/708684036.db2.gz	YKNNQKSCJFFEAK-OAHLLOKOSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H](N2CCOCC2)CC1	ZINC000886188160	708712039	/nfs/dbraw/zinc/71/20/39/708712039.db2.gz	MENSLUBVGYBHGT-HNNXBMFYSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](N2CCOCC2)CC1	ZINC000886188160	708712042	/nfs/dbraw/zinc/71/20/42/708712042.db2.gz	MENSLUBVGYBHGT-HNNXBMFYSA-N	1	1	320.393	1.677	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C)C[C@@H]1CC(C)C	ZINC000886593587	708785434	/nfs/dbraw/zinc/78/54/34/708785434.db2.gz	UVHVRITZDVKLDZ-ZDUSSCGKSA-N	1	1	323.397	1.288	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)C[C@@H]1CO	ZINC000912739800	713079543	/nfs/dbraw/zinc/07/95/43/713079543.db2.gz	HQIDKFGNWOXHQI-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C[C@@H]1CO	ZINC000912739800	713079546	/nfs/dbraw/zinc/07/95/46/713079546.db2.gz	HQIDKFGNWOXHQI-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000900046898	709275978	/nfs/dbraw/zinc/27/59/78/709275978.db2.gz	WDDLINHTDQXGJD-VHSXEESVSA-N	1	1	306.322	1.004	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC[C@H]2[C@@H](C)C[NH+](C)C)c1[N+](=O)[O-]	ZINC000912811834	713098553	/nfs/dbraw/zinc/09/85/53/713098553.db2.gz	ORXQGARZATYAPZ-JQWIXIFHSA-N	1	1	323.397	1.819	20	5		DDBDMO
CC(C)(CC[NH+]1CCOCC1)NC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000912949020	713132198	/nfs/dbraw/zinc/13/21/98/713132198.db2.gz	KZZMKBNAPIUFNO-UHFFFAOYSA-N	1	1	315.414	1.439	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@]2(C)C[C@H](O)C[N@H+]2C)cc1[N+](=O)[O-]	ZINC000900968697	709854571	/nfs/dbraw/zinc/85/45/71/709854571.db2.gz	WRMDPUMODKBGAS-RBOXIYTFSA-N	1	1	321.377	1.536	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc([N+](=O)[O-])ccc3N)C[C@@]2(C)C1	ZINC000913282133	713190696	/nfs/dbraw/zinc/19/06/96/713190696.db2.gz	YOARWAVSWCEJSW-IYBDPMFKSA-N	1	1	318.377	1.591	20	5		DDBDMO
CC[N@@H+](CCO)CCNCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000893645909	710762335	/nfs/dbraw/zinc/76/23/35/710762335.db2.gz	AWGBMOHHRZCENF-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
CCN(CCO)CC[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000893645909	710762341	/nfs/dbraw/zinc/76/23/41/710762341.db2.gz	AWGBMOHHRZCENF-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000893872506	710867570	/nfs/dbraw/zinc/86/75/70/710867570.db2.gz	KVXNSPKRHFFLFQ-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H]1C[NH2+]C[C@H]1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000903445295	711128947	/nfs/dbraw/zinc/12/89/47/711128947.db2.gz	HYBSCTVDKBXXTI-AGIUHOORSA-N	1	1	305.382	1.332	20	5		DDBDMO
C[C@@H]1C[NH2+]C[C@H]1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000903445295	711128949	/nfs/dbraw/zinc/12/89/49/711128949.db2.gz	HYBSCTVDKBXXTI-AGIUHOORSA-N	1	1	305.382	1.332	20	5		DDBDMO
CC(C)Oc1nc(N(C)CC[N@@H+](C)CCO)ccc1[N+](=O)[O-]	ZINC000894592608	711199072	/nfs/dbraw/zinc/19/90/72/711199072.db2.gz	ZGXHUYWWJJOMPD-UHFFFAOYSA-N	1	1	312.370	1.137	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000894638822	711226485	/nfs/dbraw/zinc/22/64/85/711226485.db2.gz	HFPJOAMLPOCPIN-PHIMTYICSA-N	1	1	309.366	1.833	20	5		DDBDMO
[NH3+]CC1([C@@H]2CCCCN2CCn2ccc([N+](=O)[O-])n2)CCC1	ZINC000903813818	711289216	/nfs/dbraw/zinc/28/92/16/711289216.db2.gz	ISANSSAZXPNXSK-ZDUSSCGKSA-N	1	1	307.398	1.775	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@@H]2Cc3c[nH+]cn3C2)c(Br)c1	ZINC000894995583	711356223	/nfs/dbraw/zinc/35/62/23/711356223.db2.gz	DEISYQDDPDUMOI-SSDOTTSWSA-N	1	1	324.138	1.986	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@H]1C(C)(C)C	ZINC000895100667	711411392	/nfs/dbraw/zinc/41/13/92/711411392.db2.gz	DTFOISQZPBLHFQ-AWEZNQCLSA-N	1	1	320.393	1.860	20	5		DDBDMO
CC(=O)c1ccc(N[C@@H](C)[C@H]2C[N@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246144	711463877	/nfs/dbraw/zinc/46/38/77/711463877.db2.gz	LVWVGFMQPQAHIM-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246144	711463879	/nfs/dbraw/zinc/46/38/79/711463879.db2.gz	LVWVGFMQPQAHIM-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CN(C)CC[N@H+]1C	ZINC000895246826	711464535	/nfs/dbraw/zinc/46/45/35/711464535.db2.gz	QNLVKDDNNJISRN-HZMBPMFUSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[N@H+](C)CCN1C	ZINC000895246826	711464538	/nfs/dbraw/zinc/46/45/38/711464538.db2.gz	QNLVKDDNNJISRN-HZMBPMFUSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895246826	711464539	/nfs/dbraw/zinc/46/45/39/711464539.db2.gz	QNLVKDDNNJISRN-HZMBPMFUSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000895767826	711600513	/nfs/dbraw/zinc/60/05/13/711600513.db2.gz	SAJILWICXFUUSD-GFCCVEGCSA-N	1	1	304.350	1.603	20	5		DDBDMO
C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCN1C	ZINC000896572426	711756112	/nfs/dbraw/zinc/75/61/12/711756112.db2.gz	VBLUSBVZIRDZTC-MWLCHTKSSA-N	1	1	312.395	1.020	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2[C@@H](CC[NH+](C)C)CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000914444057	713396276	/nfs/dbraw/zinc/39/62/76/713396276.db2.gz	OVIGKETXHXVVDD-CMPLNLGQSA-N	1	1	323.397	1.961	20	5		DDBDMO
Cc1c(NC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000929222367	713570300	/nfs/dbraw/zinc/57/03/00/713570300.db2.gz	HAIZXGFOFSKHKC-TXEJJXNPSA-N	1	1	304.350	1.929	20	5		DDBDMO
CCOCCOCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929987476	713729471	/nfs/dbraw/zinc/72/94/71/713729471.db2.gz	JYJLLHMCJHRKKR-ZDUSSCGKSA-N	1	1	324.381	1.529	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000923297537	714301801	/nfs/dbraw/zinc/30/18/01/714301801.db2.gz	JNRUOYXWCSKWAB-QWHCGFSZSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H]2C2OCCO2)cc1	ZINC000933902376	714697270	/nfs/dbraw/zinc/69/72/70/714697270.db2.gz	ZNTPYTDCSFMBHB-ZIAGYGMSSA-N	1	1	308.334	1.466	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115523	714744973	/nfs/dbraw/zinc/74/49/73/714744973.db2.gz	ATJKKNOKBRBEEN-UKRRQHHQSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115523	714744977	/nfs/dbraw/zinc/74/49/77/714744977.db2.gz	ATJKKNOKBRBEEN-UKRRQHHQSA-N	1	1	319.361	1.593	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)CCc3cc(F)ccc3[N+](=O)[O-])C[C@H]2C1	ZINC000935694248	715118386	/nfs/dbraw/zinc/11/83/86/715118386.db2.gz	MQYAKCCBNVIIND-BETUJISGSA-N	1	1	321.352	1.687	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC001164637377	719160848	/nfs/dbraw/zinc/16/08/48/719160848.db2.gz	OKGXOHOZYHVQBG-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC001164643443	719218259	/nfs/dbraw/zinc/21/82/59/719218259.db2.gz	YVJKPLLLUMSRBP-WDEREUQCSA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(N2C[C@H]3OCC[N@H+](C)[C@@H]3C2)nc1Cl	ZINC001164664943	719385801	/nfs/dbraw/zinc/38/58/01/719385801.db2.gz	DAHCHOGOLPNYCK-GHMZBOCLSA-N	1	1	312.757	1.471	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncnc4cc([N+](=O)[O-])ccc43)C[C@@H]21	ZINC001164667325	719389465	/nfs/dbraw/zinc/38/94/65/719389465.db2.gz	NVBGKOPMJYIDNC-KBPBESRZSA-N	1	1	315.333	1.057	20	5		DDBDMO
COc1nc(N2CC[NH+](C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC001165037416	721904212	/nfs/dbraw/zinc/90/42/12/721904212.db2.gz	GRYQFBVYUAHAOY-GFCCVEGCSA-N	1	1	322.365	1.299	20	5		DDBDMO
C[C@@H]1CO[C@@H]2CN(c3cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn3)C[C@H]12	ZINC001167174349	732802678	/nfs/dbraw/zinc/80/26/78/732802678.db2.gz	UFOVYCLCNOLWGK-IKQBLONZSA-N	1	1	318.377	1.993	20	5		DDBDMO
CCC(=CC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C)CC	ZINC001125564569	734607511	/nfs/dbraw/zinc/60/75/11/734607511.db2.gz	CUKAFFKVHXUFKM-UHFFFAOYSA-N	1	1	309.370	1.281	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cccc2ccccc21)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936491	742841731	/nfs/dbraw/zinc/84/17/31/742841731.db2.gz	LFFBKOBNMXSDRU-HZPDHXFCSA-N	1	1	313.357	1.711	20	5		DDBDMO
O=C(NC1CC[NH+](CCC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002789628	743419276	/nfs/dbraw/zinc/41/92/76/743419276.db2.gz	WLYQQFUVTPDOJB-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CC2CCCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000674254	762078964	/nfs/dbraw/zinc/07/89/64/762078964.db2.gz	MZSZNKXBKCRUOS-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCC1=CC[N@H+](CC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674254	762078973	/nfs/dbraw/zinc/07/89/73/762078973.db2.gz	MZSZNKXBKCRUOS-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CC2CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674254	762078980	/nfs/dbraw/zinc/07/89/80/762078980.db2.gz	MZSZNKXBKCRUOS-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
CC(=O)N1CCCC[C@]12CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169030352	762186550	/nfs/dbraw/zinc/18/65/50/762186550.db2.gz	YYQFHTZRXZOLFS-BZUAXINKSA-N	1	1	309.410	1.909	20	5		DDBDMO
COC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023988	762201840	/nfs/dbraw/zinc/20/18/40/762201840.db2.gz	WLVSQIZRNPORGQ-AVGNSLFASA-N	1	1	308.382	1.411	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023988	762201843	/nfs/dbraw/zinc/20/18/43/762201843.db2.gz	WLVSQIZRNPORGQ-AVGNSLFASA-N	1	1	308.382	1.411	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169052077	762206801	/nfs/dbraw/zinc/20/68/01/762206801.db2.gz	FXEDJRAZTCIFLJ-RBSFLKMASA-N	1	1	324.425	1.702	20	5		DDBDMO
COC(=O)c1cnc2c(c1)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169055913	762210018	/nfs/dbraw/zinc/21/00/18/762210018.db2.gz	RFGKWGUWYYRBGX-BXUZGUMPSA-N	1	1	319.361	1.672	20	5		DDBDMO
CC(C)[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1	ZINC001054265140	759370382	/nfs/dbraw/zinc/37/03/82/759370382.db2.gz	FVIXZFYCKSGEHG-HUUCEWRRSA-N	1	1	303.362	1.692	20	5		DDBDMO
CC(C)[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1	ZINC001054265140	759370394	/nfs/dbraw/zinc/37/03/94/759370394.db2.gz	FVIXZFYCKSGEHG-HUUCEWRRSA-N	1	1	303.362	1.692	20	5		DDBDMO
CC(C)[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1	ZINC001054265140	759370406	/nfs/dbraw/zinc/37/04/06/759370406.db2.gz	FVIXZFYCKSGEHG-HUUCEWRRSA-N	1	1	303.362	1.692	20	5		DDBDMO
Cc1ccccc1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001020139349	760614251	/nfs/dbraw/zinc/61/42/51/760614251.db2.gz	YTOATNKYRIBZPS-KBUPBQIOSA-N	1	1	303.362	1.397	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363442	761493207	/nfs/dbraw/zinc/49/32/07/761493207.db2.gz	UVNLJVZISLZWNM-KLHDSHLOSA-N	1	1	317.389	1.379	20	5		DDBDMO
CCOc1nc(NCC[NH+]2CCSCC2)ccc1[N+](=O)[O-]	ZINC001157045540	764323805	/nfs/dbraw/zinc/32/38/05/764323805.db2.gz	MJMPEXSQPLCEAE-UHFFFAOYSA-N	1	1	312.395	1.849	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCOC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC001170335728	766257768	/nfs/dbraw/zinc/25/77/68/766257768.db2.gz	QPIBKPMOHIEPAV-WBMJQRKESA-N	1	1	324.377	1.618	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N(C)[C@@H]1CC[N@@H+](CC)C[C@H]1C	ZINC001121698269	782631708	/nfs/dbraw/zinc/63/17/08/782631708.db2.gz	FMIPUTPRBXVRJO-VXGBXAGGSA-N	1	1	310.402	1.241	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@H]1C	ZINC001121698266	782632131	/nfs/dbraw/zinc/63/21/31/782632131.db2.gz	FMIPUTPRBXVRJO-NEPJUHHUSA-N	1	1	310.402	1.241	20	5		DDBDMO
CCC(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048630498	769592847	/nfs/dbraw/zinc/59/28/47/769592847.db2.gz	HHOHBVNUTZPPMK-OKILXGFUSA-N	1	1	303.362	1.895	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1(C)CCCCC1	ZINC001133276860	769662247	/nfs/dbraw/zinc/66/22/47/769662247.db2.gz	RNNKXYMVIDWYDP-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@H](CO)[C@H](O)C1)CC2	ZINC001172905989	776916727	/nfs/dbraw/zinc/91/67/27/776916727.db2.gz	VYWFWNLHZXMGFN-IIAWOOMASA-N	1	1	306.362	1.127	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)[C@@](C)(CO)C1	ZINC001173222729	777056276	/nfs/dbraw/zinc/05/62/76/777056276.db2.gz	UZRGCJRGYOHNDL-DAXOMENPSA-N	1	1	308.378	1.591	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC001116009680	780467505	/nfs/dbraw/zinc/46/75/05/780467505.db2.gz	OSYZHQCKEPXUBH-GFCCVEGCSA-N	1	1	318.377	1.851	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1c(C)noc1C	ZINC001266560239	836469034	/nfs/dbraw/zinc/46/90/34/836469034.db2.gz	FLYWNMRNPCSUCZ-TZMCWYRMSA-N	1	1	324.381	1.285	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001155197980	861830373	/nfs/dbraw/zinc/83/03/73/861830373.db2.gz	ZJXVJLVBVZJFAH-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001155197980	861830393	/nfs/dbraw/zinc/83/03/93/861830393.db2.gz	ZJXVJLVBVZJFAH-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
Cc1ncsc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC1	ZINC001273084128	847886594	/nfs/dbraw/zinc/88/65/94/847886594.db2.gz	CKKOOOVABMVORU-GHMZBOCLSA-N	1	1	324.406	1.245	20	5		DDBDMO
Cc1cncc(C[N@H+](C)CCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001273507994	851040906	/nfs/dbraw/zinc/04/09/06/851040906.db2.gz	RSDYWAARHASIPW-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
Cc1cncc(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001273507994	851040914	/nfs/dbraw/zinc/04/09/14/851040914.db2.gz	RSDYWAARHASIPW-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
Cc1cncc(C[N@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001273507994	851040917	/nfs/dbraw/zinc/04/09/17/851040917.db2.gz	RSDYWAARHASIPW-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCC1CCCC1)C2	ZINC001072725590	857641766	/nfs/dbraw/zinc/64/17/66/857641766.db2.gz	PUKVHAHMNZVLBX-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CCC1CCCC1)C2	ZINC001072725590	857641770	/nfs/dbraw/zinc/64/17/70/857641770.db2.gz	PUKVHAHMNZVLBX-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCC1CCCC1)C2	ZINC001072725590	857641777	/nfs/dbraw/zinc/64/17/77/857641777.db2.gz	PUKVHAHMNZVLBX-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC001124088468	859571901	/nfs/dbraw/zinc/57/19/01/859571901.db2.gz	UWTJSHZIGRYCQP-MELADBBJSA-N	1	1	303.362	1.973	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Nc1c(C)cncc1[N+](=O)[O-])C1CC1	ZINC001203061058	860685871	/nfs/dbraw/zinc/68/58/71/860685871.db2.gz	NHVPDWVOAAMZAD-UHFFFAOYSA-N	1	1	307.354	1.326	20	5		DDBDMO
CC(C)[N@H+](C)CC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001152440118	863347315	/nfs/dbraw/zinc/34/73/15/863347315.db2.gz	ZQVDCYJTXLGHOS-UHFFFAOYSA-N	1	1	308.382	1.141	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001152440118	863347326	/nfs/dbraw/zinc/34/73/26/863347326.db2.gz	ZQVDCYJTXLGHOS-UHFFFAOYSA-N	1	1	308.382	1.141	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001329416374	863654520	/nfs/dbraw/zinc/65/45/20/863654520.db2.gz	LLEKPUMEEMDPAA-JSGCOSHPSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cc1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1	ZINC001157767541	864118387	/nfs/dbraw/zinc/11/83/87/864118387.db2.gz	PXMYUFFUMJBDFJ-HUUCEWRRSA-N	1	1	305.378	1.565	20	5		DDBDMO
[NH3+]Cc1ncn(C(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)n1	ZINC001157926848	864269518	/nfs/dbraw/zinc/26/95/18/864269518.db2.gz	UFLBMJZGYDSXTE-UHFFFAOYSA-N	1	1	304.644	1.291	20	5		DDBDMO
Cn1nnnc1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC001331830720	865369787	/nfs/dbraw/zinc/36/97/87/865369787.db2.gz	FDDIXZORMSOFFF-UHFFFAOYSA-N	1	1	320.328	1.637	20	5		DDBDMO
Cn1cc(COC(=O)[C@H]2CCC[N@H+]2C2CCCC2)c([N+](=O)[O-])n1	ZINC001332271090	865713020	/nfs/dbraw/zinc/71/30/20/865713020.db2.gz	QXDMZYAZBWVLDW-CYBMUJFWSA-N	1	1	322.365	1.779	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001324138992	867099586	/nfs/dbraw/zinc/09/95/86/867099586.db2.gz	FSBUWUDJEZNJNX-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001324138992	867099604	/nfs/dbraw/zinc/09/96/04/867099604.db2.gz	FSBUWUDJEZNJNX-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC001335565332	868388226	/nfs/dbraw/zinc/38/82/26/868388226.db2.gz	HYCRISVRUHFJHN-UONOGXRCSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1ccnc(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)c1[N+](=O)[O-]	ZINC001166033092	869808478	/nfs/dbraw/zinc/80/84/78/869808478.db2.gz	UEGAUCFKSGJGIR-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc4nonc4c3[N+](=O)[O-])[C@@H]2C1	ZINC001338298785	869909742	/nfs/dbraw/zinc/90/97/42/869909742.db2.gz	WFESJUUPYXEGOR-IVZWLZJFSA-N	1	1	303.322	1.883	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2c(OC)cc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001226360221	882383229	/nfs/dbraw/zinc/38/32/29/882383229.db2.gz	CGIZYUQCPBZPOL-LLVKDONJSA-N	1	1	324.333	1.863	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)n1	ZINC001339997509	870829240	/nfs/dbraw/zinc/82/92/40/870829240.db2.gz	CPOXNOCVLVEBJF-GARJFASQSA-N	1	1	320.349	1.529	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC(Cc2nn[nH]n2)CC1	ZINC001308048901	871465673	/nfs/dbraw/zinc/46/56/73/871465673.db2.gz	YFGLOXGZFBFAFR-UHFFFAOYSA-N	1	1	320.328	1.702	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001308109347	871472244	/nfs/dbraw/zinc/47/22/44/871472244.db2.gz	VMMLXNVERUDWHG-DZGCQCFKSA-N	1	1	321.377	1.428	20	5		DDBDMO
CS(=O)(=O)C1CC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC001205551251	871623002	/nfs/dbraw/zinc/62/30/02/871623002.db2.gz	PUGKBHZJVZEZNY-UHFFFAOYSA-N	1	1	324.362	1.136	20	5		DDBDMO
CCc1nc(C)c(C[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1	ZINC001316823370	872119865	/nfs/dbraw/zinc/11/98/65/872119865.db2.gz	IXFISYOARGCODY-VXGBXAGGSA-N	1	1	324.381	1.149	20	5		DDBDMO
CCc1nc(C)c(C[N@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001316823370	872119870	/nfs/dbraw/zinc/11/98/70/872119870.db2.gz	IXFISYOARGCODY-VXGBXAGGSA-N	1	1	324.381	1.149	20	5		DDBDMO
CCc1nc(C)c(C[N@@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001316823370	872119875	/nfs/dbraw/zinc/11/98/75/872119875.db2.gz	IXFISYOARGCODY-VXGBXAGGSA-N	1	1	324.381	1.149	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)NCC[N@H+]1CCC(C)(C)C1	ZINC001216486487	876955285	/nfs/dbraw/zinc/95/52/85/876955285.db2.gz	SIBMZKXVAYYSQN-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
COc1ccc(CO[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c([N+](=O)[O-])c1	ZINC001223513747	880987384	/nfs/dbraw/zinc/98/73/84/880987384.db2.gz	HBGHPJSKMYYGID-IUIKQTSFSA-N	1	1	320.345	1.924	20	5		DDBDMO
COC(=O)c1cccc(OCC[N@@H+]2CC[C@@H](OC)C2)c1[N+](=O)[O-]	ZINC001227897917	883220630	/nfs/dbraw/zinc/22/06/30/883220630.db2.gz	VRPGPSCHCSAXCG-LLVKDONJSA-N	1	1	324.333	1.481	20	5		DDBDMO
CCOCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001231406391	885620583	/nfs/dbraw/zinc/62/05/83/885620583.db2.gz	DYOAYLDORWAIRG-UHFFFAOYSA-N	1	1	309.366	1.569	20	5		DDBDMO
COC(=O)c1cnc(O[C@@H]2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC001233860348	887397728	/nfs/dbraw/zinc/39/77/28/887397728.db2.gz	ZVJOFZYBBHAOIP-LLVKDONJSA-N	1	1	309.322	1.640	20	5		DDBDMO
C[N@H+]1CCC[C@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1	ZINC001234359571	887905161	/nfs/dbraw/zinc/90/51/61/887905161.db2.gz	HPPAAPYADBUSIH-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@]1(CO)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001254545138	896496108	/nfs/dbraw/zinc/49/61/08/896496108.db2.gz	JEBJSZLTNZEBCX-CJNGLKHVSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2[C@H](C1)OCCN2C	ZINC001254554552	896498515	/nfs/dbraw/zinc/49/85/15/896498515.db2.gz	BOISKXGTLPDPLW-WQVCFCJDSA-N	1	1	305.378	1.541	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](C)CCN1[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569250	896505608	/nfs/dbraw/zinc/50/56/08/896505608.db2.gz	JEQQCRNZZCGRBS-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C)CCN1[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569250	896505624	/nfs/dbraw/zinc/50/56/24/896505624.db2.gz	JEQQCRNZZCGRBS-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)N1CCCC1	ZINC001261297527	899454154	/nfs/dbraw/zinc/45/41/54/899454154.db2.gz	DEAHPXDXSNICBS-UHFFFAOYSA-N	1	1	303.362	1.965	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC001262359575	900130994	/nfs/dbraw/zinc/13/09/94/900130994.db2.gz	CUYOPGVTPKBBQU-LLVKDONJSA-N	1	1	307.350	1.635	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC001262359575	900131001	/nfs/dbraw/zinc/13/10/01/900131001.db2.gz	CUYOPGVTPKBBQU-LLVKDONJSA-N	1	1	307.350	1.635	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC001262725518	900337270	/nfs/dbraw/zinc/33/72/70/900337270.db2.gz	YWPUOKDYXNPLGK-VZJVUDMVSA-N	1	1	318.377	1.707	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H](O)[C@@H](O)C3)o2)cc1	ZINC000278454282	214164506	/nfs/dbraw/zinc/16/45/06/214164506.db2.gz	YNKBKAXCFLQEOA-OKILXGFUSA-N	1	1	304.302	1.392	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])nc1)C(C)C	ZINC000450596884	230762161	/nfs/dbraw/zinc/76/21/61/230762161.db2.gz	GNONOTRSQNJQCO-ZDUSSCGKSA-N	1	1	310.354	1.579	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H](C)C(C)(C)O	ZINC000451358756	231075598	/nfs/dbraw/zinc/07/55/98/231075598.db2.gz	HBLJBFZDUFYVNF-NSHDSACASA-N	1	1	309.366	1.933	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000495218497	529572034	/nfs/dbraw/zinc/57/20/34/529572034.db2.gz	BGIWAKVAUGPEOJ-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000495218497	529572037	/nfs/dbraw/zinc/57/20/37/529572037.db2.gz	BGIWAKVAUGPEOJ-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC(C)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCOCC1	ZINC000090554557	185303275	/nfs/dbraw/zinc/30/32/75/185303275.db2.gz	JKQWTPZWLDWSLL-UHFFFAOYSA-N	1	1	309.366	1.646	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413105328	529784752	/nfs/dbraw/zinc/78/47/52/529784752.db2.gz	NNNICOXQNNRSTC-ZDUSSCGKSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413105328	529784753	/nfs/dbraw/zinc/78/47/53/529784753.db2.gz	NNNICOXQNNRSTC-ZDUSSCGKSA-N	1	1	302.334	1.886	20	5		DDBDMO
COc1ccc(NC(=O)N2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000272779509	210182936	/nfs/dbraw/zinc/18/29/36/210182936.db2.gz	DOHCMBVPEYDPGB-UHFFFAOYSA-N	1	1	308.338	1.773	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000615494262	362306816	/nfs/dbraw/zinc/30/68/16/362306816.db2.gz	KKPFVOVWNJLZPM-LLVKDONJSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000615494262	362306823	/nfs/dbraw/zinc/30/68/23/362306823.db2.gz	KKPFVOVWNJLZPM-LLVKDONJSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000459478465	530054572	/nfs/dbraw/zinc/05/45/72/530054572.db2.gz	IROMDBQKDQRXBC-NSHDSACASA-N	1	1	307.354	1.265	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+](CCCO)Cc2ccccn2)n1	ZINC000287044123	219284701	/nfs/dbraw/zinc/28/47/01/219284701.db2.gz	SZHSDJGHMWGMQQ-UHFFFAOYSA-N	1	1	305.338	1.071	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC(C)(C)O	ZINC000265138641	186337293	/nfs/dbraw/zinc/33/72/93/186337293.db2.gz	PMRITZNQWLLXMQ-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000265994985	186352491	/nfs/dbraw/zinc/35/24/91/186352491.db2.gz	JJCVHGREOGODLL-CYBMUJFWSA-N	1	1	323.397	1.276	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000026198164	352206152	/nfs/dbraw/zinc/20/61/52/352206152.db2.gz	GPOINSKHXWILSI-UMVBOHGHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000026198164	352206156	/nfs/dbraw/zinc/20/61/56/352206156.db2.gz	GPOINSKHXWILSI-UMVBOHGHSA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000052289129	352607524	/nfs/dbraw/zinc/60/75/24/352607524.db2.gz	RFYQHIGWNTXFQB-UHFFFAOYSA-N	1	1	303.322	1.599	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1	ZINC000491559810	234203042	/nfs/dbraw/zinc/20/30/42/234203042.db2.gz	BJYCJJTYMZGVIA-ZBKLQPJUSA-N	1	1	319.361	1.445	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)NCc2ccccc2[N+](=O)[O-])no1	ZINC000355699610	290975009	/nfs/dbraw/zinc/97/50/09/290975009.db2.gz	FENGLKRGJQVYDZ-UHFFFAOYSA-N	1	1	304.306	1.574	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000072731515	353213352	/nfs/dbraw/zinc/21/33/52/353213352.db2.gz	QQBAUNRFDBXTPA-GFCCVEGCSA-N	1	1	306.366	1.727	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000076679687	353432883	/nfs/dbraw/zinc/43/28/83/353432883.db2.gz	XMBVZOSAMXRPAB-UHFFFAOYSA-N	1	1	306.366	1.526	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078620884	353525541	/nfs/dbraw/zinc/52/55/41/353525541.db2.gz	YYPQVGHWWICMHI-NSHDSACASA-N	1	1	314.345	1.808	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078620884	353525542	/nfs/dbraw/zinc/52/55/42/353525542.db2.gz	YYPQVGHWWICMHI-NSHDSACASA-N	1	1	314.345	1.808	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000093344046	353898027	/nfs/dbraw/zinc/89/80/27/353898027.db2.gz	WOZGRMFGWORLDC-FZMZJTMJSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000139417929	354127853	/nfs/dbraw/zinc/12/78/53/354127853.db2.gz	LAYWJMZDPGZJQN-CQSZACIVSA-N	1	1	321.381	1.400	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)C[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119469	354196597	/nfs/dbraw/zinc/19/65/97/354196597.db2.gz	YKYWFEOVEGBPRU-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119469	354196599	/nfs/dbraw/zinc/19/65/99/354196599.db2.gz	YKYWFEOVEGBPRU-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@H](CO)CC2)c1	ZINC000293114300	354454197	/nfs/dbraw/zinc/45/41/97/354454197.db2.gz	LVKSBXOYNPTBIA-DZGCQCFKSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1N1CCC[N@@H+](CCO)CC1	ZINC000312224496	354477085	/nfs/dbraw/zinc/47/70/85/354477085.db2.gz	FUSZQWSQNARNTG-UHFFFAOYSA-N	1	1	300.746	1.148	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1N1CCC[N@H+](CCO)CC1	ZINC000312224496	354477088	/nfs/dbraw/zinc/47/70/88/354477088.db2.gz	FUSZQWSQNARNTG-UHFFFAOYSA-N	1	1	300.746	1.148	20	5		DDBDMO
CC[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H]1CCOC1	ZINC000589737648	355017669	/nfs/dbraw/zinc/01/76/69/355017669.db2.gz	BQTYIEIQGBTGKX-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
CC[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H]1CCOC1	ZINC000589737648	355017672	/nfs/dbraw/zinc/01/76/72/355017672.db2.gz	BQTYIEIQGBTGKX-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000590582631	355120174	/nfs/dbraw/zinc/12/01/74/355120174.db2.gz	BAINTBFDLMFLAY-SNVBAGLBSA-N	1	1	308.338	1.671	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CC(C)(C)CO)c1	ZINC000590655906	355138813	/nfs/dbraw/zinc/13/88/13/355138813.db2.gz	HCYFVDJUJUXBTC-UHFFFAOYSA-N	1	1	310.350	1.832	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CC(C)(C)CO)c1	ZINC000590655906	355138817	/nfs/dbraw/zinc/13/88/17/355138817.db2.gz	HCYFVDJUJUXBTC-UHFFFAOYSA-N	1	1	310.350	1.832	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+]([C@H]3CCC[C@@H]3O)CC2)c(F)c1	ZINC000591144263	355254100	/nfs/dbraw/zinc/25/41/00/355254100.db2.gz	BVWRVCXXLKFITN-STQMWFEESA-N	1	1	310.329	1.164	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ncc([N+](=O)[O-])cc1F	ZINC000591155624	355256750	/nfs/dbraw/zinc/25/67/50/355256750.db2.gz	SEIWNGBBKOLMSX-SNVBAGLBSA-N	1	1	312.345	1.410	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC2(CCCC2)O1	ZINC000592196855	355533450	/nfs/dbraw/zinc/53/34/50/355533450.db2.gz	ZBTSKBUMEQDYDC-GXTWGEPZSA-N	1	1	324.381	1.186	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C(C)(C)C1	ZINC000593340118	355858209	/nfs/dbraw/zinc/85/82/09/355858209.db2.gz	VBTPCHZOBBNSRC-UHFFFAOYSA-N	1	1	324.381	1.116	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C(C)(C)C1	ZINC000593340118	355858212	/nfs/dbraw/zinc/85/82/12/355858212.db2.gz	VBTPCHZOBBNSRC-UHFFFAOYSA-N	1	1	324.381	1.116	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593578989	355933257	/nfs/dbraw/zinc/93/32/57/355933257.db2.gz	RQBUIIFUODOSOX-GHMZBOCLSA-N	1	1	309.341	1.827	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000595353704	356460743	/nfs/dbraw/zinc/46/07/43/356460743.db2.gz	JUMQQPUZCISXOA-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000595484441	356512841	/nfs/dbraw/zinc/51/28/41/356512841.db2.gz	LCKAYEZTTVMDEM-OAHLLOKOSA-N	1	1	309.410	1.770	20	5		DDBDMO
CCO[C@@H]1C[C@@](CO)([NH2+]Cc2onc(C)c2[N+](=O)[O-])C1(C)C	ZINC000595447079	356496323	/nfs/dbraw/zinc/49/63/23/356496323.db2.gz	FTBFXJHVHYOBAN-RISCZKNCSA-N	1	1	313.354	1.547	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1C[C@H](C)C(O)[C@@H](C)C1	ZINC000595744676	356631880	/nfs/dbraw/zinc/63/18/80/356631880.db2.gz	LRQHOAVMZPMEKQ-RYUDHWBXSA-N	1	1	321.377	1.790	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595736439	356628510	/nfs/dbraw/zinc/62/85/10/356628510.db2.gz	GOECIWRFBOWWRU-CHWSQXEVSA-N	1	1	319.361	1.574	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2COC[C@@]2(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000595756461	356638763	/nfs/dbraw/zinc/63/87/63/356638763.db2.gz	GGPQELHCEMFEBK-MLGOLLRUSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000595759904	356641028	/nfs/dbraw/zinc/64/10/28/356641028.db2.gz	QVYOBNCNFLYFCW-LRDDRELGSA-N	1	1	319.361	1.892	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](C3CCC3)C2)c1	ZINC000595838735	356672792	/nfs/dbraw/zinc/67/27/92/356672792.db2.gz	VHVLNKQLXHPJTC-DZGCQCFKSA-N	1	1	308.382	1.664	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595873316	356686727	/nfs/dbraw/zinc/68/67/27/356686727.db2.gz	LLJFXEFQABKQIV-LRDDRELGSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595873316	356686730	/nfs/dbraw/zinc/68/67/30/356686730.db2.gz	LLJFXEFQABKQIV-LRDDRELGSA-N	1	1	321.377	1.792	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000596074494	356763538	/nfs/dbraw/zinc/76/35/38/356763538.db2.gz	AZGODRKAXQHARE-OCCSQVGLSA-N	1	1	304.350	1.732	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C	ZINC000596137025	356787337	/nfs/dbraw/zinc/78/73/37/356787337.db2.gz	OCOUWMXJLSARGC-JQWIXIFHSA-N	1	1	306.366	1.613	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596432129	356877846	/nfs/dbraw/zinc/87/78/46/356877846.db2.gz	QMHVUIHBEFDTJX-MNOVXSKESA-N	1	1	322.365	1.215	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596432129	356877848	/nfs/dbraw/zinc/87/78/48/356877848.db2.gz	QMHVUIHBEFDTJX-MNOVXSKESA-N	1	1	322.365	1.215	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596538593	356911378	/nfs/dbraw/zinc/91/13/78/356911378.db2.gz	MODNBXYIAWYKKV-AWEZNQCLSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000598221531	357497184	/nfs/dbraw/zinc/49/71/84/357497184.db2.gz	XDGICIKCXTYRMR-NSHDSACASA-N	1	1	321.381	1.763	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000598590883	357644168	/nfs/dbraw/zinc/64/41/68/357644168.db2.gz	RSDGKCQKFHOFTH-MNOVXSKESA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CC1(C)COC1	ZINC000599571398	357978855	/nfs/dbraw/zinc/97/88/55/357978855.db2.gz	GEEIISIQXKOPQY-UHFFFAOYSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CC1(C)COC1	ZINC000599571398	357978857	/nfs/dbraw/zinc/97/88/57/357978857.db2.gz	GEEIISIQXKOPQY-UHFFFAOYSA-N	1	1	307.350	1.810	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599684810	358024243	/nfs/dbraw/zinc/02/42/43/358024243.db2.gz	RDXKLOHSNOQUGW-KLZCAUPSSA-N	1	1	322.361	1.180	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599753569	358047824	/nfs/dbraw/zinc/04/78/24/358047824.db2.gz	ORTJFNXWKLYCPG-GFCCVEGCSA-N	1	1	322.365	1.400	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1nncs1)c1cccc([N+](=O)[O-])c1	ZINC000180432487	199158570	/nfs/dbraw/zinc/15/85/70/199158570.db2.gz	AJAUIROJNCWHGR-QMMMGPOBSA-N	1	1	307.335	1.736	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)C[N@@H+](C)C1CCC1	ZINC000600816931	358323412	/nfs/dbraw/zinc/32/34/12/358323412.db2.gz	VJNZKOCSAJQVHX-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1cccnc1)C1CC1	ZINC000180731371	199202680	/nfs/dbraw/zinc/20/26/80/199202680.db2.gz	UULFUTLERDPVDI-UHFFFAOYSA-N	1	1	314.345	1.816	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000601198528	358443923	/nfs/dbraw/zinc/44/39/23/358443923.db2.gz	CEOYSIKKGPDIDQ-GFCCVEGCSA-N	1	1	310.329	1.164	20	5		DDBDMO
CNC(=O)[C@H]1CCC[C@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601136390	358416772	/nfs/dbraw/zinc/41/67/72/358416772.db2.gz	QNCCGBFQAOPMAV-SMDDNHRTSA-N	1	1	314.345	1.892	20	5		DDBDMO
O=[N+]([O-])c1ccn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)n1	ZINC000601960891	358754060	/nfs/dbraw/zinc/75/40/60/358754060.db2.gz	XIWVXXGUSVBSGZ-OAHLLOKOSA-N	1	1	302.334	1.428	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@@H]3COC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000601974191	358761354	/nfs/dbraw/zinc/76/13/54/358761354.db2.gz	QNAFAZDHSIGFFX-UPJWGTAASA-N	1	1	319.361	1.808	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(OC[C@H]3CCOC3)CC2)c([N+](=O)[O-])n1	ZINC000602604894	359067877	/nfs/dbraw/zinc/06/78/77/359067877.db2.gz	QNGBROMAIRYKDD-LBPRGKRZSA-N	1	1	324.381	1.346	20	5		DDBDMO
Cc1n[nH]cc1C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602653039	359102249	/nfs/dbraw/zinc/10/22/49/359102249.db2.gz	MCAAVXPBNUCKFA-UHFFFAOYSA-N	1	1	304.354	1.739	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602777762	359183982	/nfs/dbraw/zinc/18/39/82/359183982.db2.gz	LAQUCIKKXCRBTD-CQSZACIVSA-N	1	1	309.414	1.763	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2cccs2)CC1	ZINC000602788284	359192157	/nfs/dbraw/zinc/19/21/57/359192157.db2.gz	MXCKEBATDHKFSC-UHFFFAOYSA-N	1	1	321.406	1.983	20	5		DDBDMO
Cc1cc(C2CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)n[nH]1	ZINC000602797810	359198779	/nfs/dbraw/zinc/19/87/79/359198779.db2.gz	LSSVMEBEEDNTCQ-UHFFFAOYSA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc(C2CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)[nH]n1	ZINC000602797810	359198783	/nfs/dbraw/zinc/19/87/83/359198783.db2.gz	LSSVMEBEEDNTCQ-UHFFFAOYSA-N	1	1	304.354	1.739	20	5		DDBDMO
Cn1cc(C[NH2+][C@]2(CO)CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602799407	359200134	/nfs/dbraw/zinc/20/01/34/359200134.db2.gz	SMCCGSGGKYUOCZ-HNNXBMFYSA-N	1	1	302.334	1.252	20	5		DDBDMO
CC1(C)C[N@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccco1	ZINC000602928005	359298611	/nfs/dbraw/zinc/29/86/11/359298611.db2.gz	VJCRVTDUNVVFBU-OCCSQVGLSA-N	1	1	320.349	1.828	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccco1	ZINC000602928005	359298617	/nfs/dbraw/zinc/29/86/17/359298617.db2.gz	VJCRVTDUNVVFBU-OCCSQVGLSA-N	1	1	320.349	1.828	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](OC)C[C@@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964604	359327765	/nfs/dbraw/zinc/32/77/65/359327765.db2.gz	RWDUEEYRCIIWSC-DOMZBBRYSA-N	1	1	310.350	1.575	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@](C)(CO)C1	ZINC000602964442	359327930	/nfs/dbraw/zinc/32/79/30/359327930.db2.gz	PNLVSYXNQSMROH-HZPDHXFCSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000186908766	200029678	/nfs/dbraw/zinc/02/96/78/200029678.db2.gz	AGGVRCOBRWMDOF-DYEKYZERSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CCC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000608839546	360249470	/nfs/dbraw/zinc/24/94/70/360249470.db2.gz	GGCUTFNPQMTGBY-LBPRGKRZSA-N	1	1	309.370	1.009	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609383034	360303236	/nfs/dbraw/zinc/30/32/36/360303236.db2.gz	IKNJFHXSHAPXKU-GFCCVEGCSA-N	1	1	319.361	1.818	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@H](CCO)C2)c1	ZINC000609204399	360273709	/nfs/dbraw/zinc/27/37/09/360273709.db2.gz	MUQXDZKGYRNRMX-HIFRSBDPSA-N	1	1	324.377	1.429	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000609476805	360311954	/nfs/dbraw/zinc/31/19/54/360311954.db2.gz	VPQJTNKWJOMZQG-SECBINFHSA-N	1	1	307.354	1.237	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000609521481	360317343	/nfs/dbraw/zinc/31/73/43/360317343.db2.gz	ISYFKWKJANTGLN-VIFPVBQESA-N	1	1	307.306	1.005	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCCC[N@H+]1C	ZINC000609547488	360322868	/nfs/dbraw/zinc/32/28/68/360322868.db2.gz	GYVVJBHJHLDNGZ-CYBMUJFWSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cn[nH]c1	ZINC000610487745	360448938	/nfs/dbraw/zinc/44/89/38/360448938.db2.gz	ULPMKNJMJIRLCY-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000610506763	360456249	/nfs/dbraw/zinc/45/62/49/360456249.db2.gz	XIWCNZREGWJQRL-NEPJUHHUSA-N	1	1	305.334	1.327	20	5		DDBDMO
CC[C@@H](C[NH+]1CCCC1)NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000611556703	360759242	/nfs/dbraw/zinc/75/92/42/360759242.db2.gz	OCAGCGWETQWUOG-LBPRGKRZSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC[C@@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000611615846	360776792	/nfs/dbraw/zinc/77/67/92/360776792.db2.gz	CZVMGNLRQDKSFN-ZIAGYGMSSA-N	1	1	322.409	1.888	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000272017828	209386983	/nfs/dbraw/zinc/38/69/83/209386983.db2.gz	UUABFDLTTZXYQJ-UHFFFAOYSA-N	1	1	307.354	1.262	20	5		DDBDMO
CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000194878150	201305536	/nfs/dbraw/zinc/30/55/36/201305536.db2.gz	VJUFHNJMXCLMPI-HNNXBMFYSA-N	1	1	324.381	1.703	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](CCO)C(C)(C)C1	ZINC000619497062	364039389	/nfs/dbraw/zinc/03/93/89/364039389.db2.gz	ZMAPZPKGVSUREM-UHFFFAOYSA-N	1	1	311.386	1.013	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000619497062	364039396	/nfs/dbraw/zinc/03/93/96/364039396.db2.gz	ZMAPZPKGVSUREM-UHFFFAOYSA-N	1	1	311.386	1.013	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](O)CC1	ZINC000293013081	223352527	/nfs/dbraw/zinc/35/25/27/223352527.db2.gz	DRZOVRRKJLIZAR-NWDGAFQWSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](O)CC1	ZINC000293013081	223352530	/nfs/dbraw/zinc/35/25/30/223352530.db2.gz	DRZOVRRKJLIZAR-NWDGAFQWSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000264670896	204066714	/nfs/dbraw/zinc/06/67/14/204066714.db2.gz	JGUCPROXTSTKGH-GFCCVEGCSA-N	1	1	306.366	1.781	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000264781571	204149249	/nfs/dbraw/zinc/14/92/49/204149249.db2.gz	QVFLFHLOONIBEF-LLVKDONJSA-N	1	1	309.326	1.161	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](C)C(=O)NC[C@@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000271731139	209164458	/nfs/dbraw/zinc/16/44/58/209164458.db2.gz	MZSCYGMMOWYSQD-AGIUHOORSA-N	1	1	321.377	1.929	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000267514987	206119143	/nfs/dbraw/zinc/11/91/43/206119143.db2.gz	JZQMYRUNRYZSAO-GFCCVEGCSA-N	1	1	306.366	1.980	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000023695497	182366760	/nfs/dbraw/zinc/36/67/60/182366760.db2.gz	CSZFSBICUWURTB-SNVBAGLBSA-N	1	1	321.333	1.994	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000023695497	182366763	/nfs/dbraw/zinc/36/67/63/182366763.db2.gz	CSZFSBICUWURTB-SNVBAGLBSA-N	1	1	321.333	1.994	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCS1	ZINC000171694597	248323339	/nfs/dbraw/zinc/32/33/39/248323339.db2.gz	NRLGFJOABQUVQI-YPMHNXCESA-N	1	1	312.391	1.772	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421021460	307300962	/nfs/dbraw/zinc/30/09/62/307300962.db2.gz	OBYSYWSVYKWLTO-JHJVBQTASA-N	1	1	310.350	1.180	20	5		DDBDMO
Cc1nn(C)c(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000301307841	248823230	/nfs/dbraw/zinc/82/32/30/248823230.db2.gz	ZYQSKKFDPZYRBL-ZDUSSCGKSA-N	1	1	323.397	1.185	20	5		DDBDMO
CCOc1cccc(NC[C@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000273864024	211123947	/nfs/dbraw/zinc/12/39/47/211123947.db2.gz	MXSPDKIUZDTJIL-LBPRGKRZSA-N	1	1	308.382	1.651	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000159761299	197362319	/nfs/dbraw/zinc/36/23/19/197362319.db2.gz	NIQGWEBYTZZXPW-UHFFFAOYSA-N	1	1	315.333	1.106	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2ccccc2C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000159761299	197362323	/nfs/dbraw/zinc/36/23/23/197362323.db2.gz	NIQGWEBYTZZXPW-UHFFFAOYSA-N	1	1	315.333	1.106	20	5		DDBDMO
C[C@@H](CO)[N@@H+]1CCCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000339116766	250301386	/nfs/dbraw/zinc/30/13/86/250301386.db2.gz	BCWQEHFEBFOJOR-LBPRGKRZSA-N	1	1	309.366	1.189	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000339116766	250301388	/nfs/dbraw/zinc/30/13/88/250301388.db2.gz	BCWQEHFEBFOJOR-LBPRGKRZSA-N	1	1	309.366	1.189	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000110993486	194379558	/nfs/dbraw/zinc/37/95/58/194379558.db2.gz	MOQSWZAKBIBYSD-LBPRGKRZSA-N	1	1	323.397	1.517	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cnn(C)c1	ZINC000268926150	207094162	/nfs/dbraw/zinc/09/41/62/207094162.db2.gz	LATQRQIPUFYPQG-SNVBAGLBSA-N	1	1	303.322	1.618	20	5		DDBDMO
C[C@@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000057707198	184048359	/nfs/dbraw/zinc/04/83/59/184048359.db2.gz	HQHWSDGEAUWCDK-LBPRGKRZSA-N	1	1	321.377	1.963	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000119661137	195012454	/nfs/dbraw/zinc/01/24/54/195012454.db2.gz	UPSUEYMETZPXJQ-SNVBAGLBSA-N	1	1	307.354	1.075	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000119824514	195044036	/nfs/dbraw/zinc/04/40/36/195044036.db2.gz	QZMTUWRTODWFRX-LBPRGKRZSA-N	1	1	323.397	1.344	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@]2(CCOC2)C1	ZINC000451893737	285221255	/nfs/dbraw/zinc/22/12/55/285221255.db2.gz	CEORIJNSUGDCLN-HNNXBMFYSA-N	1	1	307.350	1.259	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000289673052	221144748	/nfs/dbraw/zinc/14/47/48/221144748.db2.gz	GHSXFHDSIRXWMR-UHFFFAOYSA-N	1	1	323.397	1.600	20	5		DDBDMO
CN(CCCNC(=O)Nc1cccc([N+](=O)[O-])c1)CC[NH+](C)C	ZINC000289673052	221144751	/nfs/dbraw/zinc/14/47/51/221144751.db2.gz	GHSXFHDSIRXWMR-UHFFFAOYSA-N	1	1	323.397	1.600	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000419317801	533220790	/nfs/dbraw/zinc/22/07/90/533220790.db2.gz	APMDUYWKCNIWBP-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000294939663	224325529	/nfs/dbraw/zinc/32/55/29/224325529.db2.gz	CCWLTWPMDCNIPW-OAHLLOKOSA-N	1	1	308.334	1.606	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000414216446	224313373	/nfs/dbraw/zinc/31/33/73/224313373.db2.gz	VOCBWXZCJMFMMA-GFCCVEGCSA-N	1	1	321.377	1.849	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000121607170	195316482	/nfs/dbraw/zinc/31/64/82/195316482.db2.gz	WFSSREXUQKGFRQ-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000114352109	407563944	/nfs/dbraw/zinc/56/39/44/407563944.db2.gz	BGCHSGBIJSZRPK-UHFFFAOYSA-N	1	1	309.370	1.195	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000090458482	407166147	/nfs/dbraw/zinc/16/61/47/407166147.db2.gz	AZIPGFODBMBENO-CABCVRRESA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000090458482	407166151	/nfs/dbraw/zinc/16/61/51/407166151.db2.gz	AZIPGFODBMBENO-CABCVRRESA-N	1	1	319.361	1.578	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000122383761	407298972	/nfs/dbraw/zinc/29/89/72/407298972.db2.gz	HLLLRBSUBOLHMP-NSHDSACASA-N	1	1	309.370	1.323	20	5		DDBDMO
C[N@@H+](CCNC(=O)CNc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000104574730	407351494	/nfs/dbraw/zinc/35/14/94/407351494.db2.gz	PBNYEJBBEIFIBR-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000103283669	407335912	/nfs/dbraw/zinc/33/59/12/407335912.db2.gz	ROGFRWFIJNZMQZ-CHWSQXEVSA-N	1	1	321.377	1.950	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](C)C1	ZINC000108335416	407383787	/nfs/dbraw/zinc/38/37/87/407383787.db2.gz	DXAOHONTHQNMBJ-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[N@@H+](CCn1cccn1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000111283781	407406289	/nfs/dbraw/zinc/40/62/89/407406289.db2.gz	MEZJVBQOJXDIDU-AWEZNQCLSA-N	1	1	320.349	1.163	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)c2c(c1)COCO2	ZINC000111320671	407407442	/nfs/dbraw/zinc/40/74/42/407407442.db2.gz	QYOZDSPJCPQLGA-NNQSOWQGSA-N	1	1	320.345	1.949	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c2c(c1)COCO2	ZINC000111320671	407407444	/nfs/dbraw/zinc/40/74/44/407407444.db2.gz	QYOZDSPJCPQLGA-NNQSOWQGSA-N	1	1	320.345	1.949	20	5		DDBDMO
NC(=O)N1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000111687123	407414250	/nfs/dbraw/zinc/41/42/50/407414250.db2.gz	VFYWLNOEKAKJTM-UHFFFAOYSA-N	1	1	308.338	1.060	20	5		DDBDMO
NC(=O)N1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000111687123	407414252	/nfs/dbraw/zinc/41/42/52/407414252.db2.gz	VFYWLNOEKAKJTM-UHFFFAOYSA-N	1	1	308.338	1.060	20	5		DDBDMO
CC1(C)C[N@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000170629429	407460689	/nfs/dbraw/zinc/46/06/89/407460689.db2.gz	XVFGCRWSCUNURL-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC1(C)C[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000170629429	407460695	/nfs/dbraw/zinc/46/06/95/407460695.db2.gz	XVFGCRWSCUNURL-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000171750435	407756953	/nfs/dbraw/zinc/75/69/53/407756953.db2.gz	SRJIUVTUWHZDJJ-GFCCVEGCSA-N	1	1	306.366	1.736	20	5		DDBDMO
CC(C)COC[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000153140523	407763504	/nfs/dbraw/zinc/76/35/04/407763504.db2.gz	UARRHIGTNAZYDN-CQSZACIVSA-N	1	1	308.378	1.986	20	5		DDBDMO
CC(C)COC[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000153140523	407763510	/nfs/dbraw/zinc/76/35/10/407763510.db2.gz	UARRHIGTNAZYDN-CQSZACIVSA-N	1	1	308.378	1.986	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+](CCC)CC2)c1[N+](=O)[O-]	ZINC000171805471	407771495	/nfs/dbraw/zinc/77/14/95/407771495.db2.gz	JZWIAFGTOURUAS-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+](CCC)CC2)c1[N+](=O)[O-]	ZINC000171805471	407771500	/nfs/dbraw/zinc/77/15/00/407771500.db2.gz	JZWIAFGTOURUAS-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCC[C@H]1C[NH2+]CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000262250389	407775168	/nfs/dbraw/zinc/77/51/68/407775168.db2.gz	IQLDWVVWZUDBJI-LBPRGKRZSA-N	1	1	313.379	1.357	20	5		DDBDMO
C[N@@H+]1CC[C@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000272493317	407946586	/nfs/dbraw/zinc/94/65/86/407946586.db2.gz	CPQSZZCAQHMBKT-HZMBPMFUSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000272493317	407946590	/nfs/dbraw/zinc/94/65/90/407946590.db2.gz	CPQSZZCAQHMBKT-HZMBPMFUSA-N	1	1	305.334	1.467	20	5		DDBDMO
CC[N@H+]1CCCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000118826623	407949566	/nfs/dbraw/zinc/94/95/66/407949566.db2.gz	SJKMUHDUJNXTHX-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[N@@H+](C)C1	ZINC000118841685	407955448	/nfs/dbraw/zinc/95/54/48/407955448.db2.gz	QYRZSNAMWDHHRW-ZDUSSCGKSA-N	1	1	320.393	1.807	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000119414029	408062638	/nfs/dbraw/zinc/06/26/38/408062638.db2.gz	NZJZCCLVOOQJKR-GFCCVEGCSA-N	1	1	320.393	1.885	20	5		DDBDMO
C[C@@H]1C[C@@H](C)C[NH+](CCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136222866	408090119	/nfs/dbraw/zinc/09/01/19/408090119.db2.gz	RPCMQAWIZYEADS-GHMZBOCLSA-N	1	1	309.370	1.416	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)C[C@@H](C)O	ZINC000245725484	408054888	/nfs/dbraw/zinc/05/48/88/408054888.db2.gz	BNGSIJQWKLOQOQ-NXEZZACHSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)C[C@@H](C)O	ZINC000245725484	408054895	/nfs/dbraw/zinc/05/48/95/408054895.db2.gz	BNGSIJQWKLOQOQ-NXEZZACHSA-N	1	1	311.338	1.243	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C1CC1	ZINC000263731979	408230174	/nfs/dbraw/zinc/23/01/74/408230174.db2.gz	CPPFYGBOYOYRAS-UHFFFAOYSA-N	1	1	323.397	1.399	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[NH+](C2CC2)CC1	ZINC000150989857	408236628	/nfs/dbraw/zinc/23/66/28/408236628.db2.gz	LTFCKRHQBVWTDC-UHFFFAOYSA-N	1	1	307.325	1.583	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269394925	408293857	/nfs/dbraw/zinc/29/38/57/408293857.db2.gz	MRUDOKGZYJESRZ-LLVKDONJSA-N	1	1	323.397	1.855	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000269394925	408293861	/nfs/dbraw/zinc/29/38/61/408293861.db2.gz	MRUDOKGZYJESRZ-LLVKDONJSA-N	1	1	323.397	1.855	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269394925	408293866	/nfs/dbraw/zinc/29/38/66/408293866.db2.gz	MRUDOKGZYJESRZ-LLVKDONJSA-N	1	1	323.397	1.855	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nnnc2Sc2ccccc2[N+](=O)[O-])C1	ZINC000131974671	162026801	/nfs/dbraw/zinc/02/68/01/162026801.db2.gz	UTDVNQBNUFUOOJ-SNVBAGLBSA-N	1	1	320.378	1.684	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000246892724	408361602	/nfs/dbraw/zinc/36/16/02/408361602.db2.gz	FHUVDBOOGVKANM-WFASDCNBSA-N	1	1	319.361	1.668	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CC[N@H+](C)C[C@H]1C	ZINC000247229784	408433410	/nfs/dbraw/zinc/43/34/10/408433410.db2.gz	CYWCVXRBMAGIBZ-DGCLKSJQSA-N	1	1	323.397	1.288	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000191540141	408441957	/nfs/dbraw/zinc/44/19/57/408441957.db2.gz	GFPXQLBUJHWENA-GFCCVEGCSA-N	1	1	306.366	1.781	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[NH+](CC(C)C)CC2)n1	ZINC000191759489	408485921	/nfs/dbraw/zinc/48/59/21/408485921.db2.gz	FTMCOWWDFJCLBF-UHFFFAOYSA-N	1	1	309.370	1.225	20	5		DDBDMO
C[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@@H]1c1ccccc1	ZINC000270338985	408493548	/nfs/dbraw/zinc/49/35/48/408493548.db2.gz	ZBGUPNRJIBOLBA-YPMHNXCESA-N	1	1	314.349	1.824	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1	ZINC000264456514	408497131	/nfs/dbraw/zinc/49/71/31/408497131.db2.gz	DMGOSDSNEXQLDJ-ZDUSSCGKSA-N	1	1	307.350	1.354	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@H]21	ZINC000248042302	408527626	/nfs/dbraw/zinc/52/76/26/408527626.db2.gz	TZQOQAHNUPGAFP-IAQYHMDHSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]2CCCC[C@@H]12	ZINC000248404805	408560653	/nfs/dbraw/zinc/56/06/53/408560653.db2.gz	AIGNUCMCBSSGLY-UNQGMJICSA-N	1	1	308.382	1.663	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2nccc(C)c2[N+](=O)[O-])CC1	ZINC000265188574	408573957	/nfs/dbraw/zinc/57/39/57/408573957.db2.gz	KFGYOVYWWKQZHJ-CYBMUJFWSA-N	1	1	321.425	1.984	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1	ZINC000192742896	408640299	/nfs/dbraw/zinc/64/02/99/408640299.db2.gz	MIUWXOPADNWVIN-AATRIKPKSA-N	1	1	319.361	1.399	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000248882296	408654344	/nfs/dbraw/zinc/65/43/44/408654344.db2.gz	SOANGTIDZKNTBO-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1O	ZINC000270900177	408731077	/nfs/dbraw/zinc/73/10/77/408731077.db2.gz	MKEAOHQIRUNWSD-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000163658216	408785531	/nfs/dbraw/zinc/78/55/31/408785531.db2.gz	HEQZTKKFBGNFQS-WDEREUQCSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000251950771	408790347	/nfs/dbraw/zinc/79/03/47/408790347.db2.gz	VCEOYVBCGKHQMJ-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000188772040	163067193	/nfs/dbraw/zinc/06/71/93/163067193.db2.gz	AYZKREJCHTWYGN-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000188772040	163067196	/nfs/dbraw/zinc/06/71/96/163067196.db2.gz	AYZKREJCHTWYGN-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)[C@@H](C)C1	ZINC000188792567	163070449	/nfs/dbraw/zinc/07/04/49/163070449.db2.gz	PPKAVXKEHMHQJX-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000188792567	163070450	/nfs/dbraw/zinc/07/04/50/163070450.db2.gz	PPKAVXKEHMHQJX-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000189572424	163106110	/nfs/dbraw/zinc/10/61/10/163106110.db2.gz	FNXHOTOTDUYEIS-QWHCGFSZSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2cc(Br)cc([N+](=O)[O-])c2=O)C1	ZINC000191193504	163176318	/nfs/dbraw/zinc/17/63/18/163176318.db2.gz	PKSCBKDNUOYIBF-QMMMGPOBSA-N	1	1	316.155	1.471	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000191485222	163188425	/nfs/dbraw/zinc/18/84/25/163188425.db2.gz	QFTDBOVDQYMVIR-UHFFFAOYSA-N	1	1	301.302	1.962	20	5		DDBDMO
CNC(=O)[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000291798441	408925175	/nfs/dbraw/zinc/92/51/75/408925175.db2.gz	WXSFWBUKRYNMDH-ZETCQYMHSA-N	1	1	303.265	1.420	20	5		DDBDMO
Cc1cc(OCC(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000281760357	408926051	/nfs/dbraw/zinc/92/60/51/408926051.db2.gz	SMXPQEIQVYPGGT-BETUJISGSA-N	1	1	321.377	1.833	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000279313539	409189635	/nfs/dbraw/zinc/18/96/35/409189635.db2.gz	NKOZJWBPKPHLMS-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCCCn2cc[nH+]c2C)n1	ZINC000283420857	409152952	/nfs/dbraw/zinc/15/29/52/409152952.db2.gz	ASBBVYUVZQHGSN-UHFFFAOYSA-N	1	1	319.321	1.784	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N(C)CCC[N@H+](C)CCN(C)C)n1	ZINC000289179057	409229422	/nfs/dbraw/zinc/22/94/22/409229422.db2.gz	VTOFNWIBLJIXQF-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N(C)CCCN(C)CC[NH+](C)C)n1	ZINC000289179057	409229425	/nfs/dbraw/zinc/22/94/25/409229425.db2.gz	VTOFNWIBLJIXQF-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CCC[N@@H+](C)C1	ZINC000279391720	409205209	/nfs/dbraw/zinc/20/52/09/409205209.db2.gz	IUUSHJBBLNTUTD-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337181	409294953	/nfs/dbraw/zinc/29/49/53/409294953.db2.gz	HNWBZZUDHJAJQV-VBNZEHGJSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337181	409294955	/nfs/dbraw/zinc/29/49/55/409294955.db2.gz	HNWBZZUDHJAJQV-VBNZEHGJSA-N	1	1	322.361	1.508	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@@H](c3n[nH]c(=O)o3)C2)cccc1[N+](=O)[O-]	ZINC000284241253	409302817	/nfs/dbraw/zinc/30/28/17/409302817.db2.gz	KWWRTCCLNNLOMS-GFCCVEGCSA-N	1	1	318.333	1.959	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@@H](c3n[nH]c(=O)o3)C2)cccc1[N+](=O)[O-]	ZINC000284241253	409302820	/nfs/dbraw/zinc/30/28/20/409302820.db2.gz	KWWRTCCLNNLOMS-GFCCVEGCSA-N	1	1	318.333	1.959	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC	ZINC000280403917	409308130	/nfs/dbraw/zinc/30/81/30/409308130.db2.gz	HHLRFXONAIUMRH-CQSZACIVSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC	ZINC000280403917	409308133	/nfs/dbraw/zinc/30/81/33/409308133.db2.gz	HHLRFXONAIUMRH-CQSZACIVSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106476	409323128	/nfs/dbraw/zinc/32/31/28/409323128.db2.gz	VODZDWMWYRMMNU-QMTHXVAHSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106476	409323129	/nfs/dbraw/zinc/32/31/29/409323129.db2.gz	VODZDWMWYRMMNU-QMTHXVAHSA-N	1	1	308.334	1.807	20	5		DDBDMO
CN(CCn1cc([N+](=O)[O-])ccc1=O)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000285523354	409476857	/nfs/dbraw/zinc/47/68/57/409476857.db2.gz	ONTRDWAMKBRDPV-NNQSOWQGSA-N	1	1	320.393	1.314	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000296447471	409562455	/nfs/dbraw/zinc/56/24/55/409562455.db2.gz	WWRDHFHUEVHINU-UXIGCNINSA-N	1	1	310.350	1.180	20	5		DDBDMO
Cn1cc([C@H]2CCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)cn1	ZINC000331550290	409626276	/nfs/dbraw/zinc/62/62/76/409626276.db2.gz	GTCNBFVPAKGSDX-CQSZACIVSA-N	1	1	304.354	1.752	20	5		DDBDMO
Cn1cc([C@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cn1	ZINC000331550290	409626286	/nfs/dbraw/zinc/62/62/86/409626286.db2.gz	GTCNBFVPAKGSDX-CQSZACIVSA-N	1	1	304.354	1.752	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1nnnn1CC1CC1	ZINC000349645887	409900899	/nfs/dbraw/zinc/90/08/99/409900899.db2.gz	NOPXTEJVLFFGGN-HWKANZROSA-N	1	1	314.349	1.794	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000354580876	409950504	/nfs/dbraw/zinc/95/05/04/409950504.db2.gz	DCVPVFAROQESSF-VXGBXAGGSA-N	1	1	319.361	1.960	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000351826456	410267504	/nfs/dbraw/zinc/26/75/04/410267504.db2.gz	KBFVHADWRBKBPM-HZMBPMFUSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347015228	410315799	/nfs/dbraw/zinc/31/57/99/410315799.db2.gz	VYWVSPFFUUZRQY-GFCCVEGCSA-N	1	1	304.350	1.607	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](CO)C1	ZINC000298626049	410318967	/nfs/dbraw/zinc/31/89/67/410318967.db2.gz	DGODCZSNIXGGQS-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](CO)C1	ZINC000298626049	410318974	/nfs/dbraw/zinc/31/89/74/410318974.db2.gz	DGODCZSNIXGGQS-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC(=O)c1cc(C(C)(C)[NH2+]CCn2ccc([N+](=O)[O-])n2)no1	ZINC000351995853	410396163	/nfs/dbraw/zinc/39/61/63/410396163.db2.gz	NVVDFVSHMKMFPJ-UHFFFAOYSA-N	1	1	323.309	1.091	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN2C(=O)NC[C@H]2C1	ZINC000347354521	410494119	/nfs/dbraw/zinc/49/41/19/410494119.db2.gz	BRXKZFUUVMRSGX-BLMSOEDDSA-N	1	1	316.361	1.708	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCN2C(=O)NC[C@H]2C1	ZINC000347354521	410494124	/nfs/dbraw/zinc/49/41/24/410494124.db2.gz	BRXKZFUUVMRSGX-BLMSOEDDSA-N	1	1	316.361	1.708	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000347470434	410569466	/nfs/dbraw/zinc/56/94/66/410569466.db2.gz	HTCIXNZKJSVVAA-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H]1CCOC1	ZINC000299246229	410580493	/nfs/dbraw/zinc/58/04/93/410580493.db2.gz	KLLWCTKJRBVDIQ-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
CS[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@@H]1[NH+](C)C	ZINC000330460757	410707916	/nfs/dbraw/zinc/70/79/16/410707916.db2.gz	VZQMDXVCVOLYNS-KBPBESRZSA-N	1	1	311.407	1.778	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCC[N@H+]1C	ZINC000355924337	410734617	/nfs/dbraw/zinc/73/46/17/410734617.db2.gz	ZBDOFTHHXBSYOZ-BXKDBHETSA-N	1	1	317.349	1.684	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC)C1	ZINC000301539797	410742556	/nfs/dbraw/zinc/74/25/56/410742556.db2.gz	NOGWPNLHSPYBIG-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(N3CC[N@@H+]4CCOC[C@@H]4C3)c21	ZINC000347866475	410764363	/nfs/dbraw/zinc/76/43/63/410764363.db2.gz	OXZPFSQGDLESCB-NSHDSACASA-N	1	1	315.333	1.059	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(N3CC[N@H+]4CCOC[C@@H]4C3)c21	ZINC000347866475	410764370	/nfs/dbraw/zinc/76/43/70/410764370.db2.gz	OXZPFSQGDLESCB-NSHDSACASA-N	1	1	315.333	1.059	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000330618870	410833074	/nfs/dbraw/zinc/83/30/74/410833074.db2.gz	YUJMBMKAWQWJLW-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC000330618870	410833078	/nfs/dbraw/zinc/83/30/78/410833078.db2.gz	YUJMBMKAWQWJLW-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000330675666	410869821	/nfs/dbraw/zinc/86/98/21/410869821.db2.gz	SOFMGYCPAIBAKL-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c1	ZINC000343995405	410877443	/nfs/dbraw/zinc/87/74/43/410877443.db2.gz	QISFDSGASFYJDQ-KSZJFAHPSA-N	1	1	322.361	1.037	20	5		DDBDMO
CNS(=O)(=O)C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000330603271	410817461	/nfs/dbraw/zinc/81/74/61/410817461.db2.gz	FVUUOFNFXQQKCX-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNS(=O)(=O)C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000330603271	410817468	/nfs/dbraw/zinc/81/74/68/410817468.db2.gz	FVUUOFNFXQQKCX-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331078762	410935572	/nfs/dbraw/zinc/93/55/72/410935572.db2.gz	XSHOKWZAIFLAMY-NSHDSACASA-N	1	1	309.370	1.067	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331078762	410935578	/nfs/dbraw/zinc/93/55/78/410935578.db2.gz	XSHOKWZAIFLAMY-NSHDSACASA-N	1	1	309.370	1.067	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000341242898	410961147	/nfs/dbraw/zinc/96/11/47/410961147.db2.gz	XMZCJYDKTSSBKO-ZDUSSCGKSA-N	1	1	320.393	1.873	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000344240689	411049067	/nfs/dbraw/zinc/04/90/67/411049067.db2.gz	QZQIAFGPNFSLST-LBPRGKRZSA-N	1	1	311.313	1.184	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@@H](C[NH+]2CCCCCC2)C1	ZINC000360221015	411105855	/nfs/dbraw/zinc/10/58/55/411105855.db2.gz	CKHJPGCUOBCYFM-RRFJBIMHSA-N	1	1	309.410	1.766	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)C1	ZINC000488756843	416562025	/nfs/dbraw/zinc/56/20/25/416562025.db2.gz	WXUHWAPJSSCJHP-HBNTYKKESA-N	1	1	306.370	1.134	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000296776089	226220229	/nfs/dbraw/zinc/22/02/29/226220229.db2.gz	PYVCSRWNPPBLFU-AWEZNQCLSA-N	1	1	323.349	1.746	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cn3)CC[C@@H]21	ZINC000366295036	418453107	/nfs/dbraw/zinc/45/31/07/418453107.db2.gz	PTQVWUVAGRYZJA-FZMZJTMJSA-N	1	1	304.350	1.546	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]12	ZINC000366571586	418492183	/nfs/dbraw/zinc/49/21/83/418492183.db2.gz	XVCOUZARXKHXIS-CDBNLRSOSA-N	1	1	315.329	1.203	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2OCC(=O)N[C@@H]2C1	ZINC000366810979	418520824	/nfs/dbraw/zinc/52/08/24/418520824.db2.gz	QQKQLROFQGJROF-HONMWMINSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2OCC(=O)N[C@@H]2C1	ZINC000366810979	418520826	/nfs/dbraw/zinc/52/08/26/418520826.db2.gz	QQKQLROFQGJROF-HONMWMINSA-N	1	1	305.334	1.245	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)n1	ZINC000191633056	222106537	/nfs/dbraw/zinc/10/65/37/222106537.db2.gz	YSHDXJJSJXCBME-RYUDHWBXSA-N	1	1	323.397	1.614	20	5		DDBDMO
O=C(CC[NH+]1CC(O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000375469368	418643935	/nfs/dbraw/zinc/64/39/35/418643935.db2.gz	NKKLAFBUHVSIQJ-UHFFFAOYSA-N	1	1	305.334	1.380	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000375581096	418658332	/nfs/dbraw/zinc/65/83/32/418658332.db2.gz	ADLLGSZFZXRGDT-UHFFFAOYSA-N	1	1	300.384	1.600	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)COc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000386741907	418740947	/nfs/dbraw/zinc/74/09/47/418740947.db2.gz	XUPHWKGYNWYNRS-LLVKDONJSA-N	1	1	318.757	1.566	20	5		DDBDMO
Cc1ccc(C(=O)N2CCC[N@H+]([C@@H](C)CO)CC2)cc1[N+](=O)[O-]	ZINC000364933219	418825406	/nfs/dbraw/zinc/82/54/06/418825406.db2.gz	LPDWGZWUWJIPAA-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[N@H+]3CCC[C@@H]3CO1)CCN2	ZINC000365542875	418872929	/nfs/dbraw/zinc/87/29/29/418872929.db2.gz	CBCZIJHOAXOHMA-VXGBXAGGSA-N	1	1	318.377	1.838	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000420929419	419361975	/nfs/dbraw/zinc/36/19/75/419361975.db2.gz	BJNRJJAFFNBGPT-RDBSUJKOSA-N	1	1	324.377	1.285	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420940665	419371164	/nfs/dbraw/zinc/37/11/64/419371164.db2.gz	NAVSSGOONGCSGG-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420940665	419371170	/nfs/dbraw/zinc/37/11/70/419371170.db2.gz	NAVSSGOONGCSGG-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
COC(=O)[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411915077	419484935	/nfs/dbraw/zinc/48/49/35/419484935.db2.gz	YKZSOAJELPFRAR-NSHDSACASA-N	1	1	313.379	1.193	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H]3CCO)o2)cc1	ZINC000426256677	419421504	/nfs/dbraw/zinc/42/15/04/419421504.db2.gz	SWYYZTBPPXFLKX-LBPRGKRZSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC(=O)N[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000420990899	419428146	/nfs/dbraw/zinc/42/81/46/419428146.db2.gz	VHKSAUJAGDGPQO-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[N@H+]1C	ZINC000421000184	419435598	/nfs/dbraw/zinc/43/55/98/419435598.db2.gz	KANZSJACSKSMHN-LSDHHAIUSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000184	419435605	/nfs/dbraw/zinc/43/56/05/419435605.db2.gz	KANZSJACSKSMHN-LSDHHAIUSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000184	419435616	/nfs/dbraw/zinc/43/56/16/419435616.db2.gz	KANZSJACSKSMHN-LSDHHAIUSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@]12CCOC2	ZINC000421010949	419445857	/nfs/dbraw/zinc/44/58/57/419445857.db2.gz	DBFUSZYEFKYTHY-SWLSCSKDSA-N	1	1	308.334	1.199	20	5		DDBDMO
Cc1nn(CCC(=O)N(C)C[C@@H]2CCC[N@H+]2C)c(C)c1[N+](=O)[O-]	ZINC000421705521	419689643	/nfs/dbraw/zinc/68/96/43/419689643.db2.gz	RMSZUXAVNIRYFN-ZDUSSCGKSA-N	1	1	323.397	1.351	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CCCC[C@H]1C	ZINC000299504316	229162686	/nfs/dbraw/zinc/16/26/86/229162686.db2.gz	LMZDZFUBGKDLBD-GFCCVEGCSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000299529274	229184561	/nfs/dbraw/zinc/18/45/61/229184561.db2.gz	LJMHPMTVSDYRGR-NXEZZACHSA-N	1	1	309.370	1.477	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000416296636	420312488	/nfs/dbraw/zinc/31/24/88/420312488.db2.gz	OHTONMABVRRVDZ-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@H+](CCO)C[C@H]1C	ZINC000416296636	420312491	/nfs/dbraw/zinc/31/24/91/420312491.db2.gz	OHTONMABVRRVDZ-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@@H+]2CC(C)C)c1[N+](=O)[O-]	ZINC000439696151	420531605	/nfs/dbraw/zinc/53/16/05/420531605.db2.gz	MVLMLJCUSXGIHU-LBPRGKRZSA-N	1	1	323.397	1.867	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457080880	420605024	/nfs/dbraw/zinc/60/50/24/420605024.db2.gz	CMKPQCUFLJPDFI-NSHDSACASA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457080880	420605026	/nfs/dbraw/zinc/60/50/26/420605026.db2.gz	CMKPQCUFLJPDFI-NSHDSACASA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457080880	420605030	/nfs/dbraw/zinc/60/50/30/420605030.db2.gz	CMKPQCUFLJPDFI-NSHDSACASA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])c2cnccc21	ZINC000450955072	420568655	/nfs/dbraw/zinc/56/86/55/420568655.db2.gz	PEQFRNKCTYIOQY-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCC2)[C@@H]2COC[C@H]21	ZINC000459657321	420841674	/nfs/dbraw/zinc/84/16/74/420841674.db2.gz	FQDQOCPPLVNBHD-ZIAGYGMSSA-N	1	1	319.361	1.257	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000456322948	421142293	/nfs/dbraw/zinc/14/22/93/421142293.db2.gz	UAHQMTUPQBVIBH-YOGCLGLASA-N	1	1	319.361	1.958	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000560975077	421300607	/nfs/dbraw/zinc/30/06/07/421300607.db2.gz	HLYCAGVNMRDIJF-GRYCIOLGSA-N	1	1	321.381	1.795	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000560454440	421266252	/nfs/dbraw/zinc/26/62/52/421266252.db2.gz	JCULRKUYILCXSZ-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000560454440	421266253	/nfs/dbraw/zinc/26/62/53/421266253.db2.gz	JCULRKUYILCXSZ-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000560454440	421266256	/nfs/dbraw/zinc/26/62/56/421266256.db2.gz	JCULRKUYILCXSZ-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
C[N@@H+](C[C@H](O)CN1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000515017674	421472725	/nfs/dbraw/zinc/47/27/25/421472725.db2.gz	CUIHFXCNWDGCTE-AWEZNQCLSA-N	1	1	305.378	1.408	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)C[N@H+]1CC[C@@H](C)C1	ZINC000563822697	421546140	/nfs/dbraw/zinc/54/61/40/421546140.db2.gz	LWTBUOGIEBVBCA-LLVKDONJSA-N	1	1	307.350	1.561	20	5		DDBDMO
Cn1cc([C@@H](CO)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1	ZINC000518397987	421652406	/nfs/dbraw/zinc/65/24/06/421652406.db2.gz	SLWUCSNKDYYQIM-ZIAGYGMSSA-N	1	1	302.334	1.639	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000558589558	421814892	/nfs/dbraw/zinc/81/48/92/421814892.db2.gz	LCVBNUQQZWMLHE-JTQLQIEISA-N	1	1	307.354	1.231	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000594360255	422346007	/nfs/dbraw/zinc/34/60/07/422346007.db2.gz	LWADTVMDQFOPTC-JTQLQIEISA-N	1	1	309.370	1.422	20	5		DDBDMO
Nc1ccc(N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)nc1[N+](=O)[O-]	ZINC000596163552	422369489	/nfs/dbraw/zinc/36/94/89/422369489.db2.gz	WSDBATKSDYJRSP-QWHCGFSZSA-N	1	1	321.381	1.627	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000600271913	422409722	/nfs/dbraw/zinc/40/97/22/422409722.db2.gz	JZBAJWASLKPXID-SECBINFHSA-N	1	1	307.306	1.148	20	5		DDBDMO
CNC(=O)[C@@H](CCSC)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000342320393	271375757	/nfs/dbraw/zinc/37/57/57/271375757.db2.gz	VJIGHCJYKHIXEW-SECBINFHSA-N	1	1	303.409	1.614	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000153858854	273747710	/nfs/dbraw/zinc/74/77/10/273747710.db2.gz	GMKYJQBZKXGILH-LLVKDONJSA-N	1	1	314.773	1.536	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2nccc(C)c2[N+](=O)[O-])CC1	ZINC000413480990	274017147	/nfs/dbraw/zinc/01/71/47/274017147.db2.gz	WAJAJSNZSVVVKH-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000285554526	274055129	/nfs/dbraw/zinc/05/51/29/274055129.db2.gz	GRTBLGXOKCSKQB-NSHDSACASA-N	1	1	307.350	1.451	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000285554526	274055132	/nfs/dbraw/zinc/05/51/32/274055132.db2.gz	GRTBLGXOKCSKQB-NSHDSACASA-N	1	1	307.350	1.451	20	5		DDBDMO
COc1ccc2c(c1)ncc([N+](=O)[O-])c2N1CC[NH+](C)CC1	ZINC000295255453	274140447	/nfs/dbraw/zinc/14/04/47/274140447.db2.gz	HCWNPCZYSGYYFA-UHFFFAOYSA-N	1	1	302.334	1.903	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000266693386	277080056	/nfs/dbraw/zinc/08/00/56/277080056.db2.gz	FIZNFKSRMGEBJX-ZDUSSCGKSA-N	1	1	306.366	1.531	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H]1CCc2nc[nH]c2C1	ZINC000357972101	299037514	/nfs/dbraw/zinc/03/75/14/299037514.db2.gz	HZQPWHBNDBSDOH-JTQLQIEISA-N	1	1	318.308	1.673	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000362072667	300000316	/nfs/dbraw/zinc/00/03/16/300000316.db2.gz	PLYQHHQFKHGCMC-NEPJUHHUSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000362072667	300000319	/nfs/dbraw/zinc/00/03/19/300000319.db2.gz	PLYQHHQFKHGCMC-NEPJUHHUSA-N	1	1	307.350	1.402	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C[C@@H]21	ZINC000362279587	300042865	/nfs/dbraw/zinc/04/28/65/300042865.db2.gz	HQQQUWXEYODFOY-RNCFNFMXSA-N	1	1	322.340	1.482	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1c([N+](=O)[O-])ncn1C	ZINC000362659117	300111554	/nfs/dbraw/zinc/11/15/54/300111554.db2.gz	UVQJIEWVWTXZFE-LLVKDONJSA-N	1	1	309.370	1.018	20	5		DDBDMO
O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000363305885	300248771	/nfs/dbraw/zinc/24/87/71/300248771.db2.gz	UNPPXEBNRRDBIT-HOTGVXAUSA-N	1	1	317.389	1.475	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019288	301120111	/nfs/dbraw/zinc/12/01/11/301120111.db2.gz	XLGWVRMUWQDWJT-UONOGXRCSA-N	1	1	323.397	1.149	20	5		DDBDMO
COc1cc(N2CC[N@@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000375845417	302003094	/nfs/dbraw/zinc/00/30/94/302003094.db2.gz	GQMCKSGICPSARG-JTQLQIEISA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1cc(N2CC[N@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000375845417	302003096	/nfs/dbraw/zinc/00/30/96/302003096.db2.gz	GQMCKSGICPSARG-JTQLQIEISA-N	1	1	311.313	1.263	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000378310172	302310384	/nfs/dbraw/zinc/31/03/84/302310384.db2.gz	UHKFMKLURDJEOO-RYUDHWBXSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@@H+]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000378310172	302310388	/nfs/dbraw/zinc/31/03/88/302310388.db2.gz	UHKFMKLURDJEOO-RYUDHWBXSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000378310172	302310389	/nfs/dbraw/zinc/31/03/89/302310389.db2.gz	UHKFMKLURDJEOO-RYUDHWBXSA-N	1	1	315.333	1.146	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C1CCOCC1	ZINC000532988761	303303658	/nfs/dbraw/zinc/30/36/58/303303658.db2.gz	ZPMCRSCGYXDCBZ-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC1(C)C[NH+](CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000553555810	303679039	/nfs/dbraw/zinc/67/90/39/303679039.db2.gz	CIFVVHIZDYPUMM-UHFFFAOYSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1CO	ZINC000362089714	307013869	/nfs/dbraw/zinc/01/38/69/307013869.db2.gz	VLDCSMQGTXSQKD-ZYHUDNBSSA-N	1	1	318.333	1.705	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000365182778	307060702	/nfs/dbraw/zinc/06/07/02/307060702.db2.gz	IQJICXBJMOYVQU-RYUDHWBXSA-N	1	1	318.377	1.842	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@H]4[C@H](CO)[C@H]4C3)n2)cc1	ZINC000366443807	307073945	/nfs/dbraw/zinc/07/39/45/307073945.db2.gz	UGVJRKALXNBACU-ITGUQSILSA-N	1	1	316.317	1.315	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3C[C@H]4[C@H](CO)[C@H]4C3)n2)cc1	ZINC000366443807	307073946	/nfs/dbraw/zinc/07/39/46/307073946.db2.gz	UGVJRKALXNBACU-ITGUQSILSA-N	1	1	316.317	1.315	20	5		DDBDMO
Cn1nccc1CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000367251989	307089882	/nfs/dbraw/zinc/08/98/82/307089882.db2.gz	KGQMPTCMFRULJQ-ZDUSSCGKSA-N	1	1	304.354	1.404	20	5		DDBDMO
CNC(=O)C[N@@H+]1CCCN(Cc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000367423454	307092939	/nfs/dbraw/zinc/09/29/39/307092939.db2.gz	SPWAPIZGZFLTRL-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CNC(=O)C[N@H+]1CCCN(Cc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000367423454	307092940	/nfs/dbraw/zinc/09/29/40/307092940.db2.gz	SPWAPIZGZFLTRL-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CNC(=O)CN1CCC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000367423454	307092941	/nfs/dbraw/zinc/09/29/41/307092941.db2.gz	SPWAPIZGZFLTRL-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CNC(=O)CN1CCC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000367423454	307092942	/nfs/dbraw/zinc/09/29/42/307092942.db2.gz	SPWAPIZGZFLTRL-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[NH+]([C@H]3CCOC3)CC2)nc2sccn21	ZINC000372932187	307177054	/nfs/dbraw/zinc/17/70/54/307177054.db2.gz	WLVBIMJZOOGMDV-JTQLQIEISA-N	1	1	323.378	1.215	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@](O)(C3CC3)C2)c1	ZINC000373907797	307198019	/nfs/dbraw/zinc/19/80/19/307198019.db2.gz	GQMQEIDHNYGMMN-GDBMZVCRSA-N	1	1	322.361	1.181	20	5		DDBDMO
C[C@H]1COCC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327763	307205901	/nfs/dbraw/zinc/20/59/01/307205901.db2.gz	IORIEYDAQSQEDX-IUODEOHRSA-N	1	1	319.361	1.668	20	5		DDBDMO
C[C@H]1COCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327763	307205902	/nfs/dbraw/zinc/20/59/02/307205902.db2.gz	IORIEYDAQSQEDX-IUODEOHRSA-N	1	1	319.361	1.668	20	5		DDBDMO
O=C1NCCN1[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000374868283	307214865	/nfs/dbraw/zinc/21/48/65/307214865.db2.gz	JZIHTOUKQAOYTN-GFCCVEGCSA-N	1	1	322.340	1.724	20	5		DDBDMO
O=C1NCCN1[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000374868283	307214866	/nfs/dbraw/zinc/21/48/66/307214866.db2.gz	JZIHTOUKQAOYTN-GFCCVEGCSA-N	1	1	322.340	1.724	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H](O)C[C@@H]3CO)o2)cc1	ZINC000376897807	307258333	/nfs/dbraw/zinc/25/83/33/307258333.db2.gz	STXIZYIYLVVILL-KGLIPLIRSA-N	1	1	318.329	1.782	20	5		DDBDMO
C[C@@H](CCN(C)C)[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460676	308316032	/nfs/dbraw/zinc/31/60/32/308316032.db2.gz	XDXVCNRKCMJCMO-GXTWGEPZSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@@H](CC[NH+](C)C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460676	308316034	/nfs/dbraw/zinc/31/60/34/308316034.db2.gz	XDXVCNRKCMJCMO-GXTWGEPZSA-N	1	1	311.382	1.264	20	5		DDBDMO
CCn1ccc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000577842381	308417630	/nfs/dbraw/zinc/41/76/30/308417630.db2.gz	UAGWMWADFSOKLH-CQSZACIVSA-N	1	1	320.349	1.341	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000582367943	326020846	/nfs/dbraw/zinc/02/08/46/326020846.db2.gz	NJISUZKRKDJBQY-OAHLLOKOSA-N	1	1	307.394	1.872	20	5		DDBDMO
CC[NH+]1CCC(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000582379075	326023104	/nfs/dbraw/zinc/02/31/04/326023104.db2.gz	CMARLPFMIZMKFM-UHFFFAOYSA-N	1	1	307.350	1.762	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H](CO)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000488809132	484220465	/nfs/dbraw/zinc/22/04/65/484220465.db2.gz	SXAZSOFZCYXMOS-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000360954387	500785896	/nfs/dbraw/zinc/78/58/96/500785896.db2.gz	MMZGEIXVVCUSKK-WDEREUQCSA-N	1	1	318.377	1.992	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@]3(CNC(=O)C3)C2)ccc1[N+](=O)[O-]	ZINC000434749435	533825693	/nfs/dbraw/zinc/82/56/93/533825693.db2.gz	RYOVJDIJSPTPEN-HNNXBMFYSA-N	1	1	305.334	1.315	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](C2CCCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000154597613	526891838	/nfs/dbraw/zinc/89/18/38/526891838.db2.gz	IDWQGOLMSMBWTE-LLVKDONJSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000154597613	526891840	/nfs/dbraw/zinc/89/18/40/526891840.db2.gz	IDWQGOLMSMBWTE-LLVKDONJSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000154597613	526891845	/nfs/dbraw/zinc/89/18/45/526891845.db2.gz	IDWQGOLMSMBWTE-LLVKDONJSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCS(=O)(=O)C2)c1	ZINC000035368066	696128587	/nfs/dbraw/zinc/12/85/87/696128587.db2.gz	PRGQZXFWVASXNX-VIFPVBQESA-N	1	1	304.755	1.525	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1	ZINC000045490803	696174760	/nfs/dbraw/zinc/17/47/60/696174760.db2.gz	WDHUWEOLYASZDZ-UHFFFAOYSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC(=O)OC1CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000156885331	696969760	/nfs/dbraw/zinc/96/97/60/696969760.db2.gz	QXGJHRMBCILERU-UHFFFAOYSA-N	1	1	318.333	1.930	20	5		DDBDMO
COc1ccccc1OCC[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000157742441	696981055	/nfs/dbraw/zinc/98/10/55/696981055.db2.gz	QBIVRAIMCXIKFF-UHFFFAOYSA-N	1	1	320.349	1.811	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000157907008	696982569	/nfs/dbraw/zinc/98/25/69/696982569.db2.gz	QSWSDVLYGBYIRR-OCCSQVGLSA-N	1	1	305.382	1.698	20	5		DDBDMO
[NH3+]CCC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000262029357	698451112	/nfs/dbraw/zinc/45/11/12/698451112.db2.gz	NWCIBXVFWBSOLY-OAHLLOKOSA-N	1	1	320.393	1.414	20	5		DDBDMO
[NH3+]CCC(=O)NC[C@H]1CCCCN1Cc1ccc([N+](=O)[O-])cc1	ZINC000262029357	698451113	/nfs/dbraw/zinc/45/11/13/698451113.db2.gz	NWCIBXVFWBSOLY-OAHLLOKOSA-N	1	1	320.393	1.414	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000781561389	698630951	/nfs/dbraw/zinc/63/09/51/698630951.db2.gz	LCEYHXUYNKJLHN-UHFFFAOYSA-N	1	1	322.321	1.210	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@H]4C[C@@]4(CO)C3)o2)cc1	ZINC000782623104	698753388	/nfs/dbraw/zinc/75/33/88/698753388.db2.gz	YMBJTAVHAWPJJX-ABAIWWIYSA-N	1	1	316.317	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@H]4C[C@@]4(CO)C3)o2)cc1	ZINC000782623104	698753391	/nfs/dbraw/zinc/75/33/91/698753391.db2.gz	YMBJTAVHAWPJJX-ABAIWWIYSA-N	1	1	316.317	1.459	20	5		DDBDMO
COc1cc(C(=O)OCCC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000750882865	700253980	/nfs/dbraw/zinc/25/39/80/700253980.db2.gz	BHIJZFBSNFWNHV-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000783628726	698861662	/nfs/dbraw/zinc/86/16/62/698861662.db2.gz	LSDHOPSENFJARQ-LBPRGKRZSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000783628726	698861668	/nfs/dbraw/zinc/86/16/68/698861668.db2.gz	LSDHOPSENFJARQ-LBPRGKRZSA-N	1	1	312.801	1.584	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000789773062	699407809	/nfs/dbraw/zinc/40/78/09/699407809.db2.gz	OFDHXLDMPNYZQZ-OAHLLOKOSA-N	1	1	322.361	1.790	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3COCCO3)CC2)cc1	ZINC000733302525	699587954	/nfs/dbraw/zinc/58/79/54/699587954.db2.gz	YYYMRZVQQZYVFW-OAHLLOKOSA-N	1	1	307.350	1.132	20	5		DDBDMO
O=C1O[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CCC2	ZINC000792282510	699689716	/nfs/dbraw/zinc/68/97/16/699689716.db2.gz	UHEZRKUITUWBGV-CYBMUJFWSA-N	1	1	317.345	1.834	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CCC2	ZINC000792282510	699689717	/nfs/dbraw/zinc/68/97/17/699689717.db2.gz	UHEZRKUITUWBGV-CYBMUJFWSA-N	1	1	317.345	1.834	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@H](O)C2CC2)CC1	ZINC000736221331	699721099	/nfs/dbraw/zinc/72/10/99/699721099.db2.gz	XNBNAOSVTJVGNK-HNNXBMFYSA-N	1	1	319.361	1.124	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000741156995	699818496	/nfs/dbraw/zinc/81/84/96/699818496.db2.gz	OBCQDEBKESILPH-CYBMUJFWSA-N	1	1	316.741	1.604	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000741156995	699818498	/nfs/dbraw/zinc/81/84/98/699818498.db2.gz	OBCQDEBKESILPH-CYBMUJFWSA-N	1	1	316.741	1.604	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000741720105	699849104	/nfs/dbraw/zinc/84/91/04/699849104.db2.gz	DZIJVNBNCURBSR-MWLCHTKSSA-N	1	1	322.321	1.716	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000742197010	699865764	/nfs/dbraw/zinc/86/57/64/699865764.db2.gz	OQHUUQRUAQDOAE-SNVBAGLBSA-N	1	1	321.333	1.158	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000742197010	699865767	/nfs/dbraw/zinc/86/57/67/699865767.db2.gz	OQHUUQRUAQDOAE-SNVBAGLBSA-N	1	1	321.333	1.158	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(Cn2cc([N+](=O)[O-])cn2)C1	ZINC000743375608	699909794	/nfs/dbraw/zinc/90/97/94/699909794.db2.gz	IUQLOXWXVRYZHP-OAHLLOKOSA-N	1	1	315.377	1.955	20	5		DDBDMO
C[C@H]1CN(C(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)CCO1	ZINC000801600086	700326448	/nfs/dbraw/zinc/32/64/48/700326448.db2.gz	LAHKDRZCUYEQMR-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@H]1CN(C(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)CCO1	ZINC000801600086	700326452	/nfs/dbraw/zinc/32/64/52/700326452.db2.gz	LAHKDRZCUYEQMR-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
Cc1nn(C[N@H+]2CCOC[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000753984879	700473721	/nfs/dbraw/zinc/47/37/21/700473721.db2.gz	FTYSJQTXAZZMFO-JTQLQIEISA-N	1	1	305.338	1.574	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCOC[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000753984879	700473722	/nfs/dbraw/zinc/47/37/22/700473722.db2.gz	FTYSJQTXAZZMFO-JTQLQIEISA-N	1	1	305.338	1.574	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000770661351	701288746	/nfs/dbraw/zinc/28/87/46/701288746.db2.gz	IJBLHUZXGNUKLJ-UHFFFAOYSA-N	1	1	312.333	1.867	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000808227730	701509457	/nfs/dbraw/zinc/50/94/57/701509457.db2.gz	CVNTUCVBWQKXFN-SNVBAGLBSA-N	1	1	303.322	1.099	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C[C@H]2C1	ZINC000867873613	701806019	/nfs/dbraw/zinc/80/60/19/701806019.db2.gz	KBADVLVFPHRIQS-TXEJJXNPSA-N	1	1	307.325	1.296	20	5		DDBDMO
C[C@@H]1[C@H](C)OCCN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867970146	701863131	/nfs/dbraw/zinc/86/31/31/701863131.db2.gz	WWQQIXYKRLNUPJ-ZETOZRRWSA-N	1	1	307.350	1.405	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]2[C@@H](O)c2ccccc2)n1	ZINC000879244225	706627210	/nfs/dbraw/zinc/62/72/10/706627210.db2.gz	PHSWNPLSDZTMLH-HOCLYGCPSA-N	1	1	316.361	1.989	20	5		DDBDMO
Cc1ccc(CNC(=O)NCC[N@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000868363940	702086649	/nfs/dbraw/zinc/08/66/49/702086649.db2.gz	ANMBWGOMGJNCHL-UHFFFAOYSA-N	1	1	306.366	1.797	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840458601	702117163	/nfs/dbraw/zinc/11/71/63/702117163.db2.gz	CVGROMQSKOONJR-PMOUVXMZSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000840458601	702117166	/nfs/dbraw/zinc/11/71/66/702117166.db2.gz	CVGROMQSKOONJR-PMOUVXMZSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840458601	702117170	/nfs/dbraw/zinc/11/71/70/702117170.db2.gz	CVGROMQSKOONJR-PMOUVXMZSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000868450301	702135326	/nfs/dbraw/zinc/13/53/26/702135326.db2.gz	CIVGFZKTGKXTLZ-MNOVXSKESA-N	1	1	307.325	1.758	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@H]21	ZINC000866205263	706647873	/nfs/dbraw/zinc/64/78/73/706647873.db2.gz	KSZXBAMMVLAMDL-WDEREUQCSA-N	1	1	302.338	1.168	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])c4nonc43)CC[C@H]21	ZINC000866207005	706648448	/nfs/dbraw/zinc/64/84/48/706648448.db2.gz	NUVVZLLYSJTWOX-VHSXEESVSA-N	1	1	303.322	1.661	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3ccc([N+](=O)[O-])s3)CC2)CC1	ZINC000866214024	706650787	/nfs/dbraw/zinc/65/07/87/706650787.db2.gz	GQGJOXSOVJIAAG-UHFFFAOYSA-N	1	1	310.423	1.873	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C[C@@H]1CCC[N@H+]1C	ZINC000817131724	702281695	/nfs/dbraw/zinc/28/16/95/702281695.db2.gz	MGMGJLOLNOMNHO-LBPRGKRZSA-N	1	1	306.366	1.485	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000840993623	702305630	/nfs/dbraw/zinc/30/56/30/702305630.db2.gz	GZDHDIFORNCUCZ-SNVBAGLBSA-N	1	1	306.278	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F	ZINC000844459230	703034243	/nfs/dbraw/zinc/03/42/43/703034243.db2.gz	QVQLWFUHUVBVCS-MXWKQRLJSA-N	1	1	314.288	1.531	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000846636980	703305963	/nfs/dbraw/zinc/30/59/63/703305963.db2.gz	AFPLGTKOLADWOO-NSHDSACASA-N	1	1	309.341	1.877	20	5		DDBDMO
COCC[N@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848475248	703554552	/nfs/dbraw/zinc/55/45/52/703554552.db2.gz	NSEBBBFSEUROCQ-AWEZNQCLSA-N	1	1	307.350	1.446	20	5		DDBDMO
COCC[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848475248	703554554	/nfs/dbraw/zinc/55/45/54/703554554.db2.gz	NSEBBBFSEUROCQ-AWEZNQCLSA-N	1	1	307.350	1.446	20	5		DDBDMO
C[N@@H+]1CC[C@H](NC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848582503	703565450	/nfs/dbraw/zinc/56/54/50/703565450.db2.gz	MVOWAFRTJONCCP-VIFPVBQESA-N	1	1	315.276	1.387	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848582503	703565452	/nfs/dbraw/zinc/56/54/52/703565452.db2.gz	MVOWAFRTJONCCP-VIFPVBQESA-N	1	1	315.276	1.387	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000848659580	703572901	/nfs/dbraw/zinc/57/29/01/703572901.db2.gz	MPSLQAVJWCFHTJ-NEPJUHHUSA-N	1	1	307.350	1.879	20	5		DDBDMO
O=C1CC[C@@H](C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851844327	703868842	/nfs/dbraw/zinc/86/88/42/703868842.db2.gz	VVWGGNHIXBTEKE-JQWIXIFHSA-N	1	1	306.322	1.182	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852412703	704037808	/nfs/dbraw/zinc/03/78/08/704037808.db2.gz	YDVZQMQTBDHKNW-CABCVRRESA-N	1	1	310.350	1.102	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871154820	704232672	/nfs/dbraw/zinc/23/26/72/704232672.db2.gz	KHZYTSGFITUGBE-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871154820	704232674	/nfs/dbraw/zinc/23/26/74/704232674.db2.gz	KHZYTSGFITUGBE-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871154820	704232676	/nfs/dbraw/zinc/23/26/76/704232676.db2.gz	KHZYTSGFITUGBE-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC(C[NH+]3CCOCC3)C2)nc2ccccn21	ZINC000853640563	704291648	/nfs/dbraw/zinc/29/16/48/704291648.db2.gz	LOUAQNYKROBSIV-UHFFFAOYSA-N	1	1	317.349	1.011	20	5		DDBDMO
CCN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000855360251	704480691	/nfs/dbraw/zinc/48/06/91/704480691.db2.gz	DFCZGCNYHHGSFU-KGLIPLIRSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1ccc(N2CC(CN3CC[NH+](C)CC3)C2)c([N+](=O)[O-])c1	ZINC000858612198	704734394	/nfs/dbraw/zinc/73/43/94/704734394.db2.gz	ZHMFJUFCKHETKJ-UHFFFAOYSA-N	1	1	304.394	1.587	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCCOc1ccc([N+](=O)[O-])cc1	ZINC000859949002	705051226	/nfs/dbraw/zinc/05/12/26/705051226.db2.gz	FQSKEVPPDUWANM-UHFFFAOYSA-N	1	1	305.290	1.722	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000874850677	705203505	/nfs/dbraw/zinc/20/35/05/705203505.db2.gz	VUUDOEHAABRUPN-CABCVRRESA-N	1	1	303.362	1.832	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000823968145	705346983	/nfs/dbraw/zinc/34/69/83/705346983.db2.gz	LQQULRVXWDDZDC-UHFFFAOYSA-N	1	1	305.338	1.560	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000823968691	705347012	/nfs/dbraw/zinc/34/70/12/705347012.db2.gz	YILNUUOTXZECBL-JTQLQIEISA-N	1	1	319.365	1.949	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825776603	705729499	/nfs/dbraw/zinc/72/94/99/705729499.db2.gz	JUIRMXGUFHTWHE-DZGCQCFKSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@@H]21	ZINC000827313253	705973521	/nfs/dbraw/zinc/97/35/21/705973521.db2.gz	YVPSQBRDAZHKJP-JQWIXIFHSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC(C)(CCC(=O)NCCCC[N@H+]1CCC[C@@H]1CO)[N+](=O)[O-]	ZINC000827349185	705983070	/nfs/dbraw/zinc/98/30/70/705983070.db2.gz	HTEWMFFJSDEHHL-CYBMUJFWSA-N	1	1	315.414	1.175	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000828544882	706197157	/nfs/dbraw/zinc/19/71/57/706197157.db2.gz	IEXSMBSTXJTECC-CQSZACIVSA-N	1	1	305.334	1.006	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2cc(F)c([N+](=O)[O-])cc2CO)C1	ZINC000865526845	706455204	/nfs/dbraw/zinc/45/52/04/706455204.db2.gz	XBCURQBUPLKVAR-NSHDSACASA-N	1	1	313.329	1.359	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)c(F)c1	ZINC000880072321	706871036	/nfs/dbraw/zinc/87/10/36/706871036.db2.gz	SDUNQPVCIDGBEC-UONOGXRCSA-N	1	1	309.341	1.375	20	5		DDBDMO
O=C1CC2(CCC2)[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])CCN1	ZINC000880170382	706900063	/nfs/dbraw/zinc/90/00/63/706900063.db2.gz	JEWNDHZVMRJHPV-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])CCN1	ZINC000880170382	706900065	/nfs/dbraw/zinc/90/00/65/706900065.db2.gz	JEWNDHZVMRJHPV-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000880311479	706937560	/nfs/dbraw/zinc/93/75/60/706937560.db2.gz	IDPVNZGVHSDACN-LZWOXQAQSA-N	1	1	319.361	1.038	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3nccs3)C2)c1	ZINC000880318447	706939504	/nfs/dbraw/zinc/93/95/04/706939504.db2.gz	ZEQFUSSTOJCZJY-ZYHUDNBSSA-N	1	1	323.378	1.098	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000880428830	706972529	/nfs/dbraw/zinc/97/25/29/706972529.db2.gz	SLXGGNNUNXYSAF-HUUCEWRRSA-N	1	1	310.350	1.709	20	5		DDBDMO
CCOc1cc(N2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)ccc1[N+](=O)[O-]	ZINC000872758219	707587293	/nfs/dbraw/zinc/58/72/93/707587293.db2.gz	UUAYRXLPFXQTNH-UONOGXRCSA-N	1	1	321.377	1.639	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000872779128	707596519	/nfs/dbraw/zinc/59/65/19/707596519.db2.gz	MYCHKUCDGUVBFQ-KGLIPLIRSA-N	1	1	304.350	1.367	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2cnn(C[N@H+]3C[C@@H]4COC[C@@H]4C3)c2)cc1	ZINC000872785308	707600320	/nfs/dbraw/zinc/60/03/20/707600320.db2.gz	OXBQGHPVWOVPRJ-GASCZTMLSA-N	1	1	314.345	1.994	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c1	ZINC000897221126	708259243	/nfs/dbraw/zinc/25/92/43/708259243.db2.gz	HMEGXJYBBURCKT-STQMWFEESA-N	1	1	306.366	1.212	20	5		DDBDMO
CNC(=O)C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1	ZINC000886184189	708711590	/nfs/dbraw/zinc/71/15/90/708711590.db2.gz	WGRNZBPTTZMRDT-CQSZACIVSA-N	1	1	314.345	1.957	20	5		DDBDMO
O=C1CCCN1[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886250006	708725526	/nfs/dbraw/zinc/72/55/26/708725526.db2.gz	YHQBNOYWQHKNCP-AWEZNQCLSA-N	1	1	318.377	1.967	20	5		DDBDMO
O=C1CCCN1[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886250006	708725528	/nfs/dbraw/zinc/72/55/28/708725528.db2.gz	YHQBNOYWQHKNCP-AWEZNQCLSA-N	1	1	318.377	1.967	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000886590859	708784064	/nfs/dbraw/zinc/78/40/64/708784064.db2.gz	FZOCKLBRXKVZFQ-LBPRGKRZSA-N	1	1	308.382	1.736	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000886590859	708784067	/nfs/dbraw/zinc/78/40/67/708784067.db2.gz	FZOCKLBRXKVZFQ-LBPRGKRZSA-N	1	1	308.382	1.736	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cc([N+](=O)[O-])c1	ZINC000887934158	709170166	/nfs/dbraw/zinc/17/01/66/709170166.db2.gz	AXJRATWMHGOBQH-CJNGLKHVSA-N	1	1	303.362	1.927	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)C1	ZINC000911473112	710812855	/nfs/dbraw/zinc/81/28/55/710812855.db2.gz	QVOAZVFUMXUAGK-SECBINFHSA-N	1	1	313.304	1.831	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@H]3CCCC[NH2+]C3)C2)nc1	ZINC000903739893	711262477	/nfs/dbraw/zinc/26/24/77/711262477.db2.gz	AXMSJKFAXPKWHH-KBPBESRZSA-N	1	1	319.409	1.866	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(F)cc2c1NCC[N@@H+]1CC[C@H](O)C1	ZINC000894833672	711289481	/nfs/dbraw/zinc/28/94/81/711289481.db2.gz	XBPKKMKVJNQPOZ-NSHDSACASA-N	1	1	320.324	1.183	20	5		DDBDMO
O=[N+]([O-])c1cc(Br)cnc1N[C@H]1Cc2c[nH+]cn2C1	ZINC000894997228	711357474	/nfs/dbraw/zinc/35/74/74/711357474.db2.gz	XMDJKAXVXVIKTL-QMMMGPOBSA-N	1	1	324.138	1.986	20	5		DDBDMO
COc1ccc(CNC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000914300033	713373119	/nfs/dbraw/zinc/37/31/19/713373119.db2.gz	HTEHOWVAIWSVAU-PWSUYJOCSA-N	1	1	322.365	1.495	20	5		DDBDMO
CCC[N@@H+](CC[N+](=O)[O-])[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000929526551	713630695	/nfs/dbraw/zinc/63/06/95/713630695.db2.gz	SHBQAMDDKSNGEP-LBPRGKRZSA-N	1	1	301.387	1.985	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)NC[C@@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000921336891	713738350	/nfs/dbraw/zinc/73/83/50/713738350.db2.gz	ZLTQDTUEILAPKS-AAEUAGOBSA-N	1	1	306.366	1.968	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)[C@H](C)[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000930916136	713958026	/nfs/dbraw/zinc/95/80/26/713958026.db2.gz	NJSYFAHHVAZXLF-XUJVJEKNSA-N	1	1	321.377	1.948	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000932069678	714251852	/nfs/dbraw/zinc/25/18/52/714251852.db2.gz	FLGPCAXAEUGFFU-NWANDNLSSA-N	1	1	303.362	1.909	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CN[C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000932177895	714279807	/nfs/dbraw/zinc/27/98/07/714279807.db2.gz	GBXMZLOQTJFXNC-DOMZBBRYSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@@H](O)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000932177895	714279810	/nfs/dbraw/zinc/27/98/10/714279810.db2.gz	GBXMZLOQTJFXNC-DOMZBBRYSA-N	1	1	311.382	1.185	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN(C[C@H]2CC3(C[NH2+]C3)CO2)C2CC2)c1	ZINC000923369620	714330435	/nfs/dbraw/zinc/33/04/35/714330435.db2.gz	LSDPJGXOWKBUFW-MRXNPFEDSA-N	1	1	317.389	1.938	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000933220914	714540045	/nfs/dbraw/zinc/54/00/45/714540045.db2.gz	LWYYLPWRMBHKTJ-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000933220914	714540047	/nfs/dbraw/zinc/54/00/47/714540047.db2.gz	LWYYLPWRMBHKTJ-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)cc1F	ZINC000934265786	714780010	/nfs/dbraw/zinc/78/00/10/714780010.db2.gz	NPMPFAOUQJSPQG-CVEARBPZSA-N	1	1	323.368	1.765	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925317515	714806870	/nfs/dbraw/zinc/80/68/70/714806870.db2.gz	MCKAOCIKYMURRK-AAEUAGOBSA-N	1	1	306.366	1.829	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CC3(CCC3)C2)C1	ZINC000950056150	720470007	/nfs/dbraw/zinc/47/00/07/720470007.db2.gz	UXCHLIVXKCUPSV-HUUCEWRRSA-N	1	1	321.421	1.765	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000601101240	721904299	/nfs/dbraw/zinc/90/42/99/721904299.db2.gz	VICQXJUDMWTTFJ-GFCCVEGCSA-N	1	1	310.329	1.430	20	5		DDBDMO
Cc1cc(C)c(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)o1	ZINC001125400484	733187370	/nfs/dbraw/zinc/18/73/70/733187370.db2.gz	AHEIVVOHCQKKIB-UHFFFAOYSA-N	1	1	321.337	1.058	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022064037	734368617	/nfs/dbraw/zinc/36/86/17/734368617.db2.gz	RXJYMGCZGUEGKS-XJFOESAGSA-N	1	1	307.394	1.469	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@H](C)[C@@H](O)C(F)(F)F)c1[N+](=O)[O-]	ZINC001183270342	743813301	/nfs/dbraw/zinc/81/33/01/743813301.db2.gz	SRTXBZCHEKJWTA-KSBSHMNSSA-N	1	1	324.255	1.710	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)n1	ZINC001184820536	744108356	/nfs/dbraw/zinc/10/83/56/744108356.db2.gz	MAMYYVNCMNRJTI-GFCCVEGCSA-N	1	1	309.370	1.019	20	5		DDBDMO
COc1ccccc1C1([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)COC1	ZINC001168994067	762168002	/nfs/dbraw/zinc/16/80/02/762168002.db2.gz	OLFLAOADKUUQCA-STQMWFEESA-N	1	1	306.362	1.956	20	5		DDBDMO
O=C1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038655	762193648	/nfs/dbraw/zinc/19/36/48/762193648.db2.gz	JXKLKTISFAUVFU-HZPDHXFCSA-N	1	1	317.389	1.776	20	5		DDBDMO
O=C1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038655	762193649	/nfs/dbraw/zinc/19/36/49/762193649.db2.gz	JXKLKTISFAUVFU-HZPDHXFCSA-N	1	1	317.389	1.776	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169018748	762198920	/nfs/dbraw/zinc/19/89/20/762198920.db2.gz	DIQCMSLLZLLXRR-FPMFFAJLSA-N	1	1	308.382	1.411	20	5		DDBDMO
CC(=O)NC1(C2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)CC1	ZINC001000042565	761469818	/nfs/dbraw/zinc/46/98/18/761469818.db2.gz	NIMLJBXKONRRIQ-UHFFFAOYSA-N	1	1	321.381	1.209	20	5		DDBDMO
Cc1cncc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001086363216	761493149	/nfs/dbraw/zinc/49/31/49/761493149.db2.gz	HWJBRIFELFQUPV-NMFUWQPSSA-N	1	1	318.377	1.040	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])ccc1-n1[nH]c(=O)c(CC[NH3+])c1C	ZINC001170339639	766272880	/nfs/dbraw/zinc/27/28/80/766272880.db2.gz	NUAVRLYGQXXKNL-UHFFFAOYSA-N	1	1	306.322	1.694	20	5		DDBDMO
Cc1cc(N[C@H](N)CCC[NH3+])nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC001170897297	771897230	/nfs/dbraw/zinc/89/72/30/771897230.db2.gz	LXNCSKFUEFWSON-ZDUSSCGKSA-N	1	1	316.365	1.796	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C[N@H+](C)C(C)C)c1	ZINC001093674072	774989351	/nfs/dbraw/zinc/98/93/51/774989351.db2.gz	NAOVUUNCPMRPGH-UHFFFAOYSA-N	1	1	308.382	1.772	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1F	ZINC001094008757	775325615	/nfs/dbraw/zinc/32/56/15/775325615.db2.gz	WZBLDWIXIUVTAC-UHFFFAOYSA-N	1	1	321.312	1.467	20	5		DDBDMO
C[N@@H+](CC(=O)NCCCNc1ccc([N+](=O)[O-])cn1)C1CCC1	ZINC001094853519	776503696	/nfs/dbraw/zinc/50/36/96/776503696.db2.gz	PSQQRQBHXVLNNB-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(CC[NH+](C)C)CC1	ZINC001173229364	777062510	/nfs/dbraw/zinc/06/25/10/777062510.db2.gz	SVGNDKFKCFUJDU-OAHLLOKOSA-N	1	1	320.437	1.705	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC001178861626	779214586	/nfs/dbraw/zinc/21/45/86/779214586.db2.gz	ZTUYTTYAVOLZMJ-AWEZNQCLSA-N	1	1	321.377	1.820	20	5		DDBDMO
CCc1ncc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC001179352815	779342024	/nfs/dbraw/zinc/34/20/24/779342024.db2.gz	IHVJCYHJYDWMIN-INIZCTEOSA-N	1	1	316.361	1.945	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@H](C(=O)N(C)C)C2)cc1[N+](=O)[O-]	ZINC000069522376	779429890	/nfs/dbraw/zinc/42/98/90/779429890.db2.gz	FKJNAJZBFJHZQX-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001116023054	780467338	/nfs/dbraw/zinc/46/73/38/780467338.db2.gz	IFPBJSVEGANQOS-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001116023054	780467343	/nfs/dbraw/zinc/46/73/43/780467343.db2.gz	IFPBJSVEGANQOS-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC001117779029	780899454	/nfs/dbraw/zinc/89/94/54/780899454.db2.gz	DOLLWPRZDBVBJH-IINYFYTJSA-N	1	1	304.350	1.413	20	5		DDBDMO
Cc1cnc(N2CCN(c3[nH+]cccc3N)CC2)c([N+](=O)[O-])c1	ZINC001154782017	861447946	/nfs/dbraw/zinc/44/79/46/861447946.db2.gz	BYNGCCCINPCDQW-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
Nc1c(C(=O)NCc2c[nH+]c3n2CCC3)cccc1[N+](=O)[O-]	ZINC001154937966	861584888	/nfs/dbraw/zinc/58/48/88/861584888.db2.gz	YCNZASMXLJCYDN-UHFFFAOYSA-N	1	1	301.306	1.250	20	5		DDBDMO
CC[C@H]1[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021514	850518676	/nfs/dbraw/zinc/51/86/76/850518676.db2.gz	LGKQCJPNRMFIDS-KQTLUZQSSA-N	1	1	309.410	1.955	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)cc1[N+](=O)[O-]	ZINC001124088465	859571609	/nfs/dbraw/zinc/57/16/09/859571609.db2.gz	UWTJSHZIGRYCQP-HZSPNIEDSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[N@@H+](C1CN(c2cc(Cl)cc([N+](=O)[O-])n2)C1)[C@H]1CCOC1	ZINC001158731268	864864621	/nfs/dbraw/zinc/86/46/21/864864621.db2.gz	JDYGINPHFZQFQL-JTQLQIEISA-N	1	1	312.757	1.553	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC001160152791	865702395	/nfs/dbraw/zinc/70/23/95/865702395.db2.gz	GJVWUGCKOLYUEC-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ncccc3[N+](=O)[O-])C[C@H]1[N@H+]2C	ZINC001225598945	881931730	/nfs/dbraw/zinc/93/17/30/881931730.db2.gz	ZIZGTCBQTXCPES-VTPLQMEGSA-N	1	1	321.333	1.535	20	5		DDBDMO
O=C(NCC[N@@H+](CCF)C1CCCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001323708371	866786834	/nfs/dbraw/zinc/78/68/34/866786834.db2.gz	GLKNWAKADCKWFC-ZIAGYGMSSA-N	1	1	315.389	1.762	20	5		DDBDMO
O=C(NCC[N@H+](CCF)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001323708371	866786848	/nfs/dbraw/zinc/78/68/48/866786848.db2.gz	GLKNWAKADCKWFC-ZIAGYGMSSA-N	1	1	315.389	1.762	20	5		DDBDMO
O=C(NCC[N@@H+](CCF)C1CCCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001323708371	866786861	/nfs/dbraw/zinc/78/68/61/866786861.db2.gz	GLKNWAKADCKWFC-ZIAGYGMSSA-N	1	1	315.389	1.762	20	5		DDBDMO
C[N@H+]1CCC[C@@](C)(Nc2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C1	ZINC001162336430	867467103	/nfs/dbraw/zinc/46/71/03/867467103.db2.gz	BILCWSLBRWGOKN-GFCCVEGCSA-N	1	1	300.746	1.778	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC001335116691	868075588	/nfs/dbraw/zinc/07/55/88/868075588.db2.gz	JMWMXWUYEKKRKK-CHWSQXEVSA-N	1	1	309.341	1.769	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@@](C)(CO)C2)ncc1[N+](=O)[O-]	ZINC001164147032	868971703	/nfs/dbraw/zinc/97/17/03/868971703.db2.gz	KURRGAUPYLRCJQ-CSPWOOARSA-N	1	1	306.366	1.731	20	5		DDBDMO
NC(=O)[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC001336722630	869109122	/nfs/dbraw/zinc/10/91/22/869109122.db2.gz	LDSOAJAYSIVSNB-HUUCEWRRSA-N	1	1	315.329	1.444	20	5		DDBDMO
[NH3+][C@@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)CCC1(F)F	ZINC001164319868	869124274	/nfs/dbraw/zinc/12/42/74/869124274.db2.gz	RKENWRITLYKCET-LLVKDONJSA-N	1	1	309.276	1.711	20	5		DDBDMO
[NH3+]CCONc1ccc([N+](=O)[O-])c(OCc2ccccc2)n1	ZINC001164424154	869187068	/nfs/dbraw/zinc/18/70/68/869187068.db2.gz	PADKLQYHTPGTJS-UHFFFAOYSA-N	1	1	304.306	1.871	20	5		DDBDMO
Cc1c(C)c(N2CC([N@H+](C)[C@@H]3CCOC3)C2)ncc1[N+](=O)[O-]	ZINC001165205908	869431906	/nfs/dbraw/zinc/43/19/06/869431906.db2.gz	XVHIZNLWPLUEHA-GFCCVEGCSA-N	1	1	306.366	1.516	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1cccc([N+](=O)[O-])n1)CC2	ZINC001166032761	869808676	/nfs/dbraw/zinc/80/86/76/869808676.db2.gz	SBWAJNKDTQEGNZ-UHFFFAOYSA-N	1	1	305.338	1.624	20	5		DDBDMO
O=C(N1Cc2ccc([N+](=O)[O-])cc2C1)[C@@]12CC[N@@H+](C1)CCC2	ZINC001338363166	869947165	/nfs/dbraw/zinc/94/71/65/869947165.db2.gz	PFVBFSKYOMJXIH-INIZCTEOSA-N	1	1	301.346	1.923	20	5		DDBDMO
CN(C)[C@@H]1C[C@@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC001338553537	870042976	/nfs/dbraw/zinc/04/29/76/870042976.db2.gz	XUEVENUQZRSYCN-RRFJBIMHSA-N	1	1	307.394	1.947	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3nc(Cl)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226367156	882386952	/nfs/dbraw/zinc/38/69/52/882386952.db2.gz	VIEQEDHSLGNBCN-WHGOUJPWSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nc(Cl)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226367156	882386971	/nfs/dbraw/zinc/38/69/71/882386971.db2.gz	VIEQEDHSLGNBCN-WHGOUJPWSA-N	1	1	311.725	1.826	20	5		DDBDMO
COC(CN(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)OC	ZINC001167032162	870489115	/nfs/dbraw/zinc/48/91/15/870489115.db2.gz	XGDGXCNZQNQALP-VOTSOKGWSA-N	1	1	310.354	1.577	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001226430081	882426100	/nfs/dbraw/zinc/42/61/00/882426100.db2.gz	CERRPCORPJLBDP-JTQLQIEISA-N	1	1	324.333	1.863	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001298706959	870684726	/nfs/dbraw/zinc/68/47/26/870684726.db2.gz	ZPSQURFKPPTVOZ-MRVPVSSYSA-N	1	1	317.777	1.822	20	5		DDBDMO
CC(C)(NC(=O)CC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC001340095046	870893191	/nfs/dbraw/zinc/89/31/91/870893191.db2.gz	YWGDKATXQXSXIQ-UHFFFAOYSA-N	1	1	321.377	1.668	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[N@@H+](CC)CC2(C)C)c1[N+](=O)[O-]	ZINC001304042444	871180526	/nfs/dbraw/zinc/18/05/26/871180526.db2.gz	JHGTVMOMFHWSQH-NSHDSACASA-N	1	1	323.397	1.731	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](CO)[C@H](CCO)C2)cc1Cl	ZINC001308983843	871544000	/nfs/dbraw/zinc/54/40/00/871544000.db2.gz	UYLYCMNRPSDHLG-VXGBXAGGSA-N	1	1	314.769	1.671	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@@H]1CCC[N@H+]1CC1CC1	ZINC001347982233	874328645	/nfs/dbraw/zinc/32/86/45/874328645.db2.gz	KHYVYKPYGKPZOF-ZDUSSCGKSA-N	1	1	322.365	1.517	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC001348998647	874915594	/nfs/dbraw/zinc/91/55/94/874915594.db2.gz	MLTKTYAHMOTCFZ-RYUDHWBXSA-N	1	1	322.340	1.625	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C	ZINC001351177307	876100511	/nfs/dbraw/zinc/10/05/11/876100511.db2.gz	PIRHQYMHAUDIHI-VXGBXAGGSA-N	1	1	323.397	1.479	20	5		DDBDMO
CN1C(=O)C[C@@H]([NH2+]CC[N+](=O)[O-])[C@H]1c1ccc(Cl)c(F)c1	ZINC001351401420	876232372	/nfs/dbraw/zinc/23/23/72/876232372.db2.gz	VKFBOLUBSIDNLW-DGCLKSJQSA-N	1	1	315.732	1.617	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC001352971968	877046876	/nfs/dbraw/zinc/04/68/76/877046876.db2.gz	YHXZOYKECKIWJG-JTQLQIEISA-N	1	1	321.381	1.715	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C3CCCC3)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC001352971968	877046887	/nfs/dbraw/zinc/04/68/87/877046887.db2.gz	YHXZOYKECKIWJG-JTQLQIEISA-N	1	1	321.381	1.715	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C3CCCC3)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC001352971968	877046902	/nfs/dbraw/zinc/04/69/02/877046902.db2.gz	YHXZOYKECKIWJG-JTQLQIEISA-N	1	1	321.381	1.715	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(OC2CC[NH+](C)CC2)cc1O	ZINC001228812106	883684857	/nfs/dbraw/zinc/68/48/57/883684857.db2.gz	UFJBFZWRZOWFDD-UHFFFAOYSA-N	1	1	310.306	1.560	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2c(F)cc(F)cc2[N+](=O)[O-])C1	ZINC001233699857	887237132	/nfs/dbraw/zinc/23/71/32/887237132.db2.gz	VVLXQAKLHTWTIY-SNVBAGLBSA-N	1	1	302.277	1.973	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2c(F)cc(F)cc2[N+](=O)[O-])C1	ZINC001233699857	887237142	/nfs/dbraw/zinc/23/71/42/887237142.db2.gz	VVLXQAKLHTWTIY-SNVBAGLBSA-N	1	1	302.277	1.973	20	5		DDBDMO
COC(=O)c1ccc(O[C@H]2CCc3[nH+]ccn3C2)cc1[N+](=O)[O-]	ZINC001234058154	887601739	/nfs/dbraw/zinc/60/17/39/887601739.db2.gz	NRLPWXWLBICKJW-NSHDSACASA-N	1	1	317.301	1.972	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O[C@@H]2CCC[N@H+](C)C2)n1	ZINC001234908508	888246331	/nfs/dbraw/zinc/24/63/31/888246331.db2.gz	GEAFQBYWTHKUSU-SNVBAGLBSA-N	1	1	309.326	1.125	20	5		DDBDMO
COc1ccc(C[C@@H](C)N[C@H]2CC[NH2+]C[C@@H]2F)c([N+](=O)[O-])c1	ZINC001246092730	892411828	/nfs/dbraw/zinc/41/18/28/892411828.db2.gz	OZWDOPFCTPYFKC-SWHYSGLUSA-N	1	1	311.357	1.824	20	5		DDBDMO
CCN(CC)CCNC(=[NH2+])N[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254590335	896520493	/nfs/dbraw/zinc/52/04/93/896520493.db2.gz	VNXSGGIQSWCUNX-AWEZNQCLSA-N	1	1	319.409	1.518	20	5		DDBDMO
Cc1nc(C)c(C[N@H+](C)CCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])o1	ZINC001280813180	897436197	/nfs/dbraw/zinc/43/61/97/897436197.db2.gz	CDGJKFAPGQFZBF-CHWSQXEVSA-N	1	1	324.381	1.237	20	5		DDBDMO
Cc1nc(C)c(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001280813180	897436205	/nfs/dbraw/zinc/43/62/05/897436205.db2.gz	CDGJKFAPGQFZBF-CHWSQXEVSA-N	1	1	324.381	1.237	20	5		DDBDMO
Cc1nc(C)c(C[N@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001280813180	897436212	/nfs/dbraw/zinc/43/62/12/897436212.db2.gz	CDGJKFAPGQFZBF-CHWSQXEVSA-N	1	1	324.381	1.237	20	5		DDBDMO
Cc1cc(NC(=O)[C@H]2C[N@@H+]3CCN2C[C@H]3C)cc([N+](=O)[O-])c1	ZINC001264010941	900870445	/nfs/dbraw/zinc/87/04/45/900870445.db2.gz	QHRXEGHCDZKFKE-BXUZGUMPSA-N	1	1	304.350	1.230	20	5		DDBDMO
CC(C)CCC[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001265405431	901978917	/nfs/dbraw/zinc/97/89/17/901978917.db2.gz	ZJRYLIILGIKGEY-LXTVHRRPSA-N	1	1	309.410	1.763	20	5		DDBDMO
CC(C)CCC[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001265405431	901978923	/nfs/dbraw/zinc/97/89/23/901978923.db2.gz	ZJRYLIILGIKGEY-LXTVHRRPSA-N	1	1	309.410	1.763	20	5		DDBDMO
CC(C)CCC[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001265405431	901978933	/nfs/dbraw/zinc/97/89/33/901978933.db2.gz	ZJRYLIILGIKGEY-LXTVHRRPSA-N	1	1	309.410	1.763	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)CS(C)(=O)=O	ZINC000081903541	192337109	/nfs/dbraw/zinc/33/71/09/192337109.db2.gz	JDQFTDYKENYNOE-VIFPVBQESA-N	1	1	302.352	1.126	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1CO	ZINC000248934207	282118543	/nfs/dbraw/zinc/11/85/43/282118543.db2.gz	MYQNXVSWHMYHLY-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+]1CC=C(CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC1	ZINC000286550079	219049422	/nfs/dbraw/zinc/04/94/22/219049422.db2.gz	QBWFTKRRBDVNJJ-UHFFFAOYSA-N	1	1	315.333	1.917	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CC(C)(C)CO	ZINC000451243809	231044103	/nfs/dbraw/zinc/04/41/03/231044103.db2.gz	CUVJEQQFJRVRFC-UHFFFAOYSA-N	1	1	309.366	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CC(C)(C)CO	ZINC000451243809	231044106	/nfs/dbraw/zinc/04/41/06/231044106.db2.gz	CUVJEQQFJRVRFC-UHFFFAOYSA-N	1	1	309.366	1.792	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000249484537	282159736	/nfs/dbraw/zinc/15/97/36/282159736.db2.gz	CFVYQIUFZHGWTD-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323656	529466583	/nfs/dbraw/zinc/46/65/83/529466583.db2.gz	LEVBSTVXRRJKCY-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323656	529466585	/nfs/dbraw/zinc/46/65/85/529466585.db2.gz	LEVBSTVXRRJKCY-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323656	529466587	/nfs/dbraw/zinc/46/65/87/529466587.db2.gz	LEVBSTVXRRJKCY-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323656	529466589	/nfs/dbraw/zinc/46/65/89/529466589.db2.gz	LEVBSTVXRRJKCY-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](CCO)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000614895393	362066600	/nfs/dbraw/zinc/06/66/00/362066600.db2.gz	RNVGTJPNQSKQJG-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](CCO)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000614895393	362066606	/nfs/dbraw/zinc/06/66/06/362066606.db2.gz	RNVGTJPNQSKQJG-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@H]3C2)c1[N+](=O)[O-]	ZINC000301324760	282272485	/nfs/dbraw/zinc/27/24/85/282272485.db2.gz	ACWCFPCQNVDJRL-AVGNSLFASA-N	1	1	305.382	1.557	20	5		DDBDMO
C[N@@H+](CCNC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-])C1CC1	ZINC000491323018	529912397	/nfs/dbraw/zinc/91/23/97/529912397.db2.gz	XVLHTLVXVZNNQQ-CLTKARDFSA-N	1	1	307.325	1.958	20	5		DDBDMO
C[N@@H+](CCNC(=O)OC(C)(C)C)CCn1ccc([N+](=O)[O-])n1	ZINC000297461680	529915788	/nfs/dbraw/zinc/91/57/88/529915788.db2.gz	QDUZVBSDAKFRHZ-UHFFFAOYSA-N	1	1	313.358	1.248	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1	ZINC000420968473	529926436	/nfs/dbraw/zinc/92/64/36/529926436.db2.gz	BXCRZZIATVKKSJ-LBPRGKRZSA-N	1	1	321.377	1.950	20	5		DDBDMO
CN1CCC([N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CCO)CC1	ZINC000434992502	530049631	/nfs/dbraw/zinc/04/96/31/530049631.db2.gz	TUDIOUNKUGJGPZ-XQRVVYSFSA-N	1	1	319.405	1.997	20	5		DDBDMO
C[NH+]1CCC(N(C/C=C\c2ccccc2[N+](=O)[O-])CCO)CC1	ZINC000434992502	530049632	/nfs/dbraw/zinc/04/96/32/530049632.db2.gz	TUDIOUNKUGJGPZ-XQRVVYSFSA-N	1	1	319.405	1.997	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000458168646	530060547	/nfs/dbraw/zinc/06/05/47/530060547.db2.gz	NPNYCXLGDPREJJ-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](O)C(C)(C)C1	ZINC000279816727	215172574	/nfs/dbraw/zinc/17/25/74/215172574.db2.gz	QGCHQCSPVKMDHY-GWCFXTLKSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](O)C(C)(C)C1	ZINC000279816727	215172579	/nfs/dbraw/zinc/17/25/79/215172579.db2.gz	QGCHQCSPVKMDHY-GWCFXTLKSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000280018151	215315801	/nfs/dbraw/zinc/31/58/01/215315801.db2.gz	KGJLCEAQBQMINA-BBRMVZONSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000272441351	209845698	/nfs/dbraw/zinc/84/56/98/209845698.db2.gz	INGPOMKBVCEFHH-SWLSCSKDSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[C@@H]1[C@@H](C)CC[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000177877276	186197322	/nfs/dbraw/zinc/19/73/22/186197322.db2.gz	LSQFRHMNRDIBEM-VHSXEESVSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@@H]1[C@@H](C)CC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000177877276	186197324	/nfs/dbraw/zinc/19/73/24/186197324.db2.gz	LSQFRHMNRDIBEM-VHSXEESVSA-N	1	1	321.333	1.992	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072664884	191211706	/nfs/dbraw/zinc/21/17/06/191211706.db2.gz	LJHPUOYFLNYMTN-NSHDSACASA-N	1	1	321.381	1.391	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072664884	191211709	/nfs/dbraw/zinc/21/17/09/191211709.db2.gz	LJHPUOYFLNYMTN-NSHDSACASA-N	1	1	321.381	1.391	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000054644032	352699436	/nfs/dbraw/zinc/69/94/36/352699436.db2.gz	BQCROYWIYJURPA-ZDUSSCGKSA-N	1	1	306.366	1.531	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000068080238	353085728	/nfs/dbraw/zinc/08/57/28/353085728.db2.gz	XTIHXCFYNAAAPH-UHFFFAOYSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC(C)[N@H+](C)CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000068080238	353085730	/nfs/dbraw/zinc/08/57/30/353085730.db2.gz	XTIHXCFYNAAAPH-UHFFFAOYSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000068080238	353085732	/nfs/dbraw/zinc/08/57/32/353085732.db2.gz	XTIHXCFYNAAAPH-UHFFFAOYSA-N	1	1	319.365	1.931	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000068195974	353095111	/nfs/dbraw/zinc/09/51/11/353095111.db2.gz	DCGFADAGLZPPHE-LLVKDONJSA-N	1	1	321.377	1.745	20	5		DDBDMO
CNC(=O)c1ccc(N2CCC[N@H+](C(C)C)CC2)c([N+](=O)[O-])c1	ZINC000068916240	353135906	/nfs/dbraw/zinc/13/59/06/353135906.db2.gz	WHEKLWFYHHGSLL-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
CC(C)[N@H+]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000069084074	353143731	/nfs/dbraw/zinc/14/37/31/353143731.db2.gz	NQZNQOSOCUBMKZ-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cn1cc(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)cn1	ZINC000077247184	353461174	/nfs/dbraw/zinc/46/11/74/353461174.db2.gz	TYSDNWCBEQCKPD-UHFFFAOYSA-N	1	1	315.377	1.693	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CC[NH+](C[C@@H]3CCCO3)CC2)cs1	ZINC000079481795	353563696	/nfs/dbraw/zinc/56/36/96/353563696.db2.gz	YABHCMGCBJWXLM-ZDUSSCGKSA-N	1	1	311.407	1.953	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083169808	353706501	/nfs/dbraw/zinc/70/65/01/353706501.db2.gz	POKNSRRWZDGIAX-SNVBAGLBSA-N	1	1	318.333	1.966	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000091028237	353804857	/nfs/dbraw/zinc/80/48/57/353804857.db2.gz	NIAKXWVCCXQHCH-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CCC[N@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000091028237	353804859	/nfs/dbraw/zinc/80/48/59/353804859.db2.gz	NIAKXWVCCXQHCH-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCC1CC[NH2+]CC1	ZINC000122921171	354028901	/nfs/dbraw/zinc/02/89/01/354028901.db2.gz	DWFNQHSBDSGWDN-UHFFFAOYSA-N	1	1	317.342	1.012	20	5		DDBDMO
COc1ccc(C(=O)N2CCC[N@H+](C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000149259891	354172306	/nfs/dbraw/zinc/17/23/06/354172306.db2.gz	RSIMOPACNOSSRO-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000153753512	354200544	/nfs/dbraw/zinc/20/05/44/354200544.db2.gz	GUAOYOSIEOWSOT-OAHLLOKOSA-N	1	1	305.378	1.936	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@H](O)C1CC1	ZINC000156601554	354220159	/nfs/dbraw/zinc/22/01/59/354220159.db2.gz	OTYBGEWCEKZXEG-CYBMUJFWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H](O)C1CC1	ZINC000156601554	354220160	/nfs/dbraw/zinc/22/01/60/354220160.db2.gz	OTYBGEWCEKZXEG-CYBMUJFWSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCNC1=O	ZINC000281637665	354426528	/nfs/dbraw/zinc/42/65/28/354426528.db2.gz	IKFUQXXBJXCVJS-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000405198888	354677185	/nfs/dbraw/zinc/67/71/85/354677185.db2.gz	BWMVQWJFPCSUSN-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
Nc1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)cc(CO)c1[N+](=O)[O-]	ZINC000587837769	354886591	/nfs/dbraw/zinc/88/65/91/354886591.db2.gz	DLVJPJIHIVHQNS-SNVBAGLBSA-N	1	1	317.349	1.776	20	5		DDBDMO
CC[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C[C@@H]1C	ZINC000588006066	354892800	/nfs/dbraw/zinc/89/28/00/354892800.db2.gz	PRHHALNBVDCFBU-JTQLQIEISA-N	1	1	317.349	1.774	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1	ZINC000590442948	355097857	/nfs/dbraw/zinc/09/78/57/355097857.db2.gz	IGLRAPYLOKYOIF-IINYFYTJSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C[C@@H]21	ZINC000590659983	355139873	/nfs/dbraw/zinc/13/98/73/355139873.db2.gz	IFUVOIPTWGWBPL-RISCZKNCSA-N	1	1	319.361	1.502	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](O)[C@H]1C	ZINC000591039637	355237959	/nfs/dbraw/zinc/23/79/59/355237959.db2.gz	WWBFMBXHYVEAPY-ZWNOBZJWSA-N	1	1	323.349	1.387	20	5		DDBDMO
CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000591475982	355320257	/nfs/dbraw/zinc/32/02/57/355320257.db2.gz	MUVPKOPVXLVLOA-OAHLLOKOSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000332655735	235248661	/nfs/dbraw/zinc/24/86/61/235248661.db2.gz	VPKMKKBQWMATET-NSHDSACASA-N	1	1	305.334	1.524	20	5		DDBDMO
CCCN(C(=O)c1nn(CC)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592829528	355705826	/nfs/dbraw/zinc/70/58/26/355705826.db2.gz	PXAUPDBGVILBPO-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
CCc1[nH+]ccn1[C@@H](C)CC(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC000592777361	355686454	/nfs/dbraw/zinc/68/64/54/355686454.db2.gz	LGGCEZHJEGLRML-NSHDSACASA-N	1	1	320.353	1.318	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000593108704	355800961	/nfs/dbraw/zinc/80/09/61/355800961.db2.gz	ZBELWQPSFRALIX-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000593108704	355800963	/nfs/dbraw/zinc/80/09/63/355800963.db2.gz	ZBELWQPSFRALIX-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593519674	355912612	/nfs/dbraw/zinc/91/26/12/355912612.db2.gz	AOBQPXFRMSGWTM-IINYFYTJSA-N	1	1	321.352	1.875	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000593754939	355987478	/nfs/dbraw/zinc/98/74/78/355987478.db2.gz	ULANOVKMUFEBCU-UHFFFAOYSA-N	1	1	310.354	1.403	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000593969923	356076895	/nfs/dbraw/zinc/07/68/95/356076895.db2.gz	GNYIHCASRJFJJM-STQMWFEESA-N	1	1	311.382	1.185	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)n1	ZINC000594198105	356136870	/nfs/dbraw/zinc/13/68/70/356136870.db2.gz	RXLMSIDMLHIFIY-NEPJUHHUSA-N	1	1	321.381	1.558	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594198111	356137584	/nfs/dbraw/zinc/13/75/84/356137584.db2.gz	CXFPOGWXZNSHNF-UONOGXRCSA-N	1	1	321.381	1.315	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594200421	356138113	/nfs/dbraw/zinc/13/81/13/356138113.db2.gz	LVXPZTJKPOFQEM-VXGBXAGGSA-N	1	1	321.381	1.383	20	5		DDBDMO
C[C@H]1CC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CS1(=O)=O	ZINC000594973896	356366987	/nfs/dbraw/zinc/36/69/87/356366987.db2.gz	GGCMOLCDQFDRBM-WPRPVWTQSA-N	1	1	304.393	1.712	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000595025970	356373958	/nfs/dbraw/zinc/37/39/58/356373958.db2.gz	LSBOHSRSCOWTQO-LLVKDONJSA-N	1	1	323.349	1.113	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCCOCC[NH+](C)C	ZINC000595038975	356375075	/nfs/dbraw/zinc/37/50/75/356375075.db2.gz	AAJJADUMYWULLR-GFCCVEGCSA-N	1	1	311.382	1.832	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCCNC1=O	ZINC000595005615	356371436	/nfs/dbraw/zinc/37/14/36/356371436.db2.gz	BMXKOQXGMWFYJK-ZWNOBZJWSA-N	1	1	307.350	1.923	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595318270	356447354	/nfs/dbraw/zinc/44/73/54/356447354.db2.gz	TVDCJMJHVWDSIV-LBPRGKRZSA-N	1	1	322.365	1.726	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595318270	356447357	/nfs/dbraw/zinc/44/73/57/356447357.db2.gz	TVDCJMJHVWDSIV-LBPRGKRZSA-N	1	1	322.365	1.726	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595500163	356519369	/nfs/dbraw/zinc/51/93/69/356519369.db2.gz	XMOXYHLJCQWIBE-LLVKDONJSA-N	1	1	308.338	1.336	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595500163	356519372	/nfs/dbraw/zinc/51/93/72/356519372.db2.gz	XMOXYHLJCQWIBE-LLVKDONJSA-N	1	1	308.338	1.336	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595766572	356644120	/nfs/dbraw/zinc/64/41/20/356644120.db2.gz	PTLZZEXXRHWWMI-GXFFZTMASA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595766572	356644124	/nfs/dbraw/zinc/64/41/24/356644124.db2.gz	PTLZZEXXRHWWMI-GXFFZTMASA-N	1	1	323.349	1.387	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000595780369	356649633	/nfs/dbraw/zinc/64/96/33/356649633.db2.gz	JMBAMDRQYWRXEN-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000595868950	356684574	/nfs/dbraw/zinc/68/45/74/356684574.db2.gz	CNXFAHGXXPBUCR-WBMJQRKESA-N	1	1	321.377	1.874	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)n1	ZINC000595911738	356702347	/nfs/dbraw/zinc/70/23/47/356702347.db2.gz	WNUBMJSXJVFCFI-GASCZTMLSA-N	1	1	306.366	1.684	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596537902	356910158	/nfs/dbraw/zinc/91/01/58/356910158.db2.gz	JLHXGRCLCIBOHX-ZDUSSCGKSA-N	1	1	321.377	1.639	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1	ZINC000596537854	356910328	/nfs/dbraw/zinc/91/03/28/356910328.db2.gz	INFITWAPNXWMAR-ZDUSSCGKSA-N	1	1	321.377	1.639	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+](C)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000597603806	357250494	/nfs/dbraw/zinc/25/04/94/357250494.db2.gz	DYOBGHRWLUHRIW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](C)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000597603806	357250497	/nfs/dbraw/zinc/25/04/97/357250497.db2.gz	DYOBGHRWLUHRIW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](C)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000597603806	357250502	/nfs/dbraw/zinc/25/05/02/357250502.db2.gz	DYOBGHRWLUHRIW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000347685954	283258934	/nfs/dbraw/zinc/25/89/34/283258934.db2.gz	SAGHZYQKDSPXPV-LBPRGKRZSA-N	1	1	309.370	1.067	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000347685954	283258936	/nfs/dbraw/zinc/25/89/36/283258936.db2.gz	SAGHZYQKDSPXPV-LBPRGKRZSA-N	1	1	309.370	1.067	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000598342911	357545563	/nfs/dbraw/zinc/54/55/63/357545563.db2.gz	OUHWMDXRELPQTR-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
COC(=O)c1ccnc(N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000598599039	357648590	/nfs/dbraw/zinc/64/85/90/357648590.db2.gz	XGYCLEANRXFIBH-NSHDSACASA-N	1	1	322.365	1.554	20	5		DDBDMO
COC(=O)c1ccnc(N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000598631031	357662632	/nfs/dbraw/zinc/66/26/32/357662632.db2.gz	NYCNXFPSMPWJKQ-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
Cn1cc(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)nn1	ZINC000599260945	357865979	/nfs/dbraw/zinc/86/59/79/357865979.db2.gz	MKYJVJKUJLAODK-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(C)COC1	ZINC000599571754	357979345	/nfs/dbraw/zinc/97/93/45/357979345.db2.gz	ULTOUURXPKGKJV-LLVKDONJSA-N	1	1	307.350	1.890	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599684809	358024089	/nfs/dbraw/zinc/02/40/89/358024089.db2.gz	RDXKLOHSNOQUGW-CAVOSLQRSA-N	1	1	322.361	1.180	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000599704831	358033353	/nfs/dbraw/zinc/03/33/53/358033353.db2.gz	UVHWKCCOKKHLPY-CQSZACIVSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000599753570	358048115	/nfs/dbraw/zinc/04/81/15/358048115.db2.gz	ORTJFNXWKLYCPG-LBPRGKRZSA-N	1	1	322.365	1.400	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC1CC([NH+]2CCOCC2)C1	ZINC000600067355	358113387	/nfs/dbraw/zinc/11/33/87/358113387.db2.gz	SOWFMWWYNHCYRN-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000600190537	358151038	/nfs/dbraw/zinc/15/10/38/358151038.db2.gz	GWZFWJLAYGPXME-BIENSFFJSA-N	1	1	320.345	1.872	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000600190537	358151040	/nfs/dbraw/zinc/15/10/40/358151040.db2.gz	GWZFWJLAYGPXME-BIENSFFJSA-N	1	1	320.345	1.872	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000601185727	358438765	/nfs/dbraw/zinc/43/87/65/358438765.db2.gz	ZZPSEZOONANOML-WDEREUQCSA-N	1	1	320.349	1.164	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601973361	358760506	/nfs/dbraw/zinc/76/05/06/358760506.db2.gz	LOWPNKHNROXECN-TXEJJXNPSA-N	1	1	305.334	1.420	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601973361	358760510	/nfs/dbraw/zinc/76/05/10/358760510.db2.gz	LOWPNKHNROXECN-TXEJJXNPSA-N	1	1	305.334	1.420	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)C[C@@H]1CC[N@@H+](C)C1	ZINC000602150413	358848955	/nfs/dbraw/zinc/84/89/55/358848955.db2.gz	JFACJAGRBHTOFW-ZDUSSCGKSA-N	1	1	305.378	1.938	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(O[C@@H]3CCOC3)CC2)c([N+](=O)[O-])n1	ZINC000602480300	359005579	/nfs/dbraw/zinc/00/55/79/359005579.db2.gz	FURUIBDRGJSQLO-CYBMUJFWSA-N	1	1	310.354	1.098	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602787579	359192187	/nfs/dbraw/zinc/19/21/87/359192187.db2.gz	ZOTXGDGPARUUSI-ZDUSSCGKSA-N	1	1	312.370	1.085	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000602718870	359146942	/nfs/dbraw/zinc/14/69/42/359146942.db2.gz	RNZCGOXHRKMXLB-CQSZACIVSA-N	1	1	302.334	1.982	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000602718870	359146946	/nfs/dbraw/zinc/14/69/46/359146946.db2.gz	RNZCGOXHRKMXLB-CQSZACIVSA-N	1	1	302.334	1.982	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2nccs2)CC1	ZINC000602760545	359171658	/nfs/dbraw/zinc/17/16/58/359171658.db2.gz	QSKUJULAKQOVJY-UHFFFAOYSA-N	1	1	322.394	1.378	20	5		DDBDMO
CO[C@@H]1C[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C12CCC2	ZINC000602839808	359228426	/nfs/dbraw/zinc/22/84/26/359228426.db2.gz	LWLCLUUFYHDRQI-CHWSQXEVSA-N	1	1	308.382	1.989	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141286	359430294	/nfs/dbraw/zinc/43/02/94/359430294.db2.gz	FCMBGUPMOWGMEX-NSHDSACASA-N	1	1	323.397	1.439	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141286	359430297	/nfs/dbraw/zinc/43/02/97/359430297.db2.gz	FCMBGUPMOWGMEX-NSHDSACASA-N	1	1	323.397	1.439	20	5		DDBDMO
Cn1c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)ccc1[N+](=O)[O-]	ZINC000603142474	359431268	/nfs/dbraw/zinc/43/12/68/359431268.db2.gz	MVMWJFKYMSUFJE-GFCCVEGCSA-N	1	1	308.382	1.736	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)c1[N+](=O)[O-]	ZINC000186807785	200014074	/nfs/dbraw/zinc/01/40/74/200014074.db2.gz	GMGTXXOWIQZLSR-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000187732796	200149796	/nfs/dbraw/zinc/14/97/96/200149796.db2.gz	LBLUBJXYIIUCEN-UHFFFAOYSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000187743253	200152034	/nfs/dbraw/zinc/15/20/34/200152034.db2.gz	SZKWSCAAEGVIMB-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000188502410	200257521	/nfs/dbraw/zinc/25/75/21/200257521.db2.gz	ZPBZKPYMBFLPMO-UHFFFAOYSA-N	1	1	310.310	1.637	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000188502410	200257522	/nfs/dbraw/zinc/25/75/22/200257522.db2.gz	ZPBZKPYMBFLPMO-UHFFFAOYSA-N	1	1	310.310	1.637	20	5		DDBDMO
[NH3+]CC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000237813445	202361164	/nfs/dbraw/zinc/36/11/64/202361164.db2.gz	TZYMHSQYXDESCN-UHFFFAOYSA-N	1	1	303.322	1.282	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1	ZINC000609257605	360277396	/nfs/dbraw/zinc/27/73/96/360277396.db2.gz	DPMJWPHMXFGZLZ-JTQLQIEISA-N	1	1	302.334	1.900	20	5		DDBDMO
COCCOCC[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000610570717	360472528	/nfs/dbraw/zinc/47/25/28/360472528.db2.gz	YUASHEVNCMLQDF-UHFFFAOYSA-N	1	1	323.393	1.375	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[N@H+]1C1CC1	ZINC000610654055	360492325	/nfs/dbraw/zinc/49/23/25/360492325.db2.gz	GVVMHBIWPJJXLJ-GHMZBOCLSA-N	1	1	321.381	1.268	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000610518579	360458559	/nfs/dbraw/zinc/45/85/59/360458559.db2.gz	RWQHPYJFOTZWLD-LLVKDONJSA-N	1	1	303.322	1.733	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000610900770	360567271	/nfs/dbraw/zinc/56/72/71/360567271.db2.gz	KOCOVPYYJXNYGU-TVQRCGJNSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000610900770	360567276	/nfs/dbraw/zinc/56/72/76/360567276.db2.gz	KOCOVPYYJXNYGU-TVQRCGJNSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000611033064	360607756	/nfs/dbraw/zinc/60/77/56/360607756.db2.gz	SWUBZSDIZPKKBX-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000611033064	360607759	/nfs/dbraw/zinc/60/77/59/360607759.db2.gz	SWUBZSDIZPKKBX-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000611256833	360681319	/nfs/dbraw/zinc/68/13/19/360681319.db2.gz	JCSZOHFHATYCQE-GHMZBOCLSA-N	1	1	306.366	1.483	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CNC1(CCO)CC[NH+](C)CC1	ZINC000565842898	304097853	/nfs/dbraw/zinc/09/78/53/304097853.db2.gz	IJVCRTVLODCGHU-UHFFFAOYSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c(F)cc1[N+](=O)[O-]	ZINC000292689341	223202480	/nfs/dbraw/zinc/20/24/80/223202480.db2.gz	RKWLPQWSIPODIZ-ZDUSSCGKSA-N	1	1	324.356	1.794	20	5		DDBDMO
C[C@H]1CC[NH2+]C[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000193407638	201048431	/nfs/dbraw/zinc/04/84/31/201048431.db2.gz	WSQAGDWVZYWXJI-WCBMZHEXSA-N	1	1	317.342	1.010	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000619578151	364071000	/nfs/dbraw/zinc/07/10/00/364071000.db2.gz	AZYZTKRUBVPFSB-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
CCOC(=O)c1ccnc(NCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000271817432	209240598	/nfs/dbraw/zinc/24/05/98/209240598.db2.gz	MYUYDSLZCDEISC-UHFFFAOYSA-N	1	1	320.349	1.840	20	5		DDBDMO
CC[N@@H+](CCCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000275433576	212329985	/nfs/dbraw/zinc/32/99/85/212329985.db2.gz	FSZFUDSDGWBQKM-UHFFFAOYSA-N	1	1	313.329	1.767	20	5		DDBDMO
C[N@@H+](CCCCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000349932666	284109358	/nfs/dbraw/zinc/10/93/58/284109358.db2.gz	FMLQGYGONXJKBA-UHFFFAOYSA-N	1	1	323.349	1.597	20	5		DDBDMO
C[N@@H+](CCNc1ncc([N+](=O)[O-])cc1C(N)=O)C1CCCC1	ZINC000264329109	203854100	/nfs/dbraw/zinc/85/41/00/203854100.db2.gz	WQWYFKPXMYBOBJ-UHFFFAOYSA-N	1	1	307.354	1.375	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000266271875	205228583	/nfs/dbraw/zinc/22/85/83/205228583.db2.gz	RIHRBFFGSWHSQL-GFCCVEGCSA-N	1	1	309.341	1.892	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288473196	220165020	/nfs/dbraw/zinc/16/50/20/220165020.db2.gz	QNIACTBUTYEIDS-GXSJLCMTSA-N	1	1	307.354	1.325	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000334084035	249209204	/nfs/dbraw/zinc/20/92/04/249209204.db2.gz	WDAMABMGWKCZLV-MNOVXSKESA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000284701860	218139866	/nfs/dbraw/zinc/13/98/66/218139866.db2.gz	IOQTTZRMKMIPQD-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000284701860	218139867	/nfs/dbraw/zinc/13/98/67/218139867.db2.gz	IOQTTZRMKMIPQD-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1	ZINC000338762166	250124748	/nfs/dbraw/zinc/12/47/48/250124748.db2.gz	LZQCQYCZMLCXRI-UHFFFAOYSA-N	1	1	309.370	1.081	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938473	251290106	/nfs/dbraw/zinc/29/01/06/251290106.db2.gz	WHOZVUHOZSRWBW-SKDRFNHKSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938473	251290108	/nfs/dbraw/zinc/29/01/08/251290108.db2.gz	WHOZVUHOZSRWBW-SKDRFNHKSA-N	1	1	304.306	1.600	20	5		DDBDMO
NC(=O)c1cccc(NC[C@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-]	ZINC000340924602	251279237	/nfs/dbraw/zinc/27/92/37/251279237.db2.gz	NSLGUBBRXRJXBY-SNVBAGLBSA-N	1	1	315.333	1.565	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341025437	251344627	/nfs/dbraw/zinc/34/46/27/251344627.db2.gz	JCNSXHOKDYJJTC-GXTWGEPZSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@H]1[NH3+]	ZINC000269175288	207296056	/nfs/dbraw/zinc/29/60/56/207296056.db2.gz	BMJWXEPDFSPFTO-LDYMZIIASA-N	1	1	303.322	1.280	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000302518616	532955050	/nfs/dbraw/zinc/95/50/50/532955050.db2.gz	HYEFVDOCLURBGN-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H]2OCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000567796289	304243024	/nfs/dbraw/zinc/24/30/24/304243024.db2.gz	PFMMQLCRDNWMDW-RISCZKNCSA-N	1	1	305.334	1.644	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]2OCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000567796289	304243026	/nfs/dbraw/zinc/24/30/26/304243026.db2.gz	PFMMQLCRDNWMDW-RISCZKNCSA-N	1	1	305.334	1.644	20	5		DDBDMO
Cc1ccc(N(C)CCCN2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000269975211	208027734	/nfs/dbraw/zinc/02/77/34/208027734.db2.gz	YSQHTESQLABVGX-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCn2cccn2)CC1	ZINC000264384244	285165982	/nfs/dbraw/zinc/16/59/82/285165982.db2.gz	ZDXMUWYSMKGFQA-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@H]1O	ZINC000352657094	285201182	/nfs/dbraw/zinc/20/11/82/285201182.db2.gz	FAMUJIGAQJNBMP-SGMGOOAPSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000121124448	195296150	/nfs/dbraw/zinc/29/61/50/195296150.db2.gz	WPZVXRQXTAEJLT-DOMZBBRYSA-N	1	1	321.377	1.772	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000451576905	533412833	/nfs/dbraw/zinc/41/28/33/533412833.db2.gz	VCDXAVXYBVYCHT-SMDDNHRTSA-N	1	1	307.350	1.890	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000451576905	533412836	/nfs/dbraw/zinc/41/28/36/533412836.db2.gz	VCDXAVXYBVYCHT-SMDDNHRTSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950690	533662222	/nfs/dbraw/zinc/66/22/22/533662222.db2.gz	HZBXNAMLXDEURZ-ONGXEEELSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950690	533662228	/nfs/dbraw/zinc/66/22/28/533662228.db2.gz	HZBXNAMLXDEURZ-ONGXEEELSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950690	533662233	/nfs/dbraw/zinc/66/22/33/533662233.db2.gz	HZBXNAMLXDEURZ-ONGXEEELSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950690	533662237	/nfs/dbraw/zinc/66/22/37/533662237.db2.gz	HZBXNAMLXDEURZ-ONGXEEELSA-N	1	1	307.354	1.325	20	5		DDBDMO
C[C@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1	ZINC000569115927	304336990	/nfs/dbraw/zinc/33/69/90/304336990.db2.gz	ARGXHVUPJIMMDD-CJNGLKHVSA-N	1	1	318.421	1.808	20	5		DDBDMO
COc1ccc(C[NH2+]Cc2ccnc(OC)n2)cc1[N+](=O)[O-]	ZINC000294682242	533675677	/nfs/dbraw/zinc/67/56/77/533675677.db2.gz	ACNDCTJIGHKJRW-UHFFFAOYSA-N	1	1	304.306	1.692	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000072064511	406873253	/nfs/dbraw/zinc/87/32/53/406873253.db2.gz	BPBNUZPXEYORQG-ZIAGYGMSSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000078639878	407037171	/nfs/dbraw/zinc/03/71/71/407037171.db2.gz	DFXLLUPQKHTNFG-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
COCCC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000067378311	407272265	/nfs/dbraw/zinc/27/22/65/407272265.db2.gz	SQEBOBXQAWEDOZ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C(N)=O)C(C)(C)C	ZINC000109331388	407397765	/nfs/dbraw/zinc/39/77/65/407397765.db2.gz	YURJKWJLLUUQOS-CYBMUJFWSA-N	1	1	322.365	1.331	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000112364055	407427350	/nfs/dbraw/zinc/42/73/50/407427350.db2.gz	MGHBACVZLOHPFP-UHFFFAOYSA-N	1	1	321.424	1.667	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000185706681	407482699	/nfs/dbraw/zinc/48/26/99/407482699.db2.gz	VSZXEHAUDPPJOV-GFCCVEGCSA-N	1	1	308.338	1.108	20	5		DDBDMO
C[N@H+]1CCN(CCn2ccc([N+](=O)[O-])n2)C2(CCCCC2)C1	ZINC000178402458	407445522	/nfs/dbraw/zinc/44/55/22/407445522.db2.gz	JCEBCWSTPCVKLU-UHFFFAOYSA-N	1	1	307.398	1.742	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000266550775	407554461	/nfs/dbraw/zinc/55/44/61/407554461.db2.gz	UFWJVXWCDUOWMF-LLVKDONJSA-N	1	1	324.333	1.477	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1C	ZINC000267000401	407710837	/nfs/dbraw/zinc/71/08/37/407710837.db2.gz	CTIGMPOTJVZJGK-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000133326897	407830312	/nfs/dbraw/zinc/83/03/12/407830312.db2.gz	BGMPYHBUFKTADF-RISCZKNCSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000133326897	407830317	/nfs/dbraw/zinc/83/03/17/407830317.db2.gz	BGMPYHBUFKTADF-RISCZKNCSA-N	1	1	322.365	1.113	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000118096607	407886021	/nfs/dbraw/zinc/88/60/21/407886021.db2.gz	FNUWSNJSUOELMG-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
Cc1c(NC(=O)C(=O)NC[C@@H]2CCC[N@@H+]2C)cccc1[N+](=O)[O-]	ZINC000118106458	407889500	/nfs/dbraw/zinc/88/95/00/407889500.db2.gz	TUJBYEUFCHRZBQ-NSHDSACASA-N	1	1	320.349	1.052	20	5		DDBDMO
CC[N@@H+](CCO)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000118835259	407950380	/nfs/dbraw/zinc/95/03/80/407950380.db2.gz	MMMDTXZAIMEFGG-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CC[N@@H+](CCNC(=O)NCCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000119009921	407977285	/nfs/dbraw/zinc/97/72/85/407977285.db2.gz	LIGQFHMLRCBSCX-UHFFFAOYSA-N	1	1	320.393	1.921	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000175150120	408064884	/nfs/dbraw/zinc/06/48/84/408064884.db2.gz	SZURXOXQQPIAOO-CQSZACIVSA-N	1	1	321.377	1.667	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000175150120	408064888	/nfs/dbraw/zinc/06/48/88/408064888.db2.gz	SZURXOXQQPIAOO-CQSZACIVSA-N	1	1	321.377	1.667	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000189636313	408070199	/nfs/dbraw/zinc/07/01/99/408070199.db2.gz	HVNWALKQKDPUCI-MRXNPFEDSA-N	1	1	321.377	1.795	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000175250772	408087940	/nfs/dbraw/zinc/08/79/40/408087940.db2.gz	UGQAPVYUGKRRDD-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000136253875	408092794	/nfs/dbraw/zinc/09/27/94/408092794.db2.gz	NLYGOXXKLVNOLB-DZGCQCFKSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1CO	ZINC000190440549	408245725	/nfs/dbraw/zinc/24/57/25/408245725.db2.gz	MYQNXVSWHMYHLY-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[C@H]1O	ZINC000246425160	408251049	/nfs/dbraw/zinc/25/10/49/408251049.db2.gz	IIQRPQSOFIXUDC-DUVNUKRYSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000246607390	408300338	/nfs/dbraw/zinc/30/03/38/408300338.db2.gz	BYZPLROHNFPBLI-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000246607390	408300342	/nfs/dbraw/zinc/30/03/42/408300342.db2.gz	BYZPLROHNFPBLI-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269631597	408369024	/nfs/dbraw/zinc/36/90/24/408369024.db2.gz	FWXWSESOKRYCRB-FZMZJTMJSA-N	1	1	307.350	1.216	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000247340709	408455208	/nfs/dbraw/zinc/45/52/08/408455208.db2.gz	JFAWDLMMMDJZQS-IUODEOHRSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCN1CCOCC1	ZINC000264292792	408430037	/nfs/dbraw/zinc/43/00/37/408430037.db2.gz	QDWPZGYUCZWKHB-UHFFFAOYSA-N	1	1	309.366	1.238	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1	ZINC000247707399	408503911	/nfs/dbraw/zinc/50/39/11/408503911.db2.gz	ZHBOBZRHYAULQB-JKSUJKDBSA-N	1	1	320.393	1.975	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000248584176	408592794	/nfs/dbraw/zinc/59/27/94/408592794.db2.gz	QQHCYTHPSTUFMN-SGMGOOAPSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@H]21	ZINC000248130201	408537646	/nfs/dbraw/zinc/53/76/46/408537646.db2.gz	OJFLDAZPXYRQNP-DGCLKSJQSA-N	1	1	318.377	1.733	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000177426345	408614074	/nfs/dbraw/zinc/61/40/74/408614074.db2.gz	FVKIOIVZSOOQPS-OAHLLOKOSA-N	1	1	321.333	1.079	20	5		DDBDMO
Cc1ccnc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000275628867	408625626	/nfs/dbraw/zinc/62/56/26/408625626.db2.gz	VQNLXHXGHZKLOH-GFCCVEGCSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000161817725	408642998	/nfs/dbraw/zinc/64/29/98/408642998.db2.gz	BAAQAKIDVUIQEN-JTQLQIEISA-N	1	1	307.354	1.407	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000265612251	408713876	/nfs/dbraw/zinc/71/38/76/408713876.db2.gz	XFWGKTAISRHZCV-SNVBAGLBSA-N	1	1	311.769	1.859	20	5		DDBDMO
C[C@H](CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1	ZINC000251690512	408784028	/nfs/dbraw/zinc/78/40/28/408784028.db2.gz	OYBWMSRIWBFEHZ-GHMZBOCLSA-N	1	1	322.365	1.546	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001177	408754816	/nfs/dbraw/zinc/75/48/16/408754816.db2.gz	BQXDVDZVXPOLJA-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001177	408754821	/nfs/dbraw/zinc/75/48/21/408754821.db2.gz	BQXDVDZVXPOLJA-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001177	408754827	/nfs/dbraw/zinc/75/48/27/408754827.db2.gz	BQXDVDZVXPOLJA-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000281842914	408939974	/nfs/dbraw/zinc/93/99/74/408939974.db2.gz	YPJZGIBJCQSNMP-GWCFXTLKSA-N	1	1	307.350	1.693	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000231553476	163349536	/nfs/dbraw/zinc/34/95/36/163349536.db2.gz	RWIVUFKVNOXFGD-JTQLQIEISA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000231553476	163349537	/nfs/dbraw/zinc/34/95/37/163349537.db2.gz	RWIVUFKVNOXFGD-JTQLQIEISA-N	1	1	313.379	1.504	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)c1ccc(N)cc1[N+](=O)[O-]	ZINC000287907177	409112894	/nfs/dbraw/zinc/11/28/94/409112894.db2.gz	VRSVRQCBMNYUQI-UHFFFAOYSA-N	1	1	308.382	1.724	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)c1ccc(N)cc1[N+](=O)[O-]	ZINC000287907177	409112898	/nfs/dbraw/zinc/11/28/98/409112898.db2.gz	VRSVRQCBMNYUQI-UHFFFAOYSA-N	1	1	308.382	1.724	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1NC	ZINC000317055392	164025551	/nfs/dbraw/zinc/02/55/51/164025551.db2.gz	HPAACSPRULOOBT-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H]1c1ccccc1	ZINC000285492495	409465483	/nfs/dbraw/zinc/46/54/83/409465483.db2.gz	AMVVQRPHEXNCQG-FZMZJTMJSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408075845	164220217	/nfs/dbraw/zinc/22/02/17/164220217.db2.gz	ZYLWWTSLUVZGDQ-NXEZZACHSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408075845	164220218	/nfs/dbraw/zinc/22/02/18/164220218.db2.gz	ZYLWWTSLUVZGDQ-NXEZZACHSA-N	1	1	317.349	1.636	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1	ZINC000356834996	409646058	/nfs/dbraw/zinc/64/60/58/409646058.db2.gz	BYWYKLKPYZOIHW-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1	ZINC000356834996	409646062	/nfs/dbraw/zinc/64/60/62/409646062.db2.gz	BYWYKLKPYZOIHW-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2c([N+](=O)[O-])ncn2C)CC1	ZINC000342822151	409927020	/nfs/dbraw/zinc/92/70/20/409927020.db2.gz	QQGLRTDUZREDNW-GFCCVEGCSA-N	1	1	310.402	1.014	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338350927	409929959	/nfs/dbraw/zinc/92/99/59/409929959.db2.gz	QOEIPPCGBKQGSS-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCOC[C@H]1C	ZINC000297929879	410050729	/nfs/dbraw/zinc/05/07/29/410050729.db2.gz	RCTCQSDATWFAFU-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@H]1C	ZINC000297929879	410050735	/nfs/dbraw/zinc/05/07/35/410050735.db2.gz	RCTCQSDATWFAFU-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@H]1C[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357513641	410079426	/nfs/dbraw/zinc/07/94/26/410079426.db2.gz	NPRREUVXTCNYLQ-IUCAKERBSA-N	1	1	305.338	1.126	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000357682297	410186700	/nfs/dbraw/zinc/18/67/00/410186700.db2.gz	KERITXAMEGWMQK-MWLCHTKSSA-N	1	1	308.338	1.671	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000357701776	410195556	/nfs/dbraw/zinc/19/55/56/410195556.db2.gz	XSIILHYNWIWGGS-KOLCDFICSA-N	1	1	308.338	1.671	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@@H](O)C1	ZINC000351787263	410236826	/nfs/dbraw/zinc/23/68/26/410236826.db2.gz	YTGXOEZMEGSNIZ-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)[C@H](O)C1	ZINC000351776429	410223825	/nfs/dbraw/zinc/22/38/25/410223825.db2.gz	BAXXJDIMACJHPG-ZWNOBZJWSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@H](C)CO	ZINC000339629575	410343493	/nfs/dbraw/zinc/34/34/93/410343493.db2.gz	LWOBCUCYKHOXDK-LLVKDONJSA-N	1	1	323.349	1.596	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000298730974	410369098	/nfs/dbraw/zinc/36/90/98/410369098.db2.gz	SEKVNJQCBGUXCF-VXGBXAGGSA-N	1	1	305.338	1.127	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298776352	410392687	/nfs/dbraw/zinc/39/26/87/410392687.db2.gz	DIIBZXMFQSDFJR-GHMZBOCLSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298776352	410392691	/nfs/dbraw/zinc/39/26/91/410392691.db2.gz	DIIBZXMFQSDFJR-GHMZBOCLSA-N	1	1	321.333	1.417	20	5		DDBDMO
CC(C)c1ccc(CNC[C@@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358171263	410393482	/nfs/dbraw/zinc/39/34/82/410393482.db2.gz	SALFKUPAKSHJIU-INIZCTEOSA-N	1	1	307.394	1.874	20	5		DDBDMO
CC(C)c1ccc(C[NH2+]C[C@@]2(O)CCN(C)C2)cc1[N+](=O)[O-]	ZINC000358171263	410393484	/nfs/dbraw/zinc/39/34/84/410393484.db2.gz	SALFKUPAKSHJIU-INIZCTEOSA-N	1	1	307.394	1.874	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCOC[C@H]2CC2CCC2)c1	ZINC000339781494	410455943	/nfs/dbraw/zinc/45/59/43/410455943.db2.gz	YDYPPRRCIMALAK-UKRRQHHQSA-N	1	1	324.381	1.043	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN2C(=O)NC[C@@H]2C1	ZINC000347354527	410493218	/nfs/dbraw/zinc/49/32/18/410493218.db2.gz	BRXKZFUUVMRSGX-WASHYIJTSA-N	1	1	316.361	1.708	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCN2C(=O)NC[C@@H]2C1	ZINC000347354527	410493221	/nfs/dbraw/zinc/49/32/21/410493221.db2.gz	BRXKZFUUVMRSGX-WASHYIJTSA-N	1	1	316.361	1.708	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000352186867	410534747	/nfs/dbraw/zinc/53/47/47/410534747.db2.gz	OJQDLPLIFVPMMG-ZIAGYGMSSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352570320	410665215	/nfs/dbraw/zinc/66/52/15/410665215.db2.gz	FXWNAMSRGQLEBP-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1OC[C@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000340168600	410721125	/nfs/dbraw/zinc/72/11/25/410721125.db2.gz	SWJKQYHOQIVWLN-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1OC[C@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000340168600	410721133	/nfs/dbraw/zinc/72/11/33/410721133.db2.gz	SWJKQYHOQIVWLN-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000359628578	410779596	/nfs/dbraw/zinc/77/95/96/410779596.db2.gz	ZWEIFGDOUWLELL-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
Cc1cc(N2CCC[C@H]2C[N@H+]2CCC[C@@H]2CO)ncc1[N+](=O)[O-]	ZINC000301591954	410750364	/nfs/dbraw/zinc/75/03/64/410750364.db2.gz	YMBUURHMBHKJCR-UONOGXRCSA-N	1	1	320.393	1.724	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000330612440	410827048	/nfs/dbraw/zinc/82/70/48/410827048.db2.gz	QVYINUJPTYCPJK-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302389626	410844547	/nfs/dbraw/zinc/84/45/47/410844547.db2.gz	IAQXHKNQJDIXJH-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000348223779	410863884	/nfs/dbraw/zinc/86/38/84/410863884.db2.gz	XWZSPPVRKZHZMH-AWEZNQCLSA-N	1	1	318.377	1.362	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356442882	411033329	/nfs/dbraw/zinc/03/33/29/411033329.db2.gz	DLHZDIHSQJDHJD-LBPRGKRZSA-N	1	1	323.397	1.713	20	5		DDBDMO
Cn1ccnc1[C@@H](NCC[NH+]1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000353649618	411098953	/nfs/dbraw/zinc/09/89/53/411098953.db2.gz	YJWKPGVHERFRHF-HNNXBMFYSA-N	1	1	315.377	1.713	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000373742219	418455229	/nfs/dbraw/zinc/45/52/29/418455229.db2.gz	OPLAMDZBEDBQRD-LBPRGKRZSA-N	1	1	311.357	1.622	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C1	ZINC000360536604	418458275	/nfs/dbraw/zinc/45/82/75/418458275.db2.gz	LDIRKRFIELDXBU-LBPRGKRZSA-N	1	1	322.365	1.040	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000366628412	418498813	/nfs/dbraw/zinc/49/88/13/418498813.db2.gz	MULLPXMSJSHVIJ-OAHLLOKOSA-N	1	1	321.377	1.510	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC[NH2+]C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000212603901	418558817	/nfs/dbraw/zinc/55/88/17/418558817.db2.gz	GSKWVGVEOMLUSA-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000291184661	222204390	/nfs/dbraw/zinc/20/43/90/222204390.db2.gz	SEPJGWMHDGYBAX-SNVBAGLBSA-N	1	1	309.370	1.621	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)OC)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000291312703	222306442	/nfs/dbraw/zinc/30/64/42/222306442.db2.gz	TWUHCQHEWCQJPF-OLZOCXBDSA-N	1	1	312.366	1.691	20	5		DDBDMO
CC[N@@H+]1CC[C@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1	ZINC000389251102	418749263	/nfs/dbraw/zinc/74/92/63/418749263.db2.gz	BMWJIOODOBVWJS-JTQLQIEISA-N	1	1	313.379	1.504	20	5		DDBDMO
CC[N@H+]1CC[C@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1	ZINC000389251102	418749266	/nfs/dbraw/zinc/74/92/66/418749266.db2.gz	BMWJIOODOBVWJS-JTQLQIEISA-N	1	1	313.379	1.504	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](O)C3(CC3)C2)c([N+](=O)[O-])c1	ZINC000372300009	418853299	/nfs/dbraw/zinc/85/32/99/418853299.db2.gz	FUKUICNZNQNVDF-CQSZACIVSA-N	1	1	308.334	1.439	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@@H]12	ZINC000365655250	418890449	/nfs/dbraw/zinc/89/04/49/418890449.db2.gz	IHTQXHIZRLQKBK-SVDKCWMDSA-N	1	1	301.346	1.676	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1	ZINC000372155911	418840405	/nfs/dbraw/zinc/84/04/05/418840405.db2.gz	HVBCRMVCOPUPMB-TZMCWYRMSA-N	1	1	319.361	1.552	20	5		DDBDMO
C[C@H]1[C@@H](CO)CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091199	419648543	/nfs/dbraw/zinc/64/85/43/419648543.db2.gz	QOUIBIVHRKSJPV-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1[C@@H](CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091199	419648547	/nfs/dbraw/zinc/64/85/47/419648547.db2.gz	QOUIBIVHRKSJPV-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC000431952682	229069991	/nfs/dbraw/zinc/06/99/91/229069991.db2.gz	GUOLFTFAQZWNDD-UHFFFAOYSA-N	1	1	309.366	1.738	20	5		DDBDMO
COc1cccc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000435871607	420290447	/nfs/dbraw/zinc/29/04/47/420290447.db2.gz	UCKPNRVQGZRRHH-GFCCVEGCSA-N	1	1	319.361	1.912	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000302368101	230224383	/nfs/dbraw/zinc/22/43/83/230224383.db2.gz	DSIOHCGWYDUATR-LBPRGKRZSA-N	1	1	309.366	1.244	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000450952765	420567976	/nfs/dbraw/zinc/56/79/76/420567976.db2.gz	IZHGPEZCRNHPNK-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000493153067	420770787	/nfs/dbraw/zinc/77/07/87/420770787.db2.gz	BFQBXIWOCWCFPM-XQRVVYSFSA-N	1	1	307.325	1.956	20	5		DDBDMO
O=C1[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C[C@H]2CCCCN12	ZINC000453628719	420739163	/nfs/dbraw/zinc/73/91/63/420739163.db2.gz	NOBLTICRJVPHLS-RISCZKNCSA-N	1	1	307.325	1.977	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000487948940	421060109	/nfs/dbraw/zinc/06/01/09/421060109.db2.gz	MYWBOJQSNDAASZ-GXTWGEPZSA-N	1	1	305.378	1.793	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000456004535	421086457	/nfs/dbraw/zinc/08/64/57/421086457.db2.gz	KFHPDFKRXZZABD-JTQLQIEISA-N	1	1	319.365	1.412	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000488724933	421107538	/nfs/dbraw/zinc/10/75/38/421107538.db2.gz	AXHIHJCOCBBSEZ-MNOVXSKESA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CC[N@H+](C(C)C)C1	ZINC000522811422	421225912	/nfs/dbraw/zinc/22/59/12/421225912.db2.gz	PSESOKQFMBMGOS-CYBMUJFWSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[C@@H]1CN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000555220788	421672476	/nfs/dbraw/zinc/67/24/76/421672476.db2.gz	GSNUILUNCJHFRI-AOOOYVTPSA-N	1	1	317.349	1.772	20	5		DDBDMO
C[N@@H+]1CCCC[C@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000586802185	422313610	/nfs/dbraw/zinc/31/36/10/422313610.db2.gz	OFIDMYLTYQQOAH-LBPRGKRZSA-N	1	1	303.322	1.894	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000586802185	422313615	/nfs/dbraw/zinc/31/36/15/422313615.db2.gz	OFIDMYLTYQQOAH-LBPRGKRZSA-N	1	1	303.322	1.894	20	5		DDBDMO
Nc1ccc(N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)nc1[N+](=O)[O-]	ZINC000596163548	422369183	/nfs/dbraw/zinc/36/91/83/422369183.db2.gz	WSDBATKSDYJRSP-CHWSQXEVSA-N	1	1	321.381	1.627	20	5		DDBDMO
NC1(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CCOCC1	ZINC000600712336	422411872	/nfs/dbraw/zinc/41/18/72/422411872.db2.gz	WWNDUXYYXMNSHK-QWHCGFSZSA-N	1	1	323.397	1.373	20	5		DDBDMO
NC1(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CCOCC1	ZINC000600712335	422412263	/nfs/dbraw/zinc/41/22/63/422412263.db2.gz	WWNDUXYYXMNSHK-OLZOCXBDSA-N	1	1	323.397	1.373	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000578156814	422511946	/nfs/dbraw/zinc/51/19/46/422511946.db2.gz	GVBAQEPXBSEVIS-HNNXBMFYSA-N	1	1	312.329	1.777	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCS1	ZINC000076066449	263328815	/nfs/dbraw/zinc/32/88/15/263328815.db2.gz	DKFYHXZEQKVNIN-STQMWFEESA-N	1	1	314.411	1.226	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000183951681	263383597	/nfs/dbraw/zinc/38/35/97/263383597.db2.gz	URFAOCUKTSOITI-VOTSOKGWSA-N	1	1	307.350	1.038	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@]3(CC[N@@H+](C)C3)C2)n1	ZINC000292364794	274004799	/nfs/dbraw/zinc/00/47/99/274004799.db2.gz	ROSAVQBQLCGLEG-OAHLLOKOSA-N	1	1	320.349	1.308	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1	ZINC000413481863	274017186	/nfs/dbraw/zinc/01/71/86/274017186.db2.gz	UQSJJLFXHDYNRK-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[NH+](CCCO)CC1)CCN2	ZINC000275316221	275038652	/nfs/dbraw/zinc/03/86/52/275038652.db2.gz	CTZXUOYLLRUFAQ-UHFFFAOYSA-N	1	1	306.366	1.067	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CCC[N@H+](CCO)CC3)ccnc21	ZINC000322142236	275039599	/nfs/dbraw/zinc/03/95/99/275039599.db2.gz	JWJFTVOFNUMLNN-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000331216886	276041843	/nfs/dbraw/zinc/04/18/43/276041843.db2.gz	PVNYOXLRRUJJDD-UWVGGRQHSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1	ZINC000173898521	276204870	/nfs/dbraw/zinc/20/48/70/276204870.db2.gz	BFXNMSWAUWAYDA-CQSZACIVSA-N	1	1	307.350	1.274	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1	ZINC000173898521	276204871	/nfs/dbraw/zinc/20/48/71/276204871.db2.gz	BFXNMSWAUWAYDA-CQSZACIVSA-N	1	1	307.350	1.274	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](c1ccco1)[NH+](C)C	ZINC000055171827	280897877	/nfs/dbraw/zinc/89/78/77/280897877.db2.gz	AZBFQMIFQAAOQM-CYBMUJFWSA-N	1	1	318.333	1.924	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932451	281030031	/nfs/dbraw/zinc/03/00/31/281030031.db2.gz	JHGMMIAMAZEULC-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932451	281030033	/nfs/dbraw/zinc/03/00/33/281030033.db2.gz	JHGMMIAMAZEULC-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000330577755	281261191	/nfs/dbraw/zinc/26/11/91/281261191.db2.gz	HBNUTEZEANYGQL-CHWSQXEVSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@H](c1ccccc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246630560	282003160	/nfs/dbraw/zinc/00/31/60/282003160.db2.gz	AWSBLIBGLYVMAC-IUODEOHRSA-N	1	1	304.350	1.845	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1CCOC1	ZINC000247212246	282038703	/nfs/dbraw/zinc/03/87/03/282038703.db2.gz	XZCLADODYOWOBH-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3cccc(C(N)=O)c3[N+](=O)[O-])[C@@H]2C1	ZINC000425283445	290281263	/nfs/dbraw/zinc/28/12/63/290281263.db2.gz	LWUOLHGQSQCRGW-GXFFZTMASA-N	1	1	304.350	1.224	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000354004237	298335932	/nfs/dbraw/zinc/33/59/32/298335932.db2.gz	AVVLAZXEDVEDSC-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000368578522	301056432	/nfs/dbraw/zinc/05/64/32/301056432.db2.gz	NXAYONWCSCISKM-SNVBAGLBSA-N	1	1	321.333	1.159	20	5		DDBDMO
CC(C)OC[C@H](O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012203	301119723	/nfs/dbraw/zinc/11/97/23/301119723.db2.gz	UMXJYJZBBXLXBR-GXTWGEPZSA-N	1	1	312.370	1.214	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000369535741	301195954	/nfs/dbraw/zinc/19/59/54/301195954.db2.gz	CDAZQCPDSRIJDA-HIFRSBDPSA-N	1	1	324.381	1.451	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)n1	ZINC000408028731	301204609	/nfs/dbraw/zinc/20/46/09/301204609.db2.gz	FMMSCEYJTUAKGG-CHWSQXEVSA-N	1	1	306.366	1.516	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000376743409	302095849	/nfs/dbraw/zinc/09/58/49/302095849.db2.gz	VJIPOTQFYRPVBQ-UHFFFAOYSA-N	1	1	304.354	1.983	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000537598611	303375410	/nfs/dbraw/zinc/37/54/10/303375410.db2.gz	OKDKOLQQSGPOCL-LLVKDONJSA-N	1	1	311.769	1.859	20	5		DDBDMO
COc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000357661763	306904172	/nfs/dbraw/zinc/90/41/72/306904172.db2.gz	IANGVVBRPOZNSY-UHFFFAOYSA-N	1	1	303.322	1.653	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000362394290	307020766	/nfs/dbraw/zinc/02/07/66/307020766.db2.gz	CDKPKVFWHYTGSH-LLVKDONJSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](C2CCCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000362394290	307020767	/nfs/dbraw/zinc/02/07/67/307020767.db2.gz	CDKPKVFWHYTGSH-LLVKDONJSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000362394290	307020768	/nfs/dbraw/zinc/02/07/68/307020768.db2.gz	CDKPKVFWHYTGSH-LLVKDONJSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000377583437	307273624	/nfs/dbraw/zinc/27/36/24/307273624.db2.gz	HWCIOCXYQZQPCB-FYJFLYSWSA-N	1	1	311.288	1.674	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)C[C@@H]1CCn2ccnc2C1	ZINC000377642080	307275388	/nfs/dbraw/zinc/27/53/88/307275388.db2.gz	ATLWESPPBDKBTQ-LLVKDONJSA-N	1	1	304.354	1.219	20	5		DDBDMO
C[N@@H+](CCCCCO)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000434682856	307304142	/nfs/dbraw/zinc/30/41/42/307304142.db2.gz	BGKVUGTYPHSPOR-HNNXBMFYSA-N	1	1	321.377	1.795	20	5		DDBDMO
O=C1NCC[C@@]12CCC[N@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000575427384	308277158	/nfs/dbraw/zinc/27/71/58/308277158.db2.gz	PYOCWAIRKBMDRX-HNNXBMFYSA-N	1	1	305.334	1.328	20	5		DDBDMO
O=C1NCC[C@@]12CCC[N@@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000575427384	308277159	/nfs/dbraw/zinc/27/71/59/308277159.db2.gz	PYOCWAIRKBMDRX-HNNXBMFYSA-N	1	1	305.334	1.328	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](c3cccnc3)C2)c1	ZINC000582724547	337125709	/nfs/dbraw/zinc/12/57/09/337125709.db2.gz	ZVZXYFQCZZVFDK-DZGCQCFKSA-N	1	1	317.349	1.037	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCC(=O)N(C)C1	ZINC000584448322	337339000	/nfs/dbraw/zinc/33/90/00/337339000.db2.gz	NFDPFSMZUKRPEP-CYBMUJFWSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H]1CCC(=O)N(C)C1	ZINC000584448322	337339001	/nfs/dbraw/zinc/33/90/01/337339001.db2.gz	NFDPFSMZUKRPEP-CYBMUJFWSA-N	1	1	307.350	1.656	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000433165941	528025392	/nfs/dbraw/zinc/02/53/92/528025392.db2.gz	JGCJBLGHAHMGIU-AWEZNQCLSA-N	1	1	312.366	1.691	20	5		DDBDMO
CC1=CC[N@@H+](CCNc2ncc([N+](=O)[O-])cc2C(N)=O)CC1	ZINC000302175985	528120737	/nfs/dbraw/zinc/12/07/37/528120737.db2.gz	WGQNLDRMEJZEGN-UHFFFAOYSA-N	1	1	305.338	1.153	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1	ZINC000457727080	528984250	/nfs/dbraw/zinc/98/42/50/528984250.db2.gz	SFFPKXFXHDIYED-UHFFFAOYSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000820668798	599590635	/nfs/dbraw/zinc/59/06/35/599590635.db2.gz	WOKYVNOMPPLBJS-ONGXEEELSA-N	1	1	317.353	1.670	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000119739419	696684942	/nfs/dbraw/zinc/68/49/42/696684942.db2.gz	ITVIGVXZEHJRRF-SECBINFHSA-N	1	1	319.408	1.276	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC000153538678	696916816	/nfs/dbraw/zinc/91/68/16/696916816.db2.gz	XBESYVHINLJIHS-NSHDSACASA-N	1	1	322.321	1.669	20	5		DDBDMO
Cc1cccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC000983649684	697286389	/nfs/dbraw/zinc/28/63/89/697286389.db2.gz	QIMDENWXVLOHJS-KLHDSHLOSA-N	1	1	317.389	1.645	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000177215357	697411190	/nfs/dbraw/zinc/41/11/90/697411190.db2.gz	HVKRNRHHHKUJDP-HNNXBMFYSA-N	1	1	318.333	1.787	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1CCO[C@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000775577632	698011454	/nfs/dbraw/zinc/01/14/54/698011454.db2.gz	QEKFTLUOSJBKQD-VXGBXAGGSA-N	1	1	307.350	1.493	20	5		DDBDMO
C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)C(F)(F)F	ZINC000776604709	698125944	/nfs/dbraw/zinc/12/59/44/698125944.db2.gz	FDFSJJPFMMKITK-WDEREUQCSA-N	1	1	308.256	1.483	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)C(F)(F)F	ZINC000776604709	698125945	/nfs/dbraw/zinc/12/59/45/698125945.db2.gz	FDFSJJPFMMKITK-WDEREUQCSA-N	1	1	308.256	1.483	20	5		DDBDMO
Cc1nn(CN2CC[NH+](Cc3cccs3)CC2)cc1[N+](=O)[O-]	ZINC000779860190	698476536	/nfs/dbraw/zinc/47/65/36/698476536.db2.gz	UTLDGGAVQBLHQK-UHFFFAOYSA-N	1	1	321.406	1.937	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](CCO)C2CCOCC2)cc1	ZINC000781983005	698669266	/nfs/dbraw/zinc/66/92/66/698669266.db2.gz	QJDLONHGJXORFS-HNNXBMFYSA-N	1	1	310.350	1.102	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1CCO	ZINC000783680862	698867665	/nfs/dbraw/zinc/86/76/65/698867665.db2.gz	WLDUEAYRDZQGQX-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000787328293	699206097	/nfs/dbraw/zinc/20/60/97/699206097.db2.gz	QKQBRDZKFRECBF-ZLKJLUDKSA-N	1	1	308.334	1.512	20	5		DDBDMO
C[C@@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])S(C)(=O)=O	ZINC000704906191	699238550	/nfs/dbraw/zinc/23/85/50/699238550.db2.gz	HMTQHGGTGJYSRU-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)CN1	ZINC000789767331	699407272	/nfs/dbraw/zinc/40/72/72/699407272.db2.gz	IHYQQYABKMQJGI-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000741156996	699818565	/nfs/dbraw/zinc/81/85/65/699818565.db2.gz	OBCQDEBKESILPH-ZDUSSCGKSA-N	1	1	316.741	1.604	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000741156996	699818567	/nfs/dbraw/zinc/81/85/67/699818567.db2.gz	OBCQDEBKESILPH-ZDUSSCGKSA-N	1	1	316.741	1.604	20	5		DDBDMO
Cc1cc(F)cc(C(=O)NC[C@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000753452822	700435198	/nfs/dbraw/zinc/43/51/98/700435198.db2.gz	OJXAWRVWGOMSDM-LBPRGKRZSA-N	1	1	324.356	1.018	20	5		DDBDMO
Cc1cc(F)cc(C(=O)NC[C@H]2C[N@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000753452822	700435200	/nfs/dbraw/zinc/43/52/00/700435200.db2.gz	OJXAWRVWGOMSDM-LBPRGKRZSA-N	1	1	324.356	1.018	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000761066246	700837841	/nfs/dbraw/zinc/83/78/41/700837841.db2.gz	BFAHBINMVXCTCI-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000761066246	700837842	/nfs/dbraw/zinc/83/78/42/700837842.db2.gz	BFAHBINMVXCTCI-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000761066246	700837844	/nfs/dbraw/zinc/83/78/44/700837844.db2.gz	BFAHBINMVXCTCI-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839636457	701761705	/nfs/dbraw/zinc/76/17/05/701761705.db2.gz	SJTBTCKHEMACLK-JSGCOSHPSA-N	1	1	307.350	1.038	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1	ZINC000879214392	706616852	/nfs/dbraw/zinc/61/68/52/706616852.db2.gz	QSVROAPUFFUICX-NWDGAFQWSA-N	1	1	319.365	1.278	20	5		DDBDMO
C[C@@H]1CSCCN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867927796	701835188	/nfs/dbraw/zinc/83/51/88/701835188.db2.gz	OMWUBFXVHLOEEN-YGRLFVJLSA-N	1	1	309.391	1.733	20	5		DDBDMO
C[N@H+](CC1CC1)CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839969361	701883483	/nfs/dbraw/zinc/88/34/83/701883483.db2.gz	OARUWVOBJLCVNS-OAHLLOKOSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[N@@H+](CC1CC1)CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839969361	701883489	/nfs/dbraw/zinc/88/34/89/701883489.db2.gz	OARUWVOBJLCVNS-OAHLLOKOSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000868075533	701927202	/nfs/dbraw/zinc/92/72/02/701927202.db2.gz	KXLFDLNUDGUOPQ-ZFWWWQNUSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCOC(=O)Cn1cc([N+](=O)[O-])ccc1=O	ZINC000840218223	702032670	/nfs/dbraw/zinc/03/26/70/702032670.db2.gz	CBAKMWCWASWULI-LBPRGKRZSA-N	1	1	323.349	1.174	20	5		DDBDMO
CC[N@@H+](Cn1nc(C)c2cc([N+](=O)[O-])cnc21)[C@H]1CCOC1	ZINC000812297270	702140764	/nfs/dbraw/zinc/14/07/64/702140764.db2.gz	WQXTXTHDIPRSAG-NSHDSACASA-N	1	1	305.338	1.716	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1CC[N@@H+](C)C1	ZINC000843990265	702949833	/nfs/dbraw/zinc/94/98/33/702949833.db2.gz	SSRVTIFMSFBWKJ-SNVBAGLBSA-N	1	1	307.354	1.128	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000844020773	702956632	/nfs/dbraw/zinc/95/66/32/702956632.db2.gz	FYWPJYNGOCEOLG-TXEJJXNPSA-N	1	1	322.365	1.171	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000844020773	702956633	/nfs/dbraw/zinc/95/66/33/702956633.db2.gz	FYWPJYNGOCEOLG-TXEJJXNPSA-N	1	1	322.365	1.171	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000879576438	706724775	/nfs/dbraw/zinc/72/47/75/706724775.db2.gz	SCGJMWIDCQPDKF-JSGCOSHPSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+](CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@H]1CCOC1	ZINC000848478691	703555030	/nfs/dbraw/zinc/55/50/30/703555030.db2.gz	QURMULKENIFCHM-LSDHHAIUSA-N	1	1	319.361	1.589	20	5		DDBDMO
C[N@@H+](CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@H]1CCOC1	ZINC000848478691	703555031	/nfs/dbraw/zinc/55/50/31/703555031.db2.gz	QURMULKENIFCHM-LSDHHAIUSA-N	1	1	319.361	1.589	20	5		DDBDMO
CC1(C)OC[C@H](C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)O1	ZINC000851730106	703839421	/nfs/dbraw/zinc/83/94/21/703839421.db2.gz	VDPWQPDIXBHEGK-HNNXBMFYSA-N	1	1	321.377	1.868	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H]2CC[N@@H+](CC(C)(C)O)C2)cc1[N+](=O)[O-]	ZINC000869785079	703852854	/nfs/dbraw/zinc/85/28/54/703852854.db2.gz	BGNAHSQZFHAZQV-ZDUSSCGKSA-N	1	1	321.377	1.478	20	5		DDBDMO
O=C1NCC2(CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)O1	ZINC000851967866	703893231	/nfs/dbraw/zinc/89/32/31/703893231.db2.gz	OOPTTXAPOWMVBR-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC2=C(CCC(=O)N2)C1	ZINC000852296560	704000203	/nfs/dbraw/zinc/00/02/03/704000203.db2.gz	XPKGFQVSDJFYPU-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC2=C(CCC(=O)N2)C1	ZINC000852296560	704000207	/nfs/dbraw/zinc/00/02/07/704000207.db2.gz	XPKGFQVSDJFYPU-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-]	ZINC000852437700	704048574	/nfs/dbraw/zinc/04/85/74/704048574.db2.gz	FPWBONWPEWWPNH-GFCCVEGCSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-]	ZINC000852437700	704048575	/nfs/dbraw/zinc/04/85/75/704048575.db2.gz	FPWBONWPEWWPNH-GFCCVEGCSA-N	1	1	321.333	1.630	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000852495437	704062204	/nfs/dbraw/zinc/06/22/04/704062204.db2.gz	KXFFXVZGFSMXHA-BPLDGKMQSA-N	1	1	319.361	1.229	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000852569053	704076994	/nfs/dbraw/zinc/07/69/94/704076994.db2.gz	AKKSLMLRDSBZES-ZDUSSCGKSA-N	1	1	311.338	1.258	20	5		DDBDMO
C[C@H](C[C@H]1CCCC[N@H+]1C)OC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000870789998	704133003	/nfs/dbraw/zinc/13/30/03/704133003.db2.gz	LXJYCTUEUGYULM-VXGBXAGGSA-N	1	1	310.354	1.597	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3ccc([N+](=O)[O-])c4nonc43)[C@@H]2C1	ZINC000819953182	704192059	/nfs/dbraw/zinc/19/20/59/704192059.db2.gz	LFTLDJNSWFBKAG-JOYOIKCWSA-N	1	1	303.322	1.661	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@H]2COCCO2)c2ccc([N+](=O)[O-])cc12	ZINC000853559586	704269799	/nfs/dbraw/zinc/26/97/99/704269799.db2.gz	ZRYCSAWTVAASGR-ZDUSSCGKSA-N	1	1	320.349	1.558	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@H]2COCCO2)c2ccc([N+](=O)[O-])cc12	ZINC000853559586	704269802	/nfs/dbraw/zinc/26/98/02/704269802.db2.gz	ZRYCSAWTVAASGR-ZDUSSCGKSA-N	1	1	320.349	1.558	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@](C)(O)c1ccccc1	ZINC000823592240	705274911	/nfs/dbraw/zinc/27/49/11/705274911.db2.gz	QLZAVHRHJOJNME-HNNXBMFYSA-N	1	1	304.350	1.631	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000823921355	705340002	/nfs/dbraw/zinc/34/00/02/705340002.db2.gz	SYKUTGBXWHAQEH-NSHDSACASA-N	1	1	307.354	1.783	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000823973428	705348351	/nfs/dbraw/zinc/34/83/51/705348351.db2.gz	HXDKATVXWYGRJV-RNCFNFMXSA-N	1	1	323.353	1.018	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000823973428	705348356	/nfs/dbraw/zinc/34/83/56/705348356.db2.gz	HXDKATVXWYGRJV-RNCFNFMXSA-N	1	1	323.353	1.018	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000861033930	705353955	/nfs/dbraw/zinc/35/39/55/705353955.db2.gz	ZCJANXAHKVZQIB-LBPRGKRZSA-N	1	1	323.349	1.445	20	5		DDBDMO
CN(C(=O)NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC000893877084	710870962	/nfs/dbraw/zinc/87/09/62/710870962.db2.gz	RXYLAKIAGIKINF-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825098959	705599547	/nfs/dbraw/zinc/59/95/47/705599547.db2.gz	RAHWASLORUWKMO-DOMZBBRYSA-N	1	1	321.377	1.476	20	5		DDBDMO
CON(C)C(=O)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000862542593	705729578	/nfs/dbraw/zinc/72/95/78/705729578.db2.gz	UQZFDJWOPHJYHO-MRVPVSSYSA-N	1	1	301.730	1.746	20	5		DDBDMO
CC1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)OCCCO1	ZINC000877475567	706117461	/nfs/dbraw/zinc/11/74/61/706117461.db2.gz	TTXPRZOVJHOTPM-UHFFFAOYSA-N	1	1	307.306	1.979	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]2C1=O	ZINC000877719746	706188007	/nfs/dbraw/zinc/18/80/07/706188007.db2.gz	GXUQAIWWLICFOK-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]2C1=O	ZINC000877719746	706188009	/nfs/dbraw/zinc/18/80/09/706188009.db2.gz	GXUQAIWWLICFOK-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
C[C@H](NCC(=O)NC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000878659568	706459831	/nfs/dbraw/zinc/45/98/31/706459831.db2.gz	FREYNCURPIQUHT-LBPRGKRZSA-N	1	1	320.393	1.456	20	5		DDBDMO
Cc1c(CN2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)cccc1[N+](=O)[O-]	ZINC000880070707	706870303	/nfs/dbraw/zinc/87/03/03/706870303.db2.gz	KZLHFZCLNKZAHX-LSDHHAIUSA-N	1	1	305.378	1.544	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCOC[C@@H]1OC	ZINC000880425997	706970717	/nfs/dbraw/zinc/97/07/17/706970717.db2.gz	RFROUJYYEIGOJR-HIFRSBDPSA-N	1	1	310.350	1.839	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432288	706973577	/nfs/dbraw/zinc/97/35/77/706973577.db2.gz	NAQPICPLXRZSMY-UONOGXRCSA-N	1	1	320.349	1.707	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432288	706973579	/nfs/dbraw/zinc/97/35/79/706973579.db2.gz	NAQPICPLXRZSMY-UONOGXRCSA-N	1	1	320.349	1.707	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000880608609	707038626	/nfs/dbraw/zinc/03/86/26/707038626.db2.gz	FGWBMADIUHKRJV-AOOOYVTPSA-N	1	1	324.356	1.871	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2	ZINC000882960624	707873392	/nfs/dbraw/zinc/87/33/92/707873392.db2.gz	QDWGREATYHRWAH-SECBINFHSA-N	1	1	306.322	1.432	20	5		DDBDMO
CCOc1cc(N2CCN(C)CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000897099208	708230000	/nfs/dbraw/zinc/23/00/00/708230000.db2.gz	XLGVOUBKRFUBHI-UHFFFAOYSA-N	1	1	322.409	1.677	20	5		DDBDMO
CC(C)(CCC(=O)NC[C@H]1CC[N@H+]1C1CCOCC1)[N+](=O)[O-]	ZINC000885888706	708655197	/nfs/dbraw/zinc/65/51/97/708655197.db2.gz	OBMICPHHFMYOQY-CYBMUJFWSA-N	1	1	313.398	1.191	20	5		DDBDMO
C[C@](O)(C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(F)F	ZINC000886067226	708691497	/nfs/dbraw/zinc/69/14/97/708691497.db2.gz	IPYOMZYTXVUBMZ-RNCFNFMXSA-N	1	1	316.308	1.492	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000886595687	708787262	/nfs/dbraw/zinc/78/72/62/708787262.db2.gz	NVOPJYFJSVWIAL-ZDUSSCGKSA-N	1	1	306.366	1.792	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000886595687	708787267	/nfs/dbraw/zinc/78/72/67/708787267.db2.gz	NVOPJYFJSVWIAL-ZDUSSCGKSA-N	1	1	306.366	1.792	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887931740	709169040	/nfs/dbraw/zinc/16/90/40/709169040.db2.gz	GOMPOVCVISWDIZ-CJNGLKHVSA-N	1	1	303.362	1.547	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887934719	709170602	/nfs/dbraw/zinc/17/06/02/709170602.db2.gz	RQDROZYNEZGNRV-BMIGLBTASA-N	1	1	307.325	1.758	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000889780169	709631170	/nfs/dbraw/zinc/63/11/70/709631170.db2.gz	IPIMDYMXYREFAD-LSDHHAIUSA-N	1	1	319.361	1.266	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]([NH+]2CCC2)C1	ZINC000912920930	713125305	/nfs/dbraw/zinc/12/53/05/713125305.db2.gz	DQTFYZNDBKTEGC-LLVKDONJSA-N	1	1	315.333	1.391	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])[C@H](C)C1	ZINC000910281808	709863377	/nfs/dbraw/zinc/86/33/77/709863377.db2.gz	DWXGYGHNGRZSEO-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOC(=O)c2cccc([N+](=O)[O-])c2)CCO1	ZINC000893391567	710632667	/nfs/dbraw/zinc/63/26/67/710632667.db2.gz	MPISPAWPGVOKNK-GFCCVEGCSA-N	1	1	308.334	1.862	20	5		DDBDMO
CC[N@@H+](CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F)C1CC1	ZINC000911473398	710812729	/nfs/dbraw/zinc/81/27/29/710812729.db2.gz	BVIFSURJJMVXEV-UHFFFAOYSA-N	1	1	313.304	1.974	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637877	710833154	/nfs/dbraw/zinc/83/31/54/710833154.db2.gz	KTQAUNVEMMGILO-GXTWGEPZSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637877	710833155	/nfs/dbraw/zinc/83/31/55/710833155.db2.gz	KTQAUNVEMMGILO-GXTWGEPZSA-N	1	1	317.349	1.920	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000893941814	710894805	/nfs/dbraw/zinc/89/48/05/710894805.db2.gz	WWXPVMKHDVDUOZ-PWSUYJOCSA-N	1	1	320.349	1.307	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+]CC(=O)NCC(F)F)cc([N+](=O)[O-])c1	ZINC000903168590	711053411	/nfs/dbraw/zinc/05/34/11/711053411.db2.gz	YGPRNSTULKEDLP-MRVPVSSYSA-N	1	1	317.292	1.635	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@@H]1CC[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317499	711095796	/nfs/dbraw/zinc/09/57/96/711095796.db2.gz	LRRAXEWTSGNXDW-GJZGRUSLSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@@H]1CC[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317499	711095800	/nfs/dbraw/zinc/09/58/00/711095800.db2.gz	LRRAXEWTSGNXDW-GJZGRUSLSA-N	1	1	315.377	1.711	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)C1	ZINC000904022654	711365254	/nfs/dbraw/zinc/36/52/54/711365254.db2.gz	GRFYHYBHVJVFIP-JTQLQIEISA-N	1	1	303.322	1.458	20	5		DDBDMO
COc1ccc(-c2ccc(C[NH2+][C@@H]3CNOC3)o2)c([N+](=O)[O-])c1	ZINC000904425126	711856268	/nfs/dbraw/zinc/85/62/68/711856268.db2.gz	ZCJLNGMCNSDALI-SNVBAGLBSA-N	1	1	319.317	1.856	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C	ZINC000908052257	712672246	/nfs/dbraw/zinc/67/22/46/712672246.db2.gz	CAOPPTACMUFTSA-GOEBONIOSA-N	1	1	321.377	1.051	20	5		DDBDMO
COc1ccc(C[NH2+]Cc2cnc3n2CCOC3)cc1[N+](=O)[O-]	ZINC000921611794	713821486	/nfs/dbraw/zinc/82/14/86/713821486.db2.gz	JXEJYHQUNAGMCK-UHFFFAOYSA-N	1	1	318.333	1.620	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)[C@H](C)[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000930914216	713957198	/nfs/dbraw/zinc/95/71/98/713957198.db2.gz	GWZRQAHPYKHLRD-FRRDWIJNSA-N	1	1	321.377	1.948	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000930915426	713957378	/nfs/dbraw/zinc/95/73/78/713957378.db2.gz	KWSXGMHCKRNEFO-LALPHHSUSA-N	1	1	321.377	1.948	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)[C@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000930915428	713957567	/nfs/dbraw/zinc/95/75/67/713957567.db2.gz	KWSXGMHCKRNEFO-XUJVJEKNSA-N	1	1	321.377	1.948	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN(C[C@H]2CC3(C[NH2+]C3)CO2)C2CC2)cc1	ZINC000923372389	714332331	/nfs/dbraw/zinc/33/23/31/714332331.db2.gz	GKRKOWJOVWLTAD-MRXNPFEDSA-N	1	1	317.389	1.938	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117632	714746037	/nfs/dbraw/zinc/74/60/37/714746037.db2.gz	HROOBCPPKROSOL-CABCVRRESA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117632	714746039	/nfs/dbraw/zinc/74/60/39/714746039.db2.gz	HROOBCPPKROSOL-CABCVRRESA-N	1	1	319.361	1.593	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000925422597	714851432	/nfs/dbraw/zinc/85/14/32/714851432.db2.gz	ZZWOADTWQXPCAH-LBPRGKRZSA-N	1	1	320.349	1.072	20	5		DDBDMO
O=C(NC1CC2(C1)CC([NH2+]C/C=C\Cl)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC001121087661	782350998	/nfs/dbraw/zinc/35/09/98/782350998.db2.gz	SNFVQOUUTSGQLS-YAGBSGNHSA-N	1	1	313.785	1.421	20	5		DDBDMO
Cc1cccc(C)c1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001022063581	734368336	/nfs/dbraw/zinc/36/83/36/734368336.db2.gz	DXWJECGVSSMYCO-HLPPOEQASA-N	1	1	317.389	1.705	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063454	734368651	/nfs/dbraw/zinc/36/86/51/734368651.db2.gz	BPRVZMZHMLITGY-XJFOESAGSA-N	1	1	307.325	1.228	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208402	743782389	/nfs/dbraw/zinc/78/23/89/743782389.db2.gz	KBTPCSOUHKYHAL-DGCLKSJQSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208402	743782387	/nfs/dbraw/zinc/78/23/87/743782387.db2.gz	KBTPCSOUHKYHAL-DGCLKSJQSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCCCCF)CC1	ZINC001195762112	746688927	/nfs/dbraw/zinc/68/89/27/746688927.db2.gz	WVMMZWSRJBGTAP-CHWSQXEVSA-N	1	1	301.362	1.326	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCCCCF)CC1	ZINC001195762112	746688929	/nfs/dbraw/zinc/68/89/29/746688929.db2.gz	WVMMZWSRJBGTAP-CHWSQXEVSA-N	1	1	301.362	1.326	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCCCCF)CC1	ZINC001195762112	746688932	/nfs/dbraw/zinc/68/89/32/746688932.db2.gz	WVMMZWSRJBGTAP-CHWSQXEVSA-N	1	1	301.362	1.326	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccn[nH]1	ZINC001031558584	747027977	/nfs/dbraw/zinc/02/79/77/747027977.db2.gz	ZTDRUMUCLYUNFL-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759129	747248357	/nfs/dbraw/zinc/24/83/57/747248357.db2.gz	NBKNNJQCOGSYSI-JSGCOSHPSA-N	1	1	322.365	1.022	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759129	747248360	/nfs/dbraw/zinc/24/83/60/747248360.db2.gz	NBKNNJQCOGSYSI-JSGCOSHPSA-N	1	1	322.365	1.022	20	5		DDBDMO
O=C(N1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1)C(F)(F)F	ZINC001169011891	762177944	/nfs/dbraw/zinc/17/79/44/762177944.db2.gz	NGLQVFVMIOGKKA-NXEZZACHSA-N	1	1	309.288	1.138	20	5		DDBDMO
COc1cccnc1O[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169050663	762206869	/nfs/dbraw/zinc/20/68/69/762206869.db2.gz	CHCYGVHIMOSZOM-BFHYXJOUSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2cccc(F)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020138821	760612950	/nfs/dbraw/zinc/61/29/50/760612950.db2.gz	BPRVZMZHMLITGY-AAVRWANBSA-N	1	1	307.325	1.228	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086083310	760943671	/nfs/dbraw/zinc/94/36/71/760943671.db2.gz	UVNLJVZISLZWNM-QKPAOTATSA-N	1	1	317.389	1.379	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CC2CC3(CCC3)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086084358	760944842	/nfs/dbraw/zinc/94/48/42/760944842.db2.gz	NXMURTOLNLLCFA-FAAHXZRKSA-N	1	1	321.421	1.716	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170346630	766277244	/nfs/dbraw/zinc/27/72/44/766277244.db2.gz	OWUZMLKAXUCNCE-NSHDSACASA-N	1	1	309.366	1.602	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1sccc1Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767821	766566910	/nfs/dbraw/zinc/56/69/10/766566910.db2.gz	WAFZGLJUJAFQFO-PSASIEDQSA-N	1	1	317.798	1.663	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@H](C)[C@H](O)C2)c1F	ZINC001173181332	777035235	/nfs/dbraw/zinc/03/52/35/777035235.db2.gz	OQGPBRHMPRPQTN-OUJBWJOFSA-N	1	1	312.341	1.986	20	5		DDBDMO
Cc1cc(N(C(N)=[NH2+])[C@H](C)Cc2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC001173226493	777062689	/nfs/dbraw/zinc/06/26/89/777062689.db2.gz	MCSLPNVPAGMQJR-SNVBAGLBSA-N	1	1	302.338	1.957	20	5		DDBDMO
CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NC[C@@H]1CC[N@H+]1C	ZINC001178455280	779057429	/nfs/dbraw/zinc/05/74/29/779057429.db2.gz	DGNQZVWTBHZOAY-VIFPVBQESA-N	1	1	324.312	1.126	20	5		DDBDMO
CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NC[C@@H]1CC[N@@H+]1C	ZINC001178455280	779057434	/nfs/dbraw/zinc/05/74/34/779057434.db2.gz	DGNQZVWTBHZOAY-VIFPVBQESA-N	1	1	324.312	1.126	20	5		DDBDMO
Cc1nc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)ncc1[N+](=O)[O-]	ZINC001120059081	781741987	/nfs/dbraw/zinc/74/19/87/781741987.db2.gz	CZZSBHCZNFTIBZ-JQWIXIFHSA-N	1	1	309.395	1.685	20	5		DDBDMO
O=C(NC1(C[NH2+]Cc2ccsc2)CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001269545616	841748210	/nfs/dbraw/zinc/74/82/10/841748210.db2.gz	WWDAWCCFBFUTRV-CHWSQXEVSA-N	1	1	323.418	1.932	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC001328431112	862970901	/nfs/dbraw/zinc/97/09/01/862970901.db2.gz	CFTBYDZVUWKSQA-LLVKDONJSA-N	1	1	322.321	1.717	20	5		DDBDMO
Cc1ccccc1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001122840870	858984659	/nfs/dbraw/zinc/98/46/59/858984659.db2.gz	VIMYFAULJKTEAE-UHFFFAOYSA-N	1	1	317.349	1.156	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC001123003175	859049376	/nfs/dbraw/zinc/04/93/76/859049376.db2.gz	RHLDJEYWVMVRDE-VXGBXAGGSA-N	1	1	308.338	1.270	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc(F)c(F)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761414	864111508	/nfs/dbraw/zinc/11/15/08/864111508.db2.gz	RNJXGAAWZSUKEG-ZWNOBZJWSA-N	1	1	313.304	1.226	20	5		DDBDMO
Cc1cccc(CCC[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157766813	864115466	/nfs/dbraw/zinc/11/54/66/864115466.db2.gz	AAGGJQQXXHAHDR-HZPDHXFCSA-N	1	1	319.405	1.689	20	5		DDBDMO
Cc1nn(C(C)C)cc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775599	864130995	/nfs/dbraw/zinc/13/09/95/864130995.db2.gz	RLXPIYZJJOIRQH-ZIAGYGMSSA-N	1	1	323.397	1.034	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+]3CC[C@H]3C2)c1[N+](=O)[O-]	ZINC001158432742	864653095	/nfs/dbraw/zinc/65/30/95/864653095.db2.gz	YZFQCDXFSDWYIT-JTQLQIEISA-N	1	1	306.322	1.061	20	5		DDBDMO
COc1nc(N[C@@H]2CCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160722699	866066490	/nfs/dbraw/zinc/06/64/90/866066490.db2.gz	IDZJJQQQALMZNO-VXGBXAGGSA-N	1	1	322.365	1.664	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCC[C@@H](CF)C1)c1cccc([N+](=O)[O-])c1	ZINC001333216289	866528161	/nfs/dbraw/zinc/52/81/61/866528161.db2.gz	UUNXPZIEIZNOLN-XHDPSFHLSA-N	1	1	309.341	1.977	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@H]3CCNC(=O)C3)ccc([N+](=O)[O-])c2C1	ZINC001162337983	867469496	/nfs/dbraw/zinc/46/94/96/867469496.db2.gz	DIHXPQOZYBYPOC-NSHDSACASA-N	1	1	318.377	1.521	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@H]3CCNC(=O)C3)ccc([N+](=O)[O-])c2C1	ZINC001162337983	867469506	/nfs/dbraw/zinc/46/95/06/867469506.db2.gz	DIHXPQOZYBYPOC-NSHDSACASA-N	1	1	318.377	1.521	20	5		DDBDMO
CC/C=C/CC[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494926	869234126	/nfs/dbraw/zinc/23/41/26/869234126.db2.gz	YNNIGXHLCIXAQW-LSMGEYOZSA-N	1	1	309.410	1.884	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cc(NCC[C@@H]2CCC[N@@H+](C)C2)n1	ZINC001165261592	869474500	/nfs/dbraw/zinc/47/45/00/869474500.db2.gz	RPYSAYARJZOWGI-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
COc1nc(C)nc(NCC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001165261659	869474722	/nfs/dbraw/zinc/47/47/22/869474722.db2.gz	RXMFCQKTEYPRGL-LLVKDONJSA-N	1	1	309.370	1.846	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001338493461	870011438	/nfs/dbraw/zinc/01/14/38/870011438.db2.gz	ZTDOGKHZGBKAJG-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001338493461	870011452	/nfs/dbraw/zinc/01/14/52/870011452.db2.gz	ZTDOGKHZGBKAJG-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
CN(C)C(=O)CN(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001166663870	870137632	/nfs/dbraw/zinc/13/76/32/870137632.db2.gz	NBYZRTHFDBEFGQ-VOTSOKGWSA-N	1	1	307.354	1.047	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC001339998978	870829217	/nfs/dbraw/zinc/82/92/17/870829217.db2.gz	LEMQLKCQLXUNRB-ZMLRMANQSA-N	1	1	320.349	1.529	20	5		DDBDMO
Cc1[nH+]ccn1CCn1nc(-c2ccccc2[N+](=O)[O-])oc1=O	ZINC001307339180	871422711	/nfs/dbraw/zinc/42/27/11/871422711.db2.gz	DWUSTHAYJQDZSQ-UHFFFAOYSA-N	1	1	315.289	1.617	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2ccn(-c3ccccc3[N+](=O)[O-])n2)o1	ZINC001341628743	871744033	/nfs/dbraw/zinc/74/40/33/871744033.db2.gz	YKWXSRSCQAVUFH-UHFFFAOYSA-N	1	1	314.305	1.892	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1[NH2+]CCc2occc21	ZINC001343188266	872530119	/nfs/dbraw/zinc/53/01/19/872530119.db2.gz	OXLHJBMAVCLKHA-OAHLLOKOSA-N	1	1	315.329	1.734	20	5		DDBDMO
C[N@H+]1CCC[C@@H](Oc2[nH]c(=O)nc3ccc([N+](=O)[O-])cc32)C1	ZINC001227093058	882825684	/nfs/dbraw/zinc/82/56/84/882825684.db2.gz	RPFYUYOHDAUPMO-SNVBAGLBSA-N	1	1	304.306	1.717	20	5		DDBDMO
CN(C)S(=O)(=O)CC[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000405383498	877156903	/nfs/dbraw/zinc/15/69/03/877156903.db2.gz	IEISAYDKQVMLRV-UHFFFAOYSA-N	1	1	321.786	1.229	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC001353890947	877633564	/nfs/dbraw/zinc/63/35/64/877633564.db2.gz	AUHQEYQEAUPPBR-LLVKDONJSA-N	1	1	309.370	1.127	20	5		DDBDMO
N[C@H]1C[NH2+][C@H](C(=O)Nc2cc3cccnc3c3ncccc23)C1	ZINC001218980182	877851597	/nfs/dbraw/zinc/85/15/97/877851597.db2.gz	VQGCPAUGKASTMW-RISCZKNCSA-N	1	1	307.357	1.411	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](COCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001224095711	881212592	/nfs/dbraw/zinc/21/25/92/881212592.db2.gz	CTEQSUSHZZGJFH-GFCCVEGCSA-N	1	1	311.294	1.350	20	5		DDBDMO
C[N@H+]1CCO[C@@H](COCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001224095711	881212608	/nfs/dbraw/zinc/21/26/08/881212608.db2.gz	CTEQSUSHZZGJFH-GFCCVEGCSA-N	1	1	311.294	1.350	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC001227743442	883153556	/nfs/dbraw/zinc/15/35/56/883153556.db2.gz	PHWGAQKUSQBOTE-LLVKDONJSA-N	1	1	306.322	1.571	20	5		DDBDMO
COC(=O)c1cccc(O[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-]	ZINC001227897115	883219374	/nfs/dbraw/zinc/21/93/74/883219374.db2.gz	NIKDEKDVTZGSCL-SNVBAGLBSA-N	1	1	317.301	1.972	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@H]2COC[C@@H](C1)C2[NH3+]	ZINC001246859549	892947660	/nfs/dbraw/zinc/94/76/60/892947660.db2.gz	LFPFGSWILVNELD-ILMGOGQSSA-N	1	1	305.378	1.431	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254602837	896526511	/nfs/dbraw/zinc/52/65/11/896526511.db2.gz	JDANSAISMCNIDG-CABCVRRESA-N	1	1	303.362	1.615	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC001262826285	900387966	/nfs/dbraw/zinc/38/79/66/900387966.db2.gz	GXWCKKDOLBDUGO-RWMBFGLXSA-N	1	1	319.361	1.673	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001265843268	902478332	/nfs/dbraw/zinc/47/83/32/902478332.db2.gz	XWCDGPVBFWRLOE-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
Cc1cccc(C[N@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001265843268	902478338	/nfs/dbraw/zinc/47/83/38/902478338.db2.gz	XWCDGPVBFWRLOE-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001265843268	902478345	/nfs/dbraw/zinc/47/83/45/902478345.db2.gz	XWCDGPVBFWRLOE-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000286540062	219043700	/nfs/dbraw/zinc/04/37/00/219043700.db2.gz	RUSARBMIQOVBKN-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NCCC[NH+]1CCOCC1)CCN2	ZINC000278365096	214119396	/nfs/dbraw/zinc/11/93/96/214119396.db2.gz	KNNVFBJTNCBUIU-UHFFFAOYSA-N	1	1	306.366	1.697	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000451730761	529389084	/nfs/dbraw/zinc/38/90/84/529389084.db2.gz	PSYBRLHSJWFPSG-CQSZACIVSA-N	1	1	320.393	1.610	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])o2)CCCO1	ZINC000278718884	214351296	/nfs/dbraw/zinc/35/12/96/214351296.db2.gz	VVNGCPSVSQBWKN-NSHDSACASA-N	1	1	311.338	1.419	20	5		DDBDMO
CN(C)c1ccccc1C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000289153298	282300239	/nfs/dbraw/zinc/30/02/39/282300239.db2.gz	ZUMYVQSIESHEKY-UHFFFAOYSA-N	1	1	303.366	1.989	20	5		DDBDMO
C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCN2CCO[C@H]1C2	ZINC000295296580	529933354	/nfs/dbraw/zinc/93/33/54/529933354.db2.gz	FCELOYXKWKECTB-HOTGVXAUSA-N	1	1	305.378	1.542	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1	ZINC000616369950	362664491	/nfs/dbraw/zinc/66/44/91/362664491.db2.gz	DZZABXWMAGTHBS-LBPRGKRZSA-N	1	1	320.349	1.673	20	5		DDBDMO
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CC[N@H+](C2CC2)C1	ZINC000358468199	299163234	/nfs/dbraw/zinc/16/32/34/299163234.db2.gz	QDBMKPGCJSPCBS-AWEZNQCLSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[C@@H]1C[C@@H](C)C[NH+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138208969	186015196	/nfs/dbraw/zinc/01/51/96/186015196.db2.gz	KZAPWKHISZXBMY-GHMZBOCLSA-N	1	1	323.397	1.804	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)[C@@H]2C)c1[N+](=O)[O-]	ZINC000287100139	219312164	/nfs/dbraw/zinc/31/21/64/219312164.db2.gz	LIENOEOBFRFOQW-CMPLNLGQSA-N	1	1	321.381	1.579	20	5		DDBDMO
Cn1cc(C[NH+]2CC(C)(CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000459618405	233376781	/nfs/dbraw/zinc/37/67/81/233376781.db2.gz	FWSBFBNQMTUTJB-UHFFFAOYSA-N	1	1	316.361	1.810	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682607	186097166	/nfs/dbraw/zinc/09/71/66/186097166.db2.gz	PXQXDRABJSXNJL-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682607	186097167	/nfs/dbraw/zinc/09/71/67/186097167.db2.gz	PXQXDRABJSXNJL-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000046861373	352465788	/nfs/dbraw/zinc/46/57/88/352465788.db2.gz	YPGYNEMXOCGEEF-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000047287022	352489629	/nfs/dbraw/zinc/48/96/29/352489629.db2.gz	WHOKHPUMAZIVRA-CHWSQXEVSA-N	1	1	304.350	1.534	20	5		DDBDMO
CNC(=O)c1ccc(NCCC[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC000053548401	352660073	/nfs/dbraw/zinc/66/00/73/352660073.db2.gz	HWRIVWIFZHFUAT-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
C[C@@H](CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[N@@H+](C)C1CC1	ZINC000057703841	352825028	/nfs/dbraw/zinc/82/50/28/352825028.db2.gz	IQSFINHIQPVDEM-JTQLQIEISA-N	1	1	309.370	1.125	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000057159504	352802428	/nfs/dbraw/zinc/80/24/28/352802428.db2.gz	FHZDBNUAPGHFAN-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1	ZINC000068775798	353129506	/nfs/dbraw/zinc/12/95/06/353129506.db2.gz	FPCMRHVMJNKONU-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000174195826	198304792	/nfs/dbraw/zinc/30/47/92/198304792.db2.gz	YCXZCRLNPFVJJO-ZDUSSCGKSA-N	1	1	319.361	1.389	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000174334639	198321414	/nfs/dbraw/zinc/32/14/14/198321414.db2.gz	SNABEVJSJGQKDA-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000174334639	198321416	/nfs/dbraw/zinc/32/14/16/198321416.db2.gz	SNABEVJSJGQKDA-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
COC1CC[NH+](CCNC(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000079669497	353572240	/nfs/dbraw/zinc/57/22/40/353572240.db2.gz	QOEVQDJXDBKWQX-UHFFFAOYSA-N	1	1	313.379	1.497	20	5		DDBDMO
O=C1CCCN1CCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000088606421	353756908	/nfs/dbraw/zinc/75/69/08/353756908.db2.gz	ZAOKZNJKFJMUTI-UHFFFAOYSA-N	1	1	303.362	1.965	20	5		DDBDMO
O=C1CCCN1CCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000088606421	353756911	/nfs/dbraw/zinc/75/69/11/353756911.db2.gz	ZAOKZNJKFJMUTI-UHFFFAOYSA-N	1	1	303.362	1.965	20	5		DDBDMO
C[C@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000105199271	353934155	/nfs/dbraw/zinc/93/41/55/353934155.db2.gz	WERRSDFBIMWHMK-LLVKDONJSA-N	1	1	306.366	1.877	20	5		DDBDMO
CCc1ccc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157277073	354224235	/nfs/dbraw/zinc/22/42/35/354224235.db2.gz	QJMLRCIQRMYOIY-IAQYHMDHSA-N	1	1	321.377	1.606	20	5		DDBDMO
CCc1ccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157277073	354224237	/nfs/dbraw/zinc/22/42/37/354224237.db2.gz	QJMLRCIQRMYOIY-IAQYHMDHSA-N	1	1	321.377	1.606	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@@H]2CN1c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000589574580	355002372	/nfs/dbraw/zinc/00/23/72/355002372.db2.gz	BNBTUNTVSHIXCL-WDEREUQCSA-N	1	1	319.365	1.152	20	5		DDBDMO
CN1C[C@H]2[C@@H](CC[N@H+]2CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000590011971	355040047	/nfs/dbraw/zinc/04/00/47/355040047.db2.gz	NSJXUWKXIVKKHC-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1C[C@H]2[C@@H](CCN2CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000590011971	355040050	/nfs/dbraw/zinc/04/00/50/355040050.db2.gz	NSJXUWKXIVKKHC-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000590011971	355040052	/nfs/dbraw/zinc/04/00/52/355040052.db2.gz	NSJXUWKXIVKKHC-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC(C[NH+]2CCOCC2)C1	ZINC000590391502	355083524	/nfs/dbraw/zinc/08/35/24/355083524.db2.gz	DJLMJNUWEPZUEI-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)CCN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000276978014	213215344	/nfs/dbraw/zinc/21/53/44/213215344.db2.gz	YAQGPVCTFIAJBN-UHFFFAOYSA-N	1	1	323.393	1.758	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000590548468	355111354	/nfs/dbraw/zinc/11/13/54/355111354.db2.gz	FBVBGUNVRJWQIY-STQMWFEESA-N	1	1	319.361	1.184	20	5		DDBDMO
C[C@@H](CC[NH+]1CCN(C)CC1)Nc1ncc([N+](=O)[O-])cc1F	ZINC000591155721	355256486	/nfs/dbraw/zinc/25/64/86/355256486.db2.gz	GDPCIDJXORKKPF-NSHDSACASA-N	1	1	311.361	1.567	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH3+])[C@H](CC)C2)c1[N+](=O)[O-]	ZINC000592332241	355561190	/nfs/dbraw/zinc/56/11/90/355561190.db2.gz	IBHYNZFRMRFOPC-ZJUUUORDSA-N	1	1	309.370	1.470	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](C)CC(C)C)n1	ZINC000593204579	355824030	/nfs/dbraw/zinc/82/40/30/355824030.db2.gz	ZLAPVZYEHCCKGM-UHFFFAOYSA-N	1	1	311.386	1.519	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1	ZINC000593029328	355774638	/nfs/dbraw/zinc/77/46/38/355774638.db2.gz	FFXPAVAPRACXDH-WFASDCNBSA-N	1	1	319.361	1.517	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593442524	355886518	/nfs/dbraw/zinc/88/65/18/355886518.db2.gz	TXRFCRMPASJTEK-UHFFFAOYSA-N	1	1	306.297	1.598	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594386204	356191827	/nfs/dbraw/zinc/19/18/27/356191827.db2.gz	NJVPCUVXQUMGRC-QWHCGFSZSA-N	1	1	319.361	1.103	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000594418786	356203741	/nfs/dbraw/zinc/20/37/41/356203741.db2.gz	LAWMUTVBSARCJC-VXGBXAGGSA-N	1	1	320.349	1.442	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000595357113	356462949	/nfs/dbraw/zinc/46/29/49/356462949.db2.gz	YNHHWJOUKPHQHY-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595742436	356631461	/nfs/dbraw/zinc/63/14/61/356631461.db2.gz	GMDNDLJIJKUQOS-OZTPJHRESA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595742436	356631466	/nfs/dbraw/zinc/63/14/66/356631466.db2.gz	GMDNDLJIJKUQOS-OZTPJHRESA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@@H]1C[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1O	ZINC000595744668	356631911	/nfs/dbraw/zinc/63/19/11/356631911.db2.gz	LKPRLBYLASVLSC-VXGBXAGGSA-N	1	1	321.377	1.506	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2NC(=O)CC[C@@H]2C1	ZINC000595736344	356628300	/nfs/dbraw/zinc/62/83/00/356628300.db2.gz	FAVGTCMYXPGLPT-RISCZKNCSA-N	1	1	319.361	1.704	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC4(COC4)C3)n2)c1	ZINC000595834393	356670414	/nfs/dbraw/zinc/67/04/14/356670414.db2.gz	JHFGIQFPNQCFNO-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC4(COC4)C3)n2)c1	ZINC000595834393	356670416	/nfs/dbraw/zinc/67/04/16/356670416.db2.gz	JHFGIQFPNQCFNO-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595835111	356671509	/nfs/dbraw/zinc/67/15/09/356671509.db2.gz	UNVHUHAKPXALEJ-QWHCGFSZSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595835111	356671511	/nfs/dbraw/zinc/67/15/11/356671511.db2.gz	UNVHUHAKPXALEJ-QWHCGFSZSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@]1(C)CO	ZINC000595872681	356687073	/nfs/dbraw/zinc/68/70/73/356687073.db2.gz	KQFWZSHIPVPKLP-MLGOLLRUSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@]1(C)CO	ZINC000595872681	356687077	/nfs/dbraw/zinc/68/70/77/356687077.db2.gz	KQFWZSHIPVPKLP-MLGOLLRUSA-N	1	1	321.377	1.508	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)C1	ZINC000596268233	356839013	/nfs/dbraw/zinc/83/90/13/356839013.db2.gz	GPYDAPKCOKBKQT-NSHDSACASA-N	1	1	306.366	1.614	20	5		DDBDMO
Cc1cc(N2CCC([N@H+]3CCCOCC3)CC2)ncc1[N+](=O)[O-]	ZINC000596267907	356839040	/nfs/dbraw/zinc/83/90/40/356839040.db2.gz	CEXQYMBJVGAFQU-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596537449	356910192	/nfs/dbraw/zinc/91/01/92/356910192.db2.gz	GKYCPLREYSZHAI-CYBMUJFWSA-N	1	1	323.397	1.155	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cc1cc3c(cc1[N+](=O)[O-])OCCO3)C2	ZINC000597209891	357094896	/nfs/dbraw/zinc/09/48/96/357094896.db2.gz	FJOFLBIOCGYQFG-BLLLJJGKSA-N	1	1	320.345	1.834	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597717022	357300090	/nfs/dbraw/zinc/30/00/90/357300090.db2.gz	WJUGKYMVSQIDGF-OAHLLOKOSA-N	1	1	321.381	1.195	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000597920397	357381957	/nfs/dbraw/zinc/38/19/57/357381957.db2.gz	BEPWIOJUEBWBCR-LLVKDONJSA-N	1	1	323.397	1.515	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000598465719	357593123	/nfs/dbraw/zinc/59/31/23/357593123.db2.gz	KBAMDTPTHVTUOG-UHFFFAOYSA-N	1	1	311.386	1.731	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598512003	357610672	/nfs/dbraw/zinc/61/06/72/357610672.db2.gz	VVZBCBSPKWHMNE-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598512003	357610677	/nfs/dbraw/zinc/61/06/77/357610677.db2.gz	VVZBCBSPKWHMNE-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000598647129	357669133	/nfs/dbraw/zinc/66/91/33/357669133.db2.gz	BUTVSAKFMWVEFV-STQMWFEESA-N	1	1	324.377	1.933	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598651462	357671442	/nfs/dbraw/zinc/67/14/42/357671442.db2.gz	SVENGAPEZBXIAW-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598651462	357671448	/nfs/dbraw/zinc/67/14/48/357671448.db2.gz	SVENGAPEZBXIAW-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000599064848	357805875	/nfs/dbraw/zinc/80/58/75/357805875.db2.gz	GCCASRPLBNQULM-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000599064848	357805880	/nfs/dbraw/zinc/80/58/80/357805880.db2.gz	GCCASRPLBNQULM-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@@H+]2CC[C@H](O)C2)ccc2cnccc21	ZINC000599198914	357847967	/nfs/dbraw/zinc/84/79/67/357847967.db2.gz	ATFBQXVQPDLBNZ-LBPRGKRZSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000347912971	283298374	/nfs/dbraw/zinc/29/83/74/283298374.db2.gz	LTVHKPFURJYCIC-NSHDSACASA-N	1	1	306.366	1.780	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000599565999	357975393	/nfs/dbraw/zinc/97/53/93/357975393.db2.gz	BBUPFEQEEALGLH-OAHLLOKOSA-N	1	1	324.333	1.238	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000599786085	358059024	/nfs/dbraw/zinc/05/90/24/358059024.db2.gz	CTNWIRHOZSJZQP-ZDUSSCGKSA-N	1	1	322.365	1.345	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]3[NH+](C)C)c1[N+](=O)[O-]	ZINC000599998932	358100256	/nfs/dbraw/zinc/10/02/56/358100256.db2.gz	BAYIWXKERQCKHV-GDGBQDQQSA-N	1	1	307.354	1.073	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000600310436	358192351	/nfs/dbraw/zinc/19/23/51/358192351.db2.gz	IWUVVGVINWMTPT-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
CC(C)c1ccc(C(=O)NCC[N@H+]2CC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000600534738	358250749	/nfs/dbraw/zinc/25/07/49/358250749.db2.gz	OOJZQKWVUDNHGG-CYBMUJFWSA-N	1	1	321.377	1.515	20	5		DDBDMO
CC(C)(C(=O)NCC[N@H+]1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000600535830	358250834	/nfs/dbraw/zinc/25/08/34/358250834.db2.gz	SQXBMYOMFBZDNF-CQSZACIVSA-N	1	1	321.377	1.055	20	5		DDBDMO
C[N@@H+](CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C1CCC1	ZINC000600823775	358326012	/nfs/dbraw/zinc/32/60/12/358326012.db2.gz	RUPUIRDZKBPSOG-UHFFFAOYSA-N	1	1	319.361	1.669	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000301212220	283368159	/nfs/dbraw/zinc/36/81/59/283368159.db2.gz	XLTXFZYIEXFZKO-SNVBAGLBSA-N	1	1	319.365	1.518	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000180931973	199228915	/nfs/dbraw/zinc/22/89/15/199228915.db2.gz	GUSVYIBWFOXCSA-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
Cn1cc(C[NH2+][C@@H](CCCO)c2ccccc2)c([N+](=O)[O-])n1	ZINC000602550948	359040594	/nfs/dbraw/zinc/04/05/94/359040594.db2.gz	GBHSAABTWIPAPY-AWEZNQCLSA-N	1	1	304.350	1.932	20	5		DDBDMO
CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602472776	359001624	/nfs/dbraw/zinc/00/16/24/359001624.db2.gz	PNTHPHGWRCUCJU-STQMWFEESA-N	1	1	324.381	1.080	20	5		DDBDMO
O=C1NCCC[C@@H]1[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000602678963	359120945	/nfs/dbraw/zinc/12/09/45/359120945.db2.gz	GTCHKILUINLJAV-JTQLQIEISA-N	1	1	317.267	1.982	20	5		DDBDMO
C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1	ZINC000602577937	359052611	/nfs/dbraw/zinc/05/26/11/359052611.db2.gz	RLQBZOARTZJLIO-MLMJSJRWSA-N	1	1	322.390	1.917	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000602769909	359177916	/nfs/dbraw/zinc/17/79/16/359177916.db2.gz	XIBOWZZJKUOYKO-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
COC(=O)[C@@]1(C)CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602843902	359232564	/nfs/dbraw/zinc/23/25/64/359232564.db2.gz	LEGOTHFWKFPEIH-AWEZNQCLSA-N	1	1	310.354	1.375	20	5		DDBDMO
C[NH+](C)C[C@]1(O)CCCN(Cc2cc(O)ccc2[N+](=O)[O-])C1	ZINC000602875829	359258858	/nfs/dbraw/zinc/25/88/58/359258858.db2.gz	ATJUCEFASORBSL-OAHLLOKOSA-N	1	1	309.366	1.189	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C1	ZINC000602953485	359319402	/nfs/dbraw/zinc/31/94/02/359319402.db2.gz	AAARNFYUVUCFQK-LBPRGKRZSA-N	1	1	321.381	1.526	20	5		DDBDMO
C[C@](CO)([NH2+]C[C@H](O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000602963662	359326869	/nfs/dbraw/zinc/32/68/69/359326869.db2.gz	YDAQMWLWCHBAMW-WDEREUQCSA-N	1	1	308.256	1.315	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)CC[N@@H+](C)C1CC1	ZINC000186742902	200002522	/nfs/dbraw/zinc/00/25/22/200002522.db2.gz	ZXRDWHAKFCYECK-GFCCVEGCSA-N	1	1	320.393	1.948	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CC1(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000186786315	200009916	/nfs/dbraw/zinc/00/99/16/200009916.db2.gz	RDCMFMKPSJKRRI-UHFFFAOYSA-N	1	1	307.350	1.262	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC1(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000186786315	200009918	/nfs/dbraw/zinc/00/99/18/200009918.db2.gz	RDCMFMKPSJKRRI-UHFFFAOYSA-N	1	1	307.350	1.262	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000186922084	200031360	/nfs/dbraw/zinc/03/13/60/200031360.db2.gz	ROXWVCJZHQSACB-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@@H]1O	ZINC000186875443	200025186	/nfs/dbraw/zinc/02/51/86/200025186.db2.gz	JOIWIKXANJMOSS-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@@H]1O	ZINC000186875443	200025187	/nfs/dbraw/zinc/02/51/87/200025187.db2.gz	JOIWIKXANJMOSS-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1nn(C)c(N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)c1[N+](=O)[O-]	ZINC000603401246	359617250	/nfs/dbraw/zinc/61/72/50/359617250.db2.gz	KLAPQGZBMONJCR-NSHDSACASA-N	1	1	323.397	1.326	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC000603403710	359619831	/nfs/dbraw/zinc/61/98/31/359619831.db2.gz	UHKRMGQBMLCXBK-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
Cn1cc(CN2CCC[C@H]([C@@H]3C[C@@H]([NH3+])CCO3)C2)c([N+](=O)[O-])n1	ZINC000603431402	359636332	/nfs/dbraw/zinc/63/63/32/359636332.db2.gz	WTRWYUQXPPVKMW-UBHSHLNASA-N	1	1	323.397	1.047	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000604199322	359725200	/nfs/dbraw/zinc/72/52/00/359725200.db2.gz	PRVKXRFVNBBYSD-LBPRGKRZSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1	ZINC000608985024	360256192	/nfs/dbraw/zinc/25/61/92/360256192.db2.gz	HPJXELQTLJTQAA-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000610409269	360429393	/nfs/dbraw/zinc/42/93/93/360429393.db2.gz	FVPNIKMULIAKFE-LLVKDONJSA-N	1	1	313.379	1.215	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H](O)C1CC1	ZINC000610572867	360473298	/nfs/dbraw/zinc/47/32/98/360473298.db2.gz	PCWYNLYEAVHLFY-HIFRSBDPSA-N	1	1	310.350	1.037	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900749	360567770	/nfs/dbraw/zinc/56/77/70/360567770.db2.gz	KAQDYUUAGJOTTC-IINYFYTJSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900749	360567772	/nfs/dbraw/zinc/56/77/72/360567772.db2.gz	KAQDYUUAGJOTTC-IINYFYTJSA-N	1	1	322.365	1.085	20	5		DDBDMO
NC(=O)C1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611249647	360679884	/nfs/dbraw/zinc/67/98/84/360679884.db2.gz	JXMRJTRKAZALLF-UHFFFAOYSA-N	1	1	321.333	1.063	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)CNc2ccccc2[N+](=O)[O-])CC1	ZINC000271914669	209321476	/nfs/dbraw/zinc/32/14/76/209321476.db2.gz	JHQLVIHFYRWFMI-UHFFFAOYSA-N	1	1	304.350	1.385	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N(C)CCC[NH+]2CCN(C)CC2)n1	ZINC000359092701	299326012	/nfs/dbraw/zinc/32/60/12/299326012.db2.gz	GOOGIPSJSIYTSW-UHFFFAOYSA-N	1	1	321.425	1.680	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000194761619	201284688	/nfs/dbraw/zinc/28/46/88/201284688.db2.gz	RBOHAOCLEWAHQY-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000194761619	201284691	/nfs/dbraw/zinc/28/46/91/201284691.db2.gz	RBOHAOCLEWAHQY-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1c(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440433	364009878	/nfs/dbraw/zinc/00/98/78/364009878.db2.gz	GRFLTXONQVHRKC-ZWNOBZJWSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440433	364009883	/nfs/dbraw/zinc/00/98/83/364009883.db2.gz	GRFLTXONQVHRKC-ZWNOBZJWSA-N	1	1	323.349	1.052	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619574253	364067240	/nfs/dbraw/zinc/06/72/40/364067240.db2.gz	LKWHLJZCHSUKJP-MNOVXSKESA-N	1	1	313.354	1.915	20	5		DDBDMO
C[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113740	212128551	/nfs/dbraw/zinc/12/85/51/212128551.db2.gz	YQSWSUDAAPESPW-NHYWBVRUSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113740	212128554	/nfs/dbraw/zinc/12/85/54/212128554.db2.gz	YQSWSUDAAPESPW-NHYWBVRUSA-N	1	1	319.361	1.857	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@H+](CCOC)C1	ZINC000264603654	204022132	/nfs/dbraw/zinc/02/21/32/204022132.db2.gz	NZPABKNCSPSSHY-CQSZACIVSA-N	1	1	323.393	1.804	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN[C@@H]1CC[N@@H+](CCOC)C1	ZINC000264603654	204022134	/nfs/dbraw/zinc/02/21/34/204022134.db2.gz	NZPABKNCSPSSHY-CQSZACIVSA-N	1	1	323.393	1.804	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000264668539	204066776	/nfs/dbraw/zinc/06/67/76/204066776.db2.gz	LDIQZHJEMARMMN-JTQLQIEISA-N	1	1	311.313	1.181	20	5		DDBDMO
CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCNC1=O	ZINC000282503884	217046188	/nfs/dbraw/zinc/04/61/88/217046188.db2.gz	WXVLABGVGAVXFS-GFCCVEGCSA-N	1	1	323.349	1.193	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCO	ZINC000267873318	206313479	/nfs/dbraw/zinc/31/34/79/206313479.db2.gz	CWKVOYWTHICIAE-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCO	ZINC000267873318	206313482	/nfs/dbraw/zinc/31/34/82/206313482.db2.gz	CWKVOYWTHICIAE-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
COc1ccc(C[N@H+](C)CCn2cc([N+](=O)[O-])cn2)c(OC)c1	ZINC000174809033	248380350	/nfs/dbraw/zinc/38/03/50/248380350.db2.gz	VAXRONDQAQTUAC-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)c(OC)c1	ZINC000174809033	248380355	/nfs/dbraw/zinc/38/03/55/248380355.db2.gz	VAXRONDQAQTUAC-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc(F)cc1[N+](=O)[O-]	ZINC000336862216	249270212	/nfs/dbraw/zinc/27/02/12/249270212.db2.gz	HPFDGBWIUVHNRN-VIFPVBQESA-N	1	1	308.313	1.283	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000340859531	251247716	/nfs/dbraw/zinc/24/77/16/251247716.db2.gz	AWDODEZJQVPUMY-NSHDSACASA-N	1	1	311.386	1.013	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000061605311	184177368	/nfs/dbraw/zinc/17/73/68/184177368.db2.gz	BGYQKHPEGSXESA-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](O)C[C@@H]1C	ZINC000340907089	251268487	/nfs/dbraw/zinc/26/84/87/251268487.db2.gz	LEQGREUCZROMJL-WCQYABFASA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000341024826	251344288	/nfs/dbraw/zinc/34/42/88/251344288.db2.gz	HZPCLTBPOYNTOT-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286477881	219010533	/nfs/dbraw/zinc/01/05/33/219010533.db2.gz	LDZFEUSGPDYADK-LERXQTSPSA-N	1	1	307.350	1.767	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000352659519	285204179	/nfs/dbraw/zinc/20/41/79/285204179.db2.gz	NQFRHLXOIABREJ-OCCSQVGLSA-N	1	1	310.350	1.827	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000121707312	195331713	/nfs/dbraw/zinc/33/17/13/195331713.db2.gz	SEIIWSBJBKELDI-UHFFFAOYSA-N	1	1	315.320	1.766	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(c3nc(C)cc(C)c3[N+](=O)[O-])[C@@H]2C1	ZINC000338734767	285380889	/nfs/dbraw/zinc/38/08/89/285380889.db2.gz	SZHZXKIUGRLADI-KGLIPLIRSA-N	1	1	320.393	1.906	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000305764467	533643927	/nfs/dbraw/zinc/64/39/27/533643927.db2.gz	PSOCEUPQLBYMFR-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000305764467	533643934	/nfs/dbraw/zinc/64/39/34/533643934.db2.gz	PSOCEUPQLBYMFR-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c1C	ZINC000054371026	291994512	/nfs/dbraw/zinc/99/45/12/291994512.db2.gz	JDOUVIPPSLRPDB-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1	ZINC000068203041	406623157	/nfs/dbraw/zinc/62/31/57/406623157.db2.gz	UJBDVVJBXVMRNI-RYUDHWBXSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[N@@H+](C)C1CC1	ZINC000069129050	406684618	/nfs/dbraw/zinc/68/46/18/406684618.db2.gz	PHHAENCHRHGANF-MRVPVSSYSA-N	1	1	319.408	1.417	20	5		DDBDMO
Cc1c(NC(=O)NCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000071901113	406865073	/nfs/dbraw/zinc/86/50/73/406865073.db2.gz	TUTBQDXODXAJDT-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000075781451	406941248	/nfs/dbraw/zinc/94/12/48/406941248.db2.gz	LBDYZNUIQOUJTD-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000075781451	406941250	/nfs/dbraw/zinc/94/12/50/406941250.db2.gz	LBDYZNUIQOUJTD-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000075953159	406947715	/nfs/dbraw/zinc/94/77/15/406947715.db2.gz	QNUFABHOTHLJPT-AWEZNQCLSA-N	1	1	324.377	1.959	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)N1CCOCC1	ZINC000088605410	407121883	/nfs/dbraw/zinc/12/18/83/407121883.db2.gz	NGJALMVQAGVMFM-UHFFFAOYSA-N	1	1	319.361	1.202	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000055407109	407203031	/nfs/dbraw/zinc/20/30/31/407203031.db2.gz	ZRXVHYRLFMPWOJ-VXGBXAGGSA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1cc(C(=O)NCCC[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC000122378018	407299141	/nfs/dbraw/zinc/29/91/41/407299141.db2.gz	WWXGELHZWSJGGK-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076096	407346515	/nfs/dbraw/zinc/34/65/15/407346515.db2.gz	DYBGGNXVQRNWFN-WDEREUQCSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076096	407346516	/nfs/dbraw/zinc/34/65/16/407346516.db2.gz	DYBGGNXVQRNWFN-WDEREUQCSA-N	1	1	320.349	1.119	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000124319656	407354823	/nfs/dbraw/zinc/35/48/23/407354823.db2.gz	VTHTYBKRYNZQCH-DGCLKSJQSA-N	1	1	323.397	1.431	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000107632174	407377658	/nfs/dbraw/zinc/37/76/58/407377658.db2.gz	NBTYALDRBNCRQO-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000108340210	407384862	/nfs/dbraw/zinc/38/48/62/407384862.db2.gz	FHKXVIWLIHAZIB-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
COCCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000265905104	407505594	/nfs/dbraw/zinc/50/55/94/407505594.db2.gz	WCBBHTNHZOHOHV-UHFFFAOYSA-N	1	1	307.350	1.389	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](O)C1	ZINC000114204110	407550023	/nfs/dbraw/zinc/55/00/23/407550023.db2.gz	DXLGYMVEXQHDKS-BXKDBHETSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](O)C1	ZINC000114204110	407550027	/nfs/dbraw/zinc/55/00/27/407550027.db2.gz	DXLGYMVEXQHDKS-BXKDBHETSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)c1ccco1	ZINC000180496359	407894114	/nfs/dbraw/zinc/89/41/14/407894114.db2.gz	LPLGXFAECPPLJR-NSHDSACASA-N	1	1	319.321	1.198	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000268253005	407969848	/nfs/dbraw/zinc/96/98/48/407969848.db2.gz	XGELCMDOAKECKZ-NHYWBVRUSA-N	1	1	319.361	1.573	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCc3ccc(F)cc3C2)c1	ZINC000135138132	407977542	/nfs/dbraw/zinc/97/75/42/407977542.db2.gz	CYFBQBPJACTJEY-HNNXBMFYSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3ccc(F)cc3C2)c1	ZINC000135138132	407977547	/nfs/dbraw/zinc/97/75/47/407977547.db2.gz	CYFBQBPJACTJEY-HNNXBMFYSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=C1CNC(=O)N1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000135226786	407990932	/nfs/dbraw/zinc/99/09/32/407990932.db2.gz	NRJOTECNSSSETC-UHFFFAOYSA-N	1	1	318.333	1.111	20	5		DDBDMO
O=C1CNC(=O)N1CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000135226786	407990937	/nfs/dbraw/zinc/99/09/37/407990937.db2.gz	NRJOTECNSSSETC-UHFFFAOYSA-N	1	1	318.333	1.111	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@]2(CCOC2)C1	ZINC000181992865	408062990	/nfs/dbraw/zinc/06/29/90/408062990.db2.gz	SEJHFPFMMJRKGZ-CJNGLKHVSA-N	1	1	322.361	1.447	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000246221500	408183040	/nfs/dbraw/zinc/18/30/40/408183040.db2.gz	DPESEKAWIDKYPG-UKRRQHHQSA-N	1	1	308.334	1.513	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1CO	ZINC000190429032	408242432	/nfs/dbraw/zinc/24/24/32/408242432.db2.gz	HEWIKXRIRHGSRD-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CCC[N@H+](C3CCCC3)CC2)n1	ZINC000176251200	408324235	/nfs/dbraw/zinc/32/42/35/408324235.db2.gz	NFPOLQKJTDQRQM-UHFFFAOYSA-N	1	1	307.398	1.742	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@H]2C[NH+](C)C)c1[N+](=O)[O-]	ZINC000269445292	408312623	/nfs/dbraw/zinc/31/26/23/408312623.db2.gz	QIKWCFCULXJNDL-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000134141682	162071864	/nfs/dbraw/zinc/07/18/64/162071864.db2.gz	ZNCDXYRYLWYEOQ-LLVKDONJSA-N	1	1	321.352	1.877	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269629457	408368245	/nfs/dbraw/zinc/36/82/45/408368245.db2.gz	FAGUJVBMSMTZCX-CZUORRHYSA-N	1	1	307.394	1.902	20	5		DDBDMO
COC(=O)[C@H]1[C@H]2CCC[C@@H]2C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205993	408388994	/nfs/dbraw/zinc/38/89/94/408388994.db2.gz	ROBLWIBQQIZFCS-KGYLQXTDSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205993	408388997	/nfs/dbraw/zinc/38/89/97/408388997.db2.gz	ROBLWIBQQIZFCS-KGYLQXTDSA-N	1	1	308.338	1.065	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000247225082	408433746	/nfs/dbraw/zinc/43/37/46/408433746.db2.gz	VXMYHPBLYAPWAB-CMPLNLGQSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000247225082	408433749	/nfs/dbraw/zinc/43/37/49/408433749.db2.gz	VXMYHPBLYAPWAB-CMPLNLGQSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177033673	408502954	/nfs/dbraw/zinc/50/29/54/408502954.db2.gz	SMCLSNVZAAOGAC-RYUDHWBXSA-N	1	1	318.377	1.748	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000183963755	408519652	/nfs/dbraw/zinc/51/96/52/408519652.db2.gz	QRWPKBDTKIRICS-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177128949	408526917	/nfs/dbraw/zinc/52/69/17/408526917.db2.gz	KQFOATOKPVTRCR-WCQYABFASA-N	1	1	303.362	1.879	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000177130323	408527151	/nfs/dbraw/zinc/52/71/51/408527151.db2.gz	DECHSJVQDGHIHW-ZYHUDNBSSA-N	1	1	319.361	1.958	20	5		DDBDMO
CC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@H](C)O	ZINC000247438234	408471329	/nfs/dbraw/zinc/47/13/29/408471329.db2.gz	ZLMUXWNHUOOKLZ-DZGCQCFKSA-N	1	1	307.394	1.872	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000248458523	408570378	/nfs/dbraw/zinc/57/03/78/408570378.db2.gz	NAHURKVYNLBLOG-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000248458523	408570385	/nfs/dbraw/zinc/57/03/85/408570385.db2.gz	NAHURKVYNLBLOG-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000248458519	408570478	/nfs/dbraw/zinc/57/04/78/408570478.db2.gz	NAHURKVYNLBLOG-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000248458519	408570483	/nfs/dbraw/zinc/57/04/83/408570483.db2.gz	NAHURKVYNLBLOG-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000248691457	408616476	/nfs/dbraw/zinc/61/64/76/408616476.db2.gz	ZAJZBEXLTFMJHT-BMIGLBTASA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000248691457	408616480	/nfs/dbraw/zinc/61/64/80/408616480.db2.gz	ZAJZBEXLTFMJHT-BMIGLBTASA-N	1	1	318.333	1.330	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000192690337	408631445	/nfs/dbraw/zinc/63/14/45/408631445.db2.gz	CVCKGRKQBODRJU-MNOVXSKESA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000248842123	408646379	/nfs/dbraw/zinc/64/63/79/408646379.db2.gz	RBOHAOCLEWAHQY-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000248842123	408646385	/nfs/dbraw/zinc/64/63/85/408646385.db2.gz	RBOHAOCLEWAHQY-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1O	ZINC000249573342	408743643	/nfs/dbraw/zinc/74/36/43/408743643.db2.gz	OWIIRDVAXMTBFR-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1O	ZINC000249573342	408743649	/nfs/dbraw/zinc/74/36/49/408743649.db2.gz	OWIIRDVAXMTBFR-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@]1(O)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000177970259	408747788	/nfs/dbraw/zinc/74/77/88/408747788.db2.gz	YGFNBEAQBVAAJQ-CQSZACIVSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000177970259	408747793	/nfs/dbraw/zinc/74/77/93/408747793.db2.gz	YGFNBEAQBVAAJQ-CQSZACIVSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](O)[C@H](C)C1	ZINC000249601783	408749208	/nfs/dbraw/zinc/74/92/08/408749208.db2.gz	YNTVMQWAUQGVFC-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](O)[C@H](C)C1	ZINC000249601783	408749213	/nfs/dbraw/zinc/74/92/13/408749213.db2.gz	YNTVMQWAUQGVFC-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000276162943	408823712	/nfs/dbraw/zinc/82/37/12/408823712.db2.gz	FXMPRLCWSKZARL-CQSZACIVSA-N	1	1	305.334	1.279	20	5		DDBDMO
CCC[NH+]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000286920922	409000951	/nfs/dbraw/zinc/00/09/51/409000951.db2.gz	KTEBEJYNZGHVQQ-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
COc1cc(N2C[C@@H]([NH+]3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000286288205	408956736	/nfs/dbraw/zinc/95/67/36/408956736.db2.gz	INMOJJBZXSBDOX-JSGCOSHPSA-N	1	1	321.377	1.903	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000277690968	408993528	/nfs/dbraw/zinc/99/35/28/408993528.db2.gz	KJIPTQYKDIIJQM-WDEREUQCSA-N	1	1	307.354	1.237	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000293999176	409223350	/nfs/dbraw/zinc/22/33/50/409223350.db2.gz	XEPFMWCKHRBWAD-LSDHHAIUSA-N	1	1	319.361	1.530	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000279391107	409204945	/nfs/dbraw/zinc/20/49/45/409204945.db2.gz	UHCKQMIWIBKABR-BBRMVZONSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3ncc([N+](=O)[O-])cc3Cl)C[C@H]21	ZINC000284414808	409342593	/nfs/dbraw/zinc/34/25/93/409342593.db2.gz	BUPBFPSAYNBTBK-VXGBXAGGSA-N	1	1	312.757	1.553	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1	ZINC000295273009	409410152	/nfs/dbraw/zinc/41/01/52/409410152.db2.gz	GZDQYZMAITWICJ-LLVKDONJSA-N	1	1	318.377	1.733	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H]2CC[N@H+](C)C[C@H]21	ZINC000285393352	409427598	/nfs/dbraw/zinc/42/75/98/409427598.db2.gz	XGDODKWQKXMXBR-KGLIPLIRSA-N	1	1	319.361	1.448	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000290551279	409440999	/nfs/dbraw/zinc/44/09/99/409440999.db2.gz	JIKXOYHHIUNNNK-SNVBAGLBSA-N	1	1	311.386	1.731	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000347666293	164099170	/nfs/dbraw/zinc/09/91/70/164099170.db2.gz	BKXNVKMFMGWZTN-UHFFFAOYSA-N	1	1	306.326	1.043	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC000408056061	164211488	/nfs/dbraw/zinc/21/14/88/164211488.db2.gz	CIYUCHIIYSYRMJ-UONOGXRCSA-N	1	1	323.324	1.279	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000285554524	409487068	/nfs/dbraw/zinc/48/70/68/409487068.db2.gz	GRTBLGXOKCSKQB-LLVKDONJSA-N	1	1	307.350	1.451	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000285554524	409487072	/nfs/dbraw/zinc/48/70/72/409487072.db2.gz	GRTBLGXOKCSKQB-LLVKDONJSA-N	1	1	307.350	1.451	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC000408356039	164305930	/nfs/dbraw/zinc/30/59/30/164305930.db2.gz	CILDJYWDWGQISW-CQSZACIVSA-N	1	1	306.366	1.710	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000408371887	164310610	/nfs/dbraw/zinc/31/06/10/164310610.db2.gz	FXHIXPCNCAHPPI-LBPRGKRZSA-N	1	1	307.354	1.049	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2C2CCOCC2)c1	ZINC000348946815	409603130	/nfs/dbraw/zinc/60/31/30/409603130.db2.gz	HLNCJNFAGKKWQM-LSDHHAIUSA-N	1	1	324.381	1.043	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@H]1C	ZINC000342471210	409659494	/nfs/dbraw/zinc/65/94/94/409659494.db2.gz	WUPHNLZKBSKSRV-QMTHXVAHSA-N	1	1	319.361	1.816	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000342474128	409663114	/nfs/dbraw/zinc/66/31/14/409663114.db2.gz	NKYCPKNBIQTKAA-YMTOWFKASA-N	1	1	307.325	1.946	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357048323	409821663	/nfs/dbraw/zinc/82/16/63/409821663.db2.gz	MLLRHOWWCPZENE-UHFFFAOYSA-N	1	1	306.326	1.043	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[NH2+]CC1(F)F	ZINC000342721273	409844959	/nfs/dbraw/zinc/84/49/59/409844959.db2.gz	HQPOPUKCGSUXJQ-GFCCVEGCSA-N	1	1	313.304	1.498	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000357005053	409783905	/nfs/dbraw/zinc/78/39/05/409783905.db2.gz	QQQNWFUNWPLTET-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005053	409783907	/nfs/dbraw/zinc/78/39/07/409783907.db2.gz	QQQNWFUNWPLTET-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005053	409783909	/nfs/dbraw/zinc/78/39/09/409783909.db2.gz	QQQNWFUNWPLTET-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)N(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000357005084	409786356	/nfs/dbraw/zinc/78/63/56/409786356.db2.gz	QVOWUVYVELQHLJ-OLZOCXBDSA-N	1	1	320.393	1.582	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000346319631	409914357	/nfs/dbraw/zinc/91/43/57/409914357.db2.gz	CMGLOKKIDHYPHZ-SUHUHFCYSA-N	1	1	322.361	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@@H](O)[C@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000346319632	409914500	/nfs/dbraw/zinc/91/45/00/409914500.db2.gz	CMGLOKKIDHYPHZ-VHRBIJSZSA-N	1	1	322.361	1.815	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000354745195	410055941	/nfs/dbraw/zinc/05/59/41/410055941.db2.gz	YTOGOFQHRPEAPT-NSHDSACASA-N	1	1	322.365	1.018	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc[nH+]c(N(C)C)c1	ZINC000346865557	410208557	/nfs/dbraw/zinc/20/85/57/410208557.db2.gz	CVSPSTBPAXBDKH-UHFFFAOYSA-N	1	1	318.337	1.590	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@](O)(C(F)(F)F)C2)n1	ZINC000357899987	410318389	/nfs/dbraw/zinc/31/83/89/410318389.db2.gz	AGSKNLXETVWYNQ-SNVBAGLBSA-N	1	1	308.260	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@](O)(C(F)(F)F)C2)n1	ZINC000357899987	410318392	/nfs/dbraw/zinc/31/83/92/410318392.db2.gz	AGSKNLXETVWYNQ-SNVBAGLBSA-N	1	1	308.260	1.181	20	5		DDBDMO
CN(c1cccc(C(N)=O)c1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000343352236	410383197	/nfs/dbraw/zinc/38/31/97/410383197.db2.gz	GOBRSBBCLUGEKO-FOSCPWQOSA-N	1	1	318.377	1.755	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCSC[C@@H]2CO)cc1	ZINC000343725319	410651196	/nfs/dbraw/zinc/65/11/96/410651196.db2.gz	NWWZVPQGYKALIR-ZDUSSCGKSA-N	1	1	312.391	1.773	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343851580	410746120	/nfs/dbraw/zinc/74/61/20/410746120.db2.gz	DMPRQEQLFFAHNJ-OCCSQVGLSA-N	1	1	320.393	1.919	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000301430491	410720161	/nfs/dbraw/zinc/72/01/61/410720161.db2.gz	QEUQLFADGMXJQH-AAEUAGOBSA-N	1	1	320.393	1.873	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000330618867	410832721	/nfs/dbraw/zinc/83/27/21/410832721.db2.gz	YUJMBMKAWQWJLW-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC000330618867	410832727	/nfs/dbraw/zinc/83/27/27/410832727.db2.gz	YUJMBMKAWQWJLW-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000348176450	410838803	/nfs/dbraw/zinc/83/88/03/410838803.db2.gz	SDCWTYFLOFKRBR-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000348176450	410838810	/nfs/dbraw/zinc/83/88/10/410838810.db2.gz	SDCWTYFLOFKRBR-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330664462	410859851	/nfs/dbraw/zinc/85/98/51/410859851.db2.gz	GEMMXANVHNQHQW-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330664462	410859859	/nfs/dbraw/zinc/85/98/59/410859859.db2.gz	GEMMXANVHNQHQW-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000359773408	410870166	/nfs/dbraw/zinc/87/01/66/410870166.db2.gz	ISMVSVWKQFPJLN-JTQLQIEISA-N	1	1	311.386	1.731	20	5		DDBDMO
C[N@@H+](CC1(O)CCC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000353487221	411022943	/nfs/dbraw/zinc/02/29/43/411022943.db2.gz	DERCZLFKKIWACE-AWEZNQCLSA-N	1	1	319.361	1.547	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353486022	411023594	/nfs/dbraw/zinc/02/35/94/411023594.db2.gz	WDZXCXDZNJVFJL-WHXUTIOJSA-N	1	1	323.349	1.386	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353486022	411023599	/nfs/dbraw/zinc/02/35/99/411023599.db2.gz	WDZXCXDZNJVFJL-WHXUTIOJSA-N	1	1	323.349	1.386	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356448571	411037011	/nfs/dbraw/zinc/03/70/11/411037011.db2.gz	RVVFLJZOBNDURV-LLVKDONJSA-N	1	1	323.397	1.569	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1	ZINC000331435067	411089179	/nfs/dbraw/zinc/08/91/79/411089179.db2.gz	JLZJGEJIBFFVQJ-UHFFFAOYSA-N	1	1	309.370	1.081	20	5		DDBDMO
Cc1cnc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000353708081	411115485	/nfs/dbraw/zinc/11/54/85/411115485.db2.gz	HTQGJFWWHRYJAD-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1cnc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000353708081	411115486	/nfs/dbraw/zinc/11/54/86/411115486.db2.gz	HTQGJFWWHRYJAD-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1csc([N+](=O)[O-])c1	ZINC000295306890	224692850	/nfs/dbraw/zinc/69/28/50/224692850.db2.gz	BNKRSGXQZUQOBM-NSHDSACASA-N	1	1	313.379	1.233	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CCOc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000375034708	418591739	/nfs/dbraw/zinc/59/17/39/418591739.db2.gz	DDUATUHTINATFK-ZFWWWQNUSA-N	1	1	305.378	2.000	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000361408895	418646445	/nfs/dbraw/zinc/64/64/45/418646445.db2.gz	QRPMYAUKBKGVBV-LBPRGKRZSA-N	1	1	318.333	1.990	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000361408895	418646448	/nfs/dbraw/zinc/64/64/48/418646448.db2.gz	QRPMYAUKBKGVBV-LBPRGKRZSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ncc([N+](=O)[O-])s3)CC2)C1	ZINC000375590788	418659213	/nfs/dbraw/zinc/65/92/13/418659213.db2.gz	JJSTYWYIFIFHHD-NSHDSACASA-N	1	1	311.411	1.268	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CC(N)=O)C1	ZINC000367995055	418671061	/nfs/dbraw/zinc/67/10/61/418671061.db2.gz	XRBUYXLXWCYHGV-NSHDSACASA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000367995055	418671064	/nfs/dbraw/zinc/67/10/64/418671064.db2.gz	XRBUYXLXWCYHGV-NSHDSACASA-N	1	1	320.349	1.039	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583380	418686035	/nfs/dbraw/zinc/68/60/35/418686035.db2.gz	LMAOJIYEEQJBBP-YGRLFVJLSA-N	1	1	320.349	1.443	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583380	418686039	/nfs/dbraw/zinc/68/60/39/418686039.db2.gz	LMAOJIYEEQJBBP-YGRLFVJLSA-N	1	1	320.349	1.443	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990174	418755412	/nfs/dbraw/zinc/75/54/12/418755412.db2.gz	BZKUJDSQYWJIFQ-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370990174	418755414	/nfs/dbraw/zinc/75/54/14/418755414.db2.gz	BZKUJDSQYWJIFQ-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990174	418755415	/nfs/dbraw/zinc/75/54/15/418755415.db2.gz	BZKUJDSQYWJIFQ-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
Cc1noc(C2C[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000365576533	418877814	/nfs/dbraw/zinc/87/78/14/418877814.db2.gz	GYKBNUXNRRALMF-ZDUSSCGKSA-N	1	1	304.306	1.419	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000365572349	418878165	/nfs/dbraw/zinc/87/81/65/418878165.db2.gz	LEFMFKBVTJFPDQ-NRWUCQMLSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000365572349	418878166	/nfs/dbraw/zinc/87/81/66/418878166.db2.gz	LEFMFKBVTJFPDQ-NRWUCQMLSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000365572349	418878167	/nfs/dbraw/zinc/87/81/67/418878167.db2.gz	LEFMFKBVTJFPDQ-NRWUCQMLSA-N	1	1	323.418	1.912	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000426265344	419426759	/nfs/dbraw/zinc/42/67/59/419426759.db2.gz	UMAHFLHOLTWGIN-LBPRGKRZSA-N	1	1	310.350	1.829	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C[C@@H]1CCC[N@H+]1C	ZINC000420997581	419431371	/nfs/dbraw/zinc/43/13/71/419431371.db2.gz	HGYTVQDGUIUGRL-AWEZNQCLSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091197	419649786	/nfs/dbraw/zinc/64/97/86/419649786.db2.gz	QOUIBIVHRKSJPV-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091197	419649795	/nfs/dbraw/zinc/64/97/95/419649795.db2.gz	QOUIBIVHRKSJPV-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000421857719	419751135	/nfs/dbraw/zinc/75/11/35/419751135.db2.gz	CBWVXOGFQMIDPH-HNNXBMFYSA-N	1	1	307.350	1.008	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@@H]1C	ZINC000430231958	420092714	/nfs/dbraw/zinc/09/27/14/420092714.db2.gz	DNRHJSRXBUYVDY-ZWNOBZJWSA-N	1	1	308.334	1.987	20	5		DDBDMO
COc1ccc(NC(=O)CCN2CCC([NH3+])CC2)c([N+](=O)[O-])c1	ZINC000430600609	420153152	/nfs/dbraw/zinc/15/31/52/420153152.db2.gz	BLMLGOWDAHVLBW-UHFFFAOYSA-N	1	1	322.365	1.355	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(NC[C@H]3CCCC[N@H+]3C3CC3)nn21	ZINC000433807536	420255171	/nfs/dbraw/zinc/25/51/71/420255171.db2.gz	IHFIIOWOFJLRIC-GFCCVEGCSA-N	1	1	316.365	2.066	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000420741559	420374696	/nfs/dbraw/zinc/37/46/96/420374696.db2.gz	STYGWEXVPBHEDW-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4CC[C@H](O)[C@H]4C3)nc2c1	ZINC000444689728	230121633	/nfs/dbraw/zinc/12/16/33/230121633.db2.gz	OQTYTQARUOFPNU-CHIMOYNISA-N	1	1	302.334	1.674	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@H]4C3)nc2c1	ZINC000444689728	230121635	/nfs/dbraw/zinc/12/16/35/230121635.db2.gz	OQTYTQARUOFPNU-CHIMOYNISA-N	1	1	302.334	1.674	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2nnc[nH]2)C1	ZINC000425553545	420416922	/nfs/dbraw/zinc/41/69/22/420416922.db2.gz	UQQXAYIVEFIZGK-LLVKDONJSA-N	1	1	303.322	1.711	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000417758728	420469683	/nfs/dbraw/zinc/46/96/83/420469683.db2.gz	CSDCCKZLIKJIOR-HNNXBMFYSA-N	1	1	324.356	1.480	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000457084330	420606239	/nfs/dbraw/zinc/60/62/39/420606239.db2.gz	GPBFFBBJDWYZRO-NSHDSACASA-N	1	1	306.366	1.732	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450957341	420570037	/nfs/dbraw/zinc/57/00/37/420570037.db2.gz	UESGXLNEGPUQLI-SNVBAGLBSA-N	1	1	307.354	1.008	20	5		DDBDMO
CCc1nn(C)c(NCCN2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000440671619	420595966	/nfs/dbraw/zinc/59/59/66/420595966.db2.gz	HIMTVKJSQTZGEY-UHFFFAOYSA-N	1	1	324.429	1.329	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000448058396	420834990	/nfs/dbraw/zinc/83/49/90/420834990.db2.gz	NECSRGCREKQWFY-AAEUAGOBSA-N	1	1	305.382	1.781	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C\c3ccc(F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000493524276	420872463	/nfs/dbraw/zinc/87/24/63/420872463.db2.gz	OYGBROONABWOPQ-FWQWQBSGSA-N	1	1	319.336	1.910	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)Nc1ccncc1[N+](=O)[O-])C1CC1	ZINC000455035150	420960304	/nfs/dbraw/zinc/96/03/04/420960304.db2.gz	OMFSMDZDWFBUGR-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000470182974	420932834	/nfs/dbraw/zinc/93/28/34/420932834.db2.gz	LHFYVTZGTRSOBY-CDQZISKASA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000470182974	420932836	/nfs/dbraw/zinc/93/28/36/420932836.db2.gz	LHFYVTZGTRSOBY-CDQZISKASA-N	1	1	319.361	1.573	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000487494260	421031821	/nfs/dbraw/zinc/03/18/21/421031821.db2.gz	DDJFZZMCEULKSW-MWLCHTKSSA-N	1	1	317.349	1.285	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456017551	421089344	/nfs/dbraw/zinc/08/93/44/421089344.db2.gz	ZBKHHBNCDGUFIE-UWVGGRQHSA-N	1	1	307.354	1.244	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000488725759	421108800	/nfs/dbraw/zinc/10/88/00/421108800.db2.gz	BDKBKHIBIKDFHE-RYUDHWBXSA-N	1	1	307.350	1.260	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@](O)(C4CC4)C3)nc2c1	ZINC000489268598	421142380	/nfs/dbraw/zinc/14/23/80/421142380.db2.gz	NELPWOSYIDGMKB-OAHLLOKOSA-N	1	1	302.334	1.818	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@](O)(C4CC4)C3)nc2c1	ZINC000489268598	421142383	/nfs/dbraw/zinc/14/23/83/421142383.db2.gz	NELPWOSYIDGMKB-OAHLLOKOSA-N	1	1	302.334	1.818	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000450204634	421162859	/nfs/dbraw/zinc/16/28/59/421162859.db2.gz	VPNNBSFIYSLHEB-UHFFFAOYSA-N	1	1	315.333	1.216	20	5		DDBDMO
Cc1nc(NC[C@@H](CC(C)C)[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000450245929	421170964	/nfs/dbraw/zinc/17/09/64/421170964.db2.gz	SHNXOOCWDVMLMV-CYBMUJFWSA-N	1	1	323.397	1.852	20	5		DDBDMO
Cc1nc(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)ncc1[N+](=O)[O-]	ZINC000450366433	421189617	/nfs/dbraw/zinc/18/96/17/421189617.db2.gz	SZLFFMGXVFENRU-CYBMUJFWSA-N	1	1	305.382	1.861	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000518122652	421641115	/nfs/dbraw/zinc/64/11/15/421641115.db2.gz	NIGCJXWKHJZQDH-UHFFFAOYSA-N	1	1	321.381	1.276	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000517214013	421599403	/nfs/dbraw/zinc/59/94/03/421599403.db2.gz	HKYSAFNLDVCULA-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000572422984	421786900	/nfs/dbraw/zinc/78/69/00/421786900.db2.gz	NYKVOLPWCDIQIX-CZUORRHYSA-N	1	1	318.421	1.808	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+](C2CC2)C1	ZINC000580934113	421866739	/nfs/dbraw/zinc/86/67/39/421866739.db2.gz	UOFSFYWWLYVEHX-NSHDSACASA-N	1	1	304.350	1.546	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000596305781	422373670	/nfs/dbraw/zinc/37/36/70/422373670.db2.gz	AIOGMCZJIJTZIU-SNVBAGLBSA-N	1	1	304.354	1.922	20	5		DDBDMO
CC[C@]1(O)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000602983366	422440600	/nfs/dbraw/zinc/44/06/00/422440600.db2.gz	IWZIWTXEPXHMNH-CJNGLKHVSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000578414153	422563642	/nfs/dbraw/zinc/56/36/42/422563642.db2.gz	WDIHLJMVBLHWRS-RISCZKNCSA-N	1	1	305.334	1.136	20	5		DDBDMO
NC(=O)c1cccc(N2CC[N@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000341739954	271195274	/nfs/dbraw/zinc/19/52/74/271195274.db2.gz	BWQPDMXJZYATOW-LLVKDONJSA-N	1	1	304.350	1.368	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@]23CCOC3)c1	ZINC000341978022	271265457	/nfs/dbraw/zinc/26/54/57/271265457.db2.gz	XFMBTZBXLBURAG-GDBMZVCRSA-N	1	1	322.361	1.589	20	5		DDBDMO
C[N@H+]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000342014080	271275109	/nfs/dbraw/zinc/27/51/09/271275109.db2.gz	YJDQXTLWROFJES-UHFFFAOYSA-N	1	1	303.322	1.787	20	5		DDBDMO
COc1ccc(NC(=O)CCNCC2([NH3+])CCC2)c([N+](=O)[O-])c1	ZINC000342142410	271316238	/nfs/dbraw/zinc/31/62/38/271316238.db2.gz	PZYMAGLXPSSDNF-UHFFFAOYSA-N	1	1	322.365	1.403	20	5		DDBDMO
COc1ccc(NC(=O)CC[NH2+]CC2(N)CCC2)c([N+](=O)[O-])c1	ZINC000342142410	271316242	/nfs/dbraw/zinc/31/62/42/271316242.db2.gz	PZYMAGLXPSSDNF-UHFFFAOYSA-N	1	1	322.365	1.403	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000344429306	272024068	/nfs/dbraw/zinc/02/40/68/272024068.db2.gz	RFYJKANGFITYHW-BETUJISGSA-N	1	1	321.377	1.915	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)n1	ZINC000344645091	272077797	/nfs/dbraw/zinc/07/77/97/272077797.db2.gz	CNYCURFUMVGPOU-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000408071341	274333691	/nfs/dbraw/zinc/33/36/91/274333691.db2.gz	JVBCXBDCTJSHJD-LLVKDONJSA-N	1	1	307.350	1.597	20	5		DDBDMO
C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CCO	ZINC000450456061	274370561	/nfs/dbraw/zinc/37/05/61/274370561.db2.gz	WPMOPDQFDQLNJQ-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4ncccc4c3[N+](=O)[O-])C[C@@H]21	ZINC000153187072	277131617	/nfs/dbraw/zinc/13/16/17/277131617.db2.gz	RCMXGAJOFAHAOL-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000286002010	277179921	/nfs/dbraw/zinc/17/99/21/277179921.db2.gz	ZAJJBUZCMFAFCU-ZIAGYGMSSA-N	1	1	305.334	1.140	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@@H+](C)C[C@@H]1C	ZINC000127272412	281269902	/nfs/dbraw/zinc/26/99/02/281269902.db2.gz	MEPPICMXHSDOKR-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C	ZINC000127272412	281269905	/nfs/dbraw/zinc/26/99/05/281269905.db2.gz	MEPPICMXHSDOKR-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCCC(=O)N1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000364320677	300375521	/nfs/dbraw/zinc/37/55/21/300375521.db2.gz	OWOUJJRUFQYFCZ-UHFFFAOYSA-N	1	1	309.370	1.126	20	5		DDBDMO
CCCC(=O)N1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000364320677	300375524	/nfs/dbraw/zinc/37/55/24/300375524.db2.gz	OWOUJJRUFQYFCZ-UHFFFAOYSA-N	1	1	309.370	1.126	20	5		DDBDMO
C[C@@H]1CC(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000369453853	301187770	/nfs/dbraw/zinc/18/77/70/301187770.db2.gz	XAZBEJPPYDVISC-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469402	301345704	/nfs/dbraw/zinc/34/57/04/301345704.db2.gz	CUEOTLHVBXFTEC-UNQGMJICSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370469402	301345708	/nfs/dbraw/zinc/34/57/08/301345708.db2.gz	CUEOTLHVBXFTEC-UNQGMJICSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469402	301345712	/nfs/dbraw/zinc/34/57/12/301345712.db2.gz	CUEOTLHVBXFTEC-UNQGMJICSA-N	1	1	303.362	1.431	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000377058241	302138761	/nfs/dbraw/zinc/13/87/61/302138761.db2.gz	VKAYDHXURRATFT-GHMZBOCLSA-N	1	1	306.322	1.052	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000378546581	302333768	/nfs/dbraw/zinc/33/37/68/302333768.db2.gz	WQCBQZTZKHDLHZ-QWRGUYRKSA-N	1	1	304.350	1.534	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363398877	307027267	/nfs/dbraw/zinc/02/72/67/307027267.db2.gz	QBJWAAMWMCFAND-KKUMJFAQSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccnc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363398877	307027268	/nfs/dbraw/zinc/02/72/68/307027268.db2.gz	QBJWAAMWMCFAND-KKUMJFAQSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363398877	307027269	/nfs/dbraw/zinc/02/72/69/307027269.db2.gz	QBJWAAMWMCFAND-KKUMJFAQSA-N	1	1	318.377	1.075	20	5		DDBDMO
COC(=O)CN1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000363562058	307031298	/nfs/dbraw/zinc/03/12/98/307031298.db2.gz	HZBNPSDZASPPEE-UHFFFAOYSA-N	1	1	321.377	1.584	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)n1	ZINC000373142415	307180438	/nfs/dbraw/zinc/18/04/38/307180438.db2.gz	TWHLPVPDYYFKIS-KGLIPLIRSA-N	1	1	308.382	1.930	20	5		DDBDMO
O=C1N[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]2CO1	ZINC000374073904	307202469	/nfs/dbraw/zinc/20/24/69/307202469.db2.gz	FYYFZFWGCHCDLD-RISCZKNCSA-N	1	1	321.333	1.404	20	5		DDBDMO
COC(=O)[C@@]12CCC[C@H]1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000374695379	307211850	/nfs/dbraw/zinc/21/18/50/307211850.db2.gz	FNIMJXROSTXSGG-SMDDNHRTSA-N	1	1	308.338	1.066	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@@H]3CO)o2)cc1	ZINC000376897809	307258256	/nfs/dbraw/zinc/25/82/56/307258256.db2.gz	STXIZYIYLVVILL-ZIAGYGMSSA-N	1	1	318.329	1.782	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@H]12	ZINC000377683738	307275821	/nfs/dbraw/zinc/27/58/21/307275821.db2.gz	UZVIEAWEUMLMOZ-NEPJUHHUSA-N	1	1	305.334	1.042	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000554571674	307835550	/nfs/dbraw/zinc/83/55/50/307835550.db2.gz	HIOYDBDRTZNCMJ-UHFFFAOYSA-N	1	1	318.289	1.258	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CCCC[N@H+]2CCO)cc([N+](=O)[O-])c1	ZINC000452387951	534058763	/nfs/dbraw/zinc/05/87/63/534058763.db2.gz	INKLOVAZSYYTNM-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000305816460	534340208	/nfs/dbraw/zinc/34/02/08/534340208.db2.gz	AFEQTHIZEVAROK-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000305816460	534340213	/nfs/dbraw/zinc/34/02/13/534340213.db2.gz	AFEQTHIZEVAROK-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000491412905	534773321	/nfs/dbraw/zinc/77/33/21/534773321.db2.gz	AYMMXEUKAWMSJO-WAYWQWQTSA-N	1	1	300.318	1.929	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000491561349	534776170	/nfs/dbraw/zinc/77/61/70/534776170.db2.gz	JRXKHSIFJNDSNL-UTPRNQHHSA-N	1	1	301.346	1.961	20	5		DDBDMO
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@H+](C)CCO1	ZINC000154777342	525681864	/nfs/dbraw/zinc/68/18/64/525681864.db2.gz	SFYBMKYSJITJPQ-KWQFWETISA-N	1	1	300.746	1.774	20	5		DDBDMO
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@@H+](C)CCO1	ZINC000154777342	525681871	/nfs/dbraw/zinc/68/18/71/525681871.db2.gz	SFYBMKYSJITJPQ-KWQFWETISA-N	1	1	300.746	1.774	20	5		DDBDMO
CC(C)C(=O)N[C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000330999370	527523790	/nfs/dbraw/zinc/52/37/90/527523790.db2.gz	NJOPKJWRSPZUAD-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC(C)C(=O)N[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000330999370	527523793	/nfs/dbraw/zinc/52/37/93/527523793.db2.gz	NJOPKJWRSPZUAD-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000451932800	527789669	/nfs/dbraw/zinc/78/96/69/527789669.db2.gz	DPSQZDNGHCJCKN-ZLKJLUDKSA-N	1	1	323.349	1.315	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[C@@H]1CCC[N@@H+](C)C1	ZINC000736856695	599119784	/nfs/dbraw/zinc/11/97/84/599119784.db2.gz	LZJVAEODYQMBCM-LLVKDONJSA-N	1	1	317.353	1.305	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2=CCCCC2)CC1	ZINC000981137068	697015257	/nfs/dbraw/zinc/01/52/57/697015257.db2.gz	LRHMTXFFPFGJNE-HUUCEWRRSA-N	1	1	307.394	1.686	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2=CCCCC2)CC1	ZINC000981137068	697015259	/nfs/dbraw/zinc/01/52/59/697015259.db2.gz	LRHMTXFFPFGJNE-HUUCEWRRSA-N	1	1	307.394	1.686	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2=CCCCC2)CC1	ZINC000981137068	697015261	/nfs/dbraw/zinc/01/52/61/697015261.db2.gz	LRHMTXFFPFGJNE-HUUCEWRRSA-N	1	1	307.394	1.686	20	5		DDBDMO
Cc1ncsc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000983655248	697286787	/nfs/dbraw/zinc/28/67/87/697286787.db2.gz	RLJVXIXSARXRRD-DDHJBXDOSA-N	1	1	324.406	1.101	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000172833263	697372058	/nfs/dbraw/zinc/37/20/58/697372058.db2.gz	CHXAMQBXYBFHJC-VIFPVBQESA-N	1	1	311.294	1.744	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000172833263	697372061	/nfs/dbraw/zinc/37/20/61/697372061.db2.gz	CHXAMQBXYBFHJC-VIFPVBQESA-N	1	1	311.294	1.744	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCS[C@@H]3COCC[C@@H]32)cc1	ZINC000776587137	698122597	/nfs/dbraw/zinc/12/25/97/698122597.db2.gz	ULYPECVAELXWFB-RRFJBIMHSA-N	1	1	324.402	1.835	20	5		DDBDMO
CC1(C)CN(c2ccc([N+](=O)[O-])c3nonc32)CC[N@H+]1CCO	ZINC000780630479	698540313	/nfs/dbraw/zinc/54/03/13/698540313.db2.gz	RVAMFAYCHKTWNJ-UHFFFAOYSA-N	1	1	321.337	1.024	20	5		DDBDMO
COc1ccc(NC(=O)CC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000782815274	698771363	/nfs/dbraw/zinc/77/13/63/698771363.db2.gz	OZNDKLCYTCTQKO-UHFFFAOYSA-N	1	1	309.322	1.264	20	5		DDBDMO
C[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000729681860	699484786	/nfs/dbraw/zinc/48/47/86/699484786.db2.gz	LIZCFPPYOMBUBT-JTQLQIEISA-N	1	1	301.293	1.990	20	5		DDBDMO
C[N@H+]1CC[C@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000729681860	699484787	/nfs/dbraw/zinc/48/47/87/699484787.db2.gz	LIZCFPPYOMBUBT-JTQLQIEISA-N	1	1	301.293	1.990	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+](CC[N+](=O)[O-])Cc1ccccc1	ZINC000791052469	699609021	/nfs/dbraw/zinc/60/90/21/699609021.db2.gz	OGFTZUOPVWSSPZ-OAHLLOKOSA-N	1	1	307.394	1.486	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](CC[N+](=O)[O-])Cc1ccccc1	ZINC000791052469	699609022	/nfs/dbraw/zinc/60/90/22/699609022.db2.gz	OGFTZUOPVWSSPZ-OAHLLOKOSA-N	1	1	307.394	1.486	20	5		DDBDMO
CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000791366554	699627359	/nfs/dbraw/zinc/62/73/59/699627359.db2.gz	JRRFNLBNOZIKKY-AWEZNQCLSA-N	1	1	324.356	1.728	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000791366554	699627360	/nfs/dbraw/zinc/62/73/60/699627360.db2.gz	JRRFNLBNOZIKKY-AWEZNQCLSA-N	1	1	324.356	1.728	20	5		DDBDMO
Cc1cccc(C(=O)OCCC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000735894266	699709043	/nfs/dbraw/zinc/70/90/43/699709043.db2.gz	PCGQYULLEPDDSZ-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
CNC(=O)c1ccc(NCC[N@H+]2CCC[C@H]2C)c([N+](=O)[O-])c1	ZINC000742426783	699878476	/nfs/dbraw/zinc/87/84/76/699878476.db2.gz	BTQHBMNPBDZRIT-LLVKDONJSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@@H](C)C[N@@H+]1C	ZINC000801936490	700357918	/nfs/dbraw/zinc/35/79/18/700357918.db2.gz	UQLUYMBZWILDMA-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@@H](C)C[N@H+]1C	ZINC000801936490	700357921	/nfs/dbraw/zinc/35/79/21/700357921.db2.gz	UQLUYMBZWILDMA-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000754227931	700490665	/nfs/dbraw/zinc/49/06/65/700490665.db2.gz	CVSDWMFFPDOABD-JTQLQIEISA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000754227931	700490668	/nfs/dbraw/zinc/49/06/68/700490668.db2.gz	CVSDWMFFPDOABD-JTQLQIEISA-N	1	1	322.321	1.669	20	5		DDBDMO
CN(C)C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000761526085	700862827	/nfs/dbraw/zinc/86/28/27/700862827.db2.gz	GXNZTFYFIHRWTJ-UHFFFAOYSA-N	1	1	314.773	1.951	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000761526085	700862828	/nfs/dbraw/zinc/86/28/28/700862828.db2.gz	GXNZTFYFIHRWTJ-UHFFFAOYSA-N	1	1	314.773	1.951	20	5		DDBDMO
CC1(C)CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000808181654	701505862	/nfs/dbraw/zinc/50/58/62/701505862.db2.gz	KSCXAMVTMFBSCF-UHFFFAOYSA-N	1	1	321.381	1.644	20	5		DDBDMO
O=C(CC[N@H+]1CCOC[C@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000839531489	701726861	/nfs/dbraw/zinc/72/68/61/701726861.db2.gz	DOSOYNSKEZDEON-GFCCVEGCSA-N	1	1	323.349	1.007	20	5		DDBDMO
O=C(CC[N@@H+]1CCOC[C@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000839531489	701726864	/nfs/dbraw/zinc/72/68/64/701726864.db2.gz	DOSOYNSKEZDEON-GFCCVEGCSA-N	1	1	323.349	1.007	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)[nH]1	ZINC000839660903	701769767	/nfs/dbraw/zinc/76/97/67/701769767.db2.gz	ZLENMCAUWWDJEH-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660903	701769770	/nfs/dbraw/zinc/76/97/70/701769770.db2.gz	ZLENMCAUWWDJEH-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660903	701769774	/nfs/dbraw/zinc/76/97/74/701769774.db2.gz	ZLENMCAUWWDJEH-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660903	701769779	/nfs/dbraw/zinc/76/97/79/701769779.db2.gz	ZLENMCAUWWDJEH-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660903	701769780	/nfs/dbraw/zinc/76/97/80/701769780.db2.gz	ZLENMCAUWWDJEH-GXTWGEPZSA-N	1	1	317.349	1.544	20	5		DDBDMO
CCN(CC(F)F)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867979664	701869897	/nfs/dbraw/zinc/86/98/97/701869897.db2.gz	MAXKUASQZVOZHG-ZDUSSCGKSA-N	1	1	301.293	1.882	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](C)C(C)(C)CC1	ZINC000866115332	706623193	/nfs/dbraw/zinc/62/31/93/706623193.db2.gz	ZGRIRLPXCSIVSA-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000868160299	701970292	/nfs/dbraw/zinc/97/02/92/701970292.db2.gz	DUDFEYCUOQJVJH-HIFRSBDPSA-N	1	1	318.377	1.830	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c(C)c1[N+](=O)[O-]	ZINC000840118278	701977334	/nfs/dbraw/zinc/97/73/34/701977334.db2.gz	DBDZOADAHRXHMU-BFHYXJOUSA-N	1	1	308.382	1.991	20	5		DDBDMO
C[C@H]1CN(Cn2nccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840176560	702013954	/nfs/dbraw/zinc/01/39/54/702013954.db2.gz	CZCMZESLFIWOPR-AWEZNQCLSA-N	1	1	315.377	1.955	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000811599967	702014999	/nfs/dbraw/zinc/01/49/99/702014999.db2.gz	DBJYPZZBHZZQDY-JTQLQIEISA-N	1	1	324.337	1.962	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCOC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000840223349	702034814	/nfs/dbraw/zinc/03/48/14/702034814.db2.gz	ZEKFTBHFOFDEEB-GFCCVEGCSA-N	1	1	324.381	1.944	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](CO)CC2)c1	ZINC000816666762	702138456	/nfs/dbraw/zinc/13/84/56/702138456.db2.gz	VJGBYJHTMGWJAC-LBPRGKRZSA-N	1	1	322.361	1.976	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866205426	706648529	/nfs/dbraw/zinc/64/85/29/706648529.db2.gz	LULDMJKBSFQFIX-QWHCGFSZSA-N	1	1	318.377	1.485	20	5		DDBDMO
Cc1nn(CN(C)C[C@@H]2CCC[N@H+]2C)c2ncc([N+](=O)[O-])cc12	ZINC000817371665	702358943	/nfs/dbraw/zinc/35/89/43/702358943.db2.gz	BQERKUSTZGFWMK-LBPRGKRZSA-N	1	1	318.381	1.631	20	5		DDBDMO
Cc1nc(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n[nH]1	ZINC000866336478	706676348	/nfs/dbraw/zinc/67/63/48/706676348.db2.gz	JXKKZLTYCYYCPA-SECBINFHSA-N	1	1	307.329	1.924	20	5		DDBDMO
Cc1nnc(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])[nH]1	ZINC000866336478	706676349	/nfs/dbraw/zinc/67/63/49/706676349.db2.gz	JXKKZLTYCYYCPA-SECBINFHSA-N	1	1	307.329	1.924	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CN1CC(F)(F)CC1=O	ZINC000841684619	702536598	/nfs/dbraw/zinc/53/65/98/702536598.db2.gz	QQYNVRFXPYKIAD-UHFFFAOYSA-N	1	1	313.304	1.894	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CN1CC(F)(F)CC1=O	ZINC000841684619	702536602	/nfs/dbraw/zinc/53/66/02/702536602.db2.gz	QQYNVRFXPYKIAD-UHFFFAOYSA-N	1	1	313.304	1.894	20	5		DDBDMO
COCCCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000841692541	702541207	/nfs/dbraw/zinc/54/12/07/702541207.db2.gz	SAUMJDFMOPRHKM-UHFFFAOYSA-N	1	1	307.354	1.964	20	5		DDBDMO
[NH3+]CCCCCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000843510138	702897250	/nfs/dbraw/zinc/89/72/50/702897250.db2.gz	YEJXRHJDWIXVLW-UHFFFAOYSA-N	1	1	305.338	1.720	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-]	ZINC000843786249	702923660	/nfs/dbraw/zinc/92/36/60/702923660.db2.gz	SQFVFYYCBNTAKX-UHFFFAOYSA-N	1	1	313.329	1.350	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CC[N@@H+](C)C1	ZINC000843990990	702949864	/nfs/dbraw/zinc/94/98/64/702949864.db2.gz	ZWOWRWHRKYCSDY-JTQLQIEISA-N	1	1	324.356	1.872	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1	ZINC000845771618	703198434	/nfs/dbraw/zinc/19/84/34/703198434.db2.gz	XLSULTITQPXXSS-UHFFFAOYSA-N	1	1	324.381	1.083	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000846292538	703262772	/nfs/dbraw/zinc/26/27/72/703262772.db2.gz	WIZCHAUDIGIBAS-OAHLLOKOSA-N	1	1	323.393	1.722	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH3+])CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000846709024	703322272	/nfs/dbraw/zinc/32/22/72/703322272.db2.gz	XWOTVLNTZIQZBE-MNOVXSKESA-N	1	1	324.356	1.874	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC2=C(CCC(=O)N2)C1	ZINC000852301429	704003571	/nfs/dbraw/zinc/00/35/71/704003571.db2.gz	LKZYHBVMESFNNA-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC2=C(CCC(=O)N2)C1	ZINC000852301429	704003576	/nfs/dbraw/zinc/00/35/76/704003576.db2.gz	LKZYHBVMESFNNA-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
CCC[N@@H+]1CC[C@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981753	704041585	/nfs/dbraw/zinc/04/15/85/704041585.db2.gz	YFTGFRGSOQYMPU-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981753	704041587	/nfs/dbraw/zinc/04/15/87/704041587.db2.gz	YFTGFRGSOQYMPU-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000852664830	704096172	/nfs/dbraw/zinc/09/61/72/704096172.db2.gz	DNQGDSFIORBDOF-NEPJUHHUSA-N	1	1	307.306	1.971	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2cc[nH]c(=O)c2[N+](=O)[O-])C[C@@H]1C	ZINC000853708628	704303075	/nfs/dbraw/zinc/30/30/75/704303075.db2.gz	RNUHVYWMDRPBQZ-PHIMTYICSA-N	1	1	310.354	1.241	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@](O)(c3ccccc3)C2)c1	ZINC000859586997	704944329	/nfs/dbraw/zinc/94/43/29/704944329.db2.gz	VYJNJWWJOWWCEC-MRXNPFEDSA-N	1	1	316.361	1.775	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2C	ZINC000874827075	705185389	/nfs/dbraw/zinc/18/53/89/705185389.db2.gz	AXDOFSOVTYSJAD-KBPBESRZSA-N	1	1	319.361	1.912	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823970658	705347627	/nfs/dbraw/zinc/34/76/27/705347627.db2.gz	GTSFGJNGYMAYJE-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000824765243	705525720	/nfs/dbraw/zinc/52/57/20/705525720.db2.gz	VDFCIOMRRAQTMU-LLVKDONJSA-N	1	1	309.370	1.089	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000861718170	705549978	/nfs/dbraw/zinc/54/99/78/705549978.db2.gz	WMWSWAOTWQTABW-VXGBXAGGSA-N	1	1	323.324	1.015	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000825338833	705650180	/nfs/dbraw/zinc/65/01/80/705650180.db2.gz	VEKDLSISGNKVHT-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000863032900	705852605	/nfs/dbraw/zinc/85/26/05/705852605.db2.gz	QVVATGIPHMILRV-LLVKDONJSA-N	1	1	319.365	1.319	20	5		DDBDMO
CC(C)N1CCC([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)CC1	ZINC000876906778	705918041	/nfs/dbraw/zinc/91/80/41/705918041.db2.gz	HVEMPUUVIKCSGH-UHFFFAOYSA-N	1	1	307.398	1.957	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827266001	705963580	/nfs/dbraw/zinc/96/35/80/705963580.db2.gz	JKJMPYWRRUFQBX-YPMHNXCESA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC000827977543	706098336	/nfs/dbraw/zinc/09/83/36/706098336.db2.gz	MVCIXDSJPSUCKU-OKILXGFUSA-N	1	1	321.352	1.972	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000877719024	706187999	/nfs/dbraw/zinc/18/79/99/706187999.db2.gz	DCBGCJCZTBBMIM-BETUJISGSA-N	1	1	317.345	1.258	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCCC[C@@H]2CN2CCCC2=O)c([N+](=O)[O-])n1	ZINC000878097083	706291494	/nfs/dbraw/zinc/29/14/94/706291494.db2.gz	SJMWRDIRMUTJML-CYBMUJFWSA-N	1	1	321.381	1.305	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]2CN2CCCC2=O)c([N+](=O)[O-])n1	ZINC000878097083	706291495	/nfs/dbraw/zinc/29/14/95/706291495.db2.gz	SJMWRDIRMUTJML-CYBMUJFWSA-N	1	1	321.381	1.305	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1C[C@H](C)O[C@@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000880094786	706877404	/nfs/dbraw/zinc/87/74/04/706877404.db2.gz	KUGFSCXXOAFTID-RWMBFGLXSA-N	1	1	321.377	1.881	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880526042	707003698	/nfs/dbraw/zinc/00/36/98/707003698.db2.gz	BIXFRWVOPSLYHB-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880526042	707003700	/nfs/dbraw/zinc/00/37/00/707003700.db2.gz	BIXFRWVOPSLYHB-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880528626	707005372	/nfs/dbraw/zinc/00/53/72/707005372.db2.gz	FJCYPLQFDLTCTP-GLQYFDAESA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880528626	707005377	/nfs/dbraw/zinc/00/53/77/707005377.db2.gz	FJCYPLQFDLTCTP-GLQYFDAESA-N	1	1	319.361	1.229	20	5		DDBDMO
CCOC(=O)[C@H]1NCC[C@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000873296979	707802301	/nfs/dbraw/zinc/80/23/01/707802301.db2.gz	ORDBLJNXCCSDEL-QKCSRTOESA-N	1	1	307.350	1.539	20	5		DDBDMO
C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1Cl)CCOCCO	ZINC000882952081	707868369	/nfs/dbraw/zinc/86/83/69/707868369.db2.gz	HXXDLWBEJKEYIZ-UHFFFAOYSA-N	1	1	317.773	1.601	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c1	ZINC000897218134	708256413	/nfs/dbraw/zinc/25/64/13/708256413.db2.gz	BCLCBHKBTOAKAM-ZIAGYGMSSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000897219641	708257173	/nfs/dbraw/zinc/25/71/73/708257173.db2.gz	MFOKNTLWPWLAEH-WDEREUQCSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cn2ccnn2)CC1	ZINC000886084226	708695333	/nfs/dbraw/zinc/69/53/33/708695333.db2.gz	SUJAPWXUKUQAEO-UHFFFAOYSA-N	1	1	302.338	1.494	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCOCC1	ZINC000887086613	708951549	/nfs/dbraw/zinc/95/15/49/708951549.db2.gz	WYBFUUGDWNODRR-UHFFFAOYSA-N	1	1	311.313	1.119	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-]	ZINC000928093325	713127463	/nfs/dbraw/zinc/12/74/63/713127463.db2.gz	BWEZXWBDDKIEJL-ZYHUDNBSSA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-]	ZINC000928093325	713127464	/nfs/dbraw/zinc/12/74/64/713127464.db2.gz	BWEZXWBDDKIEJL-ZYHUDNBSSA-N	1	1	324.406	1.243	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105960	713132784	/nfs/dbraw/zinc/13/27/84/713132784.db2.gz	XKHQFWOFKJFFJN-DGCLKSJQSA-N	1	1	322.390	1.299	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105960	713132785	/nfs/dbraw/zinc/13/27/85/713132785.db2.gz	XKHQFWOFKJFFJN-DGCLKSJQSA-N	1	1	322.390	1.299	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000910286604	709866948	/nfs/dbraw/zinc/86/69/48/709866948.db2.gz	HICPOSWXEFAJJG-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1C	ZINC000928438954	713196445	/nfs/dbraw/zinc/19/64/45/713196445.db2.gz	VFZNLKJHLJPXBT-QWRGUYRKSA-N	1	1	307.350	1.816	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H]([C@H](C)O)C2)c1[N+](=O)[O-]	ZINC000893418028	710644741	/nfs/dbraw/zinc/64/47/41/710644741.db2.gz	NZBVVBPIHICVAZ-WDEREUQCSA-N	1	1	310.350	1.902	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000893872090	710867533	/nfs/dbraw/zinc/86/75/33/710867533.db2.gz	OTEFATSXMQYBFE-GFCCVEGCSA-N	1	1	306.366	1.485	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H](CO)CC2)c1[N+](=O)[O-]	ZINC000894650558	711229153	/nfs/dbraw/zinc/22/91/53/711229153.db2.gz	XTBYKBLQKMQASZ-LLVKDONJSA-N	1	1	310.350	1.903	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000895486820	711524944	/nfs/dbraw/zinc/52/49/44/711524944.db2.gz	JMTWTBFIUKGBMF-CQSZACIVSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[C@H]1[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C	ZINC000895737876	711591220	/nfs/dbraw/zinc/59/12/20/711591220.db2.gz	GDCHUZWKTVPIMR-GXSJLCMTSA-N	1	1	304.350	1.984	20	5		DDBDMO
O=C(C[NH2+]CC[N+](=O)[O-])N1CCC(Cc2ccccc2)CC1	ZINC000905147747	711951007	/nfs/dbraw/zinc/95/10/07/711951007.db2.gz	RNGARDDMHBFESF-UHFFFAOYSA-N	1	1	305.378	1.334	20	5		DDBDMO
O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccccc1C(F)(F)F	ZINC000905217725	711971933	/nfs/dbraw/zinc/97/19/33/711971933.db2.gz	FJPGKDGWJOPXNF-JTQLQIEISA-N	1	1	317.267	1.677	20	5		DDBDMO
C[C@@H](c1ccc(F)cc1)N1CCC[C@H]([NH2+]CC[N+](=O)[O-])C1=O	ZINC000905274223	711988835	/nfs/dbraw/zinc/98/88/35/711988835.db2.gz	NXQNLRKYQFBAJN-FZMZJTMJSA-N	1	1	309.341	1.744	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000915213006	713412902	/nfs/dbraw/zinc/41/29/02/713412902.db2.gz	PHQZVVCITWOBNP-UHFFFAOYSA-N	1	1	309.326	1.511	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2c[nH]nc21	ZINC000931460726	714103148	/nfs/dbraw/zinc/10/31/48/714103148.db2.gz	LAVKAMLBSSJMMU-SNVBAGLBSA-N	1	1	303.322	1.099	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2c[nH]nc21	ZINC000931460726	714103151	/nfs/dbraw/zinc/10/31/51/714103151.db2.gz	LAVKAMLBSSJMMU-SNVBAGLBSA-N	1	1	303.322	1.099	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCn2cc[nH+]c21	ZINC000931523651	714118976	/nfs/dbraw/zinc/11/89/76/714118976.db2.gz	HFIPWGOSVQADLY-UHFFFAOYSA-N	1	1	301.306	1.558	20	5		DDBDMO
COC(=O)c1cnc(CC2CC[NH+](CC[N+](=O)[O-])CC2)s1	ZINC000931684125	714160016	/nfs/dbraw/zinc/16/00/16/714160016.db2.gz	DGYYWTOUTLXMTO-UHFFFAOYSA-N	1	1	313.379	1.461	20	5		DDBDMO
CCOC(=O)[C@@H]1[C@@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C[C@@H]21	ZINC000932057075	714248406	/nfs/dbraw/zinc/24/84/06/714248406.db2.gz	JCVQPTGGGVYBAZ-MBNYWOFBSA-N	1	1	322.365	1.231	20	5		DDBDMO
Cn1ccc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000932133029	714267775	/nfs/dbraw/zinc/26/77/75/714267775.db2.gz	NRKFHUUPRUPKFJ-LBPRGKRZSA-N	1	1	304.354	1.404	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN(C[C@@H]2CC3(C[NH2+]C3)CO2)C2CC2)cc1	ZINC000923372388	714332249	/nfs/dbraw/zinc/33/22/49/714332249.db2.gz	GKRKOWJOVWLTAD-INIZCTEOSA-N	1	1	317.389	1.938	20	5		DDBDMO
[NH3+]CC[C@@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000923486958	714373220	/nfs/dbraw/zinc/37/32/20/714373220.db2.gz	VXZNRJZMCIIWOF-GFCCVEGCSA-N	1	1	318.377	1.155	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@@H+]2CCOc1ccc([N+](=O)[O-])cc1	ZINC000932930060	714439392	/nfs/dbraw/zinc/43/93/92/714439392.db2.gz	VOVYYWMCCPBDDF-UHFFFAOYSA-N	1	1	305.334	1.456	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@H+]2CCOc1ccc([N+](=O)[O-])cc1	ZINC000932930060	714439393	/nfs/dbraw/zinc/43/93/93/714439393.db2.gz	VOVYYWMCCPBDDF-UHFFFAOYSA-N	1	1	305.334	1.456	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H]3[C@@H]2CCCN3CCO)cc1	ZINC000934259196	714778269	/nfs/dbraw/zinc/77/82/69/714778269.db2.gz	HHRNWSJIZRUSNC-IRXDYDNUSA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)cc1	ZINC000934259196	714778271	/nfs/dbraw/zinc/77/82/71/714778271.db2.gz	HHRNWSJIZRUSNC-IRXDYDNUSA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)cc1	ZINC000934259196	714778273	/nfs/dbraw/zinc/77/82/73/714778273.db2.gz	HHRNWSJIZRUSNC-IRXDYDNUSA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934272212	714783264	/nfs/dbraw/zinc/78/32/64/714783264.db2.gz	IISXQMYKXHFQDK-GJZGRUSLSA-N	1	1	323.368	1.765	20	5		DDBDMO
CC(C)CC[NH+]1CCC(NCCn2cc([N+](=O)[O-])cn2)CC1	ZINC000925565382	714889227	/nfs/dbraw/zinc/88/92/27/714889227.db2.gz	QFQRHJRNYNDSCV-UHFFFAOYSA-N	1	1	309.414	1.891	20	5		DDBDMO
Cc1ccc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001022061367	734366799	/nfs/dbraw/zinc/36/67/99/734366799.db2.gz	FHLCJGYUEJEFAD-QKPAOTATSA-N	1	1	317.389	1.705	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CC2CCCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022064126	734369117	/nfs/dbraw/zinc/36/91/17/734369117.db2.gz	XHCLNTNKLSPGPA-LXTVHRRPSA-N	1	1	309.410	1.859	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001211587826	735070037	/nfs/dbraw/zinc/07/00/37/735070037.db2.gz	ZBGLQCAKIKNWQH-SNVBAGLBSA-N	1	1	322.300	1.097	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001211587826	735070042	/nfs/dbraw/zinc/07/00/42/735070042.db2.gz	ZBGLQCAKIKNWQH-SNVBAGLBSA-N	1	1	322.300	1.097	20	5		DDBDMO
Cc1cc(Cl)ccc1C[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932388	742777143	/nfs/dbraw/zinc/77/71/43/742777143.db2.gz	VNNWQNKHDWHUKR-CHWSQXEVSA-N	1	1	311.769	1.519	20	5		DDBDMO
CCN(CCNc1ncccc1[N+](=O)[O-])C(=O)CC[N@@H+](C)CC	ZINC001106841342	746434088	/nfs/dbraw/zinc/43/40/88/746434088.db2.gz	DFIQWORJDSMGCP-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1cn[nH]c1	ZINC001031559243	747034835	/nfs/dbraw/zinc/03/48/35/747034835.db2.gz	CDYIRXGBRXZRDF-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
COc1ccc(OCC[N@H+]2[C@H](C)CC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC001197334913	747141302	/nfs/dbraw/zinc/14/13/02/747141302.db2.gz	FGFWJJPFGLPOGG-VXGBXAGGSA-N	1	1	310.350	1.827	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1C[C@@H]2[C@H](O)CC[C@@H]2C1	ZINC001197739738	747255516	/nfs/dbraw/zinc/25/55/16/747255516.db2.gz	QIRRRIFZUGCELZ-UKTARXLSSA-N	1	1	322.361	1.037	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cn1	ZINC001107280247	749726224	/nfs/dbraw/zinc/72/62/24/749726224.db2.gz	KCPOKOSXAZUPNK-SNAWJCMRSA-N	1	1	321.381	1.416	20	5		DDBDMO
CCN1CC[C@]2(CCC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1=O	ZINC001169019200	762199468	/nfs/dbraw/zinc/19/94/68/762199468.db2.gz	FNZDXYVVUCRQKA-DZKIICNBSA-N	1	1	309.410	1.766	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169022238	762200606	/nfs/dbraw/zinc/20/06/06/762200606.db2.gz	RDIJWWVYPTYAHZ-HZSPNIEDSA-N	1	1	308.382	1.407	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169022238	762200611	/nfs/dbraw/zinc/20/06/11/762200611.db2.gz	RDIJWWVYPTYAHZ-HZSPNIEDSA-N	1	1	308.382	1.407	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000823753931	758348246	/nfs/dbraw/zinc/34/82/46/758348246.db2.gz	CYCZGMZRZDWOBB-TXEJJXNPSA-N	1	1	314.345	1.995	20	5		DDBDMO
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1F)[C@H]1C[N@@H+](C)CCN1C	ZINC000829037765	759863914	/nfs/dbraw/zinc/86/39/14/759863914.db2.gz	MIXZTHJYWZHKFB-QMTHXVAHSA-N	1	1	324.356	1.098	20	5		DDBDMO
Cc1nsc(C)c1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001020139100	760613142	/nfs/dbraw/zinc/61/31/42/760613142.db2.gz	QNABSTYGPUJQLK-PRULPYPASA-N	1	1	324.406	1.162	20	5		DDBDMO
CC(C)=CC[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC001000148662	761541709	/nfs/dbraw/zinc/54/17/09/761541709.db2.gz	JJXYGOVRASQYJI-HUUCEWRRSA-N	1	1	321.421	1.979	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(NCc2ccc(N)[nH+]c2C)n1	ZINC001156981307	764256086	/nfs/dbraw/zinc/25/60/86/764256086.db2.gz	YYIMPXZUCIXVOB-UHFFFAOYSA-N	1	1	304.310	1.600	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCOC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC001170335722	766257712	/nfs/dbraw/zinc/25/77/12/766257712.db2.gz	QPIBKPMOHIEPAV-BLLLJJGKSA-N	1	1	324.377	1.618	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccccc2)CC1	ZINC001045436430	766306612	/nfs/dbraw/zinc/30/66/12/766306612.db2.gz	RAZGNLWQTNCMCS-HUUCEWRRSA-N	1	1	317.389	1.823	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@]23CC[N@@H+](C2)CCC3)c1[N+](=O)[O-]	ZINC001144050855	772382434	/nfs/dbraw/zinc/38/24/34/772382434.db2.gz	TXXLRRBVLOBJIK-CQSZACIVSA-N	1	1	307.354	1.096	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC[C@H]21	ZINC001171815428	776482445	/nfs/dbraw/zinc/48/24/45/776482445.db2.gz	VUEBVRQGQAEVSM-QMTHXVAHSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(CC[NH+](C)C)CC1	ZINC001173229363	777062436	/nfs/dbraw/zinc/06/24/36/777062436.db2.gz	SVGNDKFKCFUJDU-HNNXBMFYSA-N	1	1	320.437	1.705	20	5		DDBDMO
CCC[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001101541838	777232097	/nfs/dbraw/zinc/23/20/97/777232097.db2.gz	XFZRLYHHMSKQQS-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
CC[C@@H]1[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021520	850518396	/nfs/dbraw/zinc/51/83/96/850518396.db2.gz	LGKQCJPNRMFIDS-YXWQFLTLSA-N	1	1	309.410	1.955	20	5		DDBDMO
CN(CCC[N@@H+](C)CC1CC(F)(F)C1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001273507571	851038924	/nfs/dbraw/zinc/03/89/24/851038924.db2.gz	FQXUJRATGWKAKR-VXGBXAGGSA-N	1	1	319.352	1.477	20	5		DDBDMO
CN(CCC[N@H+](C)CC1CC(F)(F)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273507571	851038934	/nfs/dbraw/zinc/03/89/34/851038934.db2.gz	FQXUJRATGWKAKR-VXGBXAGGSA-N	1	1	319.352	1.477	20	5		DDBDMO
CN(CCC[N@@H+](C)CC1CC(F)(F)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273507571	851038944	/nfs/dbraw/zinc/03/89/44/851038944.db2.gz	FQXUJRATGWKAKR-VXGBXAGGSA-N	1	1	319.352	1.477	20	5		DDBDMO
Cc1ccc(F)c(C[NH2+]C/C=C/CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001274014633	851852375	/nfs/dbraw/zinc/85/23/75/851852375.db2.gz	BAFVQJRIQLNMHE-MZSZDEQASA-N	1	1	321.352	1.561	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1C[C@H]2C)c1ccc([N+](=O)[O-])cc1	ZINC001124020491	859529961	/nfs/dbraw/zinc/52/99/61/859529961.db2.gz	OOAJUAZQBRSMDJ-TYNCELHUSA-N	1	1	318.377	1.160	20	5		DDBDMO
O=[N+]([O-])C[C@H](OC[C@H]1C[N@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961851	881612333	/nfs/dbraw/zinc/61/23/33/881612333.db2.gz	SBEBDIARCKVSJI-SJORKVTESA-N	1	1	320.389	1.959	20	5		DDBDMO
O=[N+]([O-])C[C@H](OC[C@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961851	881612340	/nfs/dbraw/zinc/61/23/40/881612340.db2.gz	SBEBDIARCKVSJI-SJORKVTESA-N	1	1	320.389	1.959	20	5		DDBDMO
Cc1ccc(CC[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157766900	864115989	/nfs/dbraw/zinc/11/59/89/864115989.db2.gz	BKTFJHFGGVIGLX-HUUCEWRRSA-N	1	1	305.378	1.299	20	5		DDBDMO
Cc1ccc(-c2ccc(N[C@H](N)CCC[NH3+])nn2)cc1[N+](=O)[O-]	ZINC001159786526	865522341	/nfs/dbraw/zinc/52/23/41/865522341.db2.gz	CSSREUWVKOXHJO-AWEZNQCLSA-N	1	1	316.365	1.796	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1-n1cc(CC[NH3+])c2cnccc21	ZINC001160949720	866207699	/nfs/dbraw/zinc/20/76/99/866207699.db2.gz	BKTOLUFSLXOULV-UHFFFAOYSA-N	1	1	313.317	1.377	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC001325113610	867784062	/nfs/dbraw/zinc/78/40/62/867784062.db2.gz	MEQKXEBFEBUHKH-NSHDSACASA-N	1	1	307.354	1.265	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC001335071950	868044128	/nfs/dbraw/zinc/04/41/28/868044128.db2.gz	ITSCSYBEJBUKMM-UHFFFAOYSA-N	1	1	321.299	1.974	20	5		DDBDMO
Cc1cccc(N2CCN(c3ncc([N+](=O)[O-])cc3N)CC2)[nH+]1	ZINC001163665560	868607087	/nfs/dbraw/zinc/60/70/87/868607087.db2.gz	JBERXKYPNNNVGU-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2C[C@H](F)C[C@H](CO)C2)ncc1[N+](=O)[O-]	ZINC001164050486	868912994	/nfs/dbraw/zinc/91/29/94/868912994.db2.gz	NQMPFZPBEYOJJB-JCMPJRQWSA-N	1	1	324.356	1.679	20	5		DDBDMO
Cc1nocc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164490584	869230588	/nfs/dbraw/zinc/23/05/88/869230588.db2.gz	NFYCSUXHCYLXGB-CHWSQXEVSA-N	1	1	322.365	1.024	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001226431933	882426140	/nfs/dbraw/zinc/42/61/40/882426140.db2.gz	VIXUEQXPOCFHKL-SECBINFHSA-N	1	1	310.306	1.473	20	5		DDBDMO
C[C@@H](c1nnc(N2CC[N@H+](C3CCC3)C[C@@H](C)C2)n1C)[N+](=O)[O-]	ZINC001339670213	870618802	/nfs/dbraw/zinc/61/88/02/870618802.db2.gz	XTGJCMIDGUKNOV-NEPJUHHUSA-N	1	1	322.413	1.463	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cnc(N)c([N+](=O)[O-])c2)[nH+]1	ZINC001303959585	871169303	/nfs/dbraw/zinc/16/93/03/871169303.db2.gz	MTBMHSAIXDIKQB-UHFFFAOYSA-N	1	1	316.321	1.117	20	5		DDBDMO
CCOC(=O)COCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC001307761184	871452873	/nfs/dbraw/zinc/45/28/73/871452873.db2.gz	PUGZOFYSDSKYNC-UHFFFAOYSA-N	1	1	310.350	1.649	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])n1	ZINC001307781894	871452930	/nfs/dbraw/zinc/45/29/30/871452930.db2.gz	QDNYIKWJATWXFZ-NSHDSACASA-N	1	1	323.397	1.442	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)N1CCCO1	ZINC001308547106	871508781	/nfs/dbraw/zinc/50/87/81/871508781.db2.gz	SWLGQGQLGFJLHZ-UHFFFAOYSA-N	1	1	309.322	1.247	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@@H]2CCCN(C)C2=O)c1[N+](=O)[O-]	ZINC001206691565	872512661	/nfs/dbraw/zinc/51/26/61/872512661.db2.gz	JXUNNBILMBMMMP-SNVBAGLBSA-N	1	1	309.322	1.019	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC001347892565	874301287	/nfs/dbraw/zinc/30/12/87/874301287.db2.gz	ZGXJWMNOVPETNX-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
Cc1nc(N[C@@H]2C[C@H]([NH+]3CCOCC3)C2(C)C)ncc1[N+](=O)[O-]	ZINC001353016535	877070474	/nfs/dbraw/zinc/07/04/74/877070474.db2.gz	DQIMMBYPVMVPMI-OLZOCXBDSA-N	1	1	321.381	1.604	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228602936	883568182	/nfs/dbraw/zinc/56/81/82/883568182.db2.gz	HIXNYFJGXSQXKB-JTQLQIEISA-N	1	1	308.338	1.831	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228602936	883568192	/nfs/dbraw/zinc/56/81/92/883568192.db2.gz	HIXNYFJGXSQXKB-JTQLQIEISA-N	1	1	308.338	1.831	20	5		DDBDMO
COCC(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001230940012	885064469	/nfs/dbraw/zinc/06/44/69/885064469.db2.gz	MDVMDZNWEMSAFT-UHFFFAOYSA-N	1	1	301.368	1.241	20	5		DDBDMO
COCC(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001230940012	885064486	/nfs/dbraw/zinc/06/44/86/885064486.db2.gz	MDVMDZNWEMSAFT-UHFFFAOYSA-N	1	1	301.368	1.241	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C(F)F)Cc1cccc([N+](=O)[O-])c1	ZINC001231018010	885138941	/nfs/dbraw/zinc/13/89/41/885138941.db2.gz	OTWUWRIZGWTJGA-UHFFFAOYSA-N	1	1	301.293	1.798	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3cc(Cl)cnc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233714018	887245447	/nfs/dbraw/zinc/24/54/47/887245447.db2.gz	YEGADFVFUXYTTI-JMJZKYOTSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3cc(Cl)cnc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233714018	887245465	/nfs/dbraw/zinc/24/54/65/887245465.db2.gz	YEGADFVFUXYTTI-JMJZKYOTSA-N	1	1	311.725	1.826	20	5		DDBDMO
CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@H]2CC[N@@H+](C)C2)c1	ZINC001234408464	887945550	/nfs/dbraw/zinc/94/55/50/887945550.db2.gz	MSBUGPKDTXEPGK-LBPRGKRZSA-N	1	1	308.334	1.783	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccon1)Cc1ccccc1[N+](=O)[O-]	ZINC001234512365	888041779	/nfs/dbraw/zinc/04/17/79/888041779.db2.gz	HENWHVINMWBUTD-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001291871226	913591638	/nfs/dbraw/zinc/59/16/38/913591638.db2.gz	DWYRAPUQIDDFJJ-UHFFFAOYSA-N	1	1	303.322	1.502	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(C)C(=O)[C@H]2C1	ZINC001254555434	896498192	/nfs/dbraw/zinc/49/81/92/896498192.db2.gz	GMBJSQBYJSLDDZ-BNOWGMLFSA-N	1	1	303.362	1.546	20	5		DDBDMO
CCOC(=O)CC1([NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)COC1	ZINC001254574989	896508868	/nfs/dbraw/zinc/50/88/68/896508868.db2.gz	MRWMRQYYPWKFTP-ZDUSSCGKSA-N	1	1	320.345	1.374	20	5		DDBDMO
CC(=O)N(C)[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254611678	896532922	/nfs/dbraw/zinc/53/29/22/896532922.db2.gz	QZEULWTXESPNMS-JKSUJKDBSA-N	1	1	303.362	1.615	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC001293263421	914378999	/nfs/dbraw/zinc/37/89/99/914378999.db2.gz	YABBBJJWOWAWOS-NSHDSACASA-N	1	1	304.350	1.391	20	5		DDBDMO
Cc1cc(NC(=O)C[C@]2(O)CCC[N@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001264010895	900870300	/nfs/dbraw/zinc/87/03/00/900870300.db2.gz	OEDKJKJTHDFMCV-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O	ZINC000451334532	231070050	/nfs/dbraw/zinc/07/00/50/231070050.db2.gz	BVFUGYKBVKEADN-YRGRVCCFSA-N	1	1	308.382	1.844	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262256	529480920	/nfs/dbraw/zinc/48/09/20/529480920.db2.gz	XDLNEBYOZMHOHR-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262256	529480923	/nfs/dbraw/zinc/48/09/23/529480923.db2.gz	XDLNEBYOZMHOHR-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](CCO)C(C)(C)C2)n1	ZINC000614829347	362041851	/nfs/dbraw/zinc/04/18/51/362041851.db2.gz	VZBFSQWYZMVKFD-UHFFFAOYSA-N	1	1	308.382	1.500	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@@H+](CCO)C(C)(C)C2)n1	ZINC000614829347	362041854	/nfs/dbraw/zinc/04/18/54/362041854.db2.gz	VZBFSQWYZMVKFD-UHFFFAOYSA-N	1	1	308.382	1.500	20	5		DDBDMO
CCO[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090550319	185302281	/nfs/dbraw/zinc/30/22/81/185302281.db2.gz	SVLIWMZTHGHALV-KGLIPLIRSA-N	1	1	323.393	1.892	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330895788	232146247	/nfs/dbraw/zinc/14/62/47/232146247.db2.gz	GJWAYHMYYYVHRG-VXGBXAGGSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000272659314	210064750	/nfs/dbraw/zinc/06/47/50/210064750.db2.gz	HCOPAJYLOCJWAQ-IAQYHMDHSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000272659314	210064753	/nfs/dbraw/zinc/06/47/53/210064753.db2.gz	HCOPAJYLOCJWAQ-IAQYHMDHSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000279785211	215143517	/nfs/dbraw/zinc/14/35/17/215143517.db2.gz	UWXOSIBUIBNCBP-CJNGLKHVSA-N	1	1	323.393	1.281	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000152404410	186069408	/nfs/dbraw/zinc/06/94/08/186069408.db2.gz	IUHZZWMLGGKCRB-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682471	186096658	/nfs/dbraw/zinc/09/66/58/186096658.db2.gz	PXQXDRABJSXNJL-NWDGAFQWSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682471	186096659	/nfs/dbraw/zinc/09/66/59/186096659.db2.gz	PXQXDRABJSXNJL-NWDGAFQWSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cc(C[NH+]2CCC(C)(O)CC2)c([N+](=O)[O-])cc1OC	ZINC000179724396	186210748	/nfs/dbraw/zinc/21/07/48/186210748.db2.gz	XCZPEYDRUNGFHN-UHFFFAOYSA-N	1	1	310.350	1.959	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC(C)(C)O	ZINC000181883642	186214809	/nfs/dbraw/zinc/21/48/09/186214809.db2.gz	ZDBWIQRTKSHOEF-GFCCVEGCSA-N	1	1	312.366	1.427	20	5		DDBDMO
CC[N@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000024670922	352190819	/nfs/dbraw/zinc/19/08/19/352190819.db2.gz	PFZOYKZDDMEXRM-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
CC[N@@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000024670922	352190820	/nfs/dbraw/zinc/19/08/20/352190820.db2.gz	PFZOYKZDDMEXRM-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
CNC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000012333691	352147516	/nfs/dbraw/zinc/14/75/16/352147516.db2.gz	MTAFQBRDFFHZTL-UHFFFAOYSA-N	1	1	307.350	1.561	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCn3cccn3)C2)nc1	ZINC000072665272	191211431	/nfs/dbraw/zinc/21/14/31/191211431.db2.gz	PRXSNYSNMXZKBT-LBPRGKRZSA-N	1	1	302.338	1.373	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000052191453	352603651	/nfs/dbraw/zinc/60/36/51/352603651.db2.gz	GFKRDHSZTLPCGT-UHFFFAOYSA-N	1	1	304.306	1.295	20	5		DDBDMO
CC[N@@H+]1CCc2[nH]c(=NC(=O)c3cc([N+](=O)[O-])c[nH]3)sc2C1	ZINC000051205191	352581337	/nfs/dbraw/zinc/58/13/37/352581337.db2.gz	BDCWFIIPJSNQLO-UHFFFAOYSA-N	1	1	321.362	1.432	20	5		DDBDMO
CC[N@H+]1CCc2[nH]c(=NC(=O)c3cc([N+](=O)[O-])c[nH]3)sc2C1	ZINC000051205191	352581340	/nfs/dbraw/zinc/58/13/40/352581340.db2.gz	BDCWFIIPJSNQLO-UHFFFAOYSA-N	1	1	321.362	1.432	20	5		DDBDMO
CCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)N(C)C	ZINC000056510208	352776588	/nfs/dbraw/zinc/77/65/88/352776588.db2.gz	SKTHQBKAMNXZBS-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000057553462	352820227	/nfs/dbraw/zinc/82/02/27/352820227.db2.gz	BAWATORFZUOABX-NSHDSACASA-N	1	1	305.334	1.327	20	5		DDBDMO
CCC[N@H+](CCO)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000072953256	191256731	/nfs/dbraw/zinc/25/67/31/191256731.db2.gz	PPQBFDOLHLIUGE-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000072953256	191256735	/nfs/dbraw/zinc/25/67/35/191256735.db2.gz	PPQBFDOLHLIUGE-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000068008071	353080206	/nfs/dbraw/zinc/08/02/06/353080206.db2.gz	KGQOLYTWQWWBLR-CYBMUJFWSA-N	1	1	323.397	1.562	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1C	ZINC000068960660	353138794	/nfs/dbraw/zinc/13/87/94/353138794.db2.gz	BXPHMSZTAYQJAR-UHFFFAOYSA-N	1	1	301.368	1.133	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000069370704	353158754	/nfs/dbraw/zinc/15/87/54/353158754.db2.gz	OVKGAJRFPXTFTJ-CYBMUJFWSA-N	1	1	321.377	1.746	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000069470882	353162492	/nfs/dbraw/zinc/16/24/92/353162492.db2.gz	GPKUTIGHPCURFK-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+](C)CC[C@@H](C)O)cccc1[N+](=O)[O-]	ZINC000072713610	353210599	/nfs/dbraw/zinc/21/05/99/353210599.db2.gz	FZJDZVBFMYRHMB-PWSUYJOCSA-N	1	1	309.366	1.933	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CC[N@@H+]3CCOC[C@@H]3C2)c1	ZINC000579315652	422743575	/nfs/dbraw/zinc/74/35/75/422743575.db2.gz	YQADQXKTAWVFIN-AWEZNQCLSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CC[N@H+]3CCOC[C@@H]3C2)c1	ZINC000579315652	422743580	/nfs/dbraw/zinc/74/35/80/422743580.db2.gz	YQADQXKTAWVFIN-AWEZNQCLSA-N	1	1	314.345	1.664	20	5		DDBDMO
CCO[C@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000076403973	353418975	/nfs/dbraw/zinc/41/89/75/353418975.db2.gz	ZIRIQXHFRWVYKK-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
CCO[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000076403973	353418977	/nfs/dbraw/zinc/41/89/77/353418977.db2.gz	ZIRIQXHFRWVYKK-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
COc1ccc2c(c1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000174833481	198391636	/nfs/dbraw/zinc/39/16/36/198391636.db2.gz	IHUHUVUCYVCTLW-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc2c(c1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000174833481	198391638	/nfs/dbraw/zinc/39/16/38/198391638.db2.gz	IHUHUVUCYVCTLW-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000156826954	354222720	/nfs/dbraw/zinc/22/27/20/354222720.db2.gz	SHGWGBVPXFSMOK-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000156826954	354222721	/nfs/dbraw/zinc/22/27/21/354222721.db2.gz	SHGWGBVPXFSMOK-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000357243407	291029759	/nfs/dbraw/zinc/02/97/59/291029759.db2.gz	XEWZKHLHQUZTAC-SNVBAGLBSA-N	1	1	319.365	1.518	20	5		DDBDMO
CNc1c(C(=O)N2CC[NH+](CCCF)CC2)cccc1[N+](=O)[O-]	ZINC000402681656	354669050	/nfs/dbraw/zinc/66/90/50/354669050.db2.gz	HWHBKWJGKVATFT-UHFFFAOYSA-N	1	1	324.356	1.754	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706849	354830608	/nfs/dbraw/zinc/83/06/08/354830608.db2.gz	SKBFFHFHMQBQGB-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706849	354830610	/nfs/dbraw/zinc/83/06/10/354830610.db2.gz	SKBFFHFHMQBQGB-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]([C@@H](C)O)C2)c1	ZINC000589510630	354997730	/nfs/dbraw/zinc/99/77/30/354997730.db2.gz	BIRNOFJFECCVKQ-YPMHNXCESA-N	1	1	322.361	1.974	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000590554880	355112728	/nfs/dbraw/zinc/11/27/28/355112728.db2.gz	IZTLJYMCJUYPDG-NSHDSACASA-N	1	1	323.349	1.513	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cccc(OC)c1[N+](=O)[O-]	ZINC000591004639	355231136	/nfs/dbraw/zinc/23/11/36/355231136.db2.gz	BULOZFALJYNHAU-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cccc(OC)c1[N+](=O)[O-]	ZINC000591004639	355231137	/nfs/dbraw/zinc/23/11/37/355231137.db2.gz	BULOZFALJYNHAU-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000592747090	355673928	/nfs/dbraw/zinc/67/39/28/355673928.db2.gz	IGIYOSKZADIREI-BXUZGUMPSA-N	1	1	306.366	1.463	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@H]2CO)c1	ZINC000593024741	355772731	/nfs/dbraw/zinc/77/27/31/355772731.db2.gz	LOCXTLDBABTFBF-IINYFYTJSA-N	1	1	308.334	1.584	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000593720280	355976575	/nfs/dbraw/zinc/97/65/75/355976575.db2.gz	JPMZGUOOVYVVRN-SMDDNHRTSA-N	1	1	307.325	1.439	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000593991706	356081081	/nfs/dbraw/zinc/08/10/81/356081081.db2.gz	JAMVJJOKAFLGAC-AWEZNQCLSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H](O)C[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000594062996	356103561	/nfs/dbraw/zinc/10/35/61/356103561.db2.gz	HNZPJQAWFBHXJY-LLVKDONJSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000594062996	356103562	/nfs/dbraw/zinc/10/35/62/356103562.db2.gz	HNZPJQAWFBHXJY-LLVKDONJSA-N	1	1	307.350	1.403	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)n1	ZINC000594198106	356137555	/nfs/dbraw/zinc/13/75/55/356137555.db2.gz	RXLMSIDMLHIFIY-NWDGAFQWSA-N	1	1	321.381	1.558	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3ncc(Cl)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000284576044	283158758	/nfs/dbraw/zinc/15/87/58/283158758.db2.gz	OUVMIJWTABCKFZ-VXGBXAGGSA-N	1	1	312.757	1.553	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CCOC1	ZINC000595442478	356494583	/nfs/dbraw/zinc/49/45/83/356494583.db2.gz	SEZIVVWUXIMLIT-AWEZNQCLSA-N	1	1	312.297	1.546	20	5		DDBDMO
Cc1noc(CN2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000595452137	356498349	/nfs/dbraw/zinc/49/83/49/356498349.db2.gz	YHRJQUCHUKEAEL-SNVBAGLBSA-N	1	1	312.370	1.168	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](Cn3ccnn3)C2)c1	ZINC000595608477	356575663	/nfs/dbraw/zinc/57/56/63/356575663.db2.gz	QVHLHURTPITNGN-CYBMUJFWSA-N	1	1	317.349	1.587	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@@](CO)(OC)C2)ccc1[N+](=O)[O-]	ZINC000595657641	356594931	/nfs/dbraw/zinc/59/49/31/356594931.db2.gz	DUZNYHINDLTRNK-MRXNPFEDSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)[C@H]1O	ZINC000595748320	356635043	/nfs/dbraw/zinc/63/50/43/356635043.db2.gz	FNDKNAFLWDZUBV-FIRUKDTASA-N	1	1	324.377	1.283	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595727836	356624518	/nfs/dbraw/zinc/62/45/18/356624518.db2.gz	DLFQCCWPAUKJJN-MFKMUULPSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595727836	356624520	/nfs/dbraw/zinc/62/45/20/356624520.db2.gz	DLFQCCWPAUKJJN-MFKMUULPSA-N	1	1	307.325	1.834	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]3NC(=O)CC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000595728784	356625393	/nfs/dbraw/zinc/62/53/93/356625393.db2.gz	OWHMWUFJAAJYAS-STQMWFEESA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000595733289	356627592	/nfs/dbraw/zinc/62/75/92/356627592.db2.gz	QZURUBYMSQQQNE-ATCWAGBWSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595767443	356643656	/nfs/dbraw/zinc/64/36/56/356643656.db2.gz	XKZTXERIGOUDCY-FRRDWIJNSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC(C)(C)C(F)(F)C[NH2+]C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000596068299	356760189	/nfs/dbraw/zinc/76/01/89/356760189.db2.gz	HIZLISXNMPQRJT-JTQLQIEISA-N	1	1	306.313	1.423	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000596074496	356763646	/nfs/dbraw/zinc/76/36/46/356763646.db2.gz	AZGODRKAXQHARE-TZMCWYRMSA-N	1	1	304.350	1.732	20	5		DDBDMO
NC(=O)c1cc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)ccc1[N+](=O)[O-]	ZINC000596107401	356774350	/nfs/dbraw/zinc/77/43/50/356774350.db2.gz	HYEHKIAMTWLMFE-SNVBAGLBSA-N	1	1	315.333	1.801	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000597574709	357233987	/nfs/dbraw/zinc/23/39/87/357233987.db2.gz	GYMOQASUKBQMRM-NEPJUHHUSA-N	1	1	310.329	1.192	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000598591342	357643778	/nfs/dbraw/zinc/64/37/78/357643778.db2.gz	AANKBPMTJKVVKE-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H]3CCC[C@]3([NH3+])C2)c1[N+](=O)[O-]	ZINC000598667430	357677582	/nfs/dbraw/zinc/67/75/82/357677582.db2.gz	GPPVAZVBJXFPFM-OTYXRUKQSA-N	1	1	307.354	1.224	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c1[N+](=O)[O-]	ZINC000185128341	199813318	/nfs/dbraw/zinc/81/33/18/199813318.db2.gz	QNRDFNIVVJHSNI-IVZWLZJFSA-N	1	1	307.354	1.080	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000600192456	358152326	/nfs/dbraw/zinc/15/23/26/358152326.db2.gz	OQFZEHPSRBVXHJ-OAHLLOKOSA-N	1	1	308.334	1.667	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1[nH]ncc1[N+](=O)[O-]	ZINC000600228812	358163408	/nfs/dbraw/zinc/16/34/08/358163408.db2.gz	FWOZIMIDOPTOBI-NSHDSACASA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000600228812	358163411	/nfs/dbraw/zinc/16/34/11/358163411.db2.gz	FWOZIMIDOPTOBI-NSHDSACASA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000600228812	358163416	/nfs/dbraw/zinc/16/34/16/358163416.db2.gz	FWOZIMIDOPTOBI-NSHDSACASA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(Nc1ccc([N+](=O)[O-])cc1)NC1CC([NH+]2CCOCC2)C1	ZINC000600695610	358285171	/nfs/dbraw/zinc/28/51/71/358285171.db2.gz	ABJLNZVDMYSUTA-UHFFFAOYSA-N	1	1	320.349	1.580	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCCN3CCOCC3)c2c1	ZINC000601098931	358401720	/nfs/dbraw/zinc/40/17/20/358401720.db2.gz	KPSFQJCHODLTAV-UHFFFAOYSA-N	1	1	302.334	1.309	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCCC3(O)CCOCC3)c2c1	ZINC000601166109	358430047	/nfs/dbraw/zinc/43/00/47/358430047.db2.gz	YHOWTDQCOMGLOJ-UHFFFAOYSA-N	1	1	317.345	1.908	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H]1CCCCN(C)C1=O	ZINC000601976236	358762818	/nfs/dbraw/zinc/76/28/18/358762818.db2.gz	OVXQFGDAQMUICC-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@H](CCN1CCN(C)CC1)[NH2+]CCc1ccc([N+](=O)[O-])cc1	ZINC000602613975	359074139	/nfs/dbraw/zinc/07/41/39/359074139.db2.gz	BZRUMSBBCKWTLS-OAHLLOKOSA-N	1	1	320.437	1.753	20	5		DDBDMO
C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CN(C)CCO1	ZINC000602575388	359051623	/nfs/dbraw/zinc/05/16/23/359051623.db2.gz	HJBNSAKSFUQUQE-HZMBPMFUSA-N	1	1	320.349	1.545	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])cc1O	ZINC000602789368	359193034	/nfs/dbraw/zinc/19/30/34/359193034.db2.gz	VGCKTZMUIPLAAU-UHFFFAOYSA-N	1	1	320.349	1.946	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC2(C[C@@H]1C)CCOCC2	ZINC000602850228	359237571	/nfs/dbraw/zinc/23/75/71/359237571.db2.gz	QAMGFEFHNMWXCZ-LBPRGKRZSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](c2cccnc2)C1	ZINC000602851497	359237610	/nfs/dbraw/zinc/23/76/10/359237610.db2.gz	KRRFVMFIYYBNJR-CQSZACIVSA-N	1	1	301.350	1.984	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC000602950565	359316666	/nfs/dbraw/zinc/31/66/66/359316666.db2.gz	FUZFZLMGKIXLHL-QWRGUYRKSA-N	1	1	307.354	1.276	20	5		DDBDMO
C[C@](CO)([NH2+]CC(=O)N1CCCC1)c1cccc([N+](=O)[O-])c1	ZINC000602962315	359325175	/nfs/dbraw/zinc/32/51/75/359325175.db2.gz	IPSHTHBIJLLBDT-OAHLLOKOSA-N	1	1	307.350	1.014	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC000602961564	359325778	/nfs/dbraw/zinc/32/57/78/359325778.db2.gz	VGVOIBOBKLEPCM-NSHDSACASA-N	1	1	307.354	1.278	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC000602961564	359325781	/nfs/dbraw/zinc/32/57/81/359325781.db2.gz	VGVOIBOBKLEPCM-NSHDSACASA-N	1	1	307.354	1.278	20	5		DDBDMO
Cc1cc(C(=O)N(C)CC[N@@H+](C)C2CC2)c(N)c([N+](=O)[O-])c1	ZINC000186781542	200008960	/nfs/dbraw/zinc/00/89/60/200008960.db2.gz	RUDSOWZQDAFRNG-UHFFFAOYSA-N	1	1	306.366	1.652	20	5		DDBDMO
CCO[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000604436834	359750642	/nfs/dbraw/zinc/75/06/42/359750642.db2.gz	ASQVPBYQBVPZDN-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000604543997	359764168	/nfs/dbraw/zinc/76/41/68/359764168.db2.gz	FJDTYCWNTWVAHV-ZDUSSCGKSA-N	1	1	320.393	1.853	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000609016517	360257271	/nfs/dbraw/zinc/25/72/71/360257271.db2.gz	JXTWYNULWFOKQR-UHFFFAOYSA-N	1	1	319.361	1.453	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000609521480	360317246	/nfs/dbraw/zinc/31/72/46/360317246.db2.gz	ISYFKWKJANTGLN-SECBINFHSA-N	1	1	307.306	1.005	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611276731	360687778	/nfs/dbraw/zinc/68/77/78/360687778.db2.gz	FRILYLBRAXHRDM-JTQLQIEISA-N	1	1	323.349	1.180	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611564063	360760747	/nfs/dbraw/zinc/76/07/47/360760747.db2.gz	VAXGEIWCBLSGSI-VXGBXAGGSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC[C@@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000611615845	360776971	/nfs/dbraw/zinc/77/69/71/360776971.db2.gz	CZVMGNLRQDKSFN-UONOGXRCSA-N	1	1	322.409	1.888	20	5		DDBDMO
C[C@H](CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])C[NH+](C)C	ZINC000292665469	223191478	/nfs/dbraw/zinc/19/14/78/223191478.db2.gz	OSGJTDITBIFJRS-SECBINFHSA-N	1	1	319.358	1.210	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000359080698	299322037	/nfs/dbraw/zinc/32/20/37/299322037.db2.gz	HCVUYLSYNDXNRZ-UHFFFAOYSA-N	1	1	321.381	1.183	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000619578460	364070545	/nfs/dbraw/zinc/07/05/45/364070545.db2.gz	JAGJCYPMKBWURJ-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000619578381	364070909	/nfs/dbraw/zinc/07/09/09/364070909.db2.gz	HAPQTGJOXYQHPT-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516991	364047303	/nfs/dbraw/zinc/04/73/03/364047303.db2.gz	SRJUTHBBAUVZFU-GWCFXTLKSA-N	1	1	321.333	1.708	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516991	364047308	/nfs/dbraw/zinc/04/73/08/364047308.db2.gz	SRJUTHBBAUVZFU-GWCFXTLKSA-N	1	1	321.333	1.708	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)cc1[N+](=O)[O-]	ZINC000619873733	364170647	/nfs/dbraw/zinc/17/06/47/364170647.db2.gz	SVMCDIPZUMDFES-CQSZACIVSA-N	1	1	318.377	1.023	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000274967508	212047933	/nfs/dbraw/zinc/04/79/33/212047933.db2.gz	VOPFGGNLZBVRSW-UHFFFAOYSA-N	1	1	300.318	1.545	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000274967508	212047934	/nfs/dbraw/zinc/04/79/34/212047934.db2.gz	VOPFGGNLZBVRSW-UHFFFAOYSA-N	1	1	300.318	1.545	20	5		DDBDMO
C[N@H+](CCOCCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000282539883	217072360	/nfs/dbraw/zinc/07/23/60/217072360.db2.gz	QXQKAHPUQXJGCF-UHFFFAOYSA-N	1	1	321.333	1.691	20	5		DDBDMO
C[N@@H+](CCOCCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000282539883	217072363	/nfs/dbraw/zinc/07/23/63/217072363.db2.gz	QXQKAHPUQXJGCF-UHFFFAOYSA-N	1	1	321.333	1.691	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000266194180	205172723	/nfs/dbraw/zinc/17/27/23/205172723.db2.gz	HLFFQPLTUOJQNY-NSHDSACASA-N	1	1	321.381	1.257	20	5		DDBDMO
CN(CC(=O)NC[C@H]1CCC[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000266336292	205277179	/nfs/dbraw/zinc/27/71/79/205277179.db2.gz	UCKVFLUBEUGLAV-GFCCVEGCSA-N	1	1	306.366	1.241	20	5		DDBDMO
CO[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000267631636	206185235	/nfs/dbraw/zinc/18/52/35/206185235.db2.gz	GZVOSANBESOCKJ-LBPRGKRZSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000267631636	206185240	/nfs/dbraw/zinc/18/52/40/206185240.db2.gz	GZVOSANBESOCKJ-LBPRGKRZSA-N	1	1	304.306	1.866	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCCC[NH2+]C1CC1	ZINC000336847704	249254425	/nfs/dbraw/zinc/25/44/25/249254425.db2.gz	GAYVNADIHRVIFS-UHFFFAOYSA-N	1	1	317.342	1.154	20	5		DDBDMO
Cc1c(CN2CCO[C@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000284471381	218040064	/nfs/dbraw/zinc/04/00/64/218040064.db2.gz	AGLHBCNXDNPPAF-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CCC[C@@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000104850680	194046703	/nfs/dbraw/zinc/04/67/03/194046703.db2.gz	COHNZNGJWDLJOS-LLVKDONJSA-N	1	1	320.393	1.947	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000104887600	194049600	/nfs/dbraw/zinc/04/96/00/194049600.db2.gz	HLVKLSXJWZAAEQ-LLVKDONJSA-N	1	1	308.382	1.946	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@](F)(CO)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000338588525	250043019	/nfs/dbraw/zinc/04/30/19/250043019.db2.gz	YHQGUZUGYDEVHV-CQSZACIVSA-N	1	1	311.313	1.330	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000341084681	251371698	/nfs/dbraw/zinc/37/16/98/251371698.db2.gz	JEYQBYXNEIKSMP-UHFFFAOYSA-N	1	1	308.382	1.777	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000341066155	251364806	/nfs/dbraw/zinc/36/48/06/251364806.db2.gz	JNKQKMVXKGHYPJ-PHIMTYICSA-N	1	1	323.397	1.629	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCC[NH+]1CCSCC1	ZINC000352378769	285007987	/nfs/dbraw/zinc/00/79/87/285007987.db2.gz	QJDFZETXTKQVJO-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
COCCCNC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352571841	285149096	/nfs/dbraw/zinc/14/90/96/285149096.db2.gz	ZNYMZOJAPRSOJY-CYBMUJFWSA-N	1	1	323.393	1.610	20	5		DDBDMO
COCCCNC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352571841	285149100	/nfs/dbraw/zinc/14/91/00/285149100.db2.gz	ZNYMZOJAPRSOJY-CYBMUJFWSA-N	1	1	323.393	1.610	20	5		DDBDMO
COC[C@H]1CCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000452028474	533131127	/nfs/dbraw/zinc/13/11/27/533131127.db2.gz	HFXUIFUSYPTRKX-HUUCEWRRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nc(=O)[nH][nH]2)C1	ZINC000289482053	221007124	/nfs/dbraw/zinc/00/71/24/221007124.db2.gz	RVDLJZZBSPQZCO-ZYHUDNBSSA-N	1	1	317.349	1.947	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000289518060	221035166	/nfs/dbraw/zinc/03/51/66/221035166.db2.gz	CXQQWOMLHWWTAT-UHFFFAOYSA-N	1	1	305.342	1.169	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H](O)C(F)(F)F)C2)nc1	ZINC000121613441	195317504	/nfs/dbraw/zinc/31/75/04/195317504.db2.gz	CUHSTHUGSJZPTG-SCZZXKLOSA-N	1	1	320.271	1.399	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@H](O)C(F)(F)F)C2)nc1	ZINC000121613441	195317505	/nfs/dbraw/zinc/31/75/05/195317505.db2.gz	CUHSTHUGSJZPTG-SCZZXKLOSA-N	1	1	320.271	1.399	20	5		DDBDMO
C[C@@H](C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CC[NH+](C)CC1	ZINC000331013448	533314857	/nfs/dbraw/zinc/31/48/57/533314857.db2.gz	KNHPSMRBQBVBHC-JTQLQIEISA-N	1	1	310.329	1.308	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000292833131	292030467	/nfs/dbraw/zinc/03/04/67/292030467.db2.gz	PWKIKCVIFNWDOR-AOOOYVTPSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000292833131	292030470	/nfs/dbraw/zinc/03/04/70/292030470.db2.gz	PWKIKCVIFNWDOR-AOOOYVTPSA-N	1	1	308.338	1.305	20	5		DDBDMO
O=C1NCCCC[C@H]1[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000128736730	407565783	/nfs/dbraw/zinc/56/57/83/407565783.db2.gz	VQBBXXLRHUCNSZ-OAHLLOKOSA-N	1	1	318.377	1.386	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000079943480	407066121	/nfs/dbraw/zinc/06/61/21/407066121.db2.gz	ACKFFDPFOFNKGO-ZDUSSCGKSA-N	1	1	322.409	1.878	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@H]2CO)c2c(c1)COCO2	ZINC000052870883	407159493	/nfs/dbraw/zinc/15/94/93/407159493.db2.gz	FJMPRXQOSZFDRF-ZDUSSCGKSA-N	1	1	308.334	1.808	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]2CO)c2c(c1)COCO2	ZINC000052870883	407159498	/nfs/dbraw/zinc/15/94/98/407159498.db2.gz	FJMPRXQOSZFDRF-ZDUSSCGKSA-N	1	1	308.334	1.808	20	5		DDBDMO
CC[NH+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000103062315	407330410	/nfs/dbraw/zinc/33/04/10/407330410.db2.gz	IRPDQUWEWTZAQN-UHFFFAOYSA-N	1	1	323.349	1.146	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000097161133	407284401	/nfs/dbraw/zinc/28/44/01/407284401.db2.gz	RMXIEFRRTJHRFU-UHFFFAOYSA-N	1	1	303.322	1.249	20	5		DDBDMO
C[N@@H+]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000097161133	407284402	/nfs/dbraw/zinc/28/44/02/407284402.db2.gz	RMXIEFRRTJHRFU-UHFFFAOYSA-N	1	1	303.322	1.249	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000097161133	407284404	/nfs/dbraw/zinc/28/44/04/407284404.db2.gz	RMXIEFRRTJHRFU-UHFFFAOYSA-N	1	1	303.322	1.249	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000124319855	407354693	/nfs/dbraw/zinc/35/46/93/407354693.db2.gz	VTHTYBKRYNZQCH-YPMHNXCESA-N	1	1	323.397	1.431	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000103284071	407336042	/nfs/dbraw/zinc/33/60/42/407336042.db2.gz	ILKCSPUSYCBXHT-RYUDHWBXSA-N	1	1	307.350	1.559	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1O	ZINC000271012747	407469744	/nfs/dbraw/zinc/46/97/44/407469744.db2.gz	ZWMNPPCSHVPJIQ-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1O	ZINC000271012747	407469747	/nfs/dbraw/zinc/46/97/47/407469747.db2.gz	ZWMNPPCSHVPJIQ-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@]1(CCCO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000271173362	407554161	/nfs/dbraw/zinc/55/41/61/407554161.db2.gz	DUZLUPTXNLJIGG-INIZCTEOSA-N	1	1	321.377	1.821	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000170809391	407510721	/nfs/dbraw/zinc/51/07/21/407510721.db2.gz	SQYLJKVUPSKUAM-LBPRGKRZSA-N	1	1	322.365	1.139	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H](OCCO)C2)c1	ZINC000178862626	407630841	/nfs/dbraw/zinc/63/08/41/407630841.db2.gz	KQMCAXPNUNQWHU-GJZGRUSLSA-N	1	1	310.350	1.102	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000115577385	407697623	/nfs/dbraw/zinc/69/76/23/407697623.db2.gz	IUEVFRFEEPCCHE-OCCSQVGLSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000115577385	407697631	/nfs/dbraw/zinc/69/76/31/407697631.db2.gz	IUEVFRFEEPCCHE-OCCSQVGLSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1	ZINC000179035790	407698779	/nfs/dbraw/zinc/69/87/79/407698779.db2.gz	OYLXZPNWCCXJKE-LLVKDONJSA-N	1	1	309.391	1.648	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000272164028	407801606	/nfs/dbraw/zinc/80/16/06/407801606.db2.gz	ZSCCFCXYDDADKB-OLZOCXBDSA-N	1	1	321.377	1.740	20	5		DDBDMO
O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1COCC[NH2+]1	ZINC000238021749	407872858	/nfs/dbraw/zinc/87/28/58/407872858.db2.gz	YITAXBAEUBBQAM-AWEZNQCLSA-N	1	1	307.350	1.022	20	5		DDBDMO
CCOC(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173465525	407881513	/nfs/dbraw/zinc/88/15/13/407881513.db2.gz	LCMKLGYNMXOTNJ-LLVKDONJSA-N	1	1	308.338	1.429	20	5		DDBDMO
C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000134054573	407883053	/nfs/dbraw/zinc/88/30/53/407883053.db2.gz	RTOORFLEXWVDHX-RISCZKNCSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000134054573	407883060	/nfs/dbraw/zinc/88/30/60/407883060.db2.gz	RTOORFLEXWVDHX-RISCZKNCSA-N	1	1	322.365	1.113	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH+](CC)CC)C2)c1[N+](=O)[O-]	ZINC000174120559	407917424	/nfs/dbraw/zinc/91/74/24/407917424.db2.gz	NAWNDYRJJGMMJQ-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000272562887	407986486	/nfs/dbraw/zinc/98/64/86/407986486.db2.gz	UNRDILDCLUKAFC-JSGCOSHPSA-N	1	1	319.361	1.526	20	5		DDBDMO
CSCC[C@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245450842	407987522	/nfs/dbraw/zinc/98/75/22/407987522.db2.gz	OZRLKRWEXGKIDH-CMPLNLGQSA-N	1	1	302.400	1.226	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1	ZINC000189693499	408082618	/nfs/dbraw/zinc/08/26/18/408082618.db2.gz	CQBSLXVHWXBGCE-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@H](CC(N)=O)C2)cc1[N+](=O)[O-]	ZINC000175242749	408086496	/nfs/dbraw/zinc/08/64/96/408086496.db2.gz	CAZGNSMIEPJELL-NSHDSACASA-N	1	1	307.350	1.691	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@](C)(O)C1	ZINC000245901333	408094565	/nfs/dbraw/zinc/09/45/65/408094565.db2.gz	LFMJRECRFNCDEQ-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](C)(O)C1	ZINC000245901333	408094569	/nfs/dbraw/zinc/09/45/69/408094569.db2.gz	LFMJRECRFNCDEQ-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ncccc1[N+](=O)[O-]	ZINC000263753852	408241181	/nfs/dbraw/zinc/24/11/81/408241181.db2.gz	TUDJXGSXHTVBLE-ZDUSSCGKSA-N	1	1	321.381	1.344	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C[C@@H]2CCN(C(C)=O)C2)cc1[N+](=O)[O-]	ZINC000156510268	408258004	/nfs/dbraw/zinc/25/80/04/408258004.db2.gz	GMCWEYNDONKYFD-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
Cn1cc[nH+]c1Cn1cc([N+](=O)[O-])cc(Br)c1=O	ZINC000150924678	408226177	/nfs/dbraw/zinc/22/61/77/408226177.db2.gz	QBNUZVJBJDQDDH-UHFFFAOYSA-N	1	1	313.111	1.301	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000269350269	408279030	/nfs/dbraw/zinc/27/90/30/408279030.db2.gz	GHJDKIJYEOLNSI-SNVBAGLBSA-N	1	1	309.370	1.513	20	5		DDBDMO
CNC(=O)c1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176198198	408307015	/nfs/dbraw/zinc/30/70/15/408307015.db2.gz	ZGZJEWSEDWZBGY-UHFFFAOYSA-N	1	1	317.349	1.283	20	5		DDBDMO
CC1(C)COCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000263988119	408335653	/nfs/dbraw/zinc/33/56/53/408335653.db2.gz	ISQZDEUCICLLOI-UHFFFAOYSA-N	1	1	321.337	1.654	20	5		DDBDMO
CC1(C)COCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000263988119	408335660	/nfs/dbraw/zinc/33/56/60/408335660.db2.gz	ISQZDEUCICLLOI-UHFFFAOYSA-N	1	1	321.337	1.654	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000246819642	408347501	/nfs/dbraw/zinc/34/75/01/408347501.db2.gz	RHBTUNGJJKYYNF-SWLSCSKDSA-N	1	1	305.378	1.936	20	5		DDBDMO
CC[N@@H+]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	ZINC000159601938	408419501	/nfs/dbraw/zinc/41/95/01/408419501.db2.gz	XQOWJZBMTRSXLE-UHFFFAOYSA-N	1	1	322.350	1.405	20	5		DDBDMO
CC[N@H+]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1	ZINC000159601938	408419504	/nfs/dbraw/zinc/41/95/04/408419504.db2.gz	XQOWJZBMTRSXLE-UHFFFAOYSA-N	1	1	322.350	1.405	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000177208296	408552377	/nfs/dbraw/zinc/55/23/77/408552377.db2.gz	XBIIPUCODXXVPU-VIFPVBQESA-N	1	1	306.322	1.550	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000274986676	408575719	/nfs/dbraw/zinc/57/57/19/408575719.db2.gz	CPTWDUAJOKNQAM-VIFPVBQESA-N	1	1	300.746	1.146	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1O	ZINC000249527349	408736911	/nfs/dbraw/zinc/73/69/11/408736911.db2.gz	AGGVRCOBRWMDOF-YRGRVCCFSA-N	1	1	310.350	1.037	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000185238621	408785946	/nfs/dbraw/zinc/78/59/46/408785946.db2.gz	DAOMRIZYNDSUCS-UHFFFAOYSA-N	1	1	319.408	1.371	20	5		DDBDMO
CNC(=O)NC(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000178002687	408755161	/nfs/dbraw/zinc/75/51/61/408755161.db2.gz	ANDFIXXERQYYTJ-UHFFFAOYSA-N	1	1	320.349	1.405	20	5		DDBDMO
C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1	ZINC000276064260	408764827	/nfs/dbraw/zinc/76/48/27/408764827.db2.gz	LGVOVJUPBKKOKF-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCO[C@@]3(CCOC3)C2)c1	ZINC000185186719	408775984	/nfs/dbraw/zinc/77/59/84/408775984.db2.gz	OEFRDLYVSZPJEM-HNNXBMFYSA-N	1	1	308.334	1.465	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCO[C@@]3(CCOC3)C2)c1	ZINC000185186719	408775989	/nfs/dbraw/zinc/77/59/89/408775989.db2.gz	OEFRDLYVSZPJEM-HNNXBMFYSA-N	1	1	308.334	1.465	20	5		DDBDMO
C[N@@H+](CCCCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000276323430	408836240	/nfs/dbraw/zinc/83/62/40/408836240.db2.gz	DQJBGZCGXZDLJK-UHFFFAOYSA-N	1	1	313.329	1.767	20	5		DDBDMO
NC(=O)c1ccnc(NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000290986575	408856493	/nfs/dbraw/zinc/85/64/93/408856493.db2.gz	SKENCUVPBAIZIN-LLVKDONJSA-N	1	1	319.365	1.518	20	5		DDBDMO
CSc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000192515870	163224993	/nfs/dbraw/zinc/22/49/93/163224993.db2.gz	ZNQGYPXYDHPNNF-TXEJJXNPSA-N	1	1	321.402	1.950	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1(CO)CCC1	ZINC000292123164	408984487	/nfs/dbraw/zinc/98/44/87/408984487.db2.gz	KKODWHSZMCCWRK-GFCCVEGCSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(S(C)(=O)=O)C1	ZINC000292292623	409017874	/nfs/dbraw/zinc/01/78/74/409017874.db2.gz	UJHFWJWFSCCEAL-ZDUSSCGKSA-N	1	1	313.379	1.061	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(S(C)(=O)=O)C1	ZINC000292292623	409017878	/nfs/dbraw/zinc/01/78/78/409017878.db2.gz	UJHFWJWFSCCEAL-ZDUSSCGKSA-N	1	1	313.379	1.061	20	5		DDBDMO
Cc1cc(N(C)CC[N@@H+]2CCOC(C)(C)C2)ncc1[N+](=O)[O-]	ZINC000278895393	409108521	/nfs/dbraw/zinc/10/85/21/409108521.db2.gz	QETGGLGEJKPQJH-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
Cc1cc(N(C)CC[N@H+]2CCOC(C)(C)C2)ncc1[N+](=O)[O-]	ZINC000278895393	409108523	/nfs/dbraw/zinc/10/85/23/409108523.db2.gz	QETGGLGEJKPQJH-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](C)CC2)c1	ZINC000283555317	409175273	/nfs/dbraw/zinc/17/52/73/409175273.db2.gz	IGZDDYUOLBCLGI-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@H]([NH2+][C@H](CO)c1cnn(C)c1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284983346	409387657	/nfs/dbraw/zinc/38/76/57/409387657.db2.gz	GFNYMNOZRHTYML-TVQRCGJNSA-N	1	1	305.338	1.295	20	5		DDBDMO
C[C@H]1CN(CC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CCO1	ZINC000285368109	409414474	/nfs/dbraw/zinc/41/44/74/409414474.db2.gz	QSRWUTZASNXTLV-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000296064328	409416748	/nfs/dbraw/zinc/41/67/48/409416748.db2.gz	GIXSIFZOVZCAEL-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000296064328	409416753	/nfs/dbraw/zinc/41/67/53/409416753.db2.gz	GIXSIFZOVZCAEL-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
Cc1cccc(C(=O)NCCC[N@H+](C)CCN(C)C)c1[N+](=O)[O-]	ZINC000290598069	409457701	/nfs/dbraw/zinc/45/77/01/409457701.db2.gz	JEELESCZKZYZLY-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1cccc(C(=O)NCCCN(C)CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000290598069	409457705	/nfs/dbraw/zinc/45/77/05/409457705.db2.gz	JEELESCZKZYZLY-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC000408162483	164247659	/nfs/dbraw/zinc/24/76/59/164247659.db2.gz	XAEOYNQTOCJPND-UHFFFAOYSA-N	1	1	307.354	1.362	20	5		DDBDMO
CS[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000296285328	409491079	/nfs/dbraw/zinc/49/10/79/409491079.db2.gz	MYQWMPKSCVSILQ-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000296285328	409491083	/nfs/dbraw/zinc/49/10/83/409491083.db2.gz	MYQWMPKSCVSILQ-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000356853676	409664813	/nfs/dbraw/zinc/66/48/13/409664813.db2.gz	OCQLLPAPJFTRSG-NWDGAFQWSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)N(C)c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000296869529	409678868	/nfs/dbraw/zinc/67/88/68/409678868.db2.gz	VZEFLIVYGVZKDG-NSHDSACASA-N	1	1	319.365	1.628	20	5		DDBDMO
C[N@@H+](CCNc1nccc(C(N)=O)c1[N+](=O)[O-])C1CCCCC1	ZINC000357188547	409930373	/nfs/dbraw/zinc/93/03/73/409930373.db2.gz	MOLUAQLHADGXNB-UHFFFAOYSA-N	1	1	321.381	1.765	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000354580875	409950456	/nfs/dbraw/zinc/95/04/56/409950456.db2.gz	DCVPVFAROQESSF-RYUDHWBXSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357425040	410033595	/nfs/dbraw/zinc/03/35/95/410033595.db2.gz	RNABGSZGIMXGOO-STQMWFEESA-N	1	1	321.377	1.963	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H]1C	ZINC000346609480	410035559	/nfs/dbraw/zinc/03/55/59/410035559.db2.gz	CZPGRZWINQMHCX-BXUZGUMPSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000342922042	410002284	/nfs/dbraw/zinc/00/22/84/410002284.db2.gz	UAOJLNKCOJYTTK-SNVBAGLBSA-N	1	1	302.334	1.900	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000346636821	410050904	/nfs/dbraw/zinc/05/09/04/410050904.db2.gz	HYRLTIBECBWALE-NWDGAFQWSA-N	1	1	308.334	1.857	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000339389466	410149874	/nfs/dbraw/zinc/14/98/74/410149874.db2.gz	CCSAYMMOILPBAN-CVEARBPZSA-N	1	1	305.378	1.890	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000339393319	410154957	/nfs/dbraw/zinc/15/49/57/410154957.db2.gz	FOCNWHNXAFSCCW-IAGOWNOFSA-N	1	1	319.405	1.932	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]2CCC[C@H]21	ZINC000339721820	410417258	/nfs/dbraw/zinc/41/72/58/410417258.db2.gz	YPFODDBSGORYJY-MJBXVCDLSA-N	1	1	308.382	1.663	20	5		DDBDMO
CN1CC[NH+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CC1	ZINC000298727411	410369947	/nfs/dbraw/zinc/36/99/47/410369947.db2.gz	RBBSCFIOMATAAY-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+]2CC=C(C)CC2)c1[N+](=O)[O-]	ZINC000355341599	410456342	/nfs/dbraw/zinc/45/63/42/410456342.db2.gz	WXATXJOQGGJSIK-UHFFFAOYSA-N	1	1	307.354	1.019	20	5		DDBDMO
NC(=O)c1ccc(C[NH2+][C@H](CO)c2ccsc2)c([N+](=O)[O-])c1	ZINC000352031910	410432248	/nfs/dbraw/zinc/43/22/48/410432248.db2.gz	ICWRVNDSCOBYCM-GFCCVEGCSA-N	1	1	321.358	1.578	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](NC(N)=O)C1	ZINC000347361674	410495106	/nfs/dbraw/zinc/49/51/06/410495106.db2.gz	PWMBVKBYKCWAIX-YLBKJLTLSA-N	1	1	304.350	1.741	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN2C(=O)NC[C@@H]2C1	ZINC000347354525	410492506	/nfs/dbraw/zinc/49/25/06/410492506.db2.gz	BRXKZFUUVMRSGX-CUXKMMBLSA-N	1	1	316.361	1.708	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCN2C(=O)NC[C@@H]2C1	ZINC000347354525	410492513	/nfs/dbraw/zinc/49/25/13/410492513.db2.gz	BRXKZFUUVMRSGX-CUXKMMBLSA-N	1	1	316.361	1.708	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000355500535	410548226	/nfs/dbraw/zinc/54/82/26/410548226.db2.gz	DRVDVUKZJLVDLR-ZDUSSCGKSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CCC[N@H+]1C	ZINC000343583804	410551095	/nfs/dbraw/zinc/55/10/95/410551095.db2.gz	ZKEAPTRZIIRKNT-ONGXEEELSA-N	1	1	321.333	1.536	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1	ZINC000334042910	410626112	/nfs/dbraw/zinc/62/61/12/410626112.db2.gz	ZXBBAYIHMVIKSX-MNOVXSKESA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1c(CNC(=O)NCC2=CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000359538044	410717711	/nfs/dbraw/zinc/71/77/11/410717711.db2.gz	AZECNXWTFWNFPC-UHFFFAOYSA-N	1	1	318.377	1.964	20	5		DDBDMO
COc1c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000356003971	410772360	/nfs/dbraw/zinc/77/23/60/410772360.db2.gz	QXBJXKCUVIGDMM-LBPRGKRZSA-N	1	1	319.361	1.912	20	5		DDBDMO
Cn1nccc1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337459059	410802509	/nfs/dbraw/zinc/80/25/09/410802509.db2.gz	JJMXPDTYMYJUPK-UHFFFAOYSA-N	1	1	317.349	1.789	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCCNc1cccc(C)[nH+]1	ZINC000359750791	410854395	/nfs/dbraw/zinc/85/43/95/410854395.db2.gz	JNNJLPINAPIVBN-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
C[C@H]1[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080047	410935504	/nfs/dbraw/zinc/93/55/04/410935504.db2.gz	XGQMVQPEAGSVAE-TZMCWYRMSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080047	410935508	/nfs/dbraw/zinc/93/55/08/410935508.db2.gz	XGQMVQPEAGSVAE-TZMCWYRMSA-N	1	1	324.377	1.834	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356482082	411050476	/nfs/dbraw/zinc/05/04/76/411050476.db2.gz	QMWXPUXZLUVGOZ-UHFFFAOYSA-N	1	1	323.397	1.665	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356442879	411034156	/nfs/dbraw/zinc/03/41/56/411034156.db2.gz	DLHZDIHSQJDHJD-GFCCVEGCSA-N	1	1	323.397	1.713	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@H]1CO)c1ccc([N+](=O)[O-])o1	ZINC000134069314	196358642	/nfs/dbraw/zinc/35/86/42/196358642.db2.gz	QOCQLCURJKUPPO-NSHDSACASA-N	1	1	311.338	1.155	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1CCOc1ccc([N+](=O)[O-])cc1	ZINC000419322456	226113650	/nfs/dbraw/zinc/11/36/50/226113650.db2.gz	HKDGQTWFYUWDMQ-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C([C@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461927	418431819	/nfs/dbraw/zinc/43/18/19/418431819.db2.gz	SIWSWKUMUOWVGP-XUWVNRHRSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461927	418431821	/nfs/dbraw/zinc/43/18/21/418431821.db2.gz	SIWSWKUMUOWVGP-XUWVNRHRSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461927	418431824	/nfs/dbraw/zinc/43/18/24/418431824.db2.gz	SIWSWKUMUOWVGP-XUWVNRHRSA-N	1	1	315.373	1.242	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)[C@H](C)C1	ZINC000360740312	418504682	/nfs/dbraw/zinc/50/46/82/418504682.db2.gz	VZUDDLHQLRPBNV-GHMZBOCLSA-N	1	1	309.370	1.131	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])C1	ZINC000191830070	222109947	/nfs/dbraw/zinc/10/99/47/222109947.db2.gz	CCIZMBWZRZSUGB-LBPRGKRZSA-N	1	1	323.397	1.615	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)n1	ZINC000191814903	222110397	/nfs/dbraw/zinc/11/03/97/222110397.db2.gz	KYURIMWZMSHPGJ-QWRGUYRKSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@H]1C[C@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+]1C	ZINC000342362614	418627979	/nfs/dbraw/zinc/62/79/79/418627979.db2.gz	QRSDBNNVDMDYND-VHSXEESVSA-N	1	1	317.349	2.138	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2C(=O)NC[C@@H]2C1	ZINC000368230639	418707354	/nfs/dbraw/zinc/70/73/54/418707354.db2.gz	DYQZQBXUCHKQSW-TZMCWYRMSA-N	1	1	319.361	1.561	20	5		DDBDMO
C[C@@H]1[C@H]([NH3+])CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000297457807	227194547	/nfs/dbraw/zinc/19/45/47/227194547.db2.gz	XALVVPRTDQYMKI-LDYMZIIASA-N	1	1	303.322	1.423	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H]1CCCN1c1ncc([N+](=O)[O-])c(C)n1	ZINC000297536575	227272455	/nfs/dbraw/zinc/27/24/55/227272455.db2.gz	PONAQHYUCGVLNS-GFCCVEGCSA-N	1	1	302.338	1.867	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@H](CO)C1	ZINC000371688062	418808731	/nfs/dbraw/zinc/80/87/31/418808731.db2.gz	CLWUJUQLBRZLQK-UONOGXRCSA-N	1	1	324.377	1.429	20	5		DDBDMO
COC1(C[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)CCOCC1	ZINC000365426238	418859793	/nfs/dbraw/zinc/85/97/93/418859793.db2.gz	UXVYBMISGHFPKG-CYBMUJFWSA-N	1	1	324.381	1.624	20	5		DDBDMO
CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000372839452	418907106	/nfs/dbraw/zinc/90/71/06/418907106.db2.gz	OOYWVLVNBPGOQL-LSDHHAIUSA-N	1	1	318.377	1.422	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000420952403	419382141	/nfs/dbraw/zinc/38/21/41/419382141.db2.gz	XWDXCUIEEUJJLA-VXGBXAGGSA-N	1	1	322.361	1.912	20	5		DDBDMO
COC(=O)[C@H]1CN([C@H](C)c2ccccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000411912323	419475353	/nfs/dbraw/zinc/47/53/53/419475353.db2.gz	VGKZXMDOVOWJLI-CHWSQXEVSA-N	1	1	321.377	1.692	20	5		DDBDMO
C[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000428460083	419873409	/nfs/dbraw/zinc/87/34/09/419873409.db2.gz	FYAIIRXUAMBPQI-KXQLTZBTSA-N	1	1	305.378	1.606	20	5		DDBDMO
C[C@]12CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1C2(F)F	ZINC000428711731	419919945	/nfs/dbraw/zinc/91/99/45/419919945.db2.gz	LWUXKMKWCJRREG-TUAOUCFPSA-N	1	1	316.308	1.129	20	5		DDBDMO
CC(C)[C@H]([NH3+])CN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268590	419999260	/nfs/dbraw/zinc/99/92/60/419999260.db2.gz	GPSPLAYWGIKICB-BXUZGUMPSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@H](N)C[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268590	419999266	/nfs/dbraw/zinc/99/92/66/419999266.db2.gz	GPSPLAYWGIKICB-BXUZGUMPSA-N	1	1	308.382	1.885	20	5		DDBDMO
C[C@@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC000429385349	420009792	/nfs/dbraw/zinc/00/97/92/420009792.db2.gz	VKKVSZITFJTDHW-CYBMUJFWSA-N	1	1	307.398	1.598	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000416288733	420309153	/nfs/dbraw/zinc/30/91/53/420309153.db2.gz	DOQBJUWSBCELLG-VHSXEESVSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000416288733	420309154	/nfs/dbraw/zinc/30/91/54/420309154.db2.gz	DOQBJUWSBCELLG-VHSXEESVSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000452068432	420620428	/nfs/dbraw/zinc/62/04/28/420620428.db2.gz	NYJKOKVLTPWQKH-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000454728460	420916691	/nfs/dbraw/zinc/91/66/91/420916691.db2.gz	DOEWHNFFURFHCC-NSHDSACASA-N	1	1	321.381	1.493	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2c3ccccc3ncc2[N+](=O)[O-])C1	ZINC000487759924	421048410	/nfs/dbraw/zinc/04/84/10/421048410.db2.gz	IYHYDCWJWRKVTO-HNNXBMFYSA-N	1	1	302.334	1.043	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000456241255	421132499	/nfs/dbraw/zinc/13/24/99/421132499.db2.gz	LKMDYOYZMYLASV-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000456241255	421132502	/nfs/dbraw/zinc/13/25/02/421132502.db2.gz	LKMDYOYZMYLASV-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000456224095	421127400	/nfs/dbraw/zinc/12/74/00/421127400.db2.gz	LOSSAZNGQBTJER-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000456224095	421127404	/nfs/dbraw/zinc/12/74/04/421127404.db2.gz	LOSSAZNGQBTJER-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000456375102	421152393	/nfs/dbraw/zinc/15/23/93/421152393.db2.gz	JSICMMKFDVJTLI-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000456375102	421152400	/nfs/dbraw/zinc/15/24/00/421152400.db2.gz	JSICMMKFDVJTLI-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000523285000	421233341	/nfs/dbraw/zinc/23/33/41/421233341.db2.gz	PULOYRUZHBJPOQ-GFCCVEGCSA-N	1	1	323.397	1.373	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)cc1C	ZINC000507300162	421427232	/nfs/dbraw/zinc/42/72/32/421427232.db2.gz	OIBYYFXMYWCXLU-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)cc1C	ZINC000507300162	421427234	/nfs/dbraw/zinc/42/72/34/421427234.db2.gz	OIBYYFXMYWCXLU-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000550131558	421513829	/nfs/dbraw/zinc/51/38/29/421513829.db2.gz	CYUWLZHLWFFBOS-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@@H]1c1ccccc1	ZINC000548955261	421488749	/nfs/dbraw/zinc/48/87/49/421488749.db2.gz	ZACBQHAHPAFBLT-OLZOCXBDSA-N	1	1	315.333	1.493	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757792	421665484	/nfs/dbraw/zinc/66/54/84/421665484.db2.gz	IPIDADDNTKXNEM-GHMZBOCLSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757792	421665487	/nfs/dbraw/zinc/66/54/87/421665487.db2.gz	IPIDADDNTKXNEM-GHMZBOCLSA-N	1	1	313.379	1.279	20	5		DDBDMO
COc1ccc(CNC[C@H](O)C[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000571577281	421727532	/nfs/dbraw/zinc/72/75/32/421727532.db2.gz	JTEHJVNBWYISEM-ZDUSSCGKSA-N	1	1	309.366	1.148	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000520366853	421747050	/nfs/dbraw/zinc/74/70/50/421747050.db2.gz	IUZCQOXOYSTCJD-VXGBXAGGSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000541857754	421809171	/nfs/dbraw/zinc/80/91/71/421809171.db2.gz	XFHDOEKXXZVCRS-LLVKDONJSA-N	1	1	306.366	1.637	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000581894549	422063975	/nfs/dbraw/zinc/06/39/75/422063975.db2.gz	WRTQKEZMAAOIMR-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000574782370	422179420	/nfs/dbraw/zinc/17/94/20/422179420.db2.gz	DVJOWUYVBRGFAB-GFCCVEGCSA-N	1	1	323.397	1.758	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000575194969	422275330	/nfs/dbraw/zinc/27/53/30/422275330.db2.gz	XMOWTHKXZBZQOW-UHFFFAOYSA-N	1	1	307.354	1.198	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000575194969	422275335	/nfs/dbraw/zinc/27/53/35/422275335.db2.gz	XMOWTHKXZBZQOW-UHFFFAOYSA-N	1	1	307.354	1.198	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+](C2CCC2)C1	ZINC000344779105	272116680	/nfs/dbraw/zinc/11/66/80/272116680.db2.gz	UBHLKWZQEUIXSO-GFCCVEGCSA-N	1	1	320.393	1.880	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(N)c2F)CC1	ZINC000345004407	272154044	/nfs/dbraw/zinc/15/40/44/272154044.db2.gz	ANZCOJNAMTWKAZ-SNVBAGLBSA-N	1	1	312.345	1.209	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000345308424	272215680	/nfs/dbraw/zinc/21/56/80/272215680.db2.gz	WZBOILMMRLHXGD-UWVGGRQHSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@H]1C	ZINC000345962903	272376777	/nfs/dbraw/zinc/37/67/77/272376777.db2.gz	PTDVYNBGDNIVOT-GHMZBOCLSA-N	1	1	306.366	1.732	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000273152703	276381227	/nfs/dbraw/zinc/38/12/27/276381227.db2.gz	IGQHTGFELDVGAI-QWHCGFSZSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000332238814	280112034	/nfs/dbraw/zinc/11/20/34/280112034.db2.gz	UEXCPKNCNOOZAN-RYUDHWBXSA-N	1	1	321.377	1.986	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000354008937	298337874	/nfs/dbraw/zinc/33/78/74/298337874.db2.gz	UGRWBFGHVPOLFG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)CCO1	ZINC000362660939	300112052	/nfs/dbraw/zinc/11/20/52/300112052.db2.gz	BDPFYVDUDBEOEV-GFCCVEGCSA-N	1	1	319.365	1.416	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)CCO1	ZINC000362660939	300112054	/nfs/dbraw/zinc/11/20/54/300112054.db2.gz	BDPFYVDUDBEOEV-GFCCVEGCSA-N	1	1	319.365	1.416	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000362931669	300181585	/nfs/dbraw/zinc/18/15/85/300181585.db2.gz	RWJLHNYEROKIGY-ABAIWWIYSA-N	1	1	303.362	1.677	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000363103382	300211166	/nfs/dbraw/zinc/21/11/66/300211166.db2.gz	HVEBEGFFEYNWLO-KGLIPLIRSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000363699844	300298290	/nfs/dbraw/zinc/29/82/90/300298290.db2.gz	IZHDTXBHLAMCFQ-GFCCVEGCSA-N	1	1	305.334	1.611	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000364082713	300342089	/nfs/dbraw/zinc/34/20/89/300342089.db2.gz	JVISESNRMSOMRT-QWHCGFSZSA-N	1	1	318.377	1.750	20	5		DDBDMO
CCOc1cccc(N2CCC[N@H+]([C@H](C)CO)CC2)c1[N+](=O)[O-]	ZINC000368971676	301114046	/nfs/dbraw/zinc/11/40/46/301114046.db2.gz	CUANGJADJZOJGD-CYBMUJFWSA-N	1	1	323.393	1.886	20	5		DDBDMO
CCOc1cccc(N2CCC[N@H+]([C@@H](C)CO)CC2)c1[N+](=O)[O-]	ZINC000368971678	301114276	/nfs/dbraw/zinc/11/42/76/301114276.db2.gz	CUANGJADJZOJGD-ZDUSSCGKSA-N	1	1	323.393	1.886	20	5		DDBDMO
COC[C@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000369946823	301245103	/nfs/dbraw/zinc/24/51/03/301245103.db2.gz	COEHPQJDQYTXPG-ZDUSSCGKSA-N	1	1	309.366	1.505	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]12	ZINC000377673035	302208950	/nfs/dbraw/zinc/20/89/50/302208950.db2.gz	RLMNOGOHGSYJAW-BXUZGUMPSA-N	1	1	305.334	1.042	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000531888911	303264003	/nfs/dbraw/zinc/26/40/03/303264003.db2.gz	QHQRBICLPFQLJR-UHFFFAOYSA-N	1	1	306.366	1.984	20	5		DDBDMO
Cn1cccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000535785537	303352647	/nfs/dbraw/zinc/35/26/47/303352647.db2.gz	GJKLNQZUWSOTIG-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000536609389	303365678	/nfs/dbraw/zinc/36/56/78/303365678.db2.gz	ACOKVILHAYUQHL-CQSZACIVSA-N	1	1	319.409	1.596	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000367518652	307096254	/nfs/dbraw/zinc/09/62/54/307096254.db2.gz	NNYVOGQRNITPNH-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCN(C2CC[NH+](C)CC2)C1	ZINC000367518652	307096255	/nfs/dbraw/zinc/09/62/55/307096255.db2.gz	NNYVOGQRNITPNH-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCCC2	ZINC000375970043	307236803	/nfs/dbraw/zinc/23/68/03/307236803.db2.gz	SPGZQNRSTVKIGJ-UHFFFAOYSA-N	1	1	316.321	1.035	20	5		DDBDMO
C[C@H]1NC(=O)N(CC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])C1=O	ZINC000459464522	307307506	/nfs/dbraw/zinc/30/75/06/307307506.db2.gz	NJBXMIHBROHPPU-LLVKDONJSA-N	1	1	320.349	1.009	20	5		DDBDMO
Cn1cncc1CCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000575427243	308277190	/nfs/dbraw/zinc/27/71/90/308277190.db2.gz	NQEYIQIAXCMKAV-UHFFFAOYSA-N	1	1	301.350	1.714	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N2CC([NH+](C)C)C2)cc1[N+](=O)[O-]	ZINC000581545993	325872808	/nfs/dbraw/zinc/87/28/08/325872808.db2.gz	OFUBCQRBZBAVAG-UHFFFAOYSA-N	1	1	313.379	1.092	20	5		DDBDMO
CC1(C)C[NH+](CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000582310919	326011321	/nfs/dbraw/zinc/01/13/21/326011321.db2.gz	XLBITIIRJLAIHG-UHFFFAOYSA-N	1	1	303.362	1.821	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000488736786	484217291	/nfs/dbraw/zinc/21/72/91/484217291.db2.gz	QYWDMGOFQQFENW-JHJVBQTASA-N	1	1	310.350	1.037	20	5		DDBDMO
O=C(CC[N@@H+](C1CC1)C1COC1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000295583356	534392483	/nfs/dbraw/zinc/39/24/83/534392483.db2.gz	ZSQRREMHVLTWLE-UHFFFAOYSA-N	1	1	323.324	1.926	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+](C2CC2)C1	ZINC000452171276	534424313	/nfs/dbraw/zinc/42/43/13/534424313.db2.gz	POLDLVLVTKBHCP-NSHDSACASA-N	1	1	306.366	1.490	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000156348733	525782541	/nfs/dbraw/zinc/78/25/41/525782541.db2.gz	LFEMGIGGICXMBI-SNVBAGLBSA-N	1	1	309.322	1.205	20	5		DDBDMO
CC(C)(C)C[C@H]1CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000452080372	526272048	/nfs/dbraw/zinc/27/20/48/526272048.db2.gz	ORWXECISVDMYTJ-TZMCWYRMSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000458182392	528000048	/nfs/dbraw/zinc/00/00/48/528000048.db2.gz	DWBJNCARIAEUDQ-LLVKDONJSA-N	1	1	323.397	1.903	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])C(C)C	ZINC000433746805	528506241	/nfs/dbraw/zinc/50/62/41/528506241.db2.gz	IXSQAUUVPNAHJL-UHFFFAOYSA-N	1	1	311.386	1.901	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000068359547	696371493	/nfs/dbraw/zinc/37/14/93/696371493.db2.gz	IMGBBWSSOBKCRC-JTQLQIEISA-N	1	1	317.349	1.748	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000177215371	697411120	/nfs/dbraw/zinc/41/11/20/697411120.db2.gz	HVKRNRHHHKUJDP-OAHLLOKOSA-N	1	1	318.333	1.787	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749954323	700194391	/nfs/dbraw/zinc/19/43/91/700194391.db2.gz	MXFDCSDLZMVUJT-LLVKDONJSA-N	1	1	305.338	1.574	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857805	698144122	/nfs/dbraw/zinc/14/41/22/698144122.db2.gz	NCGWNULFYVHVQS-SMDDNHRTSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857805	698144125	/nfs/dbraw/zinc/14/41/25/698144125.db2.gz	NCGWNULFYVHVQS-SMDDNHRTSA-N	1	1	323.393	1.863	20	5		DDBDMO
CC1(C)CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000781961618	698666228	/nfs/dbraw/zinc/66/62/28/698666228.db2.gz	CREDUZISZOYTGM-HNNXBMFYSA-N	1	1	323.393	1.017	20	5		DDBDMO
CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000781961618	698666229	/nfs/dbraw/zinc/66/62/29/698666229.db2.gz	CREDUZISZOYTGM-HNNXBMFYSA-N	1	1	323.393	1.017	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000781961618	698666230	/nfs/dbraw/zinc/66/62/30/698666230.db2.gz	CREDUZISZOYTGM-HNNXBMFYSA-N	1	1	323.393	1.017	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](C2OCCO2)C1	ZINC000719001649	699297417	/nfs/dbraw/zinc/29/74/17/699297417.db2.gz	PUZXGDLAJXMSIG-LBPRGKRZSA-N	1	1	310.354	1.185	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C2)CN1	ZINC000789767330	699407389	/nfs/dbraw/zinc/40/73/89/699407389.db2.gz	IHYQQYABKMQJGI-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H](C)[NH+]1CCOCC1	ZINC000729469403	699479486	/nfs/dbraw/zinc/47/94/86/699479486.db2.gz	GINYIKKKAWDNCV-RYUDHWBXSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[C@@H](C[NH+]1CCN(C)CC1)Nc1nc2ccccn2c1[N+](=O)[O-]	ZINC000730109471	699501961	/nfs/dbraw/zinc/50/19/61/699501961.db2.gz	RVVKMGZAXFXPDF-LBPRGKRZSA-N	1	1	318.381	1.290	20	5		DDBDMO
C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)C1CC1	ZINC000732567147	699562908	/nfs/dbraw/zinc/56/29/08/699562908.db2.gz	ATGUZDLCPOBJIJ-UHFFFAOYSA-N	1	1	318.377	1.993	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000791255958	699617727	/nfs/dbraw/zinc/61/77/27/699617727.db2.gz	AWMIERYDCUSQTN-GXTWGEPZSA-N	1	1	322.340	1.435	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000739876149	699781863	/nfs/dbraw/zinc/78/18/63/699781863.db2.gz	XUKNFWZVRMORQS-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000796556222	699938753	/nfs/dbraw/zinc/93/87/53/699938753.db2.gz	ODHIYUYCDFVFIL-DAXOMENPSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000796556222	699938755	/nfs/dbraw/zinc/93/87/55/699938755.db2.gz	ODHIYUYCDFVFIL-DAXOMENPSA-N	1	1	322.361	1.508	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@H+]2CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000744349548	699946312	/nfs/dbraw/zinc/94/63/12/699946312.db2.gz	KSXNXPVMLBDNDE-LBPRGKRZSA-N	1	1	321.377	1.746	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@@H](C)C1	ZINC000761077379	700840895	/nfs/dbraw/zinc/84/08/95/700840895.db2.gz	RTSBDVIZGKKQQU-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768815888	701205687	/nfs/dbraw/zinc/20/56/87/701205687.db2.gz	XOTHTWNSEIUGRQ-QMMMGPOBSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[N@H+]1CCC[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768815888	701205691	/nfs/dbraw/zinc/20/56/91/701205691.db2.gz	XOTHTWNSEIUGRQ-QMMMGPOBSA-N	1	1	305.381	1.029	20	5		DDBDMO
COc1cccc(C(=O)OCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000769600249	701250072	/nfs/dbraw/zinc/25/00/72/701250072.db2.gz	KIKMHUHBNGUBOE-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)O[C@H]2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000810841890	701859915	/nfs/dbraw/zinc/85/99/15/701859915.db2.gz	RCVGLIZQNKHORD-QWRGUYRKSA-N	1	1	308.338	1.595	20	5		DDBDMO
CC1(C)CCN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1=O	ZINC000840057637	701943400	/nfs/dbraw/zinc/94/34/00/701943400.db2.gz	BKOZRLLBAPZAOT-UHFFFAOYSA-N	1	1	321.381	1.644	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]2C1	ZINC000812341437	702165125	/nfs/dbraw/zinc/16/51/25/702165125.db2.gz	GHQRELWQLBAHEP-MNOVXSKESA-N	1	1	307.325	1.758	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nc2ccccn2c1[N+](=O)[O-]	ZINC000842047198	702663576	/nfs/dbraw/zinc/66/35/76/702663576.db2.gz	MISZGXMZKAQFID-NWDGAFQWSA-N	1	1	319.365	1.134	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-]	ZINC000843780501	702922790	/nfs/dbraw/zinc/92/27/90/702922790.db2.gz	NBDFNFXLEDRWQC-UHFFFAOYSA-N	1	1	306.297	1.977	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000846636978	703305983	/nfs/dbraw/zinc/30/59/83/703305983.db2.gz	AFPLGTKOLADWOO-LLVKDONJSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000847175522	703384057	/nfs/dbraw/zinc/38/40/57/703384057.db2.gz	COZQWZIHHFRWHH-UPJWGTAASA-N	1	1	315.414	1.436	20	5		DDBDMO
C[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000847175522	703384058	/nfs/dbraw/zinc/38/40/58/703384058.db2.gz	COZQWZIHHFRWHH-UPJWGTAASA-N	1	1	315.414	1.436	20	5		DDBDMO
C[N@@H+]1CC[C@H](NC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848582256	703565552	/nfs/dbraw/zinc/56/55/52/703565552.db2.gz	JSPHDHUJEPBRDE-VIFPVBQESA-N	1	1	315.276	1.387	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000848582256	703565555	/nfs/dbraw/zinc/56/55/55/703565555.db2.gz	JSPHDHUJEPBRDE-VIFPVBQESA-N	1	1	315.276	1.387	20	5		DDBDMO
CC1(C)CC[NH2+]CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000866700490	706768878	/nfs/dbraw/zinc/76/88/78/706768878.db2.gz	YQYZLUJTKWUALF-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC1(C)CC[NH2+]CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000866700490	706768880	/nfs/dbraw/zinc/76/88/80/706768880.db2.gz	YQYZLUJTKWUALF-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000869801141	703854939	/nfs/dbraw/zinc/85/49/39/703854939.db2.gz	FGDYLNBIFMJXDH-LCGIIJARSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801141	703854941	/nfs/dbraw/zinc/85/49/41/703854941.db2.gz	FGDYLNBIFMJXDH-LCGIIJARSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801141	703854944	/nfs/dbraw/zinc/85/49/44/703854944.db2.gz	FGDYLNBIFMJXDH-LCGIIJARSA-N	1	1	317.389	1.536	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1	ZINC000852313496	704007461	/nfs/dbraw/zinc/00/74/61/704007461.db2.gz	IHIBQZHFUCGHFS-WFASDCNBSA-N	1	1	317.349	1.242	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCC2	ZINC000818969309	704037597	/nfs/dbraw/zinc/03/75/97/704037597.db2.gz	CPQYEHDJLBDYND-GWCFXTLKSA-N	1	1	317.349	1.517	20	5		DDBDMO
CN(C[C@@H]1CCCCO1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870871636	704152127	/nfs/dbraw/zinc/15/21/27/704152127.db2.gz	IXGPRTFMIMCAFM-HOCLYGCPSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCS1	ZINC000870881617	704155932	/nfs/dbraw/zinc/15/59/32/704155932.db2.gz	CUIAKVXXBIZNSV-YGRLFVJLSA-N	1	1	309.391	1.733	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)[C@H](C)CO1	ZINC000853798683	704317209	/nfs/dbraw/zinc/31/72/09/704317209.db2.gz	HOOZZDBGQIBENK-NXEZZACHSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)[C@H](C)CO1	ZINC000853798683	704317212	/nfs/dbraw/zinc/31/72/12/704317212.db2.gz	HOOZZDBGQIBENK-NXEZZACHSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@H]1C[N@H+](CCNC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](C)CO1	ZINC000855408681	704483228	/nfs/dbraw/zinc/48/32/28/704483228.db2.gz	XLUVLXSAPZJMHP-RYUDHWBXSA-N	1	1	301.387	1.047	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](C)CO1	ZINC000855408681	704483229	/nfs/dbraw/zinc/48/32/29/704483229.db2.gz	XLUVLXSAPZJMHP-RYUDHWBXSA-N	1	1	301.387	1.047	20	5		DDBDMO
CCN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1	ZINC000855485762	704487281	/nfs/dbraw/zinc/48/72/81/704487281.db2.gz	HDAFOBVEPBZZAU-CABCVRRESA-N	1	1	321.377	1.571	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1CO	ZINC000856795794	704539045	/nfs/dbraw/zinc/53/90/45/704539045.db2.gz	JZYGBHQKMXLJGP-PWSUYJOCSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1CO	ZINC000856795794	704539046	/nfs/dbraw/zinc/53/90/46/704539046.db2.gz	JZYGBHQKMXLJGP-PWSUYJOCSA-N	1	1	309.322	1.953	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000880309049	706936623	/nfs/dbraw/zinc/93/66/23/706936623.db2.gz	LRBCLHQURMLASF-LLVKDONJSA-N	1	1	322.287	1.753	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874830012	705187861	/nfs/dbraw/zinc/18/78/61/705187861.db2.gz	PRIKSHOALVPETQ-RYUDHWBXSA-N	1	1	319.365	1.340	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000874834926	705192358	/nfs/dbraw/zinc/19/23/58/705192358.db2.gz	VSDQGCGDVDSDSB-VXGBXAGGSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000874837366	705194108	/nfs/dbraw/zinc/19/41/08/705194108.db2.gz	IGUMGLORBWHUKB-QWHCGFSZSA-N	1	1	321.381	1.222	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2C	ZINC000874845030	705199638	/nfs/dbraw/zinc/19/96/38/705199638.db2.gz	FFHMFTMKXKPHGU-ZIAGYGMSSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000874846914	705201241	/nfs/dbraw/zinc/20/12/41/705201241.db2.gz	LNBKUOHJJLRLNO-CABCVRRESA-N	1	1	319.361	1.669	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000893877405	710871106	/nfs/dbraw/zinc/87/11/06/710871106.db2.gz	WRCHCWUTQHRLMY-DZGCQCFKSA-N	1	1	318.377	1.483	20	5		DDBDMO
CO[C@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000876955681	705937323	/nfs/dbraw/zinc/93/73/23/705937323.db2.gz	AMSUYRLCFUEGOZ-GOEBONIOSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000827338665	705979764	/nfs/dbraw/zinc/97/97/64/705979764.db2.gz	PZSGNMIGLFJPAO-GXTWGEPZSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[N@@H+](CCO)[C@H](C)C1	ZINC000877438393	706107399	/nfs/dbraw/zinc/10/73/99/706107399.db2.gz	NLMVRBPRUGEUHM-CYBMUJFWSA-N	1	1	307.394	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCN(CCO)[C@H](C)C1	ZINC000877438393	706107405	/nfs/dbraw/zinc/10/74/05/706107405.db2.gz	NLMVRBPRUGEUHM-CYBMUJFWSA-N	1	1	307.394	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCN(CCO)[C@H](C)C1	ZINC000877438393	706107411	/nfs/dbraw/zinc/10/74/11/706107411.db2.gz	NLMVRBPRUGEUHM-CYBMUJFWSA-N	1	1	307.394	1.710	20	5		DDBDMO
Cn1nnnc1CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000878201961	706326353	/nfs/dbraw/zinc/32/63/53/706326353.db2.gz	KOKRADHJEBSBRR-UHFFFAOYSA-N	1	1	302.338	1.325	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000880072854	706870985	/nfs/dbraw/zinc/87/09/85/706870985.db2.gz	MZCVEZREOHIWAM-UONOGXRCSA-N	1	1	309.341	1.375	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)CC[C@H]21	ZINC000872725089	707573331	/nfs/dbraw/zinc/57/33/31/707573331.db2.gz	ORLJVDWTQBFOKT-SWLSCSKDSA-N	1	1	315.377	1.928	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000882489196	707660376	/nfs/dbraw/zinc/66/03/76/707660376.db2.gz	NXXXPUCWELWXRP-JTQLQIEISA-N	1	1	302.334	1.900	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000882495371	707665917	/nfs/dbraw/zinc/66/59/17/707665917.db2.gz	YHLZDHWDSQPEMX-AWEZNQCLSA-N	1	1	319.361	1.768	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000882495371	707665920	/nfs/dbraw/zinc/66/59/20/707665920.db2.gz	YHLZDHWDSQPEMX-AWEZNQCLSA-N	1	1	319.361	1.768	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000838149910	707854823	/nfs/dbraw/zinc/85/48/23/707854823.db2.gz	QVFGMSBKQPIDNR-DOMZBBRYSA-N	1	1	321.377	1.476	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3C[C@@]34CCOC4)C2)nc1	ZINC000886067100	708691530	/nfs/dbraw/zinc/69/15/30/708691530.db2.gz	HFLYJRLAWYNQBR-XJKCOSOUSA-N	1	1	318.377	1.903	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)C[C@]2(C)C1	ZINC000887927995	709167763	/nfs/dbraw/zinc/16/77/63/709167763.db2.gz	RDLIHKIITMYVRV-BMIGLBTASA-N	1	1	304.350	1.201	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+](C)CCO	ZINC000899741444	709185764	/nfs/dbraw/zinc/18/57/64/709185764.db2.gz	XXCGPYKPASDRRP-QXMHVHEDSA-N	1	1	307.350	1.038	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C)CC[N@@H+](C)CC1	ZINC000888993864	709426177	/nfs/dbraw/zinc/42/61/77/709426177.db2.gz	JZDRFHLNTRXIEG-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C)CC[N@H+](C)CC1	ZINC000888993864	709426178	/nfs/dbraw/zinc/42/61/78/709426178.db2.gz	JZDRFHLNTRXIEG-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000928434471	713194185	/nfs/dbraw/zinc/19/41/85/713194185.db2.gz	DZEZKJQHPJYNKJ-WCBMZHEXSA-N	1	1	307.306	1.146	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928441884	713197483	/nfs/dbraw/zinc/19/74/83/713197483.db2.gz	PTMZBRMUWIOEHC-YGRLFVJLSA-N	1	1	316.361	1.827	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928444673	713198775	/nfs/dbraw/zinc/19/87/75/713198775.db2.gz	LQNYSNGWTNEZQQ-RYUDHWBXSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000928555235	713224835	/nfs/dbraw/zinc/22/48/35/713224835.db2.gz	MLPHWUVFSQGBII-LLVKDONJSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000928555235	713224837	/nfs/dbraw/zinc/22/48/37/713224837.db2.gz	MLPHWUVFSQGBII-LLVKDONJSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC000928571269	713233551	/nfs/dbraw/zinc/23/35/51/713233551.db2.gz	KPZFJCIUAZOXRP-QMMMGPOBSA-N	1	1	301.705	1.821	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC000928571269	713233553	/nfs/dbraw/zinc/23/35/53/713233553.db2.gz	KPZFJCIUAZOXRP-QMMMGPOBSA-N	1	1	301.705	1.821	20	5		DDBDMO
COc1c(O)ccc(CN(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000894477076	711141005	/nfs/dbraw/zinc/14/10/05/711141005.db2.gz	MBABLXOTLDGCID-UHFFFAOYSA-N	1	1	309.366	1.835	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1CO	ZINC000894884476	711307882	/nfs/dbraw/zinc/30/78/82/711307882.db2.gz	FXIXXUJDFWOVKV-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@@H]1CO	ZINC000894884476	711307887	/nfs/dbraw/zinc/30/78/87/711307887.db2.gz	FXIXXUJDFWOVKV-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CC[C@H](Cc2nc(Cc3ccc([N+](=O)[O-])cn3)no2)C1	ZINC000904022655	711365169	/nfs/dbraw/zinc/36/51/69/711365169.db2.gz	GRFYHYBHVJVFIP-SNVBAGLBSA-N	1	1	303.322	1.458	20	5		DDBDMO
CON(C)C(=O)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000895041324	711381683	/nfs/dbraw/zinc/38/16/83/711381683.db2.gz	SBGGDKBNVIZHAY-UHFFFAOYSA-N	1	1	319.317	1.964	20	5		DDBDMO
C[N@@H+](CCO)CCNc1c2cc(Cl)ccc2ncc1[N+](=O)[O-]	ZINC000895240860	711462050	/nfs/dbraw/zinc/46/20/50/711462050.db2.gz	NYFNMZDVSVVXCB-UHFFFAOYSA-N	1	1	324.768	1.554	20	5		DDBDMO
Cc1nc(NCC[N@@H+]2CCC3(C2)OCCO3)ccc1[N+](=O)[O-]	ZINC000895253312	711467478	/nfs/dbraw/zinc/46/74/78/711467478.db2.gz	ARBCTCIJJFSVIO-UHFFFAOYSA-N	1	1	308.338	1.159	20	5		DDBDMO
Cc1nc(NCC[N@H+]2CCC3(C2)OCCO3)ccc1[N+](=O)[O-]	ZINC000895253312	711467479	/nfs/dbraw/zinc/46/74/79/711467479.db2.gz	ARBCTCIJJFSVIO-UHFFFAOYSA-N	1	1	308.338	1.159	20	5		DDBDMO
Cc1cc(NCC[N@@H+]2CCC3(C2)OCCO3)ccc1[N+](=O)[O-]	ZINC000895254307	711467932	/nfs/dbraw/zinc/46/79/32/711467932.db2.gz	SCXSQBJPCNCEOP-UHFFFAOYSA-N	1	1	307.350	1.764	20	5		DDBDMO
Cc1cc(NCC[N@H+]2CCC3(C2)OCCO3)ccc1[N+](=O)[O-]	ZINC000895254307	711467934	/nfs/dbraw/zinc/46/79/34/711467934.db2.gz	SCXSQBJPCNCEOP-UHFFFAOYSA-N	1	1	307.350	1.764	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H](C)[C@](C)(CO)C2)c1[N+](=O)[O-]	ZINC000895455596	711516336	/nfs/dbraw/zinc/51/63/36/711516336.db2.gz	CFMMLIRKVBKSCM-BONVTDFDSA-N	1	1	310.350	1.759	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000921420070	713765003	/nfs/dbraw/zinc/76/50/03/713765003.db2.gz	SOGXMXMXETZVPT-NSHDSACASA-N	1	1	312.757	1.752	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000930361979	713813829	/nfs/dbraw/zinc/81/38/29/713813829.db2.gz	AWGXOEAAVUAMEK-KCPJHIHWSA-N	1	1	303.362	1.766	20	5		DDBDMO
Cc1c(C[N@@H+]2CCc3c(=O)[nH]n(C)c3C2)cccc1[N+](=O)[O-]	ZINC000931197859	714032343	/nfs/dbraw/zinc/03/23/43/714032343.db2.gz	RUYZYACTGUFLIW-UHFFFAOYSA-N	1	1	302.334	1.901	20	5		DDBDMO
Cc1c(C[N@H+]2CCc3c(=O)[nH]n(C)c3C2)cccc1[N+](=O)[O-]	ZINC000931197859	714032344	/nfs/dbraw/zinc/03/23/44/714032344.db2.gz	RUYZYACTGUFLIW-UHFFFAOYSA-N	1	1	302.334	1.901	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(CCn3cc([N+](=O)[O-])ccc3=O)C[C@@]2(C)C1	ZINC000931311826	714062647	/nfs/dbraw/zinc/06/26/47/714062647.db2.gz	PQEPZGCCPZGLNW-IYBDPMFKSA-N	1	1	320.393	1.030	20	5		DDBDMO
O=C1[C@@H](N2CCn3cc[nH+]c32)CCN1c1cccc([N+](=O)[O-])c1	ZINC000931521358	714118512	/nfs/dbraw/zinc/11/85/12/714118512.db2.gz	FYSDVCUCKBFHSR-ZDUSSCGKSA-N	1	1	313.317	1.417	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C(=O)NCC1(C)C	ZINC000931664233	714154453	/nfs/dbraw/zinc/15/44/53/714154453.db2.gz	YJHPXQNTGVOOHD-CQSZACIVSA-N	1	1	321.377	1.996	20	5		DDBDMO
CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1	ZINC000923335927	714319645	/nfs/dbraw/zinc/31/96/45/714319645.db2.gz	SGXPIPUFIDIMDB-KGLIPLIRSA-N	1	1	323.393	1.408	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@H]1[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923371047	714331541	/nfs/dbraw/zinc/33/15/41/714331541.db2.gz	URIYHHQVQCWIBF-JXFSHQFZSA-N	1	1	323.393	1.311	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934252387	714774832	/nfs/dbraw/zinc/77/48/32/714774832.db2.gz	MOODQSACGBAKRJ-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H]2[C@H]1CCCN2CCO	ZINC000934252387	714774835	/nfs/dbraw/zinc/77/48/35/714774835.db2.gz	MOODQSACGBAKRJ-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H]2[C@H]1CCCN2CCO	ZINC000934252387	714774836	/nfs/dbraw/zinc/77/48/36/714774836.db2.gz	MOODQSACGBAKRJ-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)c1	ZINC000934255651	714776475	/nfs/dbraw/zinc/77/64/75/714776475.db2.gz	UYKMPXXWQJCOLF-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000935965028	715140685	/nfs/dbraw/zinc/14/06/85/715140685.db2.gz	VYFJGQHJLQXEAC-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
Nc1nc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)ccc1[N+](=O)[O-]	ZINC001164773961	721291382	/nfs/dbraw/zinc/29/13/82/721291382.db2.gz	UURIOTPWKLPOIY-UHFFFAOYSA-N	1	1	303.366	1.494	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000610514186	721901649	/nfs/dbraw/zinc/90/16/49/721901649.db2.gz	JSCUDUBLNRXPJZ-AWEZNQCLSA-N	1	1	306.366	1.599	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1	ZINC001022064171	734369067	/nfs/dbraw/zinc/36/90/67/734369067.db2.gz	ZGANVFSRBYMGAX-QKPAOTATSA-N	1	1	317.389	1.705	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)N2C/C=C\Cl	ZINC001039583278	735103343	/nfs/dbraw/zinc/10/33/43/735103343.db2.gz	KBWCYMQQKSOUMM-NHPWBWSGSA-N	1	1	313.785	1.469	20	5		DDBDMO
CCCc1ccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001126936430	742830514	/nfs/dbraw/zinc/83/05/14/742830514.db2.gz	HJXBKHRCLUJKDQ-HUUCEWRRSA-N	1	1	305.378	1.510	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC001121698906	744859681	/nfs/dbraw/zinc/85/96/81/744859681.db2.gz	LUVJVWAONGESML-TUAOUCFPSA-N	1	1	308.386	1.166	20	5		DDBDMO
O=[N+]([O-])c1c2[nH]cnc2ccc1NCC1([NH+]2CCCC2)COC1	ZINC001168448034	745064243	/nfs/dbraw/zinc/06/42/43/745064243.db2.gz	OMHHWDCQESHQIY-UHFFFAOYSA-N	1	1	317.349	1.748	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CC2CC3(CCC3)C2)CC1	ZINC000996440914	749574857	/nfs/dbraw/zinc/57/48/57/749574857.db2.gz	OUHBOFJCFDFJBO-HUUCEWRRSA-N	1	1	321.421	1.813	20	5		DDBDMO
O=C(NCC1([NH2+]CC2CCC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001115530807	751048707	/nfs/dbraw/zinc/04/87/07/751048707.db2.gz	SINIVLDOFORJKT-ZIAGYGMSSA-N	1	1	309.410	1.860	20	5		DDBDMO
COc1ccccc1C1([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)COC1	ZINC001168994065	762167485	/nfs/dbraw/zinc/16/74/85/762167485.db2.gz	OLFLAOADKUUQCA-OLZOCXBDSA-N	1	1	306.362	1.956	20	5		DDBDMO
O=C1c2ccccc2[C@@H]2C[N@@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)CCN12	ZINC001169010276	762178012	/nfs/dbraw/zinc/17/80/12/762178012.db2.gz	CCIKQPDPOMNBPE-XEZPLFJOSA-N	1	1	315.373	1.945	20	5		DDBDMO
O=C([C@@H]1CCCC[N@@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1)N1CCCC1	ZINC001169024995	762202584	/nfs/dbraw/zinc/20/25/84/762202584.db2.gz	IKACOTZHJRNTKI-ZNMIVQPWSA-N	1	1	309.410	1.909	20	5		DDBDMO
CN1CCN(C2CC[NH+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)CC1	ZINC001169026326	762203107	/nfs/dbraw/zinc/20/31/07/762203107.db2.gz	KVKJFFNMTGJGMT-ZBFHGGJFSA-N	1	1	310.442	1.144	20	5		DDBDMO
O=C1[C@H]2C[N@@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2CN1CC1CC1	ZINC001169025219	762203665	/nfs/dbraw/zinc/20/36/65/762203665.db2.gz	YDZUWGPWPFHOBM-BARDWOONSA-N	1	1	307.394	1.232	20	5		DDBDMO
Cc1ccccc1C[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086363463	761493159	/nfs/dbraw/zinc/49/31/59/761493159.db2.gz	VRTBPFOWQGSUTP-DTZQCDIJSA-N	1	1	317.389	1.645	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CCCCCC2)C1	ZINC001042706168	764374703	/nfs/dbraw/zinc/37/47/03/764374703.db2.gz	WIVIUSMPPAPBGC-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1	ZINC001129933625	767052638	/nfs/dbraw/zinc/05/26/38/767052638.db2.gz	XYRSOQXDLCWRTH-FPCVCCKLSA-N	1	1	315.373	1.385	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[N@H+](Cc3ccccc3)[C@H]2C1	ZINC001129933625	767052647	/nfs/dbraw/zinc/05/26/47/767052647.db2.gz	XYRSOQXDLCWRTH-FPCVCCKLSA-N	1	1	315.373	1.385	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1	ZINC001129933625	767052656	/nfs/dbraw/zinc/05/26/56/767052656.db2.gz	XYRSOQXDLCWRTH-FPCVCCKLSA-N	1	1	315.373	1.385	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1	ZINC001101634711	777331264	/nfs/dbraw/zinc/33/12/64/777331264.db2.gz	JZBVYWUJAHTMKB-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](c2nn[nH]n2)C1	ZINC001175698009	777863948	/nfs/dbraw/zinc/86/39/48/777863948.db2.gz	JTDWPXODDKOWED-VIFPVBQESA-N	1	1	308.729	1.751	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@H](c2nn[nH]n2)C1	ZINC001175698009	777863958	/nfs/dbraw/zinc/86/39/58/777863958.db2.gz	JTDWPXODDKOWED-VIFPVBQESA-N	1	1	308.729	1.751	20	5		DDBDMO
O=C(NCCCCCC[NH2+]Cc1ccccn1)[C@@H]1CC1[N+](=O)[O-]	ZINC001178458723	779059078	/nfs/dbraw/zinc/05/90/78/779059078.db2.gz	VEBCZMSTIUMIFS-HUUCEWRRSA-N	1	1	320.393	1.513	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC001178861627	779214428	/nfs/dbraw/zinc/21/44/28/779214428.db2.gz	ZTUYTTYAVOLZMJ-CQSZACIVSA-N	1	1	321.377	1.820	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1c(C)cccc1C	ZINC001267240889	837586546	/nfs/dbraw/zinc/58/65/46/837586546.db2.gz	BZVLXLNKVGHBKI-GDBMZVCRSA-N	1	1	319.405	1.907	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)cccc1C	ZINC001267240889	837586555	/nfs/dbraw/zinc/58/65/55/837586555.db2.gz	BZVLXLNKVGHBKI-GDBMZVCRSA-N	1	1	319.405	1.907	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)cccc1C	ZINC001267240889	837586560	/nfs/dbraw/zinc/58/65/60/837586560.db2.gz	BZVLXLNKVGHBKI-GDBMZVCRSA-N	1	1	319.405	1.907	20	5		DDBDMO
Cc1ccc(F)cc1C[NH2+]C/C=C/CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268544108	840422681	/nfs/dbraw/zinc/42/26/81/840422681.db2.gz	ZHGZZWFUYQTLER-SWVJOTTGSA-N	1	1	321.352	1.561	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccc(F)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001327212482	861966058	/nfs/dbraw/zinc/96/60/58/861966058.db2.gz	IPHQWVKIATVWQW-HUUCEWRRSA-N	1	1	323.368	1.771	20	5		DDBDMO
CN(CCC[N@H+](C)Cc1ccc(F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001327212482	861966070	/nfs/dbraw/zinc/96/60/70/861966070.db2.gz	IPHQWVKIATVWQW-HUUCEWRRSA-N	1	1	323.368	1.771	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccc(F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001327212482	861966076	/nfs/dbraw/zinc/96/60/76/861966076.db2.gz	IPHQWVKIATVWQW-HUUCEWRRSA-N	1	1	323.368	1.771	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001293855046	849612057	/nfs/dbraw/zinc/61/20/57/849612057.db2.gz	LHQXWTIHCFXOFB-HTQZYQBOSA-N	1	1	315.761	1.384	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc2ccc3cccnc3c2n1	ZINC001156621460	863198679	/nfs/dbraw/zinc/19/86/79/863198679.db2.gz	WKNUQHZJGRQSKS-UHFFFAOYSA-N	1	1	302.341	1.907	20	5		DDBDMO
CN1CCOC[C@H]1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001158707137	864832336	/nfs/dbraw/zinc/83/23/36/864832336.db2.gz	IYLLHDKHYJBUSH-MUBLQREKSA-N	1	1	321.381	1.265	20	5		DDBDMO
Cc1cccc(N2CCN(c3nc(C)ncc3[N+](=O)[O-])CC2)[nH+]1	ZINC001163660644	868601624	/nfs/dbraw/zinc/60/16/24/868601624.db2.gz	TXSKVFLXNWEMNB-UHFFFAOYSA-N	1	1	314.349	1.723	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])ccc1OC1CC[NH+](CCF)CC1	ZINC001226167402	882242664	/nfs/dbraw/zinc/24/26/64/882242664.db2.gz	IUDPIYAYVIZDGR-UHFFFAOYSA-N	1	1	311.313	1.506	20	5		DDBDMO
COc1cc(C)nc(N2CCn3c(C)[nH+]cc3C2)c1[N+](=O)[O-]	ZINC001165385338	869555950	/nfs/dbraw/zinc/55/59/50/869555950.db2.gz	LQOLGQUEXXXAGM-UHFFFAOYSA-N	1	1	303.322	1.832	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001338083764	869791357	/nfs/dbraw/zinc/79/13/57/869791357.db2.gz	JKWFCLSDLNHXRD-PWSUYJOCSA-N	1	1	309.370	1.045	20	5		DDBDMO
Cc1[nH+]ccn1CCCn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC001319598157	872709859	/nfs/dbraw/zinc/70/98/59/872709859.db2.gz	LIXJLXFAWOWLTP-UHFFFAOYSA-N	1	1	307.266	1.260	20	5		DDBDMO
Cc1cc(NC(=O)[C@H](C)N2CC[NH+](C)CC2)cc([N+](=O)[O-])c1	ZINC001348844307	874824013	/nfs/dbraw/zinc/82/40/13/874824013.db2.gz	VKRASQWFNKADNG-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C2	ZINC001349940299	875465991	/nfs/dbraw/zinc/46/59/91/875465991.db2.gz	YYJKFQGEHANQBD-WFASDCNBSA-N	1	1	322.365	1.641	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C2	ZINC001349940299	875466004	/nfs/dbraw/zinc/46/60/04/875466004.db2.gz	YYJKFQGEHANQBD-WFASDCNBSA-N	1	1	322.365	1.641	20	5		DDBDMO
CN1C(=O)C[C@@H]([NH2+]CC[N+](=O)[O-])[C@@H]1c1ccc(Cl)c(F)c1	ZINC001351401422	876231738	/nfs/dbraw/zinc/23/17/38/876231738.db2.gz	VKFBOLUBSIDNLW-YPMHNXCESA-N	1	1	315.732	1.617	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001352216036	876649824	/nfs/dbraw/zinc/64/98/24/876649824.db2.gz	GNLJMOFSEWSNBC-GFCCVEGCSA-N	1	1	303.362	1.821	20	5		DDBDMO
Nc1ncc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC001300131227	876970896	/nfs/dbraw/zinc/97/08/96/876970896.db2.gz	ODWSCNNCXSVDSC-VXGBXAGGSA-N	1	1	319.365	1.319	20	5		DDBDMO
COC(=O)c1c(COC[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC001223296149	880911655	/nfs/dbraw/zinc/91/16/55/880911655.db2.gz	YFHAKBRSCWWWCG-GFCCVEGCSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1c(COC[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC001223296149	880911660	/nfs/dbraw/zinc/91/16/60/880911660.db2.gz	YFHAKBRSCWWWCG-GFCCVEGCSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)[C@@H](OC[C@@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647076	881042984	/nfs/dbraw/zinc/04/29/84/881042984.db2.gz	IXRPVYXXCFOALR-FZMZJTMJSA-N	1	1	324.333	1.156	20	5		DDBDMO
COC(=O)[C@@H](OC[C@@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647076	881043001	/nfs/dbraw/zinc/04/30/01/881043001.db2.gz	IXRPVYXXCFOALR-FZMZJTMJSA-N	1	1	324.333	1.156	20	5		DDBDMO
O=[N+]([O-])c1c[nH]cc2nc(OC3CC[NH+](CCF)CC3)nc1-2	ZINC001230230603	884381463	/nfs/dbraw/zinc/38/14/63/884381463.db2.gz	WOZCGOZXRZRFEZ-UHFFFAOYSA-N	1	1	309.301	1.679	20	5		DDBDMO
C[N@H+](CCCNC(=O)c1cocn1)Cc1csc([N+](=O)[O-])c1	ZINC001235714797	888907368	/nfs/dbraw/zinc/90/73/68/888907368.db2.gz	BKXYKMWZWAKSIH-UHFFFAOYSA-N	1	1	324.362	1.896	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cocn1)Cc1csc([N+](=O)[O-])c1	ZINC001235714797	888907379	/nfs/dbraw/zinc/90/73/79/888907379.db2.gz	BKXYKMWZWAKSIH-UHFFFAOYSA-N	1	1	324.362	1.896	20	5		DDBDMO
[NH3+]C1(c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)CCC(=O)CC1	ZINC001249369318	893945334	/nfs/dbraw/zinc/94/53/34/893945334.db2.gz	ZCXMHBJAHURKIV-UHFFFAOYSA-N	1	1	321.268	1.476	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(C2COC2)CC1	ZINC001254550939	896498347	/nfs/dbraw/zinc/49/83/47/896498347.db2.gz	TUGQMJZMFOMTQD-CYBMUJFWSA-N	1	1	305.378	1.542	20	5		DDBDMO
C[N@@H+](C1CN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)[C@H]1CCOC1	ZINC001254604616	896528772	/nfs/dbraw/zinc/52/87/72/896528772.db2.gz	WWFNXFGEJQDQEA-JKSUJKDBSA-N	1	1	317.389	1.467	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC12CC2	ZINC001254611169	896533349	/nfs/dbraw/zinc/53/33/49/896533349.db2.gz	WPLVLYLUIDFOBV-GJZGRUSLSA-N	1	1	316.357	1.947	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC001262725516	900337137	/nfs/dbraw/zinc/33/71/37/900337137.db2.gz	YWPUOKDYXNPLGK-PSOPSSQASA-N	1	1	318.377	1.707	20	5		DDBDMO
C[N@H+](C/C=C\c1ccccc1)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001264985077	901394028	/nfs/dbraw/zinc/39/40/28/901394028.db2.gz	LUJKBWIHTWSMBL-PLHDSQEVSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@@H+](C/C=C\c1ccccc1)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985077	901394036	/nfs/dbraw/zinc/39/40/36/901394036.db2.gz	LUJKBWIHTWSMBL-PLHDSQEVSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@H+](C/C=C\c1ccccc1)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985077	901394043	/nfs/dbraw/zinc/39/40/43/901394043.db2.gz	LUJKBWIHTWSMBL-PLHDSQEVSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000249002299	282126021	/nfs/dbraw/zinc/12/60/21/282126021.db2.gz	YYGXMRRHQPYISJ-YRGRVCCFSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305756637	231040756	/nfs/dbraw/zinc/04/07/56/231040756.db2.gz	CTVDNZOZQZCBST-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305756637	231040758	/nfs/dbraw/zinc/04/07/58/231040758.db2.gz	CTVDNZOZQZCBST-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323660	529466489	/nfs/dbraw/zinc/46/64/89/529466489.db2.gz	LEVBSTVXRRJKCY-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323660	529466492	/nfs/dbraw/zinc/46/64/92/529466492.db2.gz	LEVBSTVXRRJKCY-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323660	529466496	/nfs/dbraw/zinc/46/64/96/529466496.db2.gz	LEVBSTVXRRJKCY-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000444323660	529466497	/nfs/dbraw/zinc/46/64/97/529466497.db2.gz	LEVBSTVXRRJKCY-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000452072221	231290387	/nfs/dbraw/zinc/29/03/87/231290387.db2.gz	WIVAFEZXICPFTG-SMDDNHRTSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@@H]2CCCC[N@H+]2CCO)cc1[N+](=O)[O-]	ZINC000452363982	231361937	/nfs/dbraw/zinc/36/19/37/231361937.db2.gz	ADAOOBYUIQBQFM-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000614924735	362081178	/nfs/dbraw/zinc/08/11/78/362081178.db2.gz	LFCDNRKGILYDDC-LLVKDONJSA-N	1	1	322.287	1.835	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000614924735	362081182	/nfs/dbraw/zinc/08/11/82/362081182.db2.gz	LFCDNRKGILYDDC-LLVKDONJSA-N	1	1	322.287	1.835	20	5		DDBDMO
Cc1nn(C)c(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000488736629	282270856	/nfs/dbraw/zinc/27/08/56/282270856.db2.gz	VIZKZPOXXSEUNP-NQBHXWOUSA-N	1	1	307.398	1.803	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000451629640	529797863	/nfs/dbraw/zinc/79/78/63/529797863.db2.gz	KPBSYVVUHFRNKH-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1CC[C@@H]2C[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000451629640	529797864	/nfs/dbraw/zinc/79/78/64/529797864.db2.gz	KPBSYVVUHFRNKH-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1CC[C@@H]2C[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000451629640	529797866	/nfs/dbraw/zinc/79/78/66/529797866.db2.gz	KPBSYVVUHFRNKH-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C1CC1	ZINC000457169879	529883903	/nfs/dbraw/zinc/88/39/03/529883903.db2.gz	PWKNCEJLTVIALB-UHFFFAOYSA-N	1	1	308.338	1.300	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-]	ZINC000302250298	529903317	/nfs/dbraw/zinc/90/33/17/529903317.db2.gz	MNNBAYIGOCGVND-UHFFFAOYSA-N	1	1	317.349	1.774	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301998368	529949047	/nfs/dbraw/zinc/94/90/47/529949047.db2.gz	PIFMNFHDUCOYAZ-LLVKDONJSA-N	1	1	304.354	1.416	20	5		DDBDMO
C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000292364632	529995627	/nfs/dbraw/zinc/99/56/27/529995627.db2.gz	YFKKZWMUYVJUOW-CYBMUJFWSA-N	1	1	313.379	1.061	20	5		DDBDMO
C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000292364632	529995629	/nfs/dbraw/zinc/99/56/29/529995629.db2.gz	YFKKZWMUYVJUOW-CYBMUJFWSA-N	1	1	313.379	1.061	20	5		DDBDMO
C[C@H]1[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851884	232112030	/nfs/dbraw/zinc/11/20/30/232112030.db2.gz	QGAUUEZTJRLKKA-OLZOCXBDSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851884	232112031	/nfs/dbraw/zinc/11/20/31/232112031.db2.gz	QGAUUEZTJRLKKA-OLZOCXBDSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H](NC(=O)COc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272648482	210052657	/nfs/dbraw/zinc/05/26/57/210052657.db2.gz	DPXPOFBMXMMLRL-GFCCVEGCSA-N	1	1	319.361	1.740	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000279739388	215105846	/nfs/dbraw/zinc/10/58/46/215105846.db2.gz	OOTJFTHMYNRQMO-CQSZACIVSA-N	1	1	323.393	1.626	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000279755243	215118888	/nfs/dbraw/zinc/11/88/88/215118888.db2.gz	LUQYLYLCXHMVLE-SMDDNHRTSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459514630	233266946	/nfs/dbraw/zinc/26/69/46/233266946.db2.gz	ARZHDNHVLVMICZ-OSMZGAPFSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459514630	233266955	/nfs/dbraw/zinc/26/69/55/233266955.db2.gz	ARZHDNHVLVMICZ-OSMZGAPFSA-N	1	1	305.334	1.245	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C(C)(C)CN(C)C	ZINC000459552633	233311653	/nfs/dbraw/zinc/31/16/53/233311653.db2.gz	WJYHTKYSJCGHOF-UHFFFAOYSA-N	1	1	308.382	1.772	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2sccc2C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000053267154	352647460	/nfs/dbraw/zinc/64/74/60/352647460.db2.gz	NFAHFEVTDZSMTH-UHFFFAOYSA-N	1	1	320.374	1.773	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2sccc2C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000053267154	352647461	/nfs/dbraw/zinc/64/74/61/352647461.db2.gz	NFAHFEVTDZSMTH-UHFFFAOYSA-N	1	1	320.374	1.773	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)Cn1cc[nH+]c1C	ZINC000068433620	353111717	/nfs/dbraw/zinc/11/17/17/353111717.db2.gz	OZOPUBBWRUZTAQ-SNVBAGLBSA-N	1	1	320.353	1.057	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000068121578	353090098	/nfs/dbraw/zinc/09/00/98/353090098.db2.gz	RLWHLALOPASPPU-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000068935550	353137464	/nfs/dbraw/zinc/13/74/64/353137464.db2.gz	FJYBTQVBKAIHCV-CYBMUJFWSA-N	1	1	321.377	1.820	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@@H](C)O	ZINC000174590066	198356604	/nfs/dbraw/zinc/35/66/04/198356604.db2.gz	LNEYDDZGKZERDH-TZMCWYRMSA-N	1	1	321.377	1.512	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-]	ZINC000081290875	353660687	/nfs/dbraw/zinc/66/06/87/353660687.db2.gz	XVCXXIHSRXECRV-GFCCVEGCSA-N	1	1	321.381	1.621	20	5		DDBDMO
CCc1nn(C)c(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-]	ZINC000091480071	353828302	/nfs/dbraw/zinc/82/83/02/353828302.db2.gz	KMAQYRREEBPHQE-SNVBAGLBSA-N	1	1	304.354	1.998	20	5		DDBDMO
Cc1cc(N2CCC[N@H+](CC(=O)N(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000092606462	353863348	/nfs/dbraw/zinc/86/33/48/353863348.db2.gz	XFZYRSCSQLUAAX-UHFFFAOYSA-N	1	1	320.393	1.504	20	5		DDBDMO
COCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000145109209	354155953	/nfs/dbraw/zinc/15/59/53/354155953.db2.gz	IDCDPVSVJIGSOD-UHFFFAOYSA-N	1	1	310.310	1.271	20	5		DDBDMO
CC[N@H+]1CCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000317558079	354512110	/nfs/dbraw/zinc/51/21/10/354512110.db2.gz	MZEAMPRZEAHDFK-NSHDSACASA-N	1	1	307.350	1.912	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@H+](CCO)C(C)(C)C1	ZINC000588830029	354940231	/nfs/dbraw/zinc/94/02/31/354940231.db2.gz	NGHFSHKNKNGTPM-UHFFFAOYSA-N	1	1	311.386	1.013	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000588830029	354940235	/nfs/dbraw/zinc/94/02/35/354940235.db2.gz	NGHFSHKNKNGTPM-UHFFFAOYSA-N	1	1	311.386	1.013	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[C@H]([N@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000588864064	354944105	/nfs/dbraw/zinc/94/41/05/354944105.db2.gz	ZWTFBWLLUHNZFK-UONOGXRCSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H]1CCCOC1	ZINC000589184415	354969843	/nfs/dbraw/zinc/96/98/43/354969843.db2.gz	GBKJOEKVWVWFRZ-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H]1CCCOC1	ZINC000589184415	354969845	/nfs/dbraw/zinc/96/98/45/354969845.db2.gz	GBKJOEKVWVWFRZ-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H]2CCC[C@@H]2O)c1	ZINC000589501226	354996758	/nfs/dbraw/zinc/99/67/58/354996758.db2.gz	GMMBCECPNNLSRF-DOMZBBRYSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](O)C(C)(C)C2)c1	ZINC000589513653	354997984	/nfs/dbraw/zinc/99/79/84/354997984.db2.gz	MSXGCLICYXPXED-AWEZNQCLSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](O)C(C)(C)C2)c1	ZINC000589513653	354997986	/nfs/dbraw/zinc/99/79/86/354997986.db2.gz	MSXGCLICYXPXED-AWEZNQCLSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590010573	355040691	/nfs/dbraw/zinc/04/06/91/355040691.db2.gz	PDPQJENEMDJWFL-RISCZKNCSA-N	1	1	304.350	1.169	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@H]3[C@H](CO)[C@H]3C1)OCCO2	ZINC000590052956	355044892	/nfs/dbraw/zinc/04/48/92/355044892.db2.gz	FIJLFICBYRBCAY-GDNZZTSVSA-N	1	1	306.318	1.036	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1C[C@H]3[C@H](CO)[C@H]3C1)OCCO2	ZINC000590052956	355044894	/nfs/dbraw/zinc/04/48/94/355044894.db2.gz	FIJLFICBYRBCAY-GDNZZTSVSA-N	1	1	306.318	1.036	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000589836343	355024352	/nfs/dbraw/zinc/02/43/52/355024352.db2.gz	AMRCYFFKKBVLJS-SECBINFHSA-N	1	1	313.304	1.626	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC000590446504	355099590	/nfs/dbraw/zinc/09/95/90/355099590.db2.gz	VZFCVKRQXNRXCN-MFKMUULPSA-N	1	1	305.334	1.380	20	5		DDBDMO
CCC([NH3+])(CC)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236819374	202025534	/nfs/dbraw/zinc/02/55/34/202025534.db2.gz	UOUPNRXNBRELLC-UHFFFAOYSA-N	1	1	305.338	1.718	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000590663903	355139674	/nfs/dbraw/zinc/13/96/74/355139674.db2.gz	UUNQAOFUJARVLN-PWSUYJOCSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000590663903	355139679	/nfs/dbraw/zinc/13/96/79/355139679.db2.gz	UUNQAOFUJARVLN-PWSUYJOCSA-N	1	1	308.334	1.569	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@H]1C1(O)CC1	ZINC000590969161	355226290	/nfs/dbraw/zinc/22/62/90/355226290.db2.gz	RZEYIOYMBFCNRZ-ZDUSSCGKSA-N	1	1	307.350	1.136	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN(C)C[C@@H]2CCC[N@H+]2C)c1	ZINC000591505414	355322251	/nfs/dbraw/zinc/32/22/51/355322251.db2.gz	HWYJHODJVYIEAQ-AWEZNQCLSA-N	1	1	321.377	1.907	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC000593588729	355935100	/nfs/dbraw/zinc/93/51/00/355935100.db2.gz	LXBKQCNUTCIOFL-ABAIWWIYSA-N	1	1	321.352	1.829	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1	ZINC000594056834	356101793	/nfs/dbraw/zinc/10/17/93/356101793.db2.gz	ZGVMFTKHHIAXMP-JTQLQIEISA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1	ZINC000594056834	356101798	/nfs/dbraw/zinc/10/17/98/356101798.db2.gz	ZGVMFTKHHIAXMP-JTQLQIEISA-N	1	1	308.334	1.807	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594200414	356138290	/nfs/dbraw/zinc/13/82/90/356138290.db2.gz	LVXPZTJKPOFQEM-NEPJUHHUSA-N	1	1	321.381	1.383	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000594418784	356204191	/nfs/dbraw/zinc/20/41/91/356204191.db2.gz	LAWMUTVBSARCJC-NWDGAFQWSA-N	1	1	320.349	1.442	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH+]1CC2(CC2(F)F)C1	ZINC000594570719	356252429	/nfs/dbraw/zinc/25/24/29/356252429.db2.gz	YCUJFPDYNZQVTG-JTQLQIEISA-N	1	1	314.288	1.676	20	5		DDBDMO
CCN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000595102949	356382824	/nfs/dbraw/zinc/38/28/24/356382824.db2.gz	KSLSSVLEDBGOJJ-ZDUSSCGKSA-N	1	1	320.349	1.086	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595330797	356451633	/nfs/dbraw/zinc/45/16/33/356451633.db2.gz	PBBCCGYUZLFZTK-ZDUSSCGKSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595330797	356451638	/nfs/dbraw/zinc/45/16/38/356451638.db2.gz	PBBCCGYUZLFZTK-ZDUSSCGKSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(CN2CC[N@@H+](C3CCOCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000595480449	356510265	/nfs/dbraw/zinc/51/02/65/356510265.db2.gz	KMVALUJLMYWVBN-LLVKDONJSA-N	1	1	324.381	1.576	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](Cn3ccnn3)C2)c1	ZINC000595608478	356575873	/nfs/dbraw/zinc/57/58/73/356575873.db2.gz	QVHLHURTPITNGN-ZDUSSCGKSA-N	1	1	317.349	1.587	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000595751426	356635720	/nfs/dbraw/zinc/63/57/20/356635720.db2.gz	QGXHRZNKKRZAFU-MRXNPFEDSA-N	1	1	319.361	1.431	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](CCF)C2)c1	ZINC000595756851	356638268	/nfs/dbraw/zinc/63/82/68/356638268.db2.gz	XXSCJCMIZZNOBZ-DGCLKSJQSA-N	1	1	300.334	1.224	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595756963	356639085	/nfs/dbraw/zinc/63/90/85/356639085.db2.gz	JCBYJSKYENWWON-ZIBATOQPSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595756963	356639089	/nfs/dbraw/zinc/63/90/89/356639089.db2.gz	JCBYJSKYENWWON-ZIBATOQPSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000595761677	356642276	/nfs/dbraw/zinc/64/22/76/356642276.db2.gz	ZBHXHELHKJDLTN-SWLSCSKDSA-N	1	1	305.334	1.162	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000595847558	356676010	/nfs/dbraw/zinc/67/60/10/356676010.db2.gz	GWXDRDMSNXIELO-BJHJDKERSA-N	1	1	308.334	1.857	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H]2COC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000595829516	356667236	/nfs/dbraw/zinc/66/72/36/356667236.db2.gz	IGDDJANBBURVBU-STQMWFEESA-N	1	1	319.361	1.526	20	5		DDBDMO
CCN(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000596209674	356815723	/nfs/dbraw/zinc/81/57/23/356815723.db2.gz	BAZICVRZUKBSFR-CQSZACIVSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)c1cc[nH]c(=O)c1[N+](=O)[O-]	ZINC000596214752	356817788	/nfs/dbraw/zinc/81/77/88/356817788.db2.gz	KWXWWFWBMVXWLB-UHFFFAOYSA-N	1	1	310.354	1.242	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)c1cc[nH]c(=O)c1[N+](=O)[O-]	ZINC000596214752	356817790	/nfs/dbraw/zinc/81/77/90/356817790.db2.gz	KWXWWFWBMVXWLB-UHFFFAOYSA-N	1	1	310.354	1.242	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000596336604	356860247	/nfs/dbraw/zinc/86/02/47/356860247.db2.gz	QOKRCLBIWHKDKU-SECBINFHSA-N	1	1	307.354	1.373	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000597858577	357361291	/nfs/dbraw/zinc/36/12/91/357361291.db2.gz	NOXNVAOGPGTAPD-GFCCVEGCSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1CO	ZINC000598676814	357682108	/nfs/dbraw/zinc/68/21/08/357682108.db2.gz	LMTMAKYFQWZUEG-AAEUAGOBSA-N	1	1	322.361	1.816	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]C[C@H]1C[C@@H](O)C1)c1cccc([N+](=O)[O-])c1	ZINC000599083238	357809654	/nfs/dbraw/zinc/80/96/54/357809654.db2.gz	WGOHSFDZLSHTNB-GLQYFDAESA-N	1	1	316.361	1.778	20	5		DDBDMO
O=C(CC[N@H+]1CCc2nc[nH]c2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000599424544	357929920	/nfs/dbraw/zinc/92/99/20/357929920.db2.gz	WJJMBQMWFREZRB-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC1(C)COC1	ZINC000599571293	357979823	/nfs/dbraw/zinc/97/98/23/357979823.db2.gz	BEEBKGXTTIDNMO-UHFFFAOYSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[C@@H]1CC(F)(F)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000599623363	357996408	/nfs/dbraw/zinc/99/64/08/357996408.db2.gz	OXUUFODZMDMABX-KOLCDFICSA-N	1	1	304.297	1.272	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180531146	199171831	/nfs/dbraw/zinc/17/18/31/199171831.db2.gz	KYMQVRDPRBGTDJ-SNVBAGLBSA-N	1	1	307.354	1.176	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)n1	ZINC000600474012	358234951	/nfs/dbraw/zinc/23/49/51/358234951.db2.gz	WCKNKPKIEPYOEG-NSHDSACASA-N	1	1	307.354	1.075	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000600536522	358250441	/nfs/dbraw/zinc/25/04/41/358250441.db2.gz	YKIXVSXAOKRTAY-GFCCVEGCSA-N	1	1	307.350	1.008	20	5		DDBDMO
CC(C)[C@@H]1CNCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000600714200	358291808	/nfs/dbraw/zinc/29/18/08/358291808.db2.gz	KEBJJMHVRBRURL-HNNXBMFYSA-N	1	1	320.393	1.853	20	5		DDBDMO
CC(C)[C@@H]1CNCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000600714200	358291811	/nfs/dbraw/zinc/29/18/11/358291811.db2.gz	KEBJJMHVRBRURL-HNNXBMFYSA-N	1	1	320.393	1.853	20	5		DDBDMO
O=C1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCN1C1CC1	ZINC000601126456	358413711	/nfs/dbraw/zinc/41/37/11/358413711.db2.gz	ZPAGEZDJMBXVIV-UHFFFAOYSA-N	1	1	312.329	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CC[N@@H+]4CCOC[C@@H]4C3)c2c1	ZINC000601142460	358418452	/nfs/dbraw/zinc/41/84/52/358418452.db2.gz	RSQXNDFCECBZKB-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CC[N@H+]4CCOC[C@@H]4C3)c2c1	ZINC000601142460	358418454	/nfs/dbraw/zinc/41/84/54/358418454.db2.gz	RSQXNDFCECBZKB-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
CCN(CCOCCO)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601162408	358427748	/nfs/dbraw/zinc/42/77/48/358427748.db2.gz	MVALGAOPZSMLFC-UHFFFAOYSA-N	1	1	305.334	1.978	20	5		DDBDMO
CO[C@@]1(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCOC1	ZINC000602472612	359001445	/nfs/dbraw/zinc/00/14/45/359001445.db2.gz	JBTCOSOISMCYIR-SWLSCSKDSA-N	1	1	322.365	1.282	20	5		DDBDMO
Cn1cc(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])n1	ZINC000602484129	359009774	/nfs/dbraw/zinc/00/97/74/359009774.db2.gz	HPIFYHOSWNSOLR-IUODEOHRSA-N	1	1	319.409	1.777	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602902694	359282728	/nfs/dbraw/zinc/28/27/28/359282728.db2.gz	LDEJKGPWSDAHFX-CMPLNLGQSA-N	1	1	310.354	1.231	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCn2cc(C[NH+]3CCCCC3)nn2)n1	ZINC000603219844	359491895	/nfs/dbraw/zinc/49/18/95/359491895.db2.gz	UDFBNJCVQDGZTO-UHFFFAOYSA-N	1	1	305.342	1.069	20	5		DDBDMO
COC1CC[NH+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000610891451	360565027	/nfs/dbraw/zinc/56/50/27/360565027.db2.gz	DRIBKHAGQGNLSJ-UHFFFAOYSA-N	1	1	323.349	1.141	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000611525909	360747886	/nfs/dbraw/zinc/74/78/86/360747886.db2.gz	OEYUTOBLFRHSGM-CYBMUJFWSA-N	1	1	308.382	1.956	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000281357593	216246050	/nfs/dbraw/zinc/24/60/50/216246050.db2.gz	ZYHYKALFETVRHJ-OAHLLOKOSA-N	1	1	318.333	1.694	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000281431079	216293680	/nfs/dbraw/zinc/29/36/80/216293680.db2.gz	SMIQAPYGFGHROU-NEPJUHHUSA-N	1	1	321.333	1.404	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000613919921	361631679	/nfs/dbraw/zinc/63/16/79/361631679.db2.gz	YRUPOGBSJVXKLP-NSHDSACASA-N	1	1	308.382	1.813	20	5		DDBDMO
C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC[NH+](C)CC1	ZINC000613953747	361639821	/nfs/dbraw/zinc/63/98/21/361639821.db2.gz	IHUCOUKOIRAJLP-JTQLQIEISA-N	1	1	307.350	1.761	20	5		DDBDMO
C[N@@H+](CCCCCO)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000619077266	363887965	/nfs/dbraw/zinc/88/79/65/363887965.db2.gz	JSAYNZLHOCRKIP-UHFFFAOYSA-N	1	1	310.350	1.960	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC000275248864	212222663	/nfs/dbraw/zinc/22/26/63/212222663.db2.gz	PMEJYGOXGDULFZ-UHFFFAOYSA-N	1	1	306.366	1.483	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000264661744	204061369	/nfs/dbraw/zinc/06/13/69/204061369.db2.gz	TXHGGMAHZGYSTO-GFCCVEGCSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)[C@H](C)C1	ZINC000282496765	217041555	/nfs/dbraw/zinc/04/15/55/217041555.db2.gz	NAPSMDDDCFBNAH-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)C(=O)NCCF	ZINC000282650521	217153152	/nfs/dbraw/zinc/15/31/52/217153152.db2.gz	LBNDWCRYIXYQJZ-JTQLQIEISA-N	1	1	313.329	1.557	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)c1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000266231241	205201762	/nfs/dbraw/zinc/20/17/62/205201762.db2.gz	JMOIBSAMUURWQI-NSHDSACASA-N	1	1	321.381	1.399	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000266344523	205282020	/nfs/dbraw/zinc/28/20/20/205282020.db2.gz	IROOQQWDJBTCCX-NEPJUHHUSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000267660627	206202952	/nfs/dbraw/zinc/20/29/52/206202952.db2.gz	ZKFPPDTWCDGLCT-ZIAGYGMSSA-N	1	1	323.393	1.281	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000334103049	249215331	/nfs/dbraw/zinc/21/53/31/249215331.db2.gz	IAGMSTNGCWECQK-MNOVXSKESA-N	1	1	307.350	1.816	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2C[C@H](O)c2ccco2)c1	ZINC000268213357	206548050	/nfs/dbraw/zinc/54/80/50/206548050.db2.gz	AZOSRUCRJISFRS-JSGCOSHPSA-N	1	1	320.349	1.972	20	5		DDBDMO
CCOCCN1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000105830851	194140568	/nfs/dbraw/zinc/14/05/68/194140568.db2.gz	HHSFVTQZHSYVPQ-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](CC(C)(C)O)CC2)cc([N+](=O)[O-])c1	ZINC000106400705	194208362	/nfs/dbraw/zinc/20/83/62/194208362.db2.gz	CKZKYLZSFXGXRQ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NCCC[N@H+](C)CCN(C)C)n1	ZINC000341063280	251362922	/nfs/dbraw/zinc/36/29/22/251362922.db2.gz	CHSRXSFHPUDSKZ-UHFFFAOYSA-N	1	1	309.414	1.902	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NCCCN(C)CC[NH+](C)C)n1	ZINC000341063280	251362926	/nfs/dbraw/zinc/36/29/26/251362926.db2.gz	CHSRXSFHPUDSKZ-UHFFFAOYSA-N	1	1	309.414	1.902	20	5		DDBDMO
COc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000418996552	532958422	/nfs/dbraw/zinc/95/84/22/532958422.db2.gz	FJSNLTQUGGGNER-RYUDHWBXSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1	ZINC000272915914	210304181	/nfs/dbraw/zinc/30/41/81/210304181.db2.gz	JWRVJVLPGVHNJX-VIFPVBQESA-N	1	1	322.340	1.696	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1CCC[C@@H]1O	ZINC000352660391	285204966	/nfs/dbraw/zinc/20/49/66/285204966.db2.gz	NUEHBPXFQUBLAS-AAEUAGOBSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000120690920	195217843	/nfs/dbraw/zinc/21/78/43/195217843.db2.gz	HMGIBVXCJZTOJJ-DOMZBBRYSA-N	1	1	321.377	1.772	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000295036451	533218657	/nfs/dbraw/zinc/21/86/57/533218657.db2.gz	MEHZAOOJSPLJON-HNNXBMFYSA-N	1	1	308.334	1.606	20	5		DDBDMO
CSCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000292996637	533581842	/nfs/dbraw/zinc/58/18/42/533581842.db2.gz	COZDQZCKWDPBHA-UHFFFAOYSA-N	1	1	309.391	1.716	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000070076667	406808062	/nfs/dbraw/zinc/80/80/62/406808062.db2.gz	BSMWHTIWZHNMHJ-QWRGUYRKSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1	ZINC000070076738	406808750	/nfs/dbraw/zinc/80/87/50/406808750.db2.gz	RUABHDYNFGQKBJ-PHIMTYICSA-N	1	1	313.379	1.274	20	5		DDBDMO
CCSCC[C@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000072900680	406886194	/nfs/dbraw/zinc/88/61/94/406886194.db2.gz	OCPWBMFZPPXVSR-AAEUAGOBSA-N	1	1	316.427	1.616	20	5		DDBDMO
COC(=O)C1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000076457687	406969173	/nfs/dbraw/zinc/96/91/73/406969173.db2.gz	TVYYNHKRJAIBLJ-UHFFFAOYSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000125327219	407385408	/nfs/dbraw/zinc/38/54/08/407385408.db2.gz	FSZXQOYOXCVEAQ-JTQLQIEISA-N	1	1	321.333	1.994	20	5		DDBDMO
CC[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000125327219	407385410	/nfs/dbraw/zinc/38/54/10/407385410.db2.gz	FSZXQOYOXCVEAQ-JTQLQIEISA-N	1	1	321.333	1.994	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000125692008	407395334	/nfs/dbraw/zinc/39/53/34/407395334.db2.gz	JWGRVHQASYQFNV-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C(N)=O)C(C)(C)C	ZINC000109331389	407397129	/nfs/dbraw/zinc/39/71/29/407397129.db2.gz	KBGXLFFRXBIROQ-ZDUSSCGKSA-N	1	1	322.365	1.331	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111315465	407407361	/nfs/dbraw/zinc/40/73/61/407407361.db2.gz	GTVVBYHGXQVRIH-ONXXMXGDSA-N	1	1	319.361	1.829	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111315465	407407362	/nfs/dbraw/zinc/40/73/62/407407362.db2.gz	GTVVBYHGXQVRIH-ONXXMXGDSA-N	1	1	319.361	1.829	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@H+](CCC)CC2)c1[N+](=O)[O-]	ZINC000127023765	407426152	/nfs/dbraw/zinc/42/61/52/407426152.db2.gz	KPDVNHHIYNDPOK-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+](CCC)CC2)c1[N+](=O)[O-]	ZINC000127023765	407426153	/nfs/dbraw/zinc/42/61/53/407426153.db2.gz	KPDVNHHIYNDPOK-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+](CCC)CC2)c1[N+](=O)[O-]	ZINC000127023765	407426154	/nfs/dbraw/zinc/42/61/54/407426154.db2.gz	KPDVNHHIYNDPOK-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000178516420	407477424	/nfs/dbraw/zinc/47/74/24/407477424.db2.gz	LZOHREXSTYSDLU-LLVKDONJSA-N	1	1	310.354	1.455	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000113437909	407502894	/nfs/dbraw/zinc/50/28/94/407502894.db2.gz	DKYQLACFAIAUAI-LLVKDONJSA-N	1	1	322.365	1.690	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000112926435	407447684	/nfs/dbraw/zinc/44/76/84/407447684.db2.gz	QOQZAUXUDWCZJP-UHFFFAOYSA-N	1	1	317.349	1.462	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC3(C2)CCOCC3)c([N+](=O)[O-])c1	ZINC000266630156	407586727	/nfs/dbraw/zinc/58/67/27/407586727.db2.gz	PAELFWUISSJFBJ-UHFFFAOYSA-N	1	1	319.361	1.696	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@H](C)C1	ZINC000265947307	407521679	/nfs/dbraw/zinc/52/16/79/407521679.db2.gz	KAYVJKIEIKPNQH-ZYHUDNBSSA-N	1	1	323.397	1.439	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(N2CC[NH+](C)CC2)cc1Cl	ZINC000266027496	407527122	/nfs/dbraw/zinc/52/71/22/407527122.db2.gz	REABOOZVQWBEJN-UHFFFAOYSA-N	1	1	313.741	1.787	20	5		DDBDMO
CC[C@@H]1CN(c2ncc(C)cc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000266225985	407532975	/nfs/dbraw/zinc/53/29/75/407532975.db2.gz	RODHGCRBOYKLJS-CHWSQXEVSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000178972772	407680996	/nfs/dbraw/zinc/68/09/96/407680996.db2.gz	GOOCAEGFULDVGC-VIFPVBQESA-N	1	1	303.322	1.153	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000186801141	407771938	/nfs/dbraw/zinc/77/19/38/407771938.db2.gz	CZKDZXAVXXFKRF-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H](NC(=O)[C@H](C)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000272107408	407777328	/nfs/dbraw/zinc/77/73/28/407777328.db2.gz	MUDWPPDSMKLHGD-OLZOCXBDSA-N	1	1	320.393	1.408	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)CN1CCCC1=O	ZINC000171883061	407791389	/nfs/dbraw/zinc/79/13/89/407791389.db2.gz	DBACEMRDVFSKKP-ZDUSSCGKSA-N	1	1	307.350	1.010	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)CN1CCCC1=O	ZINC000171883061	407791394	/nfs/dbraw/zinc/79/13/94/407791394.db2.gz	DBACEMRDVFSKKP-ZDUSSCGKSA-N	1	1	307.350	1.010	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000268102273	407890521	/nfs/dbraw/zinc/89/05/21/407890521.db2.gz	FTHXKLZLDONKFT-BXUZGUMPSA-N	1	1	318.377	1.877	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2CC[C@@H](C1)[NH2+]2	ZINC000262657371	407890683	/nfs/dbraw/zinc/89/06/83/407890683.db2.gz	XQHRKXYJUYCACI-ZJUUUORDSA-N	1	1	315.333	1.438	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546657	407974841	/nfs/dbraw/zinc/97/48/41/407974841.db2.gz	KEYPDMKEBPEMJK-VXGBXAGGSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546657	407974846	/nfs/dbraw/zinc/97/48/46/407974846.db2.gz	KEYPDMKEBPEMJK-VXGBXAGGSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC(C)[NH+]1CCC(O)(CNCc2csc([N+](=O)[O-])c2)CC1	ZINC000268399604	408026847	/nfs/dbraw/zinc/02/68/47/408026847.db2.gz	BLZNXLJPONFVJQ-UHFFFAOYSA-N	1	1	313.423	1.981	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000181887717	408050728	/nfs/dbraw/zinc/05/07/28/408050728.db2.gz	YFNKIFIVIJIZHR-UHFFFAOYSA-N	1	1	309.322	1.394	20	5		DDBDMO
C[C@H](c1cccc(O)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245452278	407986166	/nfs/dbraw/zinc/98/61/66/407986166.db2.gz	QFZOFCAXHORIPK-IAQYHMDHSA-N	1	1	320.349	1.551	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[NH+](C[C@H](C)O)CC2)c1[N+](=O)[O-]	ZINC000189721071	408088372	/nfs/dbraw/zinc/08/83/72/408088372.db2.gz	GMGTXXOWIQZLSR-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000182207042	408093014	/nfs/dbraw/zinc/09/30/14/408093014.db2.gz	NVWLNCNRYMMPAR-UPJWGTAASA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000182207042	408093023	/nfs/dbraw/zinc/09/30/23/408093023.db2.gz	NVWLNCNRYMMPAR-UPJWGTAASA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1CCC[C@@](CNC(=O)c2n[nH]cc2[N+](=O)[O-])([NH+](C)C)C1	ZINC000137898992	408162741	/nfs/dbraw/zinc/16/27/41/408162741.db2.gz	DDEKFQDNLRUUOJ-QMTHXVAHSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1CC(O)C1	ZINC000190199364	408188158	/nfs/dbraw/zinc/18/81/58/408188158.db2.gz	MAFLANDALMINAM-UHFFFAOYSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000175993617	408258131	/nfs/dbraw/zinc/25/81/31/408258131.db2.gz	VXXLQYZGWAYKGB-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCC[N@@H+](C)C1	ZINC000151126182	408262752	/nfs/dbraw/zinc/26/27/52/408262752.db2.gz	LFIJQUXASUMZDR-ZDUSSCGKSA-N	1	1	320.393	1.827	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1CO	ZINC000263676185	408200741	/nfs/dbraw/zinc/20/07/41/408200741.db2.gz	HIAICKZNCACTHS-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246313997	408217543	/nfs/dbraw/zinc/21/75/43/408217543.db2.gz	GPYKWJJWLXWZFD-JGGQBBKZSA-N	1	1	324.377	1.570	20	5		DDBDMO
CCCCC[N@@H+](CC(N)=O)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000183053894	408315628	/nfs/dbraw/zinc/31/56/28/408315628.db2.gz	YHZURUDATMZBTK-CQSZACIVSA-N	1	1	309.366	1.606	20	5		DDBDMO
CCCCC[N@H+](CC(N)=O)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000183053894	408315634	/nfs/dbraw/zinc/31/56/34/408315634.db2.gz	YHZURUDATMZBTK-CQSZACIVSA-N	1	1	309.366	1.606	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000183182409	408343839	/nfs/dbraw/zinc/34/38/39/408343839.db2.gz	UVZJBTZZAIWLEJ-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1(CO)CCOCC1	ZINC000191033235	408360525	/nfs/dbraw/zinc/36/05/25/408360525.db2.gz	KZBSWRHEDHQTJQ-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000264521748	408522940	/nfs/dbraw/zinc/52/29/40/408522940.db2.gz	GJCWXUMJWTXKAC-UHFFFAOYSA-N	1	1	320.349	1.384	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000270414109	408526654	/nfs/dbraw/zinc/52/66/54/408526654.db2.gz	SCHDRSYYDYRGBY-HNNXBMFYSA-N	1	1	320.393	1.921	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000247410644	408468850	/nfs/dbraw/zinc/46/88/50/408468850.db2.gz	NFQPZUUGNMGDEL-GXTWGEPZSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000248446233	408568893	/nfs/dbraw/zinc/56/88/93/408568893.db2.gz	WQRUBPNGLYTCSS-MNOVXSKESA-N	1	1	321.381	1.422	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC000270470374	408541601	/nfs/dbraw/zinc/54/16/01/408541601.db2.gz	HKMLFYIKCRYTOE-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000192517418	408603748	/nfs/dbraw/zinc/60/37/48/408603748.db2.gz	KPDCVQDQIMVOPB-PHIMTYICSA-N	1	1	320.305	1.137	20	5		DDBDMO
C[C@@H](c1cccnc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680739	408633464	/nfs/dbraw/zinc/63/34/64/408633464.db2.gz	UPNOSDPQCLECKZ-FZMZJTMJSA-N	1	1	305.338	1.240	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@H](C)O)C[C@@H]1C	ZINC000251947654	408790703	/nfs/dbraw/zinc/79/07/03/408790703.db2.gz	UJNKHPMKFFUXTK-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@H](C)O)C[C@@H]1C	ZINC000251947654	408790706	/nfs/dbraw/zinc/79/07/06/408790706.db2.gz	UJNKHPMKFFUXTK-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1	ZINC000249689780	408755198	/nfs/dbraw/zinc/75/51/98/408755198.db2.gz	JUPSTYHKGPNNKQ-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([NH+]3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000265725763	408760514	/nfs/dbraw/zinc/76/05/14/408760514.db2.gz	OIZWWRDMJIEMKQ-LBPRGKRZSA-N	1	1	321.381	1.717	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)[N@H+]1CCC[C@H](C)C1	ZINC000249860323	408769621	/nfs/dbraw/zinc/76/96/21/408769621.db2.gz	QGRODJJMIDXFSI-WDEREUQCSA-N	1	1	322.365	1.546	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C1CC1	ZINC000290833420	408841259	/nfs/dbraw/zinc/84/12/59/408841259.db2.gz	UXFPDBAXXIBVPH-ZDUSSCGKSA-N	1	1	317.349	1.308	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000285742680	408854605	/nfs/dbraw/zinc/85/46/05/408854605.db2.gz	LBPORQYPDAGMDM-GXFFZTMASA-N	1	1	319.365	1.407	20	5		DDBDMO
COc1cc(N2C[C@H]([NH+]3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000286288218	408956833	/nfs/dbraw/zinc/95/68/33/408956833.db2.gz	INMOJJBZXSBDOX-TZMCWYRMSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1	ZINC000292144844	408989469	/nfs/dbraw/zinc/98/94/69/408989469.db2.gz	MWPWKPACMVZBKP-INIZCTEOSA-N	1	1	318.377	1.561	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC000292510047	409034429	/nfs/dbraw/zinc/03/44/29/409034429.db2.gz	YAZAOFINFHRENX-LBPRGKRZSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[N@@H+](CCCN1C(=O)CNC1=O)CCc1cccc([N+](=O)[O-])c1	ZINC000282343771	409037723	/nfs/dbraw/zinc/03/77/23/409037723.db2.gz	CBELGARFVYXTGV-UHFFFAOYSA-N	1	1	320.349	1.011	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](O)CC2)c2c(c1)COCO2	ZINC000293299458	409084558	/nfs/dbraw/zinc/08/45/58/409084558.db2.gz	WJYKNVDDDKLOFS-AWEZNQCLSA-N	1	1	308.334	1.808	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](O)CC2)c2c(c1)COCO2	ZINC000293299458	409084559	/nfs/dbraw/zinc/08/45/59/409084559.db2.gz	WJYKNVDDDKLOFS-AWEZNQCLSA-N	1	1	308.334	1.808	20	5		DDBDMO
Cc1ccnc(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000283562429	409176356	/nfs/dbraw/zinc/17/63/56/409176356.db2.gz	PXRLVNROBBENPX-AWEZNQCLSA-N	1	1	320.393	1.847	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F	ZINC000279764193	409247710	/nfs/dbraw/zinc/24/77/10/409247710.db2.gz	RTQWDPGADYSEJR-GFCCVEGCSA-N	1	1	311.357	1.886	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F	ZINC000279764193	409247712	/nfs/dbraw/zinc/24/77/12/409247712.db2.gz	RTQWDPGADYSEJR-GFCCVEGCSA-N	1	1	311.357	1.886	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CC(C)(C)CO)c1ccc([N+](=O)[O-])cc1	ZINC000295303605	409422272	/nfs/dbraw/zinc/42/22/72/409422272.db2.gz	VEISRBNXPSQFKD-UHFFFAOYSA-N	1	1	309.366	1.508	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC(C)(C)CO)c1ccc([N+](=O)[O-])cc1	ZINC000295303605	409422276	/nfs/dbraw/zinc/42/22/76/409422276.db2.gz	VEISRBNXPSQFKD-UHFFFAOYSA-N	1	1	309.366	1.508	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCNC(=O)CC1	ZINC000295309603	409427076	/nfs/dbraw/zinc/42/70/76/409427076.db2.gz	NDKHSRNLNHXCRU-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000317235063	164026758	/nfs/dbraw/zinc/02/67/58/164026758.db2.gz	LOVKYIJEMQTMMS-RYUDHWBXSA-N	1	1	304.350	1.534	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCOCC1	ZINC000304288112	409594431	/nfs/dbraw/zinc/59/44/31/409594431.db2.gz	BHOJTAQHTXCNSL-AWEZNQCLSA-N	1	1	312.370	1.042	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000342533367	409700634	/nfs/dbraw/zinc/70/06/34/409700634.db2.gz	JLUVAFJIUVMWAH-NSHDSACASA-N	1	1	311.313	1.184	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C2CC2)C[C@@H]1C	ZINC000342451400	409642171	/nfs/dbraw/zinc/64/21/71/409642171.db2.gz	PAVZHJAPORMNHZ-XPTSAGLGSA-N	1	1	304.350	1.511	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000296829081	409652574	/nfs/dbraw/zinc/65/25/74/409652574.db2.gz	SDDSWQGSJCHJNY-CQSZACIVSA-N	1	1	323.349	1.746	20	5		DDBDMO
CCNC(=O)NC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338375370	409948264	/nfs/dbraw/zinc/94/82/64/409948264.db2.gz	DNVWEMITDVKVIL-LLVKDONJSA-N	1	1	322.365	1.303	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000332234648	410001251	/nfs/dbraw/zinc/00/12/51/410001251.db2.gz	RREYIMXJVPJNDS-NSHDSACASA-N	1	1	314.345	1.919	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000332234648	410001259	/nfs/dbraw/zinc/00/12/59/410001259.db2.gz	RREYIMXJVPJNDS-NSHDSACASA-N	1	1	314.345	1.919	20	5		DDBDMO
COCC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000339161096	410066213	/nfs/dbraw/zinc/06/62/13/410066213.db2.gz	WLAQWQZGWYPUKK-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
COCC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000339161096	410066219	/nfs/dbraw/zinc/06/62/19/410066219.db2.gz	WLAQWQZGWYPUKK-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
COCCOc1cc([N+](=O)[O-])c(-c2nc(C[NH3+])no2)cc1OC	ZINC000571402910	304459140	/nfs/dbraw/zinc/45/91/40/304459140.db2.gz	LTZGJFIRQQMEPL-UHFFFAOYSA-N	1	1	324.293	1.137	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000339624356	410339011	/nfs/dbraw/zinc/33/90/11/410339011.db2.gz	ZRQMWHDQKVXXOJ-BETUJISGSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNc2ncc([N+](=O)[O-])c(N)n2)C[C@H](C)O1	ZINC000298725045	410367339	/nfs/dbraw/zinc/36/73/39/410367339.db2.gz	PPMOUGKLHKHUBF-AOOOYVTPSA-N	1	1	324.385	1.267	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2ncc([N+](=O)[O-])c(N)n2)C[C@H](C)O1	ZINC000298725045	410367345	/nfs/dbraw/zinc/36/73/45/410367345.db2.gz	PPMOUGKLHKHUBF-AOOOYVTPSA-N	1	1	324.385	1.267	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@@H]3CO)n2)cc1	ZINC000298772493	410392061	/nfs/dbraw/zinc/39/20/61/410392061.db2.gz	TYZAYDRYTFZHSY-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@@H]3CO)n2)cc1	ZINC000298772493	410392068	/nfs/dbraw/zinc/39/20/68/410392068.db2.gz	TYZAYDRYTFZHSY-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H](O)CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000339780962	410453839	/nfs/dbraw/zinc/45/38/39/410453839.db2.gz	SYBZWVHBRCFLHM-CQSZACIVSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1cc(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)ncc1[N+](=O)[O-]	ZINC000301446665	410723430	/nfs/dbraw/zinc/72/34/30/410723430.db2.gz	RHXRAEZGTPOTBA-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000353058225	410761999	/nfs/dbraw/zinc/76/19/99/410761999.db2.gz	RNEJDRRBABUGIW-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)[C@@H](C)C1	ZINC000330553634	410772647	/nfs/dbraw/zinc/77/26/47/410772647.db2.gz	CTZBMIFKUOKCGS-QWRGUYRKSA-N	1	1	309.370	1.131	20	5		DDBDMO
Cn1cc[nH+]c1C[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000301717970	410781628	/nfs/dbraw/zinc/78/16/28/410781628.db2.gz	OKRQQLNXNWEZQX-JTQLQIEISA-N	1	1	317.353	1.160	20	5		DDBDMO
Cc1nn(CCC(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000330605530	410822373	/nfs/dbraw/zinc/82/23/73/410822373.db2.gz	ZDVYNUWHKZJQQQ-GHMZBOCLSA-N	1	1	323.397	1.349	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000330675600	410869618	/nfs/dbraw/zinc/86/96/18/410869618.db2.gz	SHEYVHVRYBCDAE-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000330602655	410818794	/nfs/dbraw/zinc/81/87/94/410818794.db2.gz	WUJUJFGIEFRVGN-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000330602655	410818801	/nfs/dbraw/zinc/81/88/01/410818801.db2.gz	WUJUJFGIEFRVGN-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-]	ZINC000356300142	410954773	/nfs/dbraw/zinc/95/47/73/410954773.db2.gz	OERNBOUUNRRSMO-OAHLLOKOSA-N	1	1	306.366	1.491	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000356466632	411045880	/nfs/dbraw/zinc/04/58/80/411045880.db2.gz	YAEFJMJWABGLCA-SNVBAGLBSA-N	1	1	307.354	1.075	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCCS2(=O)=O)c(F)c1	ZINC000344296287	411078138	/nfs/dbraw/zinc/07/81/38/411078138.db2.gz	BCUIWLHTZVHIGJ-LBPRGKRZSA-N	1	1	316.354	1.791	20	5		DDBDMO
O=C(NC[C@@H]1CCC[NH2+]C1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000129818677	196078280	/nfs/dbraw/zinc/07/82/80/196078280.db2.gz	DISBGAHEELPXIK-SECBINFHSA-N	1	1	303.322	1.201	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)C[NH+]1CCOCC1	ZINC000134145179	196365387	/nfs/dbraw/zinc/36/53/87/196365387.db2.gz	UREMLSZTOBABCJ-SNVBAGLBSA-N	1	1	313.379	1.354	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000296675265	226111481	/nfs/dbraw/zinc/11/14/81/226111481.db2.gz	KYTPRWQRCUOPHI-CQSZACIVSA-N	1	1	307.350	1.910	20	5		DDBDMO
C[C@@H]1CN(CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000419334998	226122018	/nfs/dbraw/zinc/12/20/18/226122018.db2.gz	VYAZMLAXPPUEJS-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH+](C[C@@H](C)O)CC1	ZINC000421866904	226795438	/nfs/dbraw/zinc/79/54/38/226795438.db2.gz	FGKKSRCSAMPTOK-CYBMUJFWSA-N	1	1	321.377	1.350	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000366620230	418498147	/nfs/dbraw/zinc/49/81/47/418498147.db2.gz	NXVAFYGHGHVXFW-GFCCVEGCSA-N	1	1	307.398	1.777	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000188302398	222010461	/nfs/dbraw/zinc/01/04/61/222010461.db2.gz	KKMWWQPWJMKGPQ-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000188302398	222010464	/nfs/dbraw/zinc/01/04/64/222010464.db2.gz	KKMWWQPWJMKGPQ-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)C[C@@H]21	ZINC000375050722	418595857	/nfs/dbraw/zinc/59/58/57/418595857.db2.gz	SFDVBJDHPQAUOU-SKDRFNHKSA-N	1	1	303.322	1.661	20	5		DDBDMO
Cc1ccncc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000361423812	418650099	/nfs/dbraw/zinc/65/00/99/418650099.db2.gz	WLXHAHXLEVBDOG-UHFFFAOYSA-N	1	1	302.334	1.592	20	5		DDBDMO
CO[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371880	418638928	/nfs/dbraw/zinc/63/89/28/418638928.db2.gz	JEAOLWLJVZJYHA-KGLIPLIRSA-N	1	1	305.334	1.421	20	5		DDBDMO
CO[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371880	418638930	/nfs/dbraw/zinc/63/89/30/418638930.db2.gz	JEAOLWLJVZJYHA-KGLIPLIRSA-N	1	1	305.334	1.421	20	5		DDBDMO
C[C@](O)(C[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614009	418662273	/nfs/dbraw/zinc/66/22/73/418662273.db2.gz	SXPBEALEFKPULM-KOLCDFICSA-N	1	1	322.287	1.742	20	5		DDBDMO
C[C@](O)(C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614009	418662274	/nfs/dbraw/zinc/66/22/74/418662274.db2.gz	SXPBEALEFKPULM-KOLCDFICSA-N	1	1	322.287	1.742	20	5		DDBDMO
CC(C)(C)[C@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000361541722	418673810	/nfs/dbraw/zinc/67/38/10/418673810.db2.gz	SBZNMBKUDJMXJB-JSGCOSHPSA-N	1	1	310.398	1.910	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)[C@@H]1CCO[C@@H]1C	ZINC000361586103	418686907	/nfs/dbraw/zinc/68/69/07/418686907.db2.gz	LCDRNXUQOOIHQK-BXUZGUMPSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)[C@@H]1CCO[C@@H]1C	ZINC000361586103	418686908	/nfs/dbraw/zinc/68/69/08/418686908.db2.gz	LCDRNXUQOOIHQK-BXUZGUMPSA-N	1	1	310.350	1.575	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H]1c2ccccc2CC[C@@H]1CO	ZINC000365264493	418847618	/nfs/dbraw/zinc/84/76/18/418847618.db2.gz	GIRSQDFDRBKWDR-IUODEOHRSA-N	1	1	316.361	1.714	20	5		DDBDMO
Cc1c(CC(=O)N(C)C[C@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC000421711536	419697033	/nfs/dbraw/zinc/69/70/33/419697033.db2.gz	OPCJFYNAAXPLTL-CQSZACIVSA-N	1	1	305.378	1.998	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H]1CCCSC1	ZINC000433195555	229171929	/nfs/dbraw/zinc/17/19/29/229171929.db2.gz	WINCLHJXUMMCDX-LBPRGKRZSA-N	1	1	314.411	1.635	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC([NH3+])CC1	ZINC000430637622	420166697	/nfs/dbraw/zinc/16/66/97/420166697.db2.gz	CYXMNZIROODUMW-UHFFFAOYSA-N	1	1	306.366	1.655	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+](C)C2)c([N+](=O)[O-])c1	ZINC000416495276	420395241	/nfs/dbraw/zinc/39/52/41/420395241.db2.gz	LCUXQAOCDYPOSI-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000457075841	420603049	/nfs/dbraw/zinc/60/30/49/420603049.db2.gz	NQYDHJLXXSLILE-UHFFFAOYSA-N	1	1	309.370	1.172	20	5		DDBDMO
CNc1nc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000457084948	420605268	/nfs/dbraw/zinc/60/52/68/420605268.db2.gz	GYXWGXZXRRVXAJ-LLVKDONJSA-N	1	1	321.381	1.586	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](C)C[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452067396	420620523	/nfs/dbraw/zinc/62/05/23/420620523.db2.gz	MHNDMTOVROIHGC-WXHSDQCUSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](C)C[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452067396	420620527	/nfs/dbraw/zinc/62/05/27/420620527.db2.gz	MHNDMTOVROIHGC-WXHSDQCUSA-N	1	1	321.377	1.933	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000452978657	420693998	/nfs/dbraw/zinc/69/39/98/420693998.db2.gz	SIHHIHYDDRIASG-GXFFZTMASA-N	1	1	304.350	1.413	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456007488	421088542	/nfs/dbraw/zinc/08/85/42/421088542.db2.gz	DFDXNKVKXWDYFQ-NXEZZACHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456007488	421088545	/nfs/dbraw/zinc/08/85/45/421088545.db2.gz	DFDXNKVKXWDYFQ-NXEZZACHSA-N	1	1	307.354	1.196	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1c2ccccc2ncc1[N+](=O)[O-]	ZINC000488096190	421068898	/nfs/dbraw/zinc/06/88/98/421068898.db2.gz	KTGJKNFGXNPXJH-UHFFFAOYSA-N	1	1	318.377	1.945	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455906633	421075588	/nfs/dbraw/zinc/07/55/88/421075588.db2.gz	GLAYHKVWDQNKHC-ZYHUDNBSSA-N	1	1	321.381	1.490	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@@H]2CCn3cc[nH+]c3C2)nc2sccn21	ZINC000489875584	421177861	/nfs/dbraw/zinc/17/78/61/421177861.db2.gz	OMXHENAGDCYHPV-MRVPVSSYSA-N	1	1	304.335	1.927	20	5		DDBDMO
O=C1CC[C@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CCN1	ZINC000450481986	421202615	/nfs/dbraw/zinc/20/26/15/421202615.db2.gz	FZLXJNBOWSGJTQ-LBPRGKRZSA-N	1	1	303.362	1.869	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000524122885	421254732	/nfs/dbraw/zinc/25/47/32/421254732.db2.gz	YMFROJOOOPIJEA-UHFFFAOYSA-N	1	1	308.386	1.524	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@@H+](C)CCCOC)cc1[N+](=O)[O-]	ZINC000525092898	421277843	/nfs/dbraw/zinc/27/78/43/421277843.db2.gz	LMAQDNKWXPEOCO-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000546103886	421285513	/nfs/dbraw/zinc/28/55/13/421285513.db2.gz	BBMPGVLNBVVJCG-OAHLLOKOSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000553785425	421625649	/nfs/dbraw/zinc/62/56/49/421625649.db2.gz	ZEFLTRVISQPIRV-HUBLWGQQSA-N	1	1	318.377	1.792	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000535958029	421715403	/nfs/dbraw/zinc/71/54/03/421715403.db2.gz	ASLFZNNVNBLOEY-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000535958029	421715406	/nfs/dbraw/zinc/71/54/06/421715406.db2.gz	ASLFZNNVNBLOEY-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1	ZINC000521114075	421773797	/nfs/dbraw/zinc/77/37/97/421773797.db2.gz	RAXKJPYPMKFHGU-SNVBAGLBSA-N	1	1	321.333	1.048	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000572979505	421890847	/nfs/dbraw/zinc/89/08/47/421890847.db2.gz	NYEIGBNGKYVFNS-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000583034436	422158077	/nfs/dbraw/zinc/15/80/77/422158077.db2.gz	PXGFYAPSGWAFCG-SNVBAGLBSA-N	1	1	309.370	1.422	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000596305779	422374118	/nfs/dbraw/zinc/37/41/18/422374118.db2.gz	AIOGMCZJIJTZIU-JTQLQIEISA-N	1	1	304.354	1.922	20	5		DDBDMO
CC(C)([NH2+]CC(=O)Nc1ccon1)c1ccccc1[N+](=O)[O-]	ZINC000590019595	422318176	/nfs/dbraw/zinc/31/81/76/422318176.db2.gz	RUJFMSYSRNFMIG-UHFFFAOYSA-N	1	1	304.306	2.046	20	5		DDBDMO
COC(=O)c1ccnc(NCCC[N@@H+](C)CC(C)C)c1[N+](=O)[O-]	ZINC000598631289	422397639	/nfs/dbraw/zinc/39/76/39/422397639.db2.gz	PYKONVKGLVTPQH-UHFFFAOYSA-N	1	1	324.381	2.166	20	5		DDBDMO
Nc1nccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600469291	422411210	/nfs/dbraw/zinc/41/12/10/422411210.db2.gz	JCDYSLYCGFVORQ-LLVKDONJSA-N	1	1	319.365	1.319	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[N@H+](C2CCCC2)CC1	ZINC000179707904	263362414	/nfs/dbraw/zinc/36/24/14/263362414.db2.gz	RSFUGUNRKRMGOE-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000341553975	271115929	/nfs/dbraw/zinc/11/59/29/271115929.db2.gz	WGPARCPMZZGJGY-UHFFFAOYSA-N	1	1	310.354	1.074	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H]1CC[NH2+]CC1(F)F	ZINC000343419307	271767863	/nfs/dbraw/zinc/76/78/63/271767863.db2.gz	PUYOFKRRPRNWSZ-NSHDSACASA-N	1	1	313.304	1.798	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000344409786	272017925	/nfs/dbraw/zinc/01/79/25/272017925.db2.gz	AMZHUCPXHGRYQC-OAHLLOKOSA-N	1	1	319.409	1.596	20	5		DDBDMO
C[C@@H]1CN(c2ccc(N)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000286754033	274363979	/nfs/dbraw/zinc/36/39/79/274363979.db2.gz	RWGJHBQEBSEEEN-LLVKDONJSA-N	1	1	308.382	1.458	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1	ZINC000339078079	274933960	/nfs/dbraw/zinc/93/39/60/274933960.db2.gz	HBIYCMSZOZKQGO-UHFFFAOYSA-N	1	1	303.240	1.721	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000285742674	275011154	/nfs/dbraw/zinc/01/11/54/275011154.db2.gz	LBPORQYPDAGMDM-GWCFXTLKSA-N	1	1	319.365	1.407	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000088349355	276205854	/nfs/dbraw/zinc/20/58/54/276205854.db2.gz	IOJGJPVYXVTRLG-OAHLLOKOSA-N	1	1	319.361	1.200	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000088349355	276205856	/nfs/dbraw/zinc/20/58/56/276205856.db2.gz	IOJGJPVYXVTRLG-OAHLLOKOSA-N	1	1	319.361	1.200	20	5		DDBDMO
C[C@@H]1CC[C@@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)O1	ZINC000298036792	278581679	/nfs/dbraw/zinc/58/16/79/278581679.db2.gz	GVJWYPUQRMXLDV-OLZOCXBDSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@@H+](C)C1CC1	ZINC000181465874	279345299	/nfs/dbraw/zinc/34/52/99/279345299.db2.gz	SGSCRUKHOVTNPE-SECBINFHSA-N	1	1	321.333	1.536	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)c(N)c([N+](=O)[O-])c1	ZINC000295309543	280331685	/nfs/dbraw/zinc/33/16/85/280331685.db2.gz	VWFOYMMVOZTOJT-AWEZNQCLSA-N	1	1	310.329	1.259	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000119761072	281107266	/nfs/dbraw/zinc/10/72/66/281107266.db2.gz	IJGUEVVRGBLXIS-UHFFFAOYSA-N	1	1	303.362	1.964	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H]2CCCN2c2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000408361178	297020318	/nfs/dbraw/zinc/02/03/18/297020318.db2.gz	CWTZINGHSUPRHL-XQQFMLRXSA-N	1	1	323.397	1.406	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H]2CCCN2c2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000408361178	297020319	/nfs/dbraw/zinc/02/03/19/297020319.db2.gz	CWTZINGHSUPRHL-XQQFMLRXSA-N	1	1	323.397	1.406	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CC[C@@H](C)C1	ZINC000362153846	300017843	/nfs/dbraw/zinc/01/78/43/300017843.db2.gz	GIWMKFKJKPWSKO-KGLIPLIRSA-N	1	1	323.393	1.894	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000362931672	300181448	/nfs/dbraw/zinc/18/14/48/300181448.db2.gz	RWJLHNYEROKIGY-XHDPSFHLSA-N	1	1	303.362	1.677	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2[N+](=O)[O-])C1	ZINC000362972743	300191365	/nfs/dbraw/zinc/19/13/65/300191365.db2.gz	ANUWQWHOPWDAFT-QPSCCSFWSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000362972743	300191367	/nfs/dbraw/zinc/19/13/67/300191367.db2.gz	ANUWQWHOPWDAFT-QPSCCSFWSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000362972743	300191369	/nfs/dbraw/zinc/19/13/69/300191369.db2.gz	ANUWQWHOPWDAFT-QPSCCSFWSA-N	1	1	309.410	1.765	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(CN2CCCC2=O)CC1	ZINC000363586830	300284170	/nfs/dbraw/zinc/28/41/70/300284170.db2.gz	OEAJLZCCUASWFA-UHFFFAOYSA-N	1	1	321.381	1.163	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2CC([C@H]3CCOC3)C2)c([N+](=O)[O-])c1	ZINC000368440216	301028338	/nfs/dbraw/zinc/02/83/38/301028338.db2.gz	BCPRAQLQHRHTJP-NSHDSACASA-N	1	1	307.306	1.971	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000368823389	301093053	/nfs/dbraw/zinc/09/30/53/301093053.db2.gz	IJVUKGLMHYOHMZ-HNNXBMFYSA-N	1	1	321.377	1.510	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000368823389	301093055	/nfs/dbraw/zinc/09/30/55/301093055.db2.gz	IJVUKGLMHYOHMZ-HNNXBMFYSA-N	1	1	321.377	1.510	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000369144147	301136529	/nfs/dbraw/zinc/13/65/29/301136529.db2.gz	OFQGBABHUQSSKC-QWRGUYRKSA-N	1	1	321.381	1.627	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CCNC(=O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000369428707	301185391	/nfs/dbraw/zinc/18/53/91/301185391.db2.gz	TWFNLXWQYJKVGR-LLVKDONJSA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCNC(=O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000369428707	301185393	/nfs/dbraw/zinc/18/53/93/301185393.db2.gz	TWFNLXWQYJKVGR-LLVKDONJSA-N	1	1	323.349	1.193	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000370163936	301286443	/nfs/dbraw/zinc/28/64/43/301286443.db2.gz	UURHDVPYWKHEFK-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000370163936	301286446	/nfs/dbraw/zinc/28/64/46/301286446.db2.gz	UURHDVPYWKHEFK-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000370163936	301286449	/nfs/dbraw/zinc/28/64/49/301286449.db2.gz	UURHDVPYWKHEFK-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H]2CCCO2)CC[C@@H]1Nc1ncc([N+](=O)[O-])cn1	ZINC000376928224	302122508	/nfs/dbraw/zinc/12/25/08/302122508.db2.gz	YXJKCTPKUCRFLJ-BNOWGMLFSA-N	1	1	321.381	1.686	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377655905	302205194	/nfs/dbraw/zinc/20/51/94/302205194.db2.gz	RCVKYVSHQWBVNC-CMPLNLGQSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377655905	302205197	/nfs/dbraw/zinc/20/51/97/302205197.db2.gz	RCVKYVSHQWBVNC-CMPLNLGQSA-N	1	1	309.753	1.816	20	5		DDBDMO
Cc1[nH+]c(CNC(=O)c2ccc([N+](=O)[O-])cn2)c2n1CCCC2	ZINC000378305572	302309944	/nfs/dbraw/zinc/30/99/44/302309944.db2.gz	HVHBAVIIEVHRLL-UHFFFAOYSA-N	1	1	315.333	1.761	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C1(CO)CCC1	ZINC000429275611	302387964	/nfs/dbraw/zinc/38/79/64/302387964.db2.gz	UZMQXTKHLCOTIQ-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C1(CO)CCC1	ZINC000429275611	302387967	/nfs/dbraw/zinc/38/79/67/302387967.db2.gz	UZMQXTKHLCOTIQ-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC000365018709	307056607	/nfs/dbraw/zinc/05/66/07/307056607.db2.gz	ORTLMWBXFZELFR-ABAIWWIYSA-N	1	1	318.377	1.485	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000366655084	307078768	/nfs/dbraw/zinc/07/87/68/307078768.db2.gz	PPHGCWNJCJYTCS-KGLIPLIRSA-N	1	1	322.361	1.759	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@H]2C1	ZINC000367253622	307089797	/nfs/dbraw/zinc/08/97/97/307089797.db2.gz	SQYSIDXJDYWSPB-XPTSAGLGSA-N	1	1	322.340	1.482	20	5		DDBDMO
CC(C)CNC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373246982	307182531	/nfs/dbraw/zinc/18/25/31/307182531.db2.gz	XUOYEMJFKNWBJL-UHFFFAOYSA-N	1	1	309.370	1.200	20	5		DDBDMO
Cc1nc(C)n(C[C@H]2CCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)n1	ZINC000374052763	307201116	/nfs/dbraw/zinc/20/11/16/307201116.db2.gz	FUKWUIALZQAHQX-GFCCVEGCSA-N	1	1	319.369	1.201	20	5		DDBDMO
Cc1nc(C)n(C[C@H]2CCC[N@@H+]2Cc2c([N+](=O)[O-])ncn2C)n1	ZINC000374052763	307201117	/nfs/dbraw/zinc/20/11/17/307201117.db2.gz	FUKWUIALZQAHQX-GFCCVEGCSA-N	1	1	319.369	1.201	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])C[C@@H]2[C@H]1c1ccccc1	ZINC000377824622	307276345	/nfs/dbraw/zinc/27/63/45/307276345.db2.gz	UNSLJPGVCHRREJ-RBGFHDKUSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@H]2[C@H]1c1ccccc1	ZINC000377824622	307276346	/nfs/dbraw/zinc/27/63/46/307276346.db2.gz	UNSLJPGVCHRREJ-RBGFHDKUSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@H]2[C@H]1c1ccccc1	ZINC000377824622	307276347	/nfs/dbraw/zinc/27/63/47/307276347.db2.gz	UNSLJPGVCHRREJ-RBGFHDKUSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])C[C@H]2[C@@H]1c1ccccc1	ZINC000377824623	307276446	/nfs/dbraw/zinc/27/64/46/307276446.db2.gz	UNSLJPGVCHRREJ-SUJAAXHWSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2[C@@H]1c1ccccc1	ZINC000377824623	307276447	/nfs/dbraw/zinc/27/64/47/307276447.db2.gz	UNSLJPGVCHRREJ-SUJAAXHWSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2[C@@H]1c1ccccc1	ZINC000377824623	307276448	/nfs/dbraw/zinc/27/64/48/307276448.db2.gz	UNSLJPGVCHRREJ-SUJAAXHWSA-N	1	1	315.373	1.413	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488805475	484219317	/nfs/dbraw/zinc/21/93/17/484219317.db2.gz	SUJWOHPLVDOQEA-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@](O)(C(F)F)C2)ccc1[N+](=O)[O-]	ZINC000451440159	533825476	/nfs/dbraw/zinc/82/54/76/533825476.db2.gz	WLUPKLVHTWRLJT-CYBMUJFWSA-N	1	1	302.277	1.805	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@](O)(C(F)F)C2)ccc1[N+](=O)[O-]	ZINC000451440159	533825482	/nfs/dbraw/zinc/82/54/82/533825482.db2.gz	WLUPKLVHTWRLJT-CYBMUJFWSA-N	1	1	302.277	1.805	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000452055514	534189683	/nfs/dbraw/zinc/18/96/83/534189683.db2.gz	UMDLCUOOHJWRKQ-UDUPFKKZSA-N	1	1	320.393	1.520	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)C1	ZINC000191193276	523962290	/nfs/dbraw/zinc/96/22/90/523962290.db2.gz	VBDVBOQAUVRPQU-MRVPVSSYSA-N	1	1	316.155	1.471	20	5		DDBDMO
CC(C)(C)C[C@@H]1CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000452080370	527699513	/nfs/dbraw/zinc/69/95/13/527699513.db2.gz	ORWXECISVDMYTJ-JSGCOSHPSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000330922066	527825785	/nfs/dbraw/zinc/82/57/85/527825785.db2.gz	AYAHLIBBVRQIFP-GFCCVEGCSA-N	1	1	323.397	1.327	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1COC1	ZINC000451285671	528399656	/nfs/dbraw/zinc/39/96/56/528399656.db2.gz	LVDIQBORBKUJAA-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCN1CC[NH+](CCCNc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000413054227	529145308	/nfs/dbraw/zinc/14/53/08/529145308.db2.gz	MYAWIRHZINWNDB-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000736846951	598810078	/nfs/dbraw/zinc/81/00/78/598810078.db2.gz	DFFLGBVPQQDTQU-SECBINFHSA-N	1	1	303.326	1.139	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000820112296	607168348	/nfs/dbraw/zinc/16/83/48/607168348.db2.gz	QQGRCYCCSBPHLP-UHFFFAOYSA-N	1	1	320.357	1.312	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000177212803	697410822	/nfs/dbraw/zinc/41/08/22/697410822.db2.gz	JPSVRABOQQTTFA-OAHLLOKOSA-N	1	1	318.333	1.787	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2nc(C)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000178589376	697426671	/nfs/dbraw/zinc/42/66/71/697426671.db2.gz	BZQBLWSTBISTGU-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
COCC(=O)N1CCC([N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000985189338	697464934	/nfs/dbraw/zinc/46/49/34/697464934.db2.gz	LTOOHDMQCVGPHV-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@H]2C2OCCO2)cc1	ZINC000776582591	698121431	/nfs/dbraw/zinc/12/14/31/698121431.db2.gz	VSHLTWYEIJEWJW-GJZGRUSLSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@H]2C2OCCO2)cc1	ZINC000776582591	698121437	/nfs/dbraw/zinc/12/14/37/698121437.db2.gz	VSHLTWYEIJEWJW-GJZGRUSLSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000776591749	698123825	/nfs/dbraw/zinc/12/38/25/698123825.db2.gz	WMRATURRMVCFQH-IIAWOOMASA-N	1	1	306.362	1.987	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776596659	698124732	/nfs/dbraw/zinc/12/47/32/698124732.db2.gz	HJOGIWSAIQDWNO-LSDHHAIUSA-N	1	1	319.361	1.325	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000800374537	700219057	/nfs/dbraw/zinc/21/90/57/700219057.db2.gz	RTVUHMXMGJIIPE-DVOMOZLQSA-N	1	1	323.393	1.015	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2C[C@]2(CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000782620088	698752375	/nfs/dbraw/zinc/75/23/75/698752375.db2.gz	KLYFJVCRADUSST-XHDPSFHLSA-N	1	1	305.334	1.238	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000786190895	699133063	/nfs/dbraw/zinc/13/30/63/699133063.db2.gz	OOXHKPMGVAPKSV-LSDHHAIUSA-N	1	1	310.350	1.366	20	5		DDBDMO
Cc1c(C[N@@H+](CCO)C2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000729930874	699495433	/nfs/dbraw/zinc/49/54/33/699495433.db2.gz	ZZVJPZOYIVUEIG-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
Cc1c(C[N@H+](CCO)C2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000729930874	699495434	/nfs/dbraw/zinc/49/54/34/699495434.db2.gz	ZZVJPZOYIVUEIG-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
C[C@H](C[NH+]1CCN(C)CC1)Nc1nc2ccccn2c1[N+](=O)[O-]	ZINC000730109459	699501995	/nfs/dbraw/zinc/50/19/95/699501995.db2.gz	RVVKMGZAXFXPDF-GFCCVEGCSA-N	1	1	318.381	1.290	20	5		DDBDMO
Nc1ccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-]	ZINC000791258850	699618146	/nfs/dbraw/zinc/61/81/46/699618146.db2.gz	LQPJBDUBCAIAIB-DGCLKSJQSA-N	1	1	322.340	1.435	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@@H]1C	ZINC000742237816	699868625	/nfs/dbraw/zinc/86/86/25/699868625.db2.gz	PWVYBDFHSCSTBJ-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000744389879	699947360	/nfs/dbraw/zinc/94/73/60/699947360.db2.gz	GQFAJDMJPNWYSX-UHFFFAOYSA-N	1	1	320.353	1.318	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801914237	700352570	/nfs/dbraw/zinc/35/25/70/700352570.db2.gz	UVKVENPCZWWDKD-SECBINFHSA-N	1	1	310.329	1.388	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801936495	700357755	/nfs/dbraw/zinc/35/77/55/700357755.db2.gz	UQLUYMBZWILDMA-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801936495	700357759	/nfs/dbraw/zinc/35/77/59/700357759.db2.gz	UQLUYMBZWILDMA-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000802139491	700372548	/nfs/dbraw/zinc/37/25/48/700372548.db2.gz	CQNBCHBRSRLAEK-OAHLLOKOSA-N	1	1	322.361	1.790	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000758336341	700699678	/nfs/dbraw/zinc/69/96/78/700699678.db2.gz	PVEFHNWFDPSHDM-ZWNOBZJWSA-N	1	1	318.377	1.698	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804522714	701197486	/nfs/dbraw/zinc/19/74/86/701197486.db2.gz	XOBHCCUJBKYPQA-NSHDSACASA-N	1	1	324.337	1.396	20	5		DDBDMO
O=C(CC[N@H+]1CCOC[C@H]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000839533628	701728527	/nfs/dbraw/zinc/72/85/27/701728527.db2.gz	WEYQBRBVLJGJKV-CQSZACIVSA-N	1	1	323.349	1.007	20	5		DDBDMO
O=C(CC[N@@H+]1CCOC[C@H]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000839533628	701728528	/nfs/dbraw/zinc/72/85/28/701728528.db2.gz	WEYQBRBVLJGJKV-CQSZACIVSA-N	1	1	323.349	1.007	20	5		DDBDMO
Cn1ncc2c1CCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000839625067	701757594	/nfs/dbraw/zinc/75/75/94/701757594.db2.gz	MFZPWDKSWYOQHO-MRXNPFEDSA-N	1	1	316.361	1.810	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000839689177	701785054	/nfs/dbraw/zinc/78/50/54/701785054.db2.gz	LEFMFKBVTJFPDQ-SFTQSGBHSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000839689177	701785059	/nfs/dbraw/zinc/78/50/59/701785059.db2.gz	LEFMFKBVTJFPDQ-SFTQSGBHSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000839689177	701785062	/nfs/dbraw/zinc/78/50/62/701785062.db2.gz	LEFMFKBVTJFPDQ-SFTQSGBHSA-N	1	1	323.418	1.912	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000810841888	701859158	/nfs/dbraw/zinc/85/91/58/701859158.db2.gz	RCVGLIZQNKHORD-GHMZBOCLSA-N	1	1	308.338	1.595	20	5		DDBDMO
CCN(CC(F)F)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867979663	701869532	/nfs/dbraw/zinc/86/95/32/701869532.db2.gz	MAXKUASQZVOZHG-CYBMUJFWSA-N	1	1	301.293	1.882	20	5		DDBDMO
CC[N@H+](CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000839960130	701878342	/nfs/dbraw/zinc/87/83/42/701878342.db2.gz	OYMRSBOHBSLDSC-OAHLLOKOSA-N	1	1	305.334	1.974	20	5		DDBDMO
CC[N@@H+](CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000839960130	701878349	/nfs/dbraw/zinc/87/83/49/701878349.db2.gz	OYMRSBOHBSLDSC-OAHLLOKOSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3c(F)cccc3[N+](=O)[O-])CC2)CC1	ZINC000866211895	706650482	/nfs/dbraw/zinc/65/04/82/706650482.db2.gz	ABMJLASBRPCAFA-UHFFFAOYSA-N	1	1	322.384	1.950	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000842479418	702726065	/nfs/dbraw/zinc/72/60/65/702726065.db2.gz	RUPFFHZWFRCOOH-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@]2(CC2(F)F)C1	ZINC000844441828	703032116	/nfs/dbraw/zinc/03/21/16/703032116.db2.gz	UJRPJMOVKOXMNE-ZDUSSCGKSA-N	1	1	313.304	1.878	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@H]21	ZINC000879574460	706723723	/nfs/dbraw/zinc/72/37/23/706723723.db2.gz	AAQVEZOWIHEPMO-UONOGXRCSA-N	1	1	318.377	1.220	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000846291890	703262718	/nfs/dbraw/zinc/26/27/18/703262718.db2.gz	VBOLGYMSDJCGFY-UHFFFAOYSA-N	1	1	308.382	1.885	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC	ZINC000850431468	703730813	/nfs/dbraw/zinc/73/08/13/703730813.db2.gz	DSEFCCRQCQXWGS-JTQLQIEISA-N	1	1	316.379	1.689	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@@H](CN3CCOC3=O)C2)c1[N+](=O)[O-]	ZINC000852094781	703921756	/nfs/dbraw/zinc/92/17/56/703921756.db2.gz	OUWJPJQSZUPNEF-SNVBAGLBSA-N	1	1	310.310	1.165	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@@H](CN3CCOC3=O)C2)c1[N+](=O)[O-]	ZINC000852094781	703921758	/nfs/dbraw/zinc/92/17/58/703921758.db2.gz	OUWJPJQSZUPNEF-SNVBAGLBSA-N	1	1	310.310	1.165	20	5		DDBDMO
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C[NH+]1CCCC1	ZINC000818966591	704036538	/nfs/dbraw/zinc/03/65/38/704036538.db2.gz	LMSBEZJZEFIANQ-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@@H](C[C@H]1CCCC[N@H+]1C)OC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000870786401	704131995	/nfs/dbraw/zinc/13/19/95/704131995.db2.gz	WHMOJTVPMRIXPL-WDEREUQCSA-N	1	1	310.354	1.748	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CC[NH+]1CCOCC1	ZINC000854510825	704410303	/nfs/dbraw/zinc/41/03/03/704410303.db2.gz	MMXVHIBTGNWNNR-UHFFFAOYSA-N	1	1	307.350	1.872	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])ccc1F)N1CC(C[NH+]2CCOCC2)C1	ZINC000854589490	704423096	/nfs/dbraw/zinc/42/30/96/704423096.db2.gz	PZHFXXQHCOXTKK-UHFFFAOYSA-N	1	1	323.324	1.138	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000854643234	704431679	/nfs/dbraw/zinc/43/16/79/704431679.db2.gz	SEOIQYUICYJEOH-OLZOCXBDSA-N	1	1	313.398	1.144	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2C	ZINC000874827077	705185517	/nfs/dbraw/zinc/18/55/17/705185517.db2.gz	AXDOFSOVTYSJAD-UONOGXRCSA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CCc2cc(C)c([N+](=O)[O-])cc21	ZINC000860588243	705228710	/nfs/dbraw/zinc/22/87/10/705228710.db2.gz	DIIOBAORIKARBR-UHFFFAOYSA-N	1	1	300.318	1.997	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000823993249	705350644	/nfs/dbraw/zinc/35/06/44/705350644.db2.gz	BQFYITKEEGOAGK-SNVBAGLBSA-N	1	1	307.354	1.640	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000893877408	710870757	/nfs/dbraw/zinc/87/07/57/710870757.db2.gz	WRCHCWUTQHRLMY-ZFWWWQNUSA-N	1	1	318.377	1.483	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000825014539	705577173	/nfs/dbraw/zinc/57/71/73/705577173.db2.gz	GSDKYRMDNGCOMI-GFCCVEGCSA-N	1	1	307.350	1.008	20	5		DDBDMO
Cc1ccc(CNC(=O)[C@H](C)[NH+]2CCSCC2)cc1[N+](=O)[O-]	ZINC000825648115	705708390	/nfs/dbraw/zinc/70/83/90/705708390.db2.gz	LRODMCOXLBGCFL-LBPRGKRZSA-N	1	1	323.418	1.957	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000862725281	705785472	/nfs/dbraw/zinc/78/54/72/705785472.db2.gz	XIEMTASGAXGOAJ-CYBMUJFWSA-N	1	1	317.349	1.155	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827216575	705952082	/nfs/dbraw/zinc/95/20/82/705952082.db2.gz	ASGRMCVTMMEIEB-PWSUYJOCSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC[C@H]21	ZINC000827339435	705979976	/nfs/dbraw/zinc/97/99/76/705979976.db2.gz	TUPMZCUBSQPLLA-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000827499514	706015177	/nfs/dbraw/zinc/01/51/77/706015177.db2.gz	GYCMKOLMYRYKLK-CQSZACIVSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2cccc([N+](=O)[O-])c2C(C)=O)CC1	ZINC000882031319	707472840	/nfs/dbraw/zinc/47/28/40/707472840.db2.gz	CYCTVTMVHRZTLT-CYBMUJFWSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000880148202	706892899	/nfs/dbraw/zinc/89/28/99/706892899.db2.gz	SYCXPVRGVVWPLU-QWHCGFSZSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000837175600	707592108	/nfs/dbraw/zinc/59/21/08/707592108.db2.gz	UPPYIFJPUDHEBD-CQSZACIVSA-N	1	1	321.377	1.619	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000882957618	707871106	/nfs/dbraw/zinc/87/11/06/707871106.db2.gz	HKAOYMRMEVMAMK-ZDUSSCGKSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000838285913	707887701	/nfs/dbraw/zinc/88/77/01/707887701.db2.gz	PTAKEWZAGFWCOA-AWEZNQCLSA-N	1	1	319.317	1.767	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)c1	ZINC000838908644	708001381	/nfs/dbraw/zinc/00/13/81/708001381.db2.gz	ZHQSMGWBVPWXST-BETUJISGSA-N	1	1	320.345	1.923	20	5		DDBDMO
CON1CCC([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000839132348	708028945	/nfs/dbraw/zinc/02/89/45/708028945.db2.gz	ZMPRYHDPQHWBPE-OAHLLOKOSA-N	1	1	309.366	1.586	20	5		DDBDMO
COc1cccc([C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+](C)C)c1	ZINC000839462493	708049268	/nfs/dbraw/zinc/04/92/68/708049268.db2.gz	QKNPISCLTQTCHQ-MGPQQGTHSA-N	1	1	307.350	1.079	20	5		DDBDMO
CC[N@@H+](CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000896715764	708127699	/nfs/dbraw/zinc/12/76/99/708127699.db2.gz	XHOJHQIANQZAJO-UHFFFAOYSA-N	1	1	317.292	1.894	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@]12CC[N@@H+](C1)CCC2	ZINC000897241649	708266678	/nfs/dbraw/zinc/26/66/78/708266678.db2.gz	PDCIICYBFBWPOS-INIZCTEOSA-N	1	1	303.362	1.739	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c2ccccc21	ZINC000884541585	708325842	/nfs/dbraw/zinc/32/58/42/708325842.db2.gz	ITSUGLXAKCXZSG-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887938930	709173503	/nfs/dbraw/zinc/17/35/03/709173503.db2.gz	GYUUFGBCQGVMBU-ABAIWWIYSA-N	1	1	304.350	1.201	20	5		DDBDMO
Cc1c(C(=O)N2CCN(C)CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000888999174	709428692	/nfs/dbraw/zinc/42/86/92/709428692.db2.gz	XGHNZBOJPCSEFF-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1c(C(=O)N2CCN(C)CC[N@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000888999174	709428694	/nfs/dbraw/zinc/42/86/94/709428694.db2.gz	XGHNZBOJPCSEFF-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104021	713132181	/nfs/dbraw/zinc/13/21/81/713132181.db2.gz	STCAQWJFTNIOJO-KGLIPLIRSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104021	713132182	/nfs/dbraw/zinc/13/21/82/713132182.db2.gz	STCAQWJFTNIOJO-KGLIPLIRSA-N	1	1	321.402	1.904	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000910279572	709861258	/nfs/dbraw/zinc/86/12/58/709861258.db2.gz	BPCCTTVZPLDKQV-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@@H+]1CCCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000910279572	709861259	/nfs/dbraw/zinc/86/12/59/709861259.db2.gz	BPCCTTVZPLDKQV-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000910279572	709861262	/nfs/dbraw/zinc/86/12/62/709861262.db2.gz	BPCCTTVZPLDKQV-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000893133769	710559702	/nfs/dbraw/zinc/55/97/02/710559702.db2.gz	COJGWQMCISCXIG-ZWNOBZJWSA-N	1	1	321.377	1.881	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000893133769	710559703	/nfs/dbraw/zinc/55/97/03/710559703.db2.gz	COJGWQMCISCXIG-ZWNOBZJWSA-N	1	1	321.377	1.881	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1	ZINC000913293488	713193510	/nfs/dbraw/zinc/19/35/10/713193510.db2.gz	PATJYUHJFIAELW-IYBDPMFKSA-N	1	1	318.377	1.712	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637880	710833106	/nfs/dbraw/zinc/83/31/06/710833106.db2.gz	KTQAUNVEMMGILO-TZMCWYRMSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637880	710833109	/nfs/dbraw/zinc/83/31/09/710833109.db2.gz	KTQAUNVEMMGILO-TZMCWYRMSA-N	1	1	317.349	1.920	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc2n1CCOC2	ZINC000894390631	711099714	/nfs/dbraw/zinc/09/97/14/711099714.db2.gz	HICMAHNHTCPDQA-UHFFFAOYSA-N	1	1	316.361	1.996	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[NH+](CCc2ccncc2)CC1	ZINC000894847438	711294483	/nfs/dbraw/zinc/29/44/83/711294483.db2.gz	ZRUDHBOLHLHORA-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1CO	ZINC000894884182	711307815	/nfs/dbraw/zinc/30/78/15/711307815.db2.gz	DJHKHAVFDUQZID-SNVBAGLBSA-N	1	1	317.292	1.309	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1CO	ZINC000894884182	711307817	/nfs/dbraw/zinc/30/78/17/711307817.db2.gz	DJHKHAVFDUQZID-SNVBAGLBSA-N	1	1	317.292	1.309	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](C(=O)N(C)C)C2)c1[N+](=O)[O-]	ZINC000894907022	711315061	/nfs/dbraw/zinc/31/50/61/711315061.db2.gz	GHZWKKACLRSLDU-LLVKDONJSA-N	1	1	323.349	1.219	20	5		DDBDMO
CC(C)(CCc1noc([C@@H]2CCc3c[nH+]cn3C2)n1)[N+](=O)[O-]	ZINC000896314122	711705364	/nfs/dbraw/zinc/70/53/64/711705364.db2.gz	DCIZCYGSMWRRHO-SNVBAGLBSA-N	1	1	305.338	1.984	20	5		DDBDMO
Cn1cc(CN[C@H]2C[C@H]([NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000906516336	712344751	/nfs/dbraw/zinc/34/47/51/712344751.db2.gz	DRVPSUQKZBARRQ-JOCQHMNTSA-N	1	1	301.350	1.575	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000913930634	713321458	/nfs/dbraw/zinc/32/14/58/713321458.db2.gz	KEDWXUQPKIHLSM-SMDDNHRTSA-N	1	1	321.381	1.399	20	5		DDBDMO
CON1CC[C@@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000930636364	713883329	/nfs/dbraw/zinc/88/33/29/713883329.db2.gz	GAKYIBRVBFDQKW-DZGCQCFKSA-N	1	1	319.361	1.937	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000932346795	714315166	/nfs/dbraw/zinc/31/51/66/714315166.db2.gz	KUWZHCYPKDBHCG-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@@H]1CNC(=O)OC(C)(C)C	ZINC000932710161	714395029	/nfs/dbraw/zinc/39/50/29/714395029.db2.gz	LFXLZLXKEMBGPC-NWDGAFQWSA-N	1	1	301.387	1.746	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@@H]1C[C@@H]1CCCO1	ZINC000933684378	714647935	/nfs/dbraw/zinc/64/79/35/714647935.db2.gz	ARKIRYPUHBUNEN-KBPBESRZSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@@H]1C[C@@H]1CCCO1	ZINC000933684378	714647937	/nfs/dbraw/zinc/64/79/37/714647937.db2.gz	ARKIRYPUHBUNEN-KBPBESRZSA-N	1	1	324.381	1.370	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000933735319	714659087	/nfs/dbraw/zinc/65/90/87/714659087.db2.gz	HFXIGNMSBPRNSW-BMFZPTHFSA-N	1	1	305.378	1.512	20	5		DDBDMO
CC[N@@H+](CC1CC1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000957712925	716011183	/nfs/dbraw/zinc/01/11/83/716011183.db2.gz	AYGVTQRGMIQBDZ-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC[N@H+](CC1CC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000957712925	716011187	/nfs/dbraw/zinc/01/11/87/716011187.db2.gz	AYGVTQRGMIQBDZ-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC[N@@H+](CC1CC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000957712925	716011191	/nfs/dbraw/zinc/01/11/91/716011191.db2.gz	AYGVTQRGMIQBDZ-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncc([N+](=O)[O-])c4ccccc43)C[C@H]21	ZINC001164668058	719389029	/nfs/dbraw/zinc/38/90/29/719389029.db2.gz	PUMXRXNIQFDKDI-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])cc1NCc1ccc(N)[nH+]c1C	ZINC001167788342	738583582	/nfs/dbraw/zinc/58/35/82/738583582.db2.gz	YTFPAWQFAAFWAK-UHFFFAOYSA-N	1	1	317.305	1.674	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1C(C)(C)C1(C)C	ZINC001125312538	732650767	/nfs/dbraw/zinc/65/07/67/732650767.db2.gz	AUBXNXIQOADPBZ-UHFFFAOYSA-N	1	1	323.397	1.216	20	5		DDBDMO
Cc1nc(Cl)c([N+](=O)[O-])c(N2CCc3[nH+]ccn3CC2)n1	ZINC001167178165	732806488	/nfs/dbraw/zinc/80/64/88/732806488.db2.gz	KCZFZEZEEUOZFB-UHFFFAOYSA-N	1	1	308.729	1.606	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022064046	734368625	/nfs/dbraw/zinc/36/86/25/734368625.db2.gz	SDKHKEOOCHFBPS-XJFOESAGSA-N	1	1	323.780	1.742	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1[N+](=O)[O-]	ZINC001184387308	744031164	/nfs/dbraw/zinc/03/11/64/744031164.db2.gz	IVUBZHDSDNQJDB-JHJVBQTASA-N	1	1	321.377	1.739	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1ncc[nH]1	ZINC001031658592	747331560	/nfs/dbraw/zinc/33/15/60/747331560.db2.gz	NNWRQRYOAIOTAL-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
Cc1ccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001031661617	747337063	/nfs/dbraw/zinc/33/70/63/747337063.db2.gz	FARLXSGTCJJWJC-HUUCEWRRSA-N	1	1	303.362	1.208	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1cc[nH]c1	ZINC001031690747	747388204	/nfs/dbraw/zinc/38/82/04/747388204.db2.gz	YSCXPLJJOKFHBP-UHFFFAOYSA-N	1	1	314.345	1.785	20	5		DDBDMO
Cc1ncccc1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000996428411	749586017	/nfs/dbraw/zinc/58/60/17/749586017.db2.gz	BVUMHGKJLVMQKQ-HUUCEWRRSA-N	1	1	318.377	1.136	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169022490	762201330	/nfs/dbraw/zinc/20/13/30/762201330.db2.gz	CEVKWGRZQQAQID-ZNMIVQPWSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169052075	762207135	/nfs/dbraw/zinc/20/71/35/762207135.db2.gz	FXEDJRAZTCIFLJ-KFWWJZLASA-N	1	1	324.425	1.702	20	5		DDBDMO
COc1cccnc1O[C@@H]1CC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169050666	762207161	/nfs/dbraw/zinc/20/71/61/762207161.db2.gz	CHCYGVHIMOSZOM-HZSPNIEDSA-N	1	1	321.377	1.989	20	5		DDBDMO
COC(=O)c1cnc2c(c1)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169056286	762211328	/nfs/dbraw/zinc/21/13/28/762211328.db2.gz	RFGKWGUWYYRBGX-SMDDNHRTSA-N	1	1	319.361	1.672	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC001097190574	756980033	/nfs/dbraw/zinc/98/00/33/756980033.db2.gz	SWYYOUFUANEYLT-BETUJISGSA-N	1	1	320.393	1.994	20	5		DDBDMO
O=C(NCc1ccc(C[NH2+]CC2CC2)cc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001001525178	762937685	/nfs/dbraw/zinc/93/76/85/762937685.db2.gz	UUNKXEVWSTYKSX-UKRRQHHQSA-N	1	1	321.352	1.607	20	5		DDBDMO
COC(=O)C1C[NH+]([C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC001170335475	766257580	/nfs/dbraw/zinc/25/75/80/766257580.db2.gz	OGBGPKBJTGCHCV-SNVBAGLBSA-N	1	1	308.334	1.639	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC001136839750	772170860	/nfs/dbraw/zinc/17/08/60/772170860.db2.gz	SPPPJOUHMQTPMU-JTQLQIEISA-N	1	1	308.338	1.109	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cnc(N)c([N+](=O)[O-])c2)C[C@H]1C	ZINC001147741601	773227790	/nfs/dbraw/zinc/22/77/90/773227790.db2.gz	GEKCQQIFFCEZMA-PWSUYJOCSA-N	1	1	321.381	1.517	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001093787590	775078842	/nfs/dbraw/zinc/07/88/42/775078842.db2.gz	GCRMAJRCFWKLLZ-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ncc([N+](=O)[O-])cc1C	ZINC001094574076	776049075	/nfs/dbraw/zinc/04/90/75/776049075.db2.gz	MZRHBZNJQKUMMT-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CN(CCNC(=O)C[N@@H+](C)C1CCC1)c1ncccc1[N+](=O)[O-]	ZINC001100386806	776083807	/nfs/dbraw/zinc/08/38/07/776083807.db2.gz	WNTJTYQMXDVEBC-UHFFFAOYSA-N	1	1	321.381	1.027	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@@H](CO)[C@@H](O)C1)CC2	ZINC001172902310	776915930	/nfs/dbraw/zinc/91/59/30/776915930.db2.gz	AKFINVJCANPYTF-UXLLHSPISA-N	1	1	320.389	1.517	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233804	777064441	/nfs/dbraw/zinc/06/44/41/777064441.db2.gz	YXFMNWGBDDMDQN-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233804	777064448	/nfs/dbraw/zinc/06/44/48/777064448.db2.gz	YXFMNWGBDDMDQN-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
Cc1[nH]c(CNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)c(C)[nH+]1	ZINC001178441800	779030988	/nfs/dbraw/zinc/03/09/88/779030988.db2.gz	VRTDYOFWZAJVQZ-UHFFFAOYSA-N	1	1	318.333	1.938	20	5		DDBDMO
Cc1ncoc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178463759	779060795	/nfs/dbraw/zinc/06/07/95/779060795.db2.gz	KYOAGEXSSBSCRC-CHWSQXEVSA-N	1	1	324.381	1.414	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CC1	ZINC001110227884	779268038	/nfs/dbraw/zinc/26/80/38/779268038.db2.gz	QKCUDWOUIDRLPX-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCN(CC[NH2+]Cc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273376121	849739539	/nfs/dbraw/zinc/73/95/39/849739539.db2.gz	UXKFAWRLMQDSTO-TZMCWYRMSA-N	1	1	309.341	1.429	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768811183	881364394	/nfs/dbraw/zinc/36/43/94/881364394.db2.gz	GYOGSBKVHXZPSU-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768811183	881364410	/nfs/dbraw/zinc/36/44/10/881364410.db2.gz	GYOGSBKVHXZPSU-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
COc1ccc(NC(=O)NCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC001123267235	859152578	/nfs/dbraw/zinc/15/25/78/859152578.db2.gz	CVQDEIFBWRXEHL-UHFFFAOYSA-N	1	1	320.349	1.987	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[N@H+](C)[C@@H]1CCC[C@H]1O	ZINC001141708230	860916603	/nfs/dbraw/zinc/91/66/03/860916603.db2.gz	XZAIAYNSAQVIDP-ZIAGYGMSSA-N	1	1	321.377	1.995	20	5		DDBDMO
CC[N@@H+]1CCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C(C)(C)C1	ZINC001158561815	864729264	/nfs/dbraw/zinc/72/92/64/864729264.db2.gz	PBVYPXJJVPJTOA-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
CC[N@H+]1CCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C(C)(C)C1	ZINC001158561815	864729269	/nfs/dbraw/zinc/72/92/69/864729269.db2.gz	PBVYPXJJVPJTOA-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
C[C@@H]([NH2+]C1CC[NH+](CC(=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1	ZINC001332447472	865849564	/nfs/dbraw/zinc/84/95/64/865849564.db2.gz	FODOTWRIKSVRGR-LLVKDONJSA-N	1	1	307.350	1.794	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2C3CCC2(CO)CC3)c1	ZINC001334498108	867623226	/nfs/dbraw/zinc/62/32/26/867623226.db2.gz	YVZOUDQGMRHKLF-CXOJTPOUSA-N	1	1	322.361	1.324	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2cccnc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164491025	869230114	/nfs/dbraw/zinc/23/01/14/869230114.db2.gz	XUTOWVQJRNIBJI-ZIAGYGMSSA-N	1	1	318.377	1.123	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001226360567	882383324	/nfs/dbraw/zinc/38/33/24/882383324.db2.gz	DBQZTJHOZNMJAR-NSHDSACASA-N	1	1	324.333	1.863	20	5		DDBDMO
CCCN(C(=O)c1cnc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC001299832728	870941491	/nfs/dbraw/zinc/94/14/91/870941491.db2.gz	FHJAFKCAYZTHGM-NSHDSACASA-N	1	1	307.354	1.128	20	5		DDBDMO
NC(=O)CC[N@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-]	ZINC001307539426	871440859	/nfs/dbraw/zinc/44/08/59/871440859.db2.gz	QKOPFYQOUKXGEE-UHFFFAOYSA-N	1	1	314.345	1.867	20	5		DDBDMO
NC(=O)CC[N@@H+](Cc1ccccc1)Cc1cccnc1[N+](=O)[O-]	ZINC001307539426	871440868	/nfs/dbraw/zinc/44/08/68/871440868.db2.gz	QKOPFYQOUKXGEE-UHFFFAOYSA-N	1	1	314.345	1.867	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](Nc2ncccn2)C1	ZINC001308140441	871476008	/nfs/dbraw/zinc/47/60/08/871476008.db2.gz	LCDBGDQCHLGHGC-GFCCVEGCSA-N	1	1	317.353	1.076	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=CCC1	ZINC001344406456	872996387	/nfs/dbraw/zinc/99/63/87/872996387.db2.gz	DUMSPGKOCPLUQJ-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3cc(F)c([N+](=O)[O-])cc3CO)[C@@H]2C1	ZINC001348566011	874636494	/nfs/dbraw/zinc/63/64/94/874636494.db2.gz	UGPXSQJVIQVLJA-NDMJEZRESA-N	1	1	309.341	1.978	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3nc4ccc([N+](=O)[O-])cc4o3)[C@H]1CC(=O)C2	ZINC001227233721	882925108	/nfs/dbraw/zinc/92/51/08/882925108.db2.gz	FPQSQWUODVJFJX-MRCXROJRSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nc4ccc([N+](=O)[O-])cc4o3)[C@H]1CC(=O)C2	ZINC001227233721	882925123	/nfs/dbraw/zinc/92/51/23/882925123.db2.gz	FPQSQWUODVJFJX-MRCXROJRSA-N	1	1	317.301	1.919	20	5		DDBDMO
CCCCOCC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001227257848	882936546	/nfs/dbraw/zinc/93/65/46/882936546.db2.gz	GHBMXSBNDTXRNK-ZIAGYGMSSA-N	1	1	313.398	1.049	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC12CCCCC2	ZINC001350741204	875864806	/nfs/dbraw/zinc/86/48/06/875864806.db2.gz	OAQPQWNZRVJNKI-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
C[N@@H+]1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@@H]1CO	ZINC001353203917	877184510	/nfs/dbraw/zinc/18/45/10/877184510.db2.gz	RSFCVDZKRZIVRX-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@@H]1CO	ZINC001353203917	877184515	/nfs/dbraw/zinc/18/45/15/877184515.db2.gz	RSFCVDZKRZIVRX-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
Cc1cnc(CO[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c(C)c1[N+](=O)[O-]	ZINC001224183128	881262069	/nfs/dbraw/zinc/26/20/69/881262069.db2.gz	MVNFMMXZEMQOPB-GLQYFDAESA-N	1	1	319.361	1.927	20	5		DDBDMO
COC(=O)c1cc(O[C@@H]2CCc3[nH+]ccn3C2)cc([N+](=O)[O-])c1	ZINC001228772814	883662813	/nfs/dbraw/zinc/66/28/13/883662813.db2.gz	ZMZZSOOQFQVXGD-GFCCVEGCSA-N	1	1	317.301	1.972	20	5		DDBDMO
C[N@H+]1CCC[C@@H](Oc2n[nH]c(=O)c3ccc([N+](=O)[O-])cc32)C1	ZINC001229365110	883946237	/nfs/dbraw/zinc/94/62/37/883946237.db2.gz	RDQPMTDMOCXZGN-SNVBAGLBSA-N	1	1	304.306	1.717	20	5		DDBDMO
COCCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001231010050	885134670	/nfs/dbraw/zinc/13/46/70/885134670.db2.gz	IDHWPLAYMFPDIA-UHFFFAOYSA-N	1	1	309.366	1.569	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccn[nH]1)Cc1ccccc1[N+](=O)[O-]	ZINC001234245085	887785445	/nfs/dbraw/zinc/78/54/45/887785445.db2.gz	ZKDWXKFBZLBKTB-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O[C@@H]2CCC[N@H+](C)CC2)n1	ZINC001234908138	888243177	/nfs/dbraw/zinc/24/31/77/888243177.db2.gz	DHZBPFKPWQMDKB-LLVKDONJSA-N	1	1	323.353	1.515	20	5		DDBDMO
COc1ccc(C[C@H](C)N[C@H]2CC[NH2+]C[C@H]2F)c([N+](=O)[O-])c1	ZINC001246087555	892408195	/nfs/dbraw/zinc/40/81/95/892408195.db2.gz	OZWDOPFCTPYFKC-GDLCADMTSA-N	1	1	311.357	1.824	20	5		DDBDMO
O=C(NCC[NH+]1CC=CC1)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC001254876423	896644795	/nfs/dbraw/zinc/64/47/95/896644795.db2.gz	CWPRYFYTIKHPLA-UHFFFAOYSA-N	1	1	319.346	1.201	20	5		DDBDMO
COCCO[C@H]1C[C@H](CO)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000278261684	214054052	/nfs/dbraw/zinc/05/40/52/214054052.db2.gz	IGZVKZREEOZTEX-ZFWWWQNUSA-N	1	1	324.377	1.441	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450958711	230978386	/nfs/dbraw/zinc/97/83/86/230978386.db2.gz	WOBSRJXFFUXILI-SECBINFHSA-N	1	1	300.746	1.146	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000450958711	230978390	/nfs/dbraw/zinc/97/83/90/230978390.db2.gz	WOBSRJXFFUXILI-SECBINFHSA-N	1	1	300.746	1.146	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)cc1	ZINC000451306469	231063082	/nfs/dbraw/zinc/06/30/82/231063082.db2.gz	YHKCGJXGGUVPCI-USXIJHARSA-N	1	1	320.389	1.999	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000249484538	282159750	/nfs/dbraw/zinc/15/97/50/282159750.db2.gz	CFVYQIUFZHGWTD-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1CCO	ZINC000451670654	231158296	/nfs/dbraw/zinc/15/82/96/231158296.db2.gz	XCBJGROEUHDYDR-OKILXGFUSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)N1CCO	ZINC000451670654	231158305	/nfs/dbraw/zinc/15/83/05/231158305.db2.gz	XCBJGROEUHDYDR-OKILXGFUSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](C(N)=O)C1	ZINC000249590323	282179501	/nfs/dbraw/zinc/17/95/01/282179501.db2.gz	VDXXBHKNNKMMFG-WCQYABFASA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](C(N)=O)C1	ZINC000249590323	282179503	/nfs/dbraw/zinc/17/95/03/282179503.db2.gz	VDXXBHKNNKMMFG-WCQYABFASA-N	1	1	307.350	1.559	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000451263371	529485571	/nfs/dbraw/zinc/48/55/71/529485571.db2.gz	YUTPSTXYJUQYIG-MELADBBJSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000495215049	529572382	/nfs/dbraw/zinc/57/23/82/529572382.db2.gz	ZLMZQURYLNHDEO-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000495215049	529572385	/nfs/dbraw/zinc/57/23/85/529572385.db2.gz	ZLMZQURYLNHDEO-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000286592895	219070452	/nfs/dbraw/zinc/07/04/52/219070452.db2.gz	VYDUGLHIOJPAPP-NSHDSACASA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000286592895	219070455	/nfs/dbraw/zinc/07/04/55/219070455.db2.gz	VYDUGLHIOJPAPP-NSHDSACASA-N	1	1	320.349	1.086	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000454289760	529797565	/nfs/dbraw/zinc/79/75/65/529797565.db2.gz	MGPJWRSGQBFESH-OCCSQVGLSA-N	1	1	304.350	1.440	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1	ZINC000286744964	219142810	/nfs/dbraw/zinc/14/28/10/219142810.db2.gz	NYDGFYQURNWLKX-CQSZACIVSA-N	1	1	315.377	1.691	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000299331515	530063585	/nfs/dbraw/zinc/06/35/85/530063585.db2.gz	ZKFYKYRDCFOUES-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1C1CC1	ZINC000272670741	210076924	/nfs/dbraw/zinc/07/69/24/210076924.db2.gz	KNLJKQDYOPFQJW-ONGXEEELSA-N	1	1	305.334	1.655	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000272670741	210076926	/nfs/dbraw/zinc/07/69/26/210076926.db2.gz	KNLJKQDYOPFQJW-ONGXEEELSA-N	1	1	305.334	1.655	20	5		DDBDMO
C[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)[NH+]1CCSCC1	ZINC000089304764	295779298	/nfs/dbraw/zinc/77/92/98/295779298.db2.gz	TZBUOJWSSPPKTB-LBPRGKRZSA-N	1	1	323.418	1.691	20	5		DDBDMO
CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000279929623	215246862	/nfs/dbraw/zinc/24/68/62/215246862.db2.gz	WQMCUTCIVWBCPI-CYBMUJFWSA-N	1	1	308.334	1.664	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000279929623	215246864	/nfs/dbraw/zinc/24/68/64/215246864.db2.gz	WQMCUTCIVWBCPI-CYBMUJFWSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](O)C1	ZINC000041886267	352317568	/nfs/dbraw/zinc/31/75/68/352317568.db2.gz	KXTQGDIXDZKNRI-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000048023419	352521292	/nfs/dbraw/zinc/52/12/92/352521292.db2.gz	NUPHTBALNDPNRZ-AWEZNQCLSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC1CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1	ZINC000053898101	352671326	/nfs/dbraw/zinc/67/13/26/352671326.db2.gz	PMEBTQJJGPCHMS-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000173213423	198196479	/nfs/dbraw/zinc/19/64/79/198196479.db2.gz	RHBTUNGJJKYYNF-DOMZBBRYSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCC[C@@H](C)C1	ZINC000063749474	352923455	/nfs/dbraw/zinc/92/34/55/352923455.db2.gz	STEKDNZZAHAXKO-VXGBXAGGSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000066126023	352978896	/nfs/dbraw/zinc/97/88/96/352978896.db2.gz	XTUCIRDSTQOMJV-LBPRGKRZSA-N	1	1	309.366	1.820	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000067724281	353064891	/nfs/dbraw/zinc/06/48/91/353064891.db2.gz	HANBLLMTVLZGCP-UHFFFAOYSA-N	1	1	317.349	1.989	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCO)C1CC1	ZINC000067965659	353077864	/nfs/dbraw/zinc/07/78/64/353077864.db2.gz	ALTOXTLVHMPWPH-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000068219488	353096846	/nfs/dbraw/zinc/09/68/46/353096846.db2.gz	VYWDVVUVJBBHSZ-NSHDSACASA-N	1	1	307.350	1.573	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000173917852	198269150	/nfs/dbraw/zinc/26/91/50/198269150.db2.gz	VFHWSSFLODKQGQ-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@]2(CNC(=O)C2)C1	ZINC000072831144	353220012	/nfs/dbraw/zinc/22/00/12/353220012.db2.gz	LOBLSTUSQIRXJG-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@]2(CNC(=O)C2)C1	ZINC000072831144	353220015	/nfs/dbraw/zinc/22/00/15/353220015.db2.gz	LOBLSTUSQIRXJG-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)on1	ZINC000075640526	353373718	/nfs/dbraw/zinc/37/37/18/353373718.db2.gz	YZVOIEBLZPHMMN-STQMWFEESA-N	1	1	321.337	1.286	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000083217010	353707837	/nfs/dbraw/zinc/70/78/37/353707837.db2.gz	ZIBXUOZFOJZCET-JTQLQIEISA-N	1	1	318.333	1.823	20	5		DDBDMO
Cc1nc(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000090146174	353791431	/nfs/dbraw/zinc/79/14/31/353791431.db2.gz	LVJXVQPFSQPTJQ-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1nc(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000090146174	353791433	/nfs/dbraw/zinc/79/14/33/353791433.db2.gz	LVJXVQPFSQPTJQ-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000093333210	353896001	/nfs/dbraw/zinc/89/60/01/353896001.db2.gz	RFDFFFVWCCRSRD-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000108346736	353951516	/nfs/dbraw/zinc/95/15/16/353951516.db2.gz	GELRCCKKJUEHSV-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@](CO)(OC)C1	ZINC000401789583	354667117	/nfs/dbraw/zinc/66/71/17/354667117.db2.gz	VRDBDKKOTNWLNF-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@](CO)(OC)C1	ZINC000401789583	354667119	/nfs/dbraw/zinc/66/71/19/354667119.db2.gz	VRDBDKKOTNWLNF-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706851	354830741	/nfs/dbraw/zinc/83/07/41/354830741.db2.gz	SKBFFHFHMQBQGB-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706851	354830743	/nfs/dbraw/zinc/83/07/43/354830743.db2.gz	SKBFFHFHMQBQGB-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
Cc1c(C(=O)N2CC[C@@H]([N@H+]3CC[C@@H](O)C3)C2)cccc1[N+](=O)[O-]	ZINC000588860601	354943329	/nfs/dbraw/zinc/94/33/29/354943329.db2.gz	JYQOATUSLJYVOG-CHWSQXEVSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000589498394	354996995	/nfs/dbraw/zinc/99/69/95/354996995.db2.gz	UQKZMVWBDWSYCG-LLVKDONJSA-N	1	1	308.334	1.850	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590044199	355042515	/nfs/dbraw/zinc/04/25/15/355042515.db2.gz	IFRXHFZPJYPXOM-DZGCQCFKSA-N	1	1	303.362	1.933	20	5		DDBDMO
CCOc1cc(C[N@@H+](C[C@H](C)O)[C@H](C)CO)ccc1[N+](=O)[O-]	ZINC000276972766	213210782	/nfs/dbraw/zinc/21/07/82/213210782.db2.gz	XFELUBQVIIKZMC-NEPJUHHUSA-N	1	1	312.366	1.557	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590446890	355099434	/nfs/dbraw/zinc/09/94/34/355099434.db2.gz	WVSFCDSZUZUFFU-TZMCWYRMSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@H]2C1	ZINC000590446623	355099769	/nfs/dbraw/zinc/09/97/69/355099769.db2.gz	TYJAIVXHGVBAHF-YGRLFVJLSA-N	1	1	314.345	1.852	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])cc3F)C2)CC1	ZINC000591147597	355254827	/nfs/dbraw/zinc/25/48/27/355254827.db2.gz	STIJRALQIWJLHN-LLVKDONJSA-N	1	1	323.372	1.709	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3ncc([N+](=O)[O-])cc3F)C2)CC1	ZINC000591147597	355254832	/nfs/dbraw/zinc/25/48/32/355254832.db2.gz	STIJRALQIWJLHN-LLVKDONJSA-N	1	1	323.372	1.709	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@H+](C)C[C@@H]21	ZINC000591534391	355324493	/nfs/dbraw/zinc/32/44/93/355324493.db2.gz	AHTTUCVQQBOUDM-DOMZBBRYSA-N	1	1	303.362	1.988	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000593062078	355783875	/nfs/dbraw/zinc/78/38/75/355783875.db2.gz	XEJKIAGDNCXTEC-UONOGXRCSA-N	1	1	324.333	1.043	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000593062078	355783876	/nfs/dbraw/zinc/78/38/76/355783876.db2.gz	XEJKIAGDNCXTEC-UONOGXRCSA-N	1	1	324.333	1.043	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000593187605	355819673	/nfs/dbraw/zinc/81/96/73/355819673.db2.gz	MKHPHXODYNUZKI-JLLWLGSASA-N	1	1	306.366	1.851	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CN[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000593969922	356077036	/nfs/dbraw/zinc/07/70/36/356077036.db2.gz	GNYIHCASRJFJJM-QWHCGFSZSA-N	1	1	311.382	1.185	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(CN2CCN(c3[nH]cc[nH+]3)CC2)c(F)c1	ZINC000593979708	356078710	/nfs/dbraw/zinc/07/87/10/356078710.db2.gz	QOBOQTOZOJNREY-UHFFFAOYSA-N	1	1	323.303	1.918	20	5		DDBDMO
Cn1cnnc1N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000594024275	356093373	/nfs/dbraw/zinc/09/33/73/356093373.db2.gz	ZIJFYONBFBYHPD-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](OC3CCC3)C2)c1	ZINC000594027792	356094202	/nfs/dbraw/zinc/09/42/02/356094202.db2.gz	ZVFYKPXMTXZKLD-HIFRSBDPSA-N	1	1	324.381	1.186	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595829059	356666729	/nfs/dbraw/zinc/66/67/29/356666729.db2.gz	GZIPKAKGGPCPEG-CHWSQXEVSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595829059	356666730	/nfs/dbraw/zinc/66/67/30/356666730.db2.gz	GZIPKAKGGPCPEG-CHWSQXEVSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595871950	356687232	/nfs/dbraw/zinc/68/72/32/356687232.db2.gz	IXWCYTFQLSDQEG-ZUZCIYMTSA-N	1	1	307.350	1.144	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc(N)c([N+](=O)[O-])n1	ZINC000596173181	356801689	/nfs/dbraw/zinc/80/16/89/356801689.db2.gz	QGGGMFYPOIFHPZ-UHFFFAOYSA-N	1	1	323.397	1.367	20	5		DDBDMO
Cc1nc(N2CCC([N@H+]3CCCOCC3)CC2)ccc1[N+](=O)[O-]	ZINC000596268565	356838921	/nfs/dbraw/zinc/83/89/21/356838921.db2.gz	LYISSEVTOUWBAP-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cc1cc3c(cc1[N+](=O)[O-])OCCO3)C2	ZINC000597209903	357094769	/nfs/dbraw/zinc/09/47/69/357094769.db2.gz	FJOFLBIOCGYQFG-WBMJQRKESA-N	1	1	320.345	1.834	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](CO)C1	ZINC000598651464	357671648	/nfs/dbraw/zinc/67/16/48/357671648.db2.gz	SVENGAPEZBXIAW-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](CO)C1	ZINC000598651464	357671655	/nfs/dbraw/zinc/67/16/55/357671655.db2.gz	SVENGAPEZBXIAW-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598652065	357671709	/nfs/dbraw/zinc/67/17/09/357671709.db2.gz	WTISVTANRRKVJE-QWHCGFSZSA-N	1	1	321.377	1.874	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1	ZINC000598562030	357633737	/nfs/dbraw/zinc/63/37/37/357633737.db2.gz	RXHYTUYAFXTHSU-ZDUSSCGKSA-N	1	1	321.381	1.030	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000599064859	357805656	/nfs/dbraw/zinc/80/56/56/357805656.db2.gz	GCCASRPLBNQULM-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000599064859	357805661	/nfs/dbraw/zinc/80/56/61/357805661.db2.gz	GCCASRPLBNQULM-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[C@@H]1CC[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[NH2+]1	ZINC000599104018	357816414	/nfs/dbraw/zinc/81/64/14/357816414.db2.gz	KWXRKXMUODMBIB-RKDXNWHRSA-N	1	1	317.342	1.153	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000599137648	357826849	/nfs/dbraw/zinc/82/68/49/357826849.db2.gz	ARXAVVKTIVUCLD-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1NCC[N@@H+]1CC[C@@H](O)C1	ZINC000599175973	357840578	/nfs/dbraw/zinc/84/05/78/357840578.db2.gz	LPSGVMSQCJCSPY-LLVKDONJSA-N	1	1	302.334	1.043	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H](C)C1(F)F	ZINC000599512294	357961022	/nfs/dbraw/zinc/96/10/22/357961022.db2.gz	HVGFEBSTIIXEKL-JFGNBEQYSA-N	1	1	318.324	1.375	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCS(=O)(=O)CC3)c2c1	ZINC000601110658	358405425	/nfs/dbraw/zinc/40/54/25/358405425.db2.gz	JKRBNUDERYBBPA-UHFFFAOYSA-N	1	1	307.331	1.378	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2COC[C@@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000601972370	358760622	/nfs/dbraw/zinc/76/06/22/358760622.db2.gz	FMIDLHAQNKHTTD-BETUJISGSA-N	1	1	317.345	1.062	20	5		DDBDMO
CCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602472770	359001672	/nfs/dbraw/zinc/00/16/72/359001672.db2.gz	PNTHPHGWRCUCJU-OLZOCXBDSA-N	1	1	324.381	1.080	20	5		DDBDMO
CS[C@@H]1C[N@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000602797271	359199454	/nfs/dbraw/zinc/19/94/54/359199454.db2.gz	IBPQQAYJLGVXTI-VXGBXAGGSA-N	1	1	313.427	1.077	20	5		DDBDMO
CS[C@@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000602797271	359199462	/nfs/dbraw/zinc/19/94/62/359199462.db2.gz	IBPQQAYJLGVXTI-VXGBXAGGSA-N	1	1	313.427	1.077	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@]2(CCOC2)OC(C)(C)C1	ZINC000602822144	359216138	/nfs/dbraw/zinc/21/61/38/359216138.db2.gz	SBXDMTKMXLQUNQ-HNNXBMFYSA-N	1	1	324.381	1.370	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899263	359280609	/nfs/dbraw/zinc/28/06/09/359280609.db2.gz	OYVPQTBVUBQMBM-WCQYABFASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899263	359280611	/nfs/dbraw/zinc/28/06/11/359280611.db2.gz	OYVPQTBVUBQMBM-WCQYABFASA-N	1	1	300.742	1.566	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@H+](C)C[C@H]1CO	ZINC000602902399	359282755	/nfs/dbraw/zinc/28/27/55/359282755.db2.gz	BWFLOFRWRMVPRU-HNNXBMFYSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C)C[C@H]1CO	ZINC000602902399	359282761	/nfs/dbraw/zinc/28/27/61/359282761.db2.gz	BWFLOFRWRMVPRU-HNNXBMFYSA-N	1	1	323.393	1.490	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1	ZINC000602957754	359321883	/nfs/dbraw/zinc/32/18/83/359321883.db2.gz	PQZMTIJVSZGBKZ-GFCCVEGCSA-N	1	1	321.381	1.526	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC000602960500	359322341	/nfs/dbraw/zinc/32/23/41/359322341.db2.gz	KOKLVZKGKPOWAQ-LBPRGKRZSA-N	1	1	321.381	1.668	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@](C)(CO)C1	ZINC000602964443	359327916	/nfs/dbraw/zinc/32/79/16/359327916.db2.gz	PNLVSYXNQSMROH-JKSUJKDBSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(CO)CC1	ZINC000186803711	200013171	/nfs/dbraw/zinc/01/31/71/200013171.db2.gz	IWNDJGNSFCVDBK-CYBMUJFWSA-N	1	1	310.350	1.039	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)CC[N@@H+](C)C1CC1	ZINC000186804082	200014650	/nfs/dbraw/zinc/01/46/50/200014650.db2.gz	CBYYYISGZVCKEF-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1O	ZINC000186900490	200028508	/nfs/dbraw/zinc/02/85/08/200028508.db2.gz	HPDTXANIZJCYTP-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000603400391	359616623	/nfs/dbraw/zinc/61/66/23/359616623.db2.gz	HGRXPNSIOMPJDF-NSHDSACASA-N	1	1	324.356	1.818	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O	ZINC000188688318	200287365	/nfs/dbraw/zinc/28/73/65/200287365.db2.gz	OSJCNIZGLJEERF-LBPRGKRZSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1CC(C)(C)O	ZINC000188724470	200294233	/nfs/dbraw/zinc/29/42/33/200294233.db2.gz	NHORKUKLNIPIQQ-GFCCVEGCSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000188724470	200294235	/nfs/dbraw/zinc/29/42/35/200294235.db2.gz	NHORKUKLNIPIQQ-GFCCVEGCSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000609257960	360277305	/nfs/dbraw/zinc/27/73/05/360277305.db2.gz	XYBHVQZVGCUKFM-SECBINFHSA-N	1	1	307.306	1.148	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000610070455	360378329	/nfs/dbraw/zinc/37/83/29/360378329.db2.gz	AHJHMTNPUKMGBC-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1OC	ZINC000610484691	360447474	/nfs/dbraw/zinc/44/74/74/360447474.db2.gz	DJSMGXOTRITSBL-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000610615774	360482841	/nfs/dbraw/zinc/48/28/41/360482841.db2.gz	SMWAFXXQKFSVOB-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000610615774	360482848	/nfs/dbraw/zinc/48/28/48/360482848.db2.gz	SMWAFXXQKFSVOB-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1C1CCN(c2ccsc2[N+](=O)[O-])CC1	ZINC000611242540	360676839	/nfs/dbraw/zinc/67/68/39/360676839.db2.gz	SJOZWHXHZDQLTC-NSHDSACASA-N	1	1	324.406	1.575	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCN(c2sccc2[N+](=O)[O-])CC1	ZINC000611413831	360714924	/nfs/dbraw/zinc/71/49/24/360714924.db2.gz	ZDCIRLQOTITMGJ-NSHDSACASA-N	1	1	324.406	1.399	20	5		DDBDMO
C[C@@H]1[NH2+]CCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000193558616	201075418	/nfs/dbraw/zinc/07/54/18/201075418.db2.gz	WKGPLULPBKGMAC-GZMMTYOYSA-N	1	1	303.322	1.341	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C(=O)NCC[C@@H]1C	ZINC000193633866	201091532	/nfs/dbraw/zinc/09/15/32/201091532.db2.gz	JMJVIXQRGVJDHE-XHDPSFHLSA-N	1	1	321.377	1.996	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+]2CCN1CCC2	ZINC000619873755	364170684	/nfs/dbraw/zinc/17/06/84/364170684.db2.gz	UTESVQZCBCCKQB-CQSZACIVSA-N	1	1	318.377	1.023	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1	ZINC000351078319	284300670	/nfs/dbraw/zinc/30/06/70/284300670.db2.gz	XVXDYZJXQFVSNM-UHFFFAOYSA-N	1	1	307.354	1.128	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000266114864	205109003	/nfs/dbraw/zinc/10/90/03/205109003.db2.gz	NMUUKBJABDELDK-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000159787185	197364431	/nfs/dbraw/zinc/36/44/31/197364431.db2.gz	ROTUHNCMSRZPLI-WFASDCNBSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1CCNC(=O)[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000284739777	218155824	/nfs/dbraw/zinc/15/58/24/218155824.db2.gz	KUCWSWWEFRROMB-QPUJVOFHSA-N	1	1	308.294	1.117	20	5		DDBDMO
CC(C)[N@H+](CCOCCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000338594443	250048747	/nfs/dbraw/zinc/04/87/47/250048747.db2.gz	XHICLENDZBEIGD-UHFFFAOYSA-N	1	1	322.365	1.690	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000338594443	250048751	/nfs/dbraw/zinc/04/87/51/250048751.db2.gz	XHICLENDZBEIGD-UHFFFAOYSA-N	1	1	322.365	1.690	20	5		DDBDMO
C[C@@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1	ZINC000105177119	194082181	/nfs/dbraw/zinc/08/21/81/194082181.db2.gz	NTOVWQBMERYRCR-LBPRGKRZSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000057701519	184047584	/nfs/dbraw/zinc/04/75/84/184047584.db2.gz	NOSLVJJPHBRRPD-LLVKDONJSA-N	1	1	306.366	1.606	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C[NH+]1CCCC1	ZINC000269219898	207340169	/nfs/dbraw/zinc/34/01/69/207340169.db2.gz	ZYZZALJHEFVTTA-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
COc1cc(C[N@H+]2CCCC[C@@H]2CC(N)=O)ccc1[N+](=O)[O-]	ZINC000352407568	285030075	/nfs/dbraw/zinc/03/00/75/285030075.db2.gz	VLFYHSXPEXHJNC-GFCCVEGCSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1ccc(OCC[N@@H+](CCO)CC2CC2)c([N+](=O)[O-])c1	ZINC000352467658	285072009	/nfs/dbraw/zinc/07/20/09/285072009.db2.gz	MEOLYOIWBFEHPT-UHFFFAOYSA-N	1	1	310.350	1.687	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccncc1	ZINC000352563780	285144166	/nfs/dbraw/zinc/14/41/66/285144166.db2.gz	UCSCRXXRWFQNPK-UHFFFAOYSA-N	1	1	314.345	1.525	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)Nc1ccncc1	ZINC000352563780	285144167	/nfs/dbraw/zinc/14/41/67/285144167.db2.gz	UCSCRXXRWFQNPK-UHFFFAOYSA-N	1	1	314.345	1.525	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCC[C@@H]1O	ZINC000352661254	285205380	/nfs/dbraw/zinc/20/53/80/285205380.db2.gz	RNRJCJHJGZXACX-STQMWFEESA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCC[C@@H]1O	ZINC000352661254	285205382	/nfs/dbraw/zinc/20/53/82/285205382.db2.gz	RNRJCJHJGZXACX-STQMWFEESA-N	1	1	318.333	1.990	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000444750490	533200196	/nfs/dbraw/zinc/20/01/96/533200196.db2.gz	DXXDWRKXOGSZBE-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000352820994	285320362	/nfs/dbraw/zinc/32/03/62/285320362.db2.gz	RPDFTKVLHXIVLU-UWVGGRQHSA-N	1	1	309.370	1.477	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000352869377	285348296	/nfs/dbraw/zinc/34/82/96/285348296.db2.gz	WJXRSTUEQCBWKN-GHMZBOCLSA-N	1	1	323.397	1.629	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000299690377	533554379	/nfs/dbraw/zinc/55/43/79/533554379.db2.gz	VWTLYVGPBKJMKC-STQMWFEESA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@@H+](C)C[C@H]2C)c1	ZINC000330689938	292290327	/nfs/dbraw/zinc/29/03/27/292290327.db2.gz	WDUCOQVSXWDZHM-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)C[C@H]2C)c1	ZINC000330689938	292290329	/nfs/dbraw/zinc/29/03/29/292290329.db2.gz	WDUCOQVSXWDZHM-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@H]1CO)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000123010328	407316522	/nfs/dbraw/zinc/31/65/22/407316522.db2.gz	UOOCETHGANSAQR-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@H]1CO)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000123010328	407316523	/nfs/dbraw/zinc/31/65/23/407316523.db2.gz	UOOCETHGANSAQR-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
COC[C@](C)(CC(=O)OC)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000123466428	407329833	/nfs/dbraw/zinc/32/98/33/407329833.db2.gz	APGDAEPDWIYXQB-AWEZNQCLSA-N	1	1	314.313	1.792	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)c2ccccc2C1	ZINC000103410798	407338529	/nfs/dbraw/zinc/33/85/29/407338529.db2.gz	FXQXDFUGEGXMLV-UHFFFAOYSA-N	1	1	315.333	1.270	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)c2ccccc2C1	ZINC000103410798	407338531	/nfs/dbraw/zinc/33/85/31/407338531.db2.gz	FXQXDFUGEGXMLV-UHFFFAOYSA-N	1	1	315.333	1.270	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000124661760	407365758	/nfs/dbraw/zinc/36/57/58/407365758.db2.gz	KAYBMWKJJWPKLA-RYUDHWBXSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000124982999	407375487	/nfs/dbraw/zinc/37/54/87/407375487.db2.gz	RYCULNAIMWTWFD-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000124982999	407375488	/nfs/dbraw/zinc/37/54/88/407375488.db2.gz	RYCULNAIMWTWFD-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000111276889	407404707	/nfs/dbraw/zinc/40/47/07/407404707.db2.gz	OVSZKHUTDFOXHO-QEJZJMRPSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000111276889	407404709	/nfs/dbraw/zinc/40/47/09/407404709.db2.gz	OVSZKHUTDFOXHO-QEJZJMRPSA-N	1	1	324.377	1.834	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000265807058	407465452	/nfs/dbraw/zinc/46/54/52/407465452.db2.gz	PFCITIFFAKMQBN-GFCCVEGCSA-N	1	1	319.361	1.452	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000113437912	407501982	/nfs/dbraw/zinc/50/19/82/407501982.db2.gz	DKYQLACFAIAUAI-NSHDSACASA-N	1	1	322.365	1.690	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C[C@H]1CCC[N@@H+](C)C1	ZINC000151962275	407533933	/nfs/dbraw/zinc/53/39/33/407533933.db2.gz	PZIKDKLHIZQRIB-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000245613598	408028440	/nfs/dbraw/zinc/02/84/40/408028440.db2.gz	LZDSXWDIFKBHCT-QWHCGFSZSA-N	1	1	312.391	1.772	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCOC3(CCOCC3)C2)c1	ZINC000154472795	408040846	/nfs/dbraw/zinc/04/08/46/408040846.db2.gz	JEOKPLFPPSFEHI-HNNXBMFYSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCOC3(CCOCC3)C2)c1	ZINC000154472795	408040849	/nfs/dbraw/zinc/04/08/49/408040849.db2.gz	JEOKPLFPPSFEHI-HNNXBMFYSA-N	1	1	322.361	1.510	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000175211396	408079934	/nfs/dbraw/zinc/07/99/34/408079934.db2.gz	GQXKKMVTSFDMAP-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000136222783	408090329	/nfs/dbraw/zinc/09/03/29/408090329.db2.gz	RPCMQAWIZYEADS-PHIMTYICSA-N	1	1	309.370	1.416	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+](CCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136222783	408090335	/nfs/dbraw/zinc/09/03/35/408090335.db2.gz	RPCMQAWIZYEADS-PHIMTYICSA-N	1	1	309.370	1.416	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136222783	408090340	/nfs/dbraw/zinc/09/03/40/408090340.db2.gz	RPCMQAWIZYEADS-PHIMTYICSA-N	1	1	309.370	1.416	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2[nH]nc(CC)c2[N+](=O)[O-])C1	ZINC000175329037	408107452	/nfs/dbraw/zinc/10/74/52/408107452.db2.gz	VJLSKAAYZKPQLT-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCC[N@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])C1	ZINC000175329037	408107456	/nfs/dbraw/zinc/10/74/56/408107456.db2.gz	VJLSKAAYZKPQLT-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])C1	ZINC000175329037	408107459	/nfs/dbraw/zinc/10/74/59/408107459.db2.gz	VJLSKAAYZKPQLT-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000140404081	408175249	/nfs/dbraw/zinc/17/52/49/408175249.db2.gz	XYBBPFQOUZZIHP-PHIMTYICSA-N	1	1	311.386	1.628	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000140404081	408175252	/nfs/dbraw/zinc/17/52/52/408175252.db2.gz	XYBBPFQOUZZIHP-PHIMTYICSA-N	1	1	311.386	1.628	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C[C@H]2CCN(C(C)=O)C2)cc1[N+](=O)[O-]	ZINC000156510150	408258467	/nfs/dbraw/zinc/25/84/67/408258467.db2.gz	GMCWEYNDONKYFD-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000183198501	408349424	/nfs/dbraw/zinc/34/94/24/408349424.db2.gz	KUASMYUWIGSIRS-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000183198501	408349428	/nfs/dbraw/zinc/34/94/28/408349428.db2.gz	KUASMYUWIGSIRS-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183185017	408346317	/nfs/dbraw/zinc/34/63/17/408346317.db2.gz	AGRFETPLPRKKJK-YPMHNXCESA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183185017	408346323	/nfs/dbraw/zinc/34/63/23/408346323.db2.gz	AGRFETPLPRKKJK-YPMHNXCESA-N	1	1	319.361	1.187	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1	ZINC000173257767	162328526	/nfs/dbraw/zinc/32/85/26/162328526.db2.gz	PFAHMBUJTMJUCI-CYBMUJFWSA-N	1	1	321.381	1.172	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2cnn(C)c2)CC1	ZINC000183345080	408385421	/nfs/dbraw/zinc/38/54/21/408385421.db2.gz	DLYURWSRCKMBEI-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000247329408	408450999	/nfs/dbraw/zinc/45/09/99/408450999.db2.gz	MXHDUIRISZNAAB-SWLSCSKDSA-N	1	1	305.378	1.982	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C	ZINC000191327582	408406176	/nfs/dbraw/zinc/40/61/76/408406176.db2.gz	SJYXJULDOLORTP-UHFFFAOYSA-N	1	1	324.381	1.647	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)n1	ZINC000191789285	408492568	/nfs/dbraw/zinc/49/25/68/408492568.db2.gz	NABKWVDFGJGSJG-LBPRGKRZSA-N	1	1	323.397	1.661	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@H](O)C2CC2)cccc1[N+](=O)[O-]	ZINC000160853212	408529651	/nfs/dbraw/zinc/52/96/51/408529651.db2.gz	ZWJLJSLNDFXJLZ-NHYWBVRUSA-N	1	1	321.377	1.933	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC=C(C(F)(F)F)CC1	ZINC000270609786	408602773	/nfs/dbraw/zinc/60/27/73/408602773.db2.gz	ZBEDGZNIFXYOEK-UHFFFAOYSA-N	1	1	317.267	1.951	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC=C(C(F)(F)F)CC1	ZINC000270609786	408602779	/nfs/dbraw/zinc/60/27/79/408602779.db2.gz	ZBEDGZNIFXYOEK-UHFFFAOYSA-N	1	1	317.267	1.951	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000177162534	408538859	/nfs/dbraw/zinc/53/88/59/408538859.db2.gz	GXZLDTRBHQKFAE-ONGXEEELSA-N	1	1	304.350	1.653	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000161486353	408608351	/nfs/dbraw/zinc/60/83/51/408608351.db2.gz	OILRHRPULQUPLX-UHFFFAOYSA-N	1	1	323.393	1.530	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000249262085	408707330	/nfs/dbraw/zinc/70/73/30/408707330.db2.gz	HFDYUOJMAWLYAP-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1	ZINC000162188185	408677339	/nfs/dbraw/zinc/67/73/39/408677339.db2.gz	XPSONIUHPPLVKG-ZDUSSCGKSA-N	1	1	323.397	1.194	20	5		DDBDMO
CCn1cc(C[NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])cn1	ZINC000265571800	408697830	/nfs/dbraw/zinc/69/78/30/408697830.db2.gz	WXNMYDIWORJPSO-UHFFFAOYSA-N	1	1	306.322	1.815	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000251853244	408787682	/nfs/dbraw/zinc/78/76/82/408787682.db2.gz	QPAILHDQOPQQMG-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000251853244	408787686	/nfs/dbraw/zinc/78/76/86/408787686.db2.gz	QPAILHDQOPQQMG-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC(F)(F)[C@H](CO)C1	ZINC000292029950	408966021	/nfs/dbraw/zinc/96/60/21/408966021.db2.gz	YXOYRLFQRUVPPV-NSHDSACASA-N	1	1	316.304	1.923	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC(F)(F)[C@H](CO)C1	ZINC000292029950	408966023	/nfs/dbraw/zinc/96/60/23/408966023.db2.gz	YXOYRLFQRUVPPV-NSHDSACASA-N	1	1	316.304	1.923	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](C)CC1	ZINC000282049120	408979579	/nfs/dbraw/zinc/97/95/79/408979579.db2.gz	VEDDVVPRPWDTSM-UHFFFAOYSA-N	1	1	308.338	1.773	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1	ZINC000277683316	408992452	/nfs/dbraw/zinc/99/24/52/408992452.db2.gz	YVQYFMWGTAKHRO-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@H](C2CCC2)C1	ZINC000292183527	408997249	/nfs/dbraw/zinc/99/72/49/408997249.db2.gz	QUCNCTHDISBAKQ-CQSZACIVSA-N	1	1	321.377	1.505	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)c1cc(N)ccc1[N+](=O)[O-]	ZINC000282247977	409018307	/nfs/dbraw/zinc/01/83/07/409018307.db2.gz	MPJOCCIFRAPWFO-UHFFFAOYSA-N	1	1	308.382	1.724	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)c1cc(N)ccc1[N+](=O)[O-]	ZINC000282247977	409018309	/nfs/dbraw/zinc/01/83/09/409018309.db2.gz	MPJOCCIFRAPWFO-UHFFFAOYSA-N	1	1	308.382	1.724	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H](O)CC2)c1	ZINC000293288055	409082942	/nfs/dbraw/zinc/08/29/42/409082942.db2.gz	VURYUIXGWSLYMN-KGLIPLIRSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284012562	409257830	/nfs/dbraw/zinc/25/78/30/409257830.db2.gz	OEMLNHWEDWJTPU-SNVBAGLBSA-N	1	1	324.356	1.920	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[N@H+](C[C@@H](C)O)C[C@H]1C	ZINC000284269196	409307497	/nfs/dbraw/zinc/30/74/97/409307497.db2.gz	GUUBLVWFPPMXQL-ZIAGYGMSSA-N	1	1	307.394	1.790	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000280518730	409337811	/nfs/dbraw/zinc/33/78/11/409337811.db2.gz	CEZIJUVUBXTCQB-HNNXBMFYSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@H](C(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C)CC1	ZINC000295260788	409401747	/nfs/dbraw/zinc/40/17/47/409401747.db2.gz	GCJFLDMBADPCOF-QWHCGFSZSA-N	1	1	320.393	1.408	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000285380478	409419846	/nfs/dbraw/zinc/41/98/46/409419846.db2.gz	WLXVHSFMWGBZFQ-ZIAGYGMSSA-N	1	1	305.334	1.140	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000317768836	164029189	/nfs/dbraw/zinc/02/91/89/164029189.db2.gz	QKAMYUGUZPNYOR-OLZOCXBDSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000331560306	409638179	/nfs/dbraw/zinc/63/81/79/409638179.db2.gz	SXGOMCPNRJYPJA-SNVBAGLBSA-N	1	1	305.334	1.570	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000342351353	409586121	/nfs/dbraw/zinc/58/61/21/409586121.db2.gz	WSQKKNIVLYZBIC-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+](Cc1cccc(F)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304302907	409596715	/nfs/dbraw/zinc/59/67/15/409596715.db2.gz	IQZOGWMHRGYCBU-HNNXBMFYSA-N	1	1	322.340	1.813	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000345075454	409616077	/nfs/dbraw/zinc/61/60/77/409616077.db2.gz	ODSZVTPOHWWGEL-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000356903496	409707555	/nfs/dbraw/zinc/70/75/55/409707555.db2.gz	PRLJFEMSRQTCBL-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
COc1c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331591917	409671496	/nfs/dbraw/zinc/67/14/96/409671496.db2.gz	XZBUEQYHXSLZJN-MNOVXSKESA-N	1	1	319.361	1.958	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000349990939	409921275	/nfs/dbraw/zinc/92/12/75/409921275.db2.gz	NCXCQZLPPJDZJJ-UHFFFAOYSA-N	1	1	306.322	1.077	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](C)C1	ZINC000346244110	409870645	/nfs/dbraw/zinc/87/06/45/409870645.db2.gz	UNJPEFOYRLLDEA-SRVKXCTJSA-N	1	1	321.381	1.131	20	5		DDBDMO
Cc1nn(CCC(=O)NCC[N@H+](C)C(C)C)c(C)c1[N+](=O)[O-]	ZINC000338814388	410040039	/nfs/dbraw/zinc/04/00/39/410040039.db2.gz	HGRFLSNNPGCJIT-UHFFFAOYSA-N	1	1	311.386	1.255	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000354739924	410052218	/nfs/dbraw/zinc/05/22/18/410052218.db2.gz	NZAIOIAXUQLTBQ-UHFFFAOYSA-N	1	1	301.368	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000342986099	410053067	/nfs/dbraw/zinc/05/30/67/410053067.db2.gz	AMDUWSZGLVGNDO-KWQFWETISA-N	1	1	303.322	1.607	20	5		DDBDMO
COc1c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000354811978	410105650	/nfs/dbraw/zinc/10/56/50/410105650.db2.gz	WVKSWVIVJNJVSM-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000298471474	410245236	/nfs/dbraw/zinc/24/52/36/410245236.db2.gz	QOAJQMFIRLYHBB-GFCCVEGCSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000298732262	410372952	/nfs/dbraw/zinc/37/29/52/410372952.db2.gz	JRWRWOWOXPAROU-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](O)CC1	ZINC000339778647	410453609	/nfs/dbraw/zinc/45/36/09/410453609.db2.gz	FIKUKUKGBSPLAF-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](O)CC1	ZINC000339778647	410453613	/nfs/dbraw/zinc/45/36/13/410453613.db2.gz	FIKUKUKGBSPLAF-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000352235567	410569561	/nfs/dbraw/zinc/56/95/61/410569561.db2.gz	XCLXGDKRLJPDCR-LBPRGKRZSA-N	1	1	319.361	1.452	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000343612961	410571435	/nfs/dbraw/zinc/57/14/35/410571435.db2.gz	QCVLGYBJAQXARA-AWEZNQCLSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@@H]1CCCOC1	ZINC000352196558	410540394	/nfs/dbraw/zinc/54/03/94/410540394.db2.gz	ZXRGEQDHKBAZQG-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H]1CCCOC1	ZINC000352196558	410540401	/nfs/dbraw/zinc/54/04/01/410540401.db2.gz	ZXRGEQDHKBAZQG-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CCC[N@H+]1C	ZINC000343583802	410551430	/nfs/dbraw/zinc/55/14/30/410551430.db2.gz	ZKEAPTRZIIRKNT-KOLCDFICSA-N	1	1	321.333	1.536	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])c4cnccc43)C[C@H]21	ZINC000301682872	410771087	/nfs/dbraw/zinc/77/10/87/410771087.db2.gz	VUKRLOGMFPPUQF-CVEARBPZSA-N	1	1	314.345	1.662	20	5		DDBDMO
Cc1cc(N2CCC[C@H]2C[N@H+]2CCC[C@H]2CO)ncc1[N+](=O)[O-]	ZINC000301591950	410750029	/nfs/dbraw/zinc/75/00/29/410750029.db2.gz	YMBUURHMBHKJCR-KBPBESRZSA-N	1	1	320.393	1.724	20	5		DDBDMO
Cc1c([C@@H](C)NC[C@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673532	410865380	/nfs/dbraw/zinc/86/53/80/410865380.db2.gz	HKGPOMFCILMVPH-KGLIPLIRSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1c([C@@H](C)NC[C@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673532	410865384	/nfs/dbraw/zinc/86/53/84/410865384.db2.gz	HKGPOMFCILMVPH-KGLIPLIRSA-N	1	1	306.410	1.800	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@]1(CO)CCOC1	ZINC000359816004	410897326	/nfs/dbraw/zinc/89/73/26/410897326.db2.gz	VOVBIKKUMUTBED-MRXNPFEDSA-N	1	1	324.377	1.965	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@]1(CO)CCOC1	ZINC000359816004	410897332	/nfs/dbraw/zinc/89/73/32/410897332.db2.gz	VOVBIKKUMUTBED-MRXNPFEDSA-N	1	1	324.377	1.965	20	5		DDBDMO
C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CCS(=O)(=O)C1	ZINC000353774884	411128523	/nfs/dbraw/zinc/12/85/23/411128523.db2.gz	JIAWSDCAUJVRPY-DIECRNLCSA-N	1	1	324.402	1.975	20	5		DDBDMO
C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1CCS(=O)(=O)C1	ZINC000353774884	411128526	/nfs/dbraw/zinc/12/85/26/411128526.db2.gz	JIAWSDCAUJVRPY-DIECRNLCSA-N	1	1	324.402	1.975	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@@H](C[NH+]2CCCCCC2)C1	ZINC000360221016	411104997	/nfs/dbraw/zinc/10/49/97/411104997.db2.gz	CKHJPGCUOBCYFM-ZNMIVQPWSA-N	1	1	309.410	1.766	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@]3(CNC(=O)C3)C2)cc1[N+](=O)[O-]	ZINC000353767458	411126528	/nfs/dbraw/zinc/12/65/28/411126528.db2.gz	LELKIQVKNHZOLV-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)CC[NH+]1CCOCC1	ZINC000358036073	299053046	/nfs/dbraw/zinc/05/30/46/299053046.db2.gz	BVUMCGOVBOIGAE-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000366332975	418459798	/nfs/dbraw/zinc/45/97/98/418459798.db2.gz	PNBADEOIFUWTCF-YUSALJHKSA-N	1	1	303.318	1.250	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000374164659	418497603	/nfs/dbraw/zinc/49/76/03/418497603.db2.gz	SIPWTKJGTUUBFM-DGCLKSJQSA-N	1	1	305.334	1.184	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000374164659	418497604	/nfs/dbraw/zinc/49/76/04/418497604.db2.gz	SIPWTKJGTUUBFM-DGCLKSJQSA-N	1	1	305.334	1.184	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000366620231	418498245	/nfs/dbraw/zinc/49/82/45/418498245.db2.gz	NXVAFYGHGHVXFW-LBPRGKRZSA-N	1	1	307.398	1.777	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H]2C[N@H+](C(C)C)CCO2)cc1[N+](=O)[O-]	ZINC000366817197	418520954	/nfs/dbraw/zinc/52/09/54/418520954.db2.gz	CYVGEWMXLOXPHF-AWEZNQCLSA-N	1	1	307.350	1.951	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H]2C[N@@H+](C(C)C)CCO2)cc1[N+](=O)[O-]	ZINC000366817197	418520957	/nfs/dbraw/zinc/52/09/57/418520957.db2.gz	CYVGEWMXLOXPHF-AWEZNQCLSA-N	1	1	307.350	1.951	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@]1(CO)CCCc2ccccc21	ZINC000366919263	418537895	/nfs/dbraw/zinc/53/78/95/418537895.db2.gz	CJWXYFBOQUVWOC-INIZCTEOSA-N	1	1	316.361	1.642	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](CC)CC3)n1	ZINC000191660144	222106508	/nfs/dbraw/zinc/10/65/08/222106508.db2.gz	DUFBMNVEBIHXIF-NEPJUHHUSA-N	1	1	321.381	1.510	20	5		DDBDMO
COc1cccc(C(=O)NCCC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000195311218	222198765	/nfs/dbraw/zinc/19/87/65/222198765.db2.gz	VWSNGEGXWYURRL-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CC[N@@H+](C)[C@H]2C1	ZINC000375053877	418596217	/nfs/dbraw/zinc/59/62/17/418596217.db2.gz	IJANSJJBAVLURK-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000375031284	418591830	/nfs/dbraw/zinc/59/18/30/418591830.db2.gz	NPCGQTGCLAWNHP-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[C@](O)(C[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614013	418663150	/nfs/dbraw/zinc/66/31/50/418663150.db2.gz	SXPBEALEFKPULM-ONGXEEELSA-N	1	1	322.287	1.742	20	5		DDBDMO
C[C@](O)(C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614013	418663153	/nfs/dbraw/zinc/66/31/53/418663153.db2.gz	SXPBEALEFKPULM-ONGXEEELSA-N	1	1	322.287	1.742	20	5		DDBDMO
CNc1c(C(=O)NC[C@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000388640047	418747091	/nfs/dbraw/zinc/74/70/91/418747091.db2.gz	MTCGQDRNOWURPR-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000364933211	418824693	/nfs/dbraw/zinc/82/46/93/418824693.db2.gz	LOBNYOKQEAERMX-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@H]12	ZINC000365655245	418890177	/nfs/dbraw/zinc/89/01/77/418890177.db2.gz	IHTQXHIZRLQKBK-JRFBKZHLSA-N	1	1	301.346	1.676	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000417953209	419415840	/nfs/dbraw/zinc/41/58/40/419415840.db2.gz	ZDFZSAUQDOARHJ-OAHLLOKOSA-N	1	1	324.356	1.480	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915442	419368649	/nfs/dbraw/zinc/36/86/49/419368649.db2.gz	HHQVQVAKCIJVMZ-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915442	419368653	/nfs/dbraw/zinc/36/86/53/419368653.db2.gz	HHQVQVAKCIJVMZ-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H](CO)C1	ZINC000420936524	419370860	/nfs/dbraw/zinc/37/08/60/419370860.db2.gz	ITWSWATYCPCXEL-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H](CO)C1	ZINC000420936524	419370866	/nfs/dbraw/zinc/37/08/66/419370866.db2.gz	ITWSWATYCPCXEL-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
COC(=O)[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)C1	ZINC000411906159	419464964	/nfs/dbraw/zinc/46/49/64/419464964.db2.gz	NMPRTDKMENSEHL-ZDUSSCGKSA-N	1	1	307.350	1.131	20	5		DDBDMO
COC(=O)[C@@H]1CN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411910615	419473965	/nfs/dbraw/zinc/47/39/65/419473965.db2.gz	SLBXIWUVPZYWHL-JSGCOSHPSA-N	1	1	321.377	1.692	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000421707887	419692545	/nfs/dbraw/zinc/69/25/45/419692545.db2.gz	YOQZIVPRJXSWGK-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
COC(=O)[C@H]1CSCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000412088469	419644597	/nfs/dbraw/zinc/64/45/97/419644597.db2.gz	WSENGSQXTKWRBH-GFCCVEGCSA-N	1	1	310.375	1.933	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCC1([NH3+])CCC1	ZINC000414883995	419859288	/nfs/dbraw/zinc/85/92/88/419859288.db2.gz	VKCCEXGZRCBIPG-LLVKDONJSA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC1(N)CCC1	ZINC000414883995	419859294	/nfs/dbraw/zinc/85/92/94/419859294.db2.gz	VKCCEXGZRCBIPG-LLVKDONJSA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000428988698	419959098	/nfs/dbraw/zinc/95/90/98/419959098.db2.gz	ARZCVJZOSYXDDJ-IPYPFGDCSA-N	1	1	307.398	1.453	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1	ZINC000429021287	419964024	/nfs/dbraw/zinc/96/40/24/419964024.db2.gz	PSNWQGQYJUZGEN-MRXNPFEDSA-N	1	1	315.377	1.999	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(N)=O	ZINC000429167330	419981054	/nfs/dbraw/zinc/98/10/54/419981054.db2.gz	LAOWFCNKUDSJEJ-UHFFFAOYSA-N	1	1	322.365	1.429	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000429695774	420038479	/nfs/dbraw/zinc/03/84/79/420038479.db2.gz	IGIJXLLQGVAEKF-HNNXBMFYSA-N	1	1	308.334	1.483	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NC[C@H]2C[NH2+]CCCO2)n1	ZINC000423493214	420062451	/nfs/dbraw/zinc/06/24/51/420062451.db2.gz	PPHYMRREQARMEF-MGPQQGTHSA-N	1	1	323.397	1.243	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420606512	420328964	/nfs/dbraw/zinc/32/89/64/420328964.db2.gz	XJJSHJREMYWIDB-NSHDSACASA-N	1	1	306.366	1.980	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](c3nnc[nH]3)C2)cc1[N+](=O)[O-]	ZINC000425355468	420362055	/nfs/dbraw/zinc/36/20/55/420362055.db2.gz	LTVWAGOZHLZUCL-LLVKDONJSA-N	1	1	303.322	1.711	20	5		DDBDMO
CO[C@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000425417025	420378532	/nfs/dbraw/zinc/37/85/32/420378532.db2.gz	MCMKCXUHJTZZNE-TZMCWYRMSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000416493203	420392688	/nfs/dbraw/zinc/39/26/88/420392688.db2.gz	CXVPPMXMZNOPII-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CNCCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC001120569876	782027545	/nfs/dbraw/zinc/02/75/45/782027545.db2.gz	LGYHYTVYHLCQGT-ZDUSSCGKSA-N	1	1	308.382	1.051	20	5		DDBDMO
CN(C[C@@H](O)C[NH2+]CCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC001120569876	782027551	/nfs/dbraw/zinc/02/75/51/782027551.db2.gz	LGYHYTVYHLCQGT-ZDUSSCGKSA-N	1	1	308.382	1.051	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC[C@@H]3CCOC3)C2)nc1	ZINC000438096542	420438929	/nfs/dbraw/zinc/43/89/29/420438929.db2.gz	OWDGXCZLZIKYRK-OLZOCXBDSA-N	1	1	306.366	1.903	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000457051340	420597396	/nfs/dbraw/zinc/59/73/96/420597396.db2.gz	HXDQPWLIUTZNSP-UHFFFAOYSA-N	1	1	308.338	1.300	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1CO	ZINC000441692432	420659582	/nfs/dbraw/zinc/65/95/82/420659582.db2.gz	TUCRKFAXGKSFBY-INWMFGNUSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCC[N@H+]1CCO	ZINC000452789159	420662010	/nfs/dbraw/zinc/66/20/10/420662010.db2.gz	AFWAGTRNKJGULS-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+]1C1CC1	ZINC000492892024	420701261	/nfs/dbraw/zinc/70/12/61/420701261.db2.gz	ODMTVUXGGOZUJS-OAHLLOKOSA-N	1	1	318.377	1.750	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](CC[NH3+])C1	ZINC000443078023	420742776	/nfs/dbraw/zinc/74/27/76/420742776.db2.gz	VVVDAVACYRRMRL-QWHCGFSZSA-N	1	1	320.393	1.983	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489382639	421151215	/nfs/dbraw/zinc/15/12/15/421151215.db2.gz	BQZFXQODBQHFQK-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489382639	421151227	/nfs/dbraw/zinc/15/12/27/421151227.db2.gz	BQZFXQODBQHFQK-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489382639	421151230	/nfs/dbraw/zinc/15/12/30/421151230.db2.gz	BQZFXQODBQHFQK-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000524783285	421273674	/nfs/dbraw/zinc/27/36/74/421273674.db2.gz	FTGMFNKPELCJOC-WCQYABFASA-N	1	1	306.366	1.877	20	5		DDBDMO
C[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1(C)C	ZINC000551042176	421526351	/nfs/dbraw/zinc/52/63/51/421526351.db2.gz	KEPOQXLXQVPQHE-UHFFFAOYSA-N	1	1	321.377	1.987	20	5		DDBDMO
O=C1NCC[C@]12CCC[N@@H+]2CCOc1cccc([N+](=O)[O-])c1	ZINC000516875018	421575328	/nfs/dbraw/zinc/57/53/28/421575328.db2.gz	BIXMRMJCNIHQLY-OAHLLOKOSA-N	1	1	305.334	1.328	20	5		DDBDMO
CC1(C)C[NH+](CC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000552865132	421595564	/nfs/dbraw/zinc/59/55/64/421595564.db2.gz	BJXIFBULVDUNFH-UHFFFAOYSA-N	1	1	306.366	1.465	20	5		DDBDMO
CC(C)Oc1nc(NCC[N@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000569471061	421626455	/nfs/dbraw/zinc/62/64/55/421626455.db2.gz	GIZXLLJZHXIPJW-UHFFFAOYSA-N	1	1	324.381	1.911	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000518026772	421637876	/nfs/dbraw/zinc/63/78/76/421637876.db2.gz	FJNRDLUWOGRPPM-SNVBAGLBSA-N	1	1	309.370	1.340	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000571162311	421692629	/nfs/dbraw/zinc/69/26/29/421692629.db2.gz	PYFBGFASRWGYQX-IPYPFGDCSA-N	1	1	322.361	1.445	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000556806915	421739113	/nfs/dbraw/zinc/73/91/13/421739113.db2.gz	MFFPTKUTXOTPBR-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000556806915	421739116	/nfs/dbraw/zinc/73/91/16/421739116.db2.gz	MFFPTKUTXOTPBR-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1	ZINC000558737214	421823702	/nfs/dbraw/zinc/82/37/02/421823702.db2.gz	WVIJNNUSZKMPKN-UHFFFAOYSA-N	1	1	309.370	1.510	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000582098118	422106859	/nfs/dbraw/zinc/10/68/59/422106859.db2.gz	XFOMUTWEMQWSBS-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000582098118	422106865	/nfs/dbraw/zinc/10/68/65/422106865.db2.gz	XFOMUTWEMQWSBS-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000574940144	422221443	/nfs/dbraw/zinc/22/14/43/422221443.db2.gz	WPKWGEVLDLEISV-GFCCVEGCSA-N	1	1	312.366	1.691	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000592201833	422330156	/nfs/dbraw/zinc/33/01/56/422330156.db2.gz	WDTKQPMHNPKIDS-TUAOUCFPSA-N	1	1	308.334	1.512	20	5		DDBDMO
C[N@H+]1CCN(CCn2ccc([N+](=O)[O-])n2)CC12CCCCC2	ZINC000578451065	422572941	/nfs/dbraw/zinc/57/29/41/422572941.db2.gz	SYVBVEFIKDJTGV-UHFFFAOYSA-N	1	1	307.398	1.742	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@]23CCOC3)c1	ZINC000341978026	271265264	/nfs/dbraw/zinc/26/52/64/271265264.db2.gz	XFMBTZBXLBURAG-ZBFHGGJFSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=C1OCC[C@H]1CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000177648968	275026992	/nfs/dbraw/zinc/02/69/92/275026992.db2.gz	LCEYIQPJKZTMJK-CYBMUJFWSA-N	1	1	319.361	1.670	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21	ZINC000284887880	277121709	/nfs/dbraw/zinc/12/17/09/277121709.db2.gz	GWNNXUMCCNJIDR-UONOGXRCSA-N	1	1	317.349	1.380	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC000408056059	277152281	/nfs/dbraw/zinc/15/22/81/277152281.db2.gz	CIYUCHIIYSYRMJ-KBPBESRZSA-N	1	1	323.324	1.279	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000286002004	277179940	/nfs/dbraw/zinc/17/99/40/277179940.db2.gz	ZAJJBUZCMFAFCU-UONOGXRCSA-N	1	1	305.334	1.140	20	5		DDBDMO
C[C@H]1CC[NH2+]C[C@@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000193407616	278373327	/nfs/dbraw/zinc/37/33/27/278373327.db2.gz	WSQAGDWVZYWXJI-WPRPVWTQSA-N	1	1	317.342	1.010	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@H](C)[NH+]1CCOCC1	ZINC000264187218	279556053	/nfs/dbraw/zinc/55/60/53/279556053.db2.gz	BVPFWGWOYKKRHJ-UWVGGRQHSA-N	1	1	321.337	1.652	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1[N+](=O)[O-]	ZINC000269790127	280189979	/nfs/dbraw/zinc/18/99/79/280189979.db2.gz	GFXFJROLGJPIJL-LLVKDONJSA-N	1	1	309.370	1.477	20	5		DDBDMO
Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000261746500	294422119	/nfs/dbraw/zinc/42/21/19/294422119.db2.gz	OQDMUYAUXDNCTE-VIFPVBQESA-N	1	1	321.362	1.177	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@H]21	ZINC000368596849	301062056	/nfs/dbraw/zinc/06/20/56/301062056.db2.gz	WFOKGLZMQIUMCF-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@@H]2C1	ZINC000370044619	301264694	/nfs/dbraw/zinc/26/46/94/301264694.db2.gz	FQRNQKQOVVRJCI-UPJWGTAASA-N	1	1	305.382	1.244	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000370163941	301286320	/nfs/dbraw/zinc/28/63/20/301286320.db2.gz	UURHDVPYWKHEFK-SYAUCNOPSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000370163941	301286322	/nfs/dbraw/zinc/28/63/22/301286322.db2.gz	UURHDVPYWKHEFK-SYAUCNOPSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000370163941	301286324	/nfs/dbraw/zinc/28/63/24/301286324.db2.gz	UURHDVPYWKHEFK-SYAUCNOPSA-N	1	1	317.389	1.678	20	5		DDBDMO
COc1ccc(C[NH+]2CCC(CO)(OC)CC2)cc1[N+](=O)[O-]	ZINC000401752128	302373149	/nfs/dbraw/zinc/37/31/49/302373149.db2.gz	OQJKTUWWMMDGJR-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
CC[C@@H]1CC[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000531025998	303226022	/nfs/dbraw/zinc/22/60/22/303226022.db2.gz	SHBZZADJFVZNDX-BXUZGUMPSA-N	1	1	317.345	1.959	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000536608802	303365690	/nfs/dbraw/zinc/36/56/90/303365690.db2.gz	RRAFJVGRAVLPBN-VXGBXAGGSA-N	1	1	321.377	1.697	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000362068726	307012612	/nfs/dbraw/zinc/01/26/12/307012612.db2.gz	CPMRGUWYRXHPAV-RYUDHWBXSA-N	1	1	307.350	1.118	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000365182779	307060798	/nfs/dbraw/zinc/06/07/98/307060798.db2.gz	IQJICXBJMOYVQU-VXGBXAGGSA-N	1	1	318.377	1.842	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920458	307233099	/nfs/dbraw/zinc/23/30/99/307233099.db2.gz	NRMMBEIURUTKPK-BZPMIXESSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920458	307233100	/nfs/dbraw/zinc/23/31/00/307233100.db2.gz	NRMMBEIURUTKPK-BZPMIXESSA-N	1	1	310.354	1.060	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC3(CCOCC3)CC2)n1	ZINC000377250228	307266939	/nfs/dbraw/zinc/26/69/39/307266939.db2.gz	MOVDLFAOVZVQLE-UHFFFAOYSA-N	1	1	310.354	1.063	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3nc4sccn4c3[N+](=O)[O-])[C@H]2C1	ZINC000408028068	307298387	/nfs/dbraw/zinc/29/83/87/307298387.db2.gz	CJENSKMOUNEANE-UWVGGRQHSA-N	1	1	323.378	1.213	20	5		DDBDMO
CC[NH2+]CCCN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000571991802	308207629	/nfs/dbraw/zinc/20/76/29/308207629.db2.gz	WIUHMUMYSFGFCB-LBPRGKRZSA-N	1	1	308.382	1.901	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000488733444	484216562	/nfs/dbraw/zinc/21/65/62/484216562.db2.gz	JJHVGGFPYLKBLG-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000488733444	484216566	/nfs/dbraw/zinc/21/65/66/484216566.db2.gz	JJHVGGFPYLKBLG-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H](C)CN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000434699913	533793439	/nfs/dbraw/zinc/79/34/39/533793439.db2.gz	PCULDAGAXRRPHI-CYBMUJFWSA-N	1	1	323.393	1.756	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000330918569	534104526	/nfs/dbraw/zinc/10/45/26/534104526.db2.gz	XMDBFEPJPFLFJU-RYUDHWBXSA-N	1	1	307.350	1.573	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCCc2c[nH+]cn2C)c1	ZINC000302131837	534245171	/nfs/dbraw/zinc/24/51/71/534245171.db2.gz	KOQSDZKHUBJIKK-UHFFFAOYSA-N	1	1	304.306	1.770	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000299370967	534630485	/nfs/dbraw/zinc/63/04/85/534630485.db2.gz	RMFLSAKBULCWSV-UHFFFAOYSA-N	1	1	305.334	1.280	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)[C@H](C)C1	ZINC000330832857	527827273	/nfs/dbraw/zinc/82/72/73/527827273.db2.gz	VKJCIBVOVSVOEE-MFKMUULPSA-N	1	1	321.381	1.374	20	5		DDBDMO
CC[N@@H+](CC(C)(C)O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000305721686	527954449	/nfs/dbraw/zinc/95/44/49/527954449.db2.gz	ILSWDPWLMXLFFI-AWEZNQCLSA-N	1	1	321.377	1.793	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@](CO)(COC)C2)ccc1[N+](=O)[O-]	ZINC000451940465	528266615	/nfs/dbraw/zinc/26/66/15/528266615.db2.gz	YHGSAABZGIAQAQ-INIZCTEOSA-N	1	1	324.377	1.824	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@H]1C	ZINC000825465068	607821717	/nfs/dbraw/zinc/82/17/17/607821717.db2.gz	HIGFCIVDFCAILP-SNVBAGLBSA-N	1	1	317.353	1.305	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@H]2CCOC2)c2ncc([N+](=O)[O-])cc12	ZINC000749964590	700195504	/nfs/dbraw/zinc/19/55/04/700195504.db2.gz	QJWJZPYRTNKTPX-NSHDSACASA-N	1	1	305.338	1.574	20	5		DDBDMO
C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000776604706	698125855	/nfs/dbraw/zinc/12/58/55/698125855.db2.gz	FDFSJJPFMMKITK-QWRGUYRKSA-N	1	1	308.256	1.483	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000776604706	698125857	/nfs/dbraw/zinc/12/58/57/698125857.db2.gz	FDFSJJPFMMKITK-QWRGUYRKSA-N	1	1	308.256	1.483	20	5		DDBDMO
CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000750066378	700202000	/nfs/dbraw/zinc/20/20/00/700202000.db2.gz	ISYXXUOBHMDGHR-JKSUJKDBSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1	ZINC000750066378	700202001	/nfs/dbraw/zinc/20/20/01/700202001.db2.gz	ISYXXUOBHMDGHR-JKSUJKDBSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1	ZINC000750066378	700202003	/nfs/dbraw/zinc/20/20/03/700202003.db2.gz	ISYXXUOBHMDGHR-JKSUJKDBSA-N	1	1	305.378	1.797	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000750094035	700203514	/nfs/dbraw/zinc/20/35/14/700203514.db2.gz	MMXWKXNHSIZDKF-RYUDHWBXSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000750094035	700203517	/nfs/dbraw/zinc/20/35/17/700203517.db2.gz	MMXWKXNHSIZDKF-RYUDHWBXSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CCn3cc[nH+]c3C2)c2nonc21	ZINC000777801580	698223094	/nfs/dbraw/zinc/22/30/94/698223094.db2.gz	HHDDOICTXJGPQW-MRVPVSSYSA-N	1	1	300.278	1.754	20	5		DDBDMO
COc1cc(C[NH2+]C[C@H](O)C(F)(F)F)c([N+](=O)[O-])cc1O	ZINC000788977267	699352531	/nfs/dbraw/zinc/35/25/31/699352531.db2.gz	ADBIFTWBICMOMZ-JTQLQIEISA-N	1	1	310.228	1.322	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](C(F)(F)F)C2)c1	ZINC000761056549	700837150	/nfs/dbraw/zinc/83/71/50/700837150.db2.gz	YADKAXYKHMQBIA-WCBMZHEXSA-N	1	1	308.260	1.036	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000767623602	701123965	/nfs/dbraw/zinc/12/39/65/701123965.db2.gz	YCASCKNRIUTTFB-UHFFFAOYSA-N	1	1	321.337	1.665	20	5		DDBDMO
COC(C)(C)CN(C)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867927188	701835507	/nfs/dbraw/zinc/83/55/07/701835507.db2.gz	CQMKMTHSYLNHSQ-OAHLLOKOSA-N	1	1	309.366	1.652	20	5		DDBDMO
C[C@H](NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576034	701898141	/nfs/dbraw/zinc/89/81/41/701898141.db2.gz	HKIVUIJNQFUYRK-IACUBPJLSA-N	1	1	320.393	1.691	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H]1CN2CCC[C@@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576034	701898147	/nfs/dbraw/zinc/89/81/47/701898147.db2.gz	HKIVUIJNQFUYRK-IACUBPJLSA-N	1	1	320.393	1.691	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000840178182	702014761	/nfs/dbraw/zinc/01/47/61/702014761.db2.gz	MUJIVPDTSUBCLR-GFCCVEGCSA-N	1	1	317.349	1.312	20	5		DDBDMO
CC(C)(C[NH+]1CCOCC1)NC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000840522207	702139493	/nfs/dbraw/zinc/13/94/93/702139493.db2.gz	JSVLQJDQNNOTHN-UHFFFAOYSA-N	1	1	301.387	1.049	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879318737	706648263	/nfs/dbraw/zinc/64/82/63/706648263.db2.gz	ZXQJKCVZBWBBBP-IVMMDQJWSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000866206837	706648628	/nfs/dbraw/zinc/64/86/28/706648628.db2.gz	GDWRGYANPJTHCS-CMPLNLGQSA-N	1	1	304.350	1.224	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000879322300	706649788	/nfs/dbraw/zinc/64/97/88/706649788.db2.gz	JGCPUVOPSIPDPY-ZWNOBZJWSA-N	1	1	307.350	1.693	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)cc1	ZINC000812860300	702253378	/nfs/dbraw/zinc/25/33/78/702253378.db2.gz	XPGYTMJWWFGZPB-YPMHNXCESA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC(F)(F)[C@@H](CO)C2)cc1	ZINC000812860300	702253381	/nfs/dbraw/zinc/25/33/81/702253381.db2.gz	XPGYTMJWWFGZPB-YPMHNXCESA-N	1	1	316.304	1.578	20	5		DDBDMO
C[N@H+](Cn1cc([N+](=O)[O-])cn1)C[C@]1(O)CCc2ccccc21	ZINC000842623180	702744412	/nfs/dbraw/zinc/74/44/12/702744412.db2.gz	KMIDMSMANKTPJU-OAHLLOKOSA-N	1	1	302.334	1.515	20	5		DDBDMO
C[N@@H+](Cn1cc([N+](=O)[O-])cn1)C[C@]1(O)CCc2ccccc21	ZINC000842623180	702744413	/nfs/dbraw/zinc/74/44/13/702744413.db2.gz	KMIDMSMANKTPJU-OAHLLOKOSA-N	1	1	302.334	1.515	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CNCCC[NH+]2CCC(O)CC2)c1	ZINC000843061135	702810537	/nfs/dbraw/zinc/81/05/37/702810537.db2.gz	AAJPSUNNQKQVQC-INIZCTEOSA-N	1	1	323.393	1.065	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000844446794	703032731	/nfs/dbraw/zinc/03/27/31/703032731.db2.gz	JDEVZDYEWOZXNR-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000844446794	703032734	/nfs/dbraw/zinc/03/27/34/703032734.db2.gz	JDEVZDYEWOZXNR-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[N@H+]1CCN(Cn2cc([N+](=O)[O-])cn2)[C@H](Cc2ccccc2)C1	ZINC000844740160	703066694	/nfs/dbraw/zinc/06/66/94/703066694.db2.gz	INNXDEZEDNUMSC-OAHLLOKOSA-N	1	1	315.377	1.608	20	5		DDBDMO
C[N@H+]1CCN(Cn2nccc2[N+](=O)[O-])[C@H](Cc2ccccc2)C1	ZINC000844743491	703067418	/nfs/dbraw/zinc/06/74/18/703067418.db2.gz	YMZBSWXSTSUGFG-OAHLLOKOSA-N	1	1	315.377	1.608	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000879571939	706721930	/nfs/dbraw/zinc/72/19/30/706721930.db2.gz	USADZQFHIBHPLU-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000879572790	706722767	/nfs/dbraw/zinc/72/27/67/706722767.db2.gz	RIDSMFZWWURFQI-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OC[C@H]1CC[N@H+]1C(C)(C)C	ZINC000845733413	703195127	/nfs/dbraw/zinc/19/51/27/703195127.db2.gz	ALPHFQVZBXTRCS-GFCCVEGCSA-N	1	1	324.381	1.906	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000846921016	703351939	/nfs/dbraw/zinc/35/19/39/703351939.db2.gz	OHDNONXBUJAWFG-ZIAGYGMSSA-N	1	1	307.350	1.181	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000848350705	703541771	/nfs/dbraw/zinc/54/17/71/703541771.db2.gz	SJYDPIRJNICHTI-KGLIPLIRSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[NH2+][C@@H](C)c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1	ZINC000848629225	703570236	/nfs/dbraw/zinc/57/02/36/703570236.db2.gz	XCBGSXGBLJRZMO-QMMMGPOBSA-N	1	1	322.321	1.866	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4C[C@H](O)C[C@H]4C3)sc2c1	ZINC000848766842	703586245	/nfs/dbraw/zinc/58/62/45/703586245.db2.gz	ZVEAEZIEQDHGDF-WDEREUQCSA-N	1	1	320.374	1.460	20	5		DDBDMO
CC1(C)OC[C@H](C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)O1	ZINC000851724457	703837352	/nfs/dbraw/zinc/83/73/52/703837352.db2.gz	XHCPNCGOJRCJPO-ZDUSSCGKSA-N	1	1	321.377	1.868	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1	ZINC000853586438	704276386	/nfs/dbraw/zinc/27/63/86/704276386.db2.gz	RMQXRUCMLFGDFL-DGCLKSJQSA-N	1	1	302.334	1.870	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000855286450	704477458	/nfs/dbraw/zinc/47/74/58/704477458.db2.gz	RRSZOPWPJBLCJX-JTQLQIEISA-N	1	1	306.366	1.780	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1CC[N@@H+](CC)C1	ZINC000855491166	704487532	/nfs/dbraw/zinc/48/75/32/704487532.db2.gz	PFVCDGSTDZZMED-JTQLQIEISA-N	1	1	307.354	1.128	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000855733405	704499765	/nfs/dbraw/zinc/49/97/65/704499765.db2.gz	SANVXIRGHJJKMT-BZUAXINKSA-N	1	1	317.389	1.427	20	5		DDBDMO
C[N@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000855733405	704499766	/nfs/dbraw/zinc/49/97/66/704499766.db2.gz	SANVXIRGHJJKMT-BZUAXINKSA-N	1	1	317.389	1.427	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000855733405	704499767	/nfs/dbraw/zinc/49/97/67/704499767.db2.gz	SANVXIRGHJJKMT-BZUAXINKSA-N	1	1	317.389	1.427	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](CO)c1ccnn1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000858435834	704710941	/nfs/dbraw/zinc/71/09/41/704710941.db2.gz	UXTFIGKDAYFTIT-SKDRFNHKSA-N	1	1	305.338	1.295	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1	ZINC000859888695	705031180	/nfs/dbraw/zinc/03/11/80/705031180.db2.gz	JJPXQCLLLDAOGW-YSOBRWQISA-N	1	1	324.402	1.614	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874830010	705188180	/nfs/dbraw/zinc/18/81/80/705188180.db2.gz	PRIKSHOALVPETQ-NEPJUHHUSA-N	1	1	319.365	1.340	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000874850725	705203204	/nfs/dbraw/zinc/20/32/04/705203204.db2.gz	WFPULLZBCUORJU-GJZGRUSLSA-N	1	1	303.362	1.832	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CCCC[N@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000862792431	705799618	/nfs/dbraw/zinc/79/96/18/705799618.db2.gz	VHPUCENWAHWFBS-LBPRGKRZSA-N	1	1	320.393	1.947	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000828338625	706162997	/nfs/dbraw/zinc/16/29/97/706162997.db2.gz	PQGFHSAWHXGOOQ-SUNKGSAMSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000828338625	706163000	/nfs/dbraw/zinc/16/30/00/706163000.db2.gz	PQGFHSAWHXGOOQ-SUNKGSAMSA-N	1	1	307.350	1.179	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000829010041	706272475	/nfs/dbraw/zinc/27/24/75/706272475.db2.gz	ABBGIGRCSOONLT-PHIMTYICSA-N	1	1	322.321	1.778	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(NCCC[NH+]2CCOCC2)cc1F	ZINC000865397149	706421123	/nfs/dbraw/zinc/42/11/23/706421123.db2.gz	CXOOVZRIPZIJRS-UHFFFAOYSA-N	1	1	313.329	1.360	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000880311371	706937746	/nfs/dbraw/zinc/93/77/46/706937746.db2.gz	DJAIWTWQMRPDDY-IJEWVQPXSA-N	1	1	319.361	1.038	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000880425588	706970419	/nfs/dbraw/zinc/97/04/19/706970419.db2.gz	GHGPZRGPWFLYBM-DOMZBBRYSA-N	1	1	310.350	1.709	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832955076	706998564	/nfs/dbraw/zinc/99/85/64/706998564.db2.gz	ZHVXLQBETNKYLX-DOMZBBRYSA-N	1	1	323.393	1.865	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@H](O)CC2(CCOCC2)C1	ZINC000880584090	707027132	/nfs/dbraw/zinc/02/71/32/707027132.db2.gz	DWHFYUYSASOAIF-CQSZACIVSA-N	1	1	306.362	1.958	20	5		DDBDMO
C[N@@H+](CCOC(=O)Cn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000837412502	707640360	/nfs/dbraw/zinc/64/03/60/707640360.db2.gz	IGXNEXFRERKTFY-UHFFFAOYSA-N	1	1	318.333	1.467	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000882483476	707654118	/nfs/dbraw/zinc/65/41/18/707654118.db2.gz	BGYXGWGPFYHXRA-ZDUSSCGKSA-N	1	1	317.349	1.155	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(OC)c1	ZINC000882484461	707654839	/nfs/dbraw/zinc/65/48/39/707654839.db2.gz	DCSSWWHBBJYKOF-LLVKDONJSA-N	1	1	323.349	1.193	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000882492889	707663364	/nfs/dbraw/zinc/66/33/64/707663364.db2.gz	CPQYDFHWOJCGNZ-SOUVJXGZSA-N	1	1	303.362	1.909	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1	ZINC000838908309	708001294	/nfs/dbraw/zinc/00/12/94/708001294.db2.gz	CWORIUZASOCECA-OKILXGFUSA-N	1	1	320.345	1.923	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886207576	708714875	/nfs/dbraw/zinc/71/48/75/708714875.db2.gz	GNZGGQIPUCGZPH-ZDUSSCGKSA-N	1	1	306.366	1.728	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCn3nncc3C2)cc1	ZINC000886455717	708763305	/nfs/dbraw/zinc/76/33/05/708763305.db2.gz	YYYNEXIHHCUABG-UHFFFAOYSA-N	1	1	317.349	1.861	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCCn3nncc3C2)cc1	ZINC000886455717	708763307	/nfs/dbraw/zinc/76/33/07/708763307.db2.gz	YYYNEXIHHCUABG-UHFFFAOYSA-N	1	1	317.349	1.861	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3cccnc3[N+](=O)[O-])C2)C1	ZINC000886839774	708858828	/nfs/dbraw/zinc/85/88/28/708858828.db2.gz	LVBXBWGPVGWLNV-BPLDGKMQSA-N	1	1	320.393	1.708	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887930411	709168287	/nfs/dbraw/zinc/16/82/87/709168287.db2.gz	HQQALZDXIMKLKN-ZUZCIYMTSA-N	1	1	321.381	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887930411	709168291	/nfs/dbraw/zinc/16/82/91/709168291.db2.gz	HQQALZDXIMKLKN-ZUZCIYMTSA-N	1	1	321.381	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887930411	709168293	/nfs/dbraw/zinc/16/82/93/709168293.db2.gz	HQQALZDXIMKLKN-ZUZCIYMTSA-N	1	1	321.381	1.465	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC1CC[NH+](CCN(C)C)CC1	ZINC000891783329	710294043	/nfs/dbraw/zinc/29/40/43/710294043.db2.gz	DRWGTASJJQSDLR-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2c([N+](=O)[O-])cnn2C)CC1	ZINC000891897638	710321403	/nfs/dbraw/zinc/32/14/03/710321403.db2.gz	MFQKDOIZHORZBC-GFCCVEGCSA-N	1	1	310.402	1.014	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@]3(C)C[NH+](C)C[C@@]3(C)C2)c1[N+](=O)[O-]	ZINC000913289229	713192490	/nfs/dbraw/zinc/19/24/90/713192490.db2.gz	KJYHKQKYNAOAOR-KBPBESRZSA-N	1	1	307.354	1.040	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOC(=O)CCC(C)(C)[N+](=O)[O-])CCO1	ZINC000893386502	710628267	/nfs/dbraw/zinc/62/82/67/710628267.db2.gz	VIFYRYXUALODBZ-GFCCVEGCSA-N	1	1	302.371	1.476	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1C	ZINC000928444033	713198437	/nfs/dbraw/zinc/19/84/37/713198437.db2.gz	IJXRACWCVXEBRK-BXKDBHETSA-N	1	1	311.313	1.322	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000893668093	710769761	/nfs/dbraw/zinc/76/97/61/710769761.db2.gz	CXBDJEYSERJQBN-QWRGUYRKSA-N	1	1	309.366	1.833	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637829	710832963	/nfs/dbraw/zinc/83/29/63/710832963.db2.gz	JTIILFKOGSSESI-KGLIPLIRSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637829	710832968	/nfs/dbraw/zinc/83/29/68/710832968.db2.gz	JTIILFKOGSSESI-KGLIPLIRSA-N	1	1	317.349	1.920	20	5		DDBDMO
COc1cc([C@H](C)[NH2+]CC(=O)NCC2CC2)cc([N+](=O)[O-])c1	ZINC000903146571	711047574	/nfs/dbraw/zinc/04/75/74/711047574.db2.gz	HOYXSOFMWKUPGZ-JTQLQIEISA-N	1	1	307.350	1.780	20	5		DDBDMO
COc1cc([C@@H](C)NC[C@@]2(O)CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000903154145	711049622	/nfs/dbraw/zinc/04/96/22/711049622.db2.gz	TVNDCMKFHJZYMU-ABAIWWIYSA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+]C[C@@]2(O)CCN(C)C2)cc([N+](=O)[O-])c1	ZINC000903154145	711049625	/nfs/dbraw/zinc/04/96/25/711049625.db2.gz	TVNDCMKFHJZYMU-ABAIWWIYSA-N	1	1	309.366	1.321	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1Cc2c[nH+]cn2C1	ZINC000894997043	711357863	/nfs/dbraw/zinc/35/78/63/711357863.db2.gz	LSVBHURPCGGWGZ-LURJTMIESA-N	1	1	316.243	1.580	20	5		DDBDMO
COC(=O)/C=C\c1ccc(NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895777741	711604143	/nfs/dbraw/zinc/60/41/43/711604143.db2.gz	WVGVSDPGOHAWBY-RNZFLTOJSA-N	1	1	305.334	1.897	20	5		DDBDMO
COCC1C[NH+](Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)C1	ZINC000895969905	711658133	/nfs/dbraw/zinc/65/81/33/711658133.db2.gz	ROMPRZVUULEFIS-UHFFFAOYSA-N	1	1	324.333	1.225	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])C1	ZINC000896257517	711697332	/nfs/dbraw/zinc/69/73/32/711697332.db2.gz	GSUBNGXWRSUAPB-CYBMUJFWSA-N	1	1	321.377	1.662	20	5		DDBDMO
Cc1ccnc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c1[N+](=O)[O-]	ZINC000896517476	711736750	/nfs/dbraw/zinc/73/67/50/711736750.db2.gz	GLBDMMNOEJRXKV-ZDUSSCGKSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1nc(NC[C@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-]	ZINC000896521178	711737606	/nfs/dbraw/zinc/73/76/06/711737606.db2.gz	HQQRYKYSNLDYGH-CYBMUJFWSA-N	1	1	306.366	1.963	20	5		DDBDMO
[NH3+]CC[C@H]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000904404929	711853679	/nfs/dbraw/zinc/85/36/79/711853679.db2.gz	BJJSQXSJNKMFRV-NSHDSACASA-N	1	1	307.350	1.537	20	5		DDBDMO
C[C@H](NC(=O)C1CN(C)CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000906318150	712296508	/nfs/dbraw/zinc/29/65/08/712296508.db2.gz	UVNWDEGJQSJJQY-LBPRGKRZSA-N	1	1	320.393	1.265	20	5		DDBDMO
Cc1[nH+]ccn1-c1ccc(CNc2c([N+](=O)[O-])ncn2C)cn1	ZINC000917093448	713482177	/nfs/dbraw/zinc/48/21/77/713482177.db2.gz	SDCQCGLVYZRJFN-UHFFFAOYSA-N	1	1	313.321	1.830	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000917789285	713513910	/nfs/dbraw/zinc/51/39/10/713513910.db2.gz	MLOUYNZUJNVMGO-BXUZGUMPSA-N	1	1	322.365	1.365	20	5		DDBDMO
Cn1ccc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000932133028	714267744	/nfs/dbraw/zinc/26/77/44/714267744.db2.gz	NRKFHUUPRUPKFJ-GFCCVEGCSA-N	1	1	304.354	1.404	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@H]1[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923371046	714331738	/nfs/dbraw/zinc/33/17/38/714331738.db2.gz	URIYHHQVQCWIBF-FOCJUVANSA-N	1	1	323.393	1.311	20	5		DDBDMO
CC(C)(C)c1cc2n(n1)CC[N@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000932616296	714367687	/nfs/dbraw/zinc/36/76/87/714367687.db2.gz	CABXDNVQJFYKNR-UHFFFAOYSA-N	1	1	318.381	1.801	20	5		DDBDMO
CC(C)(C)c1cc2n(n1)CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000932616296	714367689	/nfs/dbraw/zinc/36/76/89/714367689.db2.gz	CABXDNVQJFYKNR-UHFFFAOYSA-N	1	1	318.381	1.801	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@H]1C=C[C@@H]2C1	ZINC000933707303	714652508	/nfs/dbraw/zinc/65/25/08/714652508.db2.gz	YCSRAVJDXLUOAI-QVKMIARZSA-N	1	1	318.377	1.296	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000925419971	714850313	/nfs/dbraw/zinc/85/03/13/714850313.db2.gz	RTXDAHNQVXYQJK-HNNXBMFYSA-N	1	1	318.377	1.973	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CC2(C1)CC[N@@H+](CC1CC1)C2	ZINC001164768838	721292245	/nfs/dbraw/zinc/29/22/45/721292245.db2.gz	HWHTUEZVTIVJIJ-UHFFFAOYSA-N	1	1	318.377	1.459	20	5		DDBDMO
CC[N+](C)(C)Cc1ccccc1-n1c(C)ncc(CN)c1=N	ZINC001167674833	735344988	/nfs/dbraw/zinc/34/49/88/735344988.db2.gz	XMSDMVOFWKIFEP-UHFFFAOYSA-N	1	1	300.430	1.715	20	5		DDBDMO
COC(=O)c1cnc(N2CCc3[nH+]ccn3CC2)c([N+](=O)[O-])c1	ZINC001167181722	732809508	/nfs/dbraw/zinc/80/95/08/732809508.db2.gz	FMIXEPUSFSCHHG-UHFFFAOYSA-N	1	1	317.305	1.036	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CC2CCC3(CC3)CC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063394	734368756	/nfs/dbraw/zinc/36/87/56/734368756.db2.gz	ALERMNFYCMSRFS-LXTVHRRPSA-N	1	1	321.421	1.859	20	5		DDBDMO
C[C@@H](c1nnc(N2CCC(c3c[nH+]cn3C)CC2)n1C)[N+](=O)[O-]	ZINC001121297294	782448289	/nfs/dbraw/zinc/44/82/89/782448289.db2.gz	ORCQSNRXUUIHNN-JTQLQIEISA-N	1	1	319.369	1.270	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775753	736853245	/nfs/dbraw/zinc/85/32/45/736853245.db2.gz	MBGYBBTYKFYVER-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CCCC3CCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775753	736853247	/nfs/dbraw/zinc/85/32/47/736853247.db2.gz	MBGYBBTYKFYVER-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCCC3CCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775753	736853249	/nfs/dbraw/zinc/85/32/49/736853249.db2.gz	MBGYBBTYKFYVER-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccccc1OC1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936885	742844510	/nfs/dbraw/zinc/84/45/10/742844510.db2.gz	WAVQAOLMWBKKQA-ZIAGYGMSSA-N	1	1	319.361	1.099	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(NCC3([NH+]4CCCC4)COC3)cn21	ZINC001168451560	745114271	/nfs/dbraw/zinc/11/42/71/745114271.db2.gz	PCXDMQUSRPRWQK-UHFFFAOYSA-N	1	1	317.349	1.519	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC001192490994	745795508	/nfs/dbraw/zinc/79/55/08/745795508.db2.gz	XTNDZGZBUZBVPO-GHMZBOCLSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cn1	ZINC001107321686	749799447	/nfs/dbraw/zinc/79/94/47/749799447.db2.gz	JEZCSSBEIIXLJQ-SNAWJCMRSA-N	1	1	321.381	1.416	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CC2=CCCCC2)CC1	ZINC000997772680	751269689	/nfs/dbraw/zinc/26/96/89/751269689.db2.gz	QCLWHLLYFBDSMZ-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(N1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1)C(F)(F)F	ZINC001169011905	762178106	/nfs/dbraw/zinc/17/81/06/762178106.db2.gz	NGLQVFVMIOGKKA-ZJUUUORDSA-N	1	1	309.288	1.138	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017581	762198122	/nfs/dbraw/zinc/19/81/22/762198122.db2.gz	AQTYZTMBLRVMQE-IHRRRGAJSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017581	762198125	/nfs/dbraw/zinc/19/81/25/762198125.db2.gz	AQTYZTMBLRVMQE-IHRRRGAJSA-N	1	1	322.409	1.801	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169022487	762201075	/nfs/dbraw/zinc/20/10/75/762201075.db2.gz	CEVKWGRZQQAQID-KFWWJZLASA-N	1	1	309.410	1.766	20	5		DDBDMO
CCOCc1nnn2c1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CCC2	ZINC001169024846	762202474	/nfs/dbraw/zinc/20/24/74/762202474.db2.gz	RNRAIWWWUDDCGA-OLZOCXBDSA-N	1	1	323.397	1.466	20	5		DDBDMO
Cc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169052441	762206938	/nfs/dbraw/zinc/20/69/38/762206938.db2.gz	FXQUKIUJJHCXMG-BFHYXJOUSA-N	1	1	306.366	1.684	20	5		DDBDMO
O=C(NCc1ccc2c(c1)C[N@H+](CC1CC1)C2)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001054264692	759369851	/nfs/dbraw/zinc/36/98/51/759369851.db2.gz	OXBNPFMDSKRKAU-HZPDHXFCSA-N	1	1	315.373	1.694	20	5		DDBDMO
O=C(NCc1ccc2c(c1)C[N@@H+](CC1CC1)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC001054264692	759369862	/nfs/dbraw/zinc/36/98/62/759369862.db2.gz	OXBNPFMDSKRKAU-HZPDHXFCSA-N	1	1	315.373	1.694	20	5		DDBDMO
O=C(NCc1ccc2c(c1)C[N@H+](CC1CC1)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC001054264692	759369873	/nfs/dbraw/zinc/36/98/73/759369873.db2.gz	OXBNPFMDSKRKAU-HZPDHXFCSA-N	1	1	315.373	1.694	20	5		DDBDMO
O=C(C1CC1)N1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC001048637310	769606965	/nfs/dbraw/zinc/60/69/65/769606965.db2.gz	BDBULAYHTQGNCQ-GASCZTMLSA-N	1	1	315.373	1.895	20	5		DDBDMO
CCC(CC)CC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001135855732	771753956	/nfs/dbraw/zinc/75/39/56/771753956.db2.gz	GQMBEJQKTYZMKB-UHFFFAOYSA-N	1	1	311.386	1.360	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1F	ZINC001136342059	771942300	/nfs/dbraw/zinc/94/23/00/771942300.db2.gz	BPLGQPXBJKAXBL-VIFPVBQESA-N	1	1	311.313	1.424	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1cccc(F)c1[N+](=O)[O-]	ZINC001093788039	775079609	/nfs/dbraw/zinc/07/96/09/775079609.db2.gz	UGBYLSWBLVSWQC-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001094008638	775325339	/nfs/dbraw/zinc/32/53/39/775325339.db2.gz	RZLUCXOKZXQBPL-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
Cc1cnc(N(C)CCNC(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC001100149918	775735807	/nfs/dbraw/zinc/73/58/07/775735807.db2.gz	VOPUTGUCGYHJKJ-UHFFFAOYSA-N	1	1	323.397	1.191	20	5		DDBDMO
Cc1cc(NCCCNC(=O)C[N@H+](C)C(C)C)ncc1[N+](=O)[O-]	ZINC001094456774	775895318	/nfs/dbraw/zinc/89/53/18/775895318.db2.gz	QVYXQTGYYXARNT-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001094573755	776048349	/nfs/dbraw/zinc/04/83/49/776048349.db2.gz	GEEVEZIRRWHUBH-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC[C@H]21	ZINC001171815427	776482751	/nfs/dbraw/zinc/48/27/51/776482751.db2.gz	VUEBVRQGQAEVSM-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233802	777065217	/nfs/dbraw/zinc/06/52/17/777065217.db2.gz	YXFMNWGBDDMDQN-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233802	777065221	/nfs/dbraw/zinc/06/52/21/777065221.db2.gz	YXFMNWGBDDMDQN-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001173235013	777065309	/nfs/dbraw/zinc/06/53/09/777065309.db2.gz	VRLCJZFGPUTVIN-DOMZBBRYSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001173235013	777065315	/nfs/dbraw/zinc/06/53/15/777065315.db2.gz	VRLCJZFGPUTVIN-DOMZBBRYSA-N	1	1	319.361	1.069	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H]([C@@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243243	778092882	/nfs/dbraw/zinc/09/28/82/778092882.db2.gz	NJRVTAPAOYXVHT-QMTHXVAHSA-N	1	1	324.337	1.602	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H]([C@@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243243	778092890	/nfs/dbraw/zinc/09/28/90/778092890.db2.gz	NJRVTAPAOYXVHT-QMTHXVAHSA-N	1	1	324.337	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)cc1	ZINC001176778474	778235584	/nfs/dbraw/zinc/23/55/84/778235584.db2.gz	VNKUXGPAFFOHOV-AEGPPILISA-N	1	1	309.341	1.356	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN2CC[N@H+]3C[C@@H](F)C[C@H]3C2)cc1	ZINC001176778474	778235590	/nfs/dbraw/zinc/23/55/90/778235590.db2.gz	VNKUXGPAFFOHOV-AEGPPILISA-N	1	1	309.341	1.356	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC001116230212	780487229	/nfs/dbraw/zinc/48/72/29/780487229.db2.gz	URPUVMHRCBKOMS-WDEREUQCSA-N	1	1	318.377	1.992	20	5		DDBDMO
CN(CC[NH2+]C/C=C/c1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267371839	837933300	/nfs/dbraw/zinc/93/33/00/837933300.db2.gz	XBMHNGDKYFJHJK-VZLFFANISA-N	1	1	303.362	1.413	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@@H]3CCC[NH2+]C3)C2)nc1	ZINC001327863867	862524144	/nfs/dbraw/zinc/52/41/44/862524144.db2.gz	JVPRZNIRYYQNEO-OLZOCXBDSA-N	1	1	305.382	1.476	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1C[C@H]2C)c1ccc([N+](=O)[O-])cc1	ZINC001124020493	859529846	/nfs/dbraw/zinc/52/98/46/859529846.db2.gz	OOAJUAZQBRSMDJ-XUJVJEKNSA-N	1	1	318.377	1.160	20	5		DDBDMO
N=C(NCCCC[NH3+])Nc1nc2ccccc2cc1[N+](=O)[O-]	ZINC001157095999	863571776	/nfs/dbraw/zinc/57/17/76/863571776.db2.gz	FBFLBNATKDFPRD-UHFFFAOYSA-N	1	1	302.338	1.818	20	5		DDBDMO
Cc1c(C)c(NCC2([NH+]3CCCC3)COC2)ncc1[N+](=O)[O-]	ZINC001157654747	864019690	/nfs/dbraw/zinc/01/96/90/864019690.db2.gz	FJLONLSHRWICOL-UHFFFAOYSA-N	1	1	306.366	1.883	20	5		DDBDMO
O=C(NCCC[NH2+]CCCOc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775583	864131661	/nfs/dbraw/zinc/13/16/61/864131661.db2.gz	RFASPRQXVCCHDT-HUUCEWRRSA-N	1	1	321.377	1.217	20	5		DDBDMO
[NH3+]Cc1ncn(-c2ccc3c(ccc(Cl)c3[N+](=O)[O-])n2)n1	ZINC001157927854	864273827	/nfs/dbraw/zinc/27/38/27/864273827.db2.gz	CWCNTWQADZICIH-UHFFFAOYSA-N	1	1	304.697	1.836	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](CC2CCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001160106857	865679932	/nfs/dbraw/zinc/67/99/32/865679932.db2.gz	FHBIUJODZUDLTM-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
O=C(NCCC1=CC[N@H+](CC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001160106857	865679940	/nfs/dbraw/zinc/67/99/40/865679940.db2.gz	FHBIUJODZUDLTM-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](CC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001160106857	865679944	/nfs/dbraw/zinc/67/99/44/865679944.db2.gz	FHBIUJODZUDLTM-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
Nc1nc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160724461	866071216	/nfs/dbraw/zinc/07/12/16/866071216.db2.gz	LBZZQSCCFPMECE-QWRGUYRKSA-N	1	1	307.354	1.237	20	5		DDBDMO
CCN(CC[NH2+]Cc1cc(C)cc(C)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001320735054	866991643	/nfs/dbraw/zinc/99/16/43/866991643.db2.gz	QRXYGJSPEKVOQF-HZPDHXFCSA-N	1	1	319.405	1.907	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC001324580460	867372994	/nfs/dbraw/zinc/37/29/94/867372994.db2.gz	MLGVWEUIYPRSNJ-IINYFYTJSA-N	1	1	304.350	1.413	20	5		DDBDMO
CC[NH+](CC)CCNC(=N)Nc1ncc(OC)cc1[N+](=O)[O-]	ZINC001163125737	868130634	/nfs/dbraw/zinc/13/06/34/868130634.db2.gz	IWKPSSRVMSLYTI-UHFFFAOYSA-N	1	1	310.358	1.276	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC([NH2+]C2COC2)C1	ZINC001164220658	869030720	/nfs/dbraw/zinc/03/07/20/869030720.db2.gz	JWMXDFMVXREZJA-UHFFFAOYSA-N	1	1	300.318	1.320	20	5		DDBDMO
[NH3+][C@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)CCC1(F)F	ZINC001164319869	869124163	/nfs/dbraw/zinc/12/41/63/869124163.db2.gz	RKENWRITLYKCET-NSHDSACASA-N	1	1	309.276	1.711	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H](C)[C@H]1C[N@H+](C)CCN1C	ZINC001338083932	869791465	/nfs/dbraw/zinc/79/14/65/869791465.db2.gz	LTUGOHOVOAPTHT-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001338083932	869791469	/nfs/dbraw/zinc/79/14/69/869791469.db2.gz	LTUGOHOVOAPTHT-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001339085893	870339096	/nfs/dbraw/zinc/33/90/96/870339096.db2.gz	HMYUFMZTQLKAOI-MRXNPFEDSA-N	1	1	319.361	1.284	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)[C@@H]1[NH2+]CCc2occc21	ZINC001339960907	870808614	/nfs/dbraw/zinc/80/86/14/870808614.db2.gz	WLEVZKUQYZPULH-CQSZACIVSA-N	1	1	301.302	1.691	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCCCCF)CC1	ZINC001205224050	871440750	/nfs/dbraw/zinc/44/07/50/871440750.db2.gz	KPDWAASKVQVXMP-ZIAGYGMSSA-N	1	1	315.389	1.620	20	5		DDBDMO
NC(=O)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccn1	ZINC001308779491	871526991	/nfs/dbraw/zinc/52/69/91/871526991.db2.gz	AUVYSGSPFUEQHC-CQSZACIVSA-N	1	1	300.318	1.349	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Nc3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC001310993120	871668055	/nfs/dbraw/zinc/66/80/55/871668055.db2.gz	WWHAWJNIEZZPSV-UFGOTCBOSA-N	1	1	319.365	1.639	20	5		DDBDMO
CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[NH+](C2CC2)CC1	ZINC001344479187	873017124	/nfs/dbraw/zinc/01/71/24/873017124.db2.gz	PAFUHWLJXUOLKJ-GFCCVEGCSA-N	1	1	322.413	1.556	20	5		DDBDMO
COC(=O)c1cccc(CO[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001223665094	881048712	/nfs/dbraw/zinc/04/87/12/881048712.db2.gz	NIDPHJULPQINJZ-GFCCVEGCSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@H]1CC(=O)C2	ZINC001227744022	883153743	/nfs/dbraw/zinc/15/37/43/883153743.db2.gz	CRXUNZOJYMMNGX-FZZIBODNSA-N	1	1	316.317	1.654	20	5		DDBDMO
Cc1cc2[nH]c(O[C@@H](C)C[NH+]3CCOCC3)nc2cc1[N+](=O)[O-]	ZINC001228676312	883611562	/nfs/dbraw/zinc/61/15/62/883611562.db2.gz	ZIZVYUDURMVQCT-NSHDSACASA-N	1	1	320.349	1.879	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](COc2c3ccccc3oc(=O)c2[N+](=O)[O-])C1	ZINC001228803518	883679001	/nfs/dbraw/zinc/67/90/01/883679001.db2.gz	CCCAVUAMVZDFPE-SNVBAGLBSA-N	1	1	320.301	1.411	20	5		DDBDMO
C[N@H+]1CCO[C@@H](COc2c3ccccc3oc(=O)c2[N+](=O)[O-])C1	ZINC001228803518	883679009	/nfs/dbraw/zinc/67/90/09/883679009.db2.gz	CCCAVUAMVZDFPE-SNVBAGLBSA-N	1	1	320.301	1.411	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cocn1)Cc1cccc([N+](=O)[O-])c1	ZINC001235716829	888910424	/nfs/dbraw/zinc/91/04/24/888910424.db2.gz	UEQTULJLXHHZDI-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CCNC3(CC[NH2+]CC3)C1)C2	ZINC001246608210	892735105	/nfs/dbraw/zinc/73/51/05/892735105.db2.gz	YAIPCBBJVBSRGW-MRXNPFEDSA-N	1	1	316.405	1.089	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CCNS(C)(=O)=O	ZINC001254314850	896343362	/nfs/dbraw/zinc/34/33/62/896343362.db2.gz	XMNGBKNQGAHVDJ-NSHDSACASA-N	1	1	315.395	1.445	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CCNS(C)(=O)=O	ZINC001254314850	896343375	/nfs/dbraw/zinc/34/33/75/896343375.db2.gz	XMNGBKNQGAHVDJ-NSHDSACASA-N	1	1	315.395	1.445	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCNC(=O)C(F)(F)F	ZINC001254534730	896491276	/nfs/dbraw/zinc/49/12/76/896491276.db2.gz	CBXBIZJJAJOOCO-VIFPVBQESA-N	1	1	319.283	1.794	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(CCCO)CC1)C2	ZINC001254592638	896521625	/nfs/dbraw/zinc/52/16/25/896521625.db2.gz	DTSODPHWVMJUQW-INIZCTEOSA-N	1	1	305.378	1.062	20	5		DDBDMO
CC(C)(C)[N@@H+](C[C@@H](O)CO)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254592988	896522908	/nfs/dbraw/zinc/52/29/08/896522908.db2.gz	IPXCIVTVGCXDFP-HUUCEWRRSA-N	1	1	308.378	1.516	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)C[C@H]2C1	ZINC000278251553	214047355	/nfs/dbraw/zinc/04/73/55/214047355.db2.gz	BYDSESARGILRDL-AOOOYVTPSA-N	1	1	308.313	1.759	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000295600027	529503939	/nfs/dbraw/zinc/50/39/39/529503939.db2.gz	CFWJYJJAUYDOOA-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000286592891	219071025	/nfs/dbraw/zinc/07/10/25/219071025.db2.gz	VYDUGLHIOJPAPP-LLVKDONJSA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000286592891	219071027	/nfs/dbraw/zinc/07/10/27/219071027.db2.gz	VYDUGLHIOJPAPP-LLVKDONJSA-N	1	1	320.349	1.086	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCOC[C@@H]2C2CC2)c1	ZINC000090009593	185277126	/nfs/dbraw/zinc/27/71/26/185277126.db2.gz	KBSJGODASNMMGR-GOEBONIOSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOC[C@@H]2C2CC2)c1	ZINC000090009593	185277127	/nfs/dbraw/zinc/27/71/27/185277127.db2.gz	KBSJGODASNMMGR-GOEBONIOSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCC3(C2)OCCO3)c1	ZINC000090564069	185303838	/nfs/dbraw/zinc/30/38/38/185303838.db2.gz	QXRBRMAWLGPDRJ-AWEZNQCLSA-N	1	1	308.334	1.467	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC3(C2)OCCO3)c1	ZINC000090564069	185303839	/nfs/dbraw/zinc/30/38/39/185303839.db2.gz	QXRBRMAWLGPDRJ-AWEZNQCLSA-N	1	1	308.334	1.467	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])nc1	ZINC000443894044	529846620	/nfs/dbraw/zinc/84/66/20/529846620.db2.gz	GDRWPGQQEWXAPE-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[N@H+](CCCCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC1	ZINC000457168935	529883623	/nfs/dbraw/zinc/88/36/23/529883623.db2.gz	OXANEOKTWFZXIW-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC1	ZINC000457168935	529883624	/nfs/dbraw/zinc/88/36/24/529883624.db2.gz	OXANEOKTWFZXIW-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](CO)CC(C)(C)C	ZINC000451787207	529939577	/nfs/dbraw/zinc/93/95/77/529939577.db2.gz	JIRMTCMDTUNMDX-CYBMUJFWSA-N	1	1	311.382	1.485	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000272655474	282318174	/nfs/dbraw/zinc/31/81/74/282318174.db2.gz	QOENHQLPGOEZRN-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@H]21	ZINC000284899854	282342868	/nfs/dbraw/zinc/34/28/68/282342868.db2.gz	HOWHDNOUOACTJY-NXEZZACHSA-N	1	1	323.378	1.213	20	5		DDBDMO
COC(C[N@@H+](CCCO)CCc1ccc([N+](=O)[O-])cc1)OC	ZINC000272744342	210149604	/nfs/dbraw/zinc/14/96/04/210149604.db2.gz	IRHUFTJPHXELQW-UHFFFAOYSA-N	1	1	312.366	1.441	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C	ZINC000616322133	362636483	/nfs/dbraw/zinc/63/64/83/362636483.db2.gz	BVDOLXZZPMUOAH-GFCCVEGCSA-N	1	1	307.350	1.736	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279723182	215092797	/nfs/dbraw/zinc/09/27/97/215092797.db2.gz	IZHYQCNXYGYLIX-GXFFZTMASA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279723182	215092799	/nfs/dbraw/zinc/09/27/99/215092799.db2.gz	IZHYQCNXYGYLIX-GXFFZTMASA-N	1	1	307.350	1.625	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)[C@H]2C)c1[N+](=O)[O-]	ZINC000287100143	219313026	/nfs/dbraw/zinc/31/30/26/219313026.db2.gz	LIENOEOBFRFOQW-ZYHUDNBSSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)n1	ZINC000617405651	363090903	/nfs/dbraw/zinc/09/09/03/363090903.db2.gz	JAEFVYIGTQDJIQ-LLVKDONJSA-N	1	1	307.354	1.025	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000064334119	352933594	/nfs/dbraw/zinc/93/35/94/352933594.db2.gz	ZOLKBZIFPFNPDL-KBPBESRZSA-N	1	1	305.334	1.188	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000564957583	304030109	/nfs/dbraw/zinc/03/01/09/304030109.db2.gz	QQCBHMMHDFSIGW-AWEZNQCLSA-N	1	1	310.329	1.410	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000069111136	353145237	/nfs/dbraw/zinc/14/52/37/353145237.db2.gz	MOBNYWNVOOTXNA-UHFFFAOYSA-N	1	1	324.381	1.613	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000069471731	353162347	/nfs/dbraw/zinc/16/23/47/353162347.db2.gz	QQHNDUUYQQFNFF-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000074073620	353290030	/nfs/dbraw/zinc/29/00/30/353290030.db2.gz	YQUWUWFWPGJNLU-UHFFFAOYSA-N	1	1	324.356	1.874	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000332012029	234386818	/nfs/dbraw/zinc/38/68/18/234386818.db2.gz	SGHRPCRYVRAJPQ-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
CCOC(=O)c1ccnc(NC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000077965670	353498154	/nfs/dbraw/zinc/49/81/54/353498154.db2.gz	DVFNYKCSQLALLL-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CCC[NH+]1CCN(C)CC1	ZINC000092652815	353865843	/nfs/dbraw/zinc/86/58/43/353865843.db2.gz	JRHLTFGYCGSAIR-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423232	354225336	/nfs/dbraw/zinc/22/53/36/354225336.db2.gz	QHMBDNCOKOSXEB-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423232	354225338	/nfs/dbraw/zinc/22/53/38/354225338.db2.gz	QHMBDNCOKOSXEB-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[N@@H+](C[C@@H](O)C1CC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000305708927	354470677	/nfs/dbraw/zinc/47/06/77/354470677.db2.gz	FJOOCMTZJGLBQH-HUUCEWRRSA-N	1	1	319.361	1.403	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](CO)[C@H](O)C2)cc1	ZINC000588966442	354952447	/nfs/dbraw/zinc/95/24/47/354952447.db2.gz	ZIMUGFGVIKAJEX-SWLSCSKDSA-N	1	1	310.350	1.039	20	5		DDBDMO
COc1cc(CN2CC[C@@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1F	ZINC000590011039	355040655	/nfs/dbraw/zinc/04/06/55/355040655.db2.gz	GHOUWWSSBDIVIL-QMTHXVAHSA-N	1	1	309.341	1.878	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000591505193	355322319	/nfs/dbraw/zinc/32/23/19/355322319.db2.gz	DOKXVNXAAOMFOI-RYUDHWBXSA-N	1	1	322.361	1.816	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000592205589	355537371	/nfs/dbraw/zinc/53/73/71/355537371.db2.gz	DBOWGBVAMPIWTL-ZKYQVNSYSA-N	1	1	308.334	1.512	20	5		DDBDMO
CC(C)[C@H]1[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CC=CC2	ZINC000592446779	355587009	/nfs/dbraw/zinc/58/70/09/355587009.db2.gz	XCNPQBAADKEHJK-LSDHHAIUSA-N	1	1	320.393	1.829	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532024	355617111	/nfs/dbraw/zinc/61/71/11/355617111.db2.gz	LYUNHNXBZMUJMA-CHWSQXEVSA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532024	355617115	/nfs/dbraw/zinc/61/71/15/355617115.db2.gz	LYUNHNXBZMUJMA-CHWSQXEVSA-N	1	1	308.334	1.259	20	5		DDBDMO
COCC1([N@H+](C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000593020076	355771948	/nfs/dbraw/zinc/77/19/48/355771948.db2.gz	IQLDHVBIPNFMPQ-UHFFFAOYSA-N	1	1	308.334	1.992	20	5		DDBDMO
COCC1([N@@H+](C)Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000593020076	355771952	/nfs/dbraw/zinc/77/19/52/355771952.db2.gz	IQLDHVBIPNFMPQ-UHFFFAOYSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[C@H](CO)C1CC[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000593085770	355790214	/nfs/dbraw/zinc/79/02/14/355790214.db2.gz	XCIYIGDTWRPSRF-GFCCVEGCSA-N	1	1	321.377	1.874	20	5		DDBDMO
Cc1cc(NC(=O)N2CC([N@@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000593177489	355818068	/nfs/dbraw/zinc/81/80/68/355818068.db2.gz	IEQFOHJHKCLBEV-CYBMUJFWSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cc1cc(NC(=O)N2CC([N@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000593177489	355818072	/nfs/dbraw/zinc/81/80/72/355818072.db2.gz	IEQFOHJHKCLBEV-CYBMUJFWSA-N	1	1	320.349	1.186	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccnc2cc([N+](=O)[O-])ccc21	ZINC000593463001	355893491	/nfs/dbraw/zinc/89/34/91/355893491.db2.gz	JZVPSJWITSQPSW-CYBMUJFWSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ccnc3cc([N+](=O)[O-])ccc32)C1	ZINC000593463001	355893496	/nfs/dbraw/zinc/89/34/96/355893496.db2.gz	JZVPSJWITSQPSW-CYBMUJFWSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ccnc3cc([N+](=O)[O-])ccc32)C1	ZINC000593463001	355893499	/nfs/dbraw/zinc/89/34/99/355893499.db2.gz	JZVPSJWITSQPSW-CYBMUJFWSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCCC[C@H]1CO	ZINC000594017220	356089273	/nfs/dbraw/zinc/08/92/73/356089273.db2.gz	VQWCGWKJPHVLBY-KBPBESRZSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594199311	356138371	/nfs/dbraw/zinc/13/83/71/356138371.db2.gz	JTELFQXANUVOET-CHWSQXEVSA-N	1	1	321.381	1.233	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000594990795	356368861	/nfs/dbraw/zinc/36/88/61/356368861.db2.gz	AITYRKXSKDFWNK-CYBMUJFWSA-N	1	1	321.377	1.940	20	5		DDBDMO
CCCN1CC[C@@H]([NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000594990795	356368865	/nfs/dbraw/zinc/36/88/65/356368865.db2.gz	AITYRKXSKDFWNK-CYBMUJFWSA-N	1	1	321.377	1.940	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC1(O)CC[NH+](C)CC1	ZINC000595029781	356374350	/nfs/dbraw/zinc/37/43/50/356374350.db2.gz	YNWJPIUWOGRKMZ-LBPRGKRZSA-N	1	1	323.393	1.711	20	5		DDBDMO
Cc1noc(CN2CC[NH+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000595288134	356433572	/nfs/dbraw/zinc/43/35/72/356433572.db2.gz	JZUMXEOKOLNCJJ-LBPRGKRZSA-N	1	1	310.354	1.188	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000081556902	192290997	/nfs/dbraw/zinc/29/09/97/192290997.db2.gz	CABBOCAVYDNVGV-JTQLQIEISA-N	1	1	323.349	1.275	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000081556133	192291641	/nfs/dbraw/zinc/29/16/41/192291641.db2.gz	FHHCUHKBWNXXPX-NSHDSACASA-N	1	1	322.365	1.237	20	5		DDBDMO
C[C@H]1C[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)C1O	ZINC000595743753	356631188	/nfs/dbraw/zinc/63/11/88/356631188.db2.gz	QEGNBLJETLHARO-UWVGGRQHSA-N	1	1	304.350	1.920	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595835112	356671500	/nfs/dbraw/zinc/67/15/00/356671500.db2.gz	UNVHUHAKPXALEJ-STQMWFEESA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595835112	356671502	/nfs/dbraw/zinc/67/15/02/356671502.db2.gz	UNVHUHAKPXALEJ-STQMWFEESA-N	1	1	319.361	1.810	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cs1	ZINC000595866384	356684250	/nfs/dbraw/zinc/68/42/50/356684250.db2.gz	LFNAITSJJSULQB-CYBMUJFWSA-N	1	1	311.407	1.687	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000596209646	356815455	/nfs/dbraw/zinc/81/54/55/356815455.db2.gz	AQEBWQIVFPVDGI-UHFFFAOYSA-N	1	1	308.729	1.693	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596308692	356852881	/nfs/dbraw/zinc/85/28/81/356852881.db2.gz	KWWSHGQXBROTPH-NSHDSACASA-N	1	1	306.366	1.978	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000596541442	356912040	/nfs/dbraw/zinc/91/20/40/356912040.db2.gz	GAHCMPYZCPUKJH-UHFFFAOYSA-N	1	1	309.370	1.621	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597717021	357299833	/nfs/dbraw/zinc/29/98/33/357299833.db2.gz	WJUGKYMVSQIDGF-HNNXBMFYSA-N	1	1	321.381	1.195	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000597922516	357382345	/nfs/dbraw/zinc/38/23/45/357382345.db2.gz	FKLRSAUMPFVPJU-GFCCVEGCSA-N	1	1	321.377	1.963	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598511912	357610525	/nfs/dbraw/zinc/61/05/25/357610525.db2.gz	UTWMPRFRLZQWBD-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598511912	357610529	/nfs/dbraw/zinc/61/05/29/357610529.db2.gz	UTWMPRFRLZQWBD-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000598590886	357644334	/nfs/dbraw/zinc/64/43/34/357644334.db2.gz	RSDGKCQKFHOFTH-QWRGUYRKSA-N	1	1	320.349	1.815	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598559702	357631881	/nfs/dbraw/zinc/63/18/81/357631881.db2.gz	YOEBPJLMWXUPBA-NSHDSACASA-N	1	1	307.354	1.170	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC1CC([NH+]2CCOCC2)C1	ZINC000599094471	357814368	/nfs/dbraw/zinc/81/43/68/357814368.db2.gz	JKEKKEHKAIGROS-UHFFFAOYSA-N	1	1	309.370	1.395	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+]1CCCNCc1csc([N+](=O)[O-])c1	ZINC000598991209	357785759	/nfs/dbraw/zinc/78/57/59/357785759.db2.gz	WHJMPUYCAMMIPT-NSHDSACASA-N	1	1	312.395	1.086	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1CCCNCc1csc([N+](=O)[O-])c1	ZINC000598991209	357785766	/nfs/dbraw/zinc/78/57/66/357785766.db2.gz	WHJMPUYCAMMIPT-NSHDSACASA-N	1	1	312.395	1.086	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2NCC[N@@H+]1CC[C@@H](O)C1	ZINC000599176790	357840391	/nfs/dbraw/zinc/84/03/91/357840391.db2.gz	YGERDHNGPZXWMQ-LLVKDONJSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)CC1(O)CCC1	ZINC000599404071	357923839	/nfs/dbraw/zinc/92/38/39/357923839.db2.gz	GZZFXKDGQNKSGV-HNNXBMFYSA-N	1	1	308.378	1.735	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3cn[nH]c3)CC2)cc1	ZINC000599439298	357937246	/nfs/dbraw/zinc/93/72/46/357937246.db2.gz	NFDGVMONGMUACC-UHFFFAOYSA-N	1	1	315.377	1.678	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2C[C@@H](C(N)=O)C2)c1	ZINC000599652447	358008780	/nfs/dbraw/zinc/00/87/80/358008780.db2.gz	MNUKWIRJKPMASO-KLPPZKSPSA-N	1	1	321.333	1.077	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000599688077	358026197	/nfs/dbraw/zinc/02/61/97/358026197.db2.gz	HUBGQTLEDXBMQF-ZSBIGDGJSA-N	1	1	310.354	1.453	20	5		DDBDMO
C[C@]1(CO)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000600204049	358155832	/nfs/dbraw/zinc/15/58/32/358155832.db2.gz	NYCZTDZRKLJQPL-XKSIXWHQSA-N	1	1	320.389	1.921	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000600312045	358191947	/nfs/dbraw/zinc/19/19/47/358191947.db2.gz	DNWRNFVOKCRHDD-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000600312045	358191952	/nfs/dbraw/zinc/19/19/52/358191952.db2.gz	DNWRNFVOKCRHDD-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
C[C@@](CO)([NH2+]Cc1cnn2c1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000601149518	358422627	/nfs/dbraw/zinc/42/26/27/358422627.db2.gz	NMIVWTITCLUKTM-INIZCTEOSA-N	1	1	316.361	1.735	20	5		DDBDMO
O=C1CC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCN1	ZINC000601175976	358434755	/nfs/dbraw/zinc/43/47/55/358434755.db2.gz	MELSJVFEYOPZIQ-JTQLQIEISA-N	1	1	300.318	1.646	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@@H](CO)C1	ZINC000601979432	358763591	/nfs/dbraw/zinc/76/35/91/358763591.db2.gz	FZAVYLXSIBOFLA-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602641001	359092504	/nfs/dbraw/zinc/09/25/04/359092504.db2.gz	UEQHCSOMSGJLRS-CYBMUJFWSA-N	1	1	303.322	1.377	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602641001	359092506	/nfs/dbraw/zinc/09/25/06/359092506.db2.gz	UEQHCSOMSGJLRS-CYBMUJFWSA-N	1	1	303.322	1.377	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899264	359280675	/nfs/dbraw/zinc/28/06/75/359280675.db2.gz	OYVPQTBVUBQMBM-YPMHNXCESA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899264	359280680	/nfs/dbraw/zinc/28/06/80/359280680.db2.gz	OYVPQTBVUBQMBM-YPMHNXCESA-N	1	1	300.742	1.566	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@@H](O)C[C@H]3CO)co2)cc1	ZINC000186527080	199969333	/nfs/dbraw/zinc/96/93/33/199969333.db2.gz	CUGQWYKCQLVBAN-KBPBESRZSA-N	1	1	319.317	1.177	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H](O)C[C@H]3CO)co2)cc1	ZINC000186527080	199969335	/nfs/dbraw/zinc/96/93/35/199969335.db2.gz	CUGQWYKCQLVBAN-KBPBESRZSA-N	1	1	319.317	1.177	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000186789982	200011325	/nfs/dbraw/zinc/01/13/25/200011325.db2.gz	XKWCBVFNYPZVJU-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000186862572	200023767	/nfs/dbraw/zinc/02/37/67/200023767.db2.gz	YZFLECDAPKBHBG-KTRBRXNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CC[C@@](CO)([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000187963156	200183683	/nfs/dbraw/zinc/18/36/83/200183683.db2.gz	QOYFSAWGCNGBHS-SWLSCSKDSA-N	1	1	309.366	1.239	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000609268828	360285878	/nfs/dbraw/zinc/28/58/78/360285878.db2.gz	DMCZXQSFKTUQII-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609583263	360328779	/nfs/dbraw/zinc/32/87/79/360328779.db2.gz	CBMHLTUOHSODAT-UHFFFAOYSA-N	1	1	309.322	1.394	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000610208769	360390550	/nfs/dbraw/zinc/39/05/50/360390550.db2.gz	KRPRCMCVDQXJMO-YPMHNXCESA-N	1	1	321.377	1.745	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](C2CC2)C2CCCCC2)c1	ZINC000610367654	360422564	/nfs/dbraw/zinc/42/25/64/360422564.db2.gz	PRLKUQMPLYNZDW-OAHLLOKOSA-N	1	1	308.382	1.949	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611092509	360621687	/nfs/dbraw/zinc/62/16/87/360621687.db2.gz	WSYSCHAEXGWCKF-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@H](O)C3)o2)c1	ZINC000611276809	360687757	/nfs/dbraw/zinc/68/77/57/360687757.db2.gz	ONXQBEFZPLJOTO-OKILXGFUSA-N	1	1	318.329	1.782	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])s2)CC1	ZINC000611242447	360676224	/nfs/dbraw/zinc/67/62/24/360676224.db2.gz	ABQVLQDSYRZBSF-NSHDSACASA-N	1	1	324.406	1.575	20	5		DDBDMO
CC[C@H](C[NH+]1CCCC1)NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000611556702	360759173	/nfs/dbraw/zinc/75/91/73/360759173.db2.gz	OCAGCGWETQWUOG-GFCCVEGCSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@H+](C)CCO1	ZINC000611712052	360802139	/nfs/dbraw/zinc/80/21/39/360802139.db2.gz	UXOZEQZGEUHUMC-YGRLFVJLSA-N	1	1	317.349	1.669	20	5		DDBDMO
C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000611712052	360802141	/nfs/dbraw/zinc/80/21/41/360802141.db2.gz	UXOZEQZGEUHUMC-YGRLFVJLSA-N	1	1	317.349	1.669	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H](C[NH+]3CCOCC3)C2)n1	ZINC000611616727	360777009	/nfs/dbraw/zinc/77/70/09/360777009.db2.gz	AAKGMPHGYPGRBD-CQSZACIVSA-N	1	1	320.393	1.765	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C[C@@H]2CO1	ZINC000281370498	216254299	/nfs/dbraw/zinc/25/42/99/216254299.db2.gz	OMZUVAOADKOFOM-RISCZKNCSA-N	1	1	321.333	1.404	20	5		DDBDMO
CCC[NH2+]CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000193344836	201036190	/nfs/dbraw/zinc/03/61/90/201036190.db2.gz	PKXWQQHJJDVNEV-UHFFFAOYSA-N	1	1	305.331	1.012	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000264499656	203959845	/nfs/dbraw/zinc/95/98/45/203959845.db2.gz	KDWHRFQFTOVDNU-JTQLQIEISA-N	1	1	311.313	1.184	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000264679556	204072521	/nfs/dbraw/zinc/07/25/21/204072521.db2.gz	OVFLLALFTLILLM-UHFFFAOYSA-N	1	1	306.326	1.205	20	5		DDBDMO
Nc1ccc(C(=O)N2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-]	ZINC000264977103	204318834	/nfs/dbraw/zinc/31/88/34/204318834.db2.gz	OULLRGNRFVYQAV-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000351251160	284312406	/nfs/dbraw/zinc/31/24/06/284312406.db2.gz	GMOQIAAVRLPBOV-PHIMTYICSA-N	1	1	321.381	1.565	20	5		DDBDMO
C[C@H](CO)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCC1	ZINC000351525012	284361822	/nfs/dbraw/zinc/36/18/22/284361822.db2.gz	QOGNVFXFJSMYJZ-LLVKDONJSA-N	1	1	321.377	1.819	20	5		DDBDMO
CNC(=O)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000338715417	250102199	/nfs/dbraw/zinc/10/21/99/250102199.db2.gz	ZXWAGEOXLZTLKP-UHFFFAOYSA-N	1	1	319.317	1.699	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000105793647	194128879	/nfs/dbraw/zinc/12/88/79/194128879.db2.gz	DVODZGLLXMROLI-UHFFFAOYSA-N	1	1	317.353	1.160	20	5		DDBDMO
CN(C)[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000109807596	194288215	/nfs/dbraw/zinc/28/82/15/194288215.db2.gz	QEPYVLYDDGQGLU-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(C)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000109807596	194288217	/nfs/dbraw/zinc/28/82/17/194288217.db2.gz	QEPYVLYDDGQGLU-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nnnc2Sc2ccc([N+](=O)[O-])cc2)C1	ZINC000340745928	251188938	/nfs/dbraw/zinc/18/89/38/251188938.db2.gz	SABCAHMFWCZGEE-SNVBAGLBSA-N	1	1	320.378	1.684	20	5		DDBDMO
COCC[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1C	ZINC000330703797	532968449	/nfs/dbraw/zinc/96/84/49/532968449.db2.gz	JLUGTVUMVWKBQW-LBPRGKRZSA-N	1	1	311.357	1.886	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N2CC([NH+](C)C)C2)cc1[N+](=O)[O-]	ZINC000276934976	291819529	/nfs/dbraw/zinc/81/95/29/291819529.db2.gz	BCBROBZGISOELL-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
CC[N@H+](CCO)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000120021110	195081833	/nfs/dbraw/zinc/08/18/33/195081833.db2.gz	HCPUPRGBNQCBIF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CCO)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000120021110	195081835	/nfs/dbraw/zinc/08/18/35/195081835.db2.gz	HCPUPRGBNQCBIF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@H]1OCC[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1C	ZINC000156561928	197123419	/nfs/dbraw/zinc/12/34/19/197123419.db2.gz	JQJBSKOPJPPVAD-BZPMIXESSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@H]1OCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1C	ZINC000156561928	197123421	/nfs/dbraw/zinc/12/34/21/197123421.db2.gz	JQJBSKOPJPPVAD-BZPMIXESSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@H](n3cc(Cl)cn3)C2)c1	ZINC000289910704	221310211	/nfs/dbraw/zinc/31/02/11/221310211.db2.gz	NZQNURMNBIGENK-LLVKDONJSA-N	1	1	310.745	1.588	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)c1	ZINC000289910704	221310213	/nfs/dbraw/zinc/31/02/13/221310213.db2.gz	NZQNURMNBIGENK-LLVKDONJSA-N	1	1	310.745	1.588	20	5		DDBDMO
CS(=O)(=O)C[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000292404014	533368500	/nfs/dbraw/zinc/36/85/00/533368500.db2.gz	ZBHMCSJUJBPHDD-CYBMUJFWSA-N	1	1	312.391	1.504	20	5		DDBDMO
CS(=O)(=O)C[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000292404014	533368502	/nfs/dbraw/zinc/36/85/02/533368502.db2.gz	ZBHMCSJUJBPHDD-CYBMUJFWSA-N	1	1	312.391	1.504	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000299565072	533665207	/nfs/dbraw/zinc/66/52/07/533665207.db2.gz	USMLODAVLKIVJP-SNVBAGLBSA-N	1	1	309.370	1.621	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000072064512	406873767	/nfs/dbraw/zinc/87/37/67/406873767.db2.gz	BPBNUZPXEYORQG-KGLIPLIRSA-N	1	1	319.361	1.496	20	5		DDBDMO
CCSCC[C@@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000072900678	406886132	/nfs/dbraw/zinc/88/61/32/406886132.db2.gz	OCPWBMFZPPXVSR-YPMHNXCESA-N	1	1	316.427	1.616	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2CN2CCOCC2)cc1	ZINC000075889609	406946495	/nfs/dbraw/zinc/94/64/95/406946495.db2.gz	FDPURMBQYBJYJV-KRWDZBQOSA-N	1	1	319.405	1.934	20	5		DDBDMO
CC[N@@H+](CCNC(=O)NCc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000101984964	407318750	/nfs/dbraw/zinc/31/87/50/407318750.db2.gz	QMAFBUJCJAOKNG-UHFFFAOYSA-N	1	1	306.366	1.878	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000126048127	407403575	/nfs/dbraw/zinc/40/35/75/407403575.db2.gz	GDPPBWZYJCQJLZ-JSGCOSHPSA-N	1	1	320.393	1.805	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000271010973	407466623	/nfs/dbraw/zinc/46/66/23/407466623.db2.gz	ZSXFOQLZQMCTIK-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](C)(C[NH3+])C1	ZINC000261724694	407592521	/nfs/dbraw/zinc/59/25/21/407592521.db2.gz	JMNDAIHRUPSUIH-MRXNPFEDSA-N	1	1	320.393	1.903	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000152996108	407730941	/nfs/dbraw/zinc/73/09/41/407730941.db2.gz	DWWHCTPMIMPWSH-IUODEOHRSA-N	1	1	321.377	1.793	20	5		DDBDMO
COC(=O)CCC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000116351748	407747842	/nfs/dbraw/zinc/74/78/42/407747842.db2.gz	ZAZKBHAIWKMNAD-UHFFFAOYSA-N	1	1	307.350	1.670	20	5		DDBDMO
O=C(NC1CC[NH+](CC2CCCC2)CC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000179698821	407821575	/nfs/dbraw/zinc/82/15/75/407821575.db2.gz	LBEKFWIIRZUUMH-UHFFFAOYSA-N	1	1	321.381	1.702	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000117398308	407833559	/nfs/dbraw/zinc/83/35/59/407833559.db2.gz	QNMVFVOGGFTLDA-GFCCVEGCSA-N	1	1	322.365	1.779	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000117398308	407833563	/nfs/dbraw/zinc/83/35/63/407833563.db2.gz	QNMVFVOGGFTLDA-GFCCVEGCSA-N	1	1	322.365	1.779	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000133550080	407855476	/nfs/dbraw/zinc/85/54/76/407855476.db2.gz	YXRJVUHWJAOUHU-PWSUYJOCSA-N	1	1	318.377	1.992	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180565512	407901193	/nfs/dbraw/zinc/90/11/93/407901193.db2.gz	DEBZACKUKOQYTB-NSHDSACASA-N	1	1	321.381	1.566	20	5		DDBDMO
C[C@@H]1C[NH2+]CC[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000262812748	407940715	/nfs/dbraw/zinc/94/07/15/407940715.db2.gz	YLJQOWKADJRFJA-PSASIEDQSA-N	1	1	317.342	1.010	20	5		DDBDMO
CC[C@H](c1ccncc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245714596	408050275	/nfs/dbraw/zinc/05/02/75/408050275.db2.gz	PWTOXOXDNXDGBV-HUUCEWRRSA-N	1	1	319.365	1.630	20	5		DDBDMO
C[C@H](CCO)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272563990	407984840	/nfs/dbraw/zinc/98/48/40/407984840.db2.gz	UQLKYNDKOSPJNU-BXUZGUMPSA-N	1	1	304.350	1.778	20	5		DDBDMO
Cc1c(CC(=O)NCC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000189445649	408018387	/nfs/dbraw/zinc/01/83/87/408018387.db2.gz	IACJEEYAKQQTDM-UHFFFAOYSA-N	1	1	321.377	1.284	20	5		DDBDMO
CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cn1ccc([N+](=O)[O-])n1)C2	ZINC000174975233	408020086	/nfs/dbraw/zinc/02/00/86/408020086.db2.gz	YDLHNZYIRBHLJD-QWHCGFSZSA-N	1	1	321.381	1.265	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000189747713	408097904	/nfs/dbraw/zinc/09/79/04/408097904.db2.gz	YZFLECDAPKBHBG-YBJDMEARSA-N	1	1	319.361	1.133	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])cn1	ZINC000182227594	408099170	/nfs/dbraw/zinc/09/91/70/408099170.db2.gz	ZDUIWRIHDVMCGY-ZDUSSCGKSA-N	1	1	320.349	1.200	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000263664637	408195618	/nfs/dbraw/zinc/19/56/18/408195618.db2.gz	FBSLXEQWQMAOQF-UHFFFAOYSA-N	1	1	306.366	1.243	20	5		DDBDMO
CCNC(=O)C[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000263664637	408195625	/nfs/dbraw/zinc/19/56/25/408195625.db2.gz	FBSLXEQWQMAOQF-UHFFFAOYSA-N	1	1	306.366	1.243	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cn1	ZINC000263761502	408242799	/nfs/dbraw/zinc/24/27/99/408242799.db2.gz	USLDQLRHTSYWEL-CYBMUJFWSA-N	1	1	321.381	1.344	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000175906011	408235974	/nfs/dbraw/zinc/23/59/74/408235974.db2.gz	MMKFGSVLDQYUDP-ZDUSSCGKSA-N	1	1	320.349	1.073	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000175906011	408235979	/nfs/dbraw/zinc/23/59/79/408235979.db2.gz	MMKFGSVLDQYUDP-ZDUSSCGKSA-N	1	1	320.349	1.073	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488364	408326243	/nfs/dbraw/zinc/32/62/43/408326243.db2.gz	YCYXKXZYWNMJAA-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488364	408326247	/nfs/dbraw/zinc/32/62/47/408326247.db2.gz	YCYXKXZYWNMJAA-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@H]2C[NH+]3CCN2CC3)c2ccncc21	ZINC000269490231	408328488	/nfs/dbraw/zinc/32/84/88/408328488.db2.gz	NUGAHSWVGPXQRR-GFCCVEGCSA-N	1	1	313.361	1.555	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000269390660	408292215	/nfs/dbraw/zinc/29/22/15/408292215.db2.gz	RHAFSSABJVZSFO-GHMZBOCLSA-N	1	1	321.381	1.798	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccccc1[N+](=O)[O-]	ZINC000269428247	408305526	/nfs/dbraw/zinc/30/55/26/408305526.db2.gz	QKWQTGVMNADCKH-CYBMUJFWSA-N	1	1	321.377	1.562	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@H]1O	ZINC000246751963	408332371	/nfs/dbraw/zinc/33/23/71/408332371.db2.gz	OOWAGRPRUYSLNB-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O	ZINC000247021309	408390818	/nfs/dbraw/zinc/39/08/18/408390818.db2.gz	CQQJVZJJQAKOOM-ZFWWWQNUSA-N	1	1	307.394	1.872	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000184000250	408527619	/nfs/dbraw/zinc/52/76/19/408527619.db2.gz	JZFPOBGRUKWQPC-UHFFFAOYSA-N	1	1	301.368	1.009	20	5		DDBDMO
CC[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000247392441	408461437	/nfs/dbraw/zinc/46/14/37/408461437.db2.gz	XGLYJJYLFLZQPJ-DZGCQCFKSA-N	1	1	307.394	1.872	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](CO)c1ccccc1	ZINC000270563182	408581775	/nfs/dbraw/zinc/58/17/75/408581775.db2.gz	KWJGGVPOJBTJMF-OAHLLOKOSA-N	1	1	317.345	1.422	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)C[C@H]2CCC[N@@H+]2CC)c1[N+](=O)[O-]	ZINC000177422176	408610700	/nfs/dbraw/zinc/61/07/00/408610700.db2.gz	KAIPTDHCNXJSHP-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000177422176	408610704	/nfs/dbraw/zinc/61/07/04/408610704.db2.gz	KAIPTDHCNXJSHP-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@@H+]2CC)c1[N+](=O)[O-]	ZINC000177422176	408610709	/nfs/dbraw/zinc/61/07/09/408610709.db2.gz	KAIPTDHCNXJSHP-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1O	ZINC000249531010	408738258	/nfs/dbraw/zinc/73/82/58/408738258.db2.gz	AXUIWIAXEJUMSC-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1O	ZINC000249531010	408738265	/nfs/dbraw/zinc/73/82/65/408738265.db2.gz	AXUIWIAXEJUMSC-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CC(C)[N@H+](CCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000177650447	408677812	/nfs/dbraw/zinc/67/78/12/408677812.db2.gz	NKFZQMOOVMXAML-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC(C)[N@@H+](CCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000177650447	408677817	/nfs/dbraw/zinc/67/78/17/408677817.db2.gz	NKFZQMOOVMXAML-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000162232081	408681542	/nfs/dbraw/zinc/68/15/42/408681542.db2.gz	BNPDGSHLSLYNMD-TXEJJXNPSA-N	1	1	323.397	1.426	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1C	ZINC000251933776	408790628	/nfs/dbraw/zinc/79/06/28/408790628.db2.gz	UBUONCFZSBKOJG-DUVNUKRYSA-N	1	1	324.377	1.691	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@](C)(O)C1	ZINC000177980388	408751006	/nfs/dbraw/zinc/75/10/06/408751006.db2.gz	IDWPOWZMNKULKY-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COCCOCCOCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC000276149343	408823162	/nfs/dbraw/zinc/82/31/62/408823162.db2.gz	GDFKCIBKUCBSCF-UHFFFAOYSA-N	1	1	312.366	1.706	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1	ZINC000290783058	408831887	/nfs/dbraw/zinc/83/18/87/408831887.db2.gz	NFMVQQZZZXPUAD-CQSZACIVSA-N	1	1	317.349	1.308	20	5		DDBDMO
Cc1ccc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000285628914	408832164	/nfs/dbraw/zinc/83/21/64/408832164.db2.gz	DWTWENZGNXLTMU-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])c(OC[C@@H](O)C[N@@H+](C)C2CC2)c1	ZINC000290794697	408834570	/nfs/dbraw/zinc/83/45/70/408834570.db2.gz	OVLVVBFCSUBFLV-ZDUSSCGKSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280876168	408851398	/nfs/dbraw/zinc/85/13/98/408851398.db2.gz	ZUNTWEIMAUDJGS-MEBBXXQBSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[N@H+](CCCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000276473776	408864720	/nfs/dbraw/zinc/86/47/20/408864720.db2.gz	ZEEAWFRQSILLGM-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[N@@H+](CCCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000276473776	408864722	/nfs/dbraw/zinc/86/47/22/408864722.db2.gz	ZEEAWFRQSILLGM-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])c1	ZINC000291664766	408904237	/nfs/dbraw/zinc/90/42/37/408904237.db2.gz	GAEIRKSWJPDVRS-CYBMUJFWSA-N	1	1	315.333	1.337	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H](n3cccn3)C2)c([N+](=O)[O-])c1	ZINC000291664766	408904241	/nfs/dbraw/zinc/90/42/41/408904241.db2.gz	GAEIRKSWJPDVRS-CYBMUJFWSA-N	1	1	315.333	1.337	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCN2CC[N@H+](C)C(C)(C)C2)n1	ZINC000281675613	408909143	/nfs/dbraw/zinc/90/91/43/408909143.db2.gz	QHJFQMLIVYIKHS-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
COC(=O)c1cc(C(=O)NC[C@@H]2CCC[N@H+]2C)cc([N+](=O)[O-])c1	ZINC000194734002	163295745	/nfs/dbraw/zinc/29/57/45/163295745.db2.gz	BWJAWHJZWVXONC-LBPRGKRZSA-N	1	1	321.333	1.205	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000277567934	408966024	/nfs/dbraw/zinc/96/60/24/408966024.db2.gz	KWUKJXAVIGEOEJ-MNOVXSKESA-N	1	1	319.361	1.958	20	5		DDBDMO
CSC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000292297396	409019534	/nfs/dbraw/zinc/01/95/34/409019534.db2.gz	CXSYZMMMOCSARM-LBPRGKRZSA-N	1	1	311.407	1.832	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000287539738	409051704	/nfs/dbraw/zinc/05/17/04/409051704.db2.gz	BOBLQPLRUFRBLN-PHIMTYICSA-N	1	1	320.349	1.083	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@@H](O)CC2)c([N+](=O)[O-])cc1OC	ZINC000294125097	409244811	/nfs/dbraw/zinc/24/48/11/409244811.db2.gz	UCBDVWGCYSNRNK-GFCCVEGCSA-N	1	1	310.350	1.959	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@H](O)CC2)c([N+](=O)[O-])cc1OC	ZINC000294125097	409244812	/nfs/dbraw/zinc/24/48/12/409244812.db2.gz	UCBDVWGCYSNRNK-GFCCVEGCSA-N	1	1	310.350	1.959	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000280274024	409282780	/nfs/dbraw/zinc/28/27/80/409282780.db2.gz	MWOGCSFGFNYAOQ-CYBMUJFWSA-N	1	1	308.294	1.200	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280301327	409287921	/nfs/dbraw/zinc/28/79/21/409287921.db2.gz	FTKIORFUJPQEIM-KCXAZCMYSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280301327	409287925	/nfs/dbraw/zinc/28/79/25/409287925.db2.gz	FTKIORFUJPQEIM-KCXAZCMYSA-N	1	1	322.361	1.508	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1CC=CCC1	ZINC000280468400	409317664	/nfs/dbraw/zinc/31/76/64/409317664.db2.gz	GGDSIIOABBDMPE-UHFFFAOYSA-N	1	1	320.349	1.987	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000295281811	409412134	/nfs/dbraw/zinc/41/21/34/409412134.db2.gz	DACTUVICCOTKAH-CABCVRRESA-N	1	1	309.341	1.639	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CCO1	ZINC000285368113	409414704	/nfs/dbraw/zinc/41/47/04/409414704.db2.gz	QSRWUTZASNXTLV-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](C2CC2)C2COC2)c1	ZINC000295325604	409436015	/nfs/dbraw/zinc/43/60/15/409436015.db2.gz	GZHFOVMQDNIBHD-AWEZNQCLSA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+](C2CC2)C2COC2)c1	ZINC000295325604	409436021	/nfs/dbraw/zinc/43/60/21/409436021.db2.gz	GZHFOVMQDNIBHD-AWEZNQCLSA-N	1	1	308.334	1.198	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000322339189	164047097	/nfs/dbraw/zinc/04/70/97/164047097.db2.gz	BPZNZCQJDOXCJM-GHMZBOCLSA-N	1	1	320.349	1.815	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356715587	409547610	/nfs/dbraw/zinc/54/76/10/409547610.db2.gz	SEZIUXJWURPXQU-LBPRGKRZSA-N	1	1	323.397	1.569	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H](C)C[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000356757587	409578683	/nfs/dbraw/zinc/57/86/83/409578683.db2.gz	ADFBHCKBVNGQST-JTQLQIEISA-N	1	1	311.386	1.900	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000356843274	409654577	/nfs/dbraw/zinc/65/45/77/409654577.db2.gz	GIBLQKDZLQTATP-QWHCGFSZSA-N	1	1	320.393	1.582	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000357005085	409784551	/nfs/dbraw/zinc/78/45/51/409784551.db2.gz	QVOWUVYVELQHLJ-QWHCGFSZSA-N	1	1	320.393	1.582	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)C1	ZINC000346229488	409869890	/nfs/dbraw/zinc/86/98/90/409869890.db2.gz	MBNUOODYTMMJMR-UMNHJUIQSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357513634	410078420	/nfs/dbraw/zinc/07/84/20/410078420.db2.gz	NPRREUVXTCNYLQ-BDAKNGLRSA-N	1	1	305.338	1.126	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[N@H+](C)CC1	ZINC000298652061	410330036	/nfs/dbraw/zinc/33/00/36/410330036.db2.gz	DCZUSJFLRPDFBH-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000298788834	410400340	/nfs/dbraw/zinc/40/03/40/410400340.db2.gz	RGTDTMCKGRWDQA-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000352013312	410411837	/nfs/dbraw/zinc/41/18/37/410411837.db2.gz	IPRQUWYDWRMPJD-GHMZBOCLSA-N	1	1	309.370	1.041	20	5		DDBDMO
CC1(C[NH+]2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)COC1	ZINC000339733067	410424147	/nfs/dbraw/zinc/42/41/47/410424147.db2.gz	CKSKPBQFZUFSLQ-UHFFFAOYSA-N	1	1	319.361	1.389	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H]1C	ZINC000347534899	410601087	/nfs/dbraw/zinc/60/10/87/410601087.db2.gz	ZSUSDZOMYRKDBF-MNOVXSKESA-N	1	1	309.370	1.273	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CCC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000343596267	410560962	/nfs/dbraw/zinc/56/09/62/410560962.db2.gz	GVJTXWZAQRMWTG-PWSUYJOCSA-N	1	1	306.366	1.849	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-]	ZINC000301145519	410663491	/nfs/dbraw/zinc/66/34/91/410663491.db2.gz	LHCIIPWZTCJQDS-UHFFFAOYSA-N	1	1	305.338	1.996	20	5		DDBDMO
C[C@@H]1[C@H](C)N(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000337299226	410700320	/nfs/dbraw/zinc/70/03/20/410700320.db2.gz	MGDUOFBPHNPWIR-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000337299226	410700321	/nfs/dbraw/zinc/70/03/21/410700321.db2.gz	MGDUOFBPHNPWIR-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000337299226	410700327	/nfs/dbraw/zinc/70/03/27/410700327.db2.gz	MGDUOFBPHNPWIR-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@H+](CC(C)(C)O)CCN1Cc1cc(O)ccc1[N+](=O)[O-]	ZINC000330450119	410700493	/nfs/dbraw/zinc/70/04/93/410700493.db2.gz	ILXYBLBIUZGOSY-LBPRGKRZSA-N	1	1	323.393	1.577	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1cc(O)ccc1[N+](=O)[O-]	ZINC000330450119	410700497	/nfs/dbraw/zinc/70/04/97/410700497.db2.gz	ILXYBLBIUZGOSY-LBPRGKRZSA-N	1	1	323.393	1.577	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](C[C@@H](O)Cc1ccccc1)CC2	ZINC000347785897	410720167	/nfs/dbraw/zinc/72/01/67/410720167.db2.gz	OPUQIAHYIIIXBC-INIZCTEOSA-N	1	1	313.357	1.952	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C[C@@H](O)Cc1ccccc1)CC2	ZINC000347785897	410720172	/nfs/dbraw/zinc/72/01/72/410720172.db2.gz	OPUQIAHYIIIXBC-INIZCTEOSA-N	1	1	313.357	1.952	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[N@H+](C)C1	ZINC000330542498	410763707	/nfs/dbraw/zinc/76/37/07/410763707.db2.gz	IVNKWAKYVNBWCN-ZLDLUXBVSA-N	1	1	321.377	1.800	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000330542498	410763712	/nfs/dbraw/zinc/76/37/12/410763712.db2.gz	IVNKWAKYVNBWCN-ZLDLUXBVSA-N	1	1	321.377	1.800	20	5		DDBDMO
Cc1nc(N2CCC[C@@H]2C[N@H+]2CCC[C@H]2CO)ccc1[N+](=O)[O-]	ZINC000301662800	410766773	/nfs/dbraw/zinc/76/67/73/410766773.db2.gz	NDSWHYVPUMRNEH-KGLIPLIRSA-N	1	1	320.393	1.724	20	5		DDBDMO
COc1cc(C(=O)NCC[NH+]2CCC2)cc([N+](=O)[O-])c1OC	ZINC000337599361	410887274	/nfs/dbraw/zinc/88/72/74/410887274.db2.gz	QTOPLNWOYKWUGA-UHFFFAOYSA-N	1	1	309.322	1.048	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344064109	410932559	/nfs/dbraw/zinc/93/25/59/410932559.db2.gz	OSNAMWMAWKDLEC-YXMPFFBPSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344064109	410932566	/nfs/dbraw/zinc/93/25/66/410932566.db2.gz	OSNAMWMAWKDLEC-YXMPFFBPSA-N	1	1	319.361	1.625	20	5		DDBDMO
Cc1c(CNC(=O)[C@@H](C)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000331160255	410989266	/nfs/dbraw/zinc/98/92/66/410989266.db2.gz	ZZGGGQYJDFYMEW-CYBMUJFWSA-N	1	1	320.393	1.155	20	5		DDBDMO
C[C@@H](CCO)[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353517112	411042775	/nfs/dbraw/zinc/04/27/75/411042775.db2.gz	HWKBFRDCOHXWKP-FZMZJTMJSA-N	1	1	304.350	1.778	20	5		DDBDMO
C[N@@H+](CCc1ccccc1O)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000344230936	411043596	/nfs/dbraw/zinc/04/35/96/411043596.db2.gz	YYCHRQHRAPDORL-CQSZACIVSA-N	1	1	320.349	1.032	20	5		DDBDMO
Nc1nccc(C(=O)NCc2c[nH+]c3n2CCCC3)c1[N+](=O)[O-]	ZINC000515070301	416691023	/nfs/dbraw/zinc/69/10/23/416691023.db2.gz	DQBHILQZSGIMET-UHFFFAOYSA-N	1	1	316.321	1.035	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC[N@H+](C3CCOCC3)CC2)n1	ZINC000366220286	418444946	/nfs/dbraw/zinc/44/49/46/418444946.db2.gz	UKQBGVMVAOBKFG-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
O=C(CCN1CC[C@@]2(CC[NH2+]C2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000360535656	418458335	/nfs/dbraw/zinc/45/83/35/418458335.db2.gz	QPKGCKMRQVLDPG-MRXNPFEDSA-N	1	1	318.377	1.609	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360937554	418550724	/nfs/dbraw/zinc/55/07/24/418550724.db2.gz	LPROCLPFMDMKRS-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360937554	418550727	/nfs/dbraw/zinc/55/07/27/418550727.db2.gz	LPROCLPFMDMKRS-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)NCC2=CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000360947972	418552651	/nfs/dbraw/zinc/55/26/51/418552651.db2.gz	YVPOPTRTGSFHNP-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
COCCO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000189726061	222053319	/nfs/dbraw/zinc/05/33/19/222053319.db2.gz	VAJMSNPBWLGNAJ-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000189726061	222053321	/nfs/dbraw/zinc/05/33/21/222053321.db2.gz	VAJMSNPBWLGNAJ-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H](C)OC	ZINC000291302893	222298621	/nfs/dbraw/zinc/29/86/21/222298621.db2.gz	SFLRKVBFFHHDFR-LBPRGKRZSA-N	1	1	309.366	1.914	20	5		DDBDMO
CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H](C)OC	ZINC000291302893	222298624	/nfs/dbraw/zinc/29/86/24/222298624.db2.gz	SFLRKVBFFHHDFR-LBPRGKRZSA-N	1	1	309.366	1.914	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CC(O)(C2CC2)C1	ZINC000375471765	418644668	/nfs/dbraw/zinc/64/46/68/418644668.db2.gz	UWDSSRWSVFXPKR-UHFFFAOYSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000371544166	418799862	/nfs/dbraw/zinc/79/98/62/418799862.db2.gz	DPLVYQAWWQXUDN-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@H]3C2)c2ccncc21	ZINC000364879248	418820971	/nfs/dbraw/zinc/82/09/71/418820971.db2.gz	CTEODIXXLXKUGK-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@H]3C2)c2ccncc21	ZINC000364879248	418820973	/nfs/dbraw/zinc/82/09/73/418820973.db2.gz	CTEODIXXLXKUGK-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](O)C3(CC3)C2)c([N+](=O)[O-])c1	ZINC000372300008	418852608	/nfs/dbraw/zinc/85/26/08/418852608.db2.gz	FUKUICNZNQNVDF-AWEZNQCLSA-N	1	1	308.334	1.439	20	5		DDBDMO
CC1(C)C(=O)NCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411274485	418887384	/nfs/dbraw/zinc/88/73/84/418887384.db2.gz	DKCSINHRDIEJAE-UHFFFAOYSA-N	1	1	320.349	1.134	20	5		DDBDMO
CC1(C)C(=O)NCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411274485	418887386	/nfs/dbraw/zinc/88/73/86/418887386.db2.gz	DKCSINHRDIEJAE-UHFFFAOYSA-N	1	1	320.349	1.134	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000372721317	418894621	/nfs/dbraw/zinc/89/46/21/418894621.db2.gz	CVHRRJULWGBCJU-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000372733277	418896893	/nfs/dbraw/zinc/89/68/93/418896893.db2.gz	WIKCEHODRVPCBF-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC(C)[C@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000365848164	418916386	/nfs/dbraw/zinc/91/63/86/418916386.db2.gz	NEPIMNLHQQSWBZ-LBPRGKRZSA-N	1	1	323.397	1.589	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000426240299	419416273	/nfs/dbraw/zinc/41/62/73/419416273.db2.gz	TZPCOTOLOVBEIR-NSHDSACASA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000426240299	419416284	/nfs/dbraw/zinc/41/62/84/419416284.db2.gz	TZPCOTOLOVBEIR-NSHDSACASA-N	1	1	323.349	1.389	20	5		DDBDMO
CC[C@H]1C[NH+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](CC)O1	ZINC000420945688	419376740	/nfs/dbraw/zinc/37/67/40/419376740.db2.gz	BFVXQEIQXYDMNX-KBPBESRZSA-N	1	1	309.366	1.646	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)n1	ZINC000411948337	419513497	/nfs/dbraw/zinc/51/34/97/419513497.db2.gz	PQNWEPGZLRNRRD-KGLIPLIRSA-N	1	1	302.334	1.599	20	5		DDBDMO
C[C@H](O)[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103856	419663732	/nfs/dbraw/zinc/66/37/32/419663732.db2.gz	ZKUCPNWBEXUSAX-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H](O)[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103856	419663742	/nfs/dbraw/zinc/66/37/42/419663742.db2.gz	ZKUCPNWBEXUSAX-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000421710851	419698011	/nfs/dbraw/zinc/69/80/11/419698011.db2.gz	MPYIWBCGLGVTPM-LLVKDONJSA-N	1	1	321.333	1.490	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2c([N+](=O)[O-])ncn2C)CC1	ZINC000428265647	419839053	/nfs/dbraw/zinc/83/90/53/419839053.db2.gz	IZRTUONEXHTYIG-UHFFFAOYSA-N	1	1	305.342	1.143	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[NH+](C2CC2)CC1	ZINC000299311653	229043624	/nfs/dbraw/zinc/04/36/24/229043624.db2.gz	FCAOKCGBVBTZEP-UHFFFAOYSA-N	1	1	318.377	1.622	20	5		DDBDMO
O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[NH+](C2CC2)CC1	ZINC000299376490	229084098	/nfs/dbraw/zinc/08/40/98/229084098.db2.gz	SRYQZMVNYPDCGO-UHFFFAOYSA-N	1	1	314.345	1.996	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000423444712	420052202	/nfs/dbraw/zinc/05/22/02/420052202.db2.gz	XCPRIMBVHOWPPH-JWFUOXDNSA-N	1	1	304.350	1.119	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1	ZINC000423615275	420100803	/nfs/dbraw/zinc/10/08/03/420100803.db2.gz	QVQURURRFWJAKK-GFCCVEGCSA-N	1	1	319.296	1.244	20	5		DDBDMO
CC1(C)C[C@@H](NC[C@@H]2C[NH2+]CCO2)c2cc([N+](=O)[O-])ccc21	ZINC000423580175	420087213	/nfs/dbraw/zinc/08/72/13/420087213.db2.gz	XHTIRRHKOZJKPL-SWLSCSKDSA-N	1	1	305.378	1.895	20	5		DDBDMO
C[NH2+]C[C@@H]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000430641446	420167795	/nfs/dbraw/zinc/16/77/95/420167795.db2.gz	TVZAUVRXCKMVEW-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
CCc1nn(C)c(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1[N+](=O)[O-]	ZINC000450792102	420532818	/nfs/dbraw/zinc/53/28/18/420532818.db2.gz	NLQNDLJCZXBWCS-PHIMTYICSA-N	1	1	309.370	1.166	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCCC2(C)C)c1[N+](=O)[O-]	ZINC000457083095	420605465	/nfs/dbraw/zinc/60/54/65/420605465.db2.gz	XEIFQYWQWREILM-UHFFFAOYSA-N	1	1	323.397	1.875	20	5		DDBDMO
C[N@@H+]1CCN(CCNCc2ccc([N+](=O)[O-])cc2F)CC1(C)C	ZINC000441372715	420649119	/nfs/dbraw/zinc/64/91/19/420649119.db2.gz	QCDOUNCIXLIWJZ-UHFFFAOYSA-N	1	1	324.400	1.850	20	5		DDBDMO
C[N@H+]1CCN(CCNCc2ccc([N+](=O)[O-])cc2F)CC1(C)C	ZINC000441372715	420649123	/nfs/dbraw/zinc/64/91/23/420649123.db2.gz	QCDOUNCIXLIWJZ-UHFFFAOYSA-N	1	1	324.400	1.850	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1C(C)C	ZINC000453041971	420706195	/nfs/dbraw/zinc/70/61/95/420706195.db2.gz	SBRBRONHRZNGNX-SOUVJXGZSA-N	1	1	310.398	1.765	20	5		DDBDMO
CCOc1cc(C[NH+]2C[C@H](OC)[C@@H](OC)C2)ccc1[N+](=O)[O-]	ZINC000493703036	420919230	/nfs/dbraw/zinc/91/92/30/420919230.db2.gz	BQMYTUPANALLHT-GJZGRUSLSA-N	1	1	310.350	1.839	20	5		DDBDMO
Cc1ccc(CN2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000449536561	421023104	/nfs/dbraw/zinc/02/31/04/421023104.db2.gz	FIYBLCIYHJZZQZ-OKILXGFUSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000449536578	421023524	/nfs/dbraw/zinc/02/35/24/421023524.db2.gz	FMDMPXJEPMOXPD-GWJAVYCQSA-N	1	1	319.405	1.995	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000449748069	421074645	/nfs/dbraw/zinc/07/46/45/421074645.db2.gz	ZFZKYBKTALZAMF-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000449748069	421074648	/nfs/dbraw/zinc/07/46/48/421074648.db2.gz	ZFZKYBKTALZAMF-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000456353017	421147353	/nfs/dbraw/zinc/14/73/53/421147353.db2.gz	NVXFOGHGEVNDLU-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000524590598	421262962	/nfs/dbraw/zinc/26/29/62/421262962.db2.gz	MERNYVKTGRQZOY-LBPRGKRZSA-N	1	1	306.366	1.830	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](CC(C)(C)O)C[C@H]2C)n1	ZINC000548036721	421392053	/nfs/dbraw/zinc/39/20/53/421392053.db2.gz	ASZNBFDRFLEBTO-CYBMUJFWSA-N	1	1	322.409	1.888	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C(C)C)C1	ZINC000522167988	421817806	/nfs/dbraw/zinc/81/78/06/421817806.db2.gz	QVUZWHFGTSRPCU-LBPRGKRZSA-N	1	1	306.366	1.758	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2ccncc2)C1	ZINC000581139311	421909257	/nfs/dbraw/zinc/90/92/57/421909257.db2.gz	ARDKMDVHDBZFPA-CQSZACIVSA-N	1	1	314.345	1.641	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](c3ccnc(N)n3)C2)c1[N+](=O)[O-]	ZINC000595461060	422356728	/nfs/dbraw/zinc/35/67/28/422356728.db2.gz	LGJONEBMITWOHM-JTQLQIEISA-N	1	1	318.337	1.643	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](c3ccnc(N)n3)C2)c1[N+](=O)[O-]	ZINC000595461060	422356731	/nfs/dbraw/zinc/35/67/31/422356731.db2.gz	LGJONEBMITWOHM-JTQLQIEISA-N	1	1	318.337	1.643	20	5		DDBDMO
COc1ccc(CNc2cc(CO)cc(C)[nH+]2)cc1[N+](=O)[O-]	ZINC000596085397	422362247	/nfs/dbraw/zinc/36/22/47/422362247.db2.gz	WJJPZRQQCFEVHY-UHFFFAOYSA-N	1	1	303.318	2.411	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CC[N@H+]3C3CCCC3)nn21	ZINC000599164059	422402266	/nfs/dbraw/zinc/40/22/66/422402266.db2.gz	IUZFWPGKDPPXFG-LBPRGKRZSA-N	1	1	316.365	2.066	20	5		DDBDMO
Cn1c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)ccc1[N+](=O)[O-]	ZINC000344620095	272071581	/nfs/dbraw/zinc/07/15/81/272071581.db2.gz	RKVRLWARCYTRCK-LBPRGKRZSA-N	1	1	308.382	1.784	20	5		DDBDMO
CCOc1cc(N2CCC[N@H+]([C@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000345044510	272162587	/nfs/dbraw/zinc/16/25/87/272162587.db2.gz	QCRSMDNZSQHBJY-CYBMUJFWSA-N	1	1	323.393	1.886	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CCC[N@H+]1C	ZINC000345321780	272218914	/nfs/dbraw/zinc/21/89/14/272218914.db2.gz	OUQYRXIADAGGPE-GZMMTYOYSA-N	1	1	310.329	1.529	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000345971485	272379646	/nfs/dbraw/zinc/37/96/46/272379646.db2.gz	VEPSMEUYDGFAGB-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@]3(CC[N@@H+](C)C3)C2)c1	ZINC000323802948	274004781	/nfs/dbraw/zinc/00/47/81/274004781.db2.gz	GZXBTGRBYMLOCY-INIZCTEOSA-N	1	1	319.361	1.913	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)[C@H]2C1	ZINC000272188278	277146838	/nfs/dbraw/zinc/14/68/38/277146838.db2.gz	LOSVBPJDZDEBNU-SKDRFNHKSA-N	1	1	303.322	1.661	20	5		DDBDMO
COC(=O)C1(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000450557136	277308509	/nfs/dbraw/zinc/30/85/09/277308509.db2.gz	BMMNJAXMSMMXJE-LLVKDONJSA-N	1	1	320.349	1.429	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)c([N+](=O)[O-])c1	ZINC000123968393	281181453	/nfs/dbraw/zinc/18/14/53/281181453.db2.gz	CGFLHCXKGLMGIW-GHMZBOCLSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cc1cc(NC(=O)CCn2cc([N+](=O)[O-])cn2)cn2cc[nH+]c12	ZINC000355401586	298730298	/nfs/dbraw/zinc/73/02/98/298730298.db2.gz	KIOJEKYRGGVTCO-UHFFFAOYSA-N	1	1	314.305	1.776	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)cc1[N+](=O)[O-]	ZINC000362287203	300044349	/nfs/dbraw/zinc/04/43/49/300044349.db2.gz	OKAYVEIMXGJVHB-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCOCC1	ZINC000363379591	300259763	/nfs/dbraw/zinc/25/97/63/300259763.db2.gz	SSHFBAQHLOAEGJ-UHFFFAOYSA-N	1	1	323.349	1.654	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2cccs2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000368804894	301090347	/nfs/dbraw/zinc/09/03/47/301090347.db2.gz	JTJXZFHMJMFIFD-QWHCGFSZSA-N	1	1	309.391	1.494	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccncc2)CC1	ZINC000368818424	301092414	/nfs/dbraw/zinc/09/24/14/301092414.db2.gz	UIKMNBHQDOIQGO-CABCVRRESA-N	1	1	318.377	1.170	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)CC12CC2	ZINC000369007169	301118225	/nfs/dbraw/zinc/11/82/25/301118225.db2.gz	GRHCOKNDLRSWQB-AAEUAGOBSA-N	1	1	320.349	1.524	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)C1	ZINC000369212342	301146348	/nfs/dbraw/zinc/14/63/48/301146348.db2.gz	DBYCYRXNNFDKPX-CQSZACIVSA-N	1	1	319.409	1.393	20	5		DDBDMO
CCn1nccc1C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000369408872	301182849	/nfs/dbraw/zinc/18/28/49/301182849.db2.gz	QUKKGZSDUKXKTB-UHFFFAOYSA-N	1	1	318.381	1.924	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2CC[N@@H+](C)[C@H]2C1	ZINC000370445624	301340871	/nfs/dbraw/zinc/34/08/71/301340871.db2.gz	WHMUTWSFPFXMPS-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1	ZINC000377767452	302229368	/nfs/dbraw/zinc/22/93/68/302229368.db2.gz	MWILFINXCYXDFK-KBPBESRZSA-N	1	1	306.366	1.825	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532143602	303277228	/nfs/dbraw/zinc/27/72/28/303277228.db2.gz	OGTGLKPBWZWONW-LBPRGKRZSA-N	1	1	306.366	1.984	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000538709536	303389278	/nfs/dbraw/zinc/38/92/78/303389278.db2.gz	LQYMPADZIKMSRL-SNVBAGLBSA-N	1	1	321.333	1.395	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000362068724	307012663	/nfs/dbraw/zinc/01/26/63/307012663.db2.gz	CPMRGUWYRXHPAV-NWDGAFQWSA-N	1	1	307.350	1.118	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000373767356	307194774	/nfs/dbraw/zinc/19/47/74/307194774.db2.gz	BQBBDLPINAPTCP-CQSZACIVSA-N	1	1	307.350	1.120	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCN2CCOC[C@H]2C1	ZINC000373767356	307194775	/nfs/dbraw/zinc/19/47/75/307194775.db2.gz	BQBBDLPINAPTCP-CQSZACIVSA-N	1	1	307.350	1.120	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000373813342	307195779	/nfs/dbraw/zinc/19/57/79/307195779.db2.gz	SXVINOZPVPJYNI-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000373813342	307195780	/nfs/dbraw/zinc/19/57/80/307195780.db2.gz	SXVINOZPVPJYNI-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000564782569	308005701	/nfs/dbraw/zinc/00/57/01/308005701.db2.gz	FPOHQTMVHGVUKZ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000564782569	308005703	/nfs/dbraw/zinc/00/57/03/308005703.db2.gz	FPOHQTMVHGVUKZ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000577510022	308394334	/nfs/dbraw/zinc/39/43/34/308394334.db2.gz	JETKHYBZRYOOJO-OAHLLOKOSA-N	1	1	304.350	1.771	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1	ZINC000577510021	308394432	/nfs/dbraw/zinc/39/44/32/308394432.db2.gz	JETKHYBZRYOOJO-HNNXBMFYSA-N	1	1	304.350	1.771	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ncccn2)n1	ZINC000580661004	308621859	/nfs/dbraw/zinc/62/18/59/308621859.db2.gz	ZPSQVWMXBWWMEI-VXGBXAGGSA-N	1	1	302.338	1.855	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000452055516	534189771	/nfs/dbraw/zinc/18/97/71/534189771.db2.gz	UMDLCUOOHJWRKQ-XVLPMQGWSA-N	1	1	320.393	1.520	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)c1ccccc1[N+](=O)[O-]	ZINC000452347342	534571842	/nfs/dbraw/zinc/57/18/42/534571842.db2.gz	IJRNFIFWSIMFQX-LBPRGKRZSA-N	1	1	307.350	1.171	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000491423263	534773408	/nfs/dbraw/zinc/77/34/08/534773408.db2.gz	YZIBXOKVDJNITI-VOTSOKGWSA-N	1	1	300.318	1.929	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000330890008	528548927	/nfs/dbraw/zinc/54/89/27/528548927.db2.gz	BPXYYFSFWDHXDO-ZJUUUORDSA-N	1	1	309.370	1.483	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736452660	598772775	/nfs/dbraw/zinc/77/27/75/598772775.db2.gz	HGDOKONSCNPOHP-UHFFFAOYSA-N	1	1	319.369	1.919	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000824992259	608554886	/nfs/dbraw/zinc/55/48/86/608554886.db2.gz	LDGWTFLUANGXPZ-UWVGGRQHSA-N	1	1	317.353	1.304	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000797525086	700013282	/nfs/dbraw/zinc/01/32/82/700013282.db2.gz	AKODOWSXMQAENN-UKRRQHHQSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000119739559	696684859	/nfs/dbraw/zinc/68/48/59/696684859.db2.gz	ITVIGVXZEHJRRF-VIFPVBQESA-N	1	1	319.408	1.276	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000776582113	698121184	/nfs/dbraw/zinc/12/11/84/698121184.db2.gz	QNUIPDIIELLOCW-ABAIWWIYSA-N	1	1	322.361	1.902	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCSC[C@@H]2CCO)cc1	ZINC000776585905	698122173	/nfs/dbraw/zinc/12/21/73/698122173.db2.gz	CTBGIDVLTUBFEA-UONOGXRCSA-N	1	1	312.391	1.428	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776588826	698123191	/nfs/dbraw/zinc/12/31/91/698123191.db2.gz	CFHPUYIXBYEGLS-CJNGLKHVSA-N	1	1	307.394	1.902	20	5		DDBDMO
C[NH+]1CCN(C(=O)CNc2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000788071347	699273693	/nfs/dbraw/zinc/27/36/93/699273693.db2.gz	CMMOHTWOLWKHMQ-UHFFFAOYSA-N	1	1	312.757	1.434	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@](C)(C(N)=O)C2)c2ccc([N+](=O)[O-])cc12	ZINC000794704604	699825309	/nfs/dbraw/zinc/82/53/09/699825309.db2.gz	LIXCPBCAXGZWNK-HNNXBMFYSA-N	1	1	317.349	1.408	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000741720103	699848966	/nfs/dbraw/zinc/84/89/66/699848966.db2.gz	DZIJVNBNCURBSR-KOLCDFICSA-N	1	1	322.321	1.716	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000795674533	699883403	/nfs/dbraw/zinc/88/34/03/699883403.db2.gz	KNEMETHUEQYUFK-OKILXGFUSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000795674533	699883405	/nfs/dbraw/zinc/88/34/05/699883405.db2.gz	KNEMETHUEQYUFK-OKILXGFUSA-N	1	1	317.349	1.920	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000751947721	700329022	/nfs/dbraw/zinc/32/90/22/700329022.db2.gz	UULXJUBGHWDPRT-NSHDSACASA-N	1	1	305.338	1.716	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000751952094	700329803	/nfs/dbraw/zinc/32/98/03/700329803.db2.gz	VIDYXYAQIVPXOG-ZDUSSCGKSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000751952094	700329808	/nfs/dbraw/zinc/32/98/08/700329808.db2.gz	VIDYXYAQIVPXOG-ZDUSSCGKSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801936493	700357720	/nfs/dbraw/zinc/35/77/20/700357720.db2.gz	UQLUYMBZWILDMA-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801936493	700357721	/nfs/dbraw/zinc/35/77/21/700357721.db2.gz	UQLUYMBZWILDMA-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@@H+]1C	ZINC000761078338	700840556	/nfs/dbraw/zinc/84/05/56/700840556.db2.gz	BOPKJHNCSHYIBW-WFASDCNBSA-N	1	1	318.377	1.336	20	5		DDBDMO
C[C@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+]1C	ZINC000761078338	700840558	/nfs/dbraw/zinc/84/05/58/700840558.db2.gz	BOPKJHNCSHYIBW-WFASDCNBSA-N	1	1	318.377	1.336	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O	ZINC000768770142	701201517	/nfs/dbraw/zinc/20/15/17/701201517.db2.gz	SEHCUZDMDSHCMF-QPUJVOFHSA-N	1	1	313.741	1.499	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1O	ZINC000768770142	701201520	/nfs/dbraw/zinc/20/15/20/701201520.db2.gz	SEHCUZDMDSHCMF-QPUJVOFHSA-N	1	1	313.741	1.499	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H](C)CN1CC[NH+](C)CC1	ZINC000807967119	701492556	/nfs/dbraw/zinc/49/25/56/701492556.db2.gz	NPBHWMOWSOKHGF-GFCCVEGCSA-N	1	1	320.393	1.845	20	5		DDBDMO
C[C@H]1C[C@@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000810376719	701761832	/nfs/dbraw/zinc/76/18/32/701761832.db2.gz	QKUMTPHZZBGCKB-STQMWFEESA-N	1	1	321.377	1.820	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000866073873	706611279	/nfs/dbraw/zinc/61/12/79/706611279.db2.gz	UVXIRYYAJSZOAI-ZYHUDNBSSA-N	1	1	309.341	1.875	20	5		DDBDMO
CSc1ccc([C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+](C)C)cc1	ZINC000839780912	701824353	/nfs/dbraw/zinc/82/43/53/701824353.db2.gz	YOHPHKROOHPNDY-MGPQQGTHSA-N	1	1	323.418	1.793	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1C[C@H]2[C@@H](C1)C2(F)F)c1cccc([N+](=O)[O-])c1	ZINC000867984238	701873537	/nfs/dbraw/zinc/87/35/37/701873537.db2.gz	VRRUOGLSPADKJQ-LOWVWBTDSA-N	1	1	311.288	1.492	20	5		DDBDMO
CC(C)(C[C@@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])C1)C(N)=O	ZINC000840110814	701973800	/nfs/dbraw/zinc/97/38/00/701973800.db2.gz	ULCUXEBFKFGTNY-NSHDSACASA-N	1	1	309.370	1.362	20	5		DDBDMO
CC(C)(C[C@@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])C1)C(N)=O	ZINC000840110814	701973803	/nfs/dbraw/zinc/97/38/03/701973803.db2.gz	ULCUXEBFKFGTNY-NSHDSACASA-N	1	1	309.370	1.362	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])c4nonc43)CC[C@@H]21	ZINC000866207003	706648717	/nfs/dbraw/zinc/64/87/17/706648717.db2.gz	NUVVZLLYSJTWOX-UWVGGRQHSA-N	1	1	303.322	1.661	20	5		DDBDMO
COC(=O)Cc1ccc(N(C)C[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000817131927	702281545	/nfs/dbraw/zinc/28/15/45/702281545.db2.gz	VRBFMCINBWHEHF-ZDUSSCGKSA-N	1	1	321.377	1.841	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H]1C	ZINC000843309588	702857893	/nfs/dbraw/zinc/85/78/93/702857893.db2.gz	FMUKCKUIYAQQNV-TXEJJXNPSA-N	1	1	324.381	1.115	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H]1C	ZINC000843309588	702857895	/nfs/dbraw/zinc/85/78/95/702857895.db2.gz	FMUKCKUIYAQQNV-TXEJJXNPSA-N	1	1	324.381	1.115	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000879561543	706718359	/nfs/dbraw/zinc/71/83/59/706718359.db2.gz	QFXBGHGIWHEHGK-STQMWFEESA-N	1	1	321.402	1.879	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000879577505	706724954	/nfs/dbraw/zinc/72/49/54/706724954.db2.gz	JRKSOZRIZFNERO-KBMXLJTQSA-N	1	1	305.378	1.654	20	5		DDBDMO
CC1(C)OC[C@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)O1	ZINC000851717438	703836014	/nfs/dbraw/zinc/83/60/14/703836014.db2.gz	SFQASUDJUYKCRA-ZDUSSCGKSA-N	1	1	322.365	1.263	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000818963293	704035900	/nfs/dbraw/zinc/03/59/00/704035900.db2.gz	NTSXJOWQFLYJAS-IIAWOOMASA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCc3cn[nH]c3C2)cc1	ZINC000819154240	704077708	/nfs/dbraw/zinc/07/77/08/704077708.db2.gz	GCTPNVCFSNXMEI-IUODEOHRSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2nnc(C3CC3)[nH]2)cc1	ZINC000819342253	704110668	/nfs/dbraw/zinc/11/06/68/704110668.db2.gz	YNPDBGLEUMGIMM-LBPRGKRZSA-N	1	1	303.322	1.414	20	5		DDBDMO
CCc1nc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])co1	ZINC000819357660	704112674	/nfs/dbraw/zinc/11/26/74/704112674.db2.gz	URTXGBIYNDZPHM-LBPRGKRZSA-N	1	1	321.333	1.675	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000870874381	704153342	/nfs/dbraw/zinc/15/33/42/704153342.db2.gz	IVGVBGLNBOHXBP-BZNIZROVSA-N	1	1	321.377	1.795	20	5		DDBDMO
CO[C@@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870880779	704155320	/nfs/dbraw/zinc/15/53/20/704155320.db2.gz	ONDRRDOGHYQEBH-HIFRSBDPSA-N	1	1	307.350	1.406	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1	ZINC000822152028	704885825	/nfs/dbraw/zinc/88/58/25/704885825.db2.gz	QIGUGQPYYPCXJF-LBPRGKRZSA-N	1	1	309.370	1.041	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000874836914	705193856	/nfs/dbraw/zinc/19/38/56/705193856.db2.gz	IDKKXSPBGAGTDT-NEPJUHHUSA-N	1	1	304.350	1.486	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000823468831	705249606	/nfs/dbraw/zinc/24/96/06/705249606.db2.gz	LIBKLMXKOFIXLQ-CABCVRRESA-N	1	1	317.349	1.557	20	5		DDBDMO
Cc1ccc(CNC(=O)N2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000876172234	705647645	/nfs/dbraw/zinc/64/76/45/705647645.db2.gz	UFOGMUULNRTBRA-UHFFFAOYSA-N	1	1	318.377	1.893	20	5		DDBDMO
CCOC(=O)[C@@H](F)C1C[NH+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000877549307	706139067	/nfs/dbraw/zinc/13/90/67/706139067.db2.gz	BOAZXPXFDZHEPW-AWEZNQCLSA-N	1	1	310.325	1.970	20	5		DDBDMO
CO[C@H]1C[C@@H](C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000878251476	706338741	/nfs/dbraw/zinc/33/87/41/706338741.db2.gz	MZYFDUJSHNFIDQ-BZPMIXESSA-N	1	1	306.366	1.901	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000837184905	707592907	/nfs/dbraw/zinc/59/29/07/707592907.db2.gz	PBXCTGNZFLQMPV-GFCCVEGCSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000882481756	707652534	/nfs/dbraw/zinc/65/25/34/707652534.db2.gz	VDJLNOMYXMXTBE-NSHDSACASA-N	1	1	309.391	1.897	20	5		DDBDMO
Cc1ccc(CN[C@@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1[N+](=O)[O-]	ZINC000873251846	707786052	/nfs/dbraw/zinc/78/60/52/707786052.db2.gz	LVJODEQCTFBPRN-CVEARBPZSA-N	1	1	305.378	1.760	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000838137347	707851318	/nfs/dbraw/zinc/85/13/18/707851318.db2.gz	QOWQCNNLWYXGAI-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000882959937	707873511	/nfs/dbraw/zinc/87/35/11/707873511.db2.gz	UNGAMZIXRLKQSB-JTQLQIEISA-N	1	1	308.338	1.591	20	5		DDBDMO
COc1cc(N2CCN(C)CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000897097191	708229349	/nfs/dbraw/zinc/22/93/49/708229349.db2.gz	KQINLHADHSJTLH-UHFFFAOYSA-N	1	1	308.382	1.287	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c1	ZINC000897218130	708256561	/nfs/dbraw/zinc/25/65/61/708256561.db2.gz	BCLCBHKBTOAKAM-KGLIPLIRSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=C(N1CCc2c(cccc2[N+](=O)[O-])C1)[C@@]12CC[N@@H+](C1)CCC2	ZINC000897232680	708263605	/nfs/dbraw/zinc/26/36/05/708263605.db2.gz	RKVHSNSEAJNINK-KRWDZBQOSA-N	1	1	315.373	1.965	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCCO3)C2)c([N+](=O)[O-])c1	ZINC000886827924	708855165	/nfs/dbraw/zinc/85/51/65/708855165.db2.gz	UFWDTHKRSMIRMS-UKRRQHHQSA-N	1	1	319.361	1.695	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1	ZINC000887937601	709172371	/nfs/dbraw/zinc/17/23/71/709172371.db2.gz	BNANQBUIQZYBCG-ABAIWWIYSA-N	1	1	304.350	1.322	20	5		DDBDMO
CC(C)c1ccc(C(=O)NCC[N@@H+](C)CCO)cc1[N+](=O)[O-]	ZINC000899737171	709184058	/nfs/dbraw/zinc/18/40/58/709184058.db2.gz	BHTQKFYBIOJJNV-UHFFFAOYSA-N	1	1	309.366	1.372	20	5		DDBDMO
C[C@@H](NC(=O)C[C@]1(O)CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000900267395	709512633	/nfs/dbraw/zinc/51/26/33/709512633.db2.gz	FHEOPOIWAPHJJS-MLGOLLRUSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C	ZINC000928439691	713196299	/nfs/dbraw/zinc/19/62/99/713196299.db2.gz	JVQKRKDKVNHQOG-KOLCDFICSA-N	1	1	302.334	1.899	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000893872083	710867687	/nfs/dbraw/zinc/86/76/87/710867687.db2.gz	ONWPJBKXHDNZDG-SECBINFHSA-N	1	1	307.306	1.148	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CC([C@H]3CCOC3)C2)c1[N+](=O)[O-]	ZINC000894149763	710986989	/nfs/dbraw/zinc/98/69/89/710986989.db2.gz	VHWDAGYRFWGOJJ-NSHDSACASA-N	1	1	308.334	1.777	20	5		DDBDMO
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+]1C	ZINC000928560788	713227158	/nfs/dbraw/zinc/22/71/58/713227158.db2.gz	VLOUWVGMLIPRFL-DZGCQCFKSA-N	1	1	305.378	1.984	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CC[C@@H](n3cccn3)C2)c1[N+](=O)[O-]	ZINC000894569436	711185601	/nfs/dbraw/zinc/18/56/01/711185601.db2.gz	VMEJAVXLURQNLX-GFCCVEGCSA-N	1	1	318.333	1.953	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](n3cccn3)C2)c1[N+](=O)[O-]	ZINC000894569436	711185604	/nfs/dbraw/zinc/18/56/04/711185604.db2.gz	VMEJAVXLURQNLX-GFCCVEGCSA-N	1	1	318.333	1.953	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](CCCO)C2)c1[N+](=O)[O-]	ZINC000894797601	711275067	/nfs/dbraw/zinc/27/50/67/711275067.db2.gz	NTLHPZWDZXLSGK-LLVKDONJSA-N	1	1	310.350	1.903	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@@H]1CO	ZINC000894887643	711309193	/nfs/dbraw/zinc/30/91/93/711309193.db2.gz	HPTMYPZNQHIIDG-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@@H]1C(C)(C)C	ZINC000895100668	711411367	/nfs/dbraw/zinc/41/13/67/711411367.db2.gz	DTFOISQZPBLHFQ-CQSZACIVSA-N	1	1	320.393	1.860	20	5		DDBDMO
COC(=O)/C=C/c1ccc(NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895777740	711603988	/nfs/dbraw/zinc/60/39/88/711603988.db2.gz	WVGVSDPGOHAWBY-FVOPLDGLSA-N	1	1	305.334	1.897	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000896581025	711758302	/nfs/dbraw/zinc/75/83/02/711758302.db2.gz	FUJHYOMQCJFABI-JSGCOSHPSA-N	1	1	320.393	1.267	20	5		DDBDMO
COC(=O)/C=C(\C)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989013	713730049	/nfs/dbraw/zinc/73/00/49/713730049.db2.gz	POUJFPYDXUQZKY-VNKGSWCUSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C=C(\C)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989013	713730052	/nfs/dbraw/zinc/73/00/52/713730052.db2.gz	POUJFPYDXUQZKY-VNKGSWCUSA-N	1	1	320.349	1.595	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1	ZINC000930875224	713947474	/nfs/dbraw/zinc/94/74/74/713947474.db2.gz	LMBKRLRZBVXPQV-LBPRGKRZSA-N	1	1	321.381	1.667	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2	ZINC000931196829	714031982	/nfs/dbraw/zinc/03/19/82/714031982.db2.gz	KYZILTNZENBKHQ-UHFFFAOYSA-N	1	1	318.333	1.471	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000931312891	714063212	/nfs/dbraw/zinc/06/32/12/714063212.db2.gz	WBTCMOFXOMQMMW-YESZJQIVSA-N	1	1	319.405	1.902	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C2OCCO2)C1	ZINC000932000209	714229296	/nfs/dbraw/zinc/22/92/96/714229296.db2.gz	AMOUFJXVZRMOCT-LBPRGKRZSA-N	1	1	308.334	1.798	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000933170677	714526616	/nfs/dbraw/zinc/52/66/16/714526616.db2.gz	KNCKQGHXJQPFLT-KYOSRNDESA-N	1	1	322.361	1.902	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933967801	714710645	/nfs/dbraw/zinc/71/06/45/714710645.db2.gz	PMSBHPRTTJUNQF-RRFJBIMHSA-N	1	1	308.334	1.118	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933967801	714710648	/nfs/dbraw/zinc/71/06/48/714710648.db2.gz	PMSBHPRTTJUNQF-RRFJBIMHSA-N	1	1	308.334	1.118	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122785	714748863	/nfs/dbraw/zinc/74/88/63/714748863.db2.gz	WOIFGXQCGSYYQT-ZIAGYGMSSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122785	714748866	/nfs/dbraw/zinc/74/88/66/714748866.db2.gz	WOIFGXQCGSYYQT-ZIAGYGMSSA-N	1	1	307.350	1.951	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000936059006	715146742	/nfs/dbraw/zinc/14/67/42/715146742.db2.gz	KFULLBDQFWEJMB-NSHDSACASA-N	1	1	311.386	1.336	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000611712216	719389432	/nfs/dbraw/zinc/38/94/32/719389432.db2.gz	XZWBNTJGLXWLND-KBPBESRZSA-N	1	1	315.333	1.057	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001120959083	782257499	/nfs/dbraw/zinc/25/74/99/782257499.db2.gz	FLZNAZYKKRXQIA-AAEUAGOBSA-N	1	1	308.382	1.650	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1nc(-c2ccccc2)ccc1[N+](=O)[O-]	ZINC001167351560	733273743	/nfs/dbraw/zinc/27/37/43/733273743.db2.gz	UPFCJEAQJWQWSJ-UHFFFAOYSA-N	1	1	322.328	1.781	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(CF)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022064142	734369170	/nfs/dbraw/zinc/36/91/70/734369170.db2.gz	YFFFSJWZLSEVGQ-LXTVHRRPSA-N	1	1	321.352	1.558	20	5		DDBDMO
COCCC(=O)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001194621732	746427771	/nfs/dbraw/zinc/42/77/71/746427771.db2.gz	DKTNDMWUTAZHNV-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
COCCC(=O)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001194621732	746427776	/nfs/dbraw/zinc/42/77/76/746427776.db2.gz	DKTNDMWUTAZHNV-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
CCOCC(=O)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001194725347	746450129	/nfs/dbraw/zinc/45/01/29/746450129.db2.gz	DBYXJSRNHSLAEJ-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
CCOCC(=O)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001194725347	746450131	/nfs/dbraw/zinc/45/01/31/746450131.db2.gz	DBYXJSRNHSLAEJ-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCN(C)c1ncccc1[N+](=O)[O-]	ZINC001095625192	750093104	/nfs/dbraw/zinc/09/31/04/750093104.db2.gz	CGJFAMHBQFBCOR-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
COC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023990	762202194	/nfs/dbraw/zinc/20/21/94/762202194.db2.gz	WLVSQIZRNPORGQ-RWMBFGLXSA-N	1	1	308.382	1.411	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023990	762202197	/nfs/dbraw/zinc/20/21/97/762202197.db2.gz	WLVSQIZRNPORGQ-RWMBFGLXSA-N	1	1	308.382	1.411	20	5		DDBDMO
CC(C)C[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC001000148612	761541853	/nfs/dbraw/zinc/54/18/53/761541853.db2.gz	HHXCHXMFZCVLMP-ZIAGYGMSSA-N	1	1	309.410	1.668	20	5		DDBDMO
COc1ccc(C[C@H](C)N2CC[N@H+]3CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC001170355644	766261903	/nfs/dbraw/zinc/26/19/03/766261903.db2.gz	NNVKFSAQQBSHDU-JSGCOSHPSA-N	1	1	305.378	1.924	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cnc(N)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC001147741599	773227602	/nfs/dbraw/zinc/22/76/02/773227602.db2.gz	GEKCQQIFFCEZMA-JQWIXIFHSA-N	1	1	321.381	1.517	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@@H](C)n2cnc(C[NH3+])n2)c1F	ZINC001173188168	777036371	/nfs/dbraw/zinc/03/63/71/777036371.db2.gz	IUIUVAMUIXUALE-MRVPVSSYSA-N	1	1	309.301	1.596	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@H](CO)C2)c1F	ZINC001173188883	777036633	/nfs/dbraw/zinc/03/66/33/777036633.db2.gz	HPOYHAGYPWJTRD-MNOVXSKESA-N	1	1	312.341	1.988	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(CCNC2=O)C1	ZINC001173221013	777053314	/nfs/dbraw/zinc/05/33/14/777053314.db2.gz	FGARWIVFGRAKBR-WBMJQRKESA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001173231959	777063901	/nfs/dbraw/zinc/06/39/01/777063901.db2.gz	DPIMFNQALBQANR-SMDDNHRTSA-N	1	1	305.334	1.662	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001173231959	777063907	/nfs/dbraw/zinc/06/39/07/777063907.db2.gz	DPIMFNQALBQANR-SMDDNHRTSA-N	1	1	305.334	1.662	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](c2nn[nH]n2)C1	ZINC001175698008	777863593	/nfs/dbraw/zinc/86/35/93/777863593.db2.gz	JTDWPXODDKOWED-SECBINFHSA-N	1	1	308.729	1.751	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](c2nn[nH]n2)C1	ZINC001175698008	777863598	/nfs/dbraw/zinc/86/35/98/777863598.db2.gz	JTDWPXODDKOWED-SECBINFHSA-N	1	1	308.729	1.751	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC001177513628	778629821	/nfs/dbraw/zinc/62/98/21/778629821.db2.gz	FWUUGDXOEUECEV-UHFFFAOYSA-N	1	1	318.337	1.220	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2cc([N+](=O)[O-])cc3c2OCCO3)o1	ZINC001117229309	780692834	/nfs/dbraw/zinc/69/28/34/780692834.db2.gz	SBQNCWOSVBZZOQ-UHFFFAOYSA-N	1	1	306.278	1.478	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NCC[NH+]2CC=CC2)cc1[N+](=O)[O-]	ZINC001326482977	861401127	/nfs/dbraw/zinc/40/11/27/861401127.db2.gz	RWIOCRZAZLYFOF-UHFFFAOYSA-N	1	1	322.340	1.402	20	5		DDBDMO
[NH3+]Cc1ncn(-c2cnc(Oc3ccc([N+](=O)[O-])cc3)nc2)n1	ZINC001168753726	848078471	/nfs/dbraw/zinc/07/84/71/848078471.db2.gz	GFSSMVSVZSZAMB-UHFFFAOYSA-N	1	1	313.277	1.217	20	5		DDBDMO
C[C@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC001293397080	852866846	/nfs/dbraw/zinc/86/68/46/852866846.db2.gz	ZEVRZNTWMGWPFZ-LBPRGKRZSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[C@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC001293397080	852866850	/nfs/dbraw/zinc/86/68/50/852866850.db2.gz	ZEVRZNTWMGWPFZ-LBPRGKRZSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)o1	ZINC001328432659	862970160	/nfs/dbraw/zinc/97/01/60/862970160.db2.gz	HWQVECPHLGZDKB-UHFFFAOYSA-N	1	1	314.305	1.892	20	5		DDBDMO
CC(CC(=O)OC(C)C)=Nc1ncc([N+](=O)[O-])c(C2C[NH2+]C2)n1	ZINC001156515132	863114719	/nfs/dbraw/zinc/11/47/19/863114719.db2.gz	XEICIJLPLHSIHZ-WTKPLQERSA-N	1	1	321.337	1.339	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2C[C@@H]3C[C@H]2C(=O)O3)ncc1[N+](=O)[O-]	ZINC001157295833	863720628	/nfs/dbraw/zinc/72/06/28/863720628.db2.gz	MBGRRPHWYXIQLA-SEUFLZDSSA-N	1	1	304.306	1.026	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3c(C)c([N+](=O)[O-])cc[n+]3[O-])C[C@H]2C1	ZINC001157690357	864049591	/nfs/dbraw/zinc/04/95/91/864049591.db2.gz	DDWXMWDIZRIWPX-BETUJISGSA-N	1	1	306.366	1.315	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H](C)C[NH+]2CCOCC2)c(N)c1[N+](=O)[O-]	ZINC001158232507	864504926	/nfs/dbraw/zinc/50/49/26/864504926.db2.gz	XHUZQQJAFFFPNI-LLVKDONJSA-N	1	1	322.365	1.392	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC001333072399	866393717	/nfs/dbraw/zinc/39/37/17/866393717.db2.gz	WKODNGJBVHSPAE-UHFFFAOYSA-N	1	1	311.313	1.624	20	5		DDBDMO
CN1CC[NH+](CCCNc2ncnc(Cl)c2[N+](=O)[O-])CC1	ZINC001161700618	866906258	/nfs/dbraw/zinc/90/62/58/866906258.db2.gz	NCQZJXUXLBTVED-UHFFFAOYSA-N	1	1	314.777	1.088	20	5		DDBDMO
COc1nc(NC2C[NH+](C(C)(C)C)C2)nc(OC)c1[N+](=O)[O-]	ZINC001162220764	867351529	/nfs/dbraw/zinc/35/15/29/867351529.db2.gz	ACNVXGIWWSEYGC-UHFFFAOYSA-N	1	1	311.342	1.297	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC001324580464	867371118	/nfs/dbraw/zinc/37/11/18/867371118.db2.gz	MLGVWEUIYPRSNJ-YGRLFVJLSA-N	1	1	304.350	1.413	20	5		DDBDMO
Cc1cnc(Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)c(=O)[nH]1	ZINC001162715092	867760566	/nfs/dbraw/zinc/76/05/66/867760566.db2.gz	HHNXXMYOEYLVGF-SNAWJCMRSA-N	1	1	316.321	1.657	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])c(NCC[C@H]2CC[NH2+]CC2(F)F)n1	ZINC001162811451	867846169	/nfs/dbraw/zinc/84/61/69/867846169.db2.gz	ZHDDLYDXJUEMFA-SECBINFHSA-N	1	1	301.297	1.740	20	5		DDBDMO
CN(C)C1(CNc2cnc(F)c([N+](=O)[O-])c2)CC[NH+](C)CC1	ZINC001164213030	869022836	/nfs/dbraw/zinc/02/28/36/869022836.db2.gz	MAYREVVCJVGJCJ-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC([NH2+]C3COC3)C2)c2ccncc21	ZINC001164220933	869030860	/nfs/dbraw/zinc/03/08/60/869030860.db2.gz	PSFRGKRTVLQMDJ-UHFFFAOYSA-N	1	1	300.318	1.320	20	5		DDBDMO
CN(C)/C=C\c1cc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC001165147390	869408143	/nfs/dbraw/zinc/40/81/43/869408143.db2.gz	FKAQKHXNOFFWIL-XTBPLBNGSA-N	1	1	317.393	1.520	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC001338464793	869993197	/nfs/dbraw/zinc/99/31/97/869993197.db2.gz	QRRKFOLAYBPVNA-FPMFFAJLSA-N	1	1	321.352	1.733	20	5		DDBDMO
CN1CC[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)C1=O	ZINC001166691595	870157203	/nfs/dbraw/zinc/15/72/03/870157203.db2.gz	AAKBOSNYOYCVDN-CYBMUJFWSA-N	1	1	304.350	1.225	20	5		DDBDMO
CN1CC[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)C1=O	ZINC001166691595	870157207	/nfs/dbraw/zinc/15/72/07/870157207.db2.gz	AAKBOSNYOYCVDN-CYBMUJFWSA-N	1	1	304.350	1.225	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)[C@@H](CO)[NH2+]Cc2nccs2)cc1	ZINC001203582387	870650851	/nfs/dbraw/zinc/65/08/51/870650851.db2.gz	FEIZBIKLMTXCSJ-DGCLKSJQSA-N	1	1	309.347	1.235	20	5		DDBDMO
Cc1cc(NC(=O)NC[C@]2(O)CC[N@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001311323313	871694228	/nfs/dbraw/zinc/69/42/28/871694228.db2.gz	UGWMFVKADKRFDH-CQSZACIVSA-N	1	1	308.338	1.091	20	5		DDBDMO
CO[C@@H]1CC[C@H]1N(C)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC001345464658	873413291	/nfs/dbraw/zinc/41/32/91/873413291.db2.gz	AJSKPXZKMPDTEP-UMVBOHGHSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC001348747746	874758281	/nfs/dbraw/zinc/75/82/81/874758281.db2.gz	PBKDVQJZQYUTPO-XQQFMLRXSA-N	1	1	318.377	1.463	20	5		DDBDMO
C[C@@H](OCC(=O)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC001222543321	880549332	/nfs/dbraw/zinc/54/93/32/880549332.db2.gz	NSHZRUDZKYSOQL-GFCCVEGCSA-N	1	1	307.350	1.446	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOCc2ncc(C)c([N+](=O)[O-])c2C)C1	ZINC001224185865	881260630	/nfs/dbraw/zinc/26/06/30/881260630.db2.gz	RNIBSKPMUSXDFS-CYBMUJFWSA-N	1	1	309.366	1.844	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1ncc([N+](=O)[O-])c2nc[nH]c21	ZINC001227694219	883135841	/nfs/dbraw/zinc/13/58/41/883135841.db2.gz	FGJIUFWFUTYLPH-WDAIWFPHSA-N	1	1	317.349	1.975	20	5		DDBDMO
C[N@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1nc(C3CC3)[nH]c(=O)c1[N+](=O)[O-])C2	ZINC001228607513	883572349	/nfs/dbraw/zinc/57/23/49/883572349.db2.gz	WBGYYDYTBSLRGV-JGPRNRPPSA-N	1	1	320.349	1.972	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1nc(C3CC3)[nH]c(=O)c1[N+](=O)[O-])C2	ZINC001228607513	883572357	/nfs/dbraw/zinc/57/23/57/883572357.db2.gz	WBGYYDYTBSLRGV-JGPRNRPPSA-N	1	1	320.349	1.972	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3cc4n[nH]cc4cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230594488	884631230	/nfs/dbraw/zinc/63/12/30/884631230.db2.gz	FZYSZPLWTIPDON-BHYNMZESSA-N	1	1	316.317	1.654	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3cc4n[nH]cc4cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230594488	884631239	/nfs/dbraw/zinc/63/12/39/884631239.db2.gz	FZYSZPLWTIPDON-BHYNMZESSA-N	1	1	316.317	1.654	20	5		DDBDMO
CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccnc1	ZINC001230763178	884845965	/nfs/dbraw/zinc/84/59/65/884845965.db2.gz	UBYHXPHFSKRRGN-ZIAGYGMSSA-N	1	1	306.366	1.075	20	5		DDBDMO
CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001230763178	884845981	/nfs/dbraw/zinc/84/59/81/884845981.db2.gz	UBYHXPHFSKRRGN-ZIAGYGMSSA-N	1	1	306.366	1.075	20	5		DDBDMO
CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001230763178	884845995	/nfs/dbraw/zinc/84/59/95/884845995.db2.gz	UBYHXPHFSKRRGN-ZIAGYGMSSA-N	1	1	306.366	1.075	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c([N+](=O)[O-])c3)[C@H]1CC(=O)C2	ZINC001233702914	887237676	/nfs/dbraw/zinc/23/76/76/887237676.db2.gz	RMAQMQUBVVDWGR-PCTYZZJISA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c([N+](=O)[O-])c3)[C@H]1CC(=O)C2	ZINC001233702914	887237690	/nfs/dbraw/zinc/23/76/90/887237690.db2.gz	RMAQMQUBVVDWGR-PCTYZZJISA-N	1	1	321.289	1.686	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)ccc1[N+](=O)[O-]	ZINC001289377337	913190380	/nfs/dbraw/zinc/19/03/80/913190380.db2.gz	RIIMWUNMHUKSCD-WBMJQRKESA-N	1	1	319.361	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CC[C@@H](F)[C@H](O)C3)CC2)cc1	ZINC001254473927	896455695	/nfs/dbraw/zinc/45/56/95/896455695.db2.gz	JRDYLFDMQZAHSL-HZPDHXFCSA-N	1	1	323.368	1.968	20	5		DDBDMO
CCC(=O)N1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254596339	896520907	/nfs/dbraw/zinc/52/09/07/896520907.db2.gz	CPWOOLYCRDOSNJ-HNNXBMFYSA-N	1	1	303.362	1.616	20	5		DDBDMO
CCOC(=O)[C@H]1[C@@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]21	ZINC001254606467	896527834	/nfs/dbraw/zinc/52/78/34/896527834.db2.gz	GTPHTMKUKYAWHD-CAOSSQGBSA-N	1	1	316.357	1.803	20	5		DDBDMO
O=C1NCC[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]12	ZINC001254608758	896529959	/nfs/dbraw/zinc/52/99/59/896529959.db2.gz	SLUNJKYSTNQONM-NILFDRSVSA-N	1	1	301.346	1.130	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(CC(F)F)CC1)C2	ZINC001254609551	896531428	/nfs/dbraw/zinc/53/14/28/896531428.db2.gz	XCTGJJVTNKDCRN-CQSZACIVSA-N	1	1	311.332	1.945	20	5		DDBDMO
Cc1ncc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)s1	ZINC001280480532	903723299	/nfs/dbraw/zinc/72/32/99/903723299.db2.gz	RIYVWIAUPYYPRJ-VXGBXAGGSA-N	1	1	324.406	1.245	20	5		DDBDMO
C[C@@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC[N@H+]1CCO	ZINC000302443699	230247973	/nfs/dbraw/zinc/24/79/73/230247973.db2.gz	QWVBYNWSHUKIGD-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC1(C)CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000614895480	362066388	/nfs/dbraw/zinc/06/63/88/362066388.db2.gz	VCNYMOVXJRZRGT-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC1(C)CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000614895480	362066391	/nfs/dbraw/zinc/06/63/91/362066391.db2.gz	VCNYMOVXJRZRGT-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])[C@H]2C1	ZINC000272768226	210172567	/nfs/dbraw/zinc/17/25/67/210172567.db2.gz	WYWNPNRHLXLBQG-GWCFXTLKSA-N	1	1	305.338	1.548	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000272655473	282318080	/nfs/dbraw/zinc/31/80/80/282318080.db2.gz	QOENHQLPGOEZRN-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000286724888	219131394	/nfs/dbraw/zinc/13/13/94/219131394.db2.gz	XKNFWFYTUWKRAW-LLVKDONJSA-N	1	1	306.366	1.220	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000272747223	210151215	/nfs/dbraw/zinc/15/12/15/210151215.db2.gz	SBSTWOPDFCTEDS-UHFFFAOYSA-N	1	1	304.310	1.707	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000181706847	199341657	/nfs/dbraw/zinc/34/16/57/199341657.db2.gz	ZXVGBDRWWXNVCC-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000045753204	352422723	/nfs/dbraw/zinc/42/27/23/352422723.db2.gz	LGBLTSUGWVIAHP-UONOGXRCSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000045753204	352422725	/nfs/dbraw/zinc/42/27/25/352422725.db2.gz	LGBLTSUGWVIAHP-UONOGXRCSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000172894020	198165036	/nfs/dbraw/zinc/16/50/36/198165036.db2.gz	IHRBWDGWUBJIFT-GFCCVEGCSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000172894020	198165038	/nfs/dbraw/zinc/16/50/38/198165038.db2.gz	IHRBWDGWUBJIFT-GFCCVEGCSA-N	1	1	323.349	1.271	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000173181327	198192557	/nfs/dbraw/zinc/19/25/57/198192557.db2.gz	JCAYCOCRPXDHAY-CYBMUJFWSA-N	1	1	303.362	1.738	20	5		DDBDMO
COc1ccc(CC(=O)NCCC[N@@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000067906684	353074349	/nfs/dbraw/zinc/07/43/49/353074349.db2.gz	RNXOKBLTFOGACX-UHFFFAOYSA-N	1	1	323.393	1.992	20	5		DDBDMO
Cc1cc(C(=O)NCc2c[nH+]c(N(C)C)n2C)ccc1[N+](=O)[O-]	ZINC000074095619	353290625	/nfs/dbraw/zinc/29/06/25/353290625.db2.gz	RPLRYYKDUYBMCS-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)CC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000074105743	353292655	/nfs/dbraw/zinc/29/26/55/353292655.db2.gz	WFJRXAJIVRZKBI-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000174294506	198316566	/nfs/dbraw/zinc/31/65/66/198316566.db2.gz	REURMGBCFKZUCO-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000174294506	198316568	/nfs/dbraw/zinc/31/65/68/198316568.db2.gz	REURMGBCFKZUCO-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](CO)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000174705451	198372806	/nfs/dbraw/zinc/37/28/06/198372806.db2.gz	CTWDBUBROAVZIN-VIFPVBQESA-N	1	1	313.741	1.501	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](CO)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000174705451	198372807	/nfs/dbraw/zinc/37/28/07/198372807.db2.gz	CTWDBUBROAVZIN-VIFPVBQESA-N	1	1	313.741	1.501	20	5		DDBDMO
Cc1cnc(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c([N+](=O)[O-])c1	ZINC000078632057	353526295	/nfs/dbraw/zinc/52/62/95/353526295.db2.gz	AAFNLQFZZPJSRD-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@]3(CCCOC3)C2)c1	ZINC000355776138	291003644	/nfs/dbraw/zinc/00/36/44/291003644.db2.gz	BBSUGMQCQXLIPY-CABCVRRESA-N	1	1	324.381	1.045	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000080375432	353604575	/nfs/dbraw/zinc/60/45/75/353604575.db2.gz	VELYGBNLFDTHIP-UHFFFAOYSA-N	1	1	318.333	1.685	20	5		DDBDMO
Cc1cc(N2CCCC[C@@H]2C[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000080605364	353618037	/nfs/dbraw/zinc/61/80/37/353618037.db2.gz	KIHVQEVFZOYEHL-CQSZACIVSA-N	1	1	320.393	1.989	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@](C)(O)C[NH+]2CCOCC2)c1	ZINC000088725774	353757796	/nfs/dbraw/zinc/75/77/96/353757796.db2.gz	DJHJPHFXXFFEFR-OAHLLOKOSA-N	1	1	309.366	1.398	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000089267231	353763396	/nfs/dbraw/zinc/76/33/96/353763396.db2.gz	DVGTVCJZRXIXNC-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000089267231	353763400	/nfs/dbraw/zinc/76/34/00/353763400.db2.gz	DVGTVCJZRXIXNC-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CC2)CC1	ZINC000124894904	354043141	/nfs/dbraw/zinc/04/31/41/354043141.db2.gz	QZHXIVIBWXTYDA-UHFFFAOYSA-N	1	1	305.334	1.280	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000144000699	354152561	/nfs/dbraw/zinc/15/25/61/354152561.db2.gz	SIQUMQIABSPGHP-SNVBAGLBSA-N	1	1	305.334	1.570	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000157813295	354226821	/nfs/dbraw/zinc/22/68/21/354226821.db2.gz	OLNGSEGAEQVKJF-ZANVPECISA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000157813295	354226823	/nfs/dbraw/zinc/22/68/23/354226823.db2.gz	OLNGSEGAEQVKJF-ZANVPECISA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H](O)C1CC1	ZINC000305721033	354471242	/nfs/dbraw/zinc/47/12/42/354471242.db2.gz	IIVOKQRTTSZROA-YGRLFVJLSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)C1CC1	ZINC000305721033	354471243	/nfs/dbraw/zinc/47/12/43/354471243.db2.gz	IIVOKQRTTSZROA-YGRLFVJLSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+](CCO)Cc2cccc(F)c2)n1	ZINC000494226614	235009509	/nfs/dbraw/zinc/00/95/09/235009509.db2.gz	IWZHLXGQQFFIEF-UHFFFAOYSA-N	1	1	308.313	1.425	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](CC(N)=O)C1	ZINC000588977627	354953543	/nfs/dbraw/zinc/95/35/43/354953543.db2.gz	QPXPQEGHZXDXJL-NSHDSACASA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000588977627	354953545	/nfs/dbraw/zinc/95/35/45/354953545.db2.gz	QPXPQEGHZXDXJL-NSHDSACASA-N	1	1	320.349	1.039	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H](O)C1CC1	ZINC000589198284	354972721	/nfs/dbraw/zinc/97/27/21/354972721.db2.gz	YPULFFCSHWALHC-ZDUSSCGKSA-N	1	1	308.334	1.569	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590447422	355099449	/nfs/dbraw/zinc/09/94/49/355099449.db2.gz	XDCSNEKQAIPBIM-PWSUYJOCSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(F)c1	ZINC000591138797	355253466	/nfs/dbraw/zinc/25/34/66/355253466.db2.gz	VLYGFVQSXJYMBI-ZDUSSCGKSA-N	1	1	324.356	1.820	20	5		DDBDMO
CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000593066440	355785668	/nfs/dbraw/zinc/78/56/68/355785668.db2.gz	DFIKAPDUOUSECX-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000593754446	355987248	/nfs/dbraw/zinc/98/72/48/355987248.db2.gz	NGEFAIPJLVBGEE-UHFFFAOYSA-N	1	1	308.382	1.885	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(=O)N1CCOCC1	ZINC000595025972	356373823	/nfs/dbraw/zinc/37/38/23/356373823.db2.gz	LSBOHSRSCOWTQO-NSHDSACASA-N	1	1	323.349	1.113	20	5		DDBDMO
C[C@H](CCN1CC[NH+](C)CC1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000184337714	199704036	/nfs/dbraw/zinc/70/40/36/199704036.db2.gz	XUVLXWWKATVMPM-CYBMUJFWSA-N	1	1	320.393	1.351	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c1[N+](=O)[O-]	ZINC000595528105	356534469	/nfs/dbraw/zinc/53/44/69/356534469.db2.gz	PYZVJSDWAHZNQM-TUAOUCFPSA-N	1	1	311.338	1.253	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])n2C)CCCO1	ZINC000347094713	283175954	/nfs/dbraw/zinc/17/59/54/283175954.db2.gz	DZNWNCIHDJSWHG-LBPRGKRZSA-N	1	1	324.381	1.164	20	5		DDBDMO
COc1cc(C[N@@H+](CCOCCO)C2CCC2)ccc1[N+](=O)[O-]	ZINC000595595740	356568422	/nfs/dbraw/zinc/56/84/22/356568422.db2.gz	LOIUJBAETUJHCB-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595744679	356632321	/nfs/dbraw/zinc/63/23/21/356632321.db2.gz	LRQHOAVMZPMEKQ-VXGBXAGGSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@]1(C)CO	ZINC000595873339	356687384	/nfs/dbraw/zinc/68/73/84/356687384.db2.gz	LVCGPQARYWNKSD-ZUZCIYMTSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@]1(C)CO	ZINC000595873339	356687386	/nfs/dbraw/zinc/68/73/86/356687386.db2.gz	LVCGPQARYWNKSD-ZUZCIYMTSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595869412	356685988	/nfs/dbraw/zinc/68/59/88/356685988.db2.gz	CWGFIAOHWNAVAQ-HWWQOWPSSA-N	1	1	321.377	1.872	20	5		DDBDMO
COCC[N@@H+]1CCCN(c2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000596076052	356763661	/nfs/dbraw/zinc/76/36/61/356763661.db2.gz	BSALCGKIMRCOFA-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
COCC[N@H+]1CCCN(c2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000596076052	356763664	/nfs/dbraw/zinc/76/36/64/356763664.db2.gz	BSALCGKIMRCOFA-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
CCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000596420132	356873640	/nfs/dbraw/zinc/87/36/40/356873640.db2.gz	XEPQBVFKNHBYKC-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1nc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000596537432	356910392	/nfs/dbraw/zinc/91/03/92/356910392.db2.gz	FXKOJHRVURLXDY-ZDUSSCGKSA-N	1	1	306.366	1.334	20	5		DDBDMO
CCN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000596817665	356985046	/nfs/dbraw/zinc/98/50/46/356985046.db2.gz	PUYAZPDOGKZDOP-NSHDSACASA-N	1	1	307.354	1.360	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597715581	357299848	/nfs/dbraw/zinc/29/98/48/357299848.db2.gz	MWIAPFIQEOAUNU-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597715581	357299849	/nfs/dbraw/zinc/29/98/49/357299849.db2.gz	MWIAPFIQEOAUNU-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597715581	357299851	/nfs/dbraw/zinc/29/98/51/357299851.db2.gz	MWIAPFIQEOAUNU-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@@H]1CC[N@@H+](C)C1	ZINC000597945058	357393516	/nfs/dbraw/zinc/39/35/16/357393516.db2.gz	HHVSOADOLBTNJP-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc(OC)ccc2[N+](=O)[O-])C1	ZINC000598342276	357545689	/nfs/dbraw/zinc/54/56/89/357545689.db2.gz	LMGHEJPVDZDDOA-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[N@@H+]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000598605325	357650876	/nfs/dbraw/zinc/65/08/76/357650876.db2.gz	AZYWEIQJZGTFTA-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
CC[N@H+]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000598605325	357650879	/nfs/dbraw/zinc/65/08/79/357650879.db2.gz	AZYWEIQJZGTFTA-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
COC(=O)c1ccnc(N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000598617200	357655756	/nfs/dbraw/zinc/65/57/56/357655756.db2.gz	ICFVZEHWQAKGRN-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000598745585	357713121	/nfs/dbraw/zinc/71/31/21/357713121.db2.gz	KQYVDRHULMIESV-SNVBAGLBSA-N	1	1	322.365	1.546	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000598914020	357756993	/nfs/dbraw/zinc/75/69/93/357756993.db2.gz	VKUXHAPNZAHFIV-CYBMUJFWSA-N	1	1	314.292	1.899	20	5		DDBDMO
C[C@@H]1CN(c2ccc3cnccc3c2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000599071089	357807707	/nfs/dbraw/zinc/80/77/07/357807707.db2.gz	PQPDHPIGUKWLIM-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
Cc1cc(N2CC(CN3CC[NH+](C)CC3)C2)ccc1[N+](=O)[O-]	ZINC000599109948	357818317	/nfs/dbraw/zinc/81/83/17/357818317.db2.gz	ZAEXSPGMETYRNX-UHFFFAOYSA-N	1	1	304.394	1.587	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000276711946	213061541	/nfs/dbraw/zinc/06/15/41/213061541.db2.gz	YLWKXRMZWYBBBZ-CYBMUJFWSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000276711946	213061545	/nfs/dbraw/zinc/06/15/45/213061545.db2.gz	YLWKXRMZWYBBBZ-CYBMUJFWSA-N	1	1	315.377	1.801	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000600473146	358234820	/nfs/dbraw/zinc/23/48/20/358234820.db2.gz	RXWLVDIBCCQWHH-LBPRGKRZSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC(C)(C(=O)NCC[N@H+]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000600808837	358320907	/nfs/dbraw/zinc/32/09/07/358320907.db2.gz	SQXBMYOMFBZDNF-AWEZNQCLSA-N	1	1	321.377	1.055	20	5		DDBDMO
CC(C)C(=O)NCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601099968	358402270	/nfs/dbraw/zinc/40/22/70/358402270.db2.gz	CGDJLWUDZSWSLH-UHFFFAOYSA-N	1	1	302.334	1.749	20	5		DDBDMO
Cc1cnn(C)c1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149163	358422501	/nfs/dbraw/zinc/42/25/01/358422501.db2.gz	KBOHWSPANIQUHP-HNNXBMFYSA-N	1	1	304.350	1.634	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000601583510	358611741	/nfs/dbraw/zinc/61/17/41/358611741.db2.gz	BULNLEZDMKSBNN-GHMZBOCLSA-N	1	1	323.324	1.015	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2COC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000601974149	358760943	/nfs/dbraw/zinc/76/09/43/358760943.db2.gz	PLKVITFSEFZYES-TXEJJXNPSA-N	1	1	305.334	1.136	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602446783	358982332	/nfs/dbraw/zinc/98/23/32/358982332.db2.gz	AVBGTKYOCCSVBW-UHFFFAOYSA-N	1	1	309.414	1.881	20	5		DDBDMO
CO[C@H](C[NH+]1CC(Oc2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCOC1	ZINC000602689095	359127247	/nfs/dbraw/zinc/12/72/47/359127247.db2.gz	QSPULLAVXWQNIN-BLLLJJGKSA-N	1	1	322.361	1.709	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](C(=O)N2CCCC2)C1	ZINC000602829156	359221365	/nfs/dbraw/zinc/22/13/65/359221365.db2.gz	QCJWTOODIWIUTP-CYBMUJFWSA-N	1	1	321.381	1.044	20	5		DDBDMO
C[C@@](CO)([NH2+]C[C@H](O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000602963661	359326900	/nfs/dbraw/zinc/32/69/00/359326900.db2.gz	YDAQMWLWCHBAMW-QWRGUYRKSA-N	1	1	308.256	1.315	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@](C)(CO)C1	ZINC000602964440	359327843	/nfs/dbraw/zinc/32/78/43/359327843.db2.gz	PNLVSYXNQSMROH-CVEARBPZSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCCn1cc(C[NH+]2CCCC2)nn1	ZINC000603202731	359477892	/nfs/dbraw/zinc/47/78/92/359477892.db2.gz	XRERCRYRYZATDY-UHFFFAOYSA-N	1	1	317.349	1.861	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000186787290	200010033	/nfs/dbraw/zinc/01/00/33/200010033.db2.gz	RYCHDWKQRXKZHQ-FZMZJTMJSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@H]1CC[NH2+]C[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000186766392	200006111	/nfs/dbraw/zinc/00/61/11/200006111.db2.gz	HFBXFUUYFWPKBJ-UFBFGSQYSA-N	1	1	303.322	1.199	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1O	ZINC000186912472	200030683	/nfs/dbraw/zinc/03/06/83/200030683.db2.gz	AXUIWIAXEJUMSC-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1O	ZINC000186912472	200030684	/nfs/dbraw/zinc/03/06/84/200030684.db2.gz	AXUIWIAXEJUMSC-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000186931632	200033240	/nfs/dbraw/zinc/03/32/40/200033240.db2.gz	HUDQTVUXGWQZQH-GFCCVEGCSA-N	1	1	321.377	1.512	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)NCc1ccc([N+](=O)[O-])cc1	ZINC000186987036	200043691	/nfs/dbraw/zinc/04/36/91/200043691.db2.gz	QZZFPZDLQJQLPO-UHFFFAOYSA-N	1	1	322.365	1.116	20	5		DDBDMO
CO[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@H]1C	ZINC000189330477	200383031	/nfs/dbraw/zinc/38/30/31/200383031.db2.gz	FWNVTPSLKZWTNH-YGRLFVJLSA-N	1	1	307.350	1.551	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(Cc3csc([N+](=O)[O-])c3)CC2)C1	ZINC000609672353	360342891	/nfs/dbraw/zinc/34/28/91/360342891.db2.gz	BFBVSPAOFBYEFH-CQSZACIVSA-N	1	1	324.450	1.868	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610605353	360480879	/nfs/dbraw/zinc/48/08/79/360480879.db2.gz	ZMHUPJLJGJBCGV-KBPBESRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610615616	360482696	/nfs/dbraw/zinc/48/26/96/360482696.db2.gz	ZOYYHHJGIDEGIQ-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610615616	360482702	/nfs/dbraw/zinc/48/27/02/360482702.db2.gz	ZOYYHHJGIDEGIQ-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(CO)CC1)OCCO2	ZINC000611253873	360680975	/nfs/dbraw/zinc/68/09/75/360680975.db2.gz	UXAWDHMIEVJOFV-UHFFFAOYSA-N	1	1	308.334	1.570	20	5		DDBDMO
COc1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-]	ZINC000611348847	360703766	/nfs/dbraw/zinc/70/37/66/360703766.db2.gz	MUAZPJOAMCYROS-CQSZACIVSA-N	1	1	321.377	1.510	20	5		DDBDMO
COc1cc(CN2CC[NH+]([C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000611516706	360744397	/nfs/dbraw/zinc/74/43/97/360744397.db2.gz	DCOFHZXKSVRTIL-CQSZACIVSA-N	1	1	321.377	1.510	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000611525983	360747746	/nfs/dbraw/zinc/74/77/46/360747746.db2.gz	WQLDQAXWSHYPJC-LLVKDONJSA-N	1	1	308.382	1.447	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611564060	360761259	/nfs/dbraw/zinc/76/12/59/360761259.db2.gz	VAXGEIWCBLSGSI-NEPJUHHUSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000281291872	216215567	/nfs/dbraw/zinc/21/55/67/216215567.db2.gz	GXTOBPPXXVPZPQ-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](O)CC1	ZINC000293037203	223363752	/nfs/dbraw/zinc/36/37/52/223363752.db2.gz	GSXKKSCTWHLNOF-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](O)CC1	ZINC000293037203	223363755	/nfs/dbraw/zinc/36/37/55/223363755.db2.gz	GSXKKSCTWHLNOF-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000261732112	203104936	/nfs/dbraw/zinc/10/49/36/203104936.db2.gz	MAIBBBLIJBJANC-LLVKDONJSA-N	1	1	318.358	1.838	20	5		DDBDMO
C[C@@H](c1cccnc1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000093228078	193219327	/nfs/dbraw/zinc/21/93/27/193219327.db2.gz	DOUOGPNHURWRFK-LBPRGKRZSA-N	1	1	302.334	1.845	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](C)C(=O)NC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000271731143	209163532	/nfs/dbraw/zinc/16/35/32/209163532.db2.gz	MZSCYGMMOWYSQD-FRRDWIJNSA-N	1	1	321.377	1.929	20	5		DDBDMO
COC(C[N@H+](CCCO)Cc1ccc([N+](=O)[O-])c(F)c1)OC	ZINC000282645865	217149641	/nfs/dbraw/zinc/14/96/41/217149641.db2.gz	BZMNSIUTACXWPD-UHFFFAOYSA-N	1	1	316.329	1.537	20	5		DDBDMO
COC(C[N@@H+](CCCO)Cc1ccc([N+](=O)[O-])c(F)c1)OC	ZINC000282645865	217149645	/nfs/dbraw/zinc/14/96/45/217149645.db2.gz	BZMNSIUTACXWPD-UHFFFAOYSA-N	1	1	316.329	1.537	20	5		DDBDMO
Cc1n[nH]c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266081594	205081909	/nfs/dbraw/zinc/08/19/09/205081909.db2.gz	DOFNDYPQOKPLRG-NSHDSACASA-N	1	1	309.370	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000266081594	205081913	/nfs/dbraw/zinc/08/19/13/205081913.db2.gz	DOFNDYPQOKPLRG-NSHDSACASA-N	1	1	309.370	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266081594	205081916	/nfs/dbraw/zinc/08/19/16/205081916.db2.gz	DOFNDYPQOKPLRG-NSHDSACASA-N	1	1	309.370	1.573	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc32)C1	ZINC000266192878	205172314	/nfs/dbraw/zinc/17/23/14/205172314.db2.gz	GZAMJZPOFFJMAH-JTQLQIEISA-N	1	1	305.338	1.909	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000266480786	205377300	/nfs/dbraw/zinc/37/73/00/205377300.db2.gz	SWXUSVXOTYHJJO-OAHLLOKOSA-N	1	1	304.350	1.593	20	5		DDBDMO
C[C@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000288459972	220155660	/nfs/dbraw/zinc/15/56/60/220155660.db2.gz	DTFOVKLGRMLNDB-QPUJVOFHSA-N	1	1	318.782	1.771	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CC[N@H+](C)C[C@@H]1C	ZINC000121056778	248265751	/nfs/dbraw/zinc/26/57/51/248265751.db2.gz	CYWCVXRBMAGIBZ-AAEUAGOBSA-N	1	1	323.397	1.288	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(CCOc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000284481182	218044716	/nfs/dbraw/zinc/04/47/16/218044716.db2.gz	AWCVUDAWKDAUMK-GOEBONIOSA-N	1	1	321.377	1.379	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cccc([N+](=O)[O-])c2C)[N@@H+](C)C1	ZINC000284551299	218075053	/nfs/dbraw/zinc/07/50/53/218075053.db2.gz	GRQUULVHGIMYDP-STQMWFEESA-N	1	1	321.377	1.694	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCO[C@H]2CC[N@@H+](C)C[C@H]21	ZINC000284923291	218235856	/nfs/dbraw/zinc/23/58/56/218235856.db2.gz	UDBBXQCDVTWMIZ-ZBFHGGJFSA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000109992242	194303525	/nfs/dbraw/zinc/30/35/25/194303525.db2.gz	YGICHSORFYNEOZ-JTQLQIEISA-N	1	1	323.349	1.294	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000340992612	251323004	/nfs/dbraw/zinc/32/30/04/251323004.db2.gz	NIMCABNANJMBNF-VIFPVBQESA-N	1	1	315.333	1.438	20	5		DDBDMO
Cc1ncc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cn1	ZINC000352407030	285030342	/nfs/dbraw/zinc/03/03/42/285030342.db2.gz	OQILLEMVAIUUPC-UHFFFAOYSA-N	1	1	302.338	1.727	20	5		DDBDMO
CC[N@H+](CCO)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000120011036	195080487	/nfs/dbraw/zinc/08/04/87/195080487.db2.gz	JNYKGRHIGMVOTR-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CCO)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000120011036	195080489	/nfs/dbraw/zinc/08/04/89/195080489.db2.gz	JNYKGRHIGMVOTR-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000286510306	219028417	/nfs/dbraw/zinc/02/84/17/219028417.db2.gz	MUPSXNNOVVJIHE-BBKQSLKASA-N	1	1	318.373	1.983	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@@H+](C)CCN2C)c(F)cc1[N+](=O)[O-]	ZINC000271100397	208623439	/nfs/dbraw/zinc/62/34/39/208623439.db2.gz	PCBGEUMKXIJAAD-SNVBAGLBSA-N	1	1	312.345	1.400	20	5		DDBDMO
C[C@@H](NC(=O)NCC(F)(F)C[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000417128309	533153077	/nfs/dbraw/zinc/15/30/77/533153077.db2.gz	IAKYPRIMDMNACQ-MRVPVSSYSA-N	1	1	302.281	1.549	20	5		DDBDMO
C[C@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000154876538	197001115	/nfs/dbraw/zinc/00/11/15/197001115.db2.gz	NZVJARWHISDWFN-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1	ZINC000154876538	197001117	/nfs/dbraw/zinc/00/11/17/197001117.db2.gz	NZVJARWHISDWFN-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000154876538	197001118	/nfs/dbraw/zinc/00/11/18/197001118.db2.gz	NZVJARWHISDWFN-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[C@H]1O	ZINC000352696689	285235011	/nfs/dbraw/zinc/23/50/11/285235011.db2.gz	JZUVJRYQXCGMNN-AEGPPILISA-N	1	1	310.350	1.180	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CNc1ccccc1[N+](=O)[O-])C1CC1	ZINC000078454177	407028226	/nfs/dbraw/zinc/02/82/26/407028226.db2.gz	QRLKNLUOXOMXAH-UHFFFAOYSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000055758717	407207244	/nfs/dbraw/zinc/20/72/44/407207244.db2.gz	OZNOBUJGUHRTRN-FRRDWIJNSA-N	1	1	323.397	1.274	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000067298486	407270313	/nfs/dbraw/zinc/27/03/13/407270313.db2.gz	QHBPDEFNJHUYKR-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH2+][C@@H](C)C1	ZINC000124198930	407350887	/nfs/dbraw/zinc/35/08/87/407350887.db2.gz	OWYAETCEBVDMKE-JTQLQIEISA-N	1	1	313.379	1.140	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H]1CCOC1	ZINC000106883018	407365179	/nfs/dbraw/zinc/36/51/79/407365179.db2.gz	JIUKTYOCSZXPSV-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)c1ccco1	ZINC000124806040	407369673	/nfs/dbraw/zinc/36/96/73/407369673.db2.gz	OSWSKHMMASNORW-NSHDSACASA-N	1	1	320.305	1.321	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000265824052	407471965	/nfs/dbraw/zinc/47/19/65/407471965.db2.gz	XILLIOWCEHITBJ-UHFFFAOYSA-N	1	1	305.313	1.794	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000170793070	407509145	/nfs/dbraw/zinc/50/91/45/407509145.db2.gz	UXLJIGREBAEZBB-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CCn1nccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000128906472	407584261	/nfs/dbraw/zinc/58/42/61/407584261.db2.gz	YCWFUIOBRDWHSB-GFCCVEGCSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1nccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000128906472	407584268	/nfs/dbraw/zinc/58/42/68/407584268.db2.gz	YCWFUIOBRDWHSB-GFCCVEGCSA-N	1	1	316.365	1.893	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000266693382	407602151	/nfs/dbraw/zinc/60/21/51/407602151.db2.gz	FIZNFKSRMGEBJX-CYBMUJFWSA-N	1	1	306.366	1.531	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@](C)(O)C2)c([N+](=O)[O-])cc1OC	ZINC000129485052	407611240	/nfs/dbraw/zinc/61/12/40/407611240.db2.gz	BZMWSHRZGIWRQJ-HNNXBMFYSA-N	1	1	310.350	1.959	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@](C)(O)C2)c([N+](=O)[O-])cc1OC	ZINC000129485052	407611246	/nfs/dbraw/zinc/61/12/46/407611246.db2.gz	BZMWSHRZGIWRQJ-HNNXBMFYSA-N	1	1	310.350	1.959	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000171312083	407655893	/nfs/dbraw/zinc/65/58/93/407655893.db2.gz	OQWJKDASAVCYHI-UHFFFAOYSA-N	1	1	310.329	1.484	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)NCc1cccc([N+](=O)[O-])c1	ZINC000187049736	407814766	/nfs/dbraw/zinc/81/47/66/407814766.db2.gz	IIPCIYQCONGYSB-UHFFFAOYSA-N	1	1	322.365	1.116	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000118117447	407896392	/nfs/dbraw/zinc/89/63/92/407896392.db2.gz	AVPVIQNYVQZLFN-LLVKDONJSA-N	1	1	322.365	1.380	20	5		DDBDMO
Cc1c(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000154024528	407956452	/nfs/dbraw/zinc/95/64/52/407956452.db2.gz	NSXBPFQOMKQSSA-MBNYWOFBSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1c(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000154024528	407956458	/nfs/dbraw/zinc/95/64/58/407956458.db2.gz	NSXBPFQOMKQSSA-MBNYWOFBSA-N	1	1	324.377	1.752	20	5		DDBDMO
CCCCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000272485264	407944002	/nfs/dbraw/zinc/94/40/02/407944002.db2.gz	BMAGWZCNBXPTQD-UHFFFAOYSA-N	1	1	309.366	1.951	20	5		DDBDMO
C[N@@H+](CCC1CC1)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000135299298	408000714	/nfs/dbraw/zinc/00/07/14/408000714.db2.gz	WVBNACWHRCOBKT-UHFFFAOYSA-N	1	1	321.333	1.994	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000189665671	408074382	/nfs/dbraw/zinc/07/43/82/408074382.db2.gz	WVXCYPYYHCCJSO-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000190067087	408156287	/nfs/dbraw/zinc/15/62/87/408156287.db2.gz	RCGMBICRXCRSHD-JTQLQIEISA-N	1	1	317.349	1.748	20	5		DDBDMO
C[C@@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822372	408256194	/nfs/dbraw/zinc/25/61/94/408256194.db2.gz	PLXJOWNWGVAQCV-MNOVXSKESA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000182822372	408256199	/nfs/dbraw/zinc/25/61/99/408256199.db2.gz	PLXJOWNWGVAQCV-MNOVXSKESA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822372	408256207	/nfs/dbraw/zinc/25/62/07/408256207.db2.gz	PLXJOWNWGVAQCV-MNOVXSKESA-N	1	1	321.381	1.701	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1CCOCC1	ZINC000155729384	408204640	/nfs/dbraw/zinc/20/46/40/408204640.db2.gz	YDBFUWREXOTGHK-UHFFFAOYSA-N	1	1	307.350	1.892	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](Nc3ccccc3)C2)n1	ZINC000176226029	408315399	/nfs/dbraw/zinc/31/53/99/408315399.db2.gz	BFZBMHZKZDSXEB-CQSZACIVSA-N	1	1	301.350	1.978	20	5		DDBDMO
O=C(C[NH2+][C@@H](CO)c1ccccc1)Nc1ccccc1[N+](=O)[O-]	ZINC000182898433	408276796	/nfs/dbraw/zinc/27/67/96/408276796.db2.gz	QKBXPONARBPNJK-AWEZNQCLSA-N	1	1	315.329	1.857	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000246557404	408290474	/nfs/dbraw/zinc/29/04/74/408290474.db2.gz	WLBDONHHXDRCQM-KOLCDFICSA-N	1	1	309.370	1.339	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000269412476	408299440	/nfs/dbraw/zinc/29/94/40/408299440.db2.gz	VSBDKUSWYQDCLU-NSHDSACASA-N	1	1	323.397	1.903	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000269416776	408300310	/nfs/dbraw/zinc/30/03/10/408300310.db2.gz	WOPGQAOASPXKRP-UHFFFAOYSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000269416776	408300321	/nfs/dbraw/zinc/30/03/21/408300321.db2.gz	WOPGQAOASPXKRP-UHFFFAOYSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000269416776	408300326	/nfs/dbraw/zinc/30/03/26/408300326.db2.gz	WOPGQAOASPXKRP-UHFFFAOYSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176550743	408392907	/nfs/dbraw/zinc/39/29/07/408392907.db2.gz	RONGWVVISJGCRO-NEPJUHHUSA-N	1	1	318.377	1.876	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176612712	408404357	/nfs/dbraw/zinc/40/43/57/408404357.db2.gz	AKEUCSWDNHJMHS-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
Nc1cc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)ccn1	ZINC000191439581	408425635	/nfs/dbraw/zinc/42/56/35/408425635.db2.gz	WEQIVJBVGQZDJT-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000247943358	408516052	/nfs/dbraw/zinc/51/60/52/408516052.db2.gz	HGEKGTVOQDGRMY-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000247943358	408516056	/nfs/dbraw/zinc/51/60/56/408516056.db2.gz	HGEKGTVOQDGRMY-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)C[C@@H]2CCC[N@@H+]2CC)c1[N+](=O)[O-]	ZINC000177422163	408609878	/nfs/dbraw/zinc/60/98/78/408609878.db2.gz	KAIPTDHCNXJSHP-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000177422163	408609881	/nfs/dbraw/zinc/60/98/81/408609881.db2.gz	KAIPTDHCNXJSHP-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@@H+]2CC)c1[N+](=O)[O-]	ZINC000177422163	408609884	/nfs/dbraw/zinc/60/98/84/408609884.db2.gz	KAIPTDHCNXJSHP-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](CCOC)[C@@H](C)C1	ZINC000248671857	408613393	/nfs/dbraw/zinc/61/33/93/408613393.db2.gz	UIZOSUXAAVFQQE-NSHDSACASA-N	1	1	311.386	1.277	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](CCOC)[C@@H](C)C1	ZINC000248671857	408613399	/nfs/dbraw/zinc/61/33/99/408613399.db2.gz	UIZOSUXAAVFQQE-NSHDSACASA-N	1	1	311.386	1.277	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000192646774	408624061	/nfs/dbraw/zinc/62/40/61/408624061.db2.gz	ZAJZBEXLTFMJHT-ZUZCIYMTSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000192646774	408624066	/nfs/dbraw/zinc/62/40/66/408624066.db2.gz	ZAJZBEXLTFMJHT-ZUZCIYMTSA-N	1	1	318.333	1.330	20	5		DDBDMO
CCc1ccc([C@@H](COC)[NH2+]CCn2cc([N+](=O)[O-])cn2)o1	ZINC000184805103	408694192	/nfs/dbraw/zinc/69/41/92/408694192.db2.gz	XKXXLJHMAVQRBM-CYBMUJFWSA-N	1	1	308.338	1.924	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1C	ZINC000251933780	408790974	/nfs/dbraw/zinc/79/09/74/408790974.db2.gz	UBUONCFZSBKOJG-JGGQBBKZSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)C[C@@H](CO)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000185371890	408801360	/nfs/dbraw/zinc/80/13/60/408801360.db2.gz	SVDXINWJTKOVKD-ZDUSSCGKSA-N	1	1	309.366	1.533	20	5		DDBDMO
COc1cccc(N[C@@H](C)CN2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000185385094	408802780	/nfs/dbraw/zinc/80/27/80/408802780.db2.gz	WRPLNMQFHZDFIQ-LBPRGKRZSA-N	1	1	308.382	1.651	20	5		DDBDMO
COc1cccc(N[C@@H](C)C[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000185385094	408802784	/nfs/dbraw/zinc/80/27/84/408802784.db2.gz	WRPLNMQFHZDFIQ-LBPRGKRZSA-N	1	1	308.382	1.651	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000249764535	408763817	/nfs/dbraw/zinc/76/38/17/408763817.db2.gz	ZRXVHYRLFMPWOJ-RYUDHWBXSA-N	1	1	309.370	1.028	20	5		DDBDMO
CCc1n[nH]c(C2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000190706441	163155403	/nfs/dbraw/zinc/15/54/03/163155403.db2.gz	HRWTUGFNIMOYQE-UHFFFAOYSA-N	1	1	319.369	1.351	20	5		DDBDMO
CCc1nc(C2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)n[nH]1	ZINC000190706441	163155406	/nfs/dbraw/zinc/15/54/06/163155406.db2.gz	HRWTUGFNIMOYQE-UHFFFAOYSA-N	1	1	319.369	1.351	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000277413192	408935702	/nfs/dbraw/zinc/93/57/02/408935702.db2.gz	CIPCRYDABPEHCH-CYBMUJFWSA-N	1	1	318.377	1.924	20	5		DDBDMO
CC(C)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000291885409	408939765	/nfs/dbraw/zinc/93/97/65/408939765.db2.gz	QKEMPSZWWFGQGW-CYBMUJFWSA-N	1	1	307.350	1.693	20	5		DDBDMO
C[C@@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293344288	409093906	/nfs/dbraw/zinc/09/39/06/409093906.db2.gz	HINDBIVOZCRWTN-TXEJJXNPSA-N	1	1	306.366	1.558	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293865947	409196810	/nfs/dbraw/zinc/19/68/10/409196810.db2.gz	KWXPAOAENCECMZ-AWEZNQCLSA-N	1	1	307.354	1.048	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293865947	409196813	/nfs/dbraw/zinc/19/68/13/409196813.db2.gz	KWXPAOAENCECMZ-AWEZNQCLSA-N	1	1	307.354	1.048	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293865947	409196814	/nfs/dbraw/zinc/19/68/14/409196814.db2.gz	KWXPAOAENCECMZ-AWEZNQCLSA-N	1	1	307.354	1.048	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000283449731	409158470	/nfs/dbraw/zinc/15/84/70/409158470.db2.gz	DOUPHGLMWKYNHR-CYBMUJFWSA-N	1	1	321.425	1.863	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1	ZINC000279166686	409162576	/nfs/dbraw/zinc/16/25/76/409162576.db2.gz	GQYKMJMWTXYWGV-LLVKDONJSA-N	1	1	322.365	1.248	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@](C)(O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000280275885	409283179	/nfs/dbraw/zinc/28/31/79/409283179.db2.gz	YNEVBANIAGAOLW-INIZCTEOSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H](CO)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC1CCC1	ZINC000280557877	409357581	/nfs/dbraw/zinc/35/75/81/409357581.db2.gz	QYZDVEKCXQKLPP-LBPRGKRZSA-N	1	1	309.366	1.239	20	5		DDBDMO
CNC(=O)c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1	ZINC000296037714	409409237	/nfs/dbraw/zinc/40/92/37/409409237.db2.gz	PPSCJAAWLCOLCW-YHWZYXNKSA-N	1	1	318.377	1.992	20	5		DDBDMO
NC(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000317043686	164024987	/nfs/dbraw/zinc/02/49/87/164024987.db2.gz	VBVFLVVBINSNDH-VXGBXAGGSA-N	1	1	304.350	1.732	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000317712454	164028932	/nfs/dbraw/zinc/02/89/32/164028932.db2.gz	MAJFDPZOWRFMIF-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000317712454	164028934	/nfs/dbraw/zinc/02/89/34/164028934.db2.gz	MAJFDPZOWRFMIF-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
CN(C(=O)C[N@H+](C)[C@@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000352201214	164119403	/nfs/dbraw/zinc/11/94/03/164119403.db2.gz	DZENGSJKRNKFIB-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000352201214	164119404	/nfs/dbraw/zinc/11/94/04/164119404.db2.gz	DZENGSJKRNKFIB-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000408024752	164201938	/nfs/dbraw/zinc/20/19/38/164201938.db2.gz	GTRPCSFAZFIBLZ-LLVKDONJSA-N	1	1	314.345	1.996	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000331547553	409623359	/nfs/dbraw/zinc/62/33/59/409623359.db2.gz	RJEXWSJLZBASTJ-NSHDSACASA-N	1	1	305.334	1.570	20	5		DDBDMO
CC(C)[N@H+](C)C[C@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000356756812	409577116	/nfs/dbraw/zinc/57/71/16/409577116.db2.gz	BSHSTNHKQXQRGY-JTQLQIEISA-N	1	1	323.349	1.782	20	5		DDBDMO
C[N@H+](Cc1cccc(F)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304386548	409615905	/nfs/dbraw/zinc/61/59/05/409615905.db2.gz	ZRMLRFUGCALLNA-AWEZNQCLSA-N	1	1	308.313	1.423	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000345609011	409706322	/nfs/dbraw/zinc/70/63/22/409706322.db2.gz	WHTKTHIOWFCWPI-UHFFFAOYSA-N	1	1	323.397	1.875	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000346057071	409743840	/nfs/dbraw/zinc/74/38/40/409743840.db2.gz	UJAWROYQPHOHLL-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091611	410108001	/nfs/dbraw/zinc/10/80/01/410108001.db2.gz	RZYJRFAKINTBDQ-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091611	410108006	/nfs/dbraw/zinc/10/80/06/410108006.db2.gz	RZYJRFAKINTBDQ-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000352130554	410502208	/nfs/dbraw/zinc/50/22/08/410502208.db2.gz	ZTGSRFNMSOBALJ-UHFFFAOYSA-N	1	1	304.310	1.300	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)c1	ZINC000343511884	410503119	/nfs/dbraw/zinc/50/31/19/410503119.db2.gz	JGHXPOMPNDTBTQ-GWCFXTLKSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000347384813	410511873	/nfs/dbraw/zinc/51/18/73/410511873.db2.gz	ZCFKQVTVIDKXDF-CYBMUJFWSA-N	1	1	320.393	1.737	20	5		DDBDMO
CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](C)O	ZINC000352195634	410537715	/nfs/dbraw/zinc/53/77/15/410537715.db2.gz	SCARUSNGJHLICS-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](C)O	ZINC000352195634	410537722	/nfs/dbraw/zinc/53/77/22/410537722.db2.gz	SCARUSNGJHLICS-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
COC1CC([N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000352222433	410558112	/nfs/dbraw/zinc/55/81/12/410558112.db2.gz	QQZUTWDZULVTBZ-UHFFFAOYSA-N	1	1	307.350	1.951	20	5		DDBDMO
COC1CC([N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000352222433	410558119	/nfs/dbraw/zinc/55/81/19/410558119.db2.gz	QQZUTWDZULVTBZ-UHFFFAOYSA-N	1	1	307.350	1.951	20	5		DDBDMO
COC[C@H]1CC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000352227378	410562392	/nfs/dbraw/zinc/56/23/92/410562392.db2.gz	NFVBJEKNKVRNDR-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000352227378	410562397	/nfs/dbraw/zinc/56/23/97/410562397.db2.gz	NFVBJEKNKVRNDR-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC(=O)NC1CC1	ZINC000352570928	410668052	/nfs/dbraw/zinc/66/80/52/410668052.db2.gz	NVTBRVKIMVMLHI-UHFFFAOYSA-N	1	1	320.349	1.057	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC(=O)NC1CC1	ZINC000352570928	410668058	/nfs/dbraw/zinc/66/80/58/410668058.db2.gz	NVTBRVKIMVMLHI-UHFFFAOYSA-N	1	1	320.349	1.057	20	5		DDBDMO
CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000343807244	410714109	/nfs/dbraw/zinc/71/41/09/410714109.db2.gz	TURNZJDZRXJHQL-VXGBXAGGSA-N	1	1	323.397	1.948	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(S(N)(=O)=O)CC1	ZINC000330528756	410751697	/nfs/dbraw/zinc/75/16/97/410751697.db2.gz	RSHBESMXNYXOIC-JTQLQIEISA-N	1	1	313.379	1.409	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(N3CC[N@@H+]4CCOC[C@H]4C3)c21	ZINC000347866473	410764916	/nfs/dbraw/zinc/76/49/16/410764916.db2.gz	OXZPFSQGDLESCB-LLVKDONJSA-N	1	1	315.333	1.059	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(N3CC[N@H+]4CCOC[C@H]4C3)c21	ZINC000347866473	410764918	/nfs/dbraw/zinc/76/49/18/410764918.db2.gz	OXZPFSQGDLESCB-LLVKDONJSA-N	1	1	315.333	1.059	20	5		DDBDMO
C[C@H]1[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@@H+]1C	ZINC000343962357	410850039	/nfs/dbraw/zinc/85/00/39/410850039.db2.gz	BXKSCESVHMZYQB-GWCFXTLKSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343962357	410850044	/nfs/dbraw/zinc/85/00/44/410850044.db2.gz	BXKSCESVHMZYQB-GWCFXTLKSA-N	1	1	313.379	1.356	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000341165068	410908176	/nfs/dbraw/zinc/90/81/76/410908176.db2.gz	JKIFTSWBIGPKFM-LBPRGKRZSA-N	1	1	321.381	1.717	20	5		DDBDMO
COc1ccc(C[N@H+](C)C2CCN(CCO)CC2)cc1[N+](=O)[O-]	ZINC000353354549	410937947	/nfs/dbraw/zinc/93/79/47/410937947.db2.gz	PCJGNBINGNYOST-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C2CCN(CCO)CC2)cc1[N+](=O)[O-]	ZINC000353354549	410937954	/nfs/dbraw/zinc/93/79/54/410937954.db2.gz	PCJGNBINGNYOST-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000331208983	411018292	/nfs/dbraw/zinc/01/82/92/411018292.db2.gz	WHJBVOMOGOBAQI-CHWSQXEVSA-N	1	1	321.377	1.833	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356654423	411117871	/nfs/dbraw/zinc/11/78/71/411117871.db2.gz	LNOGJJCWYFLLEN-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356654423	411117872	/nfs/dbraw/zinc/11/78/72/411117872.db2.gz	LNOGJJCWYFLLEN-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
CNc1nccc(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000516313076	416720979	/nfs/dbraw/zinc/72/09/79/416720979.db2.gz	JLFPRAAGGFUALY-JTQLQIEISA-N	1	1	319.365	1.412	20	5		DDBDMO
Cc1c(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)cccc1[N+](=O)[O-]	ZINC000295633397	225068204	/nfs/dbraw/zinc/06/82/04/225068204.db2.gz	ZMECBTLPZHFAFP-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCn3c[nH+]cc3C2)n1	ZINC000350889818	306758865	/nfs/dbraw/zinc/75/88/65/306758865.db2.gz	NWAQTLGKKJPFBK-MRVPVSSYSA-N	1	1	315.293	1.305	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000361075664	418578614	/nfs/dbraw/zinc/57/86/14/418578614.db2.gz	CQBZEACTWVTGIC-GHMZBOCLSA-N	1	1	306.366	1.849	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCCCn2cc[nH+]c2C)n1	ZINC000191825431	222110585	/nfs/dbraw/zinc/11/05/85/222110585.db2.gz	BYVBAFHZJPYWFB-UHFFFAOYSA-N	1	1	320.353	1.526	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)[C@@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000375037020	418593460	/nfs/dbraw/zinc/59/34/60/418593460.db2.gz	HXURXPBZETUEKB-SMDDNHRTSA-N	1	1	318.377	1.652	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000361403198	418644588	/nfs/dbraw/zinc/64/45/88/418644588.db2.gz	NFYCZFSURSATDG-GXTWGEPZSA-N	1	1	310.350	1.180	20	5		DDBDMO
CCOc1cc(C[N@@H+](CCO)[C@@H]2CCO[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000361584685	418686185	/nfs/dbraw/zinc/68/61/85/418686185.db2.gz	FXXXBGZECLMMND-TZMCWYRMSA-N	1	1	324.377	1.965	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[NH2+]Cc3ccccc32)n1	ZINC000422779918	227172953	/nfs/dbraw/zinc/17/29/53/227172953.db2.gz	CHZYDJIYUJMRDU-UHFFFAOYSA-N	1	1	315.333	1.561	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000364933277	418825456	/nfs/dbraw/zinc/82/54/56/418825456.db2.gz	MCAKHAHZJYAURR-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(CC(=O)N2CC[NH+](C)CC2)c1F	ZINC000411130485	418872316	/nfs/dbraw/zinc/87/23/16/418872316.db2.gz	AEAJKGHVDDVLCP-UHFFFAOYSA-N	1	1	311.313	1.059	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000372733276	418897547	/nfs/dbraw/zinc/89/75/47/418897547.db2.gz	WIKCEHODRVPCBF-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCCC[NH+]1CCN(C)CC1	ZINC000298147173	228381953	/nfs/dbraw/zinc/38/19/53/228381953.db2.gz	GIAKKOMBAGBLHC-UHFFFAOYSA-N	1	1	320.393	1.271	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000417953208	419415293	/nfs/dbraw/zinc/41/52/93/419415293.db2.gz	ZDFZSAUQDOARHJ-HNNXBMFYSA-N	1	1	324.356	1.480	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000420936978	419368759	/nfs/dbraw/zinc/36/87/59/419368759.db2.gz	JFWLARRQKOJEGQ-OLZOCXBDSA-N	1	1	321.377	1.508	20	5		DDBDMO
CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCC[N@H+]1C	ZINC000421011132	419446201	/nfs/dbraw/zinc/44/62/01/419446201.db2.gz	RZYMNIVETGQFCH-OAHLLOKOSA-N	1	1	320.393	1.584	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000411909230	419470298	/nfs/dbraw/zinc/47/02/98/419470298.db2.gz	JOLQLCPTIVIZOM-BPNCWPANSA-N	1	1	323.349	1.003	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000411909230	419470306	/nfs/dbraw/zinc/47/03/06/419470306.db2.gz	JOLQLCPTIVIZOM-BPNCWPANSA-N	1	1	323.349	1.003	20	5		DDBDMO
COC(=O)[C@H]1CSCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000412092348	419649915	/nfs/dbraw/zinc/64/99/15/419649915.db2.gz	ZISQZDVNKYPDQU-CYBMUJFWSA-N	1	1	324.402	1.975	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@](C)(CN)C2CC2)c([N+](=O)[O-])c1	ZINC000430562467	420137906	/nfs/dbraw/zinc/13/79/06/420137906.db2.gz	RMYGMIGXXZPZGK-HNNXBMFYSA-N	1	1	309.366	1.699	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@H]1C	ZINC000430231955	420092328	/nfs/dbraw/zinc/09/23/28/420092328.db2.gz	DNRHJSRXBUYVDY-GWCFXTLKSA-N	1	1	308.334	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[C@H]2C[N@@H+]2CCC[C@H]2CO)nc1	ZINC000301526263	229721597	/nfs/dbraw/zinc/72/15/97/229721597.db2.gz	JFGYDYIJSBVXJC-KBPBESRZSA-N	1	1	306.366	1.415	20	5		DDBDMO
CCn1cncc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000417789206	420479117	/nfs/dbraw/zinc/47/91/17/420479117.db2.gz	IZFBAWCODMNUHA-LBPRGKRZSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1cncc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000417789206	420479121	/nfs/dbraw/zinc/47/91/21/420479121.db2.gz	IZFBAWCODMNUHA-LBPRGKRZSA-N	1	1	316.365	1.893	20	5		DDBDMO
CN(C)C(=O)C1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CCCCC1	ZINC000451404057	420599841	/nfs/dbraw/zinc/59/98/41/420599841.db2.gz	LWQXVRPZHHSGFX-UHFFFAOYSA-N	1	1	309.370	1.209	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000450953356	420568928	/nfs/dbraw/zinc/56/89/28/420568928.db2.gz	YFAGXBBNJKWTSS-UHFFFAOYSA-N	1	1	307.354	1.375	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCC[N@H+]1CCO	ZINC000452789160	420661875	/nfs/dbraw/zinc/66/18/75/420661875.db2.gz	AFWAGTRNKJGULS-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@H](CC[NH3+])C1	ZINC000443063895	420742381	/nfs/dbraw/zinc/74/23/81/420742381.db2.gz	XISDSYYZYVVQII-CHWSQXEVSA-N	1	1	320.393	1.983	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000448259367	420844881	/nfs/dbraw/zinc/84/48/81/420844881.db2.gz	DIGWFZOIKLEPSG-UHFFFAOYSA-N	1	1	317.349	1.751	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2c3ccccc3ncc2[N+](=O)[O-])C1	ZINC000487759925	421047737	/nfs/dbraw/zinc/04/77/37/421047737.db2.gz	IYHYDCWJWRKVTO-OAHLLOKOSA-N	1	1	302.334	1.043	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000456356786	421147665	/nfs/dbraw/zinc/14/76/65/421147665.db2.gz	RYUJHUOEQZMVDA-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC000489375311	421150988	/nfs/dbraw/zinc/15/09/88/421150988.db2.gz	OUUNVGKJNPIQFX-CYBMUJFWSA-N	1	1	323.397	1.288	20	5		DDBDMO
COc1cc(CNCC[N@H+]2CC[C@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000525800680	421302957	/nfs/dbraw/zinc/30/29/57/421302957.db2.gz	HDHGBZVIEKDJTN-NSHDSACASA-N	1	1	309.366	1.740	20	5		DDBDMO
COc1cc(C[NH2+]CCN2CC[C@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000525800680	421302958	/nfs/dbraw/zinc/30/29/58/421302958.db2.gz	HDHGBZVIEKDJTN-NSHDSACASA-N	1	1	309.366	1.740	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](CCO)C[C@@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965934	421432161	/nfs/dbraw/zinc/43/21/61/421432161.db2.gz	QFJRQASTGQOUDI-QWHCGFSZSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](CCO)C[C@@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965934	421432163	/nfs/dbraw/zinc/43/21/63/421432163.db2.gz	QFJRQASTGQOUDI-QWHCGFSZSA-N	1	1	321.377	1.223	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)CC(F)(F)C[NH3+]	ZINC000514611126	421440291	/nfs/dbraw/zinc/44/02/91/421440291.db2.gz	ABORXPDOYGVLQB-UHFFFAOYSA-N	1	1	303.265	1.204	20	5		DDBDMO
CNc1nccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000563547530	421520374	/nfs/dbraw/zinc/52/03/74/421520374.db2.gz	VNYFWYKXLQCKLU-QWRGUYRKSA-N	1	1	321.381	1.586	20	5		DDBDMO
CC[N@@H+]1CCc2nc(NC(=O)c3c[nH]nc3[N+](=O)[O-])sc2C1	ZINC000554836036	421663005	/nfs/dbraw/zinc/66/30/05/421663005.db2.gz	WXNLNRYPVCBZIT-UHFFFAOYSA-N	1	1	322.350	1.405	20	5		DDBDMO
CC[N@H+]1CCc2nc(NC(=O)c3c[nH]nc3[N+](=O)[O-])sc2C1	ZINC000554836036	421663009	/nfs/dbraw/zinc/66/30/09/421663009.db2.gz	WXNLNRYPVCBZIT-UHFFFAOYSA-N	1	1	322.350	1.405	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCOCC1	ZINC000533310309	421671167	/nfs/dbraw/zinc/67/11/67/421671167.db2.gz	HAZHFDCHKFGDKB-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2C(N)=O)CC1	ZINC000520153246	421738358	/nfs/dbraw/zinc/73/83/58/421738358.db2.gz	WQJAGTLPJAODEM-UHFFFAOYSA-N	1	1	321.381	1.399	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000522167698	421818736	/nfs/dbraw/zinc/81/87/36/421818736.db2.gz	YXZPBYLRAOAIBT-JTQLQIEISA-N	1	1	308.338	1.156	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000521114778	421774957	/nfs/dbraw/zinc/77/49/57/421774957.db2.gz	JMPCYWCIZJSTEI-GFCCVEGCSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CCO1	ZINC000581984177	422082419	/nfs/dbraw/zinc/08/24/19/422082419.db2.gz	QWQOJHMGCBRLSC-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CCO1	ZINC000581984177	422082427	/nfs/dbraw/zinc/08/24/27/422082427.db2.gz	QWQOJHMGCBRLSC-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
CC[C@]1(O)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000602983365	422439981	/nfs/dbraw/zinc/43/99/81/422439981.db2.gz	IWZIWTXEPXHMNH-BBRMVZONSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[N@@H+]1CCO[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000186017223	263395209	/nfs/dbraw/zinc/39/52/09/263395209.db2.gz	FWLHAEHFIFPBQC-LBPRGKRZSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[N@H+]1CCO[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000186017223	263395212	/nfs/dbraw/zinc/39/52/12/263395212.db2.gz	FWLHAEHFIFPBQC-LBPRGKRZSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000344617088	272071198	/nfs/dbraw/zinc/07/11/98/272071198.db2.gz	QDNTVTJHJKHVBL-LLVKDONJSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000344910193	272139164	/nfs/dbraw/zinc/13/91/64/272139164.db2.gz	KDPIFTVKMYOAHF-NSHDSACASA-N	1	1	322.365	1.018	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000346050862	272399433	/nfs/dbraw/zinc/39/94/33/272399433.db2.gz	RIDGHJDJRIVRCO-RYUDHWBXSA-N	1	1	323.397	1.431	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000346053865	272399917	/nfs/dbraw/zinc/39/99/17/272399917.db2.gz	UJAWROYQPHOHLL-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
COC(=O)c1cc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc(C)c1[N+](=O)[O-]	ZINC000450775702	274000503	/nfs/dbraw/zinc/00/05/03/274000503.db2.gz	GLPAZDGJUNVACV-SMDDNHRTSA-N	1	1	319.361	1.830	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000285989935	274004202	/nfs/dbraw/zinc/00/42/02/274004202.db2.gz	CPFDUMKQNWKDJJ-JTQLQIEISA-N	1	1	306.322	1.061	20	5		DDBDMO
C[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@@H+]1CCO	ZINC000419010343	274369502	/nfs/dbraw/zinc/36/95/02/274369502.db2.gz	XSEZIOCNOCUCNK-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000419010343	274369504	/nfs/dbraw/zinc/36/95/04/274369504.db2.gz	XSEZIOCNOCUCNK-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H]1C[NH+](C[C@@H]2CCCN2c2ncc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000160496504	274586145	/nfs/dbraw/zinc/58/61/45/274586145.db2.gz	GIFDVNLPQKWKKR-AVGNSLFASA-N	1	1	321.381	1.463	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000177022556	276181508	/nfs/dbraw/zinc/18/15/08/276181508.db2.gz	HKNNZNIFEJLEQE-NSHDSACASA-N	1	1	309.370	1.193	20	5		DDBDMO
CC[NH+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000285512451	276203726	/nfs/dbraw/zinc/20/37/26/276203726.db2.gz	GCZSGHTZVTTXGV-UHFFFAOYSA-N	1	1	308.338	1.227	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@@H]1C	ZINC000194725240	277224896	/nfs/dbraw/zinc/22/48/96/277224896.db2.gz	CQASJPDDPSNCAA-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C[C@@H]1C	ZINC000194725240	277224897	/nfs/dbraw/zinc/22/48/97/277224897.db2.gz	CQASJPDDPSNCAA-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
C[C@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000420591463	279354998	/nfs/dbraw/zinc/35/49/98/279354998.db2.gz	AERHAAXFAVQEIU-LLVKDONJSA-N	1	1	322.365	1.074	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@@H]21	ZINC000408026856	290087270	/nfs/dbraw/zinc/08/72/70/290087270.db2.gz	JJAOSVJPLOKGTO-LSDHHAIUSA-N	1	1	318.377	1.472	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@H]2CCCN2c2c([N+](=O)[O-])ncn2C)C[C@@H](C)O1	ZINC000408361176	297027871	/nfs/dbraw/zinc/02/78/71/297027871.db2.gz	CWTZINGHSUPRHL-JHJVBQTASA-N	1	1	323.397	1.406	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[N@H+](CC(C)C)CC2)c1[N+](=O)[O-]	ZINC000362999695	300196952	/nfs/dbraw/zinc/19/69/52/300196952.db2.gz	IWLWOUDDLBWDML-UHFFFAOYSA-N	1	1	323.397	1.441	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@@H]21	ZINC000364300811	300372393	/nfs/dbraw/zinc/37/23/93/300372393.db2.gz	GURFOZRAFNSNMS-ZJUUUORDSA-N	1	1	307.379	1.834	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000367399650	300842652	/nfs/dbraw/zinc/84/26/52/300842652.db2.gz	AOGMOZPJWIFKJD-OAHLLOKOSA-N	1	1	321.377	1.510	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412265	301022173	/nfs/dbraw/zinc/02/21/73/301022173.db2.gz	RMJWPXATFKIWBM-SMDDNHRTSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412265	301022175	/nfs/dbraw/zinc/02/21/75/301022175.db2.gz	RMJWPXATFKIWBM-SMDDNHRTSA-N	1	1	319.361	1.687	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000369144148	301136443	/nfs/dbraw/zinc/13/64/43/301136443.db2.gz	OFQGBABHUQSSKC-WDEREUQCSA-N	1	1	321.381	1.627	20	5		DDBDMO
CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000370525361	301357100	/nfs/dbraw/zinc/35/71/00/301357100.db2.gz	FJDNTQXYOGQUIU-OAHLLOKOSA-N	1	1	324.381	1.740	20	5		DDBDMO
CS(=O)(=O)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000355427559	306799849	/nfs/dbraw/zinc/79/98/49/306799849.db2.gz	XTXLDSVLTPFUEO-UHFFFAOYSA-N	1	1	302.327	1.401	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079653	302140247	/nfs/dbraw/zinc/14/02/47/302140247.db2.gz	CVGROMQSKOONJR-FAAHXZRKSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000377079653	302140250	/nfs/dbraw/zinc/14/02/50/302140250.db2.gz	CVGROMQSKOONJR-FAAHXZRKSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079653	302140253	/nfs/dbraw/zinc/14/02/53/302140253.db2.gz	CVGROMQSKOONJR-FAAHXZRKSA-N	1	1	303.362	1.431	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+]3CCC[C@H]3C2)c2nonc21	ZINC000377481551	302183641	/nfs/dbraw/zinc/18/36/41/302183641.db2.gz	MDOSRLPCIJVLIT-JTQLQIEISA-N	1	1	303.322	1.806	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000378546579	302333542	/nfs/dbraw/zinc/33/35/42/302333542.db2.gz	WQCBQZTZKHDLHZ-GHMZBOCLSA-N	1	1	304.350	1.534	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000398673270	302360083	/nfs/dbraw/zinc/36/00/83/302360083.db2.gz	FXZAOQHBAIJIHM-YUTCNCBUSA-N	1	1	319.361	1.287	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000516612364	302793747	/nfs/dbraw/zinc/79/37/47/302793747.db2.gz	HLQWMFUAIQHDOL-UHFFFAOYSA-N	1	1	315.333	1.209	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000362091391	307014144	/nfs/dbraw/zinc/01/41/44/307014144.db2.gz	UQBLICXTDQIMAN-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1	ZINC000364891094	307052596	/nfs/dbraw/zinc/05/25/96/307052596.db2.gz	BPWVGGOURQYAAD-UHFFFAOYSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cc1nccc(C[N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000373642623	307193740	/nfs/dbraw/zinc/19/37/40/307193740.db2.gz	VFJCHBJHZRLSRF-ZDUSSCGKSA-N	1	1	302.338	1.727	20	5		DDBDMO
Cc1nccc(C[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000373642623	307193741	/nfs/dbraw/zinc/19/37/41/307193741.db2.gz	VFJCHBJHZRLSRF-ZDUSSCGKSA-N	1	1	302.338	1.727	20	5		DDBDMO
CC1(C)C[NH+](CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000565168849	308022406	/nfs/dbraw/zinc/02/24/06/308022406.db2.gz	BSXRROLILSMORN-UHFFFAOYSA-N	1	1	306.366	1.465	20	5		DDBDMO
CC(C)O[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000567789881	308095807	/nfs/dbraw/zinc/09/58/07/308095807.db2.gz	HEXZUEIPAYKJFJ-CYBMUJFWSA-N	1	1	307.350	1.693	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000195436475	325712884	/nfs/dbraw/zinc/71/28/84/325712884.db2.gz	ZCZSQVNTMZYZEQ-UHFFFAOYSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000444180100	534061262	/nfs/dbraw/zinc/06/12/62/534061262.db2.gz	FNZLAGDTGQHSLG-NSHDSACASA-N	1	1	323.349	1.596	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000331973057	527880902	/nfs/dbraw/zinc/88/09/02/527880902.db2.gz	LDGVTNTYGBTVCG-CYBMUJFWSA-N	1	1	308.334	1.807	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000331973057	527880903	/nfs/dbraw/zinc/88/09/03/527880903.db2.gz	LDGVTNTYGBTVCG-CYBMUJFWSA-N	1	1	308.334	1.807	20	5		DDBDMO
CCn1cc(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cn1	ZINC000776275240	698090598	/nfs/dbraw/zinc/09/05/98/698090598.db2.gz	GAHJCOXVCAIFJQ-OAHLLOKOSA-N	1	1	304.350	1.977	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CNC(=O)O2)CC1	ZINC000782004997	698672527	/nfs/dbraw/zinc/67/25/27/698672527.db2.gz	UHTDEDGOOYQETH-UHFFFAOYSA-N	1	1	321.333	1.678	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2C[C@]2(CO)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000782633750	698755831	/nfs/dbraw/zinc/75/58/31/698755831.db2.gz	QCPMKODWIWVCLM-XHDPSFHLSA-N	1	1	305.334	1.238	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CCC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000783918778	698892490	/nfs/dbraw/zinc/89/24/90/698892490.db2.gz	LVVCVCXTKRQZSF-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@H+](C2CC2)C1	ZINC000786949630	699181968	/nfs/dbraw/zinc/18/19/68/699181968.db2.gz	KLYVINAQOFKZSO-LBPRGKRZSA-N	1	1	304.350	1.486	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH+]2C[C@@H](CO)[C@H](CO)C2)c1	ZINC000704787713	699238232	/nfs/dbraw/zinc/23/82/32/699238232.db2.gz	KGWMTHYDMGQLJM-QWRGUYRKSA-N	1	1	300.742	1.281	20	5		DDBDMO
CC(C)C[N@@H+](C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000726589350	699369685	/nfs/dbraw/zinc/36/96/85/699369685.db2.gz	WTHSAZOFNXPZSH-UHFFFAOYSA-N	1	1	320.349	1.909	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000729919533	699491652	/nfs/dbraw/zinc/49/16/52/699491652.db2.gz	QEZYITLJKZKBFX-LLVKDONJSA-N	1	1	306.366	1.485	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000730806822	699516332	/nfs/dbraw/zinc/51/63/32/699516332.db2.gz	MNKGRPPDMQMJOS-NSHDSACASA-N	1	1	305.338	1.375	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])C1)C(=O)OC(C)(C)C	ZINC000791052055	699608887	/nfs/dbraw/zinc/60/88/87/699608887.db2.gz	KKBYPSYKQSPQGV-LBPRGKRZSA-N	1	1	301.387	1.842	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](C[C@@H](O)C2CC2)CC1	ZINC000736219981	699720745	/nfs/dbraw/zinc/72/07/45/699720745.db2.gz	GSWFLYURUOLMKN-OAHLLOKOSA-N	1	1	319.361	1.124	20	5		DDBDMO
Cc1nn(C[N@H+]2CCOC[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000753984880	700473849	/nfs/dbraw/zinc/47/38/49/700473849.db2.gz	FTYSJQTXAZZMFO-SNVBAGLBSA-N	1	1	305.338	1.574	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCOC[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000753984880	700473851	/nfs/dbraw/zinc/47/38/51/700473851.db2.gz	FTYSJQTXAZZMFO-SNVBAGLBSA-N	1	1	305.338	1.574	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@@H+]4CCOC[C@H]4C3)sc2c1	ZINC000754080373	700481373	/nfs/dbraw/zinc/48/13/73/700481373.db2.gz	DNHUYZYOTBXRAY-LLVKDONJSA-N	1	1	320.374	1.725	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4CCOC[C@H]4C3)sc2c1	ZINC000754080373	700481374	/nfs/dbraw/zinc/48/13/74/700481374.db2.gz	DNHUYZYOTBXRAY-LLVKDONJSA-N	1	1	320.374	1.725	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248483	700557890	/nfs/dbraw/zinc/55/78/90/700557890.db2.gz	NUTDEGVQLGLRCS-UKRRQHHQSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248483	700557891	/nfs/dbraw/zinc/55/78/91/700557891.db2.gz	NUTDEGVQLGLRCS-UKRRQHHQSA-N	1	1	307.350	1.358	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC(=O)N1	ZINC000839670013	701774981	/nfs/dbraw/zinc/77/49/81/701774981.db2.gz	REVCMAGDSHXZLG-DZGCQCFKSA-N	1	1	321.377	1.617	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839682856	701782395	/nfs/dbraw/zinc/78/23/95/701782395.db2.gz	ANUWQWHOPWDAFT-KBUPBQIOSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839682856	701782398	/nfs/dbraw/zinc/78/23/98/701782398.db2.gz	ANUWQWHOPWDAFT-KBUPBQIOSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839682856	701782402	/nfs/dbraw/zinc/78/24/02/701782402.db2.gz	ANUWQWHOPWDAFT-KBUPBQIOSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867952749	701851088	/nfs/dbraw/zinc/85/10/88/701851088.db2.gz	FAIQSYZSPNXVIQ-INIZCTEOSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867960560	701855348	/nfs/dbraw/zinc/85/53/48/701855348.db2.gz	MUJYPLABZPQWTE-OAHLLOKOSA-N	1	1	307.350	1.406	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@@H]2C1	ZINC000868519332	702173693	/nfs/dbraw/zinc/17/36/93/702173693.db2.gz	AOSYIMLSSGVSQW-DGCLKSJQSA-N	1	1	307.325	1.439	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)c(N)c([N+](=O)[O-])c1	ZINC000816949334	702233281	/nfs/dbraw/zinc/23/32/81/702233281.db2.gz	TUIPTCMYZSUVIR-GWCFXTLKSA-N	1	1	304.350	1.262	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000813635679	702388106	/nfs/dbraw/zinc/38/81/06/702388106.db2.gz	BOYYUGPEEXVCTC-MRXNPFEDSA-N	1	1	318.377	1.486	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000879533663	706711165	/nfs/dbraw/zinc/71/11/65/706711165.db2.gz	IOJLESWFFJSPPJ-ZMLRMANQSA-N	1	1	303.318	1.202	20	5		DDBDMO
COC(=O)N1CC([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000850446279	703731724	/nfs/dbraw/zinc/73/17/24/703731724.db2.gz	RGBMBQRYFASPMT-SECBINFHSA-N	1	1	309.322	1.705	20	5		DDBDMO
CC(C)CC(=O)N1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000879759938	706782489	/nfs/dbraw/zinc/78/24/89/706782489.db2.gz	JNPZCAQPYXGUCQ-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
CC(C)CC(=O)N1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000879759938	706782493	/nfs/dbraw/zinc/78/24/93/706782493.db2.gz	JNPZCAQPYXGUCQ-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCC2	ZINC000818971350	704038970	/nfs/dbraw/zinc/03/89/70/704038970.db2.gz	UPIJTTCFYZHHNQ-GXFFZTMASA-N	1	1	317.349	1.517	20	5		DDBDMO
CC[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870861545	704147899	/nfs/dbraw/zinc/14/78/99/704147899.db2.gz	BPPDIXCZNGWPER-DZGCQCFKSA-N	1	1	307.350	1.406	20	5		DDBDMO
CCOC1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000870948056	704178828	/nfs/dbraw/zinc/17/88/28/704178828.db2.gz	CGJGGBHMXBWDIG-INIZCTEOSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3nc4ccccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC000819953322	704192162	/nfs/dbraw/zinc/19/21/62/704192162.db2.gz	OAXJPXLRJWAXJF-NWDGAFQWSA-N	1	1	301.350	1.773	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867188239	706918854	/nfs/dbraw/zinc/91/88/54/706918854.db2.gz	WEFPIJJBOZJQGQ-QWRGUYRKSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000874822362	705181792	/nfs/dbraw/zinc/18/17/92/705181792.db2.gz	ARBBDDZLZGIVMT-ZIAGYGMSSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)CC[C@H]21	ZINC000827328218	705976376	/nfs/dbraw/zinc/97/63/76/705976376.db2.gz	DFQWIIHZFAYDNH-DGCLKSJQSA-N	1	1	321.381	1.079	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2ccnn2C)C1	ZINC000877976683	706256085	/nfs/dbraw/zinc/25/60/85/706256085.db2.gz	YAJUFZGHYKAIBB-CYBMUJFWSA-N	1	1	318.381	1.713	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000830015877	706438043	/nfs/dbraw/zinc/43/80/43/706438043.db2.gz	GFDYBIMLQOTUNX-LKFCYVNXSA-N	1	1	307.325	1.946	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN2CCO[C@H]1C2	ZINC000830292901	706491372	/nfs/dbraw/zinc/49/13/72/706491372.db2.gz	UENYDHHNEJPHFK-JYJNAYRXSA-N	1	1	321.377	1.033	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000865999066	706589958	/nfs/dbraw/zinc/58/99/58/706589958.db2.gz	XMGPYIWADCELKA-NSHDSACASA-N	1	1	311.386	1.377	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2C[C@@H]3C[C@H]2CN3c2ccccc2)c1	ZINC000880189959	706905982	/nfs/dbraw/zinc/90/59/82/706905982.db2.gz	LPCUIXNUDORRFR-GJZGRUSLSA-N	1	1	313.361	1.754	20	5		DDBDMO
NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCOCC1	ZINC000880396092	706963517	/nfs/dbraw/zinc/96/35/17/706963517.db2.gz	XKRPGOFWSHULDB-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C1CCOCC1	ZINC000880396092	706963518	/nfs/dbraw/zinc/96/35/18/706963518.db2.gz	XKRPGOFWSHULDB-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCOC[C@H]1OC	ZINC000880425995	706970259	/nfs/dbraw/zinc/97/02/59/706970259.db2.gz	RFROUJYYEIGOJR-DZGCQCFKSA-N	1	1	310.350	1.839	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880529356	707005978	/nfs/dbraw/zinc/00/59/78/707005978.db2.gz	ALMXZUWXDKTOLB-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880529356	707005981	/nfs/dbraw/zinc/00/59/81/707005981.db2.gz	ALMXZUWXDKTOLB-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)c([N+](=O)[O-])cc3F)C[C@@H]21	ZINC000834310662	707027807	/nfs/dbraw/zinc/02/78/07/707027807.db2.gz	SKMKRWRHCBFOLS-OQPBUACISA-N	1	1	311.288	1.649	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)Cn2cc(C[NH+]3CCCC3)nn2)c1	ZINC000881410575	707244006	/nfs/dbraw/zinc/24/40/06/707244006.db2.gz	GCLWGUPWKAEXHO-OAHLLOKOSA-N	1	1	317.349	1.516	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](O)c1ccnn1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000927127092	712945093	/nfs/dbraw/zinc/94/50/93/712945093.db2.gz	QWQSNJOQHJYYDB-ZANVPECISA-N	1	1	308.313	1.852	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872781504	707597919	/nfs/dbraw/zinc/59/79/19/707597919.db2.gz	UQKWXPOCQJOZJA-GHMZBOCLSA-N	1	1	302.338	1.310	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)C[C@]2(C)C1	ZINC000896912609	708181115	/nfs/dbraw/zinc/18/11/15/708181115.db2.gz	ALXCRBIYGPCUAC-ABAIWWIYSA-N	1	1	306.366	1.057	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000897415827	708320262	/nfs/dbraw/zinc/32/02/62/708320262.db2.gz	JVFDKFURMVEISP-UHFFFAOYSA-N	1	1	309.366	1.256	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886212844	708716377	/nfs/dbraw/zinc/71/63/77/708716377.db2.gz	GWRMCJKZERTTKF-ZDUSSCGKSA-N	1	1	320.393	1.675	20	5		DDBDMO
Cc1ccc(NC(=O)C2C[NH+]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-]	ZINC000899910882	709235006	/nfs/dbraw/zinc/23/50/06/709235006.db2.gz	KUPBOADZPBIPDN-CYBMUJFWSA-N	1	1	305.334	1.562	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000889778945	709631621	/nfs/dbraw/zinc/63/16/21/709631621.db2.gz	CEBSESVAAWCXKD-LSDHHAIUSA-N	1	1	319.361	1.266	20	5		DDBDMO
CC(C)(CCC(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)[N+](=O)[O-]	ZINC000928084740	713122257	/nfs/dbraw/zinc/12/22/57/713122257.db2.gz	XPRKLSFGLPZEPD-NWDGAFQWSA-N	1	1	315.439	1.518	20	5		DDBDMO
COc1c(O)ccc(C[N@H+](C)CCn2cccn2)c1[N+](=O)[O-]	ZINC000892033179	710357080	/nfs/dbraw/zinc/35/70/80/710357080.db2.gz	YZNVPTWXXCZXSH-UHFFFAOYSA-N	1	1	306.322	1.638	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+](C)CCn2cccn2)c1[N+](=O)[O-]	ZINC000892033179	710357082	/nfs/dbraw/zinc/35/70/82/710357082.db2.gz	YZNVPTWXXCZXSH-UHFFFAOYSA-N	1	1	306.322	1.638	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000928431806	713192949	/nfs/dbraw/zinc/19/29/49/713192949.db2.gz	HAPXCSUVRZWZBK-KWQFWETISA-N	1	1	311.313	1.565	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H]([NH+]3CCC3)C2)cc1	ZINC000903214998	711068913	/nfs/dbraw/zinc/06/89/13/711068913.db2.gz	DBESIQNIKFCWBM-LBPRGKRZSA-N	1	1	311.363	1.064	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000895245597	711463421	/nfs/dbraw/zinc/46/34/21/711463421.db2.gz	GOMIIKIAYJDLQL-ZYHUDNBSSA-N	1	1	310.402	1.166	20	5		DDBDMO
COc1ccc2c(c1)ncc([N+](=O)[O-])c2NC[C@H]1CC[N@H+]1C	ZINC000895768860	711600946	/nfs/dbraw/zinc/60/09/46/711600946.db2.gz	JMSSXCJBCQFUFA-SNVBAGLBSA-N	1	1	302.334	1.690	20	5		DDBDMO
Cc1c(C(=O)N[C@H]2CCC[N@H+](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000918395281	713541527	/nfs/dbraw/zinc/54/15/27/713541527.db2.gz	MWSPVBUXFGMYOE-JTQLQIEISA-N	1	1	322.321	1.635	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)C1(O)CCCC1)C2	ZINC000930100335	713756183	/nfs/dbraw/zinc/75/61/83/713756183.db2.gz	SKNMWCJOYFOZAU-OAHLLOKOSA-N	1	1	306.362	1.619	20	5		DDBDMO
C[C@@H]1CCCN(C(=O)OC[C@@H]2CCCC[N@@H+]2CC[N+](=O)[O-])C1	ZINC000930471139	713843496	/nfs/dbraw/zinc/84/34/96/713843496.db2.gz	VBELWUKJZFWQQP-KGLIPLIRSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[C@@H]1CCCN(C(=O)OC[C@@H]2CCCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000930471139	713843498	/nfs/dbraw/zinc/84/34/98/713843498.db2.gz	VBELWUKJZFWQQP-KGLIPLIRSA-N	1	1	313.398	1.986	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@]2(C1)CCC[N@H+](CC[N+](=O)[O-])C2	ZINC000930490221	713848123	/nfs/dbraw/zinc/84/81/23/713848123.db2.gz	ZQWFHLUPEZOPAQ-OAHLLOKOSA-N	1	1	313.398	1.986	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@]2(C1)CCC[N@@H+](CC[N+](=O)[O-])C2	ZINC000930490221	713848126	/nfs/dbraw/zinc/84/81/26/713848126.db2.gz	ZQWFHLUPEZOPAQ-OAHLLOKOSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000930651588	713887426	/nfs/dbraw/zinc/88/74/26/713887426.db2.gz	YVXJTMNOYPWJIS-GJZGRUSLSA-N	1	1	303.362	1.909	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2ccns2)CC1	ZINC000930680604	713894199	/nfs/dbraw/zinc/89/41/99/713894199.db2.gz	KEWGJOAXDUSZCT-UHFFFAOYSA-N	1	1	319.390	1.811	20	5		DDBDMO
C[C@@H]1[C@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043577	713989469	/nfs/dbraw/zinc/98/94/69/713989469.db2.gz	QQULNZKQEVDCKO-TZMCWYRMSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043577	713989470	/nfs/dbraw/zinc/98/94/70/713989470.db2.gz	QQULNZKQEVDCKO-TZMCWYRMSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000923271098	714291842	/nfs/dbraw/zinc/29/18/42/714291842.db2.gz	LAQZZQZBPDCEEW-CMPLNLGQSA-N	1	1	304.350	1.486	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000923330842	714316989	/nfs/dbraw/zinc/31/69/89/714316989.db2.gz	CJSDOWYUUOJWJF-MIGQKNRLSA-N	1	1	305.378	1.687	20	5		DDBDMO
[NH3+]CC[C@H]1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000923481781	714370087	/nfs/dbraw/zinc/37/00/87/714370087.db2.gz	LOPMASGGSAWMTA-SWLSCSKDSA-N	1	1	318.377	1.371	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000933252499	714547572	/nfs/dbraw/zinc/54/75/72/714547572.db2.gz	WZCZONOXYVYTPU-OAHLLOKOSA-N	1	1	322.409	1.419	20	5		DDBDMO
CC(C)C[C@@H]1CN(C)CC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000933252499	714547576	/nfs/dbraw/zinc/54/75/76/714547576.db2.gz	WZCZONOXYVYTPU-OAHLLOKOSA-N	1	1	322.409	1.419	20	5		DDBDMO
CC(C)C[C@@H]1CN(C)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000933252499	714547577	/nfs/dbraw/zinc/54/75/77/714547577.db2.gz	WZCZONOXYVYTPU-OAHLLOKOSA-N	1	1	322.409	1.419	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)cs1	ZINC000934258097	714777762	/nfs/dbraw/zinc/77/77/62/714777762.db2.gz	PWLFCIIGQNUBOP-OLZOCXBDSA-N	1	1	311.407	1.687	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](Cc3nccs3)C2)c1	ZINC000934333746	714796932	/nfs/dbraw/zinc/79/69/32/714796932.db2.gz	QVYVEUAYTZZXPY-LLVKDONJSA-N	1	1	307.379	1.812	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)n1	ZINC001164774244	721286070	/nfs/dbraw/zinc/28/60/70/721286070.db2.gz	YDXMAUJYSMMPTE-UHFFFAOYSA-N	1	1	303.366	1.615	20	5		DDBDMO
Cc1cnc(N2CC[NH+](C[C@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC000610283862	721901546	/nfs/dbraw/zinc/90/15/46/721901546.db2.gz	IZJHEKKIVBLHIC-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
[NH3+][C@@H](CC(F)F)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001211643207	736333213	/nfs/dbraw/zinc/33/32/13/736333213.db2.gz	UEBSAHJMRUTYNJ-YFKPBYRVSA-N	1	1	303.200	1.834	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1nc(C2CC2)nc(Cl)c1[N+](=O)[O-]	ZINC001167351069	733271779	/nfs/dbraw/zinc/27/17/79/733271779.db2.gz	AUAAZVMETFBMLB-UHFFFAOYSA-N	1	1	321.728	1.039	20	5		DDBDMO
Cc1nc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)sc1C	ZINC001022063884	734368235	/nfs/dbraw/zinc/36/82/35/734368235.db2.gz	NSSRMXONFGWAEN-WRWGMCAJSA-N	1	1	324.406	1.162	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775849	736853394	/nfs/dbraw/zinc/85/33/94/736853394.db2.gz	OGGWQCQAJADFSU-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CC3CCCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775849	736853398	/nfs/dbraw/zinc/85/33/98/736853398.db2.gz	OGGWQCQAJADFSU-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3CCCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775849	736853403	/nfs/dbraw/zinc/85/34/03/736853403.db2.gz	OGGWQCQAJADFSU-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C[C@H](O)C(F)(F)F)c1[N+](=O)[O-]	ZINC001181399793	743191083	/nfs/dbraw/zinc/19/10/83/743191083.db2.gz	NGMQXTYBQPJWNJ-QMMMGPOBSA-N	1	1	310.228	1.322	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1cn[nH]c1	ZINC001031559531	747033651	/nfs/dbraw/zinc/03/36/51/747033651.db2.gz	QHPJZIADPIQGGO-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3C[C@@H](CO)[C@H](CCO)C3)nc2c1	ZINC001198754686	747599671	/nfs/dbraw/zinc/59/96/71/747599671.db2.gz	VLPXWCDZUSVHHR-MNOVXSKESA-N	1	1	321.333	1.159	20	5		DDBDMO
O=C(CCc1cnc[nH]1)NCC[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC001128986346	750687380	/nfs/dbraw/zinc/68/73/80/750687380.db2.gz	SIQQUNOQQJAHQH-UHFFFAOYSA-N	1	1	317.349	1.157	20	5		DDBDMO
Cc1cc(-n2cnc(C[NH3+])n2)c([N+](=O)[O-])cc1Br	ZINC001168756223	750692349	/nfs/dbraw/zinc/69/23/49/750692349.db2.gz	BSFIMXKOFACMIN-UHFFFAOYSA-N	1	1	312.127	1.705	20	5		DDBDMO
CC(C)C[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001040700296	762652566	/nfs/dbraw/zinc/65/25/66/762652566.db2.gz	LMLGAUDOCJAEQA-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cs1	ZINC001086084563	760944857	/nfs/dbraw/zinc/94/48/57/760944857.db2.gz	VWOWVDVOMRNJMQ-YXCITZCRSA-N	1	1	323.418	1.706	20	5		DDBDMO
C[NH+](C)CCCCC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001148360111	773456122	/nfs/dbraw/zinc/45/61/22/773456122.db2.gz	ORAYQNZWDYRUIE-UHFFFAOYSA-N	1	1	322.409	1.533	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001093770679	775067054	/nfs/dbraw/zinc/06/70/54/775067054.db2.gz	CSKWCVQUTXIXMV-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001093840670	775125973	/nfs/dbraw/zinc/12/59/73/775125973.db2.gz	PGDHGKGWCMHRHM-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCCN2CC[N@H+]3C[C@@H](F)C[C@H]3C2)c1	ZINC001176776794	778235813	/nfs/dbraw/zinc/23/58/13/778235813.db2.gz	AUIITABGHHAIKD-JSGCOSHPSA-N	1	1	309.341	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCN3C[C@@H](F)C[C@H]3C2)c1	ZINC001176776794	778235825	/nfs/dbraw/zinc/23/58/25/778235825.db2.gz	AUIITABGHHAIKD-JSGCOSHPSA-N	1	1	309.341	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCN3C[C@@H](F)C[C@H]3C2)c1	ZINC001176776794	778235826	/nfs/dbraw/zinc/23/58/26/778235826.db2.gz	AUIITABGHHAIKD-JSGCOSHPSA-N	1	1	309.341	1.702	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC001119984889	781709122	/nfs/dbraw/zinc/70/91/22/781709122.db2.gz	WZNLULNCDVLPPQ-OLZOCXBDSA-N	1	1	306.366	1.334	20	5		DDBDMO
C[N@H+](CCNC(=O)COC(C)(C)C)Cc1cccc([N+](=O)[O-])c1	ZINC001267193038	837509192	/nfs/dbraw/zinc/50/91/92/837509192.db2.gz	XAAZENTZXFWPAR-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
C[N@@H+](CCNC(=O)COC(C)(C)C)Cc1cccc([N+](=O)[O-])c1	ZINC001267193038	837509202	/nfs/dbraw/zinc/50/92/02/837509202.db2.gz	XAAZENTZXFWPAR-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC001122111976	858689043	/nfs/dbraw/zinc/68/90/43/858689043.db2.gz	PWAOQURFPIUQHF-CQSZACIVSA-N	1	1	320.393	1.921	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001140660975	860669768	/nfs/dbraw/zinc/66/97/68/860669768.db2.gz	MNYNZHIKPKBWNQ-MRVPVSSYSA-N	1	1	315.761	1.528	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001140660975	860669772	/nfs/dbraw/zinc/66/97/72/860669772.db2.gz	MNYNZHIKPKBWNQ-MRVPVSSYSA-N	1	1	315.761	1.528	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC001152052965	863134930	/nfs/dbraw/zinc/13/49/30/863134930.db2.gz	KXPBCSXWNDWWLS-GFCCVEGCSA-N	1	1	321.381	1.845	20	5		DDBDMO
Cc1[nH+]c(N)ccc1CNc1ncc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC001156974315	863490089	/nfs/dbraw/zinc/49/00/89/863490089.db2.gz	HTIWYZBIVCLLEQ-UHFFFAOYSA-N	1	1	304.266	1.796	20	5		DDBDMO
CCOc1nc(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC001157271747	863701343	/nfs/dbraw/zinc/70/13/43/863701343.db2.gz	JEPFBZOOKHSRLO-DGCLKSJQSA-N	1	1	306.366	1.919	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001329562580	863731880	/nfs/dbraw/zinc/73/18/80/863731880.db2.gz	VIHQMWRTESEIKL-IAQYHMDHSA-N	1	1	303.362	1.820	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1ccccc1)c1cc([N+](=O)[O-])cc[n+]1[O-]	ZINC001157551582	863914596	/nfs/dbraw/zinc/91/45/96/863914596.db2.gz	LHEMLVZZDOKVFG-UHFFFAOYSA-N	1	1	316.361	1.796	20	5		DDBDMO
O=C(NCCC[NH2+]C/C=C\c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761387	864111664	/nfs/dbraw/zinc/11/16/64/864111664.db2.gz	QDNNXRARWMYTDP-JFCGUDLGSA-N	1	1	303.362	1.461	20	5		DDBDMO
Cn1cc(COC(=O)[C@@H]2CCC[N@H+]2C2CCCC2)c([N+](=O)[O-])n1	ZINC001332271091	865713141	/nfs/dbraw/zinc/71/31/41/865713141.db2.gz	QXDMZYAZBWVLDW-ZDUSSCGKSA-N	1	1	322.365	1.779	20	5		DDBDMO
COc1cc(N[C@@H]2CCC[C@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160722167	866067093	/nfs/dbraw/zinc/06/70/93/866067093.db2.gz	FKVHXZISEQSIFB-VXGBXAGGSA-N	1	1	322.365	1.664	20	5		DDBDMO
Cc1c(F)cnc(NCCC[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC001161703477	866909297	/nfs/dbraw/zinc/90/92/97/866909297.db2.gz	GAHBPMIYPCVDJK-UHFFFAOYSA-N	1	1	311.361	1.487	20	5		DDBDMO
Cc1ncc(Nc2cc(C=C[NH+](C)C)c([N+](=O)[O-])cn2)c(=O)[nH]1	ZINC001162303597	867426994	/nfs/dbraw/zinc/42/69/94/867426994.db2.gz	VUIRFZBACHRLPY-SGUJLRQBSA-N	1	1	316.321	1.332	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H]1C[C@@H]3COC[C@@H]3O1)CC2	ZINC001334613745	867710515	/nfs/dbraw/zinc/71/05/15/867710515.db2.gz	JGWGQTPHQHFIPT-KBMXLJTQSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@@H]3COC[C@@H]3O1)CC2	ZINC001334613745	867710519	/nfs/dbraw/zinc/71/05/19/867710519.db2.gz	JGWGQTPHQHFIPT-KBMXLJTQSA-N	1	1	304.346	1.757	20	5		DDBDMO
Cc1cnc(N2CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC001163117555	868114349	/nfs/dbraw/zinc/11/43/49/868114349.db2.gz	JXSFACOFHUVIHF-GFCCVEGCSA-N	1	1	322.365	1.403	20	5		DDBDMO
O=C(NCCC1(C[NH2+]CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494536	869231329	/nfs/dbraw/zinc/23/13/29/869231329.db2.gz	LEOIAWGNDDUVQA-ZIAGYGMSSA-N	1	1	309.410	1.718	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1	ZINC001226213566	882284402	/nfs/dbraw/zinc/28/44/02/882284402.db2.gz	DVSAKKVLQWEQQP-GFCCVEGCSA-N	1	1	308.334	1.783	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC001226257492	882310463	/nfs/dbraw/zinc/31/04/63/882310463.db2.gz	GLISUGMRHSOQLJ-SNVBAGLBSA-N	1	1	301.730	1.743	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC001226257492	882310479	/nfs/dbraw/zinc/31/04/79/882310479.db2.gz	GLISUGMRHSOQLJ-SNVBAGLBSA-N	1	1	301.730	1.743	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2CCn3c(C)[nH+]cc3C2)n1	ZINC001165385516	869559231	/nfs/dbraw/zinc/55/92/31/869559231.db2.gz	QCXYOIXTBUXWGU-UHFFFAOYSA-N	1	1	304.310	1.227	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3c(F)cccc3[N+](=O)[O-])[C@H]2C1	ZINC001338463882	869992915	/nfs/dbraw/zinc/99/29/15/869992915.db2.gz	NPNWPZZTTRJZBA-NHCYSSNCSA-N	1	1	307.325	1.804	20	5		DDBDMO
Nc1cc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)ncc1[N+](=O)[O-]	ZINC001339824726	870715559	/nfs/dbraw/zinc/71/55/59/870715559.db2.gz	RKDIJPVPWZTSNG-CMPLNLGQSA-N	1	1	309.395	1.564	20	5		DDBDMO
COCc1ccc(C[N@@H+](C)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC001317448359	870859624	/nfs/dbraw/zinc/85/96/24/870859624.db2.gz	SFCFHZLBNOKIAB-HUUCEWRRSA-N	1	1	321.377	1.046	20	5		DDBDMO
COCc1ccc(C[N@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001317448359	870859635	/nfs/dbraw/zinc/85/96/35/870859635.db2.gz	SFCFHZLBNOKIAB-HUUCEWRRSA-N	1	1	321.377	1.046	20	5		DDBDMO
COCc1ccc(C[N@@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001317448359	870859653	/nfs/dbraw/zinc/85/96/53/870859653.db2.gz	SFCFHZLBNOKIAB-HUUCEWRRSA-N	1	1	321.377	1.046	20	5		DDBDMO
CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccon1	ZINC001317685674	871408542	/nfs/dbraw/zinc/40/85/42/871408542.db2.gz	AQZTVQTXHNDOJX-CHWSQXEVSA-N	1	1	310.354	1.057	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]C/C=C/Cl)CC1	ZINC001205229355	871446520	/nfs/dbraw/zinc/44/65/20/871446520.db2.gz	ALRZSBRSLFRRJV-IYODYBDTSA-N	1	1	301.774	1.232	20	5		DDBDMO
O=C(NCC12CCC[NH+](CCC1)C2)c1cc(O)cc([N+](=O)[O-])c1	ZINC001347861193	874292335	/nfs/dbraw/zinc/29/23/35/874292335.db2.gz	GCADBUYVILXXRN-UHFFFAOYSA-N	1	1	319.361	1.906	20	5		DDBDMO
Cn1c(CCC[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)(C)C)CC1	ZINC001350549494	875752919	/nfs/dbraw/zinc/75/29/19/875752919.db2.gz	MRMKMJLYUSYGRN-UHFFFAOYSA-N	1	1	324.429	1.335	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC001350606269	875781613	/nfs/dbraw/zinc/78/16/13/875781613.db2.gz	RJITZYHAESPYMA-NSHDSACASA-N	1	1	307.354	1.783	20	5		DDBDMO
O=C(NCCCCC[NH+]1CCNCC1)c1cccc([N+](=O)[O-])c1	ZINC001358213640	880369887	/nfs/dbraw/zinc/36/98/87/880369887.db2.gz	QRTWWCAEXXPPED-UHFFFAOYSA-N	1	1	320.393	1.400	20	5		DDBDMO
COC(=O)c1cc(COC2C[NH+](C(C)C)C2)cc([N+](=O)[O-])c1	ZINC001223689328	881059314	/nfs/dbraw/zinc/05/93/14/881059314.db2.gz	YRLHUBFHVLERAB-UHFFFAOYSA-N	1	1	308.334	1.991	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Oc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001233863727	887401106	/nfs/dbraw/zinc/40/11/06/887401106.db2.gz	YUTQRSQOIYHHSR-LLVKDONJSA-N	1	1	309.322	1.640	20	5		DDBDMO
COC(=O)c1ccc(OCC[N@@H+]2CC[C@@H](OC)C2)cc1[N+](=O)[O-]	ZINC001234056094	887598677	/nfs/dbraw/zinc/59/86/77/887598677.db2.gz	CSPDCWRHZQDURF-GFCCVEGCSA-N	1	1	324.333	1.481	20	5		DDBDMO
CC(C)(C(=O)N1CCC[N@H+]2CCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC001251498073	894713887	/nfs/dbraw/zinc/71/38/87/894713887.db2.gz	GTJMBIYMTZQVNL-GFCCVEGCSA-N	1	1	321.381	1.223	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)CC[C@@H]2C1	ZINC001254559274	896501834	/nfs/dbraw/zinc/50/18/34/896501834.db2.gz	JYIGVSUVLYJDND-TZMCWYRMSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)CC[C@@H]2C1	ZINC001254559274	896501848	/nfs/dbraw/zinc/50/18/48/896501848.db2.gz	JYIGVSUVLYJDND-TZMCWYRMSA-N	1	1	303.362	1.832	20	5		DDBDMO
COCCN1CC[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254592936	896520194	/nfs/dbraw/zinc/52/01/94/896520194.db2.gz	HGOASBWURAMGOY-INIZCTEOSA-N	1	1	305.378	1.326	20	5		DDBDMO
O=C1NC[C@@H]2CC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]12	ZINC001254602094	896524393	/nfs/dbraw/zinc/52/43/93/896524393.db2.gz	AYUIHCAFDWUGFH-CQDKDKBSSA-N	1	1	301.346	1.130	20	5		DDBDMO
CC(=O)N1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1C	ZINC001254606851	896527634	/nfs/dbraw/zinc/52/76/34/896527634.db2.gz	IQWMVIYCBAQFNT-BDJLRTHQSA-N	1	1	303.362	1.615	20	5		DDBDMO
CC(=O)N1CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1C	ZINC001254606851	896527646	/nfs/dbraw/zinc/52/76/46/896527646.db2.gz	IQWMVIYCBAQFNT-BDJLRTHQSA-N	1	1	303.362	1.615	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)NCc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC001263074194	900481881	/nfs/dbraw/zinc/48/18/81/900481881.db2.gz	ZQSAPGJGYPWFFI-MELADBBJSA-N	1	1	318.377	1.734	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000286540059	219043327	/nfs/dbraw/zinc/04/33/27/219043327.db2.gz	RUSARBMIQOVBKN-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000248969474	282122375	/nfs/dbraw/zinc/12/23/75/282122375.db2.gz	SKIBTXCYIIUYPB-FZMZJTMJSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H](CN1CC[NH+](C)CC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278590844	214259420	/nfs/dbraw/zinc/25/94/20/214259420.db2.gz	YWZGFEMHFIVVOZ-NSHDSACASA-N	1	1	318.381	1.519	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000614663074	361969961	/nfs/dbraw/zinc/96/99/61/361969961.db2.gz	VRGZQSWUKOJGIO-HNNXBMFYSA-N	1	1	308.334	1.713	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452073135	231290370	/nfs/dbraw/zinc/29/03/70/231290370.db2.gz	YKGHVHLIJPLEDC-ZWNOBZJWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452073135	231290374	/nfs/dbraw/zinc/29/03/74/231290374.db2.gz	YKGHVHLIJPLEDC-ZWNOBZJWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000615037695	362123801	/nfs/dbraw/zinc/12/38/01/362123801.db2.gz	IYVPUEPMPMCFLQ-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000615037695	362123803	/nfs/dbraw/zinc/12/38/03/362123803.db2.gz	IYVPUEPMPMCFLQ-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
CCc1ncc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cn1	ZINC000414448791	529753368	/nfs/dbraw/zinc/75/33/68/529753368.db2.gz	SROIWUBSQMBZPZ-UHFFFAOYSA-N	1	1	316.365	1.981	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000615873069	362473392	/nfs/dbraw/zinc/47/33/92/362473392.db2.gz	RIVSSEKLGHGIIR-OAHLLOKOSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[NH+](C)[C@@H]1CCC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000272663212	210067987	/nfs/dbraw/zinc/06/79/87/210067987.db2.gz	IFNLNRGLFWEVJV-NWDGAFQWSA-N	1	1	307.350	1.903	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000272621872	210023435	/nfs/dbraw/zinc/02/34/35/210023435.db2.gz	UVHHPDIMZDTJPU-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000150712920	186059109	/nfs/dbraw/zinc/05/91/09/186059109.db2.gz	KZYVZOTYAKBQNH-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
C[N@@H+](CCn1cccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181868746	186212939	/nfs/dbraw/zinc/21/29/39/186212939.db2.gz	AOPHEOIMUYJGTD-CYBMUJFWSA-N	1	1	320.349	1.163	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCC[N@H+]2C)cc([N+](=O)[O-])c1OC	ZINC000265975348	186344559	/nfs/dbraw/zinc/34/45/59/186344559.db2.gz	XBFJPTWTYRPIPH-NSHDSACASA-N	1	1	323.349	1.436	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000172831565	198155500	/nfs/dbraw/zinc/15/55/00/198155500.db2.gz	OLTQPEBYUCUXOC-GFCCVEGCSA-N	1	1	323.397	1.583	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000072713433	191219053	/nfs/dbraw/zinc/21/90/53/191219053.db2.gz	NCZPOONWYQDALE-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000072713433	191219056	/nfs/dbraw/zinc/21/90/56/191219056.db2.gz	NCZPOONWYQDALE-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H]1CCC[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000072875154	191246626	/nfs/dbraw/zinc/24/66/26/191246626.db2.gz	NLLPAKBRCSDUTE-VIFPVBQESA-N	1	1	307.306	1.746	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000072875154	191246628	/nfs/dbraw/zinc/24/66/28/191246628.db2.gz	NLLPAKBRCSDUTE-VIFPVBQESA-N	1	1	307.306	1.746	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000057159662	352802350	/nfs/dbraw/zinc/80/23/50/352802350.db2.gz	XIYBSZJHIJRCLO-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000491561347	234205026	/nfs/dbraw/zinc/20/50/26/234205026.db2.gz	JRXKHSIFJNDSNL-SYAFZNNESA-N	1	1	301.346	1.961	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](CCO)CC2CC2)c1	ZINC000064516646	352939924	/nfs/dbraw/zinc/93/99/24/352939924.db2.gz	MAVGZPRZFQLEOU-CQSZACIVSA-N	1	1	310.350	1.039	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000069485737	353163099	/nfs/dbraw/zinc/16/30/99/353163099.db2.gz	DCMQZXFWQYRQAG-LBPRGKRZSA-N	1	1	323.393	1.992	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000069528738	353166296	/nfs/dbraw/zinc/16/62/96/353166296.db2.gz	BBBAJQHDBJYMDE-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc(C)ccc1[N+](=O)[O-]	ZINC000173917226	198268180	/nfs/dbraw/zinc/26/81/80/198268180.db2.gz	FRVOXBCVSSZXSE-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
Cc1nn(C)c(N2CC[NH+](CCOC(C)C)CC2)c1[N+](=O)[O-]	ZINC000074773413	353330081	/nfs/dbraw/zinc/33/00/81/353330081.db2.gz	BGDQCOYZBKVPCZ-UHFFFAOYSA-N	1	1	311.386	1.184	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000077209572	353457002	/nfs/dbraw/zinc/45/70/02/353457002.db2.gz	BPFUKFMFVLLGDQ-UHFFFAOYSA-N	1	1	305.313	1.794	20	5		DDBDMO
CN(C)C(=O)C[N@@H+]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000080947209	353638404	/nfs/dbraw/zinc/63/84/04/353638404.db2.gz	QGQFIXYFRIXKJX-UHFFFAOYSA-N	1	1	324.356	1.334	20	5		DDBDMO
CN(C)C(=O)C[N@H+]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000080947209	353638405	/nfs/dbraw/zinc/63/84/05/353638405.db2.gz	QGQFIXYFRIXKJX-UHFFFAOYSA-N	1	1	324.356	1.334	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCC(O)(C(F)(F)F)CC2)n1	ZINC000089970337	353786148	/nfs/dbraw/zinc/78/61/48/353786148.db2.gz	HROBPQXBOGBDPG-UHFFFAOYSA-N	1	1	308.260	1.181	20	5		DDBDMO
CCc1nn(C)c(N[C@@H]2CCC[N@@H+](CCOC)C2)c1[N+](=O)[O-]	ZINC000094156437	353911669	/nfs/dbraw/zinc/91/16/69/353911669.db2.gz	MQUVWEQQMSKBNE-LLVKDONJSA-N	1	1	311.386	1.413	20	5		DDBDMO
[NH3+][C@H]1CCC[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000124876260	354042030	/nfs/dbraw/zinc/04/20/30/354042030.db2.gz	FFKVGDUWMIBWBY-DTWKUNHWSA-N	1	1	317.342	1.282	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](C)CCO1	ZINC000129904248	354087065	/nfs/dbraw/zinc/08/70/65/354087065.db2.gz	ITJFZHNJHZWWOT-GXFFZTMASA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCO1	ZINC000129904248	354087069	/nfs/dbraw/zinc/08/70/69/354087069.db2.gz	ITJFZHNJHZWWOT-GXFFZTMASA-N	1	1	308.338	1.435	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000153631533	354199799	/nfs/dbraw/zinc/19/97/99/354199799.db2.gz	RWDOWLRFFWZHFZ-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000153631533	354199803	/nfs/dbraw/zinc/19/98/03/354199803.db2.gz	RWDOWLRFFWZHFZ-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000617897645	363361296	/nfs/dbraw/zinc/36/12/96/363361296.db2.gz	CHZPGMGJJKHNIH-GFCCVEGCSA-N	1	1	323.349	1.954	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000617897645	363361302	/nfs/dbraw/zinc/36/13/02/363361302.db2.gz	CHZPGMGJJKHNIH-GFCCVEGCSA-N	1	1	323.349	1.954	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038198	354223889	/nfs/dbraw/zinc/22/38/89/354223889.db2.gz	HONAWWFSCWSRTM-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038198	354223893	/nfs/dbraw/zinc/22/38/93/354223893.db2.gz	HONAWWFSCWSRTM-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
CCc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157276799	354224524	/nfs/dbraw/zinc/22/45/24/354224524.db2.gz	QJMLRCIQRMYOIY-ABAIWWIYSA-N	1	1	321.377	1.606	20	5		DDBDMO
CCc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157276799	354224529	/nfs/dbraw/zinc/22/45/29/354224529.db2.gz	QJMLRCIQRMYOIY-ABAIWWIYSA-N	1	1	321.377	1.606	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000588823604	354939415	/nfs/dbraw/zinc/93/94/15/354939415.db2.gz	LDXZRTJOCAWLMB-GFCCVEGCSA-N	1	1	309.370	1.031	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000590697141	355150141	/nfs/dbraw/zinc/15/01/41/355150141.db2.gz	GHKFQGBSUVFVMR-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000590697141	355150147	/nfs/dbraw/zinc/15/01/47/355150147.db2.gz	GHKFQGBSUVFVMR-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CCNc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000590776511	355176688	/nfs/dbraw/zinc/17/66/88/355176688.db2.gz	FHNFWSAJSCLNIO-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1	ZINC000591054807	355238790	/nfs/dbraw/zinc/23/87/90/355238790.db2.gz	DNSXFDCRCPXOCS-IUODEOHRSA-N	1	1	310.350	1.039	20	5		DDBDMO
CC(C)[C@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CC=CC2	ZINC000592446778	355586766	/nfs/dbraw/zinc/58/67/66/355586766.db2.gz	XCNPQBAADKEHJK-HUUCEWRRSA-N	1	1	320.393	1.829	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000593029175	355774169	/nfs/dbraw/zinc/77/41/69/355774169.db2.gz	WGPZXEZSNRGWPK-LBPRGKRZSA-N	1	1	321.377	1.907	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cnn(C)c2)c1	ZINC000593025035	355772326	/nfs/dbraw/zinc/77/23/26/355772326.db2.gz	RHCLMNQKJHPWEQ-SNVBAGLBSA-N	1	1	318.333	1.966	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000593070263	355786543	/nfs/dbraw/zinc/78/65/43/355786543.db2.gz	VYTWCBRCFGPTNF-CABCVRRESA-N	1	1	324.377	1.835	20	5		DDBDMO
[NH3+]CC1(CCNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000593914982	356057187	/nfs/dbraw/zinc/05/71/87/356057187.db2.gz	RYWWPNMPHJMCED-UHFFFAOYSA-N	1	1	303.322	1.330	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c1	ZINC000594603130	356261916	/nfs/dbraw/zinc/26/19/16/356261916.db2.gz	KNMDSTPCNUHVEK-UONOGXRCSA-N	1	1	314.345	1.398	20	5		DDBDMO
COC[C@@](C)(CC(=O)OC)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595384344	356473970	/nfs/dbraw/zinc/47/39/70/356473970.db2.gz	JBSLOGKHDREVAE-CQSZACIVSA-N	1	1	314.313	1.792	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@H]1COCCO1	ZINC000595738008	356629379	/nfs/dbraw/zinc/62/93/79/356629379.db2.gz	UUDJBLBKBVADAM-FZMZJTMJSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1COCCO1	ZINC000595738008	356629381	/nfs/dbraw/zinc/62/93/81/356629381.db2.gz	UUDJBLBKBVADAM-FZMZJTMJSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000595767186	356644110	/nfs/dbraw/zinc/64/41/10/356644110.db2.gz	WPDQIRKVYFZDSF-WCQYABFASA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595756499	356639006	/nfs/dbraw/zinc/63/90/06/356639006.db2.gz	GMPCFPUGDNDKMI-MLGOLLRUSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595756499	356639011	/nfs/dbraw/zinc/63/90/11/356639011.db2.gz	GMPCFPUGDNDKMI-MLGOLLRUSA-N	1	1	319.361	1.810	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000595856719	356679056	/nfs/dbraw/zinc/67/90/56/356679056.db2.gz	PZOVWVAINUUASK-TXEJJXNPSA-N	1	1	308.334	1.987	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@]1(C)CO	ZINC000595856990	356679781	/nfs/dbraw/zinc/67/97/81/356679781.db2.gz	HERBBDFSXKPMRO-INWMFGNUSA-N	1	1	324.377	1.285	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596143855	356790026	/nfs/dbraw/zinc/79/00/26/356790026.db2.gz	WJUBMDGLWLXDTA-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596166793	356799465	/nfs/dbraw/zinc/79/94/65/356799465.db2.gz	WQOGNJRHMGBWAQ-BXUZGUMPSA-N	1	1	318.377	1.614	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000597859577	357361143	/nfs/dbraw/zinc/36/11/43/357361143.db2.gz	VFNYJBUBRWPORO-SNVBAGLBSA-N	1	1	324.356	1.919	20	5		DDBDMO
CCN(C(=O)c1ccc(NC)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000597943903	357392522	/nfs/dbraw/zinc/39/25/22/357392522.db2.gz	ASTZXXGEDFTUMA-GFCCVEGCSA-N	1	1	306.366	1.803	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000598589081	357643485	/nfs/dbraw/zinc/64/34/85/357643485.db2.gz	CVUFVKBDWALIFM-RYUDHWBXSA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000598599433	357648622	/nfs/dbraw/zinc/64/86/22/357648622.db2.gz	OCIOIOVKVWRQLK-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000598599433	357648625	/nfs/dbraw/zinc/64/86/25/357648625.db2.gz	OCIOIOVKVWRQLK-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2CC[C@@H](O)C2)c(C(F)(F)F)c1	ZINC000599176767	357840182	/nfs/dbraw/zinc/84/01/82/357840182.db2.gz	XGBJSYLRPJWXDQ-SECBINFHSA-N	1	1	320.271	1.487	20	5		DDBDMO
COc1cncc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000599387776	357919301	/nfs/dbraw/zinc/91/93/01/357919301.db2.gz	RRNCCTJHDOQPDB-UHFFFAOYSA-N	1	1	318.337	1.427	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CC1(C)COC1)c1ccc([N+](=O)[O-])cc1	ZINC000599571558	357978918	/nfs/dbraw/zinc/97/89/18/357978918.db2.gz	LMPFIESBKZHEJQ-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC1(C)COC1)c1ccc([N+](=O)[O-])cc1	ZINC000599571558	357978922	/nfs/dbraw/zinc/97/89/22/357978922.db2.gz	LMPFIESBKZHEJQ-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1C[C@@H](O)C1	ZINC000599674123	358019244	/nfs/dbraw/zinc/01/92/44/358019244.db2.gz	YMWHOYNNBQAFQJ-TXEJJXNPSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC([NH+]2CCOCC2)CC1	ZINC000600111388	358126727	/nfs/dbraw/zinc/12/67/27/358126727.db2.gz	HVMLVHCGUNCPMZ-UHFFFAOYSA-N	1	1	319.361	1.532	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000600315467	358193984	/nfs/dbraw/zinc/19/39/84/358193984.db2.gz	TVRDUTYDWMIBLM-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000600536361	358250340	/nfs/dbraw/zinc/25/03/40/358250340.db2.gz	SNTFYKWADJIZEK-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000600692045	358284428	/nfs/dbraw/zinc/28/44/28/358284428.db2.gz	RUIWBKLHZNNGIE-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601123815	358411490	/nfs/dbraw/zinc/41/14/90/358411490.db2.gz	KSKHZSVDJCHLGQ-UHFFFAOYSA-N	1	1	312.345	1.676	20	5		DDBDMO
O=C1NC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CCN12	ZINC000601125523	358412734	/nfs/dbraw/zinc/41/27/34/358412734.db2.gz	HQYMPIZVHSIYAC-LLVKDONJSA-N	1	1	313.317	1.357	20	5		DDBDMO
O=C1NCCC[C@H]1CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601173603	358432830	/nfs/dbraw/zinc/43/28/30/358432830.db2.gz	DOSQNLHPJXOQKI-JTQLQIEISA-N	1	1	300.318	1.503	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c([N+](=O)[O-])n1	ZINC000602476908	359003597	/nfs/dbraw/zinc/00/35/97/359003597.db2.gz	XTHGIVIPWASGJC-GFCCVEGCSA-N	1	1	321.381	1.163	20	5		DDBDMO
Cn1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])n1	ZINC000602484133	359010343	/nfs/dbraw/zinc/01/03/43/359010343.db2.gz	HPIFYHOSWNSOLR-WFASDCNBSA-N	1	1	319.409	1.777	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](c2ccncc2)C1	ZINC000602834591	359226238	/nfs/dbraw/zinc/22/62/38/359226238.db2.gz	ULJGAACBBUHLQY-CQSZACIVSA-N	1	1	301.350	1.984	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@H]1CCCOC1	ZINC000602851686	359239357	/nfs/dbraw/zinc/23/93/57/359239357.db2.gz	CAFQMLHOOUUXRD-UONOGXRCSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@@H](C)OC2(CCOCC2)C1	ZINC000602823054	359217607	/nfs/dbraw/zinc/21/76/07/359217607.db2.gz	VQPNNXBFFDUINY-GFCCVEGCSA-N	1	1	324.381	1.370	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@](C)(CO)C1	ZINC000602964441	359328118	/nfs/dbraw/zinc/32/81/18/359328118.db2.gz	PNLVSYXNQSMROH-HOTGVXAUSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]1C(C)(C)C	ZINC000603143332	359432356	/nfs/dbraw/zinc/43/23/56/359432356.db2.gz	SRVVMEKKUOGDGS-ZDUSSCGKSA-N	1	1	323.397	1.370	20	5		DDBDMO
O=[N+]([O-])c1ccccc1Cn1cc(C[N@H+]2CCC[C@H]2CO)nn1	ZINC000603187273	359466924	/nfs/dbraw/zinc/46/69/24/359466924.db2.gz	PXAVPMNXWAZCEW-AWEZNQCLSA-N	1	1	317.349	1.191	20	5		DDBDMO
O=[N+]([O-])c1ccccc1Cn1cc(C[N@@H+]2CCC[C@H]2CO)nn1	ZINC000603187273	359466927	/nfs/dbraw/zinc/46/69/27/359466927.db2.gz	PXAVPMNXWAZCEW-AWEZNQCLSA-N	1	1	317.349	1.191	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000186749875	200003560	/nfs/dbraw/zinc/00/35/60/200003560.db2.gz	SQBHGEHCFHMHML-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccco1	ZINC000186755292	200003889	/nfs/dbraw/zinc/00/38/89/200003889.db2.gz	OHQWHQPLBHTXDX-NSHDSACASA-N	1	1	320.305	1.321	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000186934837	200034059	/nfs/dbraw/zinc/03/40/59/200034059.db2.gz	XDMOSLODHHBDPO-GFCCVEGCSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000186955050	200037451	/nfs/dbraw/zinc/03/74/51/200037451.db2.gz	VCEOYVBCGKHQMJ-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000609883750	360360030	/nfs/dbraw/zinc/36/00/30/360360030.db2.gz	STYNPGBLBZSYSP-VIFPVBQESA-N	1	1	307.306	1.272	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)[C@H](C)C1	ZINC000610177832	360388913	/nfs/dbraw/zinc/38/89/13/360388913.db2.gz	HUXVWSPPVVOONH-YPMHNXCESA-N	1	1	308.382	1.736	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](CCO)C1	ZINC000610213850	360392086	/nfs/dbraw/zinc/39/20/86/360392086.db2.gz	WYGNJOUZVOJJDX-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](CCO)C1	ZINC000610213850	360392089	/nfs/dbraw/zinc/39/20/89/360392089.db2.gz	WYGNJOUZVOJJDX-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCCO)C1CC1	ZINC000610391282	360424400	/nfs/dbraw/zinc/42/44/00/360424400.db2.gz	HKFRXQLZYBNRNW-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCCO)C1CC1	ZINC000610391282	360424402	/nfs/dbraw/zinc/42/44/02/360424402.db2.gz	HKFRXQLZYBNRNW-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@H+](C[C@H](O)C1CC1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610572869	360473882	/nfs/dbraw/zinc/47/38/82/360473882.db2.gz	PCWYNLYEAVHLFY-ZFWWWQNUSA-N	1	1	310.350	1.037	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000610910069	360570639	/nfs/dbraw/zinc/57/06/39/360570639.db2.gz	NJHXJLHTICBRFG-LBPRGKRZSA-N	1	1	309.341	1.640	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)c1	ZINC000610912567	360570787	/nfs/dbraw/zinc/57/07/87/360570787.db2.gz	YMUVKGTWURJEJS-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)c1	ZINC000610912567	360570791	/nfs/dbraw/zinc/57/07/91/360570791.db2.gz	YMUVKGTWURJEJS-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000610922440	360572241	/nfs/dbraw/zinc/57/22/41/360572241.db2.gz	BALPZUZKTOJCGC-NSHDSACASA-N	1	1	321.381	1.655	20	5		DDBDMO
C[N@H+]1CCCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000610930180	360573939	/nfs/dbraw/zinc/57/39/39/360573939.db2.gz	SHMHRCMSVQBJTG-UHFFFAOYSA-N	1	1	307.350	1.504	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1C	ZINC000611091851	360621464	/nfs/dbraw/zinc/62/14/64/360621464.db2.gz	AFNPTAZZDAAUEG-GFCCVEGCSA-N	1	1	321.377	1.987	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252705	363945807	/nfs/dbraw/zinc/94/58/07/363945807.db2.gz	NOMUVPMXMVGGIY-TZMCWYRMSA-N	1	1	307.325	1.853	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCCS(=O)(=O)C1	ZINC000093632927	193277142	/nfs/dbraw/zinc/27/71/42/193277142.db2.gz	NIANBVFRRUCONW-LLVKDONJSA-N	1	1	318.782	1.915	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C)CC[N@H+]1C[C@H](C)O	ZINC000266309727	205255854	/nfs/dbraw/zinc/25/58/54/205255854.db2.gz	DIKFHRDHFWDIDC-QWHCGFSZSA-N	1	1	308.382	1.580	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1	ZINC000288503201	220185421	/nfs/dbraw/zinc/18/54/21/220185421.db2.gz	SFJOYBSYMOJDKB-ZDUSSCGKSA-N	1	1	321.377	1.690	20	5		DDBDMO
CO[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000267804795	206295087	/nfs/dbraw/zinc/29/50/87/206295087.db2.gz	LPOZHXREVDABKO-ZDUSSCGKSA-N	1	1	305.334	1.205	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000267804795	206295089	/nfs/dbraw/zinc/29/50/89/206295089.db2.gz	LPOZHXREVDABKO-ZDUSSCGKSA-N	1	1	305.334	1.205	20	5		DDBDMO
C[C@H](CCCC[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000336848697	249254196	/nfs/dbraw/zinc/25/41/96/249254196.db2.gz	MEZLOGVADGQADU-SECBINFHSA-N	1	1	319.358	1.530	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CCC[C@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000104850677	194046788	/nfs/dbraw/zinc/04/67/88/194046788.db2.gz	COHNZNGJWDLJOS-NSHDSACASA-N	1	1	320.393	1.947	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)c2ncc([N+](=O)[O-])cc2Cl)[N@@H+](C)C1	ZINC000284665802	218123744	/nfs/dbraw/zinc/12/37/44/218123744.db2.gz	YGNKRSDNKJTFMH-QWRGUYRKSA-N	1	1	314.773	1.799	20	5		DDBDMO
CC[N@@H+](CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C1CC1	ZINC000338824980	250152320	/nfs/dbraw/zinc/15/23/20/250152320.db2.gz	OYCAWNQQPGTCQO-UHFFFAOYSA-N	1	1	309.370	1.127	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000159440902	197354651	/nfs/dbraw/zinc/35/46/51/197354651.db2.gz	LWQMDCPVJAABLM-BDAKNGLRSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000159440902	197354653	/nfs/dbraw/zinc/35/46/53/197354653.db2.gz	LWQMDCPVJAABLM-BDAKNGLRSA-N	1	1	315.757	1.888	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@H]1CC(N)=O	ZINC000339138257	250309821	/nfs/dbraw/zinc/30/98/21/250309821.db2.gz	ZTPJQTQEMANPEP-LBPRGKRZSA-N	1	1	307.350	1.833	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000339140070	250311784	/nfs/dbraw/zinc/31/17/84/250311784.db2.gz	LDAUOCDJSNKIDX-ZDUSSCGKSA-N	1	1	307.350	1.704	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023398	207174165	/nfs/dbraw/zinc/17/41/65/207174165.db2.gz	QIGAAVSCRRJLHH-MNOVXSKESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023398	207174168	/nfs/dbraw/zinc/17/41/68/207174168.db2.gz	QIGAAVSCRRJLHH-MNOVXSKESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023398	207174171	/nfs/dbraw/zinc/17/41/71/207174171.db2.gz	QIGAAVSCRRJLHH-MNOVXSKESA-N	1	1	307.354	1.183	20	5		DDBDMO
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)[C@@H]1CSC[NH2+]1	ZINC000269071098	207218727	/nfs/dbraw/zinc/21/87/27/207218727.db2.gz	FHOOCIIVLCFYFP-JTQLQIEISA-N	1	1	301.755	1.527	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000063758281	184287948	/nfs/dbraw/zinc/28/79/48/184287948.db2.gz	DHUIVWJCBNAETD-CYBMUJFWSA-N	1	1	323.397	1.420	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccco2)cc1	ZINC000342347432	207369850	/nfs/dbraw/zinc/36/98/50/207369850.db2.gz	TWZUMHFWDGEXGV-UHFFFAOYSA-N	1	1	310.331	1.751	20	5		DDBDMO
COC(=O)[C@H]1CN(Cc2ccc(C)c([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000414493342	533006578	/nfs/dbraw/zinc/00/65/78/533006578.db2.gz	IFMNTMWLVBLGPQ-CQSZACIVSA-N	1	1	321.377	1.440	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCO)CC1CC1	ZINC000352467463	285072079	/nfs/dbraw/zinc/07/20/79/285072079.db2.gz	KVCAQDNYVDOJFJ-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
O=C1[C@@H]([N@@H+](CCO)CC2CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000352468358	285072681	/nfs/dbraw/zinc/07/26/81/285072681.db2.gz	ROSAXQKVPKRIKD-HNNXBMFYSA-N	1	1	319.361	1.404	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)[C@H](C)C1	ZINC000288627594	220302251	/nfs/dbraw/zinc/30/22/51/220302251.db2.gz	YGPJIFAQUAGHRG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)[C@H](C)C1	ZINC000288627594	220302252	/nfs/dbraw/zinc/30/22/52/220302252.db2.gz	YGPJIFAQUAGHRG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000286530195	219038765	/nfs/dbraw/zinc/03/87/65/219038765.db2.gz	NQFRHLXOIABREJ-TZMCWYRMSA-N	1	1	310.350	1.827	20	5		DDBDMO
CN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000352700715	285238927	/nfs/dbraw/zinc/23/89/27/285238927.db2.gz	UFJJWJOORWPDPX-ZDUSSCGKSA-N	1	1	320.349	1.086	20	5		DDBDMO
O=C(NCCC[C@@H]1CCC[NH2+]1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000294798262	224228368	/nfs/dbraw/zinc/22/83/68/224228368.db2.gz	IDNUSMGRQWVROL-JTQLQIEISA-N	1	1	317.349	1.733	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444644157	533617785	/nfs/dbraw/zinc/61/77/85/533617785.db2.gz	UVCGRVXYJSAQCA-OAHLLOKOSA-N	1	1	318.333	1.856	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444644157	533617790	/nfs/dbraw/zinc/61/77/90/533617790.db2.gz	UVCGRVXYJSAQCA-OAHLLOKOSA-N	1	1	318.333	1.856	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000068203187	406622538	/nfs/dbraw/zinc/62/25/38/406622538.db2.gz	OWWUOIZQMYLQAR-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000048907707	407109395	/nfs/dbraw/zinc/10/93/95/407109395.db2.gz	ZESNOVVKERVJHV-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000048907707	407109397	/nfs/dbraw/zinc/10/93/97/407109397.db2.gz	ZESNOVVKERVJHV-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
COCC[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000054353710	407183595	/nfs/dbraw/zinc/18/35/95/407183595.db2.gz	QPIAMHRCXCSKSH-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
COCC[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000054353710	407183596	/nfs/dbraw/zinc/18/35/96/407183596.db2.gz	QPIAMHRCXCSKSH-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
NC(=O)N1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000102190894	407320877	/nfs/dbraw/zinc/32/08/77/407320877.db2.gz	QRCCZKKZDFXIRR-UHFFFAOYSA-N	1	1	308.338	1.060	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H]1CCCO1	ZINC000102770665	407326629	/nfs/dbraw/zinc/32/66/29/407326629.db2.gz	LMVWOVDOTBGQNP-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H]1CCCO1	ZINC000102770665	407326631	/nfs/dbraw/zinc/32/66/31/407326631.db2.gz	LMVWOVDOTBGQNP-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000107890888	407381352	/nfs/dbraw/zinc/38/13/52/407381352.db2.gz	MMEWSCYBWIFWLI-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000185706665	407481728	/nfs/dbraw/zinc/48/17/28/407481728.db2.gz	VSZXEHAUDPPJOV-LBPRGKRZSA-N	1	1	308.338	1.108	20	5		DDBDMO
COc1ccc(OCC[N@H+](C)[C@@H]2CCN(C)C2=O)c([N+](=O)[O-])c1	ZINC000266541157	407552685	/nfs/dbraw/zinc/55/26/85/407552685.db2.gz	PTWNSMBUSNPSPT-GFCCVEGCSA-N	1	1	323.349	1.145	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@@H]2CCN(C)C2=O)c([N+](=O)[O-])c1	ZINC000266541157	407552686	/nfs/dbraw/zinc/55/26/86/407552686.db2.gz	PTWNSMBUSNPSPT-GFCCVEGCSA-N	1	1	323.349	1.145	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC(C)(C)O	ZINC000114727965	407607569	/nfs/dbraw/zinc/60/75/69/407607569.db2.gz	HMHSSWACGGDLDK-UHFFFAOYSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H]1C[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC[NH2+]1	ZINC000261783996	407614074	/nfs/dbraw/zinc/61/40/74/407614074.db2.gz	XCTOCCKWCFBMTC-RKDXNWHRSA-N	1	1	317.342	1.153	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CC[C@H](CN3CCOCC3)C2)c1	ZINC000129180418	407593572	/nfs/dbraw/zinc/59/35/72/407593572.db2.gz	FDKQNZHKYSJMJK-OAHLLOKOSA-N	1	1	305.378	1.749	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CC[C@H](C[NH+]3CCOCC3)C2)c1	ZINC000129180418	407593579	/nfs/dbraw/zinc/59/35/79/407593579.db2.gz	FDKQNZHKYSJMJK-OAHLLOKOSA-N	1	1	305.378	1.749	20	5		DDBDMO
Cc1c(CN2CCN(c3[nH+]ccn3C)CC2)cccc1[N+](=O)[O-]	ZINC000266969698	407699671	/nfs/dbraw/zinc/69/96/71/407699671.db2.gz	ZQSMVTQVYKKFAJ-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000186709476	407750574	/nfs/dbraw/zinc/75/05/74/407750574.db2.gz	FPZWWAQMMWDXHY-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117398310	407833529	/nfs/dbraw/zinc/83/35/29/407833529.db2.gz	QNMVFVOGGFTLDA-LBPRGKRZSA-N	1	1	322.365	1.779	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117398310	407833533	/nfs/dbraw/zinc/83/35/33/407833533.db2.gz	QNMVFVOGGFTLDA-LBPRGKRZSA-N	1	1	322.365	1.779	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000153728333	407887683	/nfs/dbraw/zinc/88/76/83/407887683.db2.gz	BNSGCCFHOVSBRM-LLVKDONJSA-N	1	1	309.370	1.049	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000153728333	407887688	/nfs/dbraw/zinc/88/76/88/407887688.db2.gz	BNSGCCFHOVSBRM-LLVKDONJSA-N	1	1	309.370	1.049	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000134306195	407896134	/nfs/dbraw/zinc/89/61/34/407896134.db2.gz	QKULMJMVVSFIEQ-LBPRGKRZSA-N	1	1	307.325	1.948	20	5		DDBDMO
C[C@H]1Cc2ccccc2C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000173801531	407896764	/nfs/dbraw/zinc/89/67/64/407896764.db2.gz	GLQMLHMIUYTUQV-LRDDRELGSA-N	1	1	316.361	1.599	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154014904	407952375	/nfs/dbraw/zinc/95/23/75/407952375.db2.gz	LSQNYWKGZOECNO-VNHYZAJKSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154014904	407952381	/nfs/dbraw/zinc/95/23/81/407952381.db2.gz	LSQNYWKGZOECNO-VNHYZAJKSA-N	1	1	324.377	1.752	20	5		DDBDMO
CN(C)C(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000268402461	408030440	/nfs/dbraw/zinc/03/04/40/408030440.db2.gz	QFMIXRMVTLPQMX-UHFFFAOYSA-N	1	1	324.356	1.334	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCOC[C@H]2C2CC2)c1	ZINC000245856151	408078124	/nfs/dbraw/zinc/07/81/24/408078124.db2.gz	KBSJGODASNMMGR-ZBFHGGJFSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCOC[C@H]2C2CC2)c1	ZINC000245856151	408078129	/nfs/dbraw/zinc/07/81/29/408078129.db2.gz	KBSJGODASNMMGR-ZBFHGGJFSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCCC3(C2)OCCO3)c1	ZINC000136151164	408082349	/nfs/dbraw/zinc/08/23/49/408082349.db2.gz	XJFPGFNKIMFFID-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCCC3(C2)OCCO3)c1	ZINC000136151164	408082357	/nfs/dbraw/zinc/08/23/57/408082357.db2.gz	XJFPGFNKIMFFID-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H](C[N@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000176086660	408282160	/nfs/dbraw/zinc/28/21/60/408282160.db2.gz	RFVXITRVHUGMQD-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H](C[N@@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000176086660	408282165	/nfs/dbraw/zinc/28/21/65/408282165.db2.gz	RFVXITRVHUGMQD-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H](C[N@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000176086660	408282170	/nfs/dbraw/zinc/28/21/70/408282170.db2.gz	RFVXITRVHUGMQD-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000176191657	408302821	/nfs/dbraw/zinc/30/28/21/408302821.db2.gz	QDVPEBHQSNGHGK-UHFFFAOYSA-N	1	1	304.350	1.940	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000183186159	408347026	/nfs/dbraw/zinc/34/70/26/408347026.db2.gz	SNKOIZSTJNTCCX-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000183186159	408347031	/nfs/dbraw/zinc/34/70/31/408347031.db2.gz	SNKOIZSTJNTCCX-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000247329392	408452558	/nfs/dbraw/zinc/45/25/58/408452558.db2.gz	MXHDUIRISZNAAB-IUODEOHRSA-N	1	1	305.378	1.982	20	5		DDBDMO
CC[C@H]1CN(c2nccc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000265193139	408575683	/nfs/dbraw/zinc/57/56/83/408575683.db2.gz	LHWXDKDBNPZDAD-STQMWFEESA-N	1	1	308.382	1.580	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000249262089	408707631	/nfs/dbraw/zinc/70/76/31/408707631.db2.gz	HFDYUOJMAWLYAP-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000270874700	408719465	/nfs/dbraw/zinc/71/94/65/408719465.db2.gz	JQFSYHUUKMGFMZ-CABCVRRESA-N	1	1	319.361	1.325	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C[C@H](C)O)C[C@@H]1C	ZINC000249507532	408732967	/nfs/dbraw/zinc/73/29/67/408732967.db2.gz	LKVRLXFUBPWPED-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1C	ZINC000251655653	408784525	/nfs/dbraw/zinc/78/45/25/408784525.db2.gz	HTRFWMIFWMOBLC-DVOMOZLQSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@H](C)O)C[C@H]1C	ZINC000251843402	408787338	/nfs/dbraw/zinc/78/73/38/408787338.db2.gz	OITRLJNFMXHMCS-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@H](C)O)C[C@H]1C	ZINC000251843402	408787341	/nfs/dbraw/zinc/78/73/41/408787341.db2.gz	OITRLJNFMXHMCS-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
CCOCCOCC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000276282676	408828782	/nfs/dbraw/zinc/82/87/82/408828782.db2.gz	RXIYTKGMAUEIKU-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290800155	408834756	/nfs/dbraw/zinc/83/47/56/408834756.db2.gz	PRVWCPXDYMNSOC-MNOVXSKESA-N	1	1	319.365	1.152	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1	ZINC000276382882	408846839	/nfs/dbraw/zinc/84/68/39/408846839.db2.gz	QIOGZTPTDFESMR-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NCCN1CC[NH+](C)CC1	ZINC000286138130	408929901	/nfs/dbraw/zinc/92/99/01/408929901.db2.gz	NJQBYGSYHRZECP-UHFFFAOYSA-N	1	1	306.366	1.457	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000194743059	163295202	/nfs/dbraw/zinc/29/52/02/163295202.db2.gz	IRVMIZCJAASGPA-ZDUSSCGKSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000231553451	163349970	/nfs/dbraw/zinc/34/99/70/163349970.db2.gz	RWIVUFKVNOXFGD-SNVBAGLBSA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000231553451	163349973	/nfs/dbraw/zinc/34/99/73/163349973.db2.gz	RWIVUFKVNOXFGD-SNVBAGLBSA-N	1	1	313.379	1.504	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000286412620	408980771	/nfs/dbraw/zinc/98/07/71/408980771.db2.gz	AUYSGCATKYGCIS-SECBINFHSA-N	1	1	323.378	1.732	20	5		DDBDMO
CC[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)[C@@H](C)C1	ZINC000286423375	408982813	/nfs/dbraw/zinc/98/28/13/408982813.db2.gz	REVGZMJSUVXMAB-JTQLQIEISA-N	1	1	317.349	1.774	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](C)CO	ZINC000292113833	408983796	/nfs/dbraw/zinc/98/37/96/408983796.db2.gz	HJPCPPQVOSMFDW-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1	ZINC000277683321	408992045	/nfs/dbraw/zinc/99/20/45/408992045.db2.gz	YVQYFMWGTAKHRO-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000282271340	409023605	/nfs/dbraw/zinc/02/36/05/409023605.db2.gz	HPWSVYHUXSHRAZ-NWANDNLSSA-N	1	1	324.377	1.834	20	5		DDBDMO
COCC[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccn1	ZINC000287520080	409049506	/nfs/dbraw/zinc/04/95/06/409049506.db2.gz	UYMZFRGXPURROF-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccn1	ZINC000287520080	409049508	/nfs/dbraw/zinc/04/95/08/409049508.db2.gz	UYMZFRGXPURROF-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH+]2[C@@H](CO)CC[C@@H]2CO)c1	ZINC000287604142	409062942	/nfs/dbraw/zinc/06/29/42/409062942.db2.gz	YXMGHAMKUVPTFX-VXGBXAGGSA-N	1	1	300.742	1.566	20	5		DDBDMO
CC(C)[C@@]1(CO)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000293241508	409073632	/nfs/dbraw/zinc/07/36/32/409073632.db2.gz	YYSOWAHRKPNYKB-INIZCTEOSA-N	1	1	323.393	1.487	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](C)CO	ZINC000293392835	409103565	/nfs/dbraw/zinc/10/35/65/409103565.db2.gz	KVUAASOGJPVKJZ-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H](C)CO	ZINC000293392835	409103568	/nfs/dbraw/zinc/10/35/68/409103568.db2.gz	KVUAASOGJPVKJZ-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@]3(CNC(=O)C3)C2)cc1[N+](=O)[O-]	ZINC000278936449	409117093	/nfs/dbraw/zinc/11/70/93/409117093.db2.gz	UCIHUUGKAPODCF-HNNXBMFYSA-N	1	1	305.334	1.315	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000283556769	409175448	/nfs/dbraw/zinc/17/54/48/409175448.db2.gz	UJRWLWHIQMPZKZ-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
CC(C)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000283597685	409182559	/nfs/dbraw/zinc/18/25/59/409182559.db2.gz	QJSWEKMYLZBQCM-OAHLLOKOSA-N	1	1	308.382	1.946	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)C2)C1	ZINC000294096092	409239721	/nfs/dbraw/zinc/23/97/21/409239721.db2.gz	KMHJTBZXUVJSQB-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+](C2CC2)C1	ZINC000295255408	409398413	/nfs/dbraw/zinc/39/84/13/409398413.db2.gz	FNNBPGDCEZCLCJ-LLVKDONJSA-N	1	1	318.377	1.733	20	5		DDBDMO
CO[C@H]1COC[C@@H]1[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000290245220	409335134	/nfs/dbraw/zinc/33/51/34/409335134.db2.gz	ZNFCFRXEXCGENW-JKOKRWQUSA-N	1	1	323.349	1.234	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000280682782	409409309	/nfs/dbraw/zinc/40/93/09/409409309.db2.gz	YWNQNOBQBNATMK-CYBMUJFWSA-N	1	1	321.377	1.740	20	5		DDBDMO
COc1ccc(CN2CCC(OCCC[NH3+])CC2)cc1[N+](=O)[O-]	ZINC000321301231	164044123	/nfs/dbraw/zinc/04/41/23/164044123.db2.gz	BUPNZLMEKNRQLA-UHFFFAOYSA-N	1	1	323.393	1.933	20	5		DDBDMO
CC(C)C[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000305052868	409660917	/nfs/dbraw/zinc/66/09/17/409660917.db2.gz	NHUSBRMWLRWMLF-ZFWWWQNUSA-N	1	1	310.398	1.910	20	5		DDBDMO
C[N@@H+](CC[C@H]1CCCO1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000342602192	409756430	/nfs/dbraw/zinc/75/64/30/409756430.db2.gz	LWWGOVZWSFESCM-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000297095855	409802279	/nfs/dbraw/zinc/80/22/79/409802279.db2.gz	NAGSEOAHZAAEKP-UHFFFAOYSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)CC1(O)CCOCC1	ZINC000332256082	410016596	/nfs/dbraw/zinc/01/65/96/410016596.db2.gz	CSRCSZWNWJRGTM-UHFFFAOYSA-N	1	1	320.349	1.444	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000297843847	410021484	/nfs/dbraw/zinc/02/14/84/410021484.db2.gz	KTSKDPHLKCNUDI-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCOC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000297843847	410021492	/nfs/dbraw/zinc/02/14/92/410021492.db2.gz	KTSKDPHLKCNUDI-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
CCOc1cc(OC[C@H](O)C[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000357452061	410049485	/nfs/dbraw/zinc/04/94/85/410049485.db2.gz	KVLSWSWFCBFFIU-GFCCVEGCSA-N	1	1	310.350	1.827	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCc3[nH+]c[nH]c3C2)n1	ZINC000357552046	410098203	/nfs/dbraw/zinc/09/82/03/410098203.db2.gz	VKEFWHLTDGHPRQ-MRVPVSSYSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCc3[nH]c[nH+]c3C2)n1	ZINC000357552046	410098209	/nfs/dbraw/zinc/09/82/09/410098209.db2.gz	VKEFWHLTDGHPRQ-MRVPVSSYSA-N	1	1	317.305	1.469	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000339393321	410154936	/nfs/dbraw/zinc/15/49/36/410154936.db2.gz	FOCNWHNXAFSCCW-IRXDYDNUSA-N	1	1	319.405	1.932	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](C[C@H](C)O)CC1	ZINC000343226764	410251589	/nfs/dbraw/zinc/25/15/89/410251589.db2.gz	CEAPLLBBHBGJPT-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@@H](C)[C@@H](O)C1	ZINC000351817064	410259440	/nfs/dbraw/zinc/25/94/40/410259440.db2.gz	UEMHOAMURUYANV-NRUUGDAUSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@@H](C)[C@@H](O)C1	ZINC000351817064	410259445	/nfs/dbraw/zinc/25/94/45/410259445.db2.gz	UEMHOAMURUYANV-NRUUGDAUSA-N	1	1	323.349	1.243	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351934583	410350817	/nfs/dbraw/zinc/35/08/17/410350817.db2.gz	IMWYPIVTIAYWBR-YGRLFVJLSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[NH+]1CCN(CCCCNC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000299085520	410514955	/nfs/dbraw/zinc/51/49/55/410514955.db2.gz	YXWZUGSFOVURAF-UHFFFAOYSA-N	1	1	323.397	1.070	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CCC[N@H+]1C	ZINC000299216614	410570792	/nfs/dbraw/zinc/57/07/92/410570792.db2.gz	HYJXEZFTUZMZGX-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CCC[N@@H+]1C	ZINC000299216614	410570800	/nfs/dbraw/zinc/57/08/00/410570800.db2.gz	HYJXEZFTUZMZGX-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+](CCOC)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000299133111	410540069	/nfs/dbraw/zinc/54/00/69/410540069.db2.gz	MXPWNFLOAIYBLM-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
CC[N@@H+](CCOC)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000299133111	410540071	/nfs/dbraw/zinc/54/00/71/410540071.db2.gz	MXPWNFLOAIYBLM-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
CC[N@H+](CCOC)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000299152996	410546627	/nfs/dbraw/zinc/54/66/27/410546627.db2.gz	ZOHMZVKVFWWEAV-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
CC[N@@H+](CCOC)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000299152996	410546630	/nfs/dbraw/zinc/54/66/30/410546630.db2.gz	ZOHMZVKVFWWEAV-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+](C)[C@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000355748225	410673646	/nfs/dbraw/zinc/67/36/46/410673646.db2.gz	QMHGTNZXBQCZOO-LBPRGKRZSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1cc(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)ncc1[N+](=O)[O-]	ZINC000301446666	410723068	/nfs/dbraw/zinc/72/30/68/410723068.db2.gz	RHXRAEZGTPOTBA-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1cc(NC[C@](C)(O)C[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000301762962	410790103	/nfs/dbraw/zinc/79/01/03/410790103.db2.gz	MQRYOZOFWIIVPM-HNNXBMFYSA-N	1	1	309.366	1.398	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330581317	410798860	/nfs/dbraw/zinc/79/88/60/410798860.db2.gz	JBGSCRZQYMPNPB-NWDGAFQWSA-N	1	1	305.378	1.997	20	5		DDBDMO
C[C@@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330586591	410802103	/nfs/dbraw/zinc/80/21/03/410802103.db2.gz	LTWHXYXSZQRZMB-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
Cc1nc(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000301863268	410816467	/nfs/dbraw/zinc/81/64/67/410816467.db2.gz	LVJXVQPFSQPTJQ-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1nc(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000301863268	410816472	/nfs/dbraw/zinc/81/64/72/410816472.db2.gz	LVJXVQPFSQPTJQ-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C2)C1	ZINC000356294373	410950073	/nfs/dbraw/zinc/95/00/73/410950073.db2.gz	SJMWREFAEPGLKD-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000344133178	410981236	/nfs/dbraw/zinc/98/12/36/410981236.db2.gz	PVXWHSINWAOKJG-RDBSUJKOSA-N	1	1	324.377	1.427	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000360137188	411067696	/nfs/dbraw/zinc/06/76/96/411067696.db2.gz	YQXJKAZAERFWMC-GFCCVEGCSA-N	1	1	323.349	1.514	20	5		DDBDMO
CNc1nccc(C(=O)NCC[N@H+]2CCCC2(C)C)c1[N+](=O)[O-]	ZINC000579972207	422867200	/nfs/dbraw/zinc/86/72/00/422867200.db2.gz	QSQAUFSTHVHJGD-UHFFFAOYSA-N	1	1	321.381	1.636	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)CCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000130706632	196103102	/nfs/dbraw/zinc/10/31/02/196103102.db2.gz	DPZJWOFTWOVAEM-UHFFFAOYSA-N	1	1	320.353	1.304	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccc(F)cn2)n1	ZINC000580346133	422921659	/nfs/dbraw/zinc/92/16/59/422921659.db2.gz	XETCAUALIUVEJR-NSHDSACASA-N	1	1	323.328	1.305	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3ccsc3C2)c1	ZINC000132594135	196268995	/nfs/dbraw/zinc/26/89/95/196268995.db2.gz	YVJJYHMUPZPFBU-GFCCVEGCSA-N	1	1	308.363	1.272	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000295331529	224723441	/nfs/dbraw/zinc/72/34/41/224723441.db2.gz	XOOGBIHLTJPDND-CQSZACIVSA-N	1	1	311.313	1.134	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c[nH]1)Cc1ccc(F)cc1	ZINC000360898965	418543482	/nfs/dbraw/zinc/54/34/82/418543482.db2.gz	ZSEAAYZIKKGCFG-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000291016279	222073867	/nfs/dbraw/zinc/07/38/67/222073867.db2.gz	UZRNJANFBAZVFL-LBPRGKRZSA-N	1	1	311.386	1.418	20	5		DDBDMO
CCOC1CC2(C1)CC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000367601682	418613765	/nfs/dbraw/zinc/61/37/65/418613765.db2.gz	GVZREIODRASKTQ-WLYUNCDWSA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c1	ZINC000375466477	418643525	/nfs/dbraw/zinc/64/35/25/418643525.db2.gz	UTCJBFGAKJUZCT-NSHDSACASA-N	1	1	318.337	1.541	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+]1C	ZINC000342362610	418627743	/nfs/dbraw/zinc/62/77/43/418627743.db2.gz	QRSDBNNVDMDYND-UWVGGRQHSA-N	1	1	317.349	2.138	20	5		DDBDMO
COC(=O)[C@@]12CCC[C@@H]1C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)C2	ZINC000367796406	418635719	/nfs/dbraw/zinc/63/57/19/418635719.db2.gz	RIMFLMHQOWPCCW-QMTHXVAHSA-N	1	1	308.338	1.103	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCOC1	ZINC000361587998	418687017	/nfs/dbraw/zinc/68/70/17/418687017.db2.gz	DBNGDFMBAXEBQE-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCOC1	ZINC000361587998	418687021	/nfs/dbraw/zinc/68/70/21/418687021.db2.gz	DBNGDFMBAXEBQE-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCN3CCOC[C@H]3C2)cc1	ZINC000371827899	418820272	/nfs/dbraw/zinc/82/02/72/418820272.db2.gz	BCUJNUMRAKMFRF-OAHLLOKOSA-N	1	1	321.377	1.380	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000364922471	418822622	/nfs/dbraw/zinc/82/26/22/418822622.db2.gz	XPQSYRDAPVZYSX-MNOVXSKESA-N	1	1	319.365	1.271	20	5		DDBDMO
CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])C[NH+](Cc2ccccc2)C1	ZINC000365564748	418877195	/nfs/dbraw/zinc/87/71/95/418877195.db2.gz	NQUKJWWCAIJFKQ-ZIAGYGMSSA-N	1	1	303.362	1.290	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])cn1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000372604710	418887035	/nfs/dbraw/zinc/88/70/35/418887035.db2.gz	CLCJHQLCKBNRMP-HNNXBMFYSA-N	1	1	319.409	1.595	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])cn1)[C@H]1CCN(C2CC[NH+](C)CC2)C1	ZINC000372604710	418887037	/nfs/dbraw/zinc/88/70/37/418887037.db2.gz	CLCJHQLCKBNRMP-HNNXBMFYSA-N	1	1	319.409	1.595	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000365668958	418892658	/nfs/dbraw/zinc/89/26/58/418892658.db2.gz	FRJSIHHGNJGEEN-QWHCGFSZSA-N	1	1	319.361	1.496	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000431832375	229061595	/nfs/dbraw/zinc/06/15/95/229061595.db2.gz	GASWBTRWRKLIQC-GFCCVEGCSA-N	1	1	319.361	1.635	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000299470093	229137581	/nfs/dbraw/zinc/13/75/81/229137581.db2.gz	BHEQUHMMTZGVCE-QWHCGFSZSA-N	1	1	321.381	1.233	20	5		DDBDMO
C[C@@H](c1ccccc1)[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)C(N)=O	ZINC000428855621	419942463	/nfs/dbraw/zinc/94/24/63/419942463.db2.gz	HICHYZIFRZTDMR-GWCFXTLKSA-N	1	1	317.349	1.076	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(N)=O	ZINC000429164020	419980739	/nfs/dbraw/zinc/98/07/39/419980739.db2.gz	BPCXGBOOWMRTGI-UHFFFAOYSA-N	1	1	308.338	1.121	20	5		DDBDMO
COCC1(O)CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000430206049	420089918	/nfs/dbraw/zinc/08/99/18/420089918.db2.gz	VQPXHXBUSQTVJL-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
CCc1ccccc1[C@@H]([NH3+])CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000423938220	420276894	/nfs/dbraw/zinc/27/68/94/420276894.db2.gz	ISSIYEGDTGPRBE-NSHDSACASA-N	1	1	303.322	1.310	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c1	ZINC000420425891	420278443	/nfs/dbraw/zinc/27/84/43/420278443.db2.gz	VEDFTIKACUGBCS-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1[NH3+]	ZINC000430940742	420217374	/nfs/dbraw/zinc/21/73/74/420217374.db2.gz	QVIWFIOZHAPQQT-NWDGAFQWSA-N	1	1	306.366	1.593	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000416294084	420309833	/nfs/dbraw/zinc/30/98/33/420309833.db2.gz	KOZFTFHJLBULLF-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000416294084	420309838	/nfs/dbraw/zinc/30/98/38/420309838.db2.gz	KOZFTFHJLBULLF-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449635815	421041430	/nfs/dbraw/zinc/04/14/30/421041430.db2.gz	CHSPHBDNIFPSKI-VHSXEESVSA-N	1	1	317.349	1.718	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456007489	421088466	/nfs/dbraw/zinc/08/84/66/421088466.db2.gz	DFDXNKVKXWDYFQ-UWVGGRQHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456007489	421088469	/nfs/dbraw/zinc/08/84/69/421088469.db2.gz	DFDXNKVKXWDYFQ-UWVGGRQHSA-N	1	1	307.354	1.196	20	5		DDBDMO
Cc1cc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)nn1C	ZINC000489039667	421132905	/nfs/dbraw/zinc/13/29/05/421132905.db2.gz	JXDBVKDWMRBVKQ-UHFFFAOYSA-N	1	1	304.354	1.670	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000525291526	421285310	/nfs/dbraw/zinc/28/53/10/421285310.db2.gz	IIPWSALUPBIWIJ-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cn1nccc1[C@H](CO)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000514873869	421464143	/nfs/dbraw/zinc/46/41/43/421464143.db2.gz	YYGNUXSJHKYICJ-OLZOCXBDSA-N	1	1	302.334	1.639	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000516225690	421535011	/nfs/dbraw/zinc/53/50/11/421535011.db2.gz	ATCQPMDXXIVKGQ-OCCSQVGLSA-N	1	1	321.377	1.535	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C(C)C)C1	ZINC000522167987	421818006	/nfs/dbraw/zinc/81/80/06/421818006.db2.gz	QVUZWHFGTSRPCU-GFCCVEGCSA-N	1	1	306.366	1.758	20	5		DDBDMO
CNc1ccc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000314828410	271014116	/nfs/dbraw/zinc/01/41/16/271014116.db2.gz	FPZUMGHRGAJKMC-LBPRGKRZSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000341577688	271126181	/nfs/dbraw/zinc/12/61/81/271126181.db2.gz	RYVFUWJXDHBKGM-UONOGXRCSA-N	1	1	322.409	1.561	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000341776957	271209706	/nfs/dbraw/zinc/20/97/06/271209706.db2.gz	OHZWGOQWANFPEE-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000344409784	272017263	/nfs/dbraw/zinc/01/72/63/272017263.db2.gz	AMZHUCPXHGRYQC-HNNXBMFYSA-N	1	1	319.409	1.596	20	5		DDBDMO
Nc1c(F)c(N2CCN(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000290991065	274964256	/nfs/dbraw/zinc/96/42/56/274964256.db2.gz	TXYNBYUPEHECKU-UHFFFAOYSA-N	1	1	306.301	1.366	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000273152705	276381210	/nfs/dbraw/zinc/38/12/10/276381210.db2.gz	IGQHTGFELDVGAI-STQMWFEESA-N	1	1	323.393	1.885	20	5		DDBDMO
COC(=O)C1(C[N@@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC000451051293	277308819	/nfs/dbraw/zinc/30/88/19/277308819.db2.gz	UJRDSNQJDRQZHQ-UHFFFAOYSA-N	1	1	306.318	1.742	20	5		DDBDMO
COC(=O)C1(C[N@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC000451051293	277308821	/nfs/dbraw/zinc/30/88/21/277308821.db2.gz	UJRDSNQJDRQZHQ-UHFFFAOYSA-N	1	1	306.318	1.742	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332584814	279318684	/nfs/dbraw/zinc/31/86/84/279318684.db2.gz	IAQOHTLHEPBUQT-GFCCVEGCSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332584814	279318686	/nfs/dbraw/zinc/31/86/86/279318686.db2.gz	IAQOHTLHEPBUQT-GFCCVEGCSA-N	1	1	306.366	1.069	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000123968596	281181616	/nfs/dbraw/zinc/18/16/16/281181616.db2.gz	CGFLHCXKGLMGIW-QWRGUYRKSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cc1cccc(NCCNC(=O)CCn2cc([N+](=O)[O-])cn2)[nH+]1	ZINC000126121286	281227136	/nfs/dbraw/zinc/22/71/36/281227136.db2.gz	RXQOQAXKPBNBSH-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C[C@@H](C)O)C(C)C	ZINC000107043106	281261358	/nfs/dbraw/zinc/26/13/58/281261358.db2.gz	RWWHFUCXUNISPY-GFCCVEGCSA-N	1	1	309.366	1.933	20	5		DDBDMO
COc1cccc(N2CC[N@@H+](CCO)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000302570132	295305663	/nfs/dbraw/zinc/30/56/63/295305663.db2.gz	YQKVHBVYVMOYJV-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000363170891	300225886	/nfs/dbraw/zinc/22/58/86/300225886.db2.gz	PGSSJMWTZHYTPP-OAHLLOKOSA-N	1	1	302.334	1.945	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](n3cncn3)C2)c1	ZINC000368412119	301022468	/nfs/dbraw/zinc/02/24/68/301022468.db2.gz	RCNQNIBISWBXIF-CYBMUJFWSA-N	1	1	303.322	1.512	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC23CCOCC3)c1	ZINC000368893132	301102546	/nfs/dbraw/zinc/10/25/46/301102546.db2.gz	AQHOFBBJLJFWFB-CQSZACIVSA-N	1	1	322.361	1.589	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000368950328	301108993	/nfs/dbraw/zinc/10/89/93/301108993.db2.gz	MEDIJGQWJUOIKM-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
COC(=O)c1ccc(OCC[N@@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000412989837	302376764	/nfs/dbraw/zinc/37/67/64/302376764.db2.gz	OGVLPLBKNHWYBE-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
COC(=O)c1ccc(OCC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000412989837	302376767	/nfs/dbraw/zinc/37/67/67/302376767.db2.gz	OGVLPLBKNHWYBE-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1	ZINC000531726630	303253185	/nfs/dbraw/zinc/25/31/85/303253185.db2.gz	QXIZQSMBMSFAAQ-DGCLKSJQSA-N	1	1	306.366	1.490	20	5		DDBDMO
CN(C)C(=O)C(C)(C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000533523384	303320142	/nfs/dbraw/zinc/32/01/42/303320142.db2.gz	FGTVJESJVDVNNT-UHFFFAOYSA-N	1	1	323.349	1.418	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000533539687	303320436	/nfs/dbraw/zinc/32/04/36/303320436.db2.gz	GTLRIYNNDSIICG-GZBFAFLISA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1ccnc(N2CC[NH+]([C@@H]3CCSC3)CC2)c1[N+](=O)[O-]	ZINC000363917263	307037606	/nfs/dbraw/zinc/03/76/06/307037606.db2.gz	FHWNRRSFEBBZOF-GFCCVEGCSA-N	1	1	308.407	1.926	20	5		DDBDMO
CCn1nccc1CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000367254243	307089857	/nfs/dbraw/zinc/08/98/57/307089857.db2.gz	WALWFYGIZUNUBV-AWEZNQCLSA-N	1	1	318.381	1.887	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](CC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000368572164	307105594	/nfs/dbraw/zinc/10/55/94/307105594.db2.gz	GFKZPIUPSHKIQD-GFCCVEGCSA-N	1	1	307.350	1.691	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)CN1	ZINC000369483080	307121326	/nfs/dbraw/zinc/12/13/26/307121326.db2.gz	GDKYUPSPEKDYBW-AWEZNQCLSA-N	1	1	320.305	1.215	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)CN1	ZINC000369483080	307121327	/nfs/dbraw/zinc/12/13/27/307121327.db2.gz	GDKYUPSPEKDYBW-AWEZNQCLSA-N	1	1	320.305	1.215	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H](O)C2(CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000372297512	307167915	/nfs/dbraw/zinc/16/79/15/307167915.db2.gz	VKEVZPPGVCPWTH-CYBMUJFWSA-N	1	1	305.334	1.380	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330450	307168151	/nfs/dbraw/zinc/16/81/51/307168151.db2.gz	KZWUTCHFJKLOHJ-YNEHKIRRSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330450	307168152	/nfs/dbraw/zinc/16/81/52/307168152.db2.gz	KZWUTCHFJKLOHJ-YNEHKIRRSA-N	1	1	323.397	1.731	20	5		DDBDMO
Cc1[nH+]c(CNC(=O)c2[nH]ncc2[N+](=O)[O-])c2n1CCCC2	ZINC000378311003	307285337	/nfs/dbraw/zinc/28/53/37/307285337.db2.gz	PQTRRNYXXZFIBH-UHFFFAOYSA-N	1	1	304.310	1.089	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000510122546	307398799	/nfs/dbraw/zinc/39/87/99/307398799.db2.gz	YGYYFUSYZRVEEK-NFAWXSAZSA-N	1	1	310.350	1.444	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000510122545	307398836	/nfs/dbraw/zinc/39/88/36/307398836.db2.gz	YGYYFUSYZRVEEK-KCQAQPDRSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ncccn2)n1	ZINC000580661003	308621810	/nfs/dbraw/zinc/62/18/10/308621810.db2.gz	ZPSQVWMXBWWMEI-RYUDHWBXSA-N	1	1	302.338	1.855	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000584451939	337341475	/nfs/dbraw/zinc/34/14/75/337341475.db2.gz	HMMGGYBVYLCLSK-CMPLNLGQSA-N	1	1	305.334	1.380	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000584662970	337378524	/nfs/dbraw/zinc/37/85/24/337378524.db2.gz	QCNCZJIOUFOQMK-OAHLLOKOSA-N	1	1	305.334	1.458	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000584662970	337378525	/nfs/dbraw/zinc/37/85/25/337378525.db2.gz	QCNCZJIOUFOQMK-OAHLLOKOSA-N	1	1	305.334	1.458	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccnc1	ZINC000182887114	490689003	/nfs/dbraw/zinc/68/90/03/490689003.db2.gz	WQJWQCDDPWROEW-JTQLQIEISA-N	1	1	300.318	1.940	20	5		DDBDMO
C[C@@H]([N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C(C)(C)O	ZINC000295148816	534284531	/nfs/dbraw/zinc/28/45/31/534284531.db2.gz	LUOYGPBOOBDDFG-LLVKDONJSA-N	1	1	321.377	1.575	20	5		DDBDMO
Cc1ccnc(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)c1[N+](=O)[O-]	ZINC000301244341	534401758	/nfs/dbraw/zinc/40/17/58/534401758.db2.gz	ACKJJHHQAOAWTR-LBPRGKRZSA-N	1	1	321.381	1.298	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](C2CCCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000154597721	527024942	/nfs/dbraw/zinc/02/49/42/527024942.db2.gz	IDWQGOLMSMBWTE-NSHDSACASA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000154597721	527024945	/nfs/dbraw/zinc/02/49/45/527024945.db2.gz	IDWQGOLMSMBWTE-NSHDSACASA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000154597721	527024949	/nfs/dbraw/zinc/02/49/49/527024949.db2.gz	IDWQGOLMSMBWTE-NSHDSACASA-N	1	1	321.381	1.845	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425061080	528544471	/nfs/dbraw/zinc/54/44/71/528544471.db2.gz	XWYHJDRSEWJRDU-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425061080	528544477	/nfs/dbraw/zinc/54/44/77/528544477.db2.gz	XWYHJDRSEWJRDU-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425061080	528544484	/nfs/dbraw/zinc/54/44/84/528544484.db2.gz	XWYHJDRSEWJRDU-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C1CC1	ZINC000102653121	696611095	/nfs/dbraw/zinc/61/10/95/696611095.db2.gz	PJZDNQWIHOWYCO-SECBINFHSA-N	1	1	310.354	1.639	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)C1CC1	ZINC000102653121	696611097	/nfs/dbraw/zinc/61/10/97/696611097.db2.gz	PJZDNQWIHOWYCO-SECBINFHSA-N	1	1	310.354	1.639	20	5		DDBDMO
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)CC[NH+]1CCOCC1)CC2	ZINC000773989786	697831306	/nfs/dbraw/zinc/83/13/06/697831306.db2.gz	YIQQYIVKZPCTHA-UHFFFAOYSA-N	1	1	319.361	1.515	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H](OCCO)C2)cc1	ZINC000776585045	698122151	/nfs/dbraw/zinc/12/21/51/698122151.db2.gz	RQPJJGMQMHEHPO-HUUCEWRRSA-N	1	1	310.350	1.102	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000750053815	700201392	/nfs/dbraw/zinc/20/13/92/700201392.db2.gz	UPLYFANXJRGWGU-GXTWGEPZSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000778295530	698258177	/nfs/dbraw/zinc/25/81/77/698258177.db2.gz	QRBZYAUOVZVNFY-DDTOSNHZSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000778295530	698258179	/nfs/dbraw/zinc/25/81/79/698258179.db2.gz	QRBZYAUOVZVNFY-DDTOSNHZSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[N@H+]1C	ZINC000782525592	698734423	/nfs/dbraw/zinc/73/44/23/698734423.db2.gz	YPTXGEYFYZZIBP-NSHDSACASA-N	1	1	324.356	1.698	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCN1C	ZINC000782525592	698734425	/nfs/dbraw/zinc/73/44/25/698734425.db2.gz	YPTXGEYFYZZIBP-NSHDSACASA-N	1	1	324.356	1.698	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCN1C	ZINC000782525592	698734428	/nfs/dbraw/zinc/73/44/28/698734428.db2.gz	YPTXGEYFYZZIBP-NSHDSACASA-N	1	1	324.356	1.698	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000731455910	699529142	/nfs/dbraw/zinc/52/91/42/699529142.db2.gz	XGRXQMVBAAUZTA-JSGCOSHPSA-N	1	1	323.324	1.327	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000742197911	699866158	/nfs/dbraw/zinc/86/61/58/699866158.db2.gz	WKXWVRDCCOJQCZ-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000742197911	699866160	/nfs/dbraw/zinc/86/61/60/699866160.db2.gz	WKXWVRDCCOJQCZ-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000801911959	700352657	/nfs/dbraw/zinc/35/26/57/700352657.db2.gz	WNCUUOLZMFWUOS-RKDXNWHRSA-N	1	1	310.329	1.529	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@H](CO)C3CC3)n2)cc1	ZINC000763088153	700925111	/nfs/dbraw/zinc/92/51/11/700925111.db2.gz	WJAXVAVMPUOVSL-GFCCVEGCSA-N	1	1	304.306	1.505	20	5		DDBDMO
CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839528159	701725289	/nfs/dbraw/zinc/72/52/89/701725289.db2.gz	IOUCINADZOZACT-HUUCEWRRSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC(C)[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839528159	701725295	/nfs/dbraw/zinc/72/52/95/701725295.db2.gz	IOUCINADZOZACT-HUUCEWRRSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC(C)[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839528159	701725301	/nfs/dbraw/zinc/72/53/01/701725301.db2.gz	IOUCINADZOZACT-HUUCEWRRSA-N	1	1	305.378	1.808	20	5		DDBDMO
COc1cccc(CN(CC[NH+](C)C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC000839734232	701802881	/nfs/dbraw/zinc/80/28/81/701802881.db2.gz	QOJQGVLSYCKVFV-HUUCEWRRSA-N	1	1	321.377	1.251	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@H]2C1	ZINC000868519334	702173865	/nfs/dbraw/zinc/17/38/65/702173865.db2.gz	AOSYIMLSSGVSQW-YPMHNXCESA-N	1	1	307.325	1.439	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000842836508	702781895	/nfs/dbraw/zinc/78/18/95/702781895.db2.gz	PIFGPKWUFLLINP-GFCCVEGCSA-N	1	1	310.354	1.455	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@H](CN3CCOC3=O)C2)c1[N+](=O)[O-]	ZINC000852094779	703921676	/nfs/dbraw/zinc/92/16/76/703921676.db2.gz	OUWJPJQSZUPNEF-JTQLQIEISA-N	1	1	310.310	1.165	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@H](CN3CCOC3=O)C2)c1[N+](=O)[O-]	ZINC000852094779	703921678	/nfs/dbraw/zinc/92/16/78/703921678.db2.gz	OUWJPJQSZUPNEF-JTQLQIEISA-N	1	1	310.310	1.165	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852410510	704036704	/nfs/dbraw/zinc/03/67/04/704036704.db2.gz	CDPYSWPJECBZCH-LSDHHAIUSA-N	1	1	310.350	1.102	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852412706	704037817	/nfs/dbraw/zinc/03/78/17/704037817.db2.gz	YDVZQMQTBDHKNW-LSDHHAIUSA-N	1	1	310.350	1.102	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CCC1(C)C	ZINC000871157159	704233907	/nfs/dbraw/zinc/23/39/07/704233907.db2.gz	VGEFGTOTQRVBKW-UHFFFAOYSA-N	1	1	324.356	1.872	20	5		DDBDMO
Nc1n[nH]c(C2CC[NH+](Cc3cc(F)ccc3[N+](=O)[O-])CC2)n1	ZINC000821270129	704384753	/nfs/dbraw/zinc/38/47/53/704384753.db2.gz	JJCQIOCMGJRWQO-UHFFFAOYSA-N	1	1	320.328	1.814	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H]1CCC[N@@H+]2C	ZINC000874848150	705201131	/nfs/dbraw/zinc/20/11/31/705201131.db2.gz	RUWYMZWEGNRLQP-UONOGXRCSA-N	1	1	304.350	1.607	20	5		DDBDMO
CCN(C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000823920840	705339843	/nfs/dbraw/zinc/33/98/43/705339843.db2.gz	FKVXQOOPXLXMJN-LLVKDONJSA-N	1	1	307.354	1.735	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000862794747	705800364	/nfs/dbraw/zinc/80/03/64/705800364.db2.gz	HARPOQYTXYZJGK-DOMZBBRYSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC[C@H]21	ZINC000827269712	705964909	/nfs/dbraw/zinc/96/49/09/705964909.db2.gz	ZCDXABHKJXFDJJ-NOZJJQNGSA-N	1	1	322.340	1.482	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000827626288	706039597	/nfs/dbraw/zinc/03/95/97/706039597.db2.gz	VHAHOYQPYMMQOU-SOUVJXGZSA-N	1	1	303.362	1.909	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2CCC(CO)(CO)CC2)c(Cl)c1	ZINC000877798324	706219420	/nfs/dbraw/zinc/21/94/20/706219420.db2.gz	NEAZTBHRQKKOQO-UHFFFAOYSA-N	1	1	314.769	1.815	20	5		DDBDMO
CCN1CCC([NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000877830224	706226500	/nfs/dbraw/zinc/22/65/00/706226500.db2.gz	FHFGBSAYOQCUCT-HZPDHXFCSA-N	1	1	323.393	1.063	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000829328399	706319895	/nfs/dbraw/zinc/31/98/95/706319895.db2.gz	VALNMTDPNIBQGK-OAHLLOKOSA-N	1	1	319.361	1.396	20	5		DDBDMO
COC(=O)CC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000880040604	706860763	/nfs/dbraw/zinc/86/07/63/706860763.db2.gz	YFRYXCROOCPXCE-GFCCVEGCSA-N	1	1	310.354	1.457	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+][C@H]1C[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000927147328	712947051	/nfs/dbraw/zinc/94/70/51/712947051.db2.gz	KQRHMNTXMFXBEY-WHOFXGATSA-N	1	1	316.361	1.778	20	5		DDBDMO
O=CN1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000839017788	708015942	/nfs/dbraw/zinc/01/59/42/708015942.db2.gz	DEEUMHTVZUFSJL-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000883539953	708024020	/nfs/dbraw/zinc/02/40/20/708024020.db2.gz	ONCIZJKDBJECIP-CQSZACIVSA-N	1	1	306.366	1.531	20	5		DDBDMO
COC(=O)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000886012463	708681728	/nfs/dbraw/zinc/68/17/28/708681728.db2.gz	ILTNJUOTHNWZBC-ZDUSSCGKSA-N	1	1	323.349	1.534	20	5		DDBDMO
COC(=O)CC[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000886012463	708681729	/nfs/dbraw/zinc/68/17/29/708681729.db2.gz	ILTNJUOTHNWZBC-ZDUSSCGKSA-N	1	1	323.349	1.534	20	5		DDBDMO
O=C([C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)N1CCCC1	ZINC000886205824	708714535	/nfs/dbraw/zinc/71/45/35/708714535.db2.gz	AAIGAXMQZXMEET-ZDUSSCGKSA-N	1	1	304.350	1.434	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000886863468	708869823	/nfs/dbraw/zinc/86/98/23/708869823.db2.gz	GSOLTOGNYGSXRX-NSHDSACASA-N	1	1	309.322	1.404	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000886863468	708869826	/nfs/dbraw/zinc/86/98/26/708869826.db2.gz	GSOLTOGNYGSXRX-NSHDSACASA-N	1	1	309.322	1.404	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000889780164	709631550	/nfs/dbraw/zinc/63/15/50/709631550.db2.gz	IPIMDYMXYREFAD-GJZGRUSLSA-N	1	1	319.361	1.266	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc([N+](=O)[O-])c1C	ZINC000928438772	713196127	/nfs/dbraw/zinc/19/61/27/713196127.db2.gz	GVCNLTZQIVFTAR-ZYHUDNBSSA-N	1	1	307.350	1.734	20	5		DDBDMO
COc1cc(OCC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000928442799	713198026	/nfs/dbraw/zinc/19/80/26/713198026.db2.gz	CFFOFIPZLTVHGL-CMPLNLGQSA-N	1	1	323.349	1.191	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000928457580	713205497	/nfs/dbraw/zinc/20/54/97/713205497.db2.gz	XJIMFBWRCBCTSG-ONGXEEELSA-N	1	1	323.349	1.434	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH2+]CCC12CCOCC2	ZINC000903818377	711290914	/nfs/dbraw/zinc/29/09/14/711290914.db2.gz	JIIJSBRHQZLGDJ-UHFFFAOYSA-N	1	1	321.377	1.645	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737552	711590635	/nfs/dbraw/zinc/59/06/35/711590635.db2.gz	BJCXSFDWTZCKML-PWSUYJOCSA-N	1	1	316.361	1.951	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)CC[N@H+]1C	ZINC000895737462	711590931	/nfs/dbraw/zinc/59/09/31/711590931.db2.gz	VRHXZQUCZAELLD-ZJUUUORDSA-N	1	1	319.365	1.290	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F	ZINC000895771349	711602026	/nfs/dbraw/zinc/60/20/26/711602026.db2.gz	YXDHAYSALHHMNH-LLVKDONJSA-N	1	1	324.356	1.687	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F	ZINC000895771349	711602029	/nfs/dbraw/zinc/60/20/29/711602029.db2.gz	YXDHAYSALHHMNH-LLVKDONJSA-N	1	1	324.356	1.687	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@H]1[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000895773839	711603171	/nfs/dbraw/zinc/60/31/71/711603171.db2.gz	UXBKQLLVZODBKP-NSHDSACASA-N	1	1	311.363	1.041	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000896579332	711757527	/nfs/dbraw/zinc/75/75/27/711757527.db2.gz	FQBXIXPPYJPYNC-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000896580799	711757960	/nfs/dbraw/zinc/75/79/60/711757960.db2.gz	IYKJTLDPURECNG-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C1CN(C)CC[N@@H+](C)C1	ZINC000905032402	711913805	/nfs/dbraw/zinc/91/38/05/711913805.db2.gz	KJWDZUOZNNGBKU-UHFFFAOYSA-N	1	1	306.366	1.335	20	5		DDBDMO
C[N@@H+](Cc1cn(CCn2ccc([N+](=O)[O-])n2)nn1)C(C)(C)C	ZINC000905799371	712148734	/nfs/dbraw/zinc/14/87/34/712148734.db2.gz	OXVNIYYXGYWFPH-UHFFFAOYSA-N	1	1	307.358	1.313	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[N@H+](CC)CCO1	ZINC000908278936	712727118	/nfs/dbraw/zinc/72/71/18/712727118.db2.gz	IBQOEAOYVDFRHR-AWEZNQCLSA-N	1	1	323.349	1.653	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[N@@H+](CC)CCO1	ZINC000908278936	712727119	/nfs/dbraw/zinc/72/71/19/712727119.db2.gz	IBQOEAOYVDFRHR-AWEZNQCLSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cccc([C@H]2[C@H](NCC[N+](=O)[O-])CC[N@@H+]2C2CC2)c1	ZINC000930353776	713812003	/nfs/dbraw/zinc/81/20/03/713812003.db2.gz	KGWLYTVHIBTOOE-CVEARBPZSA-N	1	1	305.378	1.839	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000932514185	714351949	/nfs/dbraw/zinc/35/19/49/714351949.db2.gz	OGBLDYKTRUTZGI-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000933740179	714659877	/nfs/dbraw/zinc/65/98/77/714659877.db2.gz	LDPUGJPNBVPCGF-CJNGLKHVSA-N	1	1	318.377	1.077	20	5		DDBDMO
C[N@H+]1C[C@H](O)C[C@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000924989607	714718001	/nfs/dbraw/zinc/71/80/01/714718001.db2.gz	SSJCOIXUVJNSLS-DTWKUNHWSA-N	1	1	313.741	1.043	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](Cc3nccs3)C2)n1	ZINC000934335271	714797821	/nfs/dbraw/zinc/79/78/21/714797821.db2.gz	ZRWIMXSLZADQFF-NSHDSACASA-N	1	1	307.379	1.812	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000935169266	714994006	/nfs/dbraw/zinc/99/40/06/714994006.db2.gz	YWZQJRPKMBNCBK-QWRGUYRKSA-N	1	1	309.370	1.041	20	5		DDBDMO
Cc1cc(Cl)nc(N2C[C@@H]3OCC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001164665839	719385031	/nfs/dbraw/zinc/38/50/31/719385031.db2.gz	IWTBKWUDDFDAPD-UWVGGRQHSA-N	1	1	312.757	1.471	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)C[C@@H]21	ZINC000347409213	719474517	/nfs/dbraw/zinc/47/45/17/719474517.db2.gz	GYAWUDBSYJFAFF-STQMWFEESA-N	1	1	315.333	1.057	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc4ncc([N+](=O)[O-])n4n3)[C@H]2C1	ZINC001120921982	782236873	/nfs/dbraw/zinc/23/68/73/782236873.db2.gz	FZYWWZUJUTUFHW-DCAQKATOSA-N	1	1	302.338	1.390	20	5		DDBDMO
O=C(NCC[NH2+]CCc1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936222	742829945	/nfs/dbraw/zinc/82/99/45/742829945.db2.gz	BKXAVKNKYNXMCL-CHWSQXEVSA-N	1	1	311.769	1.254	20	5		DDBDMO
O=C(NCC[NH2+]C/C=C\c1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936864	742854041	/nfs/dbraw/zinc/85/40/41/742854041.db2.gz	VFPSMGCVZWVGCT-KOMGFDSOSA-N	1	1	323.780	1.724	20	5		DDBDMO
C[N@@H+]1C[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001195642404	746663268	/nfs/dbraw/zinc/66/32/68/746663268.db2.gz	IQPRANDFWCDIOR-GFCCVEGCSA-N	1	1	313.379	1.213	20	5		DDBDMO
C[N@H+]1C[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001195642404	746663271	/nfs/dbraw/zinc/66/32/71/746663271.db2.gz	IQPRANDFWCDIOR-GFCCVEGCSA-N	1	1	313.379	1.213	20	5		DDBDMO
NC(=O)COC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC001116222872	752146590	/nfs/dbraw/zinc/14/65/90/752146590.db2.gz	FFWBATFVQTUJNN-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2nn[nH]n2)C1	ZINC001197295835	747123288	/nfs/dbraw/zinc/12/32/88/747123288.db2.gz	INRIEEHDIKZKRZ-JTQLQIEISA-N	1	1	304.310	1.106	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2nn[nH]n2)C1	ZINC001197295835	747123293	/nfs/dbraw/zinc/12/32/93/747123293.db2.gz	INRIEEHDIKZKRZ-JTQLQIEISA-N	1	1	304.310	1.106	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCCN(c3ncccn3)CC2)C1	ZINC001169036159	762191888	/nfs/dbraw/zinc/19/18/88/762191888.db2.gz	NGALCJUFXDFBQD-KGLIPLIRSA-N	1	1	305.382	1.434	20	5		DDBDMO
O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169026253	762203225	/nfs/dbraw/zinc/20/32/25/762203225.db2.gz	WOEASBNNHKOJIK-RXFTYZNJSA-N	1	1	307.394	1.519	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H](Oc3cnccn3)C2)C1	ZINC001169053889	762208862	/nfs/dbraw/zinc/20/88/62/762208862.db2.gz	JYLIBIAEYKRAEZ-RDBSUJKOSA-N	1	1	306.366	1.765	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000823484732	758319771	/nfs/dbraw/zinc/31/97/71/758319771.db2.gz	SFZZBUBMNIXGRJ-GASCZTMLSA-N	1	1	321.381	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000823484732	758319780	/nfs/dbraw/zinc/31/97/80/758319780.db2.gz	SFZZBUBMNIXGRJ-GASCZTMLSA-N	1	1	321.381	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000823484732	758319791	/nfs/dbraw/zinc/31/97/91/758319791.db2.gz	SFZZBUBMNIXGRJ-GASCZTMLSA-N	1	1	321.381	1.294	20	5		DDBDMO
COc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001020139321	760613801	/nfs/dbraw/zinc/61/38/01/760613801.db2.gz	XKHQPPYEWWEVAF-QHSBEEBCSA-N	1	1	319.361	1.097	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCCNc1ccc([N+](=O)[O-])cn1	ZINC001109463753	763731582	/nfs/dbraw/zinc/73/15/82/763731582.db2.gz	WFMHIXZLICELPG-UHFFFAOYSA-N	1	1	323.397	1.590	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001097053681	771600098	/nfs/dbraw/zinc/60/00/98/771600098.db2.gz	XAYLIBCXLWURNG-HDJSIYSDSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001148630382	773559009	/nfs/dbraw/zinc/55/90/09/773559009.db2.gz	JNJFYFCQDHFHNK-UHFFFAOYSA-N	1	1	317.777	1.822	20	5		DDBDMO
Cc1cnc(NCCCNC(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC001094456391	775895758	/nfs/dbraw/zinc/89/57/58/775895758.db2.gz	DPQSKAYBXNYFEP-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001101705723	777415680	/nfs/dbraw/zinc/41/56/80/777415680.db2.gz	UDTJEBZXMXEPID-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC001116072741	780472395	/nfs/dbraw/zinc/47/23/95/780472395.db2.gz	KOBAUEVUXAOBOP-UHFFFAOYSA-N	1	1	307.350	1.911	20	5		DDBDMO
CS[C@@H]1CC[C@H]([N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC001116150366	780479595	/nfs/dbraw/zinc/47/95/95/780479595.db2.gz	NSIRQVHNMORPOP-CYZMBNFOSA-N	1	1	314.411	1.368	20	5		DDBDMO
C[C@@](O)(C[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307066	781400846	/nfs/dbraw/zinc/40/08/46/781400846.db2.gz	ZOSCEALOKGQACL-IAGOWNOFSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@@](O)(C[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307066	781400853	/nfs/dbraw/zinc/40/08/53/781400853.db2.gz	ZOSCEALOKGQACL-IAGOWNOFSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[N@H+](CC/C=C/c1ccccc1)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001267194116	837510717	/nfs/dbraw/zinc/51/07/17/837510717.db2.gz	IYRBDORYQRGVDO-IBBQAADRSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@@H+](CC/C=C/c1ccccc1)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267194116	837510725	/nfs/dbraw/zinc/51/07/25/837510725.db2.gz	IYRBDORYQRGVDO-IBBQAADRSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@H+](CC/C=C/c1ccccc1)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267194116	837510735	/nfs/dbraw/zinc/51/07/35/837510735.db2.gz	IYRBDORYQRGVDO-IBBQAADRSA-N	1	1	317.389	1.803	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(F)cc1C	ZINC001266390791	836197217	/nfs/dbraw/zinc/19/72/17/836197217.db2.gz	MHEICKQTSVYODW-HUUCEWRRSA-N	1	1	323.368	1.737	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(F)cc1C	ZINC001266390791	836197220	/nfs/dbraw/zinc/19/72/20/836197220.db2.gz	MHEICKQTSVYODW-HUUCEWRRSA-N	1	1	323.368	1.737	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(F)cc1C	ZINC001266390791	836197225	/nfs/dbraw/zinc/19/72/25/836197225.db2.gz	MHEICKQTSVYODW-HUUCEWRRSA-N	1	1	323.368	1.737	20	5		DDBDMO
CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(C)(C)O	ZINC001268236237	839872768	/nfs/dbraw/zinc/87/27/68/839872768.db2.gz	UGUGKZXJDQHUJN-UHFFFAOYSA-N	1	1	323.393	1.646	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(C)(C)O	ZINC001268236237	839872770	/nfs/dbraw/zinc/87/27/70/839872770.db2.gz	UGUGKZXJDQHUJN-UHFFFAOYSA-N	1	1	323.393	1.646	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc(Cl)nc(C)c2[N+](=O)[O-])C1	ZINC001227341400	843479597	/nfs/dbraw/zinc/47/95/97/843479597.db2.gz	XDFARSXGYMCMNF-SECBINFHSA-N	1	1	316.745	1.446	20	5		DDBDMO
O=C(N[C@H]1CC[C@H](C[NH2+]CCC2CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001272727332	846727670	/nfs/dbraw/zinc/72/76/70/846727670.db2.gz	UZWDQOKMRIWLMH-KBUPBQIOSA-N	1	1	309.410	1.716	20	5		DDBDMO
[NH3+]Cc1ncn(-c2ccc(OC(F)(F)F)c([N+](=O)[O-])c2)n1	ZINC001168753555	848015126	/nfs/dbraw/zinc/01/51/26/848015126.db2.gz	DXLPPLSDMWYMJL-UHFFFAOYSA-N	1	1	303.200	1.533	20	5		DDBDMO
CCN(CC[NH2+]CCc1ccc(C)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273374153	849730243	/nfs/dbraw/zinc/73/02/43/849730243.db2.gz	GNAQDPJRXHPLBT-HZPDHXFCSA-N	1	1	319.405	1.641	20	5		DDBDMO
CC[C@@H]1[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021510	850518065	/nfs/dbraw/zinc/51/80/65/850518065.db2.gz	LGKQCJPNRMFIDS-FQLMCAECSA-N	1	1	309.410	1.955	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCN1C	ZINC001123318760	859173261	/nfs/dbraw/zinc/17/32/61/859173261.db2.gz	SGLIXIFVRFAHAZ-SMDDNHRTSA-N	1	1	321.381	1.351	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)C1	ZINC001142515875	861171240	/nfs/dbraw/zinc/17/12/40/861171240.db2.gz	BMRLKZJIFURTIE-GFCCVEGCSA-N	1	1	306.366	1.760	20	5		DDBDMO
COc1nc(NCC[C@@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-]	ZINC001162808975	867840197	/nfs/dbraw/zinc/84/01/97/867840197.db2.gz	ZPZYKNNTRBBRTC-QMMMGPOBSA-N	1	1	317.296	1.440	20	5		DDBDMO
NC(=O)[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC001336722627	869109033	/nfs/dbraw/zinc/10/90/33/869109033.db2.gz	LDSOAJAYSIVSNB-CABCVRRESA-N	1	1	315.329	1.444	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC001337970196	869722842	/nfs/dbraw/zinc/72/28/42/869722842.db2.gz	HGQPHBZLQCANQO-UHFFFAOYSA-N	1	1	323.397	1.304	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCCC[N@H+]1C	ZINC001339153803	870375097	/nfs/dbraw/zinc/37/50/97/870375097.db2.gz	YQPGEOSSTIAXNR-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@@H]2C1	ZINC001353381038	877291523	/nfs/dbraw/zinc/29/15/23/877291523.db2.gz	VCZPPKUIGIVHSD-OUCADQQQSA-N	1	1	321.352	1.733	20	5		DDBDMO
COc1ccc(CO[C@H](C)C[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC001223513783	880987424	/nfs/dbraw/zinc/98/74/24/880987424.db2.gz	HXVYBNHIOYXQLU-GFCCVEGCSA-N	1	1	310.350	1.841	20	5		DDBDMO
COC(=O)[C@H](OC[C@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647075	881042576	/nfs/dbraw/zinc/04/25/76/881042576.db2.gz	IXRPVYXXCFOALR-BXUZGUMPSA-N	1	1	324.333	1.156	20	5		DDBDMO
COC(=O)[C@H](OC[C@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647075	881042591	/nfs/dbraw/zinc/04/25/91/881042591.db2.gz	IXRPVYXXCFOALR-BXUZGUMPSA-N	1	1	324.333	1.156	20	5		DDBDMO
CN1CCc2c(cccc2OC(=O)C[C@@H](O)C[N+](C)(C)C)C1	ZINC001234419689	887955563	/nfs/dbraw/zinc/95/55/63/887955563.db2.gz	COSQHWANAWKAHO-CQSZACIVSA-N	1	1	307.414	1.037	20	5		DDBDMO
CC(C)OCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001235097869	888409362	/nfs/dbraw/zinc/40/93/62/888409362.db2.gz	DBOBDQFSBXDIQZ-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(CCNC2=O)C1	ZINC001254553084	896497969	/nfs/dbraw/zinc/49/79/69/896497969.db2.gz	RWVQEIUHSFCQJW-BLLLJJGKSA-N	1	1	303.362	1.738	20	5		DDBDMO
Cc1ccncc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001280814759	904075421	/nfs/dbraw/zinc/07/54/21/904075421.db2.gz	SBILOZSDEUMDFU-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
Cc1ccncc1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280814759	904075439	/nfs/dbraw/zinc/07/54/39/904075439.db2.gz	SBILOZSDEUMDFU-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
Cc1ccncc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280814759	904075451	/nfs/dbraw/zinc/07/54/51/904075451.db2.gz	SBILOZSDEUMDFU-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000449696252	230634076	/nfs/dbraw/zinc/63/40/76/230634076.db2.gz	KCALNIBYFNQFIW-OAHLLOKOSA-N	1	1	310.350	1.434	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1CO	ZINC000248915823	282117516	/nfs/dbraw/zinc/11/75/16/282117516.db2.gz	JUXRGGWZYHVNBA-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC(CC[NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000278560181	214237722	/nfs/dbraw/zinc/23/77/22/214237722.db2.gz	JIJMFBHDEKWALA-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
C[N@@H+](CCCCCO)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000278728456	214359486	/nfs/dbraw/zinc/35/94/86/214359486.db2.gz	AQCOEQJYWBOFAF-AWEZNQCLSA-N	1	1	312.366	1.429	20	5		DDBDMO
CO[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000451565642	231126522	/nfs/dbraw/zinc/12/65/22/231126522.db2.gz	LMYGYWPNHWHDKR-DOMZBBRYSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000451565642	231126524	/nfs/dbraw/zinc/12/65/24/231126524.db2.gz	LMYGYWPNHWHDKR-DOMZBBRYSA-N	1	1	321.377	1.914	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000425054901	529822662	/nfs/dbraw/zinc/82/26/62/529822662.db2.gz	FWSLFWCRJBETSP-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000299296219	529903410	/nfs/dbraw/zinc/90/34/10/529903410.db2.gz	RPOJOBLIWSOLPX-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000330889533	232139783	/nfs/dbraw/zinc/13/97/83/232139783.db2.gz	BJXQGIRQTPTWCZ-GXFFZTMASA-N	1	1	323.397	1.397	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1)C1CC1	ZINC000272609233	210008763	/nfs/dbraw/zinc/00/87/63/210008763.db2.gz	WLCRWKONJCWMRM-UHFFFAOYSA-N	1	1	321.362	1.424	20	5		DDBDMO
C[N@@H+](CCCCCO)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000279795926	215152842	/nfs/dbraw/zinc/15/28/42/215152842.db2.gz	WCKFUWJLFUJYQA-CYBMUJFWSA-N	1	1	312.366	1.429	20	5		DDBDMO
CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000358458809	299159014	/nfs/dbraw/zinc/15/90/14/299159014.db2.gz	CJAGPNDINHXRHK-OAHLLOKOSA-N	1	1	303.362	1.832	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)[C@H]2C)c1[N+](=O)[O-]	ZINC000287100141	219313171	/nfs/dbraw/zinc/31/31/71/219313171.db2.gz	LIENOEOBFRFOQW-PWSUYJOCSA-N	1	1	321.381	1.579	20	5		DDBDMO
C[C@@H]1OCC[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000182026197	199376294	/nfs/dbraw/zinc/37/62/94/199376294.db2.gz	MCVMPSLBXVRTED-AVGNSLFASA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1OCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000182026197	199376295	/nfs/dbraw/zinc/37/62/95/199376295.db2.gz	MCVMPSLBXVRTED-AVGNSLFASA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[C@@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000266853258	186359688	/nfs/dbraw/zinc/35/96/88/186359688.db2.gz	SBILWHQGQBJKDM-CYBMUJFWSA-N	1	1	308.382	1.845	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](CCc2cnccn2)CC1	ZINC000601252498	358464260	/nfs/dbraw/zinc/46/42/60/358464260.db2.gz	ZBSNSTHDDCRMOR-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000041886263	352317018	/nfs/dbraw/zinc/31/70/18/352317018.db2.gz	ORSGZGVQTWBHPD-LLVKDONJSA-N	1	1	323.349	1.389	20	5		DDBDMO
CCCn1cc[nH+]c1CCCN(C)c1ncc([N+](=O)[O-])c(N)n1	ZINC000277165376	213338977	/nfs/dbraw/zinc/33/89/77/213338977.db2.gz	MDBQFYQPGQEMKO-UHFFFAOYSA-N	1	1	319.369	1.643	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000046863488	352466375	/nfs/dbraw/zinc/46/63/75/352466375.db2.gz	KZKZRBGGVBEHAY-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
CCNC(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665095	191210884	/nfs/dbraw/zinc/21/08/84/191210884.db2.gz	CCOAJPLKMIWBFW-LLVKDONJSA-N	1	1	307.354	1.002	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046995088	352475666	/nfs/dbraw/zinc/47/56/66/352475666.db2.gz	DHVZYKURDPKTGB-QWHCGFSZSA-N	1	1	319.361	1.717	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000052502284	352613015	/nfs/dbraw/zinc/61/30/15/352613015.db2.gz	HOTCTJGMJXNREZ-GFCCVEGCSA-N	1	1	321.381	1.400	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000173087114	198183901	/nfs/dbraw/zinc/18/39/01/198183901.db2.gz	NXJBEWYRLZVNHB-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000064570497	352940535	/nfs/dbraw/zinc/94/05/35/352940535.db2.gz	FRCVNLBDURGEAD-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000064570497	352940537	/nfs/dbraw/zinc/94/05/37/352940537.db2.gz	FRCVNLBDURGEAD-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1	ZINC000068226857	353097526	/nfs/dbraw/zinc/09/75/26/353097526.db2.gz	KVLSOTTXTCJKNJ-RYUDHWBXSA-N	1	1	323.397	1.336	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000070949922	353186727	/nfs/dbraw/zinc/18/67/27/353186727.db2.gz	QDEBEKQYOKAUQI-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000070949922	353186729	/nfs/dbraw/zinc/18/67/29/353186729.db2.gz	QDEBEKQYOKAUQI-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCCC[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000072950596	353227444	/nfs/dbraw/zinc/22/74/44/353227444.db2.gz	NSYJNWSZOHDARL-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000073786984	353270872	/nfs/dbraw/zinc/27/08/72/353270872.db2.gz	UKLBSJLPLOQZBI-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000174472904	198338682	/nfs/dbraw/zinc/33/86/82/198338682.db2.gz	KRWWZHFRJFUCDZ-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000174703869	198373085	/nfs/dbraw/zinc/37/30/85/198373085.db2.gz	FBDHPAMSJHYYHN-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000080223515	353597601	/nfs/dbraw/zinc/59/76/01/353597601.db2.gz	SFUYWPNXCHPANG-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
Cc1ccnc(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145252	353791385	/nfs/dbraw/zinc/79/13/85/353791385.db2.gz	FQNFOHSQIWESEZ-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccnc(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145252	353791388	/nfs/dbraw/zinc/79/13/88/353791388.db2.gz	FQNFOHSQIWESEZ-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
CCc1nn(C)c(NC2CC[NH+](CCN(C)C)CC2)c1[N+](=O)[O-]	ZINC000094135119	353911044	/nfs/dbraw/zinc/91/10/44/353911044.db2.gz	CWRULBBZMQIXGF-UHFFFAOYSA-N	1	1	324.429	1.329	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000093344045	353897589	/nfs/dbraw/zinc/89/75/89/353897589.db2.gz	WOZGRMFGWORLDC-RISCZKNCSA-N	1	1	310.350	1.685	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000142316738	354144132	/nfs/dbraw/zinc/14/41/32/354144132.db2.gz	QTOISPKTXTYWLD-HNNXBMFYSA-N	1	1	303.362	1.834	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157312858	354224483	/nfs/dbraw/zinc/22/44/83/354224483.db2.gz	OOLNTIGGWVKKCX-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157312858	354224485	/nfs/dbraw/zinc/22/44/85/354224485.db2.gz	OOLNTIGGWVKKCX-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
CC(=O)N1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000268686116	354406167	/nfs/dbraw/zinc/40/61/67/354406167.db2.gz	NOUGINGDTUCTJC-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(=O)N1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000268686116	354406172	/nfs/dbraw/zinc/40/61/72/354406172.db2.gz	NOUGINGDTUCTJC-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[N@H+](CCO)C(C)(C)C1	ZINC000588829998	354940288	/nfs/dbraw/zinc/94/02/88/354940288.db2.gz	CDUOLYRAUDNBRI-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000588829998	354940289	/nfs/dbraw/zinc/94/02/89/354940289.db2.gz	CDUOLYRAUDNBRI-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590045422	355043260	/nfs/dbraw/zinc/04/32/60/355043260.db2.gz	RZCDKFQHFUJLNX-GXTWGEPZSA-N	1	1	319.361	1.770	20	5		DDBDMO
[NH3+]CC(F)(F)CNCc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000591278451	355276958	/nfs/dbraw/zinc/27/69/58/355276958.db2.gz	OXOCHGALHKIRQY-UHFFFAOYSA-N	1	1	303.265	1.050	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C[C@H](C)[N@@H+]1C	ZINC000358724215	299232934	/nfs/dbraw/zinc/23/29/34/299232934.db2.gz	MSQULGKJPUQHHG-PHIMTYICSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000592763600	355680920	/nfs/dbraw/zinc/68/09/20/355680920.db2.gz	WOCVDDHTKMMYSU-BXUZGUMPSA-N	1	1	307.350	1.430	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](O)[C@H]2C)c1	ZINC000593031054	355775270	/nfs/dbraw/zinc/77/52/70/355775270.db2.gz	ZJTOPGATGUDWRM-QMTHXVAHSA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](O)[C@H]2C)c1	ZINC000593031054	355775272	/nfs/dbraw/zinc/77/52/72/355775272.db2.gz	ZJTOPGATGUDWRM-QMTHXVAHSA-N	1	1	308.334	1.727	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](CC)CO1	ZINC000593058258	355782308	/nfs/dbraw/zinc/78/23/08/355782308.db2.gz	KBGSRWKILUBZRK-GXTWGEPZSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](CC)CO1	ZINC000593058258	355782312	/nfs/dbraw/zinc/78/23/12/355782312.db2.gz	KBGSRWKILUBZRK-GXTWGEPZSA-N	1	1	309.366	1.646	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC[N@H+](C)CC(C)C	ZINC000593204359	355823766	/nfs/dbraw/zinc/82/37/66/355823766.db2.gz	OMNMAUZTCAVPPN-UHFFFAOYSA-N	1	1	311.386	1.194	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594418451	356204007	/nfs/dbraw/zinc/20/40/07/356204007.db2.gz	JBAFFCZSRDJNJH-WDEREUQCSA-N	1	1	307.354	1.373	20	5		DDBDMO
O=C1NCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000594962890	356364784	/nfs/dbraw/zinc/36/47/84/356364784.db2.gz	MXXUNDJSYFXVFG-ZDUSSCGKSA-N	1	1	301.302	1.833	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(N)=O)CC1	ZINC000081540708	192286535	/nfs/dbraw/zinc/28/65/35/192286535.db2.gz	FYVBDNPPTVBUQQ-UHFFFAOYSA-N	1	1	308.338	1.236	20	5		DDBDMO
CC(C)[C@@](C)(C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236836162	202032451	/nfs/dbraw/zinc/03/24/51/202032451.db2.gz	OLBWIPJUNHXECY-CQSZACIVSA-N	1	1	305.338	1.574	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(Cn3cnnc3)CC2)c1[N+](=O)[O-]	ZINC000595559714	356551251	/nfs/dbraw/zinc/55/12/51/356551251.db2.gz	UZAQHCOFJZFEAS-UHFFFAOYSA-N	1	1	306.326	1.395	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@H](C)O)c([N+](=O)[O-])c1	ZINC000595766525	356643983	/nfs/dbraw/zinc/64/39/83/356643983.db2.gz	OPCYQTCGDIKFMT-WCQYABFASA-N	1	1	310.350	1.827	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H]2C[C@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595807861	356658818	/nfs/dbraw/zinc/65/88/18/356658818.db2.gz	BGQWFPWGPWOGTK-AAEUAGOBSA-N	1	1	301.346	1.826	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]2C[C@H]2C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595807861	356658822	/nfs/dbraw/zinc/65/88/22/356658822.db2.gz	BGQWFPWGPWOGTK-AAEUAGOBSA-N	1	1	301.346	1.826	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](F)[C@H](N)C1	ZINC000595905845	356699714	/nfs/dbraw/zinc/69/97/14/356699714.db2.gz	HMHBBSVTEANNCF-CHWSQXEVSA-N	1	1	324.356	1.603	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](F)[C@H](N)C1	ZINC000595905845	356699716	/nfs/dbraw/zinc/69/97/16/356699716.db2.gz	HMHBBSVTEANNCF-CHWSQXEVSA-N	1	1	324.356	1.603	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596091651	356769092	/nfs/dbraw/zinc/76/90/92/356769092.db2.gz	BJYBEUYKOFCROQ-NSHDSACASA-N	1	1	306.366	1.836	20	5		DDBDMO
COC(=O)c1cc(OCCc2c[nH+]cn2C)ccc1[N+](=O)[O-]	ZINC000596257227	356834595	/nfs/dbraw/zinc/83/45/95/356834595.db2.gz	GZBMTUOXTRFZMY-UHFFFAOYSA-N	1	1	305.290	1.736	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)C1	ZINC000596136091	356786409	/nfs/dbraw/zinc/78/64/09/356786409.db2.gz	HCUIDCOHBPWMAQ-FZMZJTMJSA-N	1	1	320.393	1.860	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000596499065	356898500	/nfs/dbraw/zinc/89/85/00/356898500.db2.gz	MDFIEPGTTUEJLM-LBPRGKRZSA-N	1	1	306.366	1.775	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)CC(C)(CO)CO)ccc1[N+](=O)[O-]	ZINC000276828347	213119386	/nfs/dbraw/zinc/11/93/86/213119386.db2.gz	AOPDVEJIGQTQFL-UHFFFAOYSA-N	1	1	312.366	1.416	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H](C)C1(F)F	ZINC000599512295	357960664	/nfs/dbraw/zinc/96/06/64/357960664.db2.gz	HVGFEBSTIIXEKL-UMNHJUIQSA-N	1	1	318.324	1.375	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)COC1	ZINC000599571622	357979622	/nfs/dbraw/zinc/97/96/22/357979622.db2.gz	OAGMOXKFALISAH-GFCCVEGCSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[N@@H+](CC1(C)COC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000599571972	357979742	/nfs/dbraw/zinc/97/97/42/357979742.db2.gz	ZADGJMCMQQVYHR-AWEZNQCLSA-N	1	1	319.361	1.668	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCc3nc(C4CC4)ncc3C2)c1	ZINC000599620268	357994910	/nfs/dbraw/zinc/99/49/10/357994910.db2.gz	TZTMVWPBFZBTSS-UHFFFAOYSA-N	1	1	314.349	1.517	20	5		DDBDMO
C[C@]1(CO)C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000599622555	357995855	/nfs/dbraw/zinc/99/58/55/357995855.db2.gz	GBFOGNFLWWIZTG-IYBDPMFKSA-N	1	1	324.377	1.286	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000600190541	358150815	/nfs/dbraw/zinc/15/08/15/358150815.db2.gz	GWZFWJLAYGPXME-YERXGYGTSA-N	1	1	320.345	1.872	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000600190541	358150816	/nfs/dbraw/zinc/15/08/16/358150816.db2.gz	GWZFWJLAYGPXME-YERXGYGTSA-N	1	1	320.345	1.872	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCCC[NH2+]C[C@@H](O)CN2CCCC2)cc1	ZINC000600721978	358296528	/nfs/dbraw/zinc/29/65/28/358296528.db2.gz	DDGRKBIHLMKAPA-QGZVFWFLSA-N	1	1	321.421	1.964	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2c(F)cccc2[N+](=O)[O-])n1C	ZINC000601163404	358428551	/nfs/dbraw/zinc/42/85/51/358428551.db2.gz	HXENQMPFEXMSCE-UHFFFAOYSA-N	1	1	321.312	1.463	20	5		DDBDMO
Cn1cc(C[N@H+]2CCc3ccc(O)cc3CC2)c([N+](=O)[O-])n1	ZINC000602454435	358988662	/nfs/dbraw/zinc/98/86/62/358988662.db2.gz	NLGYIOQOGZFRKB-UHFFFAOYSA-N	1	1	302.334	1.635	20	5		DDBDMO
CCOC(=O)CC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602483277	359008801	/nfs/dbraw/zinc/00/88/01/359008801.db2.gz	FZGWVILPTIHFJM-LBPRGKRZSA-N	1	1	324.381	1.884	20	5		DDBDMO
C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CN(C)CCO1	ZINC000602575393	359051149	/nfs/dbraw/zinc/05/11/49/359051149.db2.gz	HJBNSAKSFUQUQE-IINYFYTJSA-N	1	1	320.349	1.545	20	5		DDBDMO
Cn1cc(C[N@@H+](CC(C)(C)O)C2CCOCC2)c([N+](=O)[O-])n1	ZINC000602779069	359184768	/nfs/dbraw/zinc/18/47/68/359184768.db2.gz	LDNHMVTVNDKTRA-UHFFFAOYSA-N	1	1	312.370	1.080	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2ccccc2[C@H]1CO	ZINC000602795584	359197819	/nfs/dbraw/zinc/19/78/19/359197819.db2.gz	MMLKLIFRRKOUJD-OAHLLOKOSA-N	1	1	316.361	1.691	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H]4C[C@@]4(O)C3)co2)cc1	ZINC000603085407	359393759	/nfs/dbraw/zinc/39/37/59/359393759.db2.gz	GCFHPCYFOGGDFM-IAQYHMDHSA-N	1	1	301.302	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@H]4C[C@@]4(O)C3)co2)cc1	ZINC000603085407	359393762	/nfs/dbraw/zinc/39/37/62/359393762.db2.gz	GCFHPCYFOGGDFM-IAQYHMDHSA-N	1	1	301.302	1.816	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000603401186	359617695	/nfs/dbraw/zinc/61/76/95/359617695.db2.gz	ITZREGFHQXAJGW-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000281133981	216100613	/nfs/dbraw/zinc/10/06/13/216100613.db2.gz	NSJKTCUDDJCMLO-CQSZACIVSA-N	1	1	322.321	1.461	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000609383604	360303082	/nfs/dbraw/zinc/30/30/82/360303082.db2.gz	WIKONWGIJSNAOG-CYBMUJFWSA-N	1	1	318.377	1.851	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])C1	ZINC000609269403	360285799	/nfs/dbraw/zinc/28/57/99/360285799.db2.gz	PRCIKOCHYQTKBI-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846482	360355419	/nfs/dbraw/zinc/35/54/19/360355419.db2.gz	RTHJJMLEUZXLAE-ZYHUDNBSSA-N	1	1	319.365	1.143	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846482	360355424	/nfs/dbraw/zinc/35/54/24/360355424.db2.gz	RTHJJMLEUZXLAE-ZYHUDNBSSA-N	1	1	319.365	1.143	20	5		DDBDMO
C[C@@H]1C[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000610271198	360404920	/nfs/dbraw/zinc/40/49/20/360404920.db2.gz	JWMXABVBMAZRSW-YPMHNXCESA-N	1	1	321.377	1.938	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000610615590	360482040	/nfs/dbraw/zinc/48/20/40/360482040.db2.gz	ULTIYBCPMKYFSF-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000610615590	360482042	/nfs/dbraw/zinc/48/20/42/360482042.db2.gz	ULTIYBCPMKYFSF-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000610920548	360571920	/nfs/dbraw/zinc/57/19/20/360571920.db2.gz	QFTVDFSDQFVLLY-SECBINFHSA-N	1	1	307.354	1.408	20	5		DDBDMO
CC1(O)CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611272033	360685489	/nfs/dbraw/zinc/68/54/89/360685489.db2.gz	GKZHKAALXZQIKA-UHFFFAOYSA-N	1	1	308.334	1.713	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC(C)(C)O)c1cccc([N+](=O)[O-])c1	ZINC000611560953	360760010	/nfs/dbraw/zinc/76/00/10/360760010.db2.gz	SLJNYCXUXIQSJK-ZDUSSCGKSA-N	1	1	304.350	1.778	20	5		DDBDMO
CCO[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000612030393	360894165	/nfs/dbraw/zinc/89/41/65/360894165.db2.gz	UMSDEWJTKNQMKR-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3=CCCOC3)C2)nc1	ZINC000093534724	193266588	/nfs/dbraw/zinc/26/65/88/193266588.db2.gz	YRXHSAWVDPWVEX-CYBMUJFWSA-N	1	1	304.350	1.823	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000350596984	284219039	/nfs/dbraw/zinc/21/90/39/284219039.db2.gz	IQFYDPRLXVCDFB-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])C1	ZINC000266073061	205074303	/nfs/dbraw/zinc/07/43/03/205074303.db2.gz	FLUDKRYKWZYYEQ-GFCCVEGCSA-N	1	1	307.350	1.354	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000266344527	205281037	/nfs/dbraw/zinc/28/10/37/205281037.db2.gz	IROOQQWDJBTCCX-NWDGAFQWSA-N	1	1	309.366	1.495	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288576830	220253545	/nfs/dbraw/zinc/25/35/45/220253545.db2.gz	UUSWGKUZJHVSJC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288576830	220253548	/nfs/dbraw/zinc/25/35/48/220253548.db2.gz	UUSWGKUZJHVSJC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288576830	220253553	/nfs/dbraw/zinc/25/35/53/220253553.db2.gz	UUSWGKUZJHVSJC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288576830	220253557	/nfs/dbraw/zinc/25/35/57/220253557.db2.gz	UUSWGKUZJHVSJC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCS2(=O)=O)c(F)c1	ZINC000336838882	249246789	/nfs/dbraw/zinc/24/67/89/249246789.db2.gz	NRGYGDASTDDBMK-NSHDSACASA-N	1	1	302.327	1.401	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337193873	249382675	/nfs/dbraw/zinc/38/26/75/249382675.db2.gz	YMVZCMNTSQGRSA-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337193873	249382680	/nfs/dbraw/zinc/38/26/80/249382680.db2.gz	YMVZCMNTSQGRSA-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337193873	249382683	/nfs/dbraw/zinc/38/26/83/249382683.db2.gz	YMVZCMNTSQGRSA-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285072822	218279381	/nfs/dbraw/zinc/27/93/81/218279381.db2.gz	HCYVJHLADODKSH-LLVKDONJSA-N	1	1	309.370	1.560	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](O)C[C@H]1C	ZINC000340925923	251280794	/nfs/dbraw/zinc/28/07/94/251280794.db2.gz	IVVXCMIYBPCONN-YPMHNXCESA-N	1	1	307.350	1.687	20	5		DDBDMO
CNC(=O)NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000064350412	184295590	/nfs/dbraw/zinc/29/55/90/184295590.db2.gz	SXWAGXLJNVRFJC-UHFFFAOYSA-N	1	1	308.338	1.261	20	5		DDBDMO
CNC(=O)NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000064350412	184295592	/nfs/dbraw/zinc/29/55/92/184295592.db2.gz	SXWAGXLJNVRFJC-UHFFFAOYSA-N	1	1	308.338	1.261	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000155534285	197063540	/nfs/dbraw/zinc/06/35/40/197063540.db2.gz	JZAGMQFKOGLQNJ-TXEJJXNPSA-N	1	1	307.350	1.525	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000154978754	197009641	/nfs/dbraw/zinc/00/96/41/197009641.db2.gz	PZBGMYSZOMRBKO-SNVBAGLBSA-N	1	1	323.349	1.309	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000154978754	197009643	/nfs/dbraw/zinc/00/96/43/197009643.db2.gz	PZBGMYSZOMRBKO-SNVBAGLBSA-N	1	1	323.349	1.309	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H]1CCC[C@H]1O	ZINC000352701040	285238825	/nfs/dbraw/zinc/23/88/25/285238825.db2.gz	VFZYMSKBJSTRFK-ZIAGYGMSSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000120493028	195177003	/nfs/dbraw/zinc/17/70/03/195177003.db2.gz	VOJWOZHTCXMUHP-UHFFFAOYSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CO)C1	ZINC000121594452	195312742	/nfs/dbraw/zinc/31/27/42/195312742.db2.gz	XACGOWKGCQCUCE-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CO)C1	ZINC000121594452	195312743	/nfs/dbraw/zinc/31/27/43/195312743.db2.gz	XACGOWKGCQCUCE-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
COc1cccc(C(=O)NCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000444142767	533408576	/nfs/dbraw/zinc/40/85/76/533408576.db2.gz	LFFJFJRQDHWHDB-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000122563768	407304722	/nfs/dbraw/zinc/30/47/22/407304722.db2.gz	UWRYLVYRPKVYLO-NSHDSACASA-N	1	1	307.354	1.312	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](CC2CCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000122563768	407304723	/nfs/dbraw/zinc/30/47/23/407304723.db2.gz	UWRYLVYRPKVYLO-NSHDSACASA-N	1	1	307.354	1.312	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000122563768	407304724	/nfs/dbraw/zinc/30/47/24/407304724.db2.gz	UWRYLVYRPKVYLO-NSHDSACASA-N	1	1	307.354	1.312	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])C1	ZINC000107888947	407381041	/nfs/dbraw/zinc/38/10/41/407381041.db2.gz	LSJLYMPUAWBAQS-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000126251670	407408826	/nfs/dbraw/zinc/40/88/26/407408826.db2.gz	ROQGBYJPHYNDFM-MFKMUULPSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)CS(C)(=O)=O	ZINC000112618968	407433838	/nfs/dbraw/zinc/43/38/38/407433838.db2.gz	HRDJQEOBEVXVAZ-GFCCVEGCSA-N	1	1	314.407	1.892	20	5		DDBDMO
CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)CS(C)(=O)=O	ZINC000112618968	407433839	/nfs/dbraw/zinc/43/38/39/407433839.db2.gz	HRDJQEOBEVXVAZ-GFCCVEGCSA-N	1	1	314.407	1.892	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000271005832	407462973	/nfs/dbraw/zinc/46/29/73/407462973.db2.gz	ZEZYSRVSKDWVEW-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000271005832	407462974	/nfs/dbraw/zinc/46/29/74/407462974.db2.gz	ZEZYSRVSKDWVEW-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000261764052	407606036	/nfs/dbraw/zinc/60/60/36/407606036.db2.gz	QRBCCZMLRRMYND-ZDUSSCGKSA-N	1	1	315.333	1.115	20	5		DDBDMO
O=C1CNC(=O)N1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000130055056	407650542	/nfs/dbraw/zinc/65/05/42/407650542.db2.gz	JVHKANVNKFMPSO-UHFFFAOYSA-N	1	1	318.333	1.111	20	5		DDBDMO
COc1cc(N2C[C@H]3OCC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000153134441	407760979	/nfs/dbraw/zinc/76/09/79/407760979.db2.gz	ICIFIEAJOIQGEX-GXTWGEPZSA-N	1	1	311.313	1.262	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CCN1CC(F)F	ZINC000153332235	407804261	/nfs/dbraw/zinc/80/42/61/407804261.db2.gz	BJVRMUCRGCVZOH-LLVKDONJSA-N	1	1	317.340	1.453	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CCN1CC(F)F	ZINC000153332235	407804267	/nfs/dbraw/zinc/80/42/67/407804267.db2.gz	BJVRMUCRGCVZOH-LLVKDONJSA-N	1	1	317.340	1.453	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@@H]1C	ZINC000117290557	407824000	/nfs/dbraw/zinc/82/40/00/407824000.db2.gz	DAROVFIZKYQWBC-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@@H]1C	ZINC000117290557	407824002	/nfs/dbraw/zinc/82/40/02/407824002.db2.gz	DAROVFIZKYQWBC-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
CCCNC(=O)C[N@H+](CCC)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153754111	407894106	/nfs/dbraw/zinc/89/41/06/407894106.db2.gz	KSZVHCISYZIHQV-OAHLLOKOSA-N	1	1	323.393	1.866	20	5		DDBDMO
CCCNC(=O)C[N@@H+](CCC)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153754111	407894113	/nfs/dbraw/zinc/89/41/13/407894113.db2.gz	KSZVHCISYZIHQV-OAHLLOKOSA-N	1	1	323.393	1.866	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000267599234	407848234	/nfs/dbraw/zinc/84/82/34/407848234.db2.gz	JBFABSXIDMFDPH-DGCLKSJQSA-N	1	1	320.393	1.731	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@H]1C	ZINC000174316980	407931238	/nfs/dbraw/zinc/93/12/38/407931238.db2.gz	FAUWCGNHJAQGEY-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@H]1C	ZINC000174316980	407931242	/nfs/dbraw/zinc/93/12/42/407931242.db2.gz	FAUWCGNHJAQGEY-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000189561364	408049769	/nfs/dbraw/zinc/04/97/69/408049769.db2.gz	LKVRLXFUBPWPED-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
Cc1nnc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)[nH]1	ZINC000268497002	408070796	/nfs/dbraw/zinc/07/07/96/408070796.db2.gz	RIWYDAFKHZSMSX-LLVKDONJSA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000268497002	408070803	/nfs/dbraw/zinc/07/08/03/408070803.db2.gz	RIWYDAFKHZSMSX-LLVKDONJSA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000268497002	408070813	/nfs/dbraw/zinc/07/08/13/408070813.db2.gz	RIWYDAFKHZSMSX-LLVKDONJSA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1nc2sccn2c1C[N@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000268508311	408077442	/nfs/dbraw/zinc/07/74/42/408077442.db2.gz	VPWJNKCSBPHPJI-UHFFFAOYSA-N	1	1	320.378	1.941	20	5		DDBDMO
Cc1nc2sccn2c1C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000268508311	408077446	/nfs/dbraw/zinc/07/74/46/408077446.db2.gz	VPWJNKCSBPHPJI-UHFFFAOYSA-N	1	1	320.378	1.941	20	5		DDBDMO
CC(C)(C)[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O	ZINC000273244434	408123286	/nfs/dbraw/zinc/12/32/86/408123286.db2.gz	GERNIQHYFXWIGT-UONOGXRCSA-N	1	1	323.393	1.485	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CC(C)(CO)CO	ZINC000135865302	408056012	/nfs/dbraw/zinc/05/60/12/408056012.db2.gz	RJBLRHSMJUSCIM-UHFFFAOYSA-N	1	1	312.366	1.416	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC(C)(CO)CO	ZINC000135865302	408056018	/nfs/dbraw/zinc/05/60/18/408056018.db2.gz	RJBLRHSMJUSCIM-UHFFFAOYSA-N	1	1	312.366	1.416	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccccc1[N+](=O)[O-]	ZINC000263646379	408188165	/nfs/dbraw/zinc/18/81/65/408188165.db2.gz	ASRWJJVSPZDJET-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]([NH2+]CCCN1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000122136722	408255459	/nfs/dbraw/zinc/25/54/59/408255459.db2.gz	RJXQZTRSRKXPOZ-CQSZACIVSA-N	1	1	306.410	1.883	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000269459841	408317582	/nfs/dbraw/zinc/31/75/82/408317582.db2.gz	HMGNVBZGGJFJQY-UWVGGRQHSA-N	1	1	321.381	1.796	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269459870	408317772	/nfs/dbraw/zinc/31/77/72/408317772.db2.gz	HMPWLOGPXKTCJK-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000269459870	408317774	/nfs/dbraw/zinc/31/77/74/408317774.db2.gz	HMPWLOGPXKTCJK-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269459870	408317778	/nfs/dbraw/zinc/31/77/78/408317778.db2.gz	HMPWLOGPXKTCJK-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCN(CC(F)(F)F)CC2)n1	ZINC000176250515	408325230	/nfs/dbraw/zinc/32/52/30/408325230.db2.gz	SOEXDPCWLOEZFC-UHFFFAOYSA-N	1	1	321.303	1.361	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(CC(F)(F)F)CC2)n1	ZINC000176250515	408325235	/nfs/dbraw/zinc/32/52/35/408325235.db2.gz	SOEXDPCWLOEZFC-UHFFFAOYSA-N	1	1	321.303	1.361	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269328127	408269814	/nfs/dbraw/zinc/26/98/14/408269814.db2.gz	DMSYRUHWKIRJJX-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269328127	408269820	/nfs/dbraw/zinc/26/98/20/408269820.db2.gz	DMSYRUHWKIRJJX-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269328127	408269826	/nfs/dbraw/zinc/26/98/26/408269826.db2.gz	DMSYRUHWKIRJJX-WDEREUQCSA-N	1	1	321.381	1.750	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCCn3ccnc3)C2)nc1	ZINC000183190397	408347233	/nfs/dbraw/zinc/34/72/33/408347233.db2.gz	MLOLLJIUQJUKTM-CYBMUJFWSA-N	1	1	316.365	1.763	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000269600509	408356149	/nfs/dbraw/zinc/35/61/49/408356149.db2.gz	AEZCZJMEUZFJGN-UHFFFAOYSA-N	1	1	323.303	1.933	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000159407359	408405569	/nfs/dbraw/zinc/40/55/69/408405569.db2.gz	CXWFNGLQGBDAKS-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000274471171	408417403	/nfs/dbraw/zinc/41/74/03/408417403.db2.gz	ZEHHHVWTZRPRDK-UHFFFAOYSA-N	1	1	314.317	1.170	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@@H]1c1ccccc1	ZINC000270338982	408493000	/nfs/dbraw/zinc/49/30/00/408493000.db2.gz	ZBGUPNRJIBOLBA-AAEUAGOBSA-N	1	1	314.349	1.824	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177052898	408509156	/nfs/dbraw/zinc/50/91/56/408509156.db2.gz	MAQJNIZZMIJFJP-AAEUAGOBSA-N	1	1	303.362	1.879	20	5		DDBDMO
C[C@H](C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O)c1nccs1	ZINC000183927740	408509418	/nfs/dbraw/zinc/50/94/18/408509418.db2.gz	LMFATYZBRXUZCH-LLVKDONJSA-N	1	1	322.390	1.949	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@H]21	ZINC000248042308	408527000	/nfs/dbraw/zinc/52/70/00/408527000.db2.gz	TZQOQAHNUPGAFP-XHDPSFHLSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248456964	408570547	/nfs/dbraw/zinc/57/05/47/408570547.db2.gz	LZPBWQMQNGGYDP-RWMBFGLXSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000161273663	408581984	/nfs/dbraw/zinc/58/19/84/408581984.db2.gz	GFTGUXUIHIDTMX-YPMHNXCESA-N	1	1	309.370	1.026	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOCC12CCCC2	ZINC000270567933	408583492	/nfs/dbraw/zinc/58/34/92/408583492.db2.gz	ADIQGZBCQWBOBP-UHFFFAOYSA-N	1	1	307.350	1.402	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOCC12CCCC2	ZINC000270567933	408583496	/nfs/dbraw/zinc/58/34/96/408583496.db2.gz	ADIQGZBCQWBOBP-UHFFFAOYSA-N	1	1	307.350	1.402	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000192646785	408624957	/nfs/dbraw/zinc/62/49/57/408624957.db2.gz	ZAJZBEXLTFMJHT-MEBBXXQBSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000192646785	408624960	/nfs/dbraw/zinc/62/49/60/408624960.db2.gz	ZAJZBEXLTFMJHT-MEBBXXQBSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1O	ZINC000249531011	408738977	/nfs/dbraw/zinc/73/89/77/408738977.db2.gz	AXUIWIAXEJUMSC-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@H]1O	ZINC000249531011	408738982	/nfs/dbraw/zinc/73/89/82/408738982.db2.gz	AXUIWIAXEJUMSC-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000163658099	408785562	/nfs/dbraw/zinc/78/55/62/408785562.db2.gz	HEQZTKKFBGNFQS-GHMZBOCLSA-N	1	1	309.370	1.179	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000251853245	408787835	/nfs/dbraw/zinc/78/78/35/408787835.db2.gz	QPAILHDQOPQQMG-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000251853245	408787836	/nfs/dbraw/zinc/78/78/36/408787836.db2.gz	QPAILHDQOPQQMG-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@@H]12	ZINC000185130879	408765177	/nfs/dbraw/zinc/76/51/77/408765177.db2.gz	NBERQTNIEKNCIX-GGZOMVNGSA-N	1	1	315.333	1.280	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000276162938	408823800	/nfs/dbraw/zinc/82/38/00/408823800.db2.gz	FXMPRLCWSKZARL-AWEZNQCLSA-N	1	1	305.334	1.279	20	5		DDBDMO
C[NH+](C)CC1(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCC1	ZINC000281601457	408895666	/nfs/dbraw/zinc/89/56/66/408895666.db2.gz	DEJGYOVNDFTFAF-UHFFFAOYSA-N	1	1	317.349	1.685	20	5		DDBDMO
Cc1c(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000285953366	408895919	/nfs/dbraw/zinc/89/59/19/408895919.db2.gz	WHZJGQCERZADPG-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000281674570	408907931	/nfs/dbraw/zinc/90/79/31/408907931.db2.gz	LWIYKCOUAJRHLT-MELADBBJSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000276583950	408888214	/nfs/dbraw/zinc/88/82/14/408888214.db2.gz	PAMMEWDSICUION-SCRDCRAPSA-N	1	1	320.345	1.530	20	5		DDBDMO
COCC[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1C	ZINC000277487380	408949858	/nfs/dbraw/zinc/94/98/58/408949858.db2.gz	DETFXUZMTITVRP-NSHDSACASA-N	1	1	319.365	1.628	20	5		DDBDMO
CC(C)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000286235338	408946199	/nfs/dbraw/zinc/94/61/99/408946199.db2.gz	UIPRUCHEKFYFIL-INIZCTEOSA-N	1	1	321.425	1.861	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000277567938	408966537	/nfs/dbraw/zinc/96/65/37/408966537.db2.gz	KWUKJXAVIGEOEJ-WDEREUQCSA-N	1	1	319.361	1.958	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@H]1C	ZINC000277638654	408982706	/nfs/dbraw/zinc/98/27/06/408982706.db2.gz	TUHZCGDKHVQUOJ-QMTHXVAHSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCC[C@@]1(CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000277653831	408985609	/nfs/dbraw/zinc/98/56/09/408985609.db2.gz	DFIYREIQWVKNCT-INIZCTEOSA-N	1	1	321.377	1.821	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286447341	408986776	/nfs/dbraw/zinc/98/67/76/408986776.db2.gz	JQPMKXHCGYSHGD-ZLKJLUDKSA-N	1	1	307.350	1.767	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000277721543	408998619	/nfs/dbraw/zinc/99/86/19/408998619.db2.gz	JFNYJKUPLUQVRD-MWLCHTKSSA-N	1	1	322.287	1.427	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](C)CO	ZINC000292307443	409021296	/nfs/dbraw/zinc/02/12/96/409021296.db2.gz	VCCJKIXCZNXTMY-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H](C)CO	ZINC000292307443	409021302	/nfs/dbraw/zinc/02/13/02/409021302.db2.gz	VCCJKIXCZNXTMY-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](NC[C@H]1C[N@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668331	409158059	/nfs/dbraw/zinc/15/80/59/409158059.db2.gz	JPMLFWIXVHELFN-AAEUAGOBSA-N	1	1	307.398	1.073	20	5		DDBDMO
C[C@H](NC[C@H]1C[N@@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668331	409158062	/nfs/dbraw/zinc/15/80/62/409158062.db2.gz	JPMLFWIXVHELFN-AAEUAGOBSA-N	1	1	307.398	1.073	20	5		DDBDMO
COc1cc(C[NH2+]Cc2cc(C)nn2C)c([N+](=O)[O-])cc1O	ZINC000284069258	409268397	/nfs/dbraw/zinc/26/83/97/409268397.db2.gz	UIKUUDKQYVPUDK-UHFFFAOYSA-N	1	1	306.322	1.641	20	5		DDBDMO
C[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280507078	409334108	/nfs/dbraw/zinc/33/41/08/409334108.db2.gz	NINIUUHUPPEYNQ-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280507078	409334116	/nfs/dbraw/zinc/33/41/16/409334116.db2.gz	NINIUUHUPPEYNQ-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)c1	ZINC000295556203	409346347	/nfs/dbraw/zinc/34/63/47/409346347.db2.gz	UAJCOELLMHADML-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2NC)CC1	ZINC000307857698	164004224	/nfs/dbraw/zinc/00/42/24/164004224.db2.gz	HDVRDFIUZYRLHX-UHFFFAOYSA-N	1	1	306.366	1.804	20	5		DDBDMO
CC(C)[C@@H](CNc1ccc([N+](=O)[O-])nc1)N1CC[NH+](C)CC1	ZINC000315971645	164020987	/nfs/dbraw/zinc/02/09/87/164020987.db2.gz	VHMLGBSBUNAPCE-CQSZACIVSA-N	1	1	307.398	1.674	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000408182337	164253070	/nfs/dbraw/zinc/25/30/70/164253070.db2.gz	JJSXAAJFPIDZKI-NEPJUHHUSA-N	1	1	306.366	1.632	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)CC[C@@H]1C	ZINC000354006982	409594249	/nfs/dbraw/zinc/59/42/49/409594249.db2.gz	OFCRSYDGTFOLIU-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1nc(N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000296794509	409640416	/nfs/dbraw/zinc/64/04/16/409640416.db2.gz	OLFJDDMFURQBLY-NSHDSACASA-N	1	1	321.381	1.383	20	5		DDBDMO
CCC(=O)N1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000305157869	409705642	/nfs/dbraw/zinc/70/56/42/409705642.db2.gz	DBROKMZIJFAEAH-HNNXBMFYSA-N	1	1	321.377	1.573	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000305157869	409705651	/nfs/dbraw/zinc/70/56/51/409705651.db2.gz	DBROKMZIJFAEAH-HNNXBMFYSA-N	1	1	321.377	1.573	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000345167202	409652395	/nfs/dbraw/zinc/65/23/95/409652395.db2.gz	XVMKPUBDQJDZCV-VXGBXAGGSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@]1(O)CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	ZINC000331651137	409735714	/nfs/dbraw/zinc/73/57/14/409735714.db2.gz	MAMWMEURASMNDR-HNNXBMFYSA-N	1	1	321.333	1.350	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000354391103	409816433	/nfs/dbraw/zinc/81/64/33/409816433.db2.gz	JUGUTTHEQTXFQQ-QWHCGFSZSA-N	1	1	323.397	1.513	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000332028730	409818296	/nfs/dbraw/zinc/81/82/96/409818296.db2.gz	HUPLBMUBCXJNJY-CABCVRRESA-N	1	1	303.362	1.880	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H](c2ccccc2)C1	ZINC000354521310	409914875	/nfs/dbraw/zinc/91/48/75/409914875.db2.gz	NHZDAZDFWUSWHK-YPMHNXCESA-N	1	1	315.333	1.146	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000346617239	410038917	/nfs/dbraw/zinc/03/89/17/410038917.db2.gz	AOHJVMKKAWJGIR-LBPRGKRZSA-N	1	1	308.382	1.784	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]1C	ZINC000346636823	410051096	/nfs/dbraw/zinc/05/10/96/410051096.db2.gz	HYRLTIBECBWALE-VXGBXAGGSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000332335457	410074628	/nfs/dbraw/zinc/07/46/28/410074628.db2.gz	RBIXKICKSSNGLK-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000332335457	410074630	/nfs/dbraw/zinc/07/46/30/410074630.db2.gz	RBIXKICKSSNGLK-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@H](C)C1	ZINC000332351227	410087089	/nfs/dbraw/zinc/08/70/89/410087089.db2.gz	PJTGIVKPGZMIMR-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@H](C)C1	ZINC000332351227	410087094	/nfs/dbraw/zinc/08/70/94/410087094.db2.gz	PJTGIVKPGZMIMR-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cc1nccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1	ZINC000351639855	410127651	/nfs/dbraw/zinc/12/76/51/410127651.db2.gz	FUYOOEPRXQZZGV-ZDUSSCGKSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1nccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1	ZINC000351639855	410127657	/nfs/dbraw/zinc/12/76/57/410127657.db2.gz	FUYOOEPRXQZZGV-ZDUSSCGKSA-N	1	1	314.349	1.775	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCN(CCO)CC1	ZINC000357653893	410166660	/nfs/dbraw/zinc/16/66/60/410166660.db2.gz	XGQWJUBYNPJOEL-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000357680308	410183610	/nfs/dbraw/zinc/18/36/10/410183610.db2.gz	LWFHITKRTIZAMC-UHFFFAOYSA-N	1	1	321.381	1.623	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000351774795	410223543	/nfs/dbraw/zinc/22/35/43/410223543.db2.gz	NXSDZXPXNLWHRK-DDTOSNHZSA-N	1	1	305.334	1.013	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000351774795	410223548	/nfs/dbraw/zinc/22/35/48/410223548.db2.gz	NXSDZXPXNLWHRK-DDTOSNHZSA-N	1	1	305.334	1.013	20	5		DDBDMO
C[C@H]1C[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1C	ZINC000339632121	410343411	/nfs/dbraw/zinc/34/34/11/410343411.db2.gz	WSMZFLLBZJAREM-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCCC[C@H]1C	ZINC000347012135	410311290	/nfs/dbraw/zinc/31/12/90/410311290.db2.gz	LSJBRUAPOIIYCR-GHMZBOCLSA-N	1	1	309.370	1.321	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc(F)cc1[N+](=O)[O-]	ZINC000299002314	410479719	/nfs/dbraw/zinc/47/97/19/410479719.db2.gz	JWXRWTRYIVHTFN-RYUDHWBXSA-N	1	1	322.340	1.673	20	5		DDBDMO
Cc1c(CNC(=O)NC[C@H]2CCC[N@@H+]2C)cccc1[N+](=O)[O-]	ZINC000358577102	410483372	/nfs/dbraw/zinc/48/33/72/410483372.db2.gz	FYMMWVQENRUMEJ-CYBMUJFWSA-N	1	1	306.366	1.797	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000343690214	410623952	/nfs/dbraw/zinc/62/39/52/410623952.db2.gz	MEPQRNIWZWMDDO-OAHLLOKOSA-N	1	1	308.334	1.483	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000343690214	410623956	/nfs/dbraw/zinc/62/39/56/410623956.db2.gz	MEPQRNIWZWMDDO-OAHLLOKOSA-N	1	1	308.334	1.483	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(C(=O)NCC[NH+]2CCC2)cc1OC	ZINC000337302395	410702657	/nfs/dbraw/zinc/70/26/57/410702657.db2.gz	YEQQWSXPJVEHLS-UHFFFAOYSA-N	1	1	323.349	1.438	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000337310867	410709489	/nfs/dbraw/zinc/70/94/89/410709489.db2.gz	BOZAOEYZSONRPI-SLEUVZQESA-N	1	1	319.361	1.626	20	5		DDBDMO
CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000347900118	410781450	/nfs/dbraw/zinc/78/14/50/410781450.db2.gz	SQKHEAKVRGXFHN-ZDUSSCGKSA-N	1	1	318.377	1.702	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000330572845	410787138	/nfs/dbraw/zinc/78/71/38/410787138.db2.gz	DTAOXANNMQNKOY-CHWSQXEVSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCC[C@H](C)C1	ZINC000330586043	410800229	/nfs/dbraw/zinc/80/02/29/410800229.db2.gz	SIRJJKNKNLOYKY-RYUDHWBXSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[NH+](C)CCSc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000301868446	410816535	/nfs/dbraw/zinc/81/65/35/410816535.db2.gz	GRKUJQNVQIENFY-UHFFFAOYSA-N	1	1	304.393	1.652	20	5		DDBDMO
CC[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)N1CCCCCC1	ZINC000353206160	410852296	/nfs/dbraw/zinc/85/22/96/410852296.db2.gz	MSLNLBCOFKDUMC-UHFFFAOYSA-N	1	1	323.397	1.516	20	5		DDBDMO
CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)N1CCCCCC1	ZINC000353206160	410852302	/nfs/dbraw/zinc/85/23/02/410852302.db2.gz	MSLNLBCOFKDUMC-UHFFFAOYSA-N	1	1	323.397	1.516	20	5		DDBDMO
C[C@H]1[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@@H+]1C	ZINC000343962758	410852628	/nfs/dbraw/zinc/85/26/28/410852628.db2.gz	CNBDLTGLTFYFNN-WDEREUQCSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343962758	410852632	/nfs/dbraw/zinc/85/26/32/410852632.db2.gz	CNBDLTGLTFYFNN-WDEREUQCSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCC[C@H](C)C1	ZINC000356150102	410863345	/nfs/dbraw/zinc/86/33/45/410863345.db2.gz	HTHWUJYCCXUDRA-WDEREUQCSA-N	1	1	309.370	1.179	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000356466628	411045518	/nfs/dbraw/zinc/04/55/18/411045518.db2.gz	YAEFJMJWABGLCA-JTQLQIEISA-N	1	1	307.354	1.075	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](C(=O)N2CCCC2)C1	ZINC000331425002	411082620	/nfs/dbraw/zinc/08/26/20/411082620.db2.gz	UWHUPZZCAOFOJW-GFCCVEGCSA-N	1	1	321.381	1.163	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](C(=O)N2CCCC2)C1	ZINC000331425002	411082623	/nfs/dbraw/zinc/08/26/23/411082623.db2.gz	UWHUPZZCAOFOJW-GFCCVEGCSA-N	1	1	321.381	1.163	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)n1	ZINC000331210783	411020638	/nfs/dbraw/zinc/02/06/38/411020638.db2.gz	RGGGKRSARPCJRU-JTQLQIEISA-N	1	1	307.354	1.191	20	5		DDBDMO
Cn1c(Cl)cnc1C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC001120557894	782022055	/nfs/dbraw/zinc/02/20/55/782022055.db2.gz	BZJFYYGUGYEACG-LLVKDONJSA-N	1	1	310.741	1.805	20	5		DDBDMO
C[C@@H]1C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000360651164	418484212	/nfs/dbraw/zinc/48/42/12/418484212.db2.gz	FWWZAXQQUKBHDW-MNOVXSKESA-N	1	1	313.379	1.356	20	5		DDBDMO
COc1cccc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000192509380	418523728	/nfs/dbraw/zinc/52/37/28/418523728.db2.gz	PJHQRRMROYJXFQ-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H]([C@@H]3CCOC3)C2)c1	ZINC000374387549	418525287	/nfs/dbraw/zinc/52/52/87/418525287.db2.gz	BMJJYZXWCHCHJB-IIAWOOMASA-N	1	1	306.362	1.987	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@H]2C1	ZINC000361199465	418604998	/nfs/dbraw/zinc/60/49/98/418604998.db2.gz	DUQVIHZZTVSCAF-SDDRHHMPSA-N	1	1	305.334	1.744	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1	ZINC000358579425	418654907	/nfs/dbraw/zinc/65/49/07/418654907.db2.gz	APUGGEWBPLTTIY-UHFFFAOYSA-N	1	1	317.349	2.265	20	5		DDBDMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000367994914	418671323	/nfs/dbraw/zinc/67/13/23/418671323.db2.gz	WIEVRNKJAWKNHR-JTQLQIEISA-N	1	1	303.240	1.413	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCOC1	ZINC000361579999	418684739	/nfs/dbraw/zinc/68/47/39/418684739.db2.gz	YYCPUOZZICZWPF-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCOC1	ZINC000361579999	418684741	/nfs/dbraw/zinc/68/47/41/418684741.db2.gz	YYCPUOZZICZWPF-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+]3CCOC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000364932571	418824053	/nfs/dbraw/zinc/82/40/53/418824053.db2.gz	HIRKWORSTDBAGX-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
CCOc1cccc(N2CC[N@H+]3CCOC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000364932571	418824055	/nfs/dbraw/zinc/82/40/55/418824055.db2.gz	HIRKWORSTDBAGX-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[N@H+]3CCC[C@@H]3CO1)CCN2	ZINC000365542872	418873709	/nfs/dbraw/zinc/87/37/09/418873709.db2.gz	CBCZIJHOAXOHMA-NEPJUHHUSA-N	1	1	318.377	1.838	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@H](O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000411420294	418902248	/nfs/dbraw/zinc/90/22/48/418902248.db2.gz	JIUDIBBQMPHMIF-GHMZBOCLSA-N	1	1	323.349	1.387	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000372154705	418840306	/nfs/dbraw/zinc/84/03/06/418840306.db2.gz	HUBJICSKXCWNDC-GXFFZTMASA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000372154705	418840308	/nfs/dbraw/zinc/84/03/08/418840308.db2.gz	HUBJICSKXCWNDC-GXFFZTMASA-N	1	1	313.379	1.279	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000425974228	419376360	/nfs/dbraw/zinc/37/63/60/419376360.db2.gz	LGIUCRBQQWZHIJ-QWRGUYRKSA-N	1	1	310.350	1.815	20	5		DDBDMO
COC(=O)[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411915076	419484121	/nfs/dbraw/zinc/48/41/21/419484121.db2.gz	YKZSOAJELPFRAR-LLVKDONJSA-N	1	1	313.379	1.193	20	5		DDBDMO
CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[N@H+]1C	ZINC000420994805	419435379	/nfs/dbraw/zinc/43/53/79/419435379.db2.gz	CQVSQESLCBRAPC-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000412038690	419583128	/nfs/dbraw/zinc/58/31/28/419583128.db2.gz	PEASLJKCXMQBOJ-MFKMUULPSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000412038690	419583138	/nfs/dbraw/zinc/58/31/38/419583138.db2.gz	PEASLJKCXMQBOJ-MFKMUULPSA-N	1	1	307.350	1.544	20	5		DDBDMO
COC(=O)[C@@H]1CSCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000412066700	419614531	/nfs/dbraw/zinc/61/45/31/419614531.db2.gz	FTCPKZCENYKQAL-LBPRGKRZSA-N	1	1	310.375	1.933	20	5		DDBDMO
COC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCO1	ZINC000434790406	229332557	/nfs/dbraw/zinc/33/25/57/229332557.db2.gz	UJXFIFFABINDMG-KGLIPLIRSA-N	1	1	320.349	1.755	20	5		DDBDMO
O=C(CC[N@H+]1CCc2nn[nH]c2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000429282337	419995106	/nfs/dbraw/zinc/99/51/06/419995106.db2.gz	DVGMPWRTTOMLOW-UHFFFAOYSA-N	1	1	316.321	1.100	20	5		DDBDMO
CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CNCCO2)cc1[N+](=O)[O-]	ZINC000423550559	420079022	/nfs/dbraw/zinc/07/90/22/420079022.db2.gz	FQCURCUGPJNMRL-YPMHNXCESA-N	1	1	309.366	1.633	20	5		DDBDMO
COc1cc(C(=O)NCC(F)(F)C[NH3+])cc([N+](=O)[O-])c1C	ZINC000423555630	420079670	/nfs/dbraw/zinc/07/96/70/420079670.db2.gz	YGOQOTABYXEAGE-UHFFFAOYSA-N	1	1	303.265	1.236	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(NC[C@@H]3CCCC[N@H+]3C3CC3)nn21	ZINC000433807537	420254981	/nfs/dbraw/zinc/25/49/81/420254981.db2.gz	IHFIIOWOFJLRIC-LBPRGKRZSA-N	1	1	316.365	2.066	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000420392976	420258831	/nfs/dbraw/zinc/25/88/31/420258831.db2.gz	WUIRUWWZCKRJER-UHFFFAOYSA-N	1	1	324.381	1.473	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000416294086	420311187	/nfs/dbraw/zinc/31/11/87/420311187.db2.gz	KOZFTFHJLBULLF-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000416294086	420311190	/nfs/dbraw/zinc/31/11/90/420311190.db2.gz	KOZFTFHJLBULLF-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@H](CC[NH3+])C1	ZINC000443054758	229986444	/nfs/dbraw/zinc/98/64/44/229986444.db2.gz	AASGDTYZHGIQNX-CYBMUJFWSA-N	1	1	320.393	1.903	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000420786167	420390346	/nfs/dbraw/zinc/39/03/46/420390346.db2.gz	VDEQVSSSRLUHBI-CQSZACIVSA-N	1	1	306.366	1.830	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000437054215	420393228	/nfs/dbraw/zinc/39/32/28/420393228.db2.gz	XMIFPEMXZPMWDU-UHFFFAOYSA-N	1	1	305.338	1.601	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](n3ccnn3)C2)c1	ZINC000425498857	420399657	/nfs/dbraw/zinc/39/96/57/420399657.db2.gz	HMCLGOCVRQBANO-CQSZACIVSA-N	1	1	317.349	1.902	20	5		DDBDMO
Cc1cc(N2CC[N@H+](CC(C)(C)O)C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000302521284	230280444	/nfs/dbraw/zinc/28/04/44/230280444.db2.gz	ITVOOOVPJJDDQT-LBPRGKRZSA-N	1	1	308.382	1.580	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000302556985	230295580	/nfs/dbraw/zinc/29/55/80/230295580.db2.gz	RZYZETZHWNWVOY-UHFFFAOYSA-N	1	1	323.393	1.634	20	5		DDBDMO
COc1cc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000450796075	420534169	/nfs/dbraw/zinc/53/41/69/420534169.db2.gz	QJPLVCIXKIHXNB-TXEJJXNPSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439102609	420479711	/nfs/dbraw/zinc/47/97/11/420479711.db2.gz	TXGOKJUPKPOUGA-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H](O)[C@H](CO)C3)o2)cc1	ZINC000459718022	420856315	/nfs/dbraw/zinc/85/63/15/420856315.db2.gz	XHCSYBPJSKIOHS-SWLSCSKDSA-N	1	1	318.329	1.640	20	5		DDBDMO
COCCNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000459751260	420863583	/nfs/dbraw/zinc/86/35/83/420863583.db2.gz	IBILNPANNYIKKJ-UHFFFAOYSA-N	1	1	307.350	1.288	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000454790632	420925428	/nfs/dbraw/zinc/92/54/28/420925428.db2.gz	CSQSASTUJPHKQR-QWRGUYRKSA-N	1	1	319.365	1.388	20	5		DDBDMO
CNc1nc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000455769008	421060115	/nfs/dbraw/zinc/06/01/15/421060115.db2.gz	YJEWQDICMWXPSA-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000488357850	421085194	/nfs/dbraw/zinc/08/51/94/421085194.db2.gz	QFCSTNSJFLIXKU-DOMZBBRYSA-N	1	1	305.378	1.793	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)[C@@H](C)C1	ZINC000456045093	421093461	/nfs/dbraw/zinc/09/34/61/421093461.db2.gz	FHDLUUHCCQTDHR-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)[C@@H](C)C1	ZINC000456045093	421093464	/nfs/dbraw/zinc/09/34/64/421093464.db2.gz	FHDLUUHCCQTDHR-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[C@@H]([NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000449767172	421078139	/nfs/dbraw/zinc/07/81/39/421078139.db2.gz	AEQXEEZJSLCLFT-SNVBAGLBSA-N	1	1	311.338	1.226	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000546810964	421311402	/nfs/dbraw/zinc/31/14/02/421311402.db2.gz	DRBANJHDLSYPCQ-DOMZBBRYSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1	ZINC000561192802	421311561	/nfs/dbraw/zinc/31/15/61/421311561.db2.gz	WBOGBBWMBUAKAD-SNVBAGLBSA-N	1	1	317.349	1.997	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000563070391	421450856	/nfs/dbraw/zinc/45/08/56/421450856.db2.gz	VAKHPNTUCBXIDL-DOMZBBRYSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000563070391	421450860	/nfs/dbraw/zinc/45/08/60/421450860.db2.gz	VAKHPNTUCBXIDL-DOMZBBRYSA-N	1	1	319.361	1.953	20	5		DDBDMO
CN(C(=O)CN1CC[N@@H+](C)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000520435782	421752301	/nfs/dbraw/zinc/75/23/01/421752301.db2.gz	JMDUUDACOAMNBN-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
CCCC[N@@H+](C)CC1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1	ZINC000558744593	421824868	/nfs/dbraw/zinc/82/48/68/421824868.db2.gz	WBTSTBJUKRZUAN-UHFFFAOYSA-N	1	1	323.397	1.902	20	5		DDBDMO
CC[N@@H+](CCCNc1ncc([N+](=O)[O-])c(N)n1)C1CCCCC1	ZINC000593488948	422339635	/nfs/dbraw/zinc/33/96/35/422339635.db2.gz	OYOOKZZATHLYOP-UHFFFAOYSA-N	1	1	322.413	1.846	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000345593536	272287313	/nfs/dbraw/zinc/28/73/13/272287313.db2.gz	CPMUHOXTGILFHT-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000345916001	272364196	/nfs/dbraw/zinc/36/41/96/272364196.db2.gz	YZAZCAXIQRZOND-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000413475900	274017112	/nfs/dbraw/zinc/01/71/12/274017112.db2.gz	OMCJIOHIODVHTC-UHFFFAOYSA-N	1	1	323.393	1.687	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CCC[N@H+](CCO)CC1	ZINC000276566902	275034508	/nfs/dbraw/zinc/03/45/08/275034508.db2.gz	GYRWMACTSFBIOZ-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])c(C(=O)NCC(F)(F)C[NH3+])c1	ZINC000190238847	278174964	/nfs/dbraw/zinc/17/49/64/278174964.db2.gz	IUQYZCMZZZKDBQ-UHFFFAOYSA-N	1	1	305.306	1.641	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H]([NH+]2CCOCC2)[C@H]1C	ZINC000291211951	278747623	/nfs/dbraw/zinc/74/76/23/278747623.db2.gz	VGTPASBJJUTKPF-TZMCWYRMSA-N	1	1	306.366	1.598	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000358063746	299062443	/nfs/dbraw/zinc/06/24/43/299062443.db2.gz	ZXMZVNHOGRTVFK-MRXNPFEDSA-N	1	1	321.377	1.316	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362072668	300000628	/nfs/dbraw/zinc/00/06/28/300000628.db2.gz	PLYQHHQFKHGCMC-NWDGAFQWSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362072668	300000630	/nfs/dbraw/zinc/00/06/30/300000630.db2.gz	PLYQHHQFKHGCMC-NWDGAFQWSA-N	1	1	307.350	1.402	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)Nc1ccc([N+](=O)[O-])cc1	ZINC000363094664	300209480	/nfs/dbraw/zinc/20/94/80/300209480.db2.gz	GGYUPMQZFODIRT-KBPBESRZSA-N	1	1	320.349	1.580	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000364020014	300335569	/nfs/dbraw/zinc/33/55/69/300335569.db2.gz	XKXIWJXPHMZODY-NEPJUHHUSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412262	301022511	/nfs/dbraw/zinc/02/25/11/301022511.db2.gz	RMJWPXATFKIWBM-BXUZGUMPSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412262	301022513	/nfs/dbraw/zinc/02/25/13/301022513.db2.gz	RMJWPXATFKIWBM-BXUZGUMPSA-N	1	1	319.361	1.687	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000368964174	301111232	/nfs/dbraw/zinc/11/12/32/301111232.db2.gz	NDCQJJJAVVZLIA-HUBLWGQQSA-N	1	1	319.361	1.559	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@]3(CCCCO3)C2)c1	ZINC000370095056	301274930	/nfs/dbraw/zinc/27/49/30/301274930.db2.gz	RDARFGGVVWUZON-LSDHHAIUSA-N	1	1	324.381	1.187	20	5		DDBDMO
CCc1nn(C)c(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000376171962	302044874	/nfs/dbraw/zinc/04/48/74/302044874.db2.gz	ARJGVZUQQKRPEE-FOSCPWQOSA-N	1	1	307.398	1.952	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000377661493	302206160	/nfs/dbraw/zinc/20/61/60/302206160.db2.gz	GNNGYDXFCZPOAH-CQSZACIVSA-N	1	1	307.350	1.320	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](Oc3ccccc3)C2)n1	ZINC000377967918	302258751	/nfs/dbraw/zinc/25/87/51/302258751.db2.gz	SFUOPOIIBMYPHT-AWEZNQCLSA-N	1	1	302.334	1.945	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000536033841	303354298	/nfs/dbraw/zinc/35/42/98/303354298.db2.gz	BTWOFIRRTHGLGH-ZDUSSCGKSA-N	1	1	300.318	1.839	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000536033841	303354301	/nfs/dbraw/zinc/35/43/01/303354301.db2.gz	BTWOFIRRTHGLGH-ZDUSSCGKSA-N	1	1	300.318	1.839	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)C1CC1	ZINC000373312509	307184427	/nfs/dbraw/zinc/18/44/27/307184427.db2.gz	BCLKOHYOMWYISK-UHFFFAOYSA-N	1	1	321.381	1.439	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2c(OC)cccc2[N+](=O)[O-])CC1	ZINC000521899240	307470484	/nfs/dbraw/zinc/47/04/84/307470484.db2.gz	PGNOZKSVUAZTHT-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
C[C@H](C(=O)NCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000579190162	308512813	/nfs/dbraw/zinc/51/28/13/308512813.db2.gz	XUMVAABHFCKZEQ-ZDUSSCGKSA-N	1	1	321.377	1.537	20	5		DDBDMO
NC(=O)c1c[nH+]ccc1N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000584026424	331585353	/nfs/dbraw/zinc/58/53/53/331585353.db2.gz	KESQFTCPWACUER-UHFFFAOYSA-N	1	1	314.301	1.488	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000582853776	337210669	/nfs/dbraw/zinc/21/06/69/337210669.db2.gz	LQKSSBKHMOUVHB-LBPRGKRZSA-N	1	1	323.397	1.013	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](CCCO)C1	ZINC000295590751	534335186	/nfs/dbraw/zinc/33/51/86/534335186.db2.gz	WMLXICCTHVVEFC-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CC[NH+](Cc3cccs3)CC2)c1	ZINC000157431984	527414814	/nfs/dbraw/zinc/41/48/14/527414814.db2.gz	YEEYQQYOWLFYED-UHFFFAOYSA-N	1	1	321.406	1.671	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000302573015	528310604	/nfs/dbraw/zinc/31/06/04/528310604.db2.gz	ZMOKGLQWKMZSSU-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
CC[N@H+](CC1CC1)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000112200107	696648870	/nfs/dbraw/zinc/64/88/70/696648870.db2.gz	UVVCJJLHJRHDMD-UHFFFAOYSA-N	1	1	303.318	1.880	20	5		DDBDMO
CC[N@@H+](CC1CC1)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000112200107	696648872	/nfs/dbraw/zinc/64/88/72/696648872.db2.gz	UVVCJJLHJRHDMD-UHFFFAOYSA-N	1	1	303.318	1.880	20	5		DDBDMO
Cc1nn(C[N@H+]2CCCOC[C@@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000772828103	697682931	/nfs/dbraw/zinc/68/29/31/697682931.db2.gz	XLRSMOJXPFEVCX-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCCOC[C@@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000772828103	697682934	/nfs/dbraw/zinc/68/29/34/697682934.db2.gz	XLRSMOJXPFEVCX-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
CO[C@@H]1CCC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749949460	700194027	/nfs/dbraw/zinc/19/40/27/700194027.db2.gz	FFSQZPZKGSGUKJ-GFCCVEGCSA-N	1	1	305.338	1.716	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749949460	700194029	/nfs/dbraw/zinc/19/40/29/700194029.db2.gz	FFSQZPZKGSGUKJ-GFCCVEGCSA-N	1	1	305.338	1.716	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582147	698121254	/nfs/dbraw/zinc/12/12/54/698121254.db2.gz	RKFKOZGLDACWKR-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582147	698121255	/nfs/dbraw/zinc/12/12/55/698121255.db2.gz	RKFKOZGLDACWKR-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776586966	698122568	/nfs/dbraw/zinc/12/25/68/698122568.db2.gz	RTDPGTMBFZCJDY-DZGCQCFKSA-N	1	1	308.334	1.513	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000750094033	700203523	/nfs/dbraw/zinc/20/35/23/700203523.db2.gz	MMXWKXNHSIZDKF-NEPJUHHUSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000750094033	700203526	/nfs/dbraw/zinc/20/35/26/700203526.db2.gz	MMXWKXNHSIZDKF-NEPJUHHUSA-N	1	1	320.267	1.627	20	5		DDBDMO
C[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[NH+]1CCCCC1	ZINC000780394347	698515239	/nfs/dbraw/zinc/51/52/39/698515239.db2.gz	JVJKOPNVYNQDBP-LLVKDONJSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[N@H+]1C	ZINC000782525580	698734190	/nfs/dbraw/zinc/73/41/90/698734190.db2.gz	YPTXGEYFYZZIBP-LLVKDONJSA-N	1	1	324.356	1.698	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCN1C	ZINC000782525580	698734195	/nfs/dbraw/zinc/73/41/95/698734195.db2.gz	YPTXGEYFYZZIBP-LLVKDONJSA-N	1	1	324.356	1.698	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCN1C	ZINC000782525580	698734199	/nfs/dbraw/zinc/73/41/99/698734199.db2.gz	YPTXGEYFYZZIBP-LLVKDONJSA-N	1	1	324.356	1.698	20	5		DDBDMO
CCC[N@@H+](C)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000726589820	699369569	/nfs/dbraw/zinc/36/95/69/699369569.db2.gz	PEDWEWXLNPUGJH-UHFFFAOYSA-N	1	1	306.322	1.663	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000732060747	699545023	/nfs/dbraw/zinc/54/50/23/699545023.db2.gz	SUGPUZJHEZENTE-NSHDSACASA-N	1	1	317.349	1.012	20	5		DDBDMO
CC(C)[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000791366556	699627387	/nfs/dbraw/zinc/62/73/87/699627387.db2.gz	JRRFNLBNOZIKKY-CQSZACIVSA-N	1	1	324.356	1.728	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000791366556	699627388	/nfs/dbraw/zinc/62/73/88/699627388.db2.gz	JRRFNLBNOZIKKY-CQSZACIVSA-N	1	1	324.356	1.728	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)CCCC1	ZINC000733999593	699631695	/nfs/dbraw/zinc/63/16/95/699631695.db2.gz	QVIAGVWWXAKXFH-UHFFFAOYSA-N	1	1	307.350	1.752	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000741721809	699848873	/nfs/dbraw/zinc/84/88/73/699848873.db2.gz	CQUXNWNRGOJRKG-NEPJUHHUSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000741721812	699848914	/nfs/dbraw/zinc/84/89/14/699848914.db2.gz	CQUXNWNRGOJRKG-RYUDHWBXSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H]2C[C@@H](C)O)c2ncc([N+](=O)[O-])cc12	ZINC000752803525	700389106	/nfs/dbraw/zinc/38/91/06/700389106.db2.gz	JNMLIZQRTPCRKH-ZYHUDNBSSA-N	1	1	319.365	1.841	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000755921156	700592537	/nfs/dbraw/zinc/59/25/37/700592537.db2.gz	KMBCAAZGTTZBMM-NSHDSACASA-N	1	1	312.333	1.970	20	5		DDBDMO
CC[N@@H+]1CCCC[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000761400963	700859075	/nfs/dbraw/zinc/85/90/75/700859075.db2.gz	CPDBIUITCAKNLY-CYBMUJFWSA-N	1	1	323.349	1.174	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000761400963	700859076	/nfs/dbraw/zinc/85/90/76/700859076.db2.gz	CPDBIUITCAKNLY-CYBMUJFWSA-N	1	1	323.349	1.174	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839636456	701762015	/nfs/dbraw/zinc/76/20/15/701762015.db2.gz	SJTBTCKHEMACLK-GXTWGEPZSA-N	1	1	307.350	1.038	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)[C@H](C)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839718434	701796122	/nfs/dbraw/zinc/79/61/22/701796122.db2.gz	POWFVVJUBHXFIP-RRCSTGOVSA-N	1	1	317.389	1.773	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000868062302	701920476	/nfs/dbraw/zinc/92/04/76/701920476.db2.gz	KJWFUVRYWCCNCI-ZIAGYGMSSA-N	1	1	318.377	1.830	20	5		DDBDMO
Cc1cnc(N2CCC(N3CC[NH+](C)CC3)CC2)c([N+](=O)[O-])c1	ZINC000866212279	706650513	/nfs/dbraw/zinc/65/05/13/706650513.db2.gz	KHPRKZCHYFWXTN-UHFFFAOYSA-N	1	1	319.409	1.514	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000845767385	703198134	/nfs/dbraw/zinc/19/81/34/703198134.db2.gz	JLOOTIOGDHQJSA-UHFFFAOYSA-N	1	1	323.393	1.688	20	5		DDBDMO
COC[C@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870892154	704159242	/nfs/dbraw/zinc/15/92/42/704159242.db2.gz	NUYCNQAQOCTLRN-XHDPSFHLSA-N	1	1	307.350	1.264	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CCCOCC3)CC2)c1	ZINC000853688423	704300036	/nfs/dbraw/zinc/30/00/36/704300036.db2.gz	NXDDVZRKHGEOFB-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000854643232	704431980	/nfs/dbraw/zinc/43/19/80/704431980.db2.gz	SEOIQYUICYJEOH-CHWSQXEVSA-N	1	1	313.398	1.144	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000860165933	705121048	/nfs/dbraw/zinc/12/10/48/705121048.db2.gz	DDIFJIXPNJVLRH-VXGBXAGGSA-N	1	1	306.318	1.598	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827278616	705967269	/nfs/dbraw/zinc/96/72/69/705967269.db2.gz	XLANGEAKKQFEIA-YPMHNXCESA-N	1	1	318.377	1.803	20	5		DDBDMO
CCOC(=O)[C@H](F)C1C[NH+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000877549308	706139410	/nfs/dbraw/zinc/13/94/10/706139410.db2.gz	BOAZXPXFDZHEPW-CQSZACIVSA-N	1	1	310.325	1.970	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@@H]1C	ZINC000866948395	706853073	/nfs/dbraw/zinc/85/30/73/706853073.db2.gz	HYMJYRDYVMHIAX-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832976322	706998884	/nfs/dbraw/zinc/99/88/84/706998884.db2.gz	ZHVXLQBETNKYLX-WFASDCNBSA-N	1	1	323.393	1.865	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000882481239	707651711	/nfs/dbraw/zinc/65/17/11/707651711.db2.gz	AARWEMUGVOGANQ-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000882485909	707656918	/nfs/dbraw/zinc/65/69/18/707656918.db2.gz	MHJSAEHKBLOMNM-JTQLQIEISA-N	1	1	311.313	1.323	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC(C)([NH+]3CCC3)CC2)c1[N+](=O)[O-]	ZINC000882504009	707670776	/nfs/dbraw/zinc/67/07/76/707670776.db2.gz	HZFLVJXSDLLZID-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)c1F	ZINC000839412499	708046910	/nfs/dbraw/zinc/04/69/10/708046910.db2.gz	VCLLUWKXOZCPOZ-MFKMUULPSA-N	1	1	307.325	1.818	20	5		DDBDMO
Cc1cccc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897220930	708258754	/nfs/dbraw/zinc/25/87/54/708258754.db2.gz	ZSKMHWBJKIKQDQ-UONOGXRCSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cc1ccc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897222603	708259883	/nfs/dbraw/zinc/25/98/83/708259883.db2.gz	WCXCMIPNHGEWCN-ZIAGYGMSSA-N	1	1	305.378	1.939	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000886021128	708682573	/nfs/dbraw/zinc/68/25/73/708682573.db2.gz	PJVCUCHRJZEGKR-CYBMUJFWSA-N	1	1	306.366	1.144	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000886021128	708682575	/nfs/dbraw/zinc/68/25/75/708682575.db2.gz	PJVCUCHRJZEGKR-CYBMUJFWSA-N	1	1	306.366	1.144	20	5		DDBDMO
CC(C)[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C(=O)N1CCCC1	ZINC000886111788	708700357	/nfs/dbraw/zinc/70/03/57/708700357.db2.gz	IXTCTVRZNIRTCA-ZDUSSCGKSA-N	1	1	306.366	1.726	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CC2(CCOCC2)CC[C@@H]1CO	ZINC000886297668	708737926	/nfs/dbraw/zinc/73/79/26/708737926.db2.gz	XDYGBMJOSWHDMD-CQSZACIVSA-N	1	1	321.377	1.743	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@@]1(O)CCC[N@@H+](C)C1	ZINC000900160821	709311492	/nfs/dbraw/zinc/31/14/92/709311492.db2.gz	ZUNCBDSAYAKBDW-INIZCTEOSA-N	1	1	321.377	1.400	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+]C1CC(S(C)(=O)=O)C1	ZINC000892938458	710528722	/nfs/dbraw/zinc/52/87/22/710528722.db2.gz	FQWQTZQLYOJVAF-UHFFFAOYSA-N	1	1	314.363	1.269	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000928445237	713199680	/nfs/dbraw/zinc/19/96/80/713199680.db2.gz	PQLCXAPPUCZAIA-RISCZKNCSA-N	1	1	316.361	1.758	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C(C)(C)C)C1	ZINC000912030202	711133094	/nfs/dbraw/zinc/13/30/94/711133094.db2.gz	AYMIKHFBKSBJJM-ZDUSSCGKSA-N	1	1	308.382	1.736	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000928568250	713231801	/nfs/dbraw/zinc/23/18/01/713231801.db2.gz	KGARYNUWIXEKOG-LBPRGKRZSA-N	1	1	304.350	1.603	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000928568250	713231802	/nfs/dbraw/zinc/23/18/02/713231802.db2.gz	KGARYNUWIXEKOG-LBPRGKRZSA-N	1	1	304.350	1.603	20	5		DDBDMO
CCOc1cc(C(=O)NC[C@H]2CC[N@@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928568935	713232480	/nfs/dbraw/zinc/23/24/80/713232480.db2.gz	QHDRWTMDKOWJPY-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
CCOc1cc(C(=O)NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928568935	713232483	/nfs/dbraw/zinc/23/24/83/713232483.db2.gz	QHDRWTMDKOWJPY-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N(C)CC(=O)N2CC[NH+](C)CC2)c1	ZINC000894958776	711339573	/nfs/dbraw/zinc/33/95/73/711339573.db2.gz	QSTWVSMZRLAQHA-UHFFFAOYSA-N	1	1	306.366	1.113	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](CCCCCO)CC2)s1	ZINC000894964652	711341969	/nfs/dbraw/zinc/34/19/69/711341969.db2.gz	UJTKIQZOOVEJTG-UHFFFAOYSA-N	1	1	300.384	1.336	20	5		DDBDMO
Nc1ccc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)nc1[N+](=O)[O-]	ZINC000895567627	711544310	/nfs/dbraw/zinc/54/43/10/711544310.db2.gz	GFEKGOCBMAVIJC-MNOVXSKESA-N	1	1	309.395	1.564	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000896564694	711753316	/nfs/dbraw/zinc/75/33/16/711753316.db2.gz	RMMPEWVQQXOFSJ-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000896568491	711754644	/nfs/dbraw/zinc/75/46/44/711754644.db2.gz	NLSJDHOVGYFGJI-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929228691	713571701	/nfs/dbraw/zinc/57/17/01/713571701.db2.gz	RBOJWTAZQKGVQU-HUUCEWRRSA-N	1	1	303.362	1.862	20	5		DDBDMO
COc1cc(N[C@@H]2CCC[N@H+](CC[N+](=O)[O-])C2)cc(OC)c1	ZINC000930044352	713742706	/nfs/dbraw/zinc/74/27/06/713742706.db2.gz	YTYSVBBAFHMVHF-GFCCVEGCSA-N	1	1	309.366	1.857	20	5		DDBDMO
COc1cc(N[C@@H]2CCC[N@@H+](CC[N+](=O)[O-])C2)cc(OC)c1	ZINC000930044352	713742710	/nfs/dbraw/zinc/74/27/10/713742710.db2.gz	YTYSVBBAFHMVHF-GFCCVEGCSA-N	1	1	309.366	1.857	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000931312893	714063190	/nfs/dbraw/zinc/06/31/90/714063190.db2.gz	WBTCMOFXOMQMMW-ZACQAIPSSA-N	1	1	319.405	1.902	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000932647225	714374858	/nfs/dbraw/zinc/37/48/58/714374858.db2.gz	NJGYNXUGYHKWID-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000934257580	714777041	/nfs/dbraw/zinc/77/70/41/714777041.db2.gz	AMTVHBOVCKWFIH-HOTGVXAUSA-N	1	1	323.368	1.765	20	5		DDBDMO
CN(CCNC(=O)CCc1cnc[nH]1)c1ccc([N+](=O)[O-])cc1	ZINC001100380399	739267087	/nfs/dbraw/zinc/26/70/87/739267087.db2.gz	JURWWICNEHBMFT-UHFFFAOYSA-N	1	1	317.349	1.503	20	5		DDBDMO
C[C@@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000928246699	740129818	/nfs/dbraw/zinc/12/98/18/740129818.db2.gz	LBZJLXMFZLQIGH-YVLXSGLVSA-N	1	1	307.350	1.227	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CC3CCCC3)C2)CC1	ZINC001035704414	751791008	/nfs/dbraw/zinc/79/10/08/751791008.db2.gz	NLTRYIRYACEWGE-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1	ZINC001187926579	744636201	/nfs/dbraw/zinc/63/62/01/744636201.db2.gz	LUGKYEHIOKDPJK-ZDUSSCGKSA-N	1	1	321.377	1.841	20	5		DDBDMO
Cn1nccc1C1(O)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001197458554	747179859	/nfs/dbraw/zinc/17/98/59/747179859.db2.gz	JFKCGHRUKWRAAR-UHFFFAOYSA-N	1	1	316.361	1.812	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001095605337	750072500	/nfs/dbraw/zinc/07/25/00/750072500.db2.gz	GRZHEPACZWYXMB-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccns2)CC1	ZINC000997770941	751268474	/nfs/dbraw/zinc/26/84/74/751268474.db2.gz	CTXNTMXAEWUDOT-CHWSQXEVSA-N	1	1	324.406	1.137	20	5		DDBDMO
COC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023989	762201970	/nfs/dbraw/zinc/20/19/70/762201970.db2.gz	WLVSQIZRNPORGQ-FRRDWIJNSA-N	1	1	308.382	1.411	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023989	762201973	/nfs/dbraw/zinc/20/19/73/762201973.db2.gz	WLVSQIZRNPORGQ-FRRDWIJNSA-N	1	1	308.382	1.411	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169052079	762207039	/nfs/dbraw/zinc/20/70/39/762207039.db2.gz	FXEDJRAZTCIFLJ-RRFJBIMHSA-N	1	1	324.425	1.702	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363324	761492618	/nfs/dbraw/zinc/49/26/18/761492618.db2.gz	OBRLJHJUKFVBDN-NMFUWQPSSA-N	1	1	321.352	1.475	20	5		DDBDMO
COc1ccc(C[C@H](C)n2cnc(C[NH3+])cc2=N)c([N+](=O)[O-])c1	ZINC001170306975	766258660	/nfs/dbraw/zinc/25/86/60/766258660.db2.gz	CLBCISMBRLQAEE-JTQLQIEISA-N	1	1	317.349	1.542	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCn3nncc3C2)c([N+](=O)[O-])c1	ZINC001170350684	766279783	/nfs/dbraw/zinc/27/97/83/766279783.db2.gz	CCLYZZUYHRZTDI-LLVKDONJSA-N	1	1	317.349	1.642	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCn3nncc3C2)c([N+](=O)[O-])c1	ZINC001170350684	766279789	/nfs/dbraw/zinc/27/97/89/766279789.db2.gz	CCLYZZUYHRZTDI-LLVKDONJSA-N	1	1	317.349	1.642	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ccc(C)cc1[N+](=O)[O-]	ZINC001093788278	775079466	/nfs/dbraw/zinc/07/94/66/775079466.db2.gz	WUYLUZXTUTZOEI-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ccc([N+](=O)[O-])cc1F	ZINC001093840711	775125643	/nfs/dbraw/zinc/12/56/43/775125643.db2.gz	RHPGTPYDIKGRHE-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001093953526	775263243	/nfs/dbraw/zinc/26/32/43/775263243.db2.gz	ZWPKCZMUDIOJFX-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
C[N@@H+](CC(=O)NCCCNc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC001094853662	776504915	/nfs/dbraw/zinc/50/49/15/776504915.db2.gz	TURCYHYZLNMXMG-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172918261	776930840	/nfs/dbraw/zinc/93/08/40/776930840.db2.gz	ZXDRJSBERIRREM-CQSZACIVSA-N	1	1	305.378	1.910	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](C)CCN1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230947	777063927	/nfs/dbraw/zinc/06/39/27/777063927.db2.gz	GYMSYWLIQDHJTM-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C)CCN1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230947	777063931	/nfs/dbraw/zinc/06/39/31/777063931.db2.gz	GYMSYWLIQDHJTM-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1nccc(C)c1[N+](=O)[O-]	ZINC001101756985	777479979	/nfs/dbraw/zinc/47/99/79/777479979.db2.gz	USPCWOUCYNPTTN-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
COC(=O)c1cc(-c2nnc(C[NH+](C)C)o2)cc([N+](=O)[O-])c1	ZINC001117260562	780698150	/nfs/dbraw/zinc/69/81/50/780698150.db2.gz	MUMOWEGEWTXQJW-UHFFFAOYSA-N	1	1	306.278	1.493	20	5		DDBDMO
Cc1cc(C(=O)N(C)CC[NH2+]Cc2ccccc2[N+](=O)[O-])n[nH]1	ZINC001266651169	836595223	/nfs/dbraw/zinc/59/52/23/836595223.db2.gz	VTOHBRRYOPTRKN-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266900783	837029045	/nfs/dbraw/zinc/02/90/45/837029045.db2.gz	GDTAHGBAXUWVJE-FDAQZYERSA-N	1	1	307.394	1.444	20	5		DDBDMO
CCC/C=C/CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001266900783	837029056	/nfs/dbraw/zinc/02/90/56/837029056.db2.gz	GDTAHGBAXUWVJE-FDAQZYERSA-N	1	1	307.394	1.444	20	5		DDBDMO
CCC/C=C/CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001266900783	837029069	/nfs/dbraw/zinc/02/90/69/837029069.db2.gz	GDTAHGBAXUWVJE-FDAQZYERSA-N	1	1	307.394	1.444	20	5		DDBDMO
CCOCCC[NH+]1CCC(C)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001270225966	842401119	/nfs/dbraw/zinc/40/11/19/842401119.db2.gz	RONGOJUXPIPOFJ-CHWSQXEVSA-N	1	1	313.398	1.049	20	5		DDBDMO
CN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC001326489242	861403168	/nfs/dbraw/zinc/40/31/68/861403168.db2.gz	PLPNIQUVRHFISD-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1ccnc(N2CCN(c3[nH+]cccc3N)CC2)c1[N+](=O)[O-]	ZINC001154782581	861447846	/nfs/dbraw/zinc/44/78/46/861447846.db2.gz	STEPYRSPKSDNNM-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN2CCN(c3[nH]cc[nH+]3)CC2)cc1	ZINC001326757417	861593942	/nfs/dbraw/zinc/59/39/42/861593942.db2.gz	ORBBTRDNVVILSJ-CQSZACIVSA-N	1	1	317.349	1.174	20	5		DDBDMO
O=C(N[C@H]1CC[C@H](C[NH2+]C/C=C/Cl)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001272726442	846724059	/nfs/dbraw/zinc/72/40/59/846724059.db2.gz	DHTVUNWODUCIES-JLZSLLGCSA-N	1	1	315.801	1.669	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@H]3CCC[NH2+]C3)C2)nc1	ZINC001327863871	862524316	/nfs/dbraw/zinc/52/43/16/862524316.db2.gz	JVPRZNIRYYQNEO-STQMWFEESA-N	1	1	305.382	1.476	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)cc1[N+](=O)[O-]	ZINC001124109340	859583719	/nfs/dbraw/zinc/58/37/19/859583719.db2.gz	MLWUUPLRAARESF-FRRDWIJNSA-N	1	1	318.377	1.707	20	5		DDBDMO
CCCCC(=O)NCC1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001277001951	881571057	/nfs/dbraw/zinc/57/10/57/881571057.db2.gz	JUUKRUOBFQUYJL-UHFFFAOYSA-N	1	1	309.370	1.257	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1	ZINC001156572219	863158613	/nfs/dbraw/zinc/15/86/13/863158613.db2.gz	AYIXBXCVNVUGSF-ZETCQYMHSA-N	1	1	301.734	1.185	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(NC(=N)NCCCC[NH3+])nc1Cl	ZINC001157094856	863571637	/nfs/dbraw/zinc/57/16/37/863571637.db2.gz	XQQDOTFWHOHYLX-UHFFFAOYSA-N	1	1	300.750	1.627	20	5		DDBDMO
C[NH+](C)Cc1ncccc1O[C@H](C[N+](=O)[O-])c1cccnc1	ZINC001225276894	881756238	/nfs/dbraw/zinc/75/62/38/881756238.db2.gz	BNVPRQSNWCMMDU-OAHLLOKOSA-N	1	1	302.334	1.935	20	5		DDBDMO
C[N@@H+](C1CN(c2nccc(Cl)c2[N+](=O)[O-])C1)[C@H]1CCOC1	ZINC001158726824	864861721	/nfs/dbraw/zinc/86/17/21/864861721.db2.gz	UDFUAOPTSRRWEJ-VIFPVBQESA-N	1	1	312.757	1.553	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(NCC[C@H]2CCC[N@@H+]2C)n1	ZINC001160968042	866227895	/nfs/dbraw/zinc/22/78/95/866227895.db2.gz	GGWCCRUHAHUCBB-LLVKDONJSA-N	1	1	322.369	1.548	20	5		DDBDMO
COC(=O)N1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC001319846186	866335301	/nfs/dbraw/zinc/33/53/01/866335301.db2.gz	SJBJPTRVMQWWOQ-CQSZACIVSA-N	1	1	323.349	1.402	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC001319846186	866335323	/nfs/dbraw/zinc/33/53/23/866335323.db2.gz	SJBJPTRVMQWWOQ-CQSZACIVSA-N	1	1	323.349	1.402	20	5		DDBDMO
Cc1nn(CCC(=O)Nc2cc(C)[nH+]c(C)c2)c(C)c1[N+](=O)[O-]	ZINC001319857730	866347971	/nfs/dbraw/zinc/34/79/71/866347971.db2.gz	WJEUWVVNKJFBOK-UHFFFAOYSA-N	1	1	317.349	1.871	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@@H+](C2CC2)C[C@H]1C	ZINC001161493744	866710639	/nfs/dbraw/zinc/71/06/39/866710639.db2.gz	HDTDJIHJANMAFS-LLVKDONJSA-N	1	1	321.381	1.185	20	5		DDBDMO
CNc1cc([N+](=O)[O-])cnc1NCCC[NH+]1CCN(C)CC1	ZINC001161703311	866911783	/nfs/dbraw/zinc/91/17/83/866911783.db2.gz	CLFSTWUQISZCTR-UHFFFAOYSA-N	1	1	308.386	1.081	20	5		DDBDMO
Cc1[nH]c(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c(C)[nH+]1	ZINC001164181876	868997659	/nfs/dbraw/zinc/99/76/59/868997659.db2.gz	LWMGOYMEWWRESI-UHFFFAOYSA-N	1	1	324.362	1.950	20	5		DDBDMO
[NH3+][C@@H]1CN(c2c([N+](=O)[O-])cc[n+]([O-])c2Cl)CCC1(F)F	ZINC001164322503	869125997	/nfs/dbraw/zinc/12/59/97/869125997.db2.gz	BNLDUSDHLBAJOO-SSDOTTSWSA-N	1	1	308.672	1.054	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc4nonc4c3[N+](=O)[O-])[C@@H]2C1	ZINC001338298783	869909918	/nfs/dbraw/zinc/90/99/18/869909918.db2.gz	WFESJUUPYXEGOR-AEJSXWLSSA-N	1	1	303.322	1.883	20	5		DDBDMO
CN(C)[C@@H]1C[C@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC001338553538	870042625	/nfs/dbraw/zinc/04/26/25/870042625.db2.gz	XUEVENUQZRSYCN-SOUVJXGZSA-N	1	1	307.394	1.947	20	5		DDBDMO
C[NH+]1CCN(c2ncc(Nc3ccc([N+](=O)[O-])nc3)cn2)CC1	ZINC001203566302	870646367	/nfs/dbraw/zinc/64/63/67/870646367.db2.gz	FJPSBMXDBFASMD-UHFFFAOYSA-N	1	1	315.337	1.275	20	5		DDBDMO
Cc1cc(F)c([N+](=O)[O-])cc1C(=O)N(C)CC[N@@H+](C)CCO	ZINC001301548340	871000767	/nfs/dbraw/zinc/00/07/67/871000767.db2.gz	SLDBTNFWVOEGIV-UHFFFAOYSA-N	1	1	313.329	1.038	20	5		DDBDMO
CC(C)CCC[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001205223785	871440308	/nfs/dbraw/zinc/44/03/08/871440308.db2.gz	HTQCXAIADCFXJE-HUUCEWRRSA-N	1	1	311.426	1.916	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4nn[nH]n4)C3)nc2c1	ZINC001308035714	871464778	/nfs/dbraw/zinc/46/47/78/871464778.db2.gz	RULSHLPCYRZOIF-QMMMGPOBSA-N	1	1	315.293	1.239	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4nn[nH]n4)C3)nc2c1	ZINC001308035714	871464791	/nfs/dbraw/zinc/46/47/91/871464791.db2.gz	RULSHLPCYRZOIF-QMMMGPOBSA-N	1	1	315.293	1.239	20	5		DDBDMO
COc1cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)ncc1[N+](=O)[O-]	ZINC001226581122	882521638	/nfs/dbraw/zinc/52/16/38/882521638.db2.gz	LJSPLOPFWUNYTB-PLMOITTCSA-N	1	1	307.306	1.181	20	5		DDBDMO
COc1cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)ncc1[N+](=O)[O-]	ZINC001226581122	882521656	/nfs/dbraw/zinc/52/16/56/882521656.db2.gz	LJSPLOPFWUNYTB-PLMOITTCSA-N	1	1	307.306	1.181	20	5		DDBDMO
Cn1c2ccccc2c(NCC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1=O	ZINC001342847171	872411950	/nfs/dbraw/zinc/41/19/50/872411950.db2.gz	JHIGGHMFEHKLIE-UHFFFAOYSA-N	1	1	316.361	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[N@@H+]2CCN1C[C@H]2C	ZINC001345491712	873422238	/nfs/dbraw/zinc/42/22/38/873422238.db2.gz	PILBQZUMSUJYME-RISCZKNCSA-N	1	1	304.350	1.230	20	5		DDBDMO
C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCN1C	ZINC001345719708	873488372	/nfs/dbraw/zinc/48/83/72/873488372.db2.gz	PHZLXQIRIZAJEB-FZMZJTMJSA-N	1	1	321.381	1.351	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC001350089623	875530178	/nfs/dbraw/zinc/53/01/78/875530178.db2.gz	VSHCNEHRKXSEJC-AEGPPILISA-N	1	1	303.362	1.594	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc([N+](=O)[O-])c1	ZINC001350262651	875602360	/nfs/dbraw/zinc/60/23/60/875602360.db2.gz	QFXRDZHYHUEINF-UONOGXRCSA-N	1	1	320.349	1.186	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC001353890948	877633505	/nfs/dbraw/zinc/63/35/05/877633505.db2.gz	AUHQEYQEAUPPBR-NSHDSACASA-N	1	1	309.370	1.127	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1CO[C@@H]1CCC[N@@H+](C)C1	ZINC001222772313	880692359	/nfs/dbraw/zinc/69/23/59/880692359.db2.gz	ALTRDJSUZIZNOL-LLVKDONJSA-N	1	1	308.334	1.992	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](C)Cn1cc[nH+]c1C	ZINC001291813942	913582629	/nfs/dbraw/zinc/58/26/29/913582629.db2.gz	XHKACDQGCZOBCN-JTQLQIEISA-N	1	1	320.353	1.057	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CC[C@H](F)[C@@H](O)C3)CC2)cc1	ZINC001254476030	896456008	/nfs/dbraw/zinc/45/60/08/896456008.db2.gz	JRDYLFDMQZAHSL-HOTGVXAUSA-N	1	1	323.368	1.968	20	5		DDBDMO
[NH3+]CCCN1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254579038	896510888	/nfs/dbraw/zinc/51/08/88/896510888.db2.gz	PCPUHXQBRAAPOE-MRXNPFEDSA-N	1	1	304.394	1.028	20	5		DDBDMO
COC1C[C@@H]2COC[C@H](C1)[N@@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254595843	896522431	/nfs/dbraw/zinc/52/24/31/896522431.db2.gz	NROYCEFNRULGKJ-VPSFDDGASA-N	1	1	318.373	1.940	20	5		DDBDMO
COC1C[C@@H]2COC[C@H](C1)[N@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254595843	896522440	/nfs/dbraw/zinc/52/24/40/896522440.db2.gz	NROYCEFNRULGKJ-VPSFDDGASA-N	1	1	318.373	1.940	20	5		DDBDMO
CS(=O)(=O)[C@H]1CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601270	896524921	/nfs/dbraw/zinc/52/49/21/896524921.db2.gz	XGZGQMQVTBZCOU-KBPBESRZSA-N	1	1	310.375	1.181	20	5		DDBDMO
CS(=O)(=O)[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601270	896524934	/nfs/dbraw/zinc/52/49/34/896524934.db2.gz	XGZGQMQVTBZCOU-KBPBESRZSA-N	1	1	310.375	1.181	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)O1	ZINC001254603447	896527559	/nfs/dbraw/zinc/52/75/59/896527559.db2.gz	NGPTYYNHPHAOIR-GDBMZVCRSA-N	1	1	317.345	1.636	20	5		DDBDMO
CC[N@@H+](CCN1CCOCC1)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254604291	896527879	/nfs/dbraw/zinc/52/78/79/896527879.db2.gz	UTASZJAONNSAEZ-KRWDZBQOSA-N	1	1	319.405	1.716	20	5		DDBDMO
C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@H](C)C1	ZINC000248780735	282108236	/nfs/dbraw/zinc/10/82/36/282108236.db2.gz	WKGPRRHWSMEWIA-NWDGAFQWSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000305816305	231064815	/nfs/dbraw/zinc/06/48/15/231064815.db2.gz	ADQQDBQSJZQXCX-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000451925287	231235999	/nfs/dbraw/zinc/23/59/99/231235999.db2.gz	GCWKSPBCOGYDRP-HNNXBMFYSA-N	1	1	310.350	1.434	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000444272739	529465087	/nfs/dbraw/zinc/46/50/87/529465087.db2.gz	YXKIKJUWEHJHEG-JTQLQIEISA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000444272739	529465088	/nfs/dbraw/zinc/46/50/88/529465088.db2.gz	YXKIKJUWEHJHEG-JTQLQIEISA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000444272739	529465089	/nfs/dbraw/zinc/46/50/89/529465089.db2.gz	YXKIKJUWEHJHEG-JTQLQIEISA-N	1	1	307.354	1.189	20	5		DDBDMO
COC[C@@H](C)OC[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315463	230362674	/nfs/dbraw/zinc/36/26/74/230362674.db2.gz	QPCFGKMJVSJFRL-WBMJQRKESA-N	1	1	324.377	1.365	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](C[C@H]2CCS(=O)(=O)C2)C2CC2)cc1	ZINC000279747936	215111353	/nfs/dbraw/zinc/11/13/53/215111353.db2.gz	PWFRPSRMRXDUEQ-CYBMUJFWSA-N	1	1	324.402	1.994	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+](C[C@H]2CCS(=O)(=O)C2)C2CC2)cc1	ZINC000279747936	215111357	/nfs/dbraw/zinc/11/13/57/215111357.db2.gz	PWFRPSRMRXDUEQ-CYBMUJFWSA-N	1	1	324.402	1.994	20	5		DDBDMO
Cc1ccnc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c1[N+](=O)[O-]	ZINC000265146244	186340256	/nfs/dbraw/zinc/34/02/56/186340256.db2.gz	ABOSTBCAKNVYCO-NSHDSACASA-N	1	1	307.354	1.050	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NCC1([NH+]2CCOCC2)CCCCC1	ZINC000008319280	352134138	/nfs/dbraw/zinc/13/41/38/352134138.db2.gz	RRRHZGXLVHAMFW-UHFFFAOYSA-N	1	1	323.397	1.775	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000026711238	352210683	/nfs/dbraw/zinc/21/06/83/352210683.db2.gz	RNABSOVOMPQBII-YRGRVCCFSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000045522171	352414146	/nfs/dbraw/zinc/41/41/46/352414146.db2.gz	GQEDHLAJVVZFPU-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(CO)CC1	ZINC000052807717	352626725	/nfs/dbraw/zinc/62/67/25/352626725.db2.gz	AZQZQVWGWVIWTK-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC1	ZINC000173010436	198177343	/nfs/dbraw/zinc/17/73/43/198177343.db2.gz	PSXWYJQYPXNZNB-UHFFFAOYSA-N	1	1	306.366	1.195	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000491576002	234207157	/nfs/dbraw/zinc/20/71/57/234207157.db2.gz	LFQCMKMOISSGNY-YVMONPNESA-N	1	1	307.350	1.302	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CNC(C)=O)CC1	ZINC000061046283	352884117	/nfs/dbraw/zinc/88/41/17/352884117.db2.gz	VNQLCLCLESONDV-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CC3CC3)CC2)c1	ZINC000067752175	353065387	/nfs/dbraw/zinc/06/53/87/353065387.db2.gz	CNVPQPJJQQRVMF-UHFFFAOYSA-N	1	1	319.361	1.771	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000068800102	353131494	/nfs/dbraw/zinc/13/14/94/353131494.db2.gz	VCTSFLLQJXTGHQ-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000074763914	353329673	/nfs/dbraw/zinc/32/96/73/353329673.db2.gz	DYFXIJSIVIRMPB-UHFFFAOYSA-N	1	1	318.377	1.627	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H](C[N@@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000174471263	198338299	/nfs/dbraw/zinc/33/82/99/198338299.db2.gz	CPYBYWFRSUECHU-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H](C[N@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000174471263	198338301	/nfs/dbraw/zinc/33/83/01/198338301.db2.gz	CPYBYWFRSUECHU-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H](C[N@@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000174471263	198338303	/nfs/dbraw/zinc/33/83/03/198338303.db2.gz	CPYBYWFRSUECHU-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
Cc1cnc(N2CC[C@H](C[NH+]3CCOCC3)C2)c([N+](=O)[O-])c1	ZINC000078669263	353527580	/nfs/dbraw/zinc/52/75/80/353527580.db2.gz	HVRBYRXYFJXEIE-CYBMUJFWSA-N	1	1	306.366	1.457	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccccc2)C(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000084259679	353719078	/nfs/dbraw/zinc/71/90/78/353719078.db2.gz	CBXNSHIHRSKCQV-JKSUJKDBSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N(C)CCCN2CC[NH+](C)CC2)c1	ZINC000088722097	353757722	/nfs/dbraw/zinc/75/77/22/353757722.db2.gz	RBRXBCMKMKGATD-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@@H+]2CCCC[C@@H]2CO1	ZINC000090145725	353791598	/nfs/dbraw/zinc/79/15/98/353791598.db2.gz	UCQUJUMGMYWQBC-OCCSQVGLSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@H+]2CCCC[C@@H]2CO1	ZINC000090145725	353791601	/nfs/dbraw/zinc/79/16/01/353791601.db2.gz	UCQUJUMGMYWQBC-OCCSQVGLSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000093342908	353896559	/nfs/dbraw/zinc/89/65/59/353896559.db2.gz	ANSTWDJEZUYFLX-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000093342908	353896563	/nfs/dbraw/zinc/89/65/63/353896563.db2.gz	ANSTWDJEZUYFLX-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc(Br)c([N+](=O)[O-])n1)C1CC1	ZINC000290864247	354445126	/nfs/dbraw/zinc/44/51/26/354445126.db2.gz	YXEQSFCKIZFFQK-QMMMGPOBSA-N	1	1	319.159	1.009	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)COc1cc(C)c([N+](=O)[O-])cc1F	ZINC000319560818	354522320	/nfs/dbraw/zinc/52/23/20/354522320.db2.gz	PEGUEGSAJUBZRW-NSHDSACASA-N	1	1	316.329	1.360	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@@H](C)C1	ZINC000346216134	283032760	/nfs/dbraw/zinc/03/27/60/283032760.db2.gz	IAARIYJUMISKAV-WDMOLILDSA-N	1	1	306.366	1.725	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000405259991	354678057	/nfs/dbraw/zinc/67/80/57/354678057.db2.gz	IKLAMLNJRUNUAM-QWHCGFSZSA-N	1	1	311.769	1.499	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)[C@H]2C1	ZINC000585779648	354839688	/nfs/dbraw/zinc/83/96/88/354839688.db2.gz	HPHVDOBKSKGTAJ-YGRLFVJLSA-N	1	1	306.366	1.200	20	5		DDBDMO
Cc1cc(N2CC[N@H+](CCO)C(C)(C)C2)c(F)cc1[N+](=O)[O-]	ZINC000589691931	355013270	/nfs/dbraw/zinc/01/32/70/355013270.db2.gz	VSVHMCNSBGPMCY-UHFFFAOYSA-N	1	1	311.357	1.935	20	5		DDBDMO
Cc1cc(N2CC[N@@H+](CCO)C(C)(C)C2)c(F)cc1[N+](=O)[O-]	ZINC000589691931	355013273	/nfs/dbraw/zinc/01/32/73/355013273.db2.gz	VSVHMCNSBGPMCY-UHFFFAOYSA-N	1	1	311.357	1.935	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000590141911	355053066	/nfs/dbraw/zinc/05/30/66/355053066.db2.gz	JDIWNYZSVIIZLW-HNNXBMFYSA-N	1	1	307.398	1.813	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590442358	355096515	/nfs/dbraw/zinc/09/65/15/355096515.db2.gz	FNKLKDCVNYVVSW-DGCLKSJQSA-N	1	1	305.334	1.380	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](CCCO)C2)c1	ZINC000590663818	355139833	/nfs/dbraw/zinc/13/98/33/355139833.db2.gz	PRAROIVFINRYHH-GFCCVEGCSA-N	1	1	322.361	1.976	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](O)[C@H]2C)c([N+](=O)[O-])c1	ZINC000591039604	355237436	/nfs/dbraw/zinc/23/74/36/355237436.db2.gz	MLCUENHTSQEZCS-QMTHXVAHSA-N	1	1	323.349	1.387	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(F)c1	ZINC000591138796	355252966	/nfs/dbraw/zinc/25/29/66/355252966.db2.gz	VLYGFVQSXJYMBI-CYBMUJFWSA-N	1	1	324.356	1.820	20	5		DDBDMO
CN(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1CCC[N@H+]1C	ZINC000591505419	355322232	/nfs/dbraw/zinc/32/22/32/355322232.db2.gz	JOFGMUYSXOJDRH-ZDUSSCGKSA-N	1	1	321.377	1.892	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@@H]1[NH3+]	ZINC000592330548	355560611	/nfs/dbraw/zinc/56/06/11/355560611.db2.gz	BZQYOKKRKFFVJL-SKDRFNHKSA-N	1	1	317.349	1.671	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1	ZINC000592520416	355611184	/nfs/dbraw/zinc/61/11/84/355611184.db2.gz	MOHQFHCVSMFXPP-DOMZBBRYSA-N	1	1	320.345	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cn[nH]c2)c1	ZINC000593025526	355773479	/nfs/dbraw/zinc/77/34/79/355773479.db2.gz	XGOVCLJFMLCZIF-SECBINFHSA-N	1	1	304.306	1.955	20	5		DDBDMO
CC(C)O[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000593055560	355781483	/nfs/dbraw/zinc/78/14/83/355781483.db2.gz	LQBZPPXGOBDPGM-ZIAGYGMSSA-N	1	1	312.370	1.042	20	5		DDBDMO
CC[C@H]1COC(C)(C)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000593056741	355782974	/nfs/dbraw/zinc/78/29/74/355782974.db2.gz	OLCVDUASFLFFDJ-WCQYABFASA-N	1	1	312.370	1.042	20	5		DDBDMO
CC(C)(C)OC(=O)C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC1CC1	ZINC000593075823	355787864	/nfs/dbraw/zinc/78/78/64/355787864.db2.gz	VJXCHOGJGJLCFW-UHFFFAOYSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC(C)(C)OC(=O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC1CC1	ZINC000593075823	355787865	/nfs/dbraw/zinc/78/78/65/355787865.db2.gz	VJXCHOGJGJLCFW-UHFFFAOYSA-N	1	1	324.381	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CC([N@H+]4CC[C@@H](O)C4)C3)ccnc21	ZINC000593502475	355905706	/nfs/dbraw/zinc/90/57/06/355905706.db2.gz	DIMZHIMFESLDNO-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C[C@@H](C)O)C2CC2)c1	ZINC000594057485	356103002	/nfs/dbraw/zinc/10/30/02/356103002.db2.gz	FXQSCHSXCNXLBB-SNVBAGLBSA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@@H](C)O)C2CC2)c1	ZINC000594057485	356103007	/nfs/dbraw/zinc/10/30/07/356103007.db2.gz	FXQSCHSXCNXLBB-SNVBAGLBSA-N	1	1	308.334	1.727	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)n1	ZINC000594198976	356138528	/nfs/dbraw/zinc/13/85/28/356138528.db2.gz	WXAPPBXZEBOZSJ-GHMZBOCLSA-N	1	1	307.354	1.075	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC1(O)CC[NH+](C)CC1	ZINC000595029780	356374388	/nfs/dbraw/zinc/37/43/88/356374388.db2.gz	YNWJPIUWOGRKMZ-GFCCVEGCSA-N	1	1	323.393	1.711	20	5		DDBDMO
CO[C@H](C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@@H]1CCOC1	ZINC000595423135	356486310	/nfs/dbraw/zinc/48/63/10/356486310.db2.gz	JNELLYZVTAEFPK-IAQYHMDHSA-N	1	1	307.350	1.399	20	5		DDBDMO
CO[C@H](C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@@H]1CCOC1	ZINC000595423135	356486313	/nfs/dbraw/zinc/48/63/13/356486313.db2.gz	JNELLYZVTAEFPK-IAQYHMDHSA-N	1	1	307.350	1.399	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CO)Cc1ccccc1	ZINC000595596531	356568565	/nfs/dbraw/zinc/56/85/65/356568565.db2.gz	NNNIOWTWJHDJHF-CQSZACIVSA-N	1	1	304.350	1.327	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(CO)(CO)C1	ZINC000595799952	356655789	/nfs/dbraw/zinc/65/57/89/356655789.db2.gz	OECFGKUATXHVOP-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(CO)(CO)C1	ZINC000595799952	356655797	/nfs/dbraw/zinc/65/57/97/356655797.db2.gz	OECFGKUATXHVOP-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC2(COC2)C1	ZINC000595834273	356670358	/nfs/dbraw/zinc/67/03/58/356670358.db2.gz	NSALAYDGHVAMNV-UHFFFAOYSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1	ZINC000347432741	283213019	/nfs/dbraw/zinc/21/30/19/283213019.db2.gz	PEWDFBAAETUNTN-LBPRGKRZSA-N	1	1	321.381	1.132	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)c1c[nH]nc1[C@@H]1CC[NH2+]C1	ZINC000595925112	356707025	/nfs/dbraw/zinc/70/70/25/356707025.db2.gz	VIXAVSMASGUWGK-SECBINFHSA-N	1	1	301.306	1.647	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2cc(C)sc2[N+](=O)[O-])CC1	ZINC000596077825	356765292	/nfs/dbraw/zinc/76/52/92/356765292.db2.gz	BVHPFDQEHHPFMH-UHFFFAOYSA-N	1	1	312.395	1.587	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C2)C1	ZINC000596242811	356829682	/nfs/dbraw/zinc/82/96/82/356829682.db2.gz	ZKLKYILTWWOEJI-OAHLLOKOSA-N	1	1	304.350	1.226	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1CCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1	ZINC000596431582	356877878	/nfs/dbraw/zinc/87/78/78/356877878.db2.gz	PIFUYEXUJBQXSO-MNOVXSKESA-N	1	1	319.365	1.414	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1CCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1	ZINC000596431582	356877879	/nfs/dbraw/zinc/87/78/79/356877879.db2.gz	PIFUYEXUJBQXSO-MNOVXSKESA-N	1	1	319.365	1.414	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000596308735	356852425	/nfs/dbraw/zinc/85/24/25/356852425.db2.gz	MKOOVOQOIUEZDU-SNVBAGLBSA-N	1	1	306.366	1.978	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000596308414	356852739	/nfs/dbraw/zinc/85/27/39/356852739.db2.gz	RUHOIJJSXNYRRL-LBPRGKRZSA-N	1	1	308.382	1.954	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000597856816	357359805	/nfs/dbraw/zinc/35/98/05/357359805.db2.gz	AQPXHTWZPZPRBO-LLVKDONJSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000597857682	357359817	/nfs/dbraw/zinc/35/98/17/357359817.db2.gz	IWXXRGVXQHZTPO-JTQLQIEISA-N	1	1	308.338	1.298	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597921533	357382467	/nfs/dbraw/zinc/38/24/67/357382467.db2.gz	GUQYPEPFMXZTSX-JTQLQIEISA-N	1	1	323.397	1.873	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000598587286	357642391	/nfs/dbraw/zinc/64/23/91/357642391.db2.gz	OECSGIXGODAUMP-JTQLQIEISA-N	1	1	320.349	1.673	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000598591343	357644631	/nfs/dbraw/zinc/64/46/31/357644631.db2.gz	AANKBPMTJKVVKE-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1	ZINC000598559451	357631929	/nfs/dbraw/zinc/63/19/29/357631929.db2.gz	HQSZQOOYZSSJRQ-LBPRGKRZSA-N	1	1	321.381	1.180	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cn1	ZINC000598560046	357632050	/nfs/dbraw/zinc/63/20/50/357632050.db2.gz	JYWDGXRPYVQGBJ-ZDUSSCGKSA-N	1	1	318.377	1.842	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000599564177	357974986	/nfs/dbraw/zinc/97/49/86/357974986.db2.gz	QCSUDTGDOJMBRO-NHYWBVRUSA-N	1	1	308.334	1.920	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000599562861	357975002	/nfs/dbraw/zinc/97/50/02/357975002.db2.gz	IUINBVPKTOQQAR-OAHLLOKOSA-N	1	1	308.334	1.401	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000599568170	357977040	/nfs/dbraw/zinc/97/70/40/357977040.db2.gz	QVEWEMFEVDZEMP-IAQYHMDHSA-N	1	1	308.334	1.920	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([N@H+]3CC[C@@H](O)C3)C2)c1	ZINC000599939516	358086323	/nfs/dbraw/zinc/08/63/23/358086323.db2.gz	WCQSNWKSFXQUOO-CHWSQXEVSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000600309517	358192049	/nfs/dbraw/zinc/19/20/49/358192049.db2.gz	BBRQOJKGANVUFQ-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000600312970	358192916	/nfs/dbraw/zinc/19/29/16/358192916.db2.gz	WHNXDRBKJSGGRI-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
Cn1c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)ccc1[N+](=O)[O-]	ZINC000600472773	358234539	/nfs/dbraw/zinc/23/45/39/358234539.db2.gz	QIGCQVQDHVAZKR-GFCCVEGCSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000180839746	199216280	/nfs/dbraw/zinc/21/62/80/199216280.db2.gz	QKJOVRZAOWGIBF-JTQLQIEISA-N	1	1	321.333	1.395	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000601971330	358759638	/nfs/dbraw/zinc/75/96/38/358759638.db2.gz	AKJXPMMUDPRTKY-TXEJJXNPSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974882	358761111	/nfs/dbraw/zinc/76/11/11/358761111.db2.gz	SCSVDLMICGNQEI-UTUOFQBUSA-N	1	1	305.334	1.500	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974882	358761114	/nfs/dbraw/zinc/76/11/14/358761114.db2.gz	SCSVDLMICGNQEI-UTUOFQBUSA-N	1	1	305.334	1.500	20	5		DDBDMO
Cc1nn(C)cc1[C@@H]1CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602789268	359193079	/nfs/dbraw/zinc/19/30/79/359193079.db2.gz	UAVWXWIIFLQZOG-AWEZNQCLSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@@]2(CC[N@H+](C)C2)C1	ZINC000602834800	359226651	/nfs/dbraw/zinc/22/66/51/359226651.db2.gz	DBHAWFYFOGUPOM-HNNXBMFYSA-N	1	1	307.398	1.517	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)CCCNC(=O)C1CCC1	ZINC000602820459	359214689	/nfs/dbraw/zinc/21/46/89/359214689.db2.gz	LTESJEQZWRKCNU-UHFFFAOYSA-N	1	1	323.397	1.338	20	5		DDBDMO
C[NH+](C)C[C@]1(O)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891704	359275672	/nfs/dbraw/zinc/27/56/72/359275672.db2.gz	OCGNFKMXSUEMIY-MRXNPFEDSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[NH+](C)C[C@]1(O)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891704	359275675	/nfs/dbraw/zinc/27/56/75/359275675.db2.gz	OCGNFKMXSUEMIY-MRXNPFEDSA-N	1	1	307.394	1.526	20	5		DDBDMO
CN(C)C[C@]1(O)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891704	359275680	/nfs/dbraw/zinc/27/56/80/359275680.db2.gz	OCGNFKMXSUEMIY-MRXNPFEDSA-N	1	1	307.394	1.526	20	5		DDBDMO
CN(C)C[C@]1(O)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891704	359275684	/nfs/dbraw/zinc/27/56/84/359275684.db2.gz	OCGNFKMXSUEMIY-MRXNPFEDSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@H]1COCC[N@@H+]1C1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000603400287	359616491	/nfs/dbraw/zinc/61/64/91/359616491.db2.gz	FLZPXJUIRMSHJF-JTQLQIEISA-N	1	1	312.395	1.741	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000603400287	359616493	/nfs/dbraw/zinc/61/64/93/359616493.db2.gz	FLZPXJUIRMSHJF-JTQLQIEISA-N	1	1	312.395	1.741	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000609269195	360286162	/nfs/dbraw/zinc/28/61/62/360286162.db2.gz	NABOLXQAHSWWKM-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H]1C	ZINC000610125850	360384209	/nfs/dbraw/zinc/38/42/09/360384209.db2.gz	VDAQHTFAUZCQMM-RYUDHWBXSA-N	1	1	308.382	1.878	20	5		DDBDMO
CN(C)C(=O)CC[NH+]1CCN(c2ccsc2[N+](=O)[O-])CC1	ZINC000610756458	360529077	/nfs/dbraw/zinc/52/90/77/360529077.db2.gz	PIPWEOYCUQKLPN-UHFFFAOYSA-N	1	1	312.395	1.257	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000611087917	360619128	/nfs/dbraw/zinc/61/91/28/360619128.db2.gz	RYKHECUUQJXHHJ-LLVKDONJSA-N	1	1	309.370	1.042	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000611256836	360680962	/nfs/dbraw/zinc/68/09/62/360680962.db2.gz	JCSZOHFHATYCQE-WDEREUQCSA-N	1	1	306.366	1.483	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000611599957	360775145	/nfs/dbraw/zinc/77/51/45/360775145.db2.gz	XIGYIXBDSCWHHY-LLVKDONJSA-N	1	1	305.338	1.018	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1(O)CCC1	ZINC000612851996	361169440	/nfs/dbraw/zinc/16/94/40/361169440.db2.gz	OSGXPSCNJISHSW-UHFFFAOYSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000193359086	201036943	/nfs/dbraw/zinc/03/69/43/201036943.db2.gz	ZYLHPDUEVNGNPL-NSHDSACASA-N	1	1	322.365	1.690	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000613233711	361341151	/nfs/dbraw/zinc/34/11/51/361341151.db2.gz	XIWSRVOAGLCZLN-GFCCVEGCSA-N	1	1	318.377	1.851	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@@H]2C(N)=O)n1	ZINC000359099309	299327953	/nfs/dbraw/zinc/32/79/53/299327953.db2.gz	VFLMGVYXNSFZMO-GFCCVEGCSA-N	1	1	321.381	1.358	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000194012693	201162377	/nfs/dbraw/zinc/16/23/77/201162377.db2.gz	HZYXTACCUJKJDT-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000194012693	201162380	/nfs/dbraw/zinc/16/23/80/201162380.db2.gz	HZYXTACCUJKJDT-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000194610356	201262261	/nfs/dbraw/zinc/26/22/61/201262261.db2.gz	OZFAOLANAAEJNT-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000619578468	364070430	/nfs/dbraw/zinc/07/04/30/364070430.db2.gz	JAGJCYPMKBWURJ-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000275181037	212179098	/nfs/dbraw/zinc/17/90/98/212179098.db2.gz	ARGFFRXZVYXYSP-ZOWXZIJZSA-N	1	1	320.345	1.530	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](C)CN1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293762893	296147014	/nfs/dbraw/zinc/14/70/14/296147014.db2.gz	PDSGYYYLJNBECO-QWHCGFSZSA-N	1	1	321.425	1.464	20	5		DDBDMO
CC(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(N)=O	ZINC000282765816	217234817	/nfs/dbraw/zinc/23/48/17/217234817.db2.gz	UMYNLZPSGZCMPZ-UHFFFAOYSA-N	1	1	308.338	1.119	20	5		DDBDMO
CN(CC(=O)N1CCC[N@@H+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000266248415	205214747	/nfs/dbraw/zinc/21/47/47/205214747.db2.gz	RGIFFOOHNYQWLY-UHFFFAOYSA-N	1	1	306.366	1.195	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](O)C1	ZINC000041886255	183223355	/nfs/dbraw/zinc/22/33/55/183223355.db2.gz	SKILIFDVMAGIDN-GFCCVEGCSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C[C@H](C)O)C[C@@H]1C	ZINC000337427438	249490937	/nfs/dbraw/zinc/49/09/37/249490937.db2.gz	SWWNABANKIRICT-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[NH+](C[C@@H](C)O)CC1	ZINC000285222124	218339737	/nfs/dbraw/zinc/33/97/37/218339737.db2.gz	PIRGBIOVEXPZQX-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000285352591	218394180	/nfs/dbraw/zinc/39/41/80/218394180.db2.gz	ACMSNRVTKOAGIH-ZIAGYGMSSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000109849733	194294193	/nfs/dbraw/zinc/29/41/93/194294193.db2.gz	CPEZCJMJBWHLBX-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
C[NH+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000119932521	195064612	/nfs/dbraw/zinc/06/46/12/195064612.db2.gz	XLGZBVCDSKOXIN-UHFFFAOYSA-N	1	1	303.322	1.392	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)CC1CC1	ZINC000352457445	285063175	/nfs/dbraw/zinc/06/31/75/285063175.db2.gz	DBMLLRXQHXUDPO-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
COCCOC[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000295890977	533125942	/nfs/dbraw/zinc/12/59/42/533125942.db2.gz	BNDKKXHNLZETSW-MRXNPFEDSA-N	1	1	324.377	1.583	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000352657371	285201271	/nfs/dbraw/zinc/20/12/71/285201271.db2.gz	ACMSNRVTKOAGIH-KBPBESRZSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507876	781992641	/nfs/dbraw/zinc/99/26/41/781992641.db2.gz	MCCBQCXNOWAOSR-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001120507876	781992646	/nfs/dbraw/zinc/99/26/46/781992646.db2.gz	MCCBQCXNOWAOSR-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451547228	533571923	/nfs/dbraw/zinc/57/19/23/533571923.db2.gz	KOXZQPCGCBWWTQ-XJKSGUPXSA-N	1	1	322.361	1.698	20	5		DDBDMO
Cc1ncsc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075719588	406940810	/nfs/dbraw/zinc/94/08/10/406940810.db2.gz	HOIOYHJYNOWGGM-LLVKDONJSA-N	1	1	311.367	1.049	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCS(=O)(=O)C1	ZINC000084439776	407089515	/nfs/dbraw/zinc/08/95/15/407089515.db2.gz	FLRAFWKUDPVDSS-SNVBAGLBSA-N	1	1	304.755	1.525	20	5		DDBDMO
C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)CC1CC1	ZINC000053184101	407164081	/nfs/dbraw/zinc/16/40/81/407164081.db2.gz	LLVFBJDWNLBMER-UHFFFAOYSA-N	1	1	307.306	1.604	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000063665531	407234609	/nfs/dbraw/zinc/23/46/09/407234609.db2.gz	CZCUEHLJPYJDFA-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
COCCC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000066379247	407249803	/nfs/dbraw/zinc/24/98/03/407249803.db2.gz	QJVWYCFTZCRQRO-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
COCCC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000066379247	407249804	/nfs/dbraw/zinc/24/98/04/407249804.db2.gz	QJVWYCFTZCRQRO-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000128229881	407509150	/nfs/dbraw/zinc/50/91/50/407509150.db2.gz	YYTFZCYLYUTHMD-LBPRGKRZSA-N	1	1	323.397	1.426	20	5		DDBDMO
CC[C@H](O)[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000114188011	407550974	/nfs/dbraw/zinc/55/09/74/407550974.db2.gz	FXFZWVBSSBXKJX-ZFWWWQNUSA-N	1	1	321.377	1.819	20	5		DDBDMO
C[N@@H+](CCCOC(=O)NC(N)=O)Cc1ccccc1[N+](=O)[O-]	ZINC000271430736	407682172	/nfs/dbraw/zinc/68/21/72/407682172.db2.gz	BDFWPFDWGSPNAC-UHFFFAOYSA-N	1	1	310.310	1.222	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC[N@@H+](C)C1CC1	ZINC000186730284	407760304	/nfs/dbraw/zinc/76/03/04/407760304.db2.gz	HGMXOVQJFNPJIN-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])CC[N@@H+](C)C1CC1	ZINC000186746156	407762913	/nfs/dbraw/zinc/76/29/13/407762913.db2.gz	BODBPJDMCAOSER-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(CC[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000186746156	407762918	/nfs/dbraw/zinc/76/29/18/407762918.db2.gz	BODBPJDMCAOSER-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(CC[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000186746156	407762921	/nfs/dbraw/zinc/76/29/21/407762921.db2.gz	BODBPJDMCAOSER-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCC[C@H](C)C1	ZINC000180530419	407898458	/nfs/dbraw/zinc/89/84/58/407898458.db2.gz	TWUVZLYIPOEJHV-QWRGUYRKSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000272506523	407953908	/nfs/dbraw/zinc/95/39/08/407953908.db2.gz	JHLUUSGATXIKIQ-JQWIXIFHSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000272506523	407953911	/nfs/dbraw/zinc/95/39/11/407953911.db2.gz	JHLUUSGATXIKIQ-JQWIXIFHSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@H]1CCCC[C@@H]1O	ZINC000272451906	407928355	/nfs/dbraw/zinc/92/83/55/407928355.db2.gz	CHDQCEJBJNBSJL-OCCSQVGLSA-N	1	1	309.366	1.239	20	5		DDBDMO
CCOC(=O)c1ccnc(N(C)[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000175047694	408039627	/nfs/dbraw/zinc/03/96/27/408039627.db2.gz	UFURRJWMHSDGLX-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
Cc1nc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000268439323	408044096	/nfs/dbraw/zinc/04/40/96/408044096.db2.gz	CRWVLEBJWQRRHS-OAHLLOKOSA-N	1	1	321.425	1.982	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C(=O)NC)C1	ZINC000175221342	408080277	/nfs/dbraw/zinc/08/02/77/408080277.db2.gz	CZJCLYVWZDLIJD-LBPRGKRZSA-N	1	1	321.377	1.952	20	5		DDBDMO
CCOCC[NH+]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000137042346	408139248	/nfs/dbraw/zinc/13/92/48/408139248.db2.gz	GZYDMGHXTHAYRX-MRXNPFEDSA-N	1	1	323.393	1.282	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000156333608	408252743	/nfs/dbraw/zinc/25/27/43/408252743.db2.gz	FKOKSKWIAHDQNR-CQSZACIVSA-N	1	1	321.377	1.774	20	5		DDBDMO
CC1(C)C[N@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)CCO1	ZINC000263669702	408197374	/nfs/dbraw/zinc/19/73/74/408197374.db2.gz	GEERNIQCDRVAPP-UHFFFAOYSA-N	1	1	321.337	1.654	20	5		DDBDMO
CC1(C)C[N@@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)CCO1	ZINC000263669702	408197381	/nfs/dbraw/zinc/19/73/81/408197381.db2.gz	GEERNIQCDRVAPP-UHFFFAOYSA-N	1	1	321.337	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](Nc3ccccc3)C2)n1	ZINC000176226044	408315728	/nfs/dbraw/zinc/31/57/28/408315728.db2.gz	BFZBMHZKZDSXEB-AWEZNQCLSA-N	1	1	301.350	1.978	20	5		DDBDMO
CC1(C)C[NH+](CCn2cc([N+](=O)[O-])ccc2=O)CC(C)(C)O1	ZINC000190532537	408271604	/nfs/dbraw/zinc/27/16/04/408271604.db2.gz	STSZLECXVGUYQS-UHFFFAOYSA-N	1	1	309.366	1.646	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000246556316	408288980	/nfs/dbraw/zinc/28/89/80/408288980.db2.gz	KSAGSJCWHRTRND-BBRMVZONSA-N	1	1	319.409	1.740	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000269446504	408312188	/nfs/dbraw/zinc/31/21/88/408312188.db2.gz	FPEZMEOTWJAHEG-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1	ZINC000173898508	162374944	/nfs/dbraw/zinc/37/49/44/162374944.db2.gz	BFXNMSWAUWAYDA-AWEZNQCLSA-N	1	1	307.350	1.274	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1	ZINC000173898508	162374945	/nfs/dbraw/zinc/37/49/45/162374945.db2.gz	BFXNMSWAUWAYDA-AWEZNQCLSA-N	1	1	307.350	1.274	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000274540234	408443586	/nfs/dbraw/zinc/44/35/86/408443586.db2.gz	VXCFHNKNKYESMX-NSHDSACASA-N	1	1	323.397	1.873	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000264410910	408479863	/nfs/dbraw/zinc/47/98/63/408479863.db2.gz	JNOAHRHTJIKRKO-GWCFXTLKSA-N	1	1	307.350	1.429	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000270356238	408501372	/nfs/dbraw/zinc/50/13/72/408501372.db2.gz	ASNDKJZZAOKTMQ-NSHDSACASA-N	1	1	313.379	1.185	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000191666779	408467314	/nfs/dbraw/zinc/46/73/14/408467314.db2.gz	ALUDMJDUYGUVBR-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
CC[C@H](O)[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000269937111	408475267	/nfs/dbraw/zinc/47/52/67/408475267.db2.gz	YQQDXZNBRGGCQF-KBPBESRZSA-N	1	1	309.366	1.382	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCCC[C@H]21	ZINC000248404807	408560752	/nfs/dbraw/zinc/56/07/52/408560752.db2.gz	AIGNUCMCBSSGLY-UQOMUDLDSA-N	1	1	308.382	1.663	20	5		DDBDMO
Nc1nc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)ncc1[N+](=O)[O-]	ZINC000161926124	408652381	/nfs/dbraw/zinc/65/23/81/408652381.db2.gz	OJQKNFJRHJVVPE-ZYHUDNBSSA-N	1	1	318.381	1.420	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000248910870	408662577	/nfs/dbraw/zinc/66/25/77/408662577.db2.gz	IXZDEASTPPHPHQ-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
CCOC(=O)[C@]1(C(C)C)CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000194856057	408801302	/nfs/dbraw/zinc/80/13/02/408801302.db2.gz	CTYSKZMVCOZWDY-OAHLLOKOSA-N	1	1	324.381	1.703	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000249737612	408759087	/nfs/dbraw/zinc/75/90/87/408759087.db2.gz	GDHHXCFIRXVDHA-QWRGUYRKSA-N	1	1	322.365	1.546	20	5		DDBDMO
COC(=O)c1ccc(OC[C@@H](O)C[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000290798890	408834167	/nfs/dbraw/zinc/83/41/67/408834167.db2.gz	PIGADPSQTIYVMJ-LBPRGKRZSA-N	1	1	324.333	1.215	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(N)c2F)[C@@H](C)C1	ZINC000281611732	408896515	/nfs/dbraw/zinc/89/65/15/408896515.db2.gz	ZEULRBKZEWHTSF-UWVGGRQHSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000187807043	163028130	/nfs/dbraw/zinc/02/81/30/163028130.db2.gz	ZGOFVNJCMWRHLN-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)[N@@H+](C)C1CC1	ZINC000277403681	408934110	/nfs/dbraw/zinc/93/41/10/408934110.db2.gz	HGBSJXOSWCHGSQ-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)CO	ZINC000292159433	408992105	/nfs/dbraw/zinc/99/21/05/408992105.db2.gz	KVUAASOGJPVKJZ-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H](C)CO	ZINC000292159433	408992106	/nfs/dbraw/zinc/99/21/06/408992106.db2.gz	KVUAASOGJPVKJZ-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](O)CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000293269504	409079739	/nfs/dbraw/zinc/07/97/39/409079739.db2.gz	UVCJSIJUAHKHBZ-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](O)CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000293269504	409079741	/nfs/dbraw/zinc/07/97/41/409079741.db2.gz	UVCJSIJUAHKHBZ-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
CCNC(=O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C	ZINC000293284731	409081879	/nfs/dbraw/zinc/08/18/79/409081879.db2.gz	OIYLTMGAHWJKOC-ZDUSSCGKSA-N	1	1	324.337	1.753	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[NH2+]CC[C@H]3C2)c1[N+](=O)[O-]	ZINC000293327969	409090296	/nfs/dbraw/zinc/09/02/96/409090296.db2.gz	IWNZLWPGLPHUML-UWVGGRQHSA-N	1	1	307.354	1.094	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1nc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000287785756	409093394	/nfs/dbraw/zinc/09/33/94/409093394.db2.gz	IPUBHGGBBWSBHR-SNVBAGLBSA-N	1	1	310.354	1.919	20	5		DDBDMO
COCC[N@@H+](C)CCNc1ncnc2sc([N+](=O)[O-])cc21	ZINC000287950372	409120681	/nfs/dbraw/zinc/12/06/81/409120681.db2.gz	QKOAPISFCMVTCR-UHFFFAOYSA-N	1	1	311.367	1.590	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000294036473	409229668	/nfs/dbraw/zinc/22/96/68/409229668.db2.gz	SAZXQLCBLCQXID-PHIMTYICSA-N	1	1	309.370	1.041	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC[N@H+](C2CC2)C1	ZINC000295268652	409405316	/nfs/dbraw/zinc/40/53/16/409405316.db2.gz	GQWAHMGUYWWICI-LBPRGKRZSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[N@@H+](CCCN1C(=O)CNC1=O)CCc1ccccc1[N+](=O)[O-]	ZINC000285275935	409409210	/nfs/dbraw/zinc/40/92/10/409409210.db2.gz	JBUYZHHPFNFERW-UHFFFAOYSA-N	1	1	320.349	1.011	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296233494	409473855	/nfs/dbraw/zinc/47/38/55/409473855.db2.gz	KTIWJEMKZCPREF-VXGBXAGGSA-N	1	1	312.391	1.772	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C2CCC2)CC1	ZINC000408152233	164244215	/nfs/dbraw/zinc/24/42/15/164244215.db2.gz	XYFPPJVIXAGOHZ-UHFFFAOYSA-N	1	1	304.350	1.609	20	5		DDBDMO
Cc1nc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000296283249	409488096	/nfs/dbraw/zinc/48/80/96/409488096.db2.gz	HJTWFIQALTXGRP-CYBMUJFWSA-N	1	1	322.413	1.377	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3CCCOC3)C2)nc1	ZINC000331461070	409533910	/nfs/dbraw/zinc/53/39/10/409533910.db2.gz	JJJPGOIZHQZKRY-QWHCGFSZSA-N	1	1	306.366	1.903	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000356902455	409708316	/nfs/dbraw/zinc/70/83/16/409708316.db2.gz	OBNIIWBQXAHEPV-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000356902455	409708327	/nfs/dbraw/zinc/70/83/27/409708327.db2.gz	OBNIIWBQXAHEPV-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1	ZINC000297065970	409784433	/nfs/dbraw/zinc/78/44/33/409784433.db2.gz	LCJTUYJGNGOOHX-UHFFFAOYSA-N	1	1	316.361	1.758	20	5		DDBDMO
COc1cc(C(=O)NC2C[NH+](C(C)C)C2)cc([N+](=O)[O-])c1OC	ZINC000297076868	409791901	/nfs/dbraw/zinc/79/19/01/409791901.db2.gz	LTURFUSTWGHPGO-UHFFFAOYSA-N	1	1	323.349	1.434	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000354385213	409813918	/nfs/dbraw/zinc/81/39/18/409813918.db2.gz	CTOWRJJSCWJBOP-AAEUAGOBSA-N	1	1	323.397	1.431	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000354385290	409814599	/nfs/dbraw/zinc/81/45/99/409814599.db2.gz	CTOWRJJSCWJBOP-DGCLKSJQSA-N	1	1	323.397	1.431	20	5		DDBDMO
C[C@H](O)CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000354731846	410046790	/nfs/dbraw/zinc/04/67/90/410046790.db2.gz	LQVQSNXHKQEYIB-ZDUSSCGKSA-N	1	1	321.377	1.514	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H]1C	ZINC000346636820	410050099	/nfs/dbraw/zinc/05/00/99/410050099.db2.gz	HYRLTIBECBWALE-NEPJUHHUSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000332335455	410074855	/nfs/dbraw/zinc/07/48/55/410074855.db2.gz	RBIXKICKSSNGLK-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000332335455	410074857	/nfs/dbraw/zinc/07/48/57/410074857.db2.gz	RBIXKICKSSNGLK-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CCc3n[nH]nc3C2)c2c(c1)COCO2	ZINC000351608797	410101914	/nfs/dbraw/zinc/10/19/14/410101914.db2.gz	OBPWGIJOQARCFU-UHFFFAOYSA-N	1	1	317.305	1.138	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000298740126	410375451	/nfs/dbraw/zinc/37/54/51/410375451.db2.gz	JRXXWSXETJSNSS-UHFFFAOYSA-N	1	1	321.333	1.144	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC[C@H](O)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000339782707	410457643	/nfs/dbraw/zinc/45/76/43/410457643.db2.gz	HESNXNCXLGUGCK-LSDHHAIUSA-N	1	1	319.361	1.547	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000343538596	410515842	/nfs/dbraw/zinc/51/58/42/410515842.db2.gz	CHXKJNGNBQDXCA-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CC[N@H+](C)C1	ZINC000343600610	410564989	/nfs/dbraw/zinc/56/49/89/410564989.db2.gz	DNECLYPHESCCPF-NSHDSACASA-N	1	1	313.379	1.140	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CC[N@@H+](C)C1	ZINC000343600610	410564995	/nfs/dbraw/zinc/56/49/95/410564995.db2.gz	DNECLYPHESCCPF-NSHDSACASA-N	1	1	313.379	1.140	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H](C)O	ZINC000352232821	410567220	/nfs/dbraw/zinc/56/72/20/410567220.db2.gz	WJQPJCRYFYEZNS-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
O=C(CCN1C[C@H]2C[NH2+]C[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000359305964	410593638	/nfs/dbraw/zinc/59/36/38/410593638.db2.gz	MHMFQNWKKZXTNC-VXGBXAGGSA-N	1	1	304.350	1.075	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H]1C	ZINC000347534902	410601367	/nfs/dbraw/zinc/60/13/67/410601367.db2.gz	ZSUSDZOMYRKDBF-WDEREUQCSA-N	1	1	309.370	1.273	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c(Cl)c1	ZINC000300405246	410643174	/nfs/dbraw/zinc/64/31/74/410643174.db2.gz	JFLGLJUACKKVPX-GXSJLCMTSA-N	1	1	312.757	1.918	20	5		DDBDMO
Cc1nn(C)c(N2CCC[C@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000301307840	410695698	/nfs/dbraw/zinc/69/56/98/410695698.db2.gz	ZYQSKKFDPZYRBL-CYBMUJFWSA-N	1	1	323.397	1.185	20	5		DDBDMO
CC[C@H](C)[NH2+][C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccco1	ZINC000359533383	410714146	/nfs/dbraw/zinc/71/41/46/410714146.db2.gz	AFCSYKBEFBUAQV-VHSXEESVSA-N	1	1	321.337	1.770	20	5		DDBDMO
CC[C@H](C)[NH2+][C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccco1	ZINC000359533382	410715450	/nfs/dbraw/zinc/71/54/50/410715450.db2.gz	AFCSYKBEFBUAQV-UWVGGRQHSA-N	1	1	321.337	1.770	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCC[N@H+](C(C)C)C1	ZINC000347936538	410799699	/nfs/dbraw/zinc/79/96/99/410799699.db2.gz	CUWZULOLKDWPIQ-LBPRGKRZSA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000341074347	410882826	/nfs/dbraw/zinc/88/28/26/410882826.db2.gz	WYCQAHFZVMYWTI-AOOOYVTPSA-N	1	1	309.370	1.619	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882403	410902394	/nfs/dbraw/zinc/90/23/94/410902394.db2.gz	ZSFLJIARVHBWQJ-QWRGUYRKSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882403	410902400	/nfs/dbraw/zinc/90/24/00/410902400.db2.gz	ZSFLJIARVHBWQJ-QWRGUYRKSA-N	1	1	309.341	2.000	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344070167	410935050	/nfs/dbraw/zinc/93/50/50/410935050.db2.gz	QCESWHXJBJBEJF-OUCADQQQSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344070167	410935059	/nfs/dbraw/zinc/93/50/59/410935059.db2.gz	QCESWHXJBJBEJF-OUCADQQQSA-N	1	1	319.361	1.544	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000580366536	422924274	/nfs/dbraw/zinc/92/42/74/422924274.db2.gz	HCBOKUKCUWHJBL-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000580366536	422924276	/nfs/dbraw/zinc/92/42/76/422924276.db2.gz	HCBOKUKCUWHJBL-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1	ZINC000131387349	196164280	/nfs/dbraw/zinc/16/42/80/196164280.db2.gz	MKZFZNMDIVTQBZ-GFCCVEGCSA-N	1	1	323.418	1.691	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000296567256	226001867	/nfs/dbraw/zinc/00/18/67/226001867.db2.gz	CWPZAVHOMGTINQ-LBPRGKRZSA-N	1	1	323.349	1.746	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000296567256	226001870	/nfs/dbraw/zinc/00/18/70/226001870.db2.gz	CWPZAVHOMGTINQ-LBPRGKRZSA-N	1	1	323.349	1.746	20	5		DDBDMO
C[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1CCO	ZINC000419331828	226120928	/nfs/dbraw/zinc/12/09/28/226120928.db2.gz	RXEGQPRARFJCJK-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296695816	226135006	/nfs/dbraw/zinc/13/50/06/226135006.db2.gz	METGVWBEINTYQI-BBRMVZONSA-N	1	1	324.377	1.693	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[N@@H+](C)C[C@H]1C	ZINC000362644509	307023392	/nfs/dbraw/zinc/02/33/92/307023392.db2.gz	RXULOAZCXQIHFN-ZWNOBZJWSA-N	1	1	307.350	1.417	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)n1	ZINC000360662145	418486126	/nfs/dbraw/zinc/48/61/26/418486126.db2.gz	FEAOBPVJDNDGKJ-LBPRGKRZSA-N	1	1	321.381	1.298	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000361125879	418587687	/nfs/dbraw/zinc/58/76/87/418587687.db2.gz	UMGIWETTYCSOGX-LLVKDONJSA-N	1	1	304.350	1.487	20	5		DDBDMO
CC[N@@H+](C[C@H](C)OC)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000291348786	222330043	/nfs/dbraw/zinc/33/00/43/222330043.db2.gz	XQHMJHLNLMXWPD-JSGCOSHPSA-N	1	1	312.366	1.691	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](n2cncn2)C1	ZINC000375333423	418631096	/nfs/dbraw/zinc/63/10/96/418631096.db2.gz	POOAGZFPSBIEFW-LBPRGKRZSA-N	1	1	303.322	1.512	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2c(F)cccc2[N+](=O)[O-])CCOC1	ZINC000362262914	418751185	/nfs/dbraw/zinc/75/11/85/418751185.db2.gz	PTLQFXJUZAWJAR-CQSZACIVSA-N	1	1	312.297	1.546	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000411607709	419359868	/nfs/dbraw/zinc/35/98/68/419359868.db2.gz	DFUYVQOBKFOFGS-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O	ZINC000426208545	419406594	/nfs/dbraw/zinc/40/65/94/419406594.db2.gz	DCHAZUAHTWZTGM-FVQBIDKESA-N	1	1	324.377	1.570	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)C[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000420943301	419374655	/nfs/dbraw/zinc/37/46/55/419374655.db2.gz	POQPOECQNYKBRA-CHWSQXEVSA-N	1	1	324.377	1.933	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H]1CCO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000426257556	419422251	/nfs/dbraw/zinc/42/22/51/419422251.db2.gz	QCADBUBMOBOXEN-ZDUSSCGKSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@]12CCOC2	ZINC000421010947	419449233	/nfs/dbraw/zinc/44/92/33/419449233.db2.gz	DBFUSZYEFKYTHY-DOMZBBRYSA-N	1	1	308.334	1.199	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@@H+](CC)C2)n1	ZINC000427468311	419665242	/nfs/dbraw/zinc/66/52/42/419665242.db2.gz	BGVXPIBDPLHFAU-LLVKDONJSA-N	1	1	309.370	1.273	20	5		DDBDMO
Cc1nn(C)c(NCCC[N@H+]2CCCO[C@H](C)C2)c1[N+](=O)[O-]	ZINC000432863578	229134266	/nfs/dbraw/zinc/13/42/66/229134266.db2.gz	BAQRXEHSQNWHQZ-LLVKDONJSA-N	1	1	311.386	1.550	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](CCO)[C@H](C)C1	ZINC000430220350	420092930	/nfs/dbraw/zinc/09/29/30/420092930.db2.gz	PONVLIBKROVKEB-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4nnc[nH]4)C3)nc2c1	ZINC000425554811	420417718	/nfs/dbraw/zinc/41/77/18/420417718.db2.gz	WSWWOTDRWZDGBC-VIFPVBQESA-N	1	1	314.305	1.844	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@H](c4nnc[nH]4)C3)nc2c1	ZINC000425554811	420417721	/nfs/dbraw/zinc/41/77/21/420417721.db2.gz	WSWWOTDRWZDGBC-VIFPVBQESA-N	1	1	314.305	1.844	20	5		DDBDMO
COC[C@@H](C)OC[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315463	230362676	/nfs/dbraw/zinc/36/26/76/230362676.db2.gz	QPCFGKMJVSJFRL-WBMJQRKESA-N	1	1	324.377	1.365	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CCC[N@@H+](CCCO)C2)n1	ZINC000450614360	420499672	/nfs/dbraw/zinc/49/96/72/420499672.db2.gz	MZHZANWMBJKGJT-CYBMUJFWSA-N	1	1	308.382	1.865	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H](C)[N@H+]1CCO	ZINC000456219592	421127102	/nfs/dbraw/zinc/12/71/02/421127102.db2.gz	CSIJRDZVJCDCEP-TXEJJXNPSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000456219592	421127105	/nfs/dbraw/zinc/12/71/05/421127105.db2.gz	CSIJRDZVJCDCEP-TXEJJXNPSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC[C@H]([NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-])C(=O)NC	ZINC000449767168	421077341	/nfs/dbraw/zinc/07/73/41/421077341.db2.gz	AEQXEEZJSLCLFT-JTQLQIEISA-N	1	1	311.338	1.226	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+]([C@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000456535981	421180541	/nfs/dbraw/zinc/18/05/41/421180541.db2.gz	URLNYMVCOPQZKW-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+]([C@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000456535981	421180545	/nfs/dbraw/zinc/18/05/45/421180545.db2.gz	URLNYMVCOPQZKW-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000524775297	421270824	/nfs/dbraw/zinc/27/08/24/421270824.db2.gz	DJGNFEGJRVSCJP-VIFPVBQESA-N	1	1	310.329	1.388	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000546104470	421285072	/nfs/dbraw/zinc/28/50/72/421285072.db2.gz	KHFGXGRUUMSMHX-HIFRSBDPSA-N	1	1	310.350	1.181	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000555533523	421681374	/nfs/dbraw/zinc/68/13/74/421681374.db2.gz	KOJUHYSKDVZCSA-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000555533523	421681377	/nfs/dbraw/zinc/68/13/77/421681377.db2.gz	KOJUHYSKDVZCSA-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(OC)c1	ZINC000574665410	422156037	/nfs/dbraw/zinc/15/60/37/422156037.db2.gz	GKSKABOSNJLVFG-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(OC)c1	ZINC000574665410	422156044	/nfs/dbraw/zinc/15/60/44/422156044.db2.gz	GKSKABOSNJLVFG-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
Nc1n[nH]c(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)n1	ZINC000595487434	422356776	/nfs/dbraw/zinc/35/67/76/422356776.db2.gz	IQGCPNAQMRNANM-UHFFFAOYSA-N	1	1	320.328	1.814	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCCC[C@@H]1C	ZINC000343076665	271636426	/nfs/dbraw/zinc/63/64/26/271636426.db2.gz	NHECTAVUUKKFOV-RYUDHWBXSA-N	1	1	308.382	1.926	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000344671122	272085518	/nfs/dbraw/zinc/08/55/18/272085518.db2.gz	NNNWQHLQNGWAOM-CYBMUJFWSA-N	1	1	323.397	1.418	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000345764800	272329651	/nfs/dbraw/zinc/32/96/51/272329651.db2.gz	DVYAOAGINRHOQW-GFCCVEGCSA-N	1	1	322.365	1.745	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000278419417	274270567	/nfs/dbraw/zinc/27/05/67/274270567.db2.gz	OMKHCQBQRAGJBZ-LLVKDONJSA-N	1	1	306.366	1.066	20	5		DDBDMO
Cc1nc(N2CC[C@@H]([NH+]3CCOCC3)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000290737032	274842084	/nfs/dbraw/zinc/84/20/84/274842084.db2.gz	BKXKPWZHIRZBMK-TZMCWYRMSA-N	1	1	306.366	1.598	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000269350268	276212435	/nfs/dbraw/zinc/21/24/35/276212435.db2.gz	GHJDKIJYEOLNSI-JTQLQIEISA-N	1	1	309.370	1.513	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)[C@H]2C1	ZINC000272188276	277178437	/nfs/dbraw/zinc/17/84/37/277178437.db2.gz	LOSVBPJDZDEBNU-CABZTGNLSA-N	1	1	303.322	1.661	20	5		DDBDMO
O=C(C[N@H+]1C[C@H]2CCC[C@@H](C1)C2O)Nc1ccccc1[N+](=O)[O-]	ZINC000363234202	300236157	/nfs/dbraw/zinc/23/61/57/300236157.db2.gz	IZINVOXIDDNNJR-HBBFGDNQSA-N	1	1	319.361	1.626	20	5		DDBDMO
O=C(C[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O)Nc1ccccc1[N+](=O)[O-]	ZINC000363234202	300236159	/nfs/dbraw/zinc/23/61/59/300236159.db2.gz	IZINVOXIDDNNJR-HBBFGDNQSA-N	1	1	319.361	1.626	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019114	301120094	/nfs/dbraw/zinc/12/00/94/301120094.db2.gz	OATBYQUDBBHFCH-PWSUYJOCSA-N	1	1	307.354	1.095	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019114	301120096	/nfs/dbraw/zinc/12/00/96/301120096.db2.gz	OATBYQUDBBHFCH-PWSUYJOCSA-N	1	1	307.354	1.095	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	ZINC000369279145	301155585	/nfs/dbraw/zinc/15/55/85/301155585.db2.gz	VVTKLTZKVHROOT-LLVKDONJSA-N	1	1	322.365	1.086	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	ZINC000369279145	301155587	/nfs/dbraw/zinc/15/55/87/301155587.db2.gz	VVTKLTZKVHROOT-LLVKDONJSA-N	1	1	322.365	1.086	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000369800028	301226800	/nfs/dbraw/zinc/22/68/00/301226800.db2.gz	QULYFLJBAYXYFX-GJZGRUSLSA-N	1	1	324.381	1.451	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000369800028	301226803	/nfs/dbraw/zinc/22/68/03/301226803.db2.gz	QULYFLJBAYXYFX-GJZGRUSLSA-N	1	1	324.381	1.451	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1	ZINC000370534659	301358847	/nfs/dbraw/zinc/35/88/47/301358847.db2.gz	GJOWKVSBXJJYHL-HNNXBMFYSA-N	1	1	321.377	1.662	20	5		DDBDMO
COC[C@H](O)C[N@@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000370873998	301399161	/nfs/dbraw/zinc/39/91/61/301399161.db2.gz	WRUUKVJQAGMCSL-CQSZACIVSA-N	1	1	321.377	1.582	20	5		DDBDMO
CCN1C(=O)[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000375860389	302006206	/nfs/dbraw/zinc/00/62/06/302006206.db2.gz	MWXABWVHXUISQU-CYBMUJFWSA-N	1	1	318.333	1.063	20	5		DDBDMO
CCN1C(=O)[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000375860389	302006209	/nfs/dbraw/zinc/00/62/09/302006209.db2.gz	MWXABWVHXUISQU-CYBMUJFWSA-N	1	1	318.333	1.063	20	5		DDBDMO
C[NH+](C)CCn1nnnc1SCc1cc(O)ccc1[N+](=O)[O-]	ZINC000412990543	302376820	/nfs/dbraw/zinc/37/68/20/302376820.db2.gz	IJTAIHOGULJRHT-UHFFFAOYSA-N	1	1	324.366	1.141	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC[N@H+](C(C)(C)C)CC1	ZINC000535040094	303341431	/nfs/dbraw/zinc/34/14/31/303341431.db2.gz	NBAQSABEUQPUQY-UHFFFAOYSA-N	1	1	309.370	1.275	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000366633687	307078070	/nfs/dbraw/zinc/07/80/70/307078070.db2.gz	CKYCFGSEKRTCIW-TZMCWYRMSA-N	1	1	319.409	1.777	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](OCC2CC2)C1	ZINC000368793277	307109907	/nfs/dbraw/zinc/10/99/07/307109907.db2.gz	URGHSFCMPWFLND-OAHLLOKOSA-N	1	1	321.377	1.648	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000370888502	307139143	/nfs/dbraw/zinc/13/91/43/307139143.db2.gz	HNSGKCOPMKZXFZ-LBPRGKRZSA-N	1	1	321.381	1.267	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000373813341	307195700	/nfs/dbraw/zinc/19/57/00/307195700.db2.gz	SXVINOZPVPJYNI-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000373813341	307195701	/nfs/dbraw/zinc/19/57/01/307195701.db2.gz	SXVINOZPVPJYNI-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]12	ZINC000377632359	307275118	/nfs/dbraw/zinc/27/51/18/307275118.db2.gz	UWTUBQCEGDRUMB-QWRGUYRKSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]12	ZINC000377632359	307275119	/nfs/dbraw/zinc/27/51/19/307275119.db2.gz	UWTUBQCEGDRUMB-QWRGUYRKSA-N	1	1	309.753	1.816	20	5		DDBDMO
CC1(C)[C@H](O)C[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000576237734	308300047	/nfs/dbraw/zinc/30/00/47/308300047.db2.gz	HSCBASCSIBYUQR-NWDGAFQWSA-N	1	1	318.333	1.894	20	5		DDBDMO
C[C@@H](NC(=O)C[NH+]1CCC(CO)CC1)c1ccccc1[N+](=O)[O-]	ZINC001120686077	782093552	/nfs/dbraw/zinc/09/35/52/782093552.db2.gz	OHXFQRYOGYRYTQ-GFCCVEGCSA-N	1	1	321.377	1.476	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000583478472	333366885	/nfs/dbraw/zinc/36/68/85/333366885.db2.gz	HNPUETNPTIWQKD-CQSZACIVSA-N	1	1	322.409	1.029	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@@H]2CC[N@@H+](C)C[C@@H]21	ZINC000584649407	337380566	/nfs/dbraw/zinc/38/05/66/337380566.db2.gz	INEGSBQGXVAGSR-NWDGAFQWSA-N	1	1	309.370	1.029	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488732577	484215091	/nfs/dbraw/zinc/21/50/91/484215091.db2.gz	KHRLFTZTGGDMPB-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488732577	484215101	/nfs/dbraw/zinc/21/51/01/484215101.db2.gz	KHRLFTZTGGDMPB-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cn1nnc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1	ZINC000494355679	534332639	/nfs/dbraw/zinc/33/26/39/534332639.db2.gz	HAPPXZWNNHTNFT-DGCLKSJQSA-N	1	1	316.365	1.619	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820808	521850417	/nfs/dbraw/zinc/85/04/17/521850417.db2.gz	VFVWBQRLPQETAJ-IINYFYTJSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820808	521850426	/nfs/dbraw/zinc/85/04/26/521850426.db2.gz	VFVWBQRLPQETAJ-IINYFYTJSA-N	1	1	322.365	1.085	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1	ZINC000331937316	534713499	/nfs/dbraw/zinc/71/34/99/534713499.db2.gz	OUJHQXGYKXBSSP-UHFFFAOYSA-N	1	1	304.310	1.300	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@](O)(C(F)(F)F)C2)c1	ZINC000330986160	534889247	/nfs/dbraw/zinc/88/92/47/534889247.db2.gz	IULZYLMMCCVQTO-JTQLQIEISA-N	1	1	308.260	1.181	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@](O)(C(F)(F)F)C2)c1	ZINC000330986160	534889248	/nfs/dbraw/zinc/88/92/48/534889248.db2.gz	IULZYLMMCCVQTO-JTQLQIEISA-N	1	1	308.260	1.181	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000444083540	528243549	/nfs/dbraw/zinc/24/35/49/528243549.db2.gz	JISPPAMNLBXHBB-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC(C[NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000330869323	528544123	/nfs/dbraw/zinc/54/41/23/528544123.db2.gz	SVCARIUYRQCBNK-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
CC1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000330710592	529122286	/nfs/dbraw/zinc/12/22/86/529122286.db2.gz	XIWNIVHXDIPUTE-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000330710592	529122288	/nfs/dbraw/zinc/12/22/88/529122288.db2.gz	XIWNIVHXDIPUTE-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000820716762	599083840	/nfs/dbraw/zinc/08/38/40/599083840.db2.gz	LADFTAIGWDTANV-SNVBAGLBSA-N	1	1	317.353	1.671	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H]1C	ZINC000121031839	696705459	/nfs/dbraw/zinc/70/54/59/696705459.db2.gz	RYQMHKLBVZATOS-PHIMTYICSA-N	1	1	311.338	1.369	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H]1C	ZINC000121031839	696705462	/nfs/dbraw/zinc/70/54/62/696705462.db2.gz	RYQMHKLBVZATOS-PHIMTYICSA-N	1	1	311.338	1.369	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCCS(=O)(=O)C1	ZINC000069143939	696380877	/nfs/dbraw/zinc/38/08/77/696380877.db2.gz	WCOVVQVINLZLSO-NSHDSACASA-N	1	1	318.782	1.915	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119720395	696684619	/nfs/dbraw/zinc/68/46/19/696684619.db2.gz	PPRQOBCDFANQAY-SECBINFHSA-N	1	1	321.424	1.665	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C[C@H](C)[NH2+]1	ZINC000123882141	696736006	/nfs/dbraw/zinc/73/60/06/696736006.db2.gz	LHMWSEKAIDAYNM-IUCAKERBSA-N	1	1	317.342	1.105	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000126346316	696761252	/nfs/dbraw/zinc/76/12/52/696761252.db2.gz	KYKUJARKLMRXNQ-UHFFFAOYSA-N	1	1	312.326	1.883	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC000175317577	697395844	/nfs/dbraw/zinc/39/58/44/697395844.db2.gz	AYVYSOPCWRDMPW-LLVKDONJSA-N	1	1	306.366	1.557	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000749389552	700160956	/nfs/dbraw/zinc/16/09/56/700160956.db2.gz	DMKXKCAADOTSGV-UHFFFAOYSA-N	1	1	317.349	1.927	20	5		DDBDMO
CC(C)C1(O)C[NH+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000773894840	697820307	/nfs/dbraw/zinc/82/03/07/697820307.db2.gz	CDZCESJVRSYATO-ZDUSSCGKSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1CCO[C@@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000775577631	698011211	/nfs/dbraw/zinc/01/12/11/698011211.db2.gz	QEKFTLUOSJBKQD-RYUDHWBXSA-N	1	1	307.350	1.493	20	5		DDBDMO
CCn1cc(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cn1	ZINC000776275239	698090754	/nfs/dbraw/zinc/09/07/54/698090754.db2.gz	GAHJCOXVCAIFJQ-HNNXBMFYSA-N	1	1	304.350	1.977	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000750094034	700203379	/nfs/dbraw/zinc/20/33/79/700203379.db2.gz	MMXWKXNHSIZDKF-NWDGAFQWSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000750094034	700203382	/nfs/dbraw/zinc/20/33/82/700203382.db2.gz	MMXWKXNHSIZDKF-NWDGAFQWSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000246383717	698348417	/nfs/dbraw/zinc/34/84/17/698348417.db2.gz	OVAIUKVHOSXOKK-SWLSCSKDSA-N	1	1	305.382	1.698	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cc(C(N)=O)co1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788762470	699338171	/nfs/dbraw/zinc/33/81/71/699338171.db2.gz	HCRNRIOETZDGSD-MRVPVSSYSA-N	1	1	304.306	1.720	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1CC[N@H+](CCF)C1	ZINC000802242310	700388442	/nfs/dbraw/zinc/38/84/42/700388442.db2.gz	ZMTKUITVRYCHMH-LLVKDONJSA-N	1	1	314.317	1.077	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1CC[N@@H+](CCF)C1	ZINC000802242310	700388446	/nfs/dbraw/zinc/38/84/46/700388446.db2.gz	ZMTKUITVRYCHMH-LLVKDONJSA-N	1	1	314.317	1.077	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)[C@H](C)C1	ZINC000761077097	700840214	/nfs/dbraw/zinc/84/02/14/700840214.db2.gz	MWUKMYPUXFOCSA-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](CC(N)=O)C2)c2cc([N+](=O)[O-])ccc12	ZINC000808229340	701509618	/nfs/dbraw/zinc/50/96/18/701509618.db2.gz	QGKRQZFIDXWJKF-NSHDSACASA-N	1	1	317.349	1.408	20	5		DDBDMO
CC(C)C(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000808707326	701532491	/nfs/dbraw/zinc/53/24/91/701532491.db2.gz	LROSVOUACIUWMK-UHFFFAOYSA-N	1	1	306.366	1.727	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879362572	706661434	/nfs/dbraw/zinc/66/14/34/706661434.db2.gz	SAZDUIPTHOHZRM-SMDDNHRTSA-N	1	1	310.350	1.169	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879362572	706661435	/nfs/dbraw/zinc/66/14/35/706661435.db2.gz	SAZDUIPTHOHZRM-SMDDNHRTSA-N	1	1	310.350	1.169	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1	ZINC000817369796	702356890	/nfs/dbraw/zinc/35/68/90/702356890.db2.gz	CKVRLOHFHLVLCW-LLVKDONJSA-N	1	1	317.349	1.278	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@]2(CC[N@@H+](C)C2)C1	ZINC000813635678	702388509	/nfs/dbraw/zinc/38/85/09/702388509.db2.gz	BOYYUGPEEXVCTC-INIZCTEOSA-N	1	1	318.377	1.486	20	5		DDBDMO
[NH3+][C@@H]1CCCC[C@H]1NCCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000818341159	702638479	/nfs/dbraw/zinc/63/84/79/702638479.db2.gz	VXNNBZJTLJWPRF-CHWSQXEVSA-N	1	1	324.356	1.922	20	5		DDBDMO
N[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000818341159	702638482	/nfs/dbraw/zinc/63/84/82/702638482.db2.gz	VXNNBZJTLJWPRF-CHWSQXEVSA-N	1	1	324.356	1.922	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000879571284	706721978	/nfs/dbraw/zinc/72/19/78/706721978.db2.gz	OSLBIFPAFTZLEK-KGLIPLIRSA-N	1	1	305.378	2.000	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOC(F)F)CC2)cc1	ZINC000851713812	703835092	/nfs/dbraw/zinc/83/50/92/703835092.db2.gz	AVOMGRVZZTWOOI-UHFFFAOYSA-N	1	1	301.293	1.956	20	5		DDBDMO
C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])(c2ccccc2)CC1	ZINC000870187754	703946602	/nfs/dbraw/zinc/94/66/02/703946602.db2.gz	YVINXBZXWSCJSB-HUUCEWRRSA-N	1	1	317.389	1.431	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852436528	704047895	/nfs/dbraw/zinc/04/78/95/704047895.db2.gz	INPYGQXUUOINRZ-ZIAGYGMSSA-N	1	1	321.333	1.155	20	5		DDBDMO
COCC1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000870884684	704157200	/nfs/dbraw/zinc/15/72/00/704157200.db2.gz	FVOJHWIFVZDHIA-INIZCTEOSA-N	1	1	321.377	1.654	20	5		DDBDMO
CCC[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870911418	704165349	/nfs/dbraw/zinc/16/53/49/704165349.db2.gz	WDHOJYJLLRSPSC-ZBFHGGJFSA-N	1	1	321.377	1.796	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870912459	704165805	/nfs/dbraw/zinc/16/58/05/704165805.db2.gz	IAUVTJQTFATHKH-HOCLYGCPSA-N	1	1	321.377	1.652	20	5		DDBDMO
O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+]1CC[C@@H]2C[C@@H]2C1	ZINC000853579791	704274818	/nfs/dbraw/zinc/27/48/18/704274818.db2.gz	ZVPNYMCJAFZBGF-VXGBXAGGSA-N	1	1	316.317	1.711	20	5		DDBDMO
O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+]1CC[C@@H]2C[C@@H]2C1	ZINC000853579791	704274821	/nfs/dbraw/zinc/27/48/21/704274821.db2.gz	ZVPNYMCJAFZBGF-VXGBXAGGSA-N	1	1	316.317	1.711	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@H]4COC[C@@H]4C3)c2c1	ZINC000853585905	704275958	/nfs/dbraw/zinc/27/59/58/704275958.db2.gz	KVEJXANPJLIGQZ-OLZOCXBDSA-N	1	1	302.334	1.870	20	5		DDBDMO
O=C1CC[C@@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)O1	ZINC000821341530	704393595	/nfs/dbraw/zinc/39/35/95/704393595.db2.gz	BAEOEGOYJCBLCE-AWEZNQCLSA-N	1	1	305.334	1.422	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000880424636	706969876	/nfs/dbraw/zinc/96/98/76/706969876.db2.gz	JQTHRXHCUKVXBF-GJZGRUSLSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1	ZINC000822722625	705020076	/nfs/dbraw/zinc/02/00/76/705020076.db2.gz	IJRAEUPLYPRAJK-SNVBAGLBSA-N	1	1	320.305	1.906	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1CCNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000874708253	705141744	/nfs/dbraw/zinc/14/17/44/705141744.db2.gz	KWCWURYCXMNOFC-GFCCVEGCSA-N	1	1	301.387	1.049	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1CCNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000874708253	705141747	/nfs/dbraw/zinc/14/17/47/705141747.db2.gz	KWCWURYCXMNOFC-GFCCVEGCSA-N	1	1	301.387	1.049	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836390	705193620	/nfs/dbraw/zinc/19/36/20/705193620.db2.gz	CCQQCIVJAKQEKN-NWDGAFQWSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874836390	705193622	/nfs/dbraw/zinc/19/36/22/705193622.db2.gz	CCQQCIVJAKQEKN-NWDGAFQWSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836390	705193623	/nfs/dbraw/zinc/19/36/23/705193623.db2.gz	CCQQCIVJAKQEKN-NWDGAFQWSA-N	1	1	321.381	1.579	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000823987718	705350206	/nfs/dbraw/zinc/35/02/06/705350206.db2.gz	QREMFNOKEWKNCH-GXSJLCMTSA-N	1	1	307.354	1.781	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000861338950	705432957	/nfs/dbraw/zinc/43/29/57/705432957.db2.gz	KMKMRHBCANVRCQ-DZGCQCFKSA-N	1	1	308.334	1.861	20	5		DDBDMO
CCN(C(=O)Cn1c(C)ncc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000825017874	705578532	/nfs/dbraw/zinc/57/85/32/705578532.db2.gz	BXURNXPBOMFLOK-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000825516809	705685206	/nfs/dbraw/zinc/68/52/06/705685206.db2.gz	BZNKDTUXRGIELF-SNVBAGLBSA-N	1	1	324.356	1.624	20	5		DDBDMO
CN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000825844529	705736308	/nfs/dbraw/zinc/73/63/08/705736308.db2.gz	MCYCXIWNSHGNLL-GJZGRUSLSA-N	1	1	319.361	1.323	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827244437	705958876	/nfs/dbraw/zinc/95/88/76/705958876.db2.gz	AKXCSFVTEVAQMZ-YUELXQCFSA-N	1	1	319.361	1.181	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321185	705974774	/nfs/dbraw/zinc/97/47/74/705974774.db2.gz	USKDPSJOXSECDK-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321185	705974775	/nfs/dbraw/zinc/97/47/75/705974775.db2.gz	USKDPSJOXSECDK-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321185	705974776	/nfs/dbraw/zinc/97/47/76/705974776.db2.gz	USKDPSJOXSECDK-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
C[C@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)N1CC[NH2+]CC1=O	ZINC000863670452	705982262	/nfs/dbraw/zinc/98/22/62/705982262.db2.gz	MQMJOPHIFMNFOT-SSDOTTSWSA-N	1	1	323.334	1.199	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000827626286	706039585	/nfs/dbraw/zinc/03/95/85/706039585.db2.gz	VHAHOYQPYMMQOU-RRFJBIMHSA-N	1	1	303.362	1.909	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510071	706527776	/nfs/dbraw/zinc/52/77/76/706527776.db2.gz	QSOZCALVQHWYFH-KBPBESRZSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510071	706527778	/nfs/dbraw/zinc/52/77/78/706527778.db2.gz	QSOZCALVQHWYFH-KBPBESRZSA-N	1	1	323.349	1.401	20	5		DDBDMO
C[C@H](NC[C@H]1CCC[N@@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851558	707139010	/nfs/dbraw/zinc/13/90/10/707139010.db2.gz	ZNSKQJCHWGVXDI-GXTWGEPZSA-N	1	1	322.409	1.674	20	5		DDBDMO
C[C@H](NC[C@H]1CCC[N@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851558	707139014	/nfs/dbraw/zinc/13/90/14/707139014.db2.gz	ZNSKQJCHWGVXDI-GXTWGEPZSA-N	1	1	322.409	1.674	20	5		DDBDMO
CC[NH+]1CCN(CCNc2cccc([N+](=O)[O-])c2C(C)=O)CC1	ZINC000881797345	707369320	/nfs/dbraw/zinc/36/93/20/707369320.db2.gz	UXFLZLXOFFRSIZ-UHFFFAOYSA-N	1	1	320.393	1.847	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000836944577	707552187	/nfs/dbraw/zinc/55/21/87/707552187.db2.gz	BAIFWSWFUAMCEW-DZGCQCFKSA-N	1	1	321.377	1.571	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)CC[C@H]1CCCC[N@@H+]1C	ZINC000873396537	707836336	/nfs/dbraw/zinc/83/63/36/707836336.db2.gz	RJQCBSJONUWVPF-CYBMUJFWSA-N	1	1	324.381	1.907	20	5		DDBDMO
Cc1nc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221122	708258699	/nfs/dbraw/zinc/25/86/99/708258699.db2.gz	HLOXKMMTJRIJSF-ZIAGYGMSSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1ccc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897222601	708260140	/nfs/dbraw/zinc/26/01/40/708260140.db2.gz	WCXCMIPNHGEWCN-UONOGXRCSA-N	1	1	305.378	1.939	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000892144409	710379896	/nfs/dbraw/zinc/37/98/96/710379896.db2.gz	OAHJCJKAVALSSE-CMPLNLGQSA-N	1	1	308.338	1.274	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C[C@H]1C(C)(C)C	ZINC000912034026	711136675	/nfs/dbraw/zinc/13/66/75/711136675.db2.gz	RAHVAADGSPBHHV-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C[C@H]1C(C)(C)C	ZINC000912034026	711136678	/nfs/dbraw/zinc/13/66/78/711136678.db2.gz	RAHVAADGSPBHHV-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1nccc2c1cccc2[N+](=O)[O-]	ZINC000894590555	711197994	/nfs/dbraw/zinc/19/79/94/711197994.db2.gz	HQWFUTWLALBSPK-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1CO	ZINC000894884475	711307759	/nfs/dbraw/zinc/30/77/59/711307759.db2.gz	FXIXXUJDFWOVKV-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[C@H]1CO	ZINC000894884475	711307764	/nfs/dbraw/zinc/30/77/64/711307764.db2.gz	FXIXXUJDFWOVKV-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
CON(C)C(=O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000895041176	711381309	/nfs/dbraw/zinc/38/13/09/711381309.db2.gz	KBNJHSHHTKLYTF-UHFFFAOYSA-N	1	1	319.317	1.964	20	5		DDBDMO
C[C@@H]1[C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C	ZINC000895737878	711591410	/nfs/dbraw/zinc/59/14/10/711591410.db2.gz	GDCHUZWKTVPIMR-MWLCHTKSSA-N	1	1	304.350	1.984	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O	ZINC000895772279	711602395	/nfs/dbraw/zinc/60/23/95/711602395.db2.gz	ZYXTUVJTQIPHRH-NSHDSACASA-N	1	1	306.322	1.667	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](C3OCCO3)C2)c1[N+](=O)[O-]	ZINC000896379805	711714908	/nfs/dbraw/zinc/71/49/08/711714908.db2.gz	FCGZMSXTGNDFEU-NSHDSACASA-N	1	1	324.333	1.504	20	5		DDBDMO
Cc1cnc(NC[C@H]2CC[N@H+]2C2CCOCC2)c([N+](=O)[O-])c1	ZINC000896524597	711738138	/nfs/dbraw/zinc/73/81/38/711738138.db2.gz	XIJIHDNOJCLHGN-CYBMUJFWSA-N	1	1	306.366	1.963	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2CC[N@H+]2C2CCOCC2)c(F)c1	ZINC000896525750	711738657	/nfs/dbraw/zinc/73/86/57/711738657.db2.gz	OITVKBQLKOXQKD-LLVKDONJSA-N	1	1	310.329	1.794	20	5		DDBDMO
C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCN1C	ZINC000896572427	711756032	/nfs/dbraw/zinc/75/60/32/711756032.db2.gz	VBLUSBVZIRDZTC-ONGXEEELSA-N	1	1	312.395	1.020	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O	ZINC000917227397	713488116	/nfs/dbraw/zinc/48/81/16/713488116.db2.gz	CCCCUZGFMDLPNW-SECBINFHSA-N	1	1	316.155	1.613	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O	ZINC000917227397	713488114	/nfs/dbraw/zinc/48/81/14/713488114.db2.gz	CCCCUZGFMDLPNW-SECBINFHSA-N	1	1	316.155	1.613	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@H](C4OCCO4)C3)c2c1	ZINC000905696116	712121656	/nfs/dbraw/zinc/12/16/56/712121656.db2.gz	UKGSJNMPSQNUSK-GFCCVEGCSA-N	1	1	318.333	1.597	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929228690	713571530	/nfs/dbraw/zinc/57/15/30/713571530.db2.gz	RBOJWTAZQKGVQU-GJZGRUSLSA-N	1	1	303.362	1.862	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000931722453	714168937	/nfs/dbraw/zinc/16/89/37/714168937.db2.gz	HJSXHFHSWBHNKI-UONOGXRCSA-N	1	1	318.377	1.362	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000932644236	714373403	/nfs/dbraw/zinc/37/34/03/714373403.db2.gz	HKPUXNHGSIEVEU-OCCSQVGLSA-N	1	1	308.334	1.513	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)cs1	ZINC000934258098	714777775	/nfs/dbraw/zinc/77/77/75/714777775.db2.gz	PWLFCIIGQNUBOP-QWHCGFSZSA-N	1	1	311.407	1.687	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000925419989	714850453	/nfs/dbraw/zinc/85/04/53/714850453.db2.gz	RZXWSFVEHBZHNA-GFCCVEGCSA-N	1	1	304.350	1.367	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](C[C@@H]3CCCO3)CC2)n1	ZINC000611615648	721911405	/nfs/dbraw/zinc/91/14/05/721911405.db2.gz	SKSNYYPQYRUWGW-AWEZNQCLSA-N	1	1	320.393	1.908	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc4ncc([N+](=O)[O-])n4n3)[C@H]2C1	ZINC001120921984	782237059	/nfs/dbraw/zinc/23/70/59/782237059.db2.gz	FZYWWZUJUTUFHW-GARJFASQSA-N	1	1	302.338	1.390	20	5		DDBDMO
O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1N1CCc2[nH+]ccn2CC1	ZINC001167182633	732810370	/nfs/dbraw/zinc/81/03/70/732810370.db2.gz	RGBNHNCCOHDPEJ-UHFFFAOYSA-N	1	1	309.713	1.141	20	5		DDBDMO
Cc1ccc(F)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001022063850	734368275	/nfs/dbraw/zinc/36/82/75/734368275.db2.gz	MRAZGYARSWHZDS-QVHKTLOISA-N	1	1	321.352	1.536	20	5		DDBDMO
O=C(NCC[NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936272	742830420	/nfs/dbraw/zinc/83/04/20/742830420.db2.gz	DPSJFNUAJBLIPY-GHMZBOCLSA-N	1	1	305.325	1.183	20	5		DDBDMO
O=C(NC1CC[NH+](CCc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002787141	743428797	/nfs/dbraw/zinc/42/87/97/743428797.db2.gz	GGPKDXFRKQHQGA-ZIAGYGMSSA-N	1	1	323.418	1.536	20	5		DDBDMO
Cc1ccccc1C[NH+]1CC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001031662248	747336043	/nfs/dbraw/zinc/33/60/43/747336043.db2.gz	YVZWXMBFTAXLAI-HUUCEWRRSA-N	1	1	303.362	1.208	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001095625608	750092934	/nfs/dbraw/zinc/09/29/34/750092934.db2.gz	YFXWECBTFSRJMZ-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
CCOC(=O)[C@H](CCSC)[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001168978821	762148803	/nfs/dbraw/zinc/14/88/03/762148803.db2.gz	UMZLJSCRDHAOSL-UTUOFQBUSA-N	1	1	304.412	1.706	20	5		DDBDMO
COC(=O)CC[N@H+](CCCN(C)C)[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169030383	762186433	/nfs/dbraw/zinc/18/64/33/762186433.db2.gz	ZDLKVPIZLJANCO-KBPBESRZSA-N	1	1	315.414	1.249	20	5		DDBDMO
COC(=O)CC[N@@H+](CCCN(C)C)[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169030383	762186434	/nfs/dbraw/zinc/18/64/34/762186434.db2.gz	ZDLKVPIZLJANCO-KBPBESRZSA-N	1	1	315.414	1.249	20	5		DDBDMO
CCn1cc2c(n1)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@@H]2COC	ZINC001169019272	762198957	/nfs/dbraw/zinc/19/89/57/762198957.db2.gz	HCZSONFZAQHBIR-BFHYXJOUSA-N	1	1	322.409	1.894	20	5		DDBDMO
CCn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@@H]2COC	ZINC001169019272	762198963	/nfs/dbraw/zinc/19/89/63/762198963.db2.gz	HCZSONFZAQHBIR-BFHYXJOUSA-N	1	1	322.409	1.894	20	5		DDBDMO
CCN1CC[C@]2(CCC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)C1=O	ZINC001169019202	762199324	/nfs/dbraw/zinc/19/93/24/762199324.db2.gz	FNZDXYVVUCRQKA-LZWOXQAQSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCOCc1nnn2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CCC2	ZINC001169024845	762202169	/nfs/dbraw/zinc/20/21/69/762202169.db2.gz	RNRAIWWWUDDCGA-CHWSQXEVSA-N	1	1	323.397	1.466	20	5		DDBDMO
CCn1ncc2c1[C@H](COC)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169025068	762202460	/nfs/dbraw/zinc/20/24/60/762202460.db2.gz	XNEIHPOAOMUOIM-AEGPPILISA-N	1	1	322.409	1.894	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](F)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170327845	766254149	/nfs/dbraw/zinc/25/41/49/766254149.db2.gz	IIKWAZPQSJXIMY-PSOPSSQASA-N	1	1	312.341	1.939	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1(C2CC2)CCC1	ZINC001131913964	768477440	/nfs/dbraw/zinc/47/74/40/768477440.db2.gz	ZYPUFOYTHOXBKA-UHFFFAOYSA-N	1	1	321.381	1.114	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCNc2ncccc2[N+](=O)[O-])C1	ZINC001094140315	775475608	/nfs/dbraw/zinc/47/56/08/775475608.db2.gz	GXDFQPANHZOPMH-UHFFFAOYSA-N	1	1	321.381	1.250	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094456419	775896156	/nfs/dbraw/zinc/89/61/56/775896156.db2.gz	GAKSXOHSDRZKAD-UHFFFAOYSA-N	1	1	309.370	1.248	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCO[C@H](CO)C1)CC2	ZINC001172907079	776918298	/nfs/dbraw/zinc/91/82/98/776918298.db2.gz	CRIBLMPUUYPQDC-HOCLYGCPSA-N	1	1	306.362	1.535	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101657905	777354870	/nfs/dbraw/zinc/35/48/70/777354870.db2.gz	XSOPMBGYCPFMSB-UHFFFAOYSA-N	1	1	309.370	1.200	20	5		DDBDMO
C[NH+]1CCN(c2cc(Nc3ccc([N+](=O)[O-])cc3)ncn2)CC1	ZINC001174476001	777496840	/nfs/dbraw/zinc/49/68/40/777496840.db2.gz	WVNGEWFMXOOYIF-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
C[NH+]1CCN(c2ncc(Nc3ccc([N+](=O)[O-])cc3)cn2)CC1	ZINC001174476018	777497648	/nfs/dbraw/zinc/49/76/48/777497648.db2.gz	XNNOMZRZBZWOJM-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC001116442117	780510230	/nfs/dbraw/zinc/51/02/30/780510230.db2.gz	IHJOAANFQBJTMH-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC001116442117	780510234	/nfs/dbraw/zinc/51/02/34/780510234.db2.gz	IHJOAANFQBJTMH-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccnc1C	ZINC001267314049	837809059	/nfs/dbraw/zinc/80/90/59/837809059.db2.gz	GWTCUSAXYJYGDB-HUUCEWRRSA-N	1	1	320.393	1.383	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1C	ZINC001267314049	837809073	/nfs/dbraw/zinc/80/90/73/837809073.db2.gz	GWTCUSAXYJYGDB-HUUCEWRRSA-N	1	1	320.393	1.383	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1C	ZINC001267314049	837809087	/nfs/dbraw/zinc/80/90/87/837809087.db2.gz	GWTCUSAXYJYGDB-HUUCEWRRSA-N	1	1	320.393	1.383	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cc1ccco1)Cc1ccc([N+](=O)[O-])cc1	ZINC001266340216	836141769	/nfs/dbraw/zinc/14/17/69/836141769.db2.gz	ONFSQQIMIWQPMH-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NC1CN(Cc2ccccc2[N+](=O)[O-])C1	ZINC001268466989	840246134	/nfs/dbraw/zinc/24/61/34/840246134.db2.gz	POAXELBZCGNPNV-UHFFFAOYSA-N	1	1	320.393	1.237	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3cc(OC)c([N+](=O)[O-])cn3)C[C@H]2C1	ZINC001157691385	864053572	/nfs/dbraw/zinc/05/35/72/864053572.db2.gz	PGXJEHMEKQSLBI-TXEJJXNPSA-N	1	1	306.366	1.776	20	5		DDBDMO
C[N@@H+](C1CN(c2ncc(Cl)cc2[N+](=O)[O-])C1)[C@H]1CCOC1	ZINC001158725340	864857861	/nfs/dbraw/zinc/85/78/61/864857861.db2.gz	HEKYPVHCSAVGHH-JTQLQIEISA-N	1	1	312.757	1.553	20	5		DDBDMO
Nc1nc(N[C@H]2CCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160724462	866070238	/nfs/dbraw/zinc/07/02/38/866070238.db2.gz	LBZZQSCCFPMECE-WDEREUQCSA-N	1	1	307.354	1.237	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1NCC[C@H]1CC[NH2+]CC1(F)F	ZINC001162812733	867847365	/nfs/dbraw/zinc/84/73/65/867847365.db2.gz	NXIXDFKIFICMCK-SNVBAGLBSA-N	1	1	316.308	1.583	20	5		DDBDMO
Cc1nc(N[C@@H](C[NH+]2CCOCC2)C(C)(C)C)ncc1[N+](=O)[O-]	ZINC001162879605	867895023	/nfs/dbraw/zinc/89/50/23/867895023.db2.gz	DEYSJQJKSHAHQK-ZDUSSCGKSA-N	1	1	323.397	1.852	20	5		DDBDMO
COc1c(O)ccc(CN2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC001336813279	869160518	/nfs/dbraw/zinc/16/05/18/869160518.db2.gz	PMLCHDQIIZKRHG-PWSUYJOCSA-N	1	1	307.350	1.445	20	5		DDBDMO
CN(C)/C=C\c1cc(N2CC[N@H+]3CC[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC001165198352	869422414	/nfs/dbraw/zinc/42/24/14/869422414.db2.gz	JMNFRUIWKJPLIC-HSBHDXMMSA-N	1	1	303.366	1.416	20	5		DDBDMO
COC(=O)C1([NH3+])CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC001166794320	870253101	/nfs/dbraw/zinc/25/31/01/870253101.db2.gz	ATEQQHLJHUUUHW-UHFFFAOYSA-N	1	1	314.729	1.114	20	5		DDBDMO
C[N+](C)(C)C[C@H](O)CC(=O)Oc1cc(N)nc2ccccc21	ZINC001226418405	882417301	/nfs/dbraw/zinc/41/73/01/882417301.db2.gz	NLMIMOXAOQRVEG-LLVKDONJSA-N	1	1	304.370	1.180	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC001303470461	871125166	/nfs/dbraw/zinc/12/51/66/871125166.db2.gz	WRZCZQLHFGFYOC-UHFFFAOYSA-N	1	1	303.322	1.366	20	5		DDBDMO
COC(=O)/C(C)=C/C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001307999814	871462652	/nfs/dbraw/zinc/46/26/52/871462652.db2.gz	OTXNXEJAUUIDTA-USYSOWRXSA-N	1	1	308.334	1.511	20	5		DDBDMO
CCO[C@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC001341939572	871905160	/nfs/dbraw/zinc/90/51/60/871905160.db2.gz	PRTUVKJSCVSLRY-DZGCQCFKSA-N	1	1	307.350	1.406	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC001226748121	882627101	/nfs/dbraw/zinc/62/71/01/882627101.db2.gz	HCUNXUODOCOZDG-SNVBAGLBSA-N	1	1	302.277	1.973	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC001226748121	882627106	/nfs/dbraw/zinc/62/71/06/882627106.db2.gz	HCUNXUODOCOZDG-SNVBAGLBSA-N	1	1	302.277	1.973	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1COC1C[NH+](C(C)C)C1	ZINC001223449730	880966925	/nfs/dbraw/zinc/96/69/25/880966925.db2.gz	FDOMBYQYXCCCDN-UHFFFAOYSA-N	1	1	308.334	1.991	20	5		DDBDMO
Cc1cnc(CO[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c(C)c1[N+](=O)[O-]	ZINC001224183129	881261596	/nfs/dbraw/zinc/26/15/96/881261596.db2.gz	MVNFMMXZEMQOPB-NILFDRSVSA-N	1	1	319.361	1.927	20	5		DDBDMO
COCC[NH+]1CCC(Oc2nc(C)cc(O)c2[N+](=O)[O-])CC1	ZINC001231262280	885447288	/nfs/dbraw/zinc/44/72/88/885447288.db2.gz	DYFVRBHJUJGATK-UHFFFAOYSA-N	1	1	311.338	1.493	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccon1)Cc1ccc([N+](=O)[O-])cc1	ZINC001234513268	888039904	/nfs/dbraw/zinc/03/99/04/888039904.db2.gz	VQPLZMKACUGYAG-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254476983	896455706	/nfs/dbraw/zinc/45/57/06/896455706.db2.gz	YIVSRQLUHKFOPL-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](N2CCOCC2)C1	ZINC001254562876	896502711	/nfs/dbraw/zinc/50/27/11/896502711.db2.gz	QKPRWMRYZQAKBV-ZBFHGGJFSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1CO	ZINC000305429844	231007640	/nfs/dbraw/zinc/00/76/40/231007640.db2.gz	DLDTWSBNFQCPSW-HZMBPMFUSA-N	1	1	307.350	1.287	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000451997258	231262801	/nfs/dbraw/zinc/26/28/01/231262801.db2.gz	QZZUIUZCNYGOID-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000444260991	529464979	/nfs/dbraw/zinc/46/49/79/529464979.db2.gz	PYIDFOUHGSIRQS-GHMZBOCLSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000444260991	529464982	/nfs/dbraw/zinc/46/49/82/529464982.db2.gz	PYIDFOUHGSIRQS-GHMZBOCLSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000444260991	529464983	/nfs/dbraw/zinc/46/49/83/529464983.db2.gz	PYIDFOUHGSIRQS-GHMZBOCLSA-N	1	1	323.397	1.825	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000272834714	210232993	/nfs/dbraw/zinc/23/29/93/210232993.db2.gz	FTQBASZHJLIMSP-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
CC1(C)CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000614895392	362066696	/nfs/dbraw/zinc/06/66/96/362066696.db2.gz	RNTCTVBFNUSRCU-UHFFFAOYSA-N	1	1	321.377	1.052	20	5		DDBDMO
CC1(C)CN(C(=O)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000614895392	362066701	/nfs/dbraw/zinc/06/67/01/362066701.db2.gz	RNTCTVBFNUSRCU-UHFFFAOYSA-N	1	1	321.377	1.052	20	5		DDBDMO
CC1(C)CN(CCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000614920866	362078319	/nfs/dbraw/zinc/07/83/19/362078319.db2.gz	VTUMPFRGXOTHEW-UHFFFAOYSA-N	1	1	307.394	1.526	20	5		DDBDMO
CC1(C)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000614920866	362078323	/nfs/dbraw/zinc/07/83/23/362078323.db2.gz	VTUMPFRGXOTHEW-UHFFFAOYSA-N	1	1	307.394	1.526	20	5		DDBDMO
CC1(C)C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000614920866	362078327	/nfs/dbraw/zinc/07/83/27/362078327.db2.gz	VTUMPFRGXOTHEW-UHFFFAOYSA-N	1	1	307.394	1.526	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090551564	185302865	/nfs/dbraw/zinc/30/28/65/185302865.db2.gz	OZQOCNDWGACBQT-AWEZNQCLSA-N	1	1	322.409	1.420	20	5		DDBDMO
CC1(C)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1O	ZINC000615141178	362170658	/nfs/dbraw/zinc/17/06/58/362170658.db2.gz	HDBZAKZEMKNWJR-HNNXBMFYSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1O	ZINC000615141178	362170659	/nfs/dbraw/zinc/17/06/59/362170659.db2.gz	HDBZAKZEMKNWJR-HNNXBMFYSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC1(C)COCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181576015	199321151	/nfs/dbraw/zinc/32/11/51/199321151.db2.gz	WXVBHIBUESYASM-LBPRGKRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)COCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181576015	199321154	/nfs/dbraw/zinc/32/11/54/199321154.db2.gz	WXVBHIBUESYASM-LBPRGKRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649276	210056300	/nfs/dbraw/zinc/05/63/00/210056300.db2.gz	ZAFAHVRAPVPCEE-WCQYABFASA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649276	210056303	/nfs/dbraw/zinc/05/63/03/210056303.db2.gz	ZAFAHVRAPVPCEE-WCQYABFASA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000272635811	210037236	/nfs/dbraw/zinc/03/72/36/210037236.db2.gz	NRQJBUXITCRVNH-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000358474125	299164987	/nfs/dbraw/zinc/16/49/87/299164987.db2.gz	UCULEDQHGCUWLU-AWEZNQCLSA-N	1	1	308.338	1.091	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000046047166	352433871	/nfs/dbraw/zinc/43/38/71/352433871.db2.gz	GTNPKBHWUWADIY-CYBMUJFWSA-N	1	1	322.365	1.250	20	5		DDBDMO
COCCC[N@@H+](CCOC)CCOc1ccccc1[N+](=O)[O-]	ZINC000054366092	352689844	/nfs/dbraw/zinc/68/98/44/352689844.db2.gz	UAYYVBIYJLWMSM-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000054223585	352683906	/nfs/dbraw/zinc/68/39/06/352683906.db2.gz	FWUDURIKAHIOQP-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)CC[C@@H](C)O)cccc1[N+](=O)[O-]	ZINC000072713227	353210489	/nfs/dbraw/zinc/21/04/89/353210489.db2.gz	RUYSNIBRBBOFEC-LLVKDONJSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000074772862	353330122	/nfs/dbraw/zinc/33/01/22/353330122.db2.gz	VNTPGYBODZQPHI-LLVKDONJSA-N	1	1	306.370	1.135	20	5		DDBDMO
C[C@H]1CSCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246932432	354362713	/nfs/dbraw/zinc/36/27/13/354362713.db2.gz	DRLUAKVRTAVZJX-WCQYABFASA-N	1	1	312.391	1.772	20	5		DDBDMO
CC1(C)COCC[N@@H+]1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587862187	354886451	/nfs/dbraw/zinc/88/64/51/354886451.db2.gz	PSWALJQYANPXGP-UHFFFAOYSA-N	1	1	324.381	1.192	20	5		DDBDMO
CC1(C)COCC[N@H+]1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587862187	354886455	/nfs/dbraw/zinc/88/64/55/354886455.db2.gz	PSWALJQYANPXGP-UHFFFAOYSA-N	1	1	324.381	1.192	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@@H]21	ZINC000588001108	354891785	/nfs/dbraw/zinc/89/17/85/354891785.db2.gz	ONQNTEZXBNMFNE-NHYWBVRUSA-N	1	1	320.393	1.590	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]([N@H+]3CC[C@@H](O)C3)C2)cc([N+](=O)[O-])c1	ZINC000588860631	354943568	/nfs/dbraw/zinc/94/35/68/354943568.db2.gz	KIAFLSQLMLJQHT-UKRRQHHQSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[C@@H]([N@H+]3CC[C@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000588864063	354944081	/nfs/dbraw/zinc/94/40/81/354944081.db2.gz	ZWTFBWLLUHNZFK-KGLIPLIRSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@](C)(O)C2)c1	ZINC000589501921	354997154	/nfs/dbraw/zinc/99/71/54/354997154.db2.gz	KHDXDJYYSHILJV-HNNXBMFYSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@](C)(O)C2)c1	ZINC000589501921	354997156	/nfs/dbraw/zinc/99/71/56/354997156.db2.gz	KHDXDJYYSHILJV-HNNXBMFYSA-N	1	1	308.334	1.728	20	5		DDBDMO
Cn1c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)ccc1[N+](=O)[O-]	ZINC000495123617	235128941	/nfs/dbraw/zinc/12/89/41/235128941.db2.gz	VELDELJYKJMJJZ-RYUDHWBXSA-N	1	1	306.366	1.490	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1	ZINC000590446621	355099570	/nfs/dbraw/zinc/09/95/70/355099570.db2.gz	TYJAIVXHGVBAHF-IINYFYTJSA-N	1	1	314.345	1.852	20	5		DDBDMO
COc1cccc2c1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000590759984	355169678	/nfs/dbraw/zinc/16/96/78/355169678.db2.gz	ZSWWJNOPPXZABF-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000590765853	355172625	/nfs/dbraw/zinc/17/26/25/355172625.db2.gz	ZMZRSMBLDAYZQJ-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@H]1CN(CCO)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000590765853	355172629	/nfs/dbraw/zinc/17/26/29/355172629.db2.gz	ZMZRSMBLDAYZQJ-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@H]1CN(CCO)CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000590765853	355172630	/nfs/dbraw/zinc/17/26/30/355172630.db2.gz	ZMZRSMBLDAYZQJ-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000591047956	355238832	/nfs/dbraw/zinc/23/88/32/355238832.db2.gz	WUVPOXOHWKSFFO-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000592209139	355539499	/nfs/dbraw/zinc/53/94/99/355539499.db2.gz	VKGULDRGKUIRCK-BZPMIXESSA-N	1	1	322.361	1.820	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000593671099	355962318	/nfs/dbraw/zinc/96/23/18/355962318.db2.gz	FGQKICAUBINAGB-UHFFFAOYSA-N	1	1	307.325	1.655	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594596965	356259880	/nfs/dbraw/zinc/25/98/80/356259880.db2.gz	BPNWVDFWHOWSND-VXGBXAGGSA-N	1	1	319.365	1.518	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)ccc1[N+](=O)[O-]	ZINC000595607972	356574246	/nfs/dbraw/zinc/57/42/46/356574246.db2.gz	MDYPAKFZKWAYHZ-ZDUSSCGKSA-N	1	1	317.349	1.717	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000595754985	356637068	/nfs/dbraw/zinc/63/70/68/356637068.db2.gz	DOMQTFNESKNIKO-NOLJZWGESA-N	1	1	322.361	1.303	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@]2(O)C[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595759483	356640559	/nfs/dbraw/zinc/64/05/59/356640559.db2.gz	UWHBAWNQSHFMAM-XHDPSFHLSA-N	1	1	305.334	1.380	20	5		DDBDMO
[NH3+]CC12CC(C1)CN2C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000595942070	356715933	/nfs/dbraw/zinc/71/59/33/356715933.db2.gz	GDANNNKXKHMDHL-UHFFFAOYSA-N	1	1	301.306	1.034	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596110999	356776199	/nfs/dbraw/zinc/77/61/99/356776199.db2.gz	UBVUAQOWVRWUOR-GFCCVEGCSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)[C@@H](C)CO1	ZINC000596431584	356878009	/nfs/dbraw/zinc/87/80/09/356878009.db2.gz	PIFUYEXUJBQXSO-WDEREUQCSA-N	1	1	319.365	1.414	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)[C@@H](C)CO1	ZINC000596431584	356878010	/nfs/dbraw/zinc/87/80/10/356878010.db2.gz	PIFUYEXUJBQXSO-WDEREUQCSA-N	1	1	319.365	1.414	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596538595	356911134	/nfs/dbraw/zinc/91/11/34/356911134.db2.gz	MODNBXYIAWYKKV-CQSZACIVSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000597604467	357250859	/nfs/dbraw/zinc/25/08/59/357250859.db2.gz	IMSIQHUDIYFBQC-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000597858481	357361565	/nfs/dbraw/zinc/36/15/65/357361565.db2.gz	LZKQSOBDPCJBGC-LBPRGKRZSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597923124	357383652	/nfs/dbraw/zinc/38/36/52/357383652.db2.gz	LSLLQYBUENYKMR-VIFPVBQESA-N	1	1	309.370	1.483	20	5		DDBDMO
CCN(C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000597944539	357394266	/nfs/dbraw/zinc/39/42/66/357394266.db2.gz	DVPSDXDCQYHLAB-ZDUSSCGKSA-N	1	1	321.377	1.699	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000598589082	357643422	/nfs/dbraw/zinc/64/34/22/357643422.db2.gz	CVUFVKBDWALIFM-VXGBXAGGSA-N	1	1	320.349	1.815	20	5		DDBDMO
COC(=O)c1ccnc(N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000598599038	357648534	/nfs/dbraw/zinc/64/85/34/357648534.db2.gz	XGYCLEANRXFIBH-LLVKDONJSA-N	1	1	322.365	1.554	20	5		DDBDMO
CN(C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347890593	283291585	/nfs/dbraw/zinc/29/15/85/283291585.db2.gz	KDWBUUSUFWJTHN-GFCCVEGCSA-N	1	1	321.381	1.222	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000599569534	357978595	/nfs/dbraw/zinc/97/85/95/357978595.db2.gz	NRFYFIRRAQNNLE-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000599569534	357978596	/nfs/dbraw/zinc/97/85/96/357978596.db2.gz	NRFYFIRRAQNNLE-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC[C@]1(C)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000599693363	358027664	/nfs/dbraw/zinc/02/76/64/358027664.db2.gz	ORMBXVFZDGIUNL-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@]1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000599693363	358027669	/nfs/dbraw/zinc/02/76/69/358027669.db2.gz	ORMBXVFZDGIUNL-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600313102	358193368	/nfs/dbraw/zinc/19/33/68/358193368.db2.gz	HSYQTXBGBBZRPR-LLVKDONJSA-N	1	1	323.397	1.732	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000600316294	358194895	/nfs/dbraw/zinc/19/48/95/358194895.db2.gz	ZDPDXERXOUDAHD-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=C1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CN1C1CC1	ZINC000601126409	358413368	/nfs/dbraw/zinc/41/33/68/358413368.db2.gz	XYSRQNAMVLKMEA-SNVBAGLBSA-N	1	1	312.329	1.740	20	5		DDBDMO
O=C(CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)NCC1CC1	ZINC000601140040	358417925	/nfs/dbraw/zinc/41/79/25/358417925.db2.gz	PXKBDHVIPAEMQG-UHFFFAOYSA-N	1	1	300.318	1.503	20	5		DDBDMO
COC[C@@](C)(O)CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601171021	358431692	/nfs/dbraw/zinc/43/16/92/358431692.db2.gz	ZDTJIOAORJFRMZ-HNNXBMFYSA-N	1	1	305.334	1.764	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC000601411374	358540971	/nfs/dbraw/zinc/54/09/71/358540971.db2.gz	VCESVRYBTFBGKV-DZGCQCFKSA-N	1	1	318.377	1.605	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000602140997	358841115	/nfs/dbraw/zinc/84/11/15/358841115.db2.gz	KCTBZYBDXMLQTK-LBPRGKRZSA-N	1	1	321.381	1.297	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@@H](C2CCC2)C1	ZINC000602843253	359231161	/nfs/dbraw/zinc/23/11/61/359231161.db2.gz	ZLUOECNMCCAGHE-AWEZNQCLSA-N	1	1	308.382	1.848	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O	ZINC000602843196	359231355	/nfs/dbraw/zinc/23/13/55/359231355.db2.gz	WERNWIYYNUDZDW-MJBXVCDLSA-N	1	1	308.382	1.725	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602831817	359223705	/nfs/dbraw/zinc/22/37/05/359223705.db2.gz	IFZYVOBZDNMMJN-CQSZACIVSA-N	1	1	323.397	1.338	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC000602950563	359316458	/nfs/dbraw/zinc/31/64/58/359316458.db2.gz	FUZFZLMGKIXLHL-GHMZBOCLSA-N	1	1	307.354	1.276	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@@H](C)O)C[C@H]1C	ZINC000186977524	200042637	/nfs/dbraw/zinc/04/26/37/200042637.db2.gz	OITRLJNFMXHMCS-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@@H](C)O)C[C@H]1C	ZINC000186977524	200042639	/nfs/dbraw/zinc/04/26/39/200042639.db2.gz	OITRLJNFMXHMCS-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000187982194	200186606	/nfs/dbraw/zinc/18/66/06/200186606.db2.gz	VYNUQHZYQBGADJ-BZNIZROVSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1	ZINC000604199713	359725374	/nfs/dbraw/zinc/72/53/74/359725374.db2.gz	TYNKBAOIXOTXIY-NSHDSACASA-N	1	1	309.391	1.897	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000609268778	360285900	/nfs/dbraw/zinc/28/59/00/360285900.db2.gz	BAGBGZMZWJSUGA-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000609279536	360286802	/nfs/dbraw/zinc/28/68/02/360286802.db2.gz	FIPKBVPJLJVMKN-ZDUSSCGKSA-N	1	1	322.365	1.827	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609450477	360309205	/nfs/dbraw/zinc/30/92/05/360309205.db2.gz	YRSKKCWEWZUTAT-VIFPVBQESA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609450477	360309209	/nfs/dbraw/zinc/30/92/09/360309209.db2.gz	YRSKKCWEWZUTAT-VIFPVBQESA-N	1	1	307.306	1.100	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)[C@@H](C)C1	ZINC000610177831	360388393	/nfs/dbraw/zinc/38/83/93/360388393.db2.gz	HUXVWSPPVVOONH-WCQYABFASA-N	1	1	308.382	1.736	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[N@H+]1C1CC1	ZINC000610654057	360492177	/nfs/dbraw/zinc/49/21/77/360492177.db2.gz	GVVMHBIWPJJXLJ-QWRGUYRKSA-N	1	1	321.381	1.268	20	5		DDBDMO
CC[C@@H](NC(=O)CN1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000610527603	360461834	/nfs/dbraw/zinc/46/18/34/360461834.db2.gz	ASYYVZLMIDWWFR-OAHLLOKOSA-N	1	1	320.393	1.410	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCc2[nH+]ccn2C1	ZINC000281457147	216313042	/nfs/dbraw/zinc/31/30/42/216313042.db2.gz	LJJRYQJYYGHFBW-NSHDSACASA-N	1	1	304.354	1.991	20	5		DDBDMO
COc1cc(C[NH2+][C@@H]2C(=O)NCC[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000193651821	201095299	/nfs/dbraw/zinc/09/52/99/201095299.db2.gz	XMFHCHKRELALFN-OQPBUACISA-N	1	1	311.313	1.357	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000194921140	201312112	/nfs/dbraw/zinc/31/21/12/201312112.db2.gz	LDNBQDJBCQBAJT-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619254978	363946957	/nfs/dbraw/zinc/94/69/57/363946957.db2.gz	ROJGCUDFHWSZFV-UKRRQHHQSA-N	1	1	321.352	1.782	20	5		DDBDMO
O=C(C[N@H+](CCO)C1CCOCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000275458556	212346013	/nfs/dbraw/zinc/34/60/13/212346013.db2.gz	BOKXSKCPNBXDPR-UHFFFAOYSA-N	1	1	323.349	1.007	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](CC)CN1C(C)=O	ZINC000350487486	284205550	/nfs/dbraw/zinc/20/55/50/284205550.db2.gz	ZNBBBRJACONNRB-KBPBESRZSA-N	1	1	323.397	1.513	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](CC)CN1C(C)=O	ZINC000350487486	284205551	/nfs/dbraw/zinc/20/55/51/284205551.db2.gz	ZNBBBRJACONNRB-KBPBESRZSA-N	1	1	323.397	1.513	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000266094911	205093597	/nfs/dbraw/zinc/09/35/97/205093597.db2.gz	QFVSAPDPUYSJQJ-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
C[N@@H+](C[C@H](O)CNCCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC001120468340	781965390	/nfs/dbraw/zinc/96/53/90/781965390.db2.gz	MGBBDEGPRUUCDR-OAHLLOKOSA-N	1	1	308.382	1.051	20	5		DDBDMO
CN(C[C@H](O)C[NH2+]CCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC001120468340	781965399	/nfs/dbraw/zinc/96/53/99/781965399.db2.gz	MGBBDEGPRUUCDR-OAHLLOKOSA-N	1	1	308.382	1.051	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337478268	249519659	/nfs/dbraw/zinc/51/96/59/249519659.db2.gz	UFCUVYKRIREALX-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(CC[N@@H+]1CCn2cnnc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000105879317	194154586	/nfs/dbraw/zinc/15/45/86/194154586.db2.gz	FQAMVBNGRYQPKW-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(CC[N@H+]1CCn2cnnc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000105879317	194154589	/nfs/dbraw/zinc/15/45/89/194154589.db2.gz	FQAMVBNGRYQPKW-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000339139772	250312149	/nfs/dbraw/zinc/31/21/49/250312149.db2.gz	JEECMDPSJQFTTQ-LBPRGKRZSA-N	1	1	307.350	1.704	20	5		DDBDMO
CN(C)[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000109807594	194288375	/nfs/dbraw/zinc/28/83/75/194288375.db2.gz	QEPYVLYDDGQGLU-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(C)[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000109807594	194288377	/nfs/dbraw/zinc/28/83/77/194288377.db2.gz	QEPYVLYDDGQGLU-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C(C)C)CC1	ZINC000340618858	251140624	/nfs/dbraw/zinc/14/06/24/251140624.db2.gz	ARKVMRPSXBPFRK-UHFFFAOYSA-N	1	1	306.366	1.855	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023399	207173114	/nfs/dbraw/zinc/17/31/14/207173114.db2.gz	QIGAAVSCRRJLHH-QWRGUYRKSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023399	207173118	/nfs/dbraw/zinc/17/31/18/207173118.db2.gz	QIGAAVSCRRJLHH-QWRGUYRKSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023399	207173119	/nfs/dbraw/zinc/17/31/19/207173119.db2.gz	QIGAAVSCRRJLHH-QWRGUYRKSA-N	1	1	307.354	1.183	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000341042252	251350599	/nfs/dbraw/zinc/35/05/99/251350599.db2.gz	HEUQOASJMYLDNJ-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2CO)cccc1[N+](=O)[O-]	ZINC000063512772	184283840	/nfs/dbraw/zinc/28/38/40/184283840.db2.gz	HTEGEGKBIVJAOW-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](C(N)=O)CC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000352404120	285028533	/nfs/dbraw/zinc/02/85/33/285028533.db2.gz	CGCLMCGKIYZDIR-ZYHUDNBSSA-N	1	1	307.350	1.689	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C(C)(C)C(N)=O)c([N+](=O)[O-])c1	ZINC000295804799	533014849	/nfs/dbraw/zinc/01/48/49/533014849.db2.gz	WINZFOUEADIHDC-UHFFFAOYSA-N	1	1	311.338	1.178	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1	ZINC000272915910	210303018	/nfs/dbraw/zinc/30/30/18/210303018.db2.gz	JWRVJVLPGVHNJX-SECBINFHSA-N	1	1	322.340	1.696	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CCC[C@H]1O	ZINC000352661544	285205311	/nfs/dbraw/zinc/20/53/11/285205311.db2.gz	UALZPJGHNAVZEL-UONOGXRCSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@@H]1O	ZINC000352669322	285212390	/nfs/dbraw/zinc/21/23/90/285212390.db2.gz	YUXSYXPHUOUBRE-KBPBESRZSA-N	1	1	307.350	1.769	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000490636811	533311640	/nfs/dbraw/zinc/31/16/40/533311640.db2.gz	DWMWSYJFBXKOBB-FPLPWBNLSA-N	1	1	321.377	1.693	20	5		DDBDMO
CC[NH2+]CC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000261631484	407559286	/nfs/dbraw/zinc/55/92/86/407559286.db2.gz	BYCOFWDTBQRZDZ-UHFFFAOYSA-N	1	1	320.393	1.515	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000068127859	406617690	/nfs/dbraw/zinc/61/76/90/406617690.db2.gz	SINACVBUZDOBTL-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
C[C@@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[N@@H+](C)C1CC1	ZINC000068216794	406625888	/nfs/dbraw/zinc/62/58/88/406625888.db2.gz	XDEKJGZNXZTWIQ-VIFPVBQESA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@H+](C)C1CC1	ZINC000068216794	406625895	/nfs/dbraw/zinc/62/58/95/406625895.db2.gz	XDEKJGZNXZTWIQ-VIFPVBQESA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@@H+](C)C1CC1	ZINC000068216794	406625899	/nfs/dbraw/zinc/62/58/99/406625899.db2.gz	XDEKJGZNXZTWIQ-VIFPVBQESA-N	1	1	317.349	1.684	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@@H]1CO)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000123010041	407316474	/nfs/dbraw/zinc/31/64/74/407316474.db2.gz	UOOCETHGANSAQR-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@@H]1CO)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000123010041	407316475	/nfs/dbraw/zinc/31/64/75/407316475.db2.gz	UOOCETHGANSAQR-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1CO	ZINC000101546690	407310657	/nfs/dbraw/zinc/31/06/57/407310657.db2.gz	GNENHLPKUWEYGY-GFCCVEGCSA-N	1	1	323.349	1.389	20	5		DDBDMO
CC[C@@](C)(O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000123613644	407334352	/nfs/dbraw/zinc/33/43/52/407334352.db2.gz	ZXFAUFMJFKBKEG-MRXNPFEDSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1O	ZINC000271012738	407469783	/nfs/dbraw/zinc/46/97/83/407469783.db2.gz	ZWMNPPCSHVPJIQ-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1O	ZINC000271012738	407469787	/nfs/dbraw/zinc/46/97/87/407469787.db2.gz	ZWMNPPCSHVPJIQ-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)n1	ZINC000151792797	407498490	/nfs/dbraw/zinc/49/84/90/407498490.db2.gz	OGPODFUSTUFHKG-QWHCGFSZSA-N	1	1	320.349	1.972	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)COc1ccc([N+](=O)[O-])c(OC)c1	ZINC000112926237	407447710	/nfs/dbraw/zinc/44/77/10/407447710.db2.gz	HXBQHWLKEJUPSB-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000114063335	407535728	/nfs/dbraw/zinc/53/57/28/407535728.db2.gz	XQOHHALUYCLOSM-LLVKDONJSA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000114063335	407535730	/nfs/dbraw/zinc/53/57/30/407535730.db2.gz	XQOHHALUYCLOSM-LLVKDONJSA-N	1	1	323.349	1.583	20	5		DDBDMO
CCS(=O)(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000178884046	407639671	/nfs/dbraw/zinc/63/96/71/407639671.db2.gz	NJRXKDKEFRXUIM-UHFFFAOYSA-N	1	1	315.395	1.356	20	5		DDBDMO
CCc1ccc(C(=O)N[C@H]2CC[N@@H+](CCOC)C2)cc1[N+](=O)[O-]	ZINC000266873074	407656619	/nfs/dbraw/zinc/65/66/19/407656619.db2.gz	ANLYUSRQTIDWTK-AWEZNQCLSA-N	1	1	321.377	1.608	20	5		DDBDMO
Cc1ncc(C[N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)s1	ZINC000179199623	407752115	/nfs/dbraw/zinc/75/21/15/407752115.db2.gz	UVJRPNCAWIKAGC-UHFFFAOYSA-N	1	1	308.363	1.653	20	5		DDBDMO
Cc1ncc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)s1	ZINC000179199623	407752121	/nfs/dbraw/zinc/75/21/21/407752121.db2.gz	UVJRPNCAWIKAGC-UHFFFAOYSA-N	1	1	308.363	1.653	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000186735022	407763145	/nfs/dbraw/zinc/76/31/45/407763145.db2.gz	GCCXAOHJLOSNEO-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
CN([C@H]1CCC[N@H+](C)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000173405669	407879501	/nfs/dbraw/zinc/87/95/01/407879501.db2.gz	HXIQFYPBYRRSOG-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
CN([C@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000173405669	407879504	/nfs/dbraw/zinc/87/95/04/407879504.db2.gz	HXIQFYPBYRRSOG-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000154057568	407962554	/nfs/dbraw/zinc/96/25/54/407962554.db2.gz	RJPBPZLNLBXRJR-HNNXBMFYSA-N	1	1	321.377	1.772	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000268171914	407925254	/nfs/dbraw/zinc/92/52/54/407925254.db2.gz	QTWXJGVYMYZILG-IINYFYTJSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[C@H]1C[NH2+]CC[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000262812750	407942444	/nfs/dbraw/zinc/94/24/44/407942444.db2.gz	YLJQOWKADJRFJA-WCBMZHEXSA-N	1	1	317.342	1.010	20	5		DDBDMO
CC[NH+](CC)[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000272488351	407943430	/nfs/dbraw/zinc/94/34/30/407943430.db2.gz	GXIRMJJMCVPDLT-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1(O)CCOCC1	ZINC000189788631	408107641	/nfs/dbraw/zinc/10/76/41/408107641.db2.gz	GASXJWMSXKAJNU-UHFFFAOYSA-N	1	1	321.333	1.709	20	5		DDBDMO
CCOCC[NH+]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000137042299	408138647	/nfs/dbraw/zinc/13/86/47/408138647.db2.gz	GZYDMGHXTHAYRX-INIZCTEOSA-N	1	1	323.393	1.282	20	5		DDBDMO
CN(CC[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)c1ccccc1	ZINC000176236268	408320134	/nfs/dbraw/zinc/32/01/34/408320134.db2.gz	MQWAAYFINZWGAL-UHFFFAOYSA-N	1	1	303.366	1.860	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCn3cc([N+](=O)[O-])cn3)[C@H]2C1	ZINC000246522863	408281392	/nfs/dbraw/zinc/28/13/92/408281392.db2.gz	KUBLSILTVRREKE-HZSPNIEDSA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@H]2C1	ZINC000246522863	408281398	/nfs/dbraw/zinc/28/13/98/408281398.db2.gz	KUBLSILTVRREKE-HZSPNIEDSA-N	1	1	310.354	1.060	20	5		DDBDMO
CC(C)[N@@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000269369552	408285821	/nfs/dbraw/zinc/28/58/21/408285821.db2.gz	LXSFFICMXFRGMM-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000269369552	408285825	/nfs/dbraw/zinc/28/58/25/408285825.db2.gz	LXSFFICMXFRGMM-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000274031420	408302636	/nfs/dbraw/zinc/30/26/36/408302636.db2.gz	QLQDDFJCJZDPDN-AWEZNQCLSA-N	1	1	318.377	1.673	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nnnc2Sc2ccc([N+](=O)[O-])cn2)C1	ZINC000131941473	162026766	/nfs/dbraw/zinc/02/67/66/162026766.db2.gz	OXYUEYIJUHKHFX-VIFPVBQESA-N	1	1	321.366	1.079	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nnnc2Sc2ncccc2[N+](=O)[O-])C1	ZINC000131944184	162026890	/nfs/dbraw/zinc/02/68/90/162026890.db2.gz	ICLRYJNBQHHAFA-VIFPVBQESA-N	1	1	321.366	1.079	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269631601	408368308	/nfs/dbraw/zinc/36/83/08/408368308.db2.gz	FWXWSESOKRYCRB-SMDDNHRTSA-N	1	1	307.350	1.216	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CC[N@@H+](CC2CCCC2)C1	ZINC000173282400	162329872	/nfs/dbraw/zinc/32/98/72/162329872.db2.gz	MUMSSJVNWSKRKU-ZDUSSCGKSA-N	1	1	321.381	1.172	20	5		DDBDMO
C[C@@H]1OCC[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000247993131	408523949	/nfs/dbraw/zinc/52/39/49/408523949.db2.gz	JQJBSKOPJPPVAD-SGMGOOAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1OCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000247993131	408523956	/nfs/dbraw/zinc/52/39/56/408523956.db2.gz	JQJBSKOPJPPVAD-SGMGOOAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000177130294	408527879	/nfs/dbraw/zinc/52/78/79/408527879.db2.gz	DECHSJVQDGHIHW-PWSUYJOCSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[C@@H](O)[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402010	408476976	/nfs/dbraw/zinc/47/69/76/408476976.db2.gz	HSGGWECHQXAKEF-DGCLKSJQSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402010	408476982	/nfs/dbraw/zinc/47/69/82/408476982.db2.gz	HSGGWECHQXAKEF-DGCLKSJQSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177198707	408549509	/nfs/dbraw/zinc/54/95/09/408549509.db2.gz	SKEKEJPYNHMTPE-NEPJUHHUSA-N	1	1	319.361	1.715	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@]2(CCOC2)C1	ZINC000248466316	408574429	/nfs/dbraw/zinc/57/44/29/408574429.db2.gz	SEJHFPFMMJRKGZ-CZUORRHYSA-N	1	1	322.361	1.447	20	5		DDBDMO
C[C@@H](c1ccncc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270551591	408576265	/nfs/dbraw/zinc/57/62/65/408576265.db2.gz	BLHSPPCOVNJLTH-FZMZJTMJSA-N	1	1	305.338	1.240	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248697402	408618825	/nfs/dbraw/zinc/61/88/25/408618825.db2.gz	ARTFGOJESFOSBV-XJFOESAGSA-N	1	1	324.377	1.568	20	5		DDBDMO
COC[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccco1	ZINC000184630085	408656814	/nfs/dbraw/zinc/65/68/14/408656814.db2.gz	MEPLNKFEUXBJCN-GFCCVEGCSA-N	1	1	307.306	1.327	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270746069	408663407	/nfs/dbraw/zinc/66/34/07/408663407.db2.gz	HFGOYJOEADUIFR-GRYCIOLGSA-N	1	1	323.397	1.425	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000177842787	408727921	/nfs/dbraw/zinc/72/79/21/408727921.db2.gz	QBSBOWGDUCLFAG-WFASDCNBSA-N	1	1	321.377	1.801	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000177842787	408727927	/nfs/dbraw/zinc/72/79/27/408727927.db2.gz	QBSBOWGDUCLFAG-WFASDCNBSA-N	1	1	321.377	1.801	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000163605446	408783932	/nfs/dbraw/zinc/78/39/32/408783932.db2.gz	ROOLIICVJQQSGG-NSHDSACASA-N	1	1	323.397	1.569	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000185311554	408794659	/nfs/dbraw/zinc/79/46/59/408794659.db2.gz	DPTKGNYWVGRBSF-NSHDSACASA-N	1	1	321.381	1.280	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1CCOC1	ZINC000178350492	408810383	/nfs/dbraw/zinc/81/03/83/408810383.db2.gz	KUARZKSILNRHRI-LLVKDONJSA-N	1	1	308.334	1.930	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000162955552	408748205	/nfs/dbraw/zinc/74/82/05/408748205.db2.gz	FGJVMEXIJZIKML-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000162955552	408748210	/nfs/dbraw/zinc/74/82/10/408748210.db2.gz	FGJVMEXIJZIKML-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000285628911	408832423	/nfs/dbraw/zinc/83/24/23/408832423.db2.gz	DWTWENZGNXLTMU-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])c(OC[C@H](O)C[N@@H+](C)C2CC2)c1	ZINC000290794695	408834382	/nfs/dbraw/zinc/83/43/82/408834382.db2.gz	OVLVVBFCSUBFLV-CYBMUJFWSA-N	1	1	309.366	1.495	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000286069769	408918153	/nfs/dbraw/zinc/91/81/53/408918153.db2.gz	UACXJYRFGOSURT-KGLIPLIRSA-N	1	1	320.349	1.072	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2cc(Br)c(=O)c([N+](=O)[O-])c2)C1	ZINC000191193255	163176773	/nfs/dbraw/zinc/17/67/73/163176773.db2.gz	VBDVBOQAUVRPQU-QMMMGPOBSA-N	1	1	316.155	1.471	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1(CO)CCC1	ZINC000292069324	408974165	/nfs/dbraw/zinc/97/41/65/408974165.db2.gz	DJPPZUPUGNWZHG-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1(CO)CCC1	ZINC000292069324	408974168	/nfs/dbraw/zinc/97/41/68/408974168.db2.gz	DJPPZUPUGNWZHG-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3nonc32)[C@H](C)C1	ZINC000277791501	409012536	/nfs/dbraw/zinc/01/25/36/409012536.db2.gz	NJIXGLTXAXHXQR-ZJUUUORDSA-N	1	1	321.337	1.022	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000292307927	409021974	/nfs/dbraw/zinc/02/19/74/409021974.db2.gz	NDSGJJRGPBQLAQ-INIZCTEOSA-N	1	1	319.361	1.528	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000278793468	409089406	/nfs/dbraw/zinc/08/94/06/409089406.db2.gz	QMKPPEHQOCXJAW-PHIMTYICSA-N	1	1	320.349	1.164	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000283773301	409213924	/nfs/dbraw/zinc/21/39/24/409213924.db2.gz	PQEHCUIKHRTBKU-HNNXBMFYSA-N	1	1	312.366	1.348	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000280359178	409299629	/nfs/dbraw/zinc/29/96/29/409299629.db2.gz	JPMIMRMNTQOBSB-OAHLLOKOSA-N	1	1	309.366	1.648	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](C)C(C)(C)O	ZINC000295154008	409347363	/nfs/dbraw/zinc/34/73/63/409347363.db2.gz	MHKYSUWCFVEPEA-LLVKDONJSA-N	1	1	309.366	1.933	20	5		DDBDMO
C[C@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1	ZINC000280536476	409347607	/nfs/dbraw/zinc/34/76/07/409347607.db2.gz	PINDOXLJMZUDAN-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1	ZINC000280536476	409347614	/nfs/dbraw/zinc/34/76/14/409347614.db2.gz	PINDOXLJMZUDAN-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1COC1	ZINC000295278125	409411946	/nfs/dbraw/zinc/41/19/46/409411946.db2.gz	CSBJHDOGACSFBF-ZDUSSCGKSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280750017	409436693	/nfs/dbraw/zinc/43/66/93/409436693.db2.gz	NFEPVVZUZCMBAC-BONVTDFDSA-N	1	1	320.349	1.119	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000322339195	164047143	/nfs/dbraw/zinc/04/71/43/164047143.db2.gz	BPZNZCQJDOXCJM-QWRGUYRKSA-N	1	1	320.349	1.815	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000342095064	409561040	/nfs/dbraw/zinc/56/10/40/409561040.db2.gz	PAMPWSUYCOJIRQ-UHFFFAOYSA-N	1	1	310.354	1.837	20	5		DDBDMO
Cn1nccc1C1=CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000285597512	409504994	/nfs/dbraw/zinc/50/49/94/409504994.db2.gz	LVOTZXGDWFTZHB-UHFFFAOYSA-N	1	1	302.338	1.314	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc([N+](=O)[O-])c1C	ZINC000331595776	409676121	/nfs/dbraw/zinc/67/61/21/409676121.db2.gz	YHPBUYQJGQHPJK-GFCCVEGCSA-N	1	1	319.361	1.878	20	5		DDBDMO
COc1c(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000346316716	409910552	/nfs/dbraw/zinc/91/05/52/409910552.db2.gz	IAPXYKOSDCXJHG-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000346244105	409870872	/nfs/dbraw/zinc/87/08/72/409870872.db2.gz	UNHIFFSBEGBRHS-JFGNBEQYSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000346244105	409870876	/nfs/dbraw/zinc/87/08/76/409870876.db2.gz	UNHIFFSBEGBRHS-JFGNBEQYSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000346244105	409870881	/nfs/dbraw/zinc/87/08/81/409870881.db2.gz	UNHIFFSBEGBRHS-JFGNBEQYSA-N	1	1	321.381	1.429	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)C1	ZINC000346229483	409872393	/nfs/dbraw/zinc/87/23/93/409872393.db2.gz	MBNUOODYTMMJMR-HOSYDEDBSA-N	1	1	307.354	1.120	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCC3)[C@H]2C2CC2)c1	ZINC000357457084	410051093	/nfs/dbraw/zinc/05/10/93/410051093.db2.gz	VAALKWLSJYAIDC-UONOGXRCSA-N	1	1	306.366	1.417	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)CO	ZINC000298535605	410280436	/nfs/dbraw/zinc/28/04/36/410280436.db2.gz	MOVLKYWXRQEAOV-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000351774204	410223754	/nfs/dbraw/zinc/22/37/54/410223754.db2.gz	KDJOFYZAYGPGDQ-CHIMOYNISA-N	1	1	307.350	1.543	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000351774204	410223758	/nfs/dbraw/zinc/22/37/58/410223758.db2.gz	KDJOFYZAYGPGDQ-CHIMOYNISA-N	1	1	307.350	1.543	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])s1	ZINC000358035894	410346033	/nfs/dbraw/zinc/34/60/33/410346033.db2.gz	BQXZGGXNOFAFOU-JTQLQIEISA-N	1	1	313.379	1.497	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCSC[C@H]2CCO)cc1[N+](=O)[O-]	ZINC000355087770	410303462	/nfs/dbraw/zinc/30/34/62/410303462.db2.gz	NFBQLXOEODEACN-GFCCVEGCSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1ccc(C[N@H+]2CCSC[C@H]2CCO)cc1[N+](=O)[O-]	ZINC000355087770	410303465	/nfs/dbraw/zinc/30/34/65/410303465.db2.gz	NFBQLXOEODEACN-GFCCVEGCSA-N	1	1	312.391	1.903	20	5		DDBDMO
CCC[N@H+](CC(=O)N(C)C)Cc1ccc([N+](=O)[O-])c(OC)c1	ZINC000351978200	410386624	/nfs/dbraw/zinc/38/66/24/410386624.db2.gz	ODKIEQPHGZOXJX-UHFFFAOYSA-N	1	1	309.366	1.904	20	5		DDBDMO
CCC[N@@H+](CC(=O)N(C)C)Cc1ccc([N+](=O)[O-])c(OC)c1	ZINC000351978200	410386631	/nfs/dbraw/zinc/38/66/31/410386631.db2.gz	ODKIEQPHGZOXJX-UHFFFAOYSA-N	1	1	309.366	1.904	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358407957	410462624	/nfs/dbraw/zinc/46/26/24/410462624.db2.gz	GCOLWDDGDUCFRG-BONVTDFDSA-N	1	1	321.352	1.875	20	5		DDBDMO
COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@@H](C)C(N)=O	ZINC000347313627	410463909	/nfs/dbraw/zinc/46/39/09/410463909.db2.gz	IIUHGGSENQCYKO-SRXBQZRASA-N	1	1	321.377	1.820	20	5		DDBDMO
COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@@H](C)C(N)=O	ZINC000347313627	410463912	/nfs/dbraw/zinc/46/39/12/410463912.db2.gz	IIUHGGSENQCYKO-SRXBQZRASA-N	1	1	321.377	1.820	20	5		DDBDMO
Cc1nn(C)c(C(=O)Nc2cc(C)c3[nH+]ccn3c2)c1[N+](=O)[O-]	ZINC000355439551	410515485	/nfs/dbraw/zinc/51/54/85/410515485.db2.gz	PACLHIMDAUMVNY-UHFFFAOYSA-N	1	1	314.305	1.845	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2CCC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000355610914	410604943	/nfs/dbraw/zinc/60/49/43/410604943.db2.gz	UIAMGJMTEBSGNE-LBPRGKRZSA-N	1	1	324.333	1.103	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CCC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000355610914	410604949	/nfs/dbraw/zinc/60/49/49/410604949.db2.gz	UIAMGJMTEBSGNE-LBPRGKRZSA-N	1	1	324.333	1.103	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1	ZINC000299221370	410572678	/nfs/dbraw/zinc/57/26/78/410572678.db2.gz	NGZCCQJLIFHMAS-HIFRSBDPSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000330572851	410788663	/nfs/dbraw/zinc/78/86/63/410788663.db2.gz	DTAOXANNMQNKOY-STQMWFEESA-N	1	1	320.393	1.866	20	5		DDBDMO
Cc1cc(NC[C@@](C)(O)C[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000301762963	410790583	/nfs/dbraw/zinc/79/05/83/410790583.db2.gz	MQRYOZOFWIIVPM-OAHLLOKOSA-N	1	1	309.366	1.398	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301921805	410830536	/nfs/dbraw/zinc/83/05/36/410830536.db2.gz	DQHFUNQBYVCOQC-RYUDHWBXSA-N	1	1	323.397	1.556	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301921805	410830541	/nfs/dbraw/zinc/83/05/41/410830541.db2.gz	DQHFUNQBYVCOQC-RYUDHWBXSA-N	1	1	323.397	1.556	20	5		DDBDMO
C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@@H+]1C	ZINC000343962753	410854411	/nfs/dbraw/zinc/85/44/11/410854411.db2.gz	CNBDLTGLTFYFNN-MNOVXSKESA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343962753	410854428	/nfs/dbraw/zinc/85/44/28/410854428.db2.gz	CNBDLTGLTFYFNN-MNOVXSKESA-N	1	1	313.379	1.356	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000330660862	410856643	/nfs/dbraw/zinc/85/66/43/410856643.db2.gz	BVJXSTVEQRILKA-JTQLQIEISA-N	1	1	321.333	1.158	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000330660862	410856647	/nfs/dbraw/zinc/85/66/47/410856647.db2.gz	BVJXSTVEQRILKA-JTQLQIEISA-N	1	1	321.333	1.158	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000330678259	410874183	/nfs/dbraw/zinc/87/41/83/410874183.db2.gz	WLJHKOFSPGOMIQ-LBPRGKRZSA-N	1	1	306.366	1.194	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344038839	410912202	/nfs/dbraw/zinc/91/22/02/410912202.db2.gz	GKCPKLRRRBTWPL-WHOFXGATSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344038839	410912206	/nfs/dbraw/zinc/91/22/06/410912206.db2.gz	GKCPKLRRRBTWPL-WHOFXGATSA-N	1	1	319.361	1.544	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3CC[C@@H](O)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000344054450	410923769	/nfs/dbraw/zinc/92/37/69/410923769.db2.gz	IXZSRJJQWUKLAJ-CORIIIEPSA-N	1	1	322.361	1.685	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000613049712	416674331	/nfs/dbraw/zinc/67/43/31/416674331.db2.gz	ORKFNVVUYQPFPU-AWEZNQCLSA-N	1	1	303.322	1.017	20	5		DDBDMO
COc1cc(CN2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000419344561	226125678	/nfs/dbraw/zinc/12/56/78/226125678.db2.gz	SAOSHEOHHYWYNH-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
COCC[C@H]1COCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000291327643	222315898	/nfs/dbraw/zinc/31/58/98/222315898.db2.gz	VIGCKJXSPMOLMP-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
COCC[C@H]1COCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000291327643	222315900	/nfs/dbraw/zinc/31/59/00/222315900.db2.gz	VIGCKJXSPMOLMP-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1	ZINC000358056822	418652460	/nfs/dbraw/zinc/65/24/60/418652460.db2.gz	BQPBHOINOVFAMS-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1OC	ZINC000361662030	418697442	/nfs/dbraw/zinc/69/74/42/418697442.db2.gz	PFSWXKMPMJJOFV-CMPLNLGQSA-N	1	1	310.350	1.672	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H]3OCC[N@H+](C)[C@H]3C2)n1	ZINC000408025353	418782423	/nfs/dbraw/zinc/78/24/23/418782423.db2.gz	BCEFJGYNIBODNU-STQMWFEESA-N	1	1	306.366	1.516	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000371232282	418770561	/nfs/dbraw/zinc/77/05/61/418770561.db2.gz	ROBIQQXDXUMAES-CHWSQXEVSA-N	1	1	319.361	1.892	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@H](Cc2ccncc2)C1	ZINC000364762704	418809419	/nfs/dbraw/zinc/80/94/19/418809419.db2.gz	RXIOGFKFZNGYIS-ZDUSSCGKSA-N	1	1	301.350	1.788	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000420936981	419367937	/nfs/dbraw/zinc/36/79/37/419367937.db2.gz	JFWLARRQKOJEGQ-QWHCGFSZSA-N	1	1	321.377	1.508	20	5		DDBDMO
CCC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000420996384	419433291	/nfs/dbraw/zinc/43/32/91/419433291.db2.gz	ASIHCLMGNBBSEO-UHFFFAOYSA-N	1	1	301.368	1.215	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@H]1CCC[N@H+]1C	ZINC000421003171	419440448	/nfs/dbraw/zinc/44/04/48/419440448.db2.gz	MWACXAADCICEON-AWEZNQCLSA-N	1	1	321.377	1.987	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)[nH]1	ZINC000412033742	419576927	/nfs/dbraw/zinc/57/69/27/419576927.db2.gz	SFUVQOMIDIIIJJ-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)n1	ZINC000412033742	419576933	/nfs/dbraw/zinc/57/69/33/419576933.db2.gz	SFUVQOMIDIIIJJ-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)n1	ZINC000412033742	419576947	/nfs/dbraw/zinc/57/69/47/419576947.db2.gz	SFUVQOMIDIIIJJ-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)n[nH]1	ZINC000412033742	419576957	/nfs/dbraw/zinc/57/69/57/419576957.db2.gz	SFUVQOMIDIIIJJ-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)n[nH]1	ZINC000412033742	419576967	/nfs/dbraw/zinc/57/69/67/419576967.db2.gz	SFUVQOMIDIIIJJ-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)n1	ZINC000427594977	419691807	/nfs/dbraw/zinc/69/18/07/419691807.db2.gz	BSFTXJJTWJRXHB-NSHDSACASA-N	1	1	307.354	1.120	20	5		DDBDMO
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000299399633	229098697	/nfs/dbraw/zinc/09/86/97/229098697.db2.gz	KEORYNAYEXGBGY-GFCCVEGCSA-N	1	1	314.345	1.996	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C1CCC1)CCn1cc([N+](=O)[O-])cn1	ZINC000429537235	420023991	/nfs/dbraw/zinc/02/39/91/420023991.db2.gz	DYYKJWWDGCGPDI-UHFFFAOYSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000416289733	420307764	/nfs/dbraw/zinc/30/77/64/420307764.db2.gz	FVYPLCBYYBZAGA-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000416289733	420307768	/nfs/dbraw/zinc/30/77/68/420307768.db2.gz	FVYPLCBYYBZAGA-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000420606987	420329526	/nfs/dbraw/zinc/32/95/26/420329526.db2.gz	ZBXYWDQTLAGUIX-YPMHNXCESA-N	1	1	318.377	1.614	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c(C)cc1[N+](=O)[O-]	ZINC000416383556	420351114	/nfs/dbraw/zinc/35/11/14/420351114.db2.gz	DWZSRIPZLGUGLJ-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c(C)cc1[N+](=O)[O-]	ZINC000416383556	420351118	/nfs/dbraw/zinc/35/11/18/420351118.db2.gz	DWZSRIPZLGUGLJ-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000457004735	420585863	/nfs/dbraw/zinc/58/58/63/420585863.db2.gz	YMWPRHXNVZLNPA-LBPRGKRZSA-N	1	1	301.302	1.975	20	5		DDBDMO
C[N@@H+](CCCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000440957516	420621606	/nfs/dbraw/zinc/62/16/06/420621606.db2.gz	MCESTAWBJNVYMY-UHFFFAOYSA-N	1	1	309.322	1.207	20	5		DDBDMO
CN(C(=O)CN1CCC[C@H](CC[NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000443070149	420742360	/nfs/dbraw/zinc/74/23/60/420742360.db2.gz	KTAUACHHIHUOJL-CYBMUJFWSA-N	1	1	320.393	1.618	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C1	ZINC000493046674	420743456	/nfs/dbraw/zinc/74/34/56/420743456.db2.gz	KJVNOAOTUOMQJW-NFAHFFEMSA-N	1	1	307.325	1.768	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCCC1	ZINC000449093010	420948235	/nfs/dbraw/zinc/94/82/35/420948235.db2.gz	NUYUDQLDHRTGPJ-DZGCQCFKSA-N	1	1	307.394	1.572	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])NC[C@@H](O)C[NH+]1CCCC1	ZINC000449093010	420948236	/nfs/dbraw/zinc/94/82/36/420948236.db2.gz	NUYUDQLDHRTGPJ-DZGCQCFKSA-N	1	1	307.394	1.572	20	5		DDBDMO
CC[C@H](CNS(C)(=O)=O)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000449444195	421012499	/nfs/dbraw/zinc/01/24/99/421012499.db2.gz	ZAUGVUPDMVDZGK-SNVBAGLBSA-N	1	1	319.358	1.151	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000487514944	421032420	/nfs/dbraw/zinc/03/24/20/421032420.db2.gz	KHQTVVDCKUSRLE-AAEUAGOBSA-N	1	1	321.381	1.153	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@@H+]2CC=C(C)CC2)ccc1[N+](=O)[O-]	ZINC000456073303	421095645	/nfs/dbraw/zinc/09/56/45/421095645.db2.gz	VUVONBUVZBPZPU-UHFFFAOYSA-N	1	1	319.365	1.413	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488767292	421115178	/nfs/dbraw/zinc/11/51/78/421115178.db2.gz	VTVTVGZCRIXWSI-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488767292	421115183	/nfs/dbraw/zinc/11/51/83/421115183.db2.gz	VTVTVGZCRIXWSI-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000560615620	421285259	/nfs/dbraw/zinc/28/52/59/421285259.db2.gz	NXVNJBUIVGWGDY-CQSZACIVSA-N	1	1	321.377	1.987	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000525293087	421286954	/nfs/dbraw/zinc/28/69/54/421286954.db2.gz	WHMPMZQFESVUTB-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000518599851	421661946	/nfs/dbraw/zinc/66/19/46/421661946.db2.gz	UYJUEOJCWWUXDZ-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000518599851	421661950	/nfs/dbraw/zinc/66/19/50/421661950.db2.gz	UYJUEOJCWWUXDZ-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)c1	ZINC000572660983	421809294	/nfs/dbraw/zinc/80/92/94/421809294.db2.gz	YJACTGUIAPOUKT-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cc(C(C)(C)C)n[nH]1	ZINC000572206650	421769749	/nfs/dbraw/zinc/76/97/49/421769749.db2.gz	STWSNVCMVWDVMK-UHFFFAOYSA-N	1	1	306.370	1.944	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cc(C(C)(C)C)n[nH]1	ZINC000572206650	421769751	/nfs/dbraw/zinc/76/97/51/421769751.db2.gz	STWSNVCMVWDVMK-UHFFFAOYSA-N	1	1	306.370	1.944	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC000521141644	421773733	/nfs/dbraw/zinc/77/37/33/421773733.db2.gz	TXZVLKBTJSTIGR-UHFFFAOYSA-N	1	1	323.397	1.583	20	5		DDBDMO
O=c1[nH]c(N[C@@H]2CC[N@H+](C3CC3)C2)nc2ccc([N+](=O)[O-])cc21	ZINC000596092996	422365438	/nfs/dbraw/zinc/36/54/38/422365438.db2.gz	YXRZSGMNQMAJQN-SECBINFHSA-N	1	1	315.333	1.892	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000597922619	422391612	/nfs/dbraw/zinc/39/16/12/422391612.db2.gz	JKTMMTUJDMYVLH-SECBINFHSA-N	1	1	307.354	1.175	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000344431267	272025220	/nfs/dbraw/zinc/02/52/20/272025220.db2.gz	SLUFEBUMJSRHHC-BETUJISGSA-N	1	1	321.377	1.915	20	5		DDBDMO
CO[C@H]1CCC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000067399371	274079220	/nfs/dbraw/zinc/07/92/20/274079220.db2.gz	QTDCVUWOSYGQTH-LSDHHAIUSA-N	1	1	319.361	1.811	20	5		DDBDMO
CO[C@H]1CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000067399371	274079222	/nfs/dbraw/zinc/07/92/22/274079222.db2.gz	QTDCVUWOSYGQTH-LSDHHAIUSA-N	1	1	319.361	1.811	20	5		DDBDMO
COc1cccc(N2CCN(c3[nH]cc[nH+]3)CC2)c1[N+](=O)[O-]	ZINC000290948198	278016434	/nfs/dbraw/zinc/01/64/34/278016434.db2.gz	MJZJXRIGDQDSNF-UHFFFAOYSA-N	1	1	303.322	1.653	20	5		DDBDMO
C[C@H]1CCNC(=O)[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000193567000	279734066	/nfs/dbraw/zinc/73/40/66/279734066.db2.gz	CHLSMWBPIZPQFM-TVQRCGJNSA-N	1	1	321.333	1.076	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C[C@@H](C)[NH2+]1	ZINC000123882352	288242531	/nfs/dbraw/zinc/24/25/31/288242531.db2.gz	LHMWSEKAIDAYNM-RKDXNWHRSA-N	1	1	317.342	1.105	20	5		DDBDMO
COC(=O)CN1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000363562809	307031395	/nfs/dbraw/zinc/03/13/95/307031395.db2.gz	ODCGSVXSEOLBKN-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COc1ccc(CN[C@H](C)C[C@@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000422951210	533694483	/nfs/dbraw/zinc/69/44/83/533694483.db2.gz	ZWAARSCEDWYBJX-DGCLKSJQSA-N	1	1	309.366	1.460	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)C[C@@H](O)CO)cc1	ZINC000354038313	298346010	/nfs/dbraw/zinc/34/60/10/298346010.db2.gz	KAOZOHGPMKJUMW-GFCCVEGCSA-N	1	1	322.283	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](CCC(F)(F)F)C[C@@H](O)CO)cc1	ZINC000354038313	298346012	/nfs/dbraw/zinc/34/60/12/298346012.db2.gz	KAOZOHGPMKJUMW-GFCCVEGCSA-N	1	1	322.283	1.702	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362077781	300001342	/nfs/dbraw/zinc/00/13/42/300001342.db2.gz	ONVIWAJOJUSOJD-STQMWFEESA-N	1	1	321.377	1.792	20	5		DDBDMO
CC[C@H]1C[N@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)CCO1	ZINC000362660940	300112087	/nfs/dbraw/zinc/11/20/87/300112087.db2.gz	BDPFYVDUDBEOEV-LBPRGKRZSA-N	1	1	319.365	1.416	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)CCO1	ZINC000362660940	300112090	/nfs/dbraw/zinc/11/20/90/300112090.db2.gz	BDPFYVDUDBEOEV-LBPRGKRZSA-N	1	1	319.365	1.416	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCC[C@@H]2c2nccs2)c1	ZINC000368404317	301020194	/nfs/dbraw/zinc/02/01/94/301020194.db2.gz	LIHNCFGZVNSCLG-NWDGAFQWSA-N	1	1	323.378	1.446	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2nccs2)c1	ZINC000368404317	301020196	/nfs/dbraw/zinc/02/01/96/301020196.db2.gz	LIHNCFGZVNSCLG-NWDGAFQWSA-N	1	1	323.378	1.446	20	5		DDBDMO
C[C@@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC12CCOCC2	ZINC000368810574	301091833	/nfs/dbraw/zinc/09/18/33/301091833.db2.gz	OOECYWHQNRSTFQ-GXTWGEPZSA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]2OCC[C@H]21	ZINC000366471708	307074498	/nfs/dbraw/zinc/07/44/98/307074498.db2.gz	ICWKESIPZMEXMG-UMVBOHGHSA-N	1	1	322.361	1.588	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000367377993	307092367	/nfs/dbraw/zinc/09/23/67/307092367.db2.gz	NVERFTSOIPHBAB-GHMZBOCLSA-N	1	1	320.349	1.119	20	5		DDBDMO
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@@H+](C)C1	ZINC000156543346	523851073	/nfs/dbraw/zinc/85/10/73/523851073.db2.gz	WOPCRDPINVSIQE-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000433246383	528009162	/nfs/dbraw/zinc/00/91/62/528009162.db2.gz	LNVPGDBPMAMSOU-CQSZACIVSA-N	1	1	312.366	1.691	20	5		DDBDMO
CCOC(=O)c1cc(-c2nc(C[NH2+]C)no2)cc([N+](=O)[O-])c1	ZINC000414648061	528134635	/nfs/dbraw/zinc/13/46/35/528134635.db2.gz	VASHAEWCVMQGLG-UHFFFAOYSA-N	1	1	306.278	1.541	20	5		DDBDMO
C[C@@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000748128316	700101007	/nfs/dbraw/zinc/10/10/07/700101007.db2.gz	DDXBBURXMYFOCY-TUAOUCFPSA-N	1	1	310.354	1.596	20	5		DDBDMO
Cc1nc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cs1	ZINC000983658664	697287158	/nfs/dbraw/zinc/28/71/58/697287158.db2.gz	ZJMDZTPELWYVQU-FPQZTECRSA-N	1	1	324.406	1.101	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1F	ZINC000164563987	697336820	/nfs/dbraw/zinc/33/68/20/697336820.db2.gz	FTJQSONDZGXEON-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)cc([N+](=O)[O-])c1F	ZINC000164563987	697336822	/nfs/dbraw/zinc/33/68/22/697336822.db2.gz	FTJQSONDZGXEON-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](C3OCCO3)C2)c(C)c1[N+](=O)[O-]	ZINC000172491543	697368292	/nfs/dbraw/zinc/36/82/92/697368292.db2.gz	ZBCSKVLWABWFBE-GFCCVEGCSA-N	1	1	310.354	1.451	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](C3OCCO3)C2)c(C)c1[N+](=O)[O-]	ZINC000172491543	697368295	/nfs/dbraw/zinc/36/82/95/697368295.db2.gz	ZBCSKVLWABWFBE-GFCCVEGCSA-N	1	1	310.354	1.451	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccco1	ZINC000195128616	697731457	/nfs/dbraw/zinc/73/14/57/697731457.db2.gz	CMTGECZGOXEBTD-CYBMUJFWSA-N	1	1	318.333	1.803	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]Cc1cc([N+](=O)[O-])ccc1OC	ZINC000233826230	697790523	/nfs/dbraw/zinc/79/05/23/697790523.db2.gz	XKRMXKTWPTXPJC-UHFFFAOYSA-N	1	1	302.352	1.128	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000749954423	700194367	/nfs/dbraw/zinc/19/43/67/700194367.db2.gz	LCQMZBCAWGJEDG-UHFFFAOYSA-N	1	1	321.337	1.490	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC4(CC3)OCCO4)nc2c1	ZINC000776100536	698066598	/nfs/dbraw/zinc/06/65/98/698066598.db2.gz	SAMGDHQDIGJVCL-UHFFFAOYSA-N	1	1	318.333	1.810	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581310	698121158	/nfs/dbraw/zinc/12/11/58/698121158.db2.gz	CIXQDFVVUYMATI-GJZGRUSLSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581310	698121161	/nfs/dbraw/zinc/12/11/61/698121161.db2.gz	CIXQDFVVUYMATI-GJZGRUSLSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCS[C@@H]3COCC[C@H]32)cc1	ZINC000776587135	698122613	/nfs/dbraw/zinc/12/26/13/698122613.db2.gz	ULYPECVAELXWFB-RBSFLKMASA-N	1	1	324.402	1.835	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782525612	698734234	/nfs/dbraw/zinc/73/42/34/698734234.db2.gz	ZHZBTKDULMWVKI-KOLCDFICSA-N	1	1	311.313	1.518	20	5		DDBDMO
CCN(CC)C(=O)C[NH2+]Cc1cc(OC)c(O)cc1[N+](=O)[O-]	ZINC000725848382	699336030	/nfs/dbraw/zinc/33/60/30/699336030.db2.gz	PKKNRKAIPLEEKR-UHFFFAOYSA-N	1	1	311.338	1.267	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC000729528432	699481542	/nfs/dbraw/zinc/48/15/42/699481542.db2.gz	AUIBIBMLFQTZKY-LBPRGKRZSA-N	1	1	320.393	1.947	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000742238920	699868739	/nfs/dbraw/zinc/86/87/39/699868739.db2.gz	IQOPKKSCNFFZNH-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1	ZINC000795677263	699883232	/nfs/dbraw/zinc/88/32/32/699883232.db2.gz	YEATYUPAQMKBCX-BETUJISGSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1	ZINC000795677263	699883235	/nfs/dbraw/zinc/88/32/35/699883235.db2.gz	YEATYUPAQMKBCX-BETUJISGSA-N	1	1	317.349	1.920	20	5		DDBDMO
CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])CC(=O)NC	ZINC000743843550	699928619	/nfs/dbraw/zinc/92/86/19/699928619.db2.gz	XCISOXZHDCKBHX-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])CC(=O)NC	ZINC000743843550	699928621	/nfs/dbraw/zinc/92/86/21/699928621.db2.gz	XCISOXZHDCKBHX-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
CC1(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)OCCCO1	ZINC000752925112	700396718	/nfs/dbraw/zinc/39/67/18/700396718.db2.gz	SRKJKNAKQZDJES-UHFFFAOYSA-N	1	1	324.333	1.609	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)[C@@H](C)C1	ZINC000761067601	700838116	/nfs/dbraw/zinc/83/81/16/700838116.db2.gz	FYWYKDJWQKISFF-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+]1C	ZINC000761081935	700841902	/nfs/dbraw/zinc/84/19/02/700841902.db2.gz	OWNYBOAZBLSBQQ-NSHDSACASA-N	1	1	307.350	1.597	20	5		DDBDMO
C/C(=C/C(=O)NC[C@]1(O)CC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000762721492	700904700	/nfs/dbraw/zinc/90/47/00/700904700.db2.gz	NKJAXMPIXPXARU-HMWXGYMHSA-N	1	1	319.361	1.181	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000771850404	701334123	/nfs/dbraw/zinc/33/41/23/701334123.db2.gz	KBDKKAKQINITSY-UHFFFAOYSA-N	1	1	305.290	1.722	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1cnn(C)n1	ZINC000806167203	701428431	/nfs/dbraw/zinc/42/84/31/701428431.db2.gz	OHEVXYFZAVVCRO-SNVBAGLBSA-N	1	1	318.337	1.230	20	5		DDBDMO
C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1(CO)CC1	ZINC000839601746	701750082	/nfs/dbraw/zinc/75/00/82/701750082.db2.gz	NIHVICRATWEQMU-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1(CO)CC1	ZINC000839601746	701750084	/nfs/dbraw/zinc/75/00/84/701750084.db2.gz	NIHVICRATWEQMU-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)O[C@H](C)Cn2cc[nH+]c2C)n1	ZINC000810615856	701801504	/nfs/dbraw/zinc/80/15/04/701801504.db2.gz	OKTSQNXBHBCVBA-SECBINFHSA-N	1	1	307.310	1.562	20	5		DDBDMO
CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000867970198	701862496	/nfs/dbraw/zinc/86/24/96/701862496.db2.gz	XLXMFFWTIXRHSW-JSGCOSHPSA-N	1	1	309.391	1.733	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]2[C@H](O)c2ccccc2)n1	ZINC000879244223	706627610	/nfs/dbraw/zinc/62/76/10/706627610.db2.gz	PHSWNPLSDZTMLH-GDBMZVCRSA-N	1	1	316.361	1.989	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000816954721	702238678	/nfs/dbraw/zinc/23/86/78/702238678.db2.gz	JJNZEHZHEDHZFL-RNCFNFMXSA-N	1	1	320.305	1.279	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])C(C)(C)C1	ZINC000844948977	703088899	/nfs/dbraw/zinc/08/88/99/703088899.db2.gz	HRTQXZFBOBWXFZ-UHFFFAOYSA-N	1	1	315.414	1.391	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000852434046	704047661	/nfs/dbraw/zinc/04/76/61/704047661.db2.gz	WGMHUDIGWSHXEX-CYBMUJFWSA-N	1	1	321.333	1.500	20	5		DDBDMO
CC(C)(C)n1ncnc1C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819289647	704101791	/nfs/dbraw/zinc/10/17/91/704101791.db2.gz	NAIPURLBDBKQDN-CYBMUJFWSA-N	1	1	319.365	1.765	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCc3[nH]cnc3C2)c1	ZINC000819323312	704107249	/nfs/dbraw/zinc/10/72/49/704107249.db2.gz	ZIBAMQBWSVVNRL-XHDPSFHLSA-N	1	1	302.334	1.498	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCN(C2CC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000870875064	704153726	/nfs/dbraw/zinc/15/37/26/704153726.db2.gz	UUHQYJKQFHGTPP-MRXNPFEDSA-N	1	1	318.377	1.075	20	5		DDBDMO
COC[C@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853497814	704250717	/nfs/dbraw/zinc/25/07/17/704250717.db2.gz	GQFLASLLXSYOPD-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853497814	704250720	/nfs/dbraw/zinc/25/07/20/704250720.db2.gz	GQFLASLLXSYOPD-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000855287657	704477353	/nfs/dbraw/zinc/47/73/53/704477353.db2.gz	RHCHINRYFBOAFH-NSHDSACASA-N	1	1	306.366	1.780	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1NCC[N@@H+]1CC[C@H](O)C1	ZINC000858867159	704766269	/nfs/dbraw/zinc/76/62/69/704766269.db2.gz	CTTMCSJVWDMUES-QMMMGPOBSA-N	1	1	303.721	1.866	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ccc(N)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000826633091	705830338	/nfs/dbraw/zinc/83/03/38/705830338.db2.gz	OEJOBIHIPOQATD-TXEJJXNPSA-N	1	1	308.382	1.722	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000828095283	706117627	/nfs/dbraw/zinc/11/76/27/706117627.db2.gz	LWXFGHNKNAAQTN-XUJVJEKNSA-N	1	1	321.377	1.569	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H](O)C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000877608271	706158366	/nfs/dbraw/zinc/15/83/66/706158366.db2.gz	ODRSQNPIKDUHAW-QWHCGFSZSA-N	1	1	322.361	1.567	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2CCO)c([N+](=O)[O-])c1	ZINC000828461507	706184313	/nfs/dbraw/zinc/18/43/13/706184313.db2.gz	ZWBPZQIQQXBPRG-GFCCVEGCSA-N	1	1	324.337	1.762	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000864963737	706314115	/nfs/dbraw/zinc/31/41/15/706314115.db2.gz	YMRGIHMPTXOJCM-LLVKDONJSA-N	1	1	321.352	1.877	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@]1(O)CCc2ccccc21	ZINC000829338053	706320891	/nfs/dbraw/zinc/32/08/91/706320891.db2.gz	QLFNREHEVAQVMW-MRXNPFEDSA-N	1	1	316.361	1.557	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)CCC(C)(C)[N+](=O)[O-])CCCO1	ZINC000830486479	706524675	/nfs/dbraw/zinc/52/46/75/706524675.db2.gz	FNXDMEJCIZZFNN-CYBMUJFWSA-N	1	1	315.414	1.439	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H](C(C)(C)O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000880144504	706891227	/nfs/dbraw/zinc/89/12/27/706891227.db2.gz	GLKQVKCTLZBGTF-GFCCVEGCSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CO)c1ccccc1	ZINC000880461950	706982409	/nfs/dbraw/zinc/98/24/09/706982409.db2.gz	NXQWNTOQBIQXIC-CQSZACIVSA-N	1	1	304.350	1.847	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000880564953	707020049	/nfs/dbraw/zinc/02/00/49/707020049.db2.gz	ALSKIPFRDOPQGH-IAQYHMDHSA-N	1	1	308.334	1.574	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC[C@@H]21	ZINC000872726656	707573893	/nfs/dbraw/zinc/57/38/93/707573893.db2.gz	UEAOAUKBONLFGV-HIFRSBDPSA-N	1	1	315.377	1.928	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c1	ZINC000897221629	708259151	/nfs/dbraw/zinc/25/91/51/708259151.db2.gz	NXPCAXCOMKJUPJ-KGLIPLIRSA-N	1	1	305.378	1.939	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])c1	ZINC000897247772	708267952	/nfs/dbraw/zinc/26/79/52/708267952.db2.gz	DQXCGIOVFMRIFH-UHFFFAOYSA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1cc(NCC[N@@H+](C)CCO)c2cccc([N+](=O)[O-])c2n1	ZINC000884825387	708388057	/nfs/dbraw/zinc/38/80/57/708388057.db2.gz	UEXIDUKNPZUXGV-UHFFFAOYSA-N	1	1	304.350	1.787	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000885857334	708640681	/nfs/dbraw/zinc/64/06/81/708640681.db2.gz	AYCWYMOOHKFWBY-ZDUSSCGKSA-N	1	1	319.361	1.578	20	5		DDBDMO
CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886019400	708682190	/nfs/dbraw/zinc/68/21/90/708682190.db2.gz	SQJZJIXTLDFVHI-UONOGXRCSA-N	1	1	321.377	1.742	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000886341407	708745875	/nfs/dbraw/zinc/74/58/75/708745875.db2.gz	URFWAKYPIKGMEE-GARJFASQSA-N	1	1	305.334	1.882	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000886341407	708745876	/nfs/dbraw/zinc/74/58/76/708745876.db2.gz	URFWAKYPIKGMEE-GARJFASQSA-N	1	1	305.334	1.882	20	5		DDBDMO
C[NH+](C)[C@@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C12CCC2	ZINC000898835477	708884255	/nfs/dbraw/zinc/88/42/55/708884255.db2.gz	NPGAMDHQBBQGDL-UONOGXRCSA-N	1	1	319.361	1.903	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CC[C@@H](O)C2)c1C	ZINC000899146370	709000245	/nfs/dbraw/zinc/00/02/45/709000245.db2.gz	YAEPAZOAZIBYOP-GFCCVEGCSA-N	1	1	307.350	1.008	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1	ZINC000887927743	709166722	/nfs/dbraw/zinc/16/67/22/709166722.db2.gz	HBPWMDIZVSLMPP-WBMJQRKESA-N	1	1	303.362	1.927	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@@H+](C)C[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739941	713080075	/nfs/dbraw/zinc/08/00/75/713080075.db2.gz	KSLCERPVUGYWPH-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@H+](C)C[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739941	713080077	/nfs/dbraw/zinc/08/00/77/713080077.db2.gz	KSLCERPVUGYWPH-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000890081096	709739485	/nfs/dbraw/zinc/73/94/85/709739485.db2.gz	BSOLUAPYGPVYCN-UHFFFAOYSA-N	1	1	321.377	1.822	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CC[NH+](CCO)CC1	ZINC000891434846	710200454	/nfs/dbraw/zinc/20/04/54/710200454.db2.gz	ZUEDUDJOURLZGS-UHFFFAOYSA-N	1	1	320.324	1.396	20	5		DDBDMO
C[C@@H](NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000892112652	710374152	/nfs/dbraw/zinc/37/41/52/710374152.db2.gz	UEZCKTLOXKANKH-BNOWGMLFSA-N	1	1	318.377	1.859	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928431519	713192726	/nfs/dbraw/zinc/19/27/26/713192726.db2.gz	FBEXYQXVJIIWOX-BXUZGUMPSA-N	1	1	319.361	1.767	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)C1C[NH+]([C@H]2CCOC2)C1	ZINC000911502687	710825812	/nfs/dbraw/zinc/82/58/12/710825812.db2.gz	SMPRJIHFHBWBGL-LBPRGKRZSA-N	1	1	320.349	1.296	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(c3ncnc4sc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000893941965	710895012	/nfs/dbraw/zinc/89/50/12/710895012.db2.gz	XULUMRVBBJOEQD-WCBMZHEXSA-N	1	1	305.363	1.740	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000928559273	713226566	/nfs/dbraw/zinc/22/65/66/713226566.db2.gz	WXXWLSZPQLDJCH-SECBINFHSA-N	1	1	315.276	1.630	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000928559273	713226567	/nfs/dbraw/zinc/22/65/67/713226567.db2.gz	WXXWLSZPQLDJCH-SECBINFHSA-N	1	1	315.276	1.630	20	5		DDBDMO
C[C@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[NH+]2CCC1CC2	ZINC000912377503	711300796	/nfs/dbraw/zinc/30/07/96/711300796.db2.gz	ORUDJEATZDSUOM-HNNXBMFYSA-N	1	1	305.334	1.515	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)c1C	ZINC000896203897	711690865	/nfs/dbraw/zinc/69/08/65/711690865.db2.gz	AEUOCKGATUCXCF-GFCCVEGCSA-N	1	1	321.377	1.350	20	5		DDBDMO
O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(Cl)c(F)c1	ZINC000905189925	711963627	/nfs/dbraw/zinc/96/36/27/711963627.db2.gz	JNDKNMBRANGKPJ-NSHDSACASA-N	1	1	301.705	1.451	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccc2c(c1[N+](=O)[O-])OCCCO2	ZINC000907106723	712488985	/nfs/dbraw/zinc/48/89/85/712488985.db2.gz	LXJWTONNKRRGOW-UHFFFAOYSA-N	1	1	321.333	1.192	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000917481077	713499942	/nfs/dbraw/zinc/49/99/42/713499942.db2.gz	XZHNEJAECOSWED-SNVBAGLBSA-N	1	1	304.306	1.397	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000917481077	713499944	/nfs/dbraw/zinc/49/99/44/713499944.db2.gz	XZHNEJAECOSWED-SNVBAGLBSA-N	1	1	304.306	1.397	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000933216833	714538794	/nfs/dbraw/zinc/53/87/94/714538794.db2.gz	FNCZLEIUFYIGBJ-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cn1nccc1[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000933531148	714610250	/nfs/dbraw/zinc/61/02/50/714610250.db2.gz	LVFXMXXNZNGYNC-INIZCTEOSA-N	1	1	316.361	1.944	20	5		DDBDMO
Cn1nccc1[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000933531148	714610251	/nfs/dbraw/zinc/61/02/51/714610251.db2.gz	LVFXMXXNZNGYNC-INIZCTEOSA-N	1	1	316.361	1.944	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CC[C@@H]1OC	ZINC000934121501	714747699	/nfs/dbraw/zinc/74/76/99/714747699.db2.gz	NARZHFGRVQTBRZ-STQMWFEESA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CC[C@@H]1OC	ZINC000934121501	714747700	/nfs/dbraw/zinc/74/77/00/714747700.db2.gz	NARZHFGRVQTBRZ-STQMWFEESA-N	1	1	323.349	1.651	20	5		DDBDMO
O=C1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCCCCN1	ZINC000934155737	714756475	/nfs/dbraw/zinc/75/64/75/714756475.db2.gz	SQPKTTREOUERDI-HNNXBMFYSA-N	1	1	321.377	1.620	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934275915	714784366	/nfs/dbraw/zinc/78/43/66/714784366.db2.gz	RXEXAESRAXJRFJ-ZIAGYGMSSA-N	1	1	306.366	1.021	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925343007	714820360	/nfs/dbraw/zinc/82/03/60/714820360.db2.gz	KVTHVQZDCIDNMQ-GXTWGEPZSA-N	1	1	320.393	1.871	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)n1	ZINC001164631362	719253914	/nfs/dbraw/zinc/25/39/14/719253914.db2.gz	DODQEMVSIJWTFV-BDAKNGLRSA-N	1	1	322.369	1.180	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)n1	ZINC001164631362	719253917	/nfs/dbraw/zinc/25/39/17/719253917.db2.gz	DODQEMVSIJWTFV-BDAKNGLRSA-N	1	1	322.369	1.180	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3nccc4cc([N+](=O)[O-])ccc43)C[C@@H]21	ZINC000590694493	719481745	/nfs/dbraw/zinc/48/17/45/719481745.db2.gz	XDWXIXXHPVIZHH-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4cccc([N+](=O)[O-])c4)C[C@H]32)CC1	ZINC001025799442	736859457	/nfs/dbraw/zinc/85/94/57/736859457.db2.gz	JTICKMICDSBYSH-FICVDOATSA-N	1	1	315.373	1.941	20	5		DDBDMO
CC(=O)N1CCc2cc(N[C@H]3CC[N@H+](C)C3)cc([N+](=O)[O-])c21	ZINC001167280647	732895205	/nfs/dbraw/zinc/89/52/05/732895205.db2.gz	AGXAFPWONUALSP-LBPRGKRZSA-N	1	1	304.350	1.620	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@H]3COCCO3)ccc([N+](=O)[O-])c2C1	ZINC001168272946	741990431	/nfs/dbraw/zinc/99/04/31/741990431.db2.gz	ZHQIDJGQDONBRL-NSHDSACASA-N	1	1	307.350	1.410	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@H]3COCCO3)ccc([N+](=O)[O-])c2C1	ZINC001168272946	741990435	/nfs/dbraw/zinc/99/04/35/741990435.db2.gz	ZHQIDJGQDONBRL-NSHDSACASA-N	1	1	307.350	1.410	20	5		DDBDMO
O=C(NC1CC[NH+](CC2CC3(CCC3)C2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002787982	743429777	/nfs/dbraw/zinc/42/97/77/743429777.db2.gz	KZJVNKQGLFFQAS-HUUCEWRRSA-N	1	1	321.421	1.813	20	5		DDBDMO
CC(C)OCCC[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001195770087	746692591	/nfs/dbraw/zinc/69/25/91/746692591.db2.gz	OQJBGQRAQXXBQA-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CC(C)OCCC[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195770087	746692593	/nfs/dbraw/zinc/69/25/93/746692593.db2.gz	OQJBGQRAQXXBQA-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CC(C)OCCC[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195770087	746692599	/nfs/dbraw/zinc/69/25/99/746692599.db2.gz	OQJBGQRAQXXBQA-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
Cc1cccc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000996430060	749589312	/nfs/dbraw/zinc/58/93/12/749589312.db2.gz	ZDZWSXNLHIAYNU-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169018750	762199074	/nfs/dbraw/zinc/19/90/74/762199074.db2.gz	DIQCMSLLZLLXRR-UBHSHLNASA-N	1	1	308.382	1.411	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCS1	ZINC001169046745	762204753	/nfs/dbraw/zinc/20/47/53/762204753.db2.gz	MKCKNRQCOBDCHI-UTUOFQBUSA-N	1	1	302.396	1.412	20	5		DDBDMO
COc1ccc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054472	762210242	/nfs/dbraw/zinc/21/02/42/762210242.db2.gz	MEGADDRCOXJBCA-VNHYZAJKSA-N	1	1	321.377	1.989	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@H](O)C(F)(F)F)ccc([N+](=O)[O-])c2C1	ZINC001169459434	762448191	/nfs/dbraw/zinc/44/81/91/762448191.db2.gz	RYNNRKDSBSFHPX-LBPRGKRZSA-N	1	1	319.283	1.918	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@H](O)C(F)(F)F)ccc([N+](=O)[O-])c2C1	ZINC001169459434	762448193	/nfs/dbraw/zinc/44/81/93/762448193.db2.gz	RYNNRKDSBSFHPX-LBPRGKRZSA-N	1	1	319.283	1.918	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCCNc1ccc([N+](=O)[O-])cn1	ZINC001109496184	763754509	/nfs/dbraw/zinc/75/45/09/763754509.db2.gz	HGABYUUPGLDLDU-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
COc1ccc(C[C@H](C)[NH+]2CC3(CN(C)C3)C2)c([N+](=O)[O-])c1	ZINC001170355466	766261916	/nfs/dbraw/zinc/26/19/16/766261916.db2.gz	GCODTQYAKYWDJP-LBPRGKRZSA-N	1	1	305.378	1.782	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1c(Br)cc(F)cc1[N+](=O)[O-]	ZINC001170900195	771898767	/nfs/dbraw/zinc/89/87/67/771898767.db2.gz	QBBAZUQWDKKCKH-VIFPVBQESA-N	1	1	321.150	1.932	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1ncccc1[N+](=O)[O-]	ZINC001093953265	775262178	/nfs/dbraw/zinc/26/21/78/775262178.db2.gz	UFTAGJPRIGPOQH-UHFFFAOYSA-N	1	1	309.370	1.248	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2[C@H](C1)OCCN2C	ZINC001173220966	777053360	/nfs/dbraw/zinc/05/33/60/777053360.db2.gz	DTOUANAQJFLNGQ-WQVCFCJDSA-N	1	1	305.378	1.541	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@@H]2C[C@@H](CO)C[C@H]21	ZINC001173222786	777055791	/nfs/dbraw/zinc/05/57/91/777055791.db2.gz	VPBHAYCIMQMLMB-JWZBEHFJSA-N	1	1	320.389	1.998	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)[C@](C)(CO)C1	ZINC001173222734	777056027	/nfs/dbraw/zinc/05/60/27/777056027.db2.gz	UZRGCJRGYOHNDL-WQVCFCJDSA-N	1	1	308.378	1.591	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+](C)CCN1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230950	777063885	/nfs/dbraw/zinc/06/38/85/777063885.db2.gz	GYMSYWLIQDHJTM-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](C)CCN1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230950	777063890	/nfs/dbraw/zinc/06/38/90/777063890.db2.gz	GYMSYWLIQDHJTM-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
C[C@@](CO)([NH2+]Cc1ccnc(N)c1)c1cccc([N+](=O)[O-])c1	ZINC001175322372	777751216	/nfs/dbraw/zinc/75/12/16/777751216.db2.gz	CHLBPYAMKBIFBZ-HNNXBMFYSA-N	1	1	302.334	1.569	20	5		DDBDMO
Cc1n[nH]c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1C	ZINC001179353392	779341987	/nfs/dbraw/zinc/34/19/87/779341987.db2.gz	QPLQMPALFVGWAC-HNNXBMFYSA-N	1	1	304.350	1.932	20	5		DDBDMO
C[C@]1(CO)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC001116361045	780500389	/nfs/dbraw/zinc/50/03/89/780500389.db2.gz	FCCJVVVFSCJCGP-ZBFHGGJFSA-N	1	1	324.377	1.429	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC001116442119	780509866	/nfs/dbraw/zinc/50/98/66/780509866.db2.gz	IHJOAANFQBJTMH-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC001116442119	780509873	/nfs/dbraw/zinc/50/98/73/780509873.db2.gz	IHJOAANFQBJTMH-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)n1	ZINC001150120258	862099733	/nfs/dbraw/zinc/09/97/33/862099733.db2.gz	UWVZJAYITBMNDV-LKFCYVNXSA-N	1	1	304.350	1.511	20	5		DDBDMO
Cc1noc([C@]23COC[C@H]2C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C3)n1	ZINC001169019997	850518190	/nfs/dbraw/zinc/51/81/90/850518190.db2.gz	HMMQDZCPHPEFHA-RGCMKSIDSA-N	1	1	322.365	1.023	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1NCCn1cc[nH+]c1C	ZINC001156002043	862624832	/nfs/dbraw/zinc/62/48/32/862624832.db2.gz	NNSBSLPSIBWTKV-UHFFFAOYSA-N	1	1	305.294	1.393	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CC1=CCCCC1)C2	ZINC001072725852	857642252	/nfs/dbraw/zinc/64/22/52/857642252.db2.gz	TULKUKUKOWKVSE-HUUCEWRRSA-N	1	1	319.405	1.686	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CC1=CCCCC1)C2	ZINC001072725852	857642257	/nfs/dbraw/zinc/64/22/57/857642257.db2.gz	TULKUKUKOWKVSE-HUUCEWRRSA-N	1	1	319.405	1.686	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CC1=CCCCC1)C2	ZINC001072725852	857642261	/nfs/dbraw/zinc/64/22/61/857642261.db2.gz	TULKUKUKOWKVSE-HUUCEWRRSA-N	1	1	319.405	1.686	20	5		DDBDMO
CN1CC[C@@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1=O	ZINC001156508078	863111033	/nfs/dbraw/zinc/11/10/33/863111033.db2.gz	JUZJFUACAVSJOB-DUMNWFOQSA-N	1	1	305.338	1.165	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]21	ZINC001157266667	863696017	/nfs/dbraw/zinc/69/60/17/863696017.db2.gz	VXJIZHOIWLFAHZ-CABZTGNLSA-N	1	1	307.310	1.428	20	5		DDBDMO
COCCC[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1	ZINC001329819170	863875529	/nfs/dbraw/zinc/87/55/29/863875529.db2.gz	QKFHIKWXFMPEFT-CHWSQXEVSA-N	1	1	313.398	1.097	20	5		DDBDMO
Cc1ccc(-c2ccc(N[C@@H](N)CCC[NH3+])nn2)cc1[N+](=O)[O-]	ZINC001159786527	865523501	/nfs/dbraw/zinc/52/35/01/865523501.db2.gz	CSSREUWVKOXHJO-CQSZACIVSA-N	1	1	316.365	1.796	20	5		DDBDMO
O=[N+]([O-])c1cc[n+]([O-])c(Cl)c1N[C@H]1CC[N@H+](C2CCC2)C1	ZINC001161177633	866427986	/nfs/dbraw/zinc/42/79/86/866427986.db2.gz	QUWCJVKBAYGVRW-VIFPVBQESA-N	1	1	312.757	1.920	20	5		DDBDMO
CNc1c(C(=O)NCC[N@H+]2CC[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC001320379468	866691552	/nfs/dbraw/zinc/69/15/52/866691552.db2.gz	UXLPKYCCRPIZKE-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
C[NH+]1CCN(CCCNc2cc([N+](=O)[O-])c3nccn3c2)CC1	ZINC001161708605	866920865	/nfs/dbraw/zinc/92/08/65/866920865.db2.gz	OISCZVIEAKPBRM-UHFFFAOYSA-N	1	1	318.381	1.292	20	5		DDBDMO
C[NH+](C)[C@H]1CCCC[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC001320786413	867025673	/nfs/dbraw/zinc/02/56/73/867025673.db2.gz	ONEBDZLCOODHQS-KBPBESRZSA-N	1	1	307.350	1.903	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC2C[NH+](C(C)(C)C)C2)n1	ZINC001162225107	867358285	/nfs/dbraw/zinc/35/82/85/867358285.db2.gz	FVRHKJJZLYPVMS-UHFFFAOYSA-N	1	1	308.338	1.671	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC001324580462	867372638	/nfs/dbraw/zinc/37/26/38/867372638.db2.gz	MLGVWEUIYPRSNJ-QMTHXVAHSA-N	1	1	304.350	1.413	20	5		DDBDMO
CC[NH+](CC)CCNC(=N)Nc1ncc([N+](=O)[O-])cc1Cl	ZINC001163123094	868125937	/nfs/dbraw/zinc/12/59/37/868125937.db2.gz	YHZBTJOBQAQETF-UHFFFAOYSA-N	1	1	314.777	1.921	20	5		DDBDMO
[NH3+][C@H]1CN(c2c([N+](=O)[O-])cc[n+]([O-])c2Cl)CCC1(F)F	ZINC001164322504	869124987	/nfs/dbraw/zinc/12/49/87/869124987.db2.gz	BNLDUSDHLBAJOO-ZETCQYMHSA-N	1	1	308.672	1.054	20	5		DDBDMO
COCCC[NH+]1CCN(c2nc(Cl)ncc2[N+](=O)[O-])CC1	ZINC001165093823	869369816	/nfs/dbraw/zinc/36/98/16/869369816.db2.gz	HQHVJKKYCNGQAG-UHFFFAOYSA-N	1	1	315.761	1.197	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]C/C=C\c2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001317076035	870206809	/nfs/dbraw/zinc/20/68/09/870206809.db2.gz	LIMVVEIMNPSBKN-ORAZFKFHSA-N	1	1	315.373	1.602	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001226362591	882388529	/nfs/dbraw/zinc/38/85/29/882388529.db2.gz	XEMWQGCIJCGKMU-SNVBAGLBSA-N	1	1	310.306	1.473	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12	ZINC001339316049	870442050	/nfs/dbraw/zinc/44/20/50/870442050.db2.gz	GECHUHDHBHXLHO-DDTOSNHZSA-N	1	1	319.361	1.673	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[N@@H+](CC)[C@H](C)C1	ZINC001340011947	870837301	/nfs/dbraw/zinc/83/73/01/870837301.db2.gz	MQNPHMVJOQLWAR-GFCCVEGCSA-N	1	1	310.402	1.038	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNc2nn(C)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC001306922208	871381963	/nfs/dbraw/zinc/38/19/63/871381963.db2.gz	IJQSSDRFHYEKGK-QWRGUYRKSA-N	1	1	311.386	1.628	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CCOC)C1	ZINC001318598011	872161725	/nfs/dbraw/zinc/16/17/25/872161725.db2.gz	AUEOLIXDWKGMKM-NSHDSACASA-N	1	1	322.365	1.087	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC001318620817	872172448	/nfs/dbraw/zinc/17/24/48/872172448.db2.gz	ONLWQHOXZZFHQX-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CCC[C@@](C)(CO)C2)c1[N+](=O)[O-]	ZINC001342848864	872412252	/nfs/dbraw/zinc/41/22/52/872412252.db2.gz	ZAXKVEQDPTVJQU-OAHLLOKOSA-N	1	1	310.350	1.903	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@](C)(CO)C2)c1[N+](=O)[O-]	ZINC001342848864	872412260	/nfs/dbraw/zinc/41/22/60/872412260.db2.gz	ZAXKVEQDPTVJQU-OAHLLOKOSA-N	1	1	310.350	1.903	20	5		DDBDMO
Cc1ccc(CNC(=O)[C@H]2[NH2+]CCc3occc32)cc1[N+](=O)[O-]	ZINC001354523371	878036617	/nfs/dbraw/zinc/03/66/17/878036617.db2.gz	KIKQJTWIMPFLQF-HNNXBMFYSA-N	1	1	315.329	1.999	20	5		DDBDMO
CN(C)Cc1cc(F)ccc1OC(=O)C[C@@H](O)C[N+](C)(C)C	ZINC001229854015	884196330	/nfs/dbraw/zinc/19/63/30/884196330.db2.gz	KCCDVLYQXOZVPQ-CQSZACIVSA-N	1	1	313.393	1.250	20	5		DDBDMO
O[C@@H]1COCC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C1	ZINC001232218731	886165416	/nfs/dbraw/zinc/16/54/16/886165416.db2.gz	LCVIJHJRZGHYCO-INIZCTEOSA-N	1	1	309.369	1.976	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)n1	ZINC001234879539	888235959	/nfs/dbraw/zinc/23/59/59/888235959.db2.gz	QHOJMNAAGIZIAZ-XXILOJSOSA-N	1	1	307.306	1.181	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)n1	ZINC001234879539	888235973	/nfs/dbraw/zinc/23/59/73/888235973.db2.gz	QHOJMNAAGIZIAZ-XXILOJSOSA-N	1	1	307.306	1.181	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@](O)(CN)C1	ZINC001246554968	892693892	/nfs/dbraw/zinc/69/38/92/892693892.db2.gz	AFPPLSKFIXMXIR-XJKSGUPXSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@](O)(CN)C1	ZINC001246554968	892693894	/nfs/dbraw/zinc/69/38/94/892693894.db2.gz	AFPPLSKFIXMXIR-XJKSGUPXSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@@](O)(C[NH3+])C1	ZINC001246554968	892693898	/nfs/dbraw/zinc/69/38/98/892693898.db2.gz	AFPPLSKFIXMXIR-XJKSGUPXSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(C)C(=O)[C@H]2C1	ZINC001254555437	896498892	/nfs/dbraw/zinc/49/88/92/896498892.db2.gz	GMBJSQBYJSLDDZ-YUTCNCBUSA-N	1	1	303.362	1.546	20	5		DDBDMO
CN1C[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1=O	ZINC001254595039	896521231	/nfs/dbraw/zinc/52/12/31/896521231.db2.gz	HZXQIRKJVXYYCC-SNPRPXQTSA-N	1	1	301.346	1.082	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)c1	ZINC001262826140	900387389	/nfs/dbraw/zinc/38/73/89/900387389.db2.gz	CTNNKWSMTICKHI-FPMFFAJLSA-N	1	1	303.362	1.973	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000278364817	214119715	/nfs/dbraw/zinc/11/97/15/214119715.db2.gz	HUTNRHDWPRLVOG-JTQLQIEISA-N	1	1	323.397	1.683	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000295600024	529382040	/nfs/dbraw/zinc/38/20/40/529382040.db2.gz	CFWJYJJAUYDOOA-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000295788906	529382412	/nfs/dbraw/zinc/38/24/12/529382412.db2.gz	UWXUDCADGGURHZ-LLVKDONJSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000295788906	529382414	/nfs/dbraw/zinc/38/24/14/529382414.db2.gz	UWXUDCADGGURHZ-LLVKDONJSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](C(=O)NC(N)=O)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451543174	231122011	/nfs/dbraw/zinc/12/20/11/231122011.db2.gz	BDKDARNXQCSYSH-ZYHUDNBSSA-N	1	1	320.349	1.358	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC000444257504	529464959	/nfs/dbraw/zinc/46/49/59/529464959.db2.gz	DKKHMQNZYACXJE-NSHDSACASA-N	1	1	307.354	1.047	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccccn1	ZINC000090552230	185302684	/nfs/dbraw/zinc/30/26/84/185302684.db2.gz	CAFBBDYGDQQAGF-UHFFFAOYSA-N	1	1	302.334	1.674	20	5		DDBDMO
C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H](O)C(F)(F)F	ZINC000305755593	529926365	/nfs/dbraw/zinc/92/63/65/529926365.db2.gz	AOEXCNYHHUIRHZ-LLVKDONJSA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H](O)C(F)(F)F	ZINC000305755593	529926366	/nfs/dbraw/zinc/92/63/66/529926366.db2.gz	AOEXCNYHHUIRHZ-LLVKDONJSA-N	1	1	308.256	1.829	20	5		DDBDMO
CC(C)NC(=O)c1ccc(N2CC[N@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000615494248	362306551	/nfs/dbraw/zinc/30/65/51/362306551.db2.gz	IOYGRPGQPQFJOC-GFCCVEGCSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC(C)NC(=O)c1ccc(N2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000615494248	362306557	/nfs/dbraw/zinc/30/65/57/362306557.db2.gz	IOYGRPGQPQFJOC-GFCCVEGCSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000412411333	530054877	/nfs/dbraw/zinc/05/48/77/530054877.db2.gz	AVJCAKDQBNOHEC-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
C[NH+]1CCN(CCC(C)(C)Nc2ccc([N+](=O)[O-])cn2)CC1	ZINC000302241835	530072010	/nfs/dbraw/zinc/07/20/10/530072010.db2.gz	ITALNBXVHNZBDK-UHFFFAOYSA-N	1	1	307.398	1.818	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000330909830	232155081	/nfs/dbraw/zinc/15/50/81/232155081.db2.gz	PCAOEXHMXVKKFG-CMPLNLGQSA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[NH+](C3CC3)CC2)cccc1[N+](=O)[O-]	ZINC000616314203	362631170	/nfs/dbraw/zinc/63/11/70/362631170.db2.gz	BNLQKGXAYSYWJG-UHFFFAOYSA-N	1	1	318.377	1.893	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCOC1	ZINC000181862106	199364615	/nfs/dbraw/zinc/36/46/15/199364615.db2.gz	PTSJNEOHNTWFTD-KGLIPLIRSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000119414166	185741035	/nfs/dbraw/zinc/74/10/35/185741035.db2.gz	NZJZCCLVOOQJKR-LBPRGKRZSA-N	1	1	320.393	1.885	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748437	215111963	/nfs/dbraw/zinc/11/19/63/215111963.db2.gz	LEEKUTLAUHXQLY-RISCZKNCSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748437	215111965	/nfs/dbraw/zinc/11/19/65/215111965.db2.gz	LEEKUTLAUHXQLY-RISCZKNCSA-N	1	1	321.377	1.933	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](O)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000279910130	215229436	/nfs/dbraw/zinc/22/94/36/215229436.db2.gz	VQQBOZAYCXDVCC-AWEZNQCLSA-N	1	1	310.350	1.685	20	5		DDBDMO
CC[C@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000181868106	186212954	/nfs/dbraw/zinc/21/29/54/186212954.db2.gz	NAHURKVYNLBLOG-IHRRRGAJSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000181868106	186212955	/nfs/dbraw/zinc/21/29/55/186212955.db2.gz	NAHURKVYNLBLOG-IHRRRGAJSA-N	1	1	324.377	1.834	20	5		DDBDMO
CCOc1ccc([C@H](C)[NH2+]Cc2cnnn2C)cc1[N+](=O)[O-]	ZINC000287188748	219369630	/nfs/dbraw/zinc/36/96/30/219369630.db2.gz	CZVLZKKVHPLZTE-JTQLQIEISA-N	1	1	305.338	1.973	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000052502283	352613286	/nfs/dbraw/zinc/61/32/86/352613286.db2.gz	HOTCTJGMJXNREZ-LBPRGKRZSA-N	1	1	321.381	1.400	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000057004625	352794758	/nfs/dbraw/zinc/79/47/58/352794758.db2.gz	MYLCXFKOHRAFTH-UHFFFAOYSA-N	1	1	317.349	1.989	20	5		DDBDMO
C[N@@H+](CCNC(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-])C1CC1	ZINC000058858850	352855160	/nfs/dbraw/zinc/85/51/60/352855160.db2.gz	XVLHTLVXVZNNQQ-XVNBXDOJSA-N	1	1	307.325	1.958	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1ccc(C(=O)NC)cc1[N+](=O)[O-]	ZINC000064904662	352945707	/nfs/dbraw/zinc/94/57/07/352945707.db2.gz	CIIUEEGVYWLMNF-LBPRGKRZSA-N	1	1	306.366	1.851	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000067837655	353070098	/nfs/dbraw/zinc/07/00/98/353070098.db2.gz	SONSJJQFVUKQLN-CVEARBPZSA-N	1	1	317.389	1.680	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000068520254	353116567	/nfs/dbraw/zinc/11/65/67/353116567.db2.gz	BYDSONUEWRBGFN-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000174313578	198318220	/nfs/dbraw/zinc/31/82/20/198318220.db2.gz	WJDZJRWWWCUWAE-VXGBXAGGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000174313578	198318221	/nfs/dbraw/zinc/31/82/21/198318221.db2.gz	WJDZJRWWWCUWAE-VXGBXAGGSA-N	1	1	321.377	1.430	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000174473533	198338192	/nfs/dbraw/zinc/33/81/92/198338192.db2.gz	NLJIGWMMUFJNPY-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3sccc3C2)c1	ZINC000174702852	198372394	/nfs/dbraw/zinc/37/23/94/198372394.db2.gz	YROZFZDNIGTNTC-GFCCVEGCSA-N	1	1	308.363	1.272	20	5		DDBDMO
Cc1cnc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000078657974	353526920	/nfs/dbraw/zinc/52/69/20/353526920.db2.gz	USRGDATWKUFQML-GFCCVEGCSA-N	1	1	321.381	1.298	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cn[nH]c1	ZINC000085825089	353736730	/nfs/dbraw/zinc/73/67/30/353736730.db2.gz	KRAZGOYNMCAURI-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000617897648	363361150	/nfs/dbraw/zinc/36/11/50/363361150.db2.gz	CHZPGMGJJKHNIH-LBPRGKRZSA-N	1	1	323.349	1.954	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000617897648	363361156	/nfs/dbraw/zinc/36/11/56/363361156.db2.gz	CHZPGMGJJKHNIH-LBPRGKRZSA-N	1	1	323.349	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c2ncccc12	ZINC000405237176	354678038	/nfs/dbraw/zinc/67/80/38/354678038.db2.gz	UDFMHBYJNXBSHI-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
CCOc1cccc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c1[N+](=O)[O-]	ZINC000405639076	354679507	/nfs/dbraw/zinc/67/95/07/354679507.db2.gz	CDKWEEBJXMSMRV-NWDGAFQWSA-N	1	1	307.350	1.249	20	5		DDBDMO
COc1cccc(N2CC[C@@H]3OCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000585781964	354841280	/nfs/dbraw/zinc/84/12/80/354841280.db2.gz	GTKLYKWYLNOSMY-STQMWFEESA-N	1	1	307.350	1.513	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[C@H]([N@H+]3CC[C@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000588864062	354944575	/nfs/dbraw/zinc/94/45/75/354944575.db2.gz	ZWTFBWLLUHNZFK-KBPBESRZSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1cc(N2CC[NH+](C(C)(C)CO)CC2)c(F)cc1[N+](=O)[O-]	ZINC000589687894	355012286	/nfs/dbraw/zinc/01/22/86/355012286.db2.gz	BOQPMORYCIVZNM-UHFFFAOYSA-N	1	1	311.357	1.935	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC3(C[NH+](C)C3)C2)c1[N+](=O)[O-]	ZINC000590335538	355073485	/nfs/dbraw/zinc/07/34/85/355073485.db2.gz	LYXASCOTJWMZKS-UHFFFAOYSA-N	1	1	307.354	1.219	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000590522995	355107894	/nfs/dbraw/zinc/10/78/94/355107894.db2.gz	RYFQDHRKVXSRIC-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000590522995	355107896	/nfs/dbraw/zinc/10/78/96/355107896.db2.gz	RYFQDHRKVXSRIC-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590442878	355096457	/nfs/dbraw/zinc/09/64/57/355096457.db2.gz	HRYNJIYFQBPIJK-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590442878	355096459	/nfs/dbraw/zinc/09/64/59/355096459.db2.gz	HRYNJIYFQBPIJK-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590442878	355096460	/nfs/dbraw/zinc/09/64/60/355096460.db2.gz	HRYNJIYFQBPIJK-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000592530720	355616292	/nfs/dbraw/zinc/61/62/92/355616292.db2.gz	GILQIQUMOGUKBD-OCCSQVGLSA-N	1	1	308.334	1.259	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)CCO	ZINC000593107071	355800071	/nfs/dbraw/zinc/80/00/71/355800071.db2.gz	GILDHKCGXAPKOF-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000593109968	355802204	/nfs/dbraw/zinc/80/22/04/355802204.db2.gz	PIXIVZSIDJVRIG-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000593109968	355802206	/nfs/dbraw/zinc/80/22/06/355802206.db2.gz	PIXIVZSIDJVRIG-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC([N@@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000593131446	355808717	/nfs/dbraw/zinc/80/87/17/355808717.db2.gz	JKHHBHZMRMVCAW-CYBMUJFWSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC([N@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000593131446	355808720	/nfs/dbraw/zinc/80/87/20/355808720.db2.gz	JKHHBHZMRMVCAW-CYBMUJFWSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cn1ccnc1[C@@H]1C[NH2+]CCN1Cc1cc(O)ccc1[N+](=O)[O-]	ZINC000593727777	355977209	/nfs/dbraw/zinc/97/72/09/355977209.db2.gz	RVALRBHSRMWEPF-AWEZNQCLSA-N	1	1	317.349	1.180	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC[NH+]2CCCCC2)c1[N+](=O)[O-]	ZINC000593884102	356041070	/nfs/dbraw/zinc/04/10/70/356041070.db2.gz	QWVRRUINUNQXOK-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)C(C)(C)C1	ZINC000594356835	356180989	/nfs/dbraw/zinc/18/09/89/356180989.db2.gz	SGPNQSLHTDIEOB-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)C(C)(C)C1	ZINC000594356835	356180991	/nfs/dbraw/zinc/18/09/91/356180991.db2.gz	SGPNQSLHTDIEOB-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)C(=O)NCCF	ZINC000595040803	356376199	/nfs/dbraw/zinc/37/61/99/356376199.db2.gz	XWBNLDADXVHTAV-VHSXEESVSA-N	1	1	313.329	1.728	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000595328537	356450796	/nfs/dbraw/zinc/45/07/96/356450796.db2.gz	WMNDGZHOEHCGJF-ZDUSSCGKSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000595328537	356450798	/nfs/dbraw/zinc/45/07/98/356450798.db2.gz	WMNDGZHOEHCGJF-ZDUSSCGKSA-N	1	1	323.368	1.888	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000595470278	356506097	/nfs/dbraw/zinc/50/60/97/356506097.db2.gz	SWJNAMGGXBDCDT-CQSZACIVSA-N	1	1	320.393	1.921	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1onc(C)c1[N+](=O)[O-]	ZINC000595473748	356507348	/nfs/dbraw/zinc/50/73/48/356507348.db2.gz	BKVZWSLTKUAJPK-NSHDSACASA-N	1	1	310.354	1.772	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-]	ZINC000595473748	356507353	/nfs/dbraw/zinc/50/73/53/356507353.db2.gz	BKVZWSLTKUAJPK-NSHDSACASA-N	1	1	310.354	1.772	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595687526	356610602	/nfs/dbraw/zinc/61/06/02/356610602.db2.gz	BRYMRECMQFUFOQ-IYBDPMFKSA-N	1	1	319.361	1.892	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595687526	356610605	/nfs/dbraw/zinc/61/06/05/356610605.db2.gz	BRYMRECMQFUFOQ-IYBDPMFKSA-N	1	1	319.361	1.892	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H]3NC(=O)CC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000595744272	356632553	/nfs/dbraw/zinc/63/25/53/356632553.db2.gz	VHQBGQPZIFARMN-OLZOCXBDSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[N@H+](CC1=CCCOC1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595753718	356637320	/nfs/dbraw/zinc/63/73/20/356637320.db2.gz	SSAOVNHCALRLBL-OAHLLOKOSA-N	1	1	322.361	1.613	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595760046	356641206	/nfs/dbraw/zinc/64/12/06/356641206.db2.gz	RWXVRWRSACDOHN-LRDDRELGSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595760046	356641208	/nfs/dbraw/zinc/64/12/08/356641208.db2.gz	RWXVRWRSACDOHN-LRDDRELGSA-N	1	1	319.361	1.810	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596117156	356779417	/nfs/dbraw/zinc/77/94/17/356779417.db2.gz	XDESJUKSJYHIHW-LBPRGKRZSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596076200	356763490	/nfs/dbraw/zinc/76/34/90/356763490.db2.gz	MVNMVAAVWOYGEN-LLVKDONJSA-N	1	1	306.366	1.980	20	5		DDBDMO
O=c1[nH]ccc(N2CCC([N@H+]3CCCOCC3)CC2)c1[N+](=O)[O-]	ZINC000596268966	356838643	/nfs/dbraw/zinc/83/86/43/356838643.db2.gz	OQCJTGVYSBKKKL-UHFFFAOYSA-N	1	1	322.365	1.387	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000596309344	356853337	/nfs/dbraw/zinc/85/33/37/356853337.db2.gz	ZEVKPZNTHLNVTE-LLVKDONJSA-N	1	1	306.366	1.978	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000597202565	357091231	/nfs/dbraw/zinc/09/12/31/357091231.db2.gz	FIMXWALZITXXGG-INIZCTEOSA-N	1	1	305.378	1.810	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000597574710	357233856	/nfs/dbraw/zinc/23/38/56/357233856.db2.gz	GYMOQASUKBQMRM-NWDGAFQWSA-N	1	1	310.329	1.192	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000597604468	357250415	/nfs/dbraw/zinc/25/04/15/357250415.db2.gz	IMSIQHUDIYFBQC-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000597924424	357384028	/nfs/dbraw/zinc/38/40/28/357384028.db2.gz	REYRUZZVKXTJLI-SNVBAGLBSA-N	1	1	306.366	1.780	20	5		DDBDMO
CCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@H]1CC[N@@H+](CC)C1	ZINC000598041822	357439801	/nfs/dbraw/zinc/43/98/01/357439801.db2.gz	NKCTVYMJVXRVRV-NSHDSACASA-N	1	1	309.370	1.193	20	5		DDBDMO
[NH3+][C@@]12CCC[C@H]1CN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2	ZINC000598668052	357678257	/nfs/dbraw/zinc/67/82/57/357678257.db2.gz	OOELQRKTFWLWFA-BJOHPYRUSA-N	1	1	315.333	1.425	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000598627426	357660771	/nfs/dbraw/zinc/66/07/71/357660771.db2.gz	PYRKGRUNHCLYLY-OAHLLOKOSA-N	1	1	320.349	1.308	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1CO	ZINC000598645103	357667925	/nfs/dbraw/zinc/66/79/25/357667925.db2.gz	DOKXKCKRNLTKSL-FZMZJTMJSA-N	1	1	322.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3nccnn3)CC2)cc1	ZINC000599509664	357960227	/nfs/dbraw/zinc/96/02/27/357960227.db2.gz	NCJUMMKSRBMRLS-UHFFFAOYSA-N	1	1	314.349	1.145	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1C[C@@H](CO)[C@H](CO)C1	ZINC000599531090	357965061	/nfs/dbraw/zinc/96/50/61/357965061.db2.gz	HSJZUYMHOXTWRB-QWRGUYRKSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CCC([NH+]2CCOCC2)CC1	ZINC000600105275	358123523	/nfs/dbraw/zinc/12/35/23/358123523.db2.gz	JHPGWHZBTKOTMK-UHFFFAOYSA-N	1	1	319.361	1.532	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000600190539	358150680	/nfs/dbraw/zinc/15/06/80/358150680.db2.gz	GWZFWJLAYGPXME-WRLNGNIRSA-N	1	1	320.345	1.872	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000600190539	358150684	/nfs/dbraw/zinc/15/06/84/358150684.db2.gz	GWZFWJLAYGPXME-WRLNGNIRSA-N	1	1	320.345	1.872	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000600313122	358192907	/nfs/dbraw/zinc/19/29/07/358192907.db2.gz	HXEYEHYAIFVWLX-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccco1	ZINC000180595137	199181498	/nfs/dbraw/zinc/18/14/98/199181498.db2.gz	WWEWMOSPLFJYQE-GFCCVEGCSA-N	1	1	318.333	1.803	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C(C)(C)C(=O)NCC(C)(C)C	ZINC000348084238	283360157	/nfs/dbraw/zinc/36/01/57/283360157.db2.gz	ZUZCTNBPUPFDRQ-UHFFFAOYSA-N	1	1	311.386	1.359	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000600959675	358357324	/nfs/dbraw/zinc/35/73/24/358357324.db2.gz	ZCOUENRHWQPYKH-LSDHHAIUSA-N	1	1	320.393	1.853	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(NCC[N@H+]3CCCOCC3)c2c1	ZINC000601151176	358423376	/nfs/dbraw/zinc/42/33/76/358423376.db2.gz	QSYMSBGJYKQUCB-UHFFFAOYSA-N	1	1	316.361	1.699	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCO[C@H](C(F)F)CC1	ZINC000601978661	358763566	/nfs/dbraw/zinc/76/35/66/358763566.db2.gz	ZPMJTWCVOOXDPB-NSHDSACASA-N	1	1	317.292	1.113	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCO[C@H](C(F)F)CC1	ZINC000601978661	358763567	/nfs/dbraw/zinc/76/35/67/358763567.db2.gz	ZPMJTWCVOOXDPB-NSHDSACASA-N	1	1	317.292	1.113	20	5		DDBDMO
C[N@@H+]1CCCC[C@H]1C(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602195915	358876734	/nfs/dbraw/zinc/87/67/34/358876734.db2.gz	MSYJFYDMDLIOSR-GOEBONIOSA-N	1	1	321.377	1.403	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602195915	358876735	/nfs/dbraw/zinc/87/67/35/358876735.db2.gz	MSYJFYDMDLIOSR-GOEBONIOSA-N	1	1	321.377	1.403	20	5		DDBDMO
CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602472773	359001614	/nfs/dbraw/zinc/00/16/14/359001614.db2.gz	PNTHPHGWRCUCJU-QWHCGFSZSA-N	1	1	324.381	1.080	20	5		DDBDMO
CO[C@]1(C[NH+]2CC(Oc3ccc([N+](=O)[O-])cc3)C2)CCOC1	ZINC000602689583	359126835	/nfs/dbraw/zinc/12/68/35/359126835.db2.gz	XXRSPIKHGQWYBM-HNNXBMFYSA-N	1	1	308.334	1.463	20	5		DDBDMO
CC(=O)N1CC[N@H+](CCn2c(C)ncc2[N+](=O)[O-])C(C)(C)C1	ZINC000602804064	359202632	/nfs/dbraw/zinc/20/26/32/359202632.db2.gz	HSHWBXGWURTLKO-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC(=O)N1CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C(C)(C)C1	ZINC000602804064	359202634	/nfs/dbraw/zinc/20/26/34/359202634.db2.gz	HSHWBXGWURTLKO-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCO)Cc1ccc(C)cc1	ZINC000602807999	359205548	/nfs/dbraw/zinc/20/55/48/359205548.db2.gz	XTKYPGAHAJOZIT-UHFFFAOYSA-N	1	1	318.377	1.903	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@]2(C)C(=O)NC(=O)[C@]2(C)C1	ZINC000602937109	359306472	/nfs/dbraw/zinc/30/64/72/359306472.db2.gz	QIGDTKNJHJIJRX-CIISACIHSA-N	1	1	317.345	1.640	20	5		DDBDMO
COc1ccc(OCCN[C@H]2C[C@H]([NH3+])C2(C)C)c([N+](=O)[O-])c1	ZINC000603430957	359634933	/nfs/dbraw/zinc/63/49/33/359634933.db2.gz	DDEHABNBOZKNCT-KBPBESRZSA-N	1	1	309.366	1.698	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000186954900	200037270	/nfs/dbraw/zinc/03/72/70/200037270.db2.gz	QPAILHDQOPQQMG-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000186954900	200037271	/nfs/dbraw/zinc/03/72/71/200037271.db2.gz	QPAILHDQOPQQMG-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1CC(C)(C)O	ZINC000188724490	200294826	/nfs/dbraw/zinc/29/48/26/200294826.db2.gz	NHORKUKLNIPIQQ-LBPRGKRZSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000188724490	200294828	/nfs/dbraw/zinc/29/48/28/200294828.db2.gz	NHORKUKLNIPIQQ-LBPRGKRZSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000609257575	360276895	/nfs/dbraw/zinc/27/68/95/360276895.db2.gz	BRNUSBPNJJNBCF-AWEZNQCLSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000611165978	360643348	/nfs/dbraw/zinc/64/33/48/360643348.db2.gz	RNBLRTDBZXVZHP-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000611223064	360666871	/nfs/dbraw/zinc/66/68/71/360666871.db2.gz	QFCAMVJYTOTHEO-LLVKDONJSA-N	1	1	314.345	1.967	20	5		DDBDMO
C[N@H+]1CC=C(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611443365	360721521	/nfs/dbraw/zinc/72/15/21/360721521.db2.gz	HIRNBBMHCYGGIH-UHFFFAOYSA-N	1	1	319.361	1.718	20	5		DDBDMO
C[N@@H+]1CC=C(CNCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611443365	360721525	/nfs/dbraw/zinc/72/15/25/360721525.db2.gz	HIRNBBMHCYGGIH-UHFFFAOYSA-N	1	1	319.361	1.718	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CC(=O)N1CC[NH+](C)CC1	ZINC000611680914	360790661	/nfs/dbraw/zinc/79/06/61/360790661.db2.gz	JKNLWEVGYNAYQO-CYBMUJFWSA-N	1	1	320.393	1.362	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCC1=CC[N@@H+](C)CC1	ZINC000271922730	209326106	/nfs/dbraw/zinc/32/61/06/209326106.db2.gz	KOAPBCHOSPQAFV-UHFFFAOYSA-N	1	1	318.377	1.653	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@]1(CO)CCOC1	ZINC000613130199	361282565	/nfs/dbraw/zinc/28/25/65/361282565.db2.gz	ABAPDAZDUQURPR-HNNXBMFYSA-N	1	1	310.350	1.447	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252432	363945430	/nfs/dbraw/zinc/94/54/30/363945430.db2.gz	LKXFTCIZXGATTF-JQWIXIFHSA-N	1	1	322.340	1.435	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619253548	363946691	/nfs/dbraw/zinc/94/66/91/363946691.db2.gz	YTAIDAHXHDPLKB-HUUCEWRRSA-N	1	1	321.352	1.782	20	5		DDBDMO
Cn1ccc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1=O	ZINC000619785214	364149454	/nfs/dbraw/zinc/14/94/54/364149454.db2.gz	LCFRCBATPYLGPG-UHFFFAOYSA-N	1	1	301.346	1.968	20	5		DDBDMO
CNC(=O)c1ccc(NCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000271823367	209246320	/nfs/dbraw/zinc/24/63/20/209246320.db2.gz	NQUCBOBMUHDPIB-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
C[NH+](C)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000288187998	220006209	/nfs/dbraw/zinc/00/62/09/220006209.db2.gz	NIDYBWUPSAVZGM-NSHDSACASA-N	1	1	321.312	1.490	20	5		DDBDMO
C[N@@H+](CCCC(=O)OC(C)(C)C)CCn1cc([N+](=O)[O-])cn1	ZINC000350057802	284140075	/nfs/dbraw/zinc/14/00/75/284140075.db2.gz	BETFKLVXGIMLHR-UHFFFAOYSA-N	1	1	312.370	1.845	20	5		DDBDMO
O=C(C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)NCc1ccco1	ZINC000350620306	284222267	/nfs/dbraw/zinc/22/22/67/284222267.db2.gz	VILJMSNAQUTQSY-UHFFFAOYSA-N	1	1	307.281	1.733	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000264423232	203914543	/nfs/dbraw/zinc/91/45/43/203914543.db2.gz	OKYIYRKALQQFDT-UHFFFAOYSA-N	1	1	323.397	1.825	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000288346445	220098871	/nfs/dbraw/zinc/09/88/71/220098871.db2.gz	KBFGBQNTLRCIKJ-UHFFFAOYSA-N	1	1	314.345	1.879	20	5		DDBDMO
C[C@@H]1c2ccsc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266382014	205305207	/nfs/dbraw/zinc/30/52/07/205305207.db2.gz	AYSUYPNZTOOVQW-PWSUYJOCSA-N	1	1	322.390	1.833	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CC[N@H+]1C[C@@H](C)O	ZINC000266392087	205313988	/nfs/dbraw/zinc/31/39/88/205313988.db2.gz	OEAXAAZFFRTDEK-OLZOCXBDSA-N	1	1	323.393	1.885	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N(C)C[C@@H]2C[C@H](OC)C[N@@H+]2C)c1	ZINC000284465712	218038861	/nfs/dbraw/zinc/03/88/61/218038861.db2.gz	FIXVWZPIMXMRRV-AAEUAGOBSA-N	1	1	309.366	1.759	20	5		DDBDMO
CC[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000105827361	194138544	/nfs/dbraw/zinc/13/85/44/194138544.db2.gz	XGBSDKIGFSONRA-DGCLKSJQSA-N	1	1	313.423	1.933	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1	ZINC000054132596	183925575	/nfs/dbraw/zinc/92/55/75/183925575.db2.gz	UEMZALVBPHHKHO-UHFFFAOYSA-N	1	1	314.773	1.900	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000110991880	194378888	/nfs/dbraw/zinc/37/88/88/194378888.db2.gz	MFJGGWJKWKODBV-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](O)C[C@H]1C	ZINC000340925920	251281124	/nfs/dbraw/zinc/28/11/24/251281124.db2.gz	IVVXCMIYBPCONN-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000272951041	210338251	/nfs/dbraw/zinc/33/82/51/210338251.db2.gz	MRXDCBVLZAMSQC-JTQLQIEISA-N	1	1	304.350	1.557	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2ccncc2)CC1	ZINC000298070856	285165918	/nfs/dbraw/zinc/16/59/18/285165918.db2.gz	KZUBHBAHPBBLIP-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](CC1(O)CCOCC1)CCO2	ZINC000352706381	285242695	/nfs/dbraw/zinc/24/26/95/285242695.db2.gz	NGJVVRSLUUBVDD-UHFFFAOYSA-N	1	1	308.334	1.331	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CC1(O)CCOCC1)CCO2	ZINC000352706381	285242699	/nfs/dbraw/zinc/24/26/99/285242699.db2.gz	NGJVVRSLUUBVDD-UHFFFAOYSA-N	1	1	308.334	1.331	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1[C@@H]1CCCO1	ZINC000289683206	221150786	/nfs/dbraw/zinc/15/07/86/221150786.db2.gz	HUCLQSZCLQRODY-DZGCQCFKSA-N	1	1	321.377	1.646	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@@H]3[NH2+]CC3(C)C)CC2)c1[N+](=O)[O-]	ZINC000424043578	533661462	/nfs/dbraw/zinc/66/14/62/533661462.db2.gz	QYWCXPAUWFOBMK-ZDUSSCGKSA-N	1	1	321.381	1.477	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1	ZINC000008201126	406780495	/nfs/dbraw/zinc/78/04/95/406780495.db2.gz	DZFBYMUHDJAUBF-UHFFFAOYSA-N	1	1	318.377	1.947	20	5		DDBDMO
CN(C)c1cccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)c1	ZINC000089922865	407159024	/nfs/dbraw/zinc/15/90/24/407159024.db2.gz	ZEOSJVIHJYDDMJ-UHFFFAOYSA-N	1	1	303.366	1.989	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000108783533	407390260	/nfs/dbraw/zinc/39/02/60/407390260.db2.gz	YJLFDOAIYHQATA-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCc3cccc(F)c3C2)c1	ZINC000270983031	407450558	/nfs/dbraw/zinc/45/05/58/407450558.db2.gz	ADWGACYCJSBJLQ-CYBMUJFWSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3cccc(F)c3C2)c1	ZINC000270983031	407450566	/nfs/dbraw/zinc/45/05/66/407450566.db2.gz	ADWGACYCJSBJLQ-CYBMUJFWSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCCC[NH+]2CCOCC2)c(Cl)c1	ZINC000227647607	407636298	/nfs/dbraw/zinc/63/62/98/407636298.db2.gz	BSTMMADMHDFJQT-UHFFFAOYSA-N	1	1	300.746	1.777	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CC[NH2+]C1	ZINC000178891392	407644470	/nfs/dbraw/zinc/64/44/70/407644470.db2.gz	NTLIJMQGVCYXMO-NSHDSACASA-N	1	1	317.349	1.685	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000271375869	407659115	/nfs/dbraw/zinc/65/91/15/407659115.db2.gz	WPFUZZUGILPNHX-CQSZACIVSA-N	1	1	306.366	1.655	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](CO)C1	ZINC000266944688	407687365	/nfs/dbraw/zinc/68/73/65/407687365.db2.gz	SDJASJLSMKFQBQ-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
CC[C@H]1CN(c2nccc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000115517065	407690496	/nfs/dbraw/zinc/69/04/96/407690496.db2.gz	LHWXDKDBNPZDAD-OLZOCXBDSA-N	1	1	308.382	1.580	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000171730929	407750431	/nfs/dbraw/zinc/75/04/31/407750431.db2.gz	WAWRXJKWWOFGMD-QWRGUYRKSA-N	1	1	323.397	1.731	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])cc1F	ZINC000268223921	407955870	/nfs/dbraw/zinc/95/58/70/407955870.db2.gz	SZLCFEGQVFGEOX-JTQLQIEISA-N	1	1	312.345	1.400	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154073202	407964147	/nfs/dbraw/zinc/96/41/47/407964147.db2.gz	ZPEPUSSEUVKUTB-GUTXKFCHSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1OC[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154073202	407964151	/nfs/dbraw/zinc/96/41/51/407964151.db2.gz	ZPEPUSSEUVKUTB-GUTXKFCHSA-N	1	1	324.377	1.752	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000272463667	407935345	/nfs/dbraw/zinc/93/53/45/407935345.db2.gz	OUJJYRCAUYOZJU-SNVBAGLBSA-N	1	1	304.350	1.391	20	5		DDBDMO
CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@H](O)C(F)(F)F	ZINC000189465474	408026078	/nfs/dbraw/zinc/02/60/78/408026078.db2.gz	ZQRISUIKUDBWHW-NEPJUHHUSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@H](O)C(F)(F)F	ZINC000189465474	408026083	/nfs/dbraw/zinc/02/60/83/408026083.db2.gz	ZQRISUIKUDBWHW-NEPJUHHUSA-N	1	1	322.283	1.873	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCOC3(CCC3)C2)c1	ZINC000154157939	407985709	/nfs/dbraw/zinc/98/57/09/407985709.db2.gz	HASUCRIQGLQWSF-CQSZACIVSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCOC3(CCC3)C2)c1	ZINC000154157939	407985718	/nfs/dbraw/zinc/98/57/18/407985718.db2.gz	HASUCRIQGLQWSF-CQSZACIVSA-N	1	1	322.361	1.589	20	5		DDBDMO
COC(=O)C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000136808317	408125948	/nfs/dbraw/zinc/12/59/48/408125948.db2.gz	NULWSPSWONPSNB-CQSZACIVSA-N	1	1	308.334	1.513	20	5		DDBDMO
CC(C)(C)[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O	ZINC000273244424	408123655	/nfs/dbraw/zinc/12/36/55/408123655.db2.gz	GERNIQHYFXWIGT-KBPBESRZSA-N	1	1	323.393	1.485	20	5		DDBDMO
C[NH+](C)C[C@@H](Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000137398937	408152109	/nfs/dbraw/zinc/15/21/09/408152109.db2.gz	HSXOLVZQDWWPKX-GFCCVEGCSA-N	1	1	317.349	1.221	20	5		DDBDMO
CC[N@@H+]1CCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000273672018	408284758	/nfs/dbraw/zinc/28/47/58/408284758.db2.gz	XTDAGKBEKNNNIU-UHFFFAOYSA-N	1	1	313.379	1.311	20	5		DDBDMO
CC[N@H+]1CCCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000273672018	408284762	/nfs/dbraw/zinc/28/47/62/408284762.db2.gz	XTDAGKBEKNNNIU-UHFFFAOYSA-N	1	1	313.379	1.311	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209134	408354703	/nfs/dbraw/zinc/35/47/03/408354703.db2.gz	IIRBZIFUPCGPBY-SRVKXCTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209134	408354711	/nfs/dbraw/zinc/35/47/11/408354711.db2.gz	IIRBZIFUPCGPBY-SRVKXCTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O	ZINC000247021290	408389868	/nfs/dbraw/zinc/38/98/68/408389868.db2.gz	CQQJVZJJQAKOOM-DZGCQCFKSA-N	1	1	307.394	1.872	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)n1	ZINC000191627793	408458948	/nfs/dbraw/zinc/45/89/48/408458948.db2.gz	HQZPCCQHNFPMGY-NSHDSACASA-N	1	1	309.370	1.223	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)n1	ZINC000191627793	408458951	/nfs/dbraw/zinc/45/89/51/408458951.db2.gz	HQZPCCQHNFPMGY-NSHDSACASA-N	1	1	309.370	1.223	20	5		DDBDMO
O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H]1CCC[N@H+]1C1CCCC1	ZINC000269743850	408413092	/nfs/dbraw/zinc/41/30/92/408413092.db2.gz	XXPVOWQDCPYLDH-CQSZACIVSA-N	1	1	321.381	1.315	20	5		DDBDMO
CCCC[N@@H+](C)CC1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000160989702	408547504	/nfs/dbraw/zinc/54/75/04/408547504.db2.gz	PQUQDZHHJHGBRD-UHFFFAOYSA-N	1	1	323.397	1.902	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000248620978	408601472	/nfs/dbraw/zinc/60/14/72/408601472.db2.gz	MXOZXUWPJWJYAP-JOYOIKCWSA-N	1	1	307.354	1.031	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C[C@H]2C1	ZINC000192471540	408592621	/nfs/dbraw/zinc/59/26/21/408592621.db2.gz	YBQYASOGAZKSTO-PHIMTYICSA-N	1	1	314.345	1.710	20	5		DDBDMO
C[C@H](c1ccccn1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680759	408634746	/nfs/dbraw/zinc/63/47/46/408634746.db2.gz	URCSPOHINMCOLU-DGCLKSJQSA-N	1	1	305.338	1.240	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000249545169	408739577	/nfs/dbraw/zinc/73/95/77/408739577.db2.gz	GAVVBQOOGJOHDK-UONOGXRCSA-N	1	1	307.394	1.963	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H](C)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000193144325	408700842	/nfs/dbraw/zinc/70/08/42/408700842.db2.gz	LKADIABDQJIAOG-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@](C)(O)C1	ZINC000177973348	408747479	/nfs/dbraw/zinc/74/74/79/408747479.db2.gz	PZHIEVNLIZETFC-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CC[C@H](n3cccn3)C2)c([N+](=O)[O-])c1	ZINC000291664772	408904036	/nfs/dbraw/zinc/90/40/36/408904036.db2.gz	GAEIRKSWJPDVRS-ZDUSSCGKSA-N	1	1	315.333	1.337	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H](n3cccn3)C2)c([N+](=O)[O-])c1	ZINC000291664772	408904038	/nfs/dbraw/zinc/90/40/38/408904038.db2.gz	GAEIRKSWJPDVRS-ZDUSSCGKSA-N	1	1	315.333	1.337	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014901	408907824	/nfs/dbraw/zinc/90/78/24/408907824.db2.gz	PPOATBOMPSLUMF-AAEUAGOBSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014901	408907828	/nfs/dbraw/zinc/90/78/28/408907828.db2.gz	PPOATBOMPSLUMF-AAEUAGOBSA-N	1	1	311.407	1.951	20	5		DDBDMO
Cc1cccc2c1C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000277371229	408928962	/nfs/dbraw/zinc/92/89/62/408928962.db2.gz	XQOXCLZKSKOMCX-HNNXBMFYSA-N	1	1	316.361	1.519	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[NH2+]CC[C@@H]2C1	ZINC000293348103	409095134	/nfs/dbraw/zinc/09/51/34/409095134.db2.gz	JVKUNBLDPVIUAQ-BXKDBHETSA-N	1	1	315.333	1.295	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000295281883	409412549	/nfs/dbraw/zinc/41/25/49/409412549.db2.gz	DBVALEKCJDGWDI-CVEARBPZSA-N	1	1	321.377	1.379	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](C2CC2)C2COC2)c1	ZINC000295325608	409435364	/nfs/dbraw/zinc/43/53/64/409435364.db2.gz	GZHFOVMQDNIBHD-CQSZACIVSA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+](C2CC2)C2COC2)c1	ZINC000295325608	409435368	/nfs/dbraw/zinc/43/53/68/409435368.db2.gz	GZHFOVMQDNIBHD-CQSZACIVSA-N	1	1	308.334	1.198	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000408113025	164231608	/nfs/dbraw/zinc/23/16/08/164231608.db2.gz	PTELMGFNEXKVKT-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000408113025	164231610	/nfs/dbraw/zinc/23/16/10/164231610.db2.gz	PTELMGFNEXKVKT-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000408111931	164231659	/nfs/dbraw/zinc/23/16/59/164231659.db2.gz	GFZLVOBDUXKHMM-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000408111931	164231661	/nfs/dbraw/zinc/23/16/61/164231661.db2.gz	GFZLVOBDUXKHMM-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000408128959	164236385	/nfs/dbraw/zinc/23/63/85/164236385.db2.gz	MLEWTVLSYRLYIP-MWLCHTKSSA-N	1	1	309.370	1.049	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000408130126	164237400	/nfs/dbraw/zinc/23/74/00/164237400.db2.gz	SVISMLNEOMLWSX-ONGXEEELSA-N	1	1	309.370	1.191	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)CCO1	ZINC000408464936	164340097	/nfs/dbraw/zinc/34/00/97/164340097.db2.gz	GFKRESWQZPWBLU-NSHDSACASA-N	1	1	324.356	1.818	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)CN(C)C	ZINC000344855576	409534294	/nfs/dbraw/zinc/53/42/94/409534294.db2.gz	GJJFEKCRZUZRGL-RQPMMQJISA-N	1	1	307.394	1.900	20	5		DDBDMO
CO[C@H](C)C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)C	ZINC000354367297	409800433	/nfs/dbraw/zinc/80/04/33/409800433.db2.gz	JSASUAXXZZLBSD-LLVKDONJSA-N	1	1	309.366	1.939	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2COC[C@H](C1)O2)Nc1ccc([N+](=O)[O-])cc1	ZINC000338373529	409947978	/nfs/dbraw/zinc/94/79/78/409947978.db2.gz	YYXNBDYESRIFSX-OKILXGFUSA-N	1	1	321.333	1.023	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC[C@H](C1)O2)Nc1ccc([N+](=O)[O-])cc1	ZINC000338373529	409947988	/nfs/dbraw/zinc/94/79/88/409947988.db2.gz	YYXNBDYESRIFSX-OKILXGFUSA-N	1	1	321.333	1.023	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357392603	410010343	/nfs/dbraw/zinc/01/03/43/410010343.db2.gz	OAOIUFQQRAXKPC-OLZOCXBDSA-N	1	1	320.393	1.996	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000342938706	410014400	/nfs/dbraw/zinc/01/44/00/410014400.db2.gz	YLCKWYJLAPFHJZ-MNOVXSKESA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000342938706	410014403	/nfs/dbraw/zinc/01/44/03/410014403.db2.gz	YLCKWYJLAPFHJZ-MNOVXSKESA-N	1	1	322.365	1.614	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000298517401	410270295	/nfs/dbraw/zinc/27/02/95/410270295.db2.gz	LDOJPBINKHPESP-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000351774797	410225568	/nfs/dbraw/zinc/22/55/68/410225568.db2.gz	NXSDZXPXNLWHRK-HONMWMINSA-N	1	1	305.334	1.013	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000351774797	410225575	/nfs/dbraw/zinc/22/55/75/410225575.db2.gz	NXSDZXPXNLWHRK-HONMWMINSA-N	1	1	305.334	1.013	20	5		DDBDMO
CC[N@H+](CCOC)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000299126288	410536246	/nfs/dbraw/zinc/53/62/46/410536246.db2.gz	IWUBYLWBTPKNEA-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
CC[N@@H+](CCOC)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000299126288	410536252	/nfs/dbraw/zinc/53/62/52/410536252.db2.gz	IWUBYLWBTPKNEA-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
[NH3+]CCCN(CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000359301687	410590554	/nfs/dbraw/zinc/59/05/54/410590554.db2.gz	HYVRSDHBAYSNQH-UHFFFAOYSA-N	1	1	303.366	1.642	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C[C@H](C)O	ZINC000352203663	410545097	/nfs/dbraw/zinc/54/50/97/410545097.db2.gz	ULBARGKSGKWQNN-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cc1c(CNC(=O)N2CCC[N@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000359552646	410727610	/nfs/dbraw/zinc/72/76/10/410727610.db2.gz	OAWYOMSVXHXCKW-UHFFFAOYSA-N	1	1	306.366	1.750	20	5		DDBDMO
Cc1ccc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000301801011	410800083	/nfs/dbraw/zinc/80/00/83/410800083.db2.gz	CDCBZRKHKIKDNX-CYBMUJFWSA-N	1	1	320.393	1.903	20	5		DDBDMO
Cc1c([C@@H](C)NC[C@@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673534	410866008	/nfs/dbraw/zinc/86/60/08/410866008.db2.gz	HKGPOMFCILMVPH-ZIAGYGMSSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1c([C@@H](C)NC[C@@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673534	410866012	/nfs/dbraw/zinc/86/60/12/410866012.db2.gz	HKGPOMFCILMVPH-ZIAGYGMSSA-N	1	1	306.410	1.800	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344068257	410934309	/nfs/dbraw/zinc/93/43/09/410934309.db2.gz	QIRRRIFZUGCELZ-XFMPKHEZSA-N	1	1	322.361	1.037	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](C)[C@H]1CO	ZINC000331294382	411061957	/nfs/dbraw/zinc/06/19/57/411061957.db2.gz	XZKWBZGIPPBQTD-ZWNOBZJWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H]1CO	ZINC000331294382	411061962	/nfs/dbraw/zinc/06/19/62/411061962.db2.gz	XZKWBZGIPPBQTD-ZWNOBZJWSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H](CO)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353499268	411034744	/nfs/dbraw/zinc/03/47/44/411034744.db2.gz	CSPAYDOANSEHGE-RISCZKNCSA-N	1	1	304.350	1.636	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356451576	411039295	/nfs/dbraw/zinc/03/92/95/411039295.db2.gz	WTHBDLYEHCOUTL-GRYCIOLGSA-N	1	1	323.397	1.425	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000344370455	411096009	/nfs/dbraw/zinc/09/60/09/411096009.db2.gz	HXIQAROTPOZZGG-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000344370455	411096012	/nfs/dbraw/zinc/09/60/12/411096012.db2.gz	HXIQAROTPOZZGG-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ncccn2)n1	ZINC000580661001	422947347	/nfs/dbraw/zinc/94/73/47/422947347.db2.gz	ZPSQVWMXBWWMEI-NEPJUHHUSA-N	1	1	302.338	1.855	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000600314888	416617903	/nfs/dbraw/zinc/61/79/03/416617903.db2.gz	QHCJHOWBDQSUPR-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
CC[NH+]1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1	ZINC000042376668	418422855	/nfs/dbraw/zinc/42/28/55/418422855.db2.gz	BOIASYWHWUNWPG-UHFFFAOYSA-N	1	1	315.171	1.894	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000366333440	418458785	/nfs/dbraw/zinc/45/87/85/418458785.db2.gz	QLABRMUEZBXUPI-NXEZZACHSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000366333440	418458787	/nfs/dbraw/zinc/45/87/87/418458787.db2.gz	QLABRMUEZBXUPI-NXEZZACHSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000366452413	418475159	/nfs/dbraw/zinc/47/51/59/418475159.db2.gz	ZKIVIWXHLKODIL-GDNZZTSVSA-N	1	1	323.324	1.233	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC2(CCC[N@H+]2C)CC1	ZINC000360661765	418486415	/nfs/dbraw/zinc/48/64/15/418486415.db2.gz	CFZRHBMHIADHPY-UHFFFAOYSA-N	1	1	307.354	1.029	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000360997253	418562890	/nfs/dbraw/zinc/56/28/90/418562890.db2.gz	FUHRKIWPZCWMME-GJZGRUSLSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000291014824	222072292	/nfs/dbraw/zinc/07/22/92/222072292.db2.gz	WRWZWJVWDUWZMC-UHFFFAOYSA-N	1	1	318.337	1.120	20	5		DDBDMO
Cc1c(CN2CCC[N@H+]([C@H](C)CO)CC2)cccc1[N+](=O)[O-]	ZINC000375487318	418647577	/nfs/dbraw/zinc/64/75/77/418647577.db2.gz	VSKKFGUQCOZBAB-CYBMUJFWSA-N	1	1	307.394	1.792	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1[C@H]1CCCO1	ZINC000367724748	418626978	/nfs/dbraw/zinc/62/69/78/418626978.db2.gz	HFQBKASWMWDLAD-MJBXVCDLSA-N	1	1	324.381	1.042	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361361897	418635600	/nfs/dbraw/zinc/63/56/00/418635600.db2.gz	MRRZCRWZOJDWOA-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000361788237	418711141	/nfs/dbraw/zinc/71/11/41/418711141.db2.gz	QWCLMXTVVGCOAI-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]12	ZINC000368063935	418682755	/nfs/dbraw/zinc/68/27/55/418682755.db2.gz	OSKDVYXRDQEYCF-JQWIXIFHSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]12	ZINC000368063935	418682756	/nfs/dbraw/zinc/68/27/56/418682756.db2.gz	OSKDVYXRDQEYCF-JQWIXIFHSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]12	ZINC000368064692	418683270	/nfs/dbraw/zinc/68/32/70/418683270.db2.gz	QNHFRCFPTHJPCW-BXUZGUMPSA-N	1	1	305.334	1.042	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]3C(=O)NC[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000368067868	418684010	/nfs/dbraw/zinc/68/40/10/418684010.db2.gz	BSONQEBLQMMIQP-QWRGUYRKSA-N	1	1	323.324	1.310	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]Cc2ccccc21	ZINC000388150393	418745256	/nfs/dbraw/zinc/74/52/56/418745256.db2.gz	HQTQSBSMQJMOIU-UHFFFAOYSA-N	1	1	300.318	1.683	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000364611075	418793283	/nfs/dbraw/zinc/79/32/83/418793283.db2.gz	YLFFKLLLIHLWRY-LBPRGKRZSA-N	1	1	320.393	1.456	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](O)CC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000421026674	419457849	/nfs/dbraw/zinc/45/78/49/419457849.db2.gz	UODNIWIVZRKGLJ-RYUDHWBXSA-N	1	1	310.350	1.827	20	5		DDBDMO
COC(=O)[C@@H]1CSCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000412076230	419629135	/nfs/dbraw/zinc/62/91/35/419629135.db2.gz	IQXHISOIYHYLKA-LBPRGKRZSA-N	1	1	310.375	1.933	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)C[C@H]1CCC[N@H+]1C	ZINC000421704624	419686999	/nfs/dbraw/zinc/68/69/99/419686999.db2.gz	PHLOZSZMLBFASN-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000421857720	419751606	/nfs/dbraw/zinc/75/16/06/419751606.db2.gz	CBWVXOGFQMIDPH-OAHLLOKOSA-N	1	1	307.350	1.008	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1nccc2ccc([N+](=O)[O-])cc21	ZINC000413056134	419769447	/nfs/dbraw/zinc/76/94/47/419769447.db2.gz	UATHPWPBIIGYNN-UHFFFAOYSA-N	1	1	318.377	2.523	20	5		DDBDMO
C[C@@H](CCc1ccccc1[N+](=O)[O-])NC[C@@H]1C[NH2+]CCCO1	ZINC000415030499	419918385	/nfs/dbraw/zinc/91/83/85/419918385.db2.gz	CMKSRSCDGLUONV-ZFWWWQNUSA-N	1	1	307.394	1.884	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCCC[NH+]1CCOCC1	ZINC000299624820	229274305	/nfs/dbraw/zinc/27/43/05/229274305.db2.gz	KRDMZGXZAQQRDC-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
[NH3+]CC(F)(F)CN[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1	ZINC000423333328	420017966	/nfs/dbraw/zinc/01/79/66/420017966.db2.gz	FDVAOWYQRGWDCH-NXEZZACHSA-N	1	1	303.313	1.459	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(CNC(=O)C2)C1	ZINC000430195580	420088081	/nfs/dbraw/zinc/08/80/81/420088081.db2.gz	OGEZMTRRFGBXBV-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)C1CC([NH3+])C1	ZINC000420335245	420218316	/nfs/dbraw/zinc/21/83/16/420218316.db2.gz	PMOUMTJFLJBGQD-UHFFFAOYSA-N	1	1	306.366	1.653	20	5		DDBDMO
Cc1sc(S(=O)(=O)NC[C@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000416496861	420394285	/nfs/dbraw/zinc/39/42/85/420394285.db2.gz	RAAAQMPMCPUICL-SECBINFHSA-N	1	1	319.408	1.195	20	5		DDBDMO
CC[C@](C)(C(=O)OC)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC1CC1	ZINC000425509411	420404046	/nfs/dbraw/zinc/40/40/46/420404046.db2.gz	IJLSDWPHLYZSSX-OAHLLOKOSA-N	1	1	324.381	1.845	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000457101603	420612383	/nfs/dbraw/zinc/61/23/83/420612383.db2.gz	YPGLFIASEWDSHD-NSHDSACASA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000457101603	420612388	/nfs/dbraw/zinc/61/23/88/420612388.db2.gz	YPGLFIASEWDSHD-NSHDSACASA-N	1	1	307.350	1.042	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000447813631	420804055	/nfs/dbraw/zinc/80/40/55/420804055.db2.gz	STZFBLNPCRTPTP-NSHDSACASA-N	1	1	318.381	2.170	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000493392996	420836412	/nfs/dbraw/zinc/83/64/12/420836412.db2.gz	RGDQNIDBGATEGH-LVDDQXARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000493392996	420836415	/nfs/dbraw/zinc/83/64/15/420836415.db2.gz	RGDQNIDBGATEGH-LVDDQXARSA-N	1	1	319.361	1.133	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000493623089	420898918	/nfs/dbraw/zinc/89/89/18/420898918.db2.gz	MJQDXRKJYRKIGC-RYBZSIHZSA-N	1	1	311.288	1.674	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456019965	421089277	/nfs/dbraw/zinc/08/92/77/421089277.db2.gz	IOKUWNFUAOTOEZ-CABZTGNLSA-N	1	1	319.365	1.244	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCn2cc[nH+]c2C1	ZINC000489925373	421180765	/nfs/dbraw/zinc/18/07/65/421180765.db2.gz	OEBJIKQXLCZAEG-JTQLQIEISA-N	1	1	315.333	1.578	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)C[N@H+]1CC[C@H](C)C1	ZINC000563822698	421546765	/nfs/dbraw/zinc/54/67/65/421546765.db2.gz	LWTBUOGIEBVBCA-NSHDSACASA-N	1	1	307.350	1.561	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1	ZINC000570292982	421636293	/nfs/dbraw/zinc/63/62/93/421636293.db2.gz	GZPGWFYIPMQSNN-CQSZACIVSA-N	1	1	304.350	1.771	20	5		DDBDMO
C[C@@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[NH+]1CC(C)C1	ZINC000571102129	421688528	/nfs/dbraw/zinc/68/85/28/421688528.db2.gz	GRMGCLJWMGGBMC-LBPRGKRZSA-N	1	1	307.350	1.430	20	5		DDBDMO
COC(=O)CCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000519069754	421678160	/nfs/dbraw/zinc/67/81/60/421678160.db2.gz	FNPBPTWFMSAJPO-UHFFFAOYSA-N	1	1	310.354	1.494	20	5		DDBDMO
C[C@@H](C(=O)NCC[N@H+]1CCCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000557569719	421777246	/nfs/dbraw/zinc/77/72/46/421777246.db2.gz	PXNRGHCNOLJQSY-CYBMUJFWSA-N	1	1	321.377	1.537	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNc2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000596075742	422362757	/nfs/dbraw/zinc/36/27/57/422362757.db2.gz	KHKVRQGOERFOOE-LBPRGKRZSA-N	1	1	307.398	2.496	20	5		DDBDMO
C[N@H+]1CC[C@@H](Nc2ccc(N)c([N+](=O)[O-])n2)[C@H]1c1ccccc1	ZINC000590582373	422320445	/nfs/dbraw/zinc/32/04/45/422320445.db2.gz	QUYRIZTUSIZDHK-UKRRQHHQSA-N	1	1	313.361	2.429	20	5		DDBDMO
COC(=O)Cc1ccc(NCCc2c[nH+]cn2C)c([N+](=O)[O-])c1	ZINC000578292975	422539592	/nfs/dbraw/zinc/53/95/92/422539592.db2.gz	ZLKRPMHUELRRNG-UHFFFAOYSA-N	1	1	318.333	1.698	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000314967607	271013996	/nfs/dbraw/zinc/01/39/96/271013996.db2.gz	VTBKJEQTIOQRJM-LLVKDONJSA-N	1	1	306.366	1.836	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@]2(CCCOC2)C1	ZINC000341577006	271125953	/nfs/dbraw/zinc/12/59/53/271125953.db2.gz	MGTIZMYRDGTDPE-INIZCTEOSA-N	1	1	321.377	1.649	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2NC)[C@H](C)C1	ZINC000341799996	271215652	/nfs/dbraw/zinc/21/56/52/271215652.db2.gz	PKGPYTGMMSRJNI-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2NC)[C@H](C)C1	ZINC000341799996	271215656	/nfs/dbraw/zinc/21/56/56/271215656.db2.gz	PKGPYTGMMSRJNI-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000345361247	272230360	/nfs/dbraw/zinc/23/03/60/272230360.db2.gz	ZQOKSHUCVSAXDM-UHFFFAOYSA-N	1	1	308.382	1.208	20	5		DDBDMO
CN(CCCNC(=O)c1cccc([N+](=O)[O-])c1)CC[NH+](C)C	ZINC000345361247	272230361	/nfs/dbraw/zinc/23/03/61/272230361.db2.gz	ZQOKSHUCVSAXDM-UHFFFAOYSA-N	1	1	308.382	1.208	20	5		DDBDMO
CC(C)([NH2+]CC(=O)NC[C@@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000298124518	273506618	/nfs/dbraw/zinc/50/66/18/273506618.db2.gz	KNKIAHSPWIFFSK-LBPRGKRZSA-N	1	1	321.377	1.715	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000272601472	274343876	/nfs/dbraw/zinc/34/38/76/274343876.db2.gz	HERRHLAHXCIDNP-BXKDBHETSA-N	1	1	304.350	1.390	20	5		DDBDMO
C[C@@H]1C[NH2+]CCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000193354621	277933342	/nfs/dbraw/zinc/93/33/42/277933342.db2.gz	KPKGZHOLZYWACJ-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
CCN1CCC([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000090551626	281037376	/nfs/dbraw/zinc/03/73/76/281037376.db2.gz	YREYXZQGBSXOBC-UHFFFAOYSA-N	1	1	308.382	1.173	20	5		DDBDMO
CCN1CCC([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000090551626	281037378	/nfs/dbraw/zinc/03/73/78/281037378.db2.gz	YREYXZQGBSXOBC-UHFFFAOYSA-N	1	1	308.382	1.173	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H]3CCC[C@@H](C2)[NH2+]3)s1	ZINC000124681040	281193640	/nfs/dbraw/zinc/19/36/40/281193640.db2.gz	RQCSODGJJHYNSE-DTORHVGOSA-N	1	1	317.392	1.171	20	5		DDBDMO
C[N@H+](CC(=O)NCCn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000129963527	281363361	/nfs/dbraw/zinc/36/33/61/281363361.db2.gz	GUSUSJWXBYSJSO-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
C[N@@H+](CC(=O)NCCn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000129963527	281363363	/nfs/dbraw/zinc/36/33/63/281363363.db2.gz	GUSUSJWXBYSJSO-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
Cc1nn(C)cc1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000362281198	300043365	/nfs/dbraw/zinc/04/33/65/300043365.db2.gz	KMGCMIZVYDUIQR-AWEZNQCLSA-N	1	1	304.354	1.670	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1	ZINC000363325317	300251985	/nfs/dbraw/zinc/25/19/85/300251985.db2.gz	BWWNMUOWXURHGG-UHFFFAOYSA-N	1	1	306.366	1.856	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3CC[N@H+](C)[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000368587740	301058744	/nfs/dbraw/zinc/05/87/44/301058744.db2.gz	DRYJEIJFSCZHAM-CZUORRHYSA-N	1	1	317.389	1.998	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@H](N3CCNC3=O)C2)cccc1[N+](=O)[O-]	ZINC000368804836	301090173	/nfs/dbraw/zinc/09/01/73/301090173.db2.gz	JBOBJSACXYEBFU-AWEZNQCLSA-N	1	1	318.377	1.893	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H]2CCCO2)CC[C@H]1Nc1ncc([N+](=O)[O-])cn1	ZINC000376928226	302122246	/nfs/dbraw/zinc/12/22/46/302122246.db2.gz	YXJKCTPKUCRFLJ-MRVWCRGKSA-N	1	1	321.381	1.686	20	5		DDBDMO
O=C1NC2(CO1)CC[NH+](Cc1cc(F)ccc1[N+](=O)[O-])CC2	ZINC000496417336	302571790	/nfs/dbraw/zinc/57/17/90/302571790.db2.gz	KZVRQXPEUKARAH-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2ccccn2)c1	ZINC000530963066	303222640	/nfs/dbraw/zinc/22/26/40/303222640.db2.gz	BJBIZILWCHPDFY-HIFRSBDPSA-N	1	1	317.349	1.384	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000538918461	303392241	/nfs/dbraw/zinc/39/22/41/303392241.db2.gz	CKZAEYUCECPRGQ-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000538918461	303392242	/nfs/dbraw/zinc/39/22/42/303392242.db2.gz	CKZAEYUCECPRGQ-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1ccc(N2CCC[N@@H+](CC(=O)N(C)C)CC2)c([N+](=O)[O-])c1	ZINC000366758667	307080797	/nfs/dbraw/zinc/08/07/97/307080797.db2.gz	PAYMXWOMPDIGOS-UHFFFAOYSA-N	1	1	320.393	1.504	20	5		DDBDMO
Cc1ccc(N2CCC[N@H+](CC(=O)N(C)C)CC2)c([N+](=O)[O-])c1	ZINC000366758667	307080798	/nfs/dbraw/zinc/08/07/98/307080798.db2.gz	PAYMXWOMPDIGOS-UHFFFAOYSA-N	1	1	320.393	1.504	20	5		DDBDMO
Cc1cc(C2=CC[N@@H+](CCOCCO)CC2)cc([N+](=O)[O-])c1N	ZINC000374084981	307203117	/nfs/dbraw/zinc/20/31/17/307203117.db2.gz	XLZVWNGFQXFYPC-UHFFFAOYSA-N	1	1	321.377	1.583	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[N@H+](C)[C@@H]2C1	ZINC000376643027	307251212	/nfs/dbraw/zinc/25/12/12/307251212.db2.gz	MSTRXQXZQSUFFX-BXUZGUMPSA-N	1	1	304.350	1.464	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000565233511	308026429	/nfs/dbraw/zinc/02/64/29/308026429.db2.gz	MXSWYMBAZHCRHD-CYBMUJFWSA-N	1	1	319.365	1.554	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CNCCOc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000566117001	308043791	/nfs/dbraw/zinc/04/37/91/308043791.db2.gz	LJAOSOAPYKYLDO-AWEZNQCLSA-N	1	1	309.366	1.018	20	5		DDBDMO
CN(C[C@@H](O)C[NH2+]CCOc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000566117001	308043793	/nfs/dbraw/zinc/04/37/93/308043793.db2.gz	LJAOSOAPYKYLDO-AWEZNQCLSA-N	1	1	309.366	1.018	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1	ZINC000566123492	308044652	/nfs/dbraw/zinc/04/46/52/308044652.db2.gz	AOVVYQFFGCWJEE-LBPRGKRZSA-N	1	1	319.365	1.016	20	5		DDBDMO
CC1(C)[C@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000576237733	308299972	/nfs/dbraw/zinc/29/99/72/308299972.db2.gz	HSCBASCSIBYUQR-NEPJUHHUSA-N	1	1	318.333	1.894	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000576253290	308301114	/nfs/dbraw/zinc/30/11/14/308301114.db2.gz	KLTLSBLXMGDHNG-GFCCVEGCSA-N	1	1	322.365	1.642	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595875164	490372056	/nfs/dbraw/zinc/37/20/56/490372056.db2.gz	PWFBSUPWRHBQGQ-XJKCOSOUSA-N	1	1	324.377	1.285	20	5		DDBDMO
CCOCC[C@@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000444657231	528862665	/nfs/dbraw/zinc/86/26/65/528862665.db2.gz	KBVXXSFWOBKWDQ-GXTWGEPZSA-N	1	1	324.381	1.264	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000050900127	696235205	/nfs/dbraw/zinc/23/52/05/696235205.db2.gz	BBEBSEJGPCXGMI-CYBMUJFWSA-N	1	1	323.397	1.604	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000050900127	696235206	/nfs/dbraw/zinc/23/52/06/696235206.db2.gz	BBEBSEJGPCXGMI-CYBMUJFWSA-N	1	1	323.397	1.604	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCS(=O)(=O)C1	ZINC000069143938	696380842	/nfs/dbraw/zinc/38/08/42/696380842.db2.gz	WCOVVQVINLZLSO-LLVKDONJSA-N	1	1	318.782	1.915	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1	ZINC000748500435	700122309	/nfs/dbraw/zinc/12/23/09/700122309.db2.gz	QVKFDZZIYUUPKC-UHFFFAOYSA-N	1	1	309.322	1.056	20	5		DDBDMO
CCC(=O)N1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274966	698090584	/nfs/dbraw/zinc/09/05/84/698090584.db2.gz	DZARDDBCJNKOAX-OAHLLOKOSA-N	1	1	321.377	1.573	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274966	698090587	/nfs/dbraw/zinc/09/05/87/698090587.db2.gz	DZARDDBCJNKOAX-OAHLLOKOSA-N	1	1	321.377	1.573	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776590907	698123509	/nfs/dbraw/zinc/12/35/09/698123509.db2.gz	MFRSJDQBNAWYMN-KBPBESRZSA-N	1	1	308.334	1.656	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)C(F)(F)F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000778202617	698249475	/nfs/dbraw/zinc/24/94/75/698249475.db2.gz	CZSPPAGYJMYGSF-VXGBXAGGSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC[N@H+](C[C@@H](O)C(F)(F)F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000778202617	698249477	/nfs/dbraw/zinc/24/94/77/698249477.db2.gz	CZSPPAGYJMYGSF-VXGBXAGGSA-N	1	1	322.283	1.873	20	5		DDBDMO
Cn1ccnc1[C@@H](N[C@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000780765202	698558535	/nfs/dbraw/zinc/55/85/35/698558535.db2.gz	WYDDVCKNDXLRGL-ZFWWWQNUSA-N	1	1	315.377	1.711	20	5		DDBDMO
NC(=[NH+]OCCOc1ccccc1[N+](=O)[O-])C1CCOCC1	ZINC000782332144	698710048	/nfs/dbraw/zinc/71/00/48/698710048.db2.gz	KDGMWZLNUOBSND-UHFFFAOYSA-N	1	1	309.322	1.899	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@@H]4C[C@]4(CO)C3)o2)cc1	ZINC000782623107	698753379	/nfs/dbraw/zinc/75/33/79/698753379.db2.gz	YMBJTAVHAWPJJX-XHDPSFHLSA-N	1	1	316.317	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@@H]4C[C@]4(CO)C3)o2)cc1	ZINC000782623107	698753381	/nfs/dbraw/zinc/75/33/81/698753381.db2.gz	YMBJTAVHAWPJJX-XHDPSFHLSA-N	1	1	316.317	1.459	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000786193006	699133546	/nfs/dbraw/zinc/13/35/46/699133546.db2.gz	VYNCWUNIDXTWLO-HUUCEWRRSA-N	1	1	310.350	1.366	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](OC(F)F)C2)cc1	ZINC000801991310	700362423	/nfs/dbraw/zinc/36/24/23/700362423.db2.gz	MKCVARHXJWWXSL-NWDGAFQWSA-N	1	1	302.277	1.942	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248482	700557951	/nfs/dbraw/zinc/55/79/51/700557951.db2.gz	NUTDEGVQLGLRCS-HIFRSBDPSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248482	700557953	/nfs/dbraw/zinc/55/79/53/700557953.db2.gz	NUTDEGVQLGLRCS-HIFRSBDPSA-N	1	1	307.350	1.358	20	5		DDBDMO
CC[C@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1	ZINC000839517584	701721969	/nfs/dbraw/zinc/72/19/69/701721969.db2.gz	RZZHLJPQMORYBF-BZUAXINKSA-N	1	1	317.389	1.605	20	5		DDBDMO
CC[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1	ZINC000839517584	701721974	/nfs/dbraw/zinc/72/19/74/701721974.db2.gz	RZZHLJPQMORYBF-BZUAXINKSA-N	1	1	317.389	1.605	20	5		DDBDMO
CC[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1	ZINC000839517584	701721977	/nfs/dbraw/zinc/72/19/77/701721977.db2.gz	RZZHLJPQMORYBF-BZUAXINKSA-N	1	1	317.389	1.605	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000810091407	701727685	/nfs/dbraw/zinc/72/76/85/701727685.db2.gz	SUUDTWUZZNRPJA-SECBINFHSA-N	1	1	321.424	1.663	20	5		DDBDMO
C[NH+](C)CCn1ccc2ccc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc21	ZINC000839687467	701784386	/nfs/dbraw/zinc/78/43/86/701784386.db2.gz	GNBUBNOREIDPGR-UKRRQHHQSA-N	1	1	316.361	1.807	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@](C)(CO)C1	ZINC000879262749	706633431	/nfs/dbraw/zinc/63/34/31/706633431.db2.gz	ZIIGSPRBXDKZJZ-KKUMJFAQSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1	ZINC000840179366	702015667	/nfs/dbraw/zinc/01/56/67/702015667.db2.gz	RBXMSAWBLNSXOK-CQSZACIVSA-N	1	1	315.377	1.955	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000868519330	702173960	/nfs/dbraw/zinc/17/39/60/702173960.db2.gz	AOSYIMLSSGVSQW-AAEUAGOBSA-N	1	1	307.325	1.439	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@@H+](C)C1	ZINC000843990490	702949823	/nfs/dbraw/zinc/94/98/23/702949823.db2.gz	UJIAOJWEFMDGRR-LBPRGKRZSA-N	1	1	306.366	1.733	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)[C@H](C)C2)c1	ZINC000844314199	703011338	/nfs/dbraw/zinc/01/13/38/703011338.db2.gz	RYXZFKRJSDNEME-LLVKDONJSA-N	1	1	307.350	1.517	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3cccc(F)n3)CC2)c1	ZINC000831478115	706715011	/nfs/dbraw/zinc/71/50/11/706715011.db2.gz	XYKSHDMTAVNJMO-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
CC[N@H+](CCOC)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848474334	703554406	/nfs/dbraw/zinc/55/44/06/703554406.db2.gz	BHRBRWPWVIGCMD-HNNXBMFYSA-N	1	1	321.377	1.837	20	5		DDBDMO
CC[N@@H+](CCOC)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848474334	703554408	/nfs/dbraw/zinc/55/44/08/703554408.db2.gz	BHRBRWPWVIGCMD-HNNXBMFYSA-N	1	1	321.377	1.837	20	5		DDBDMO
COC(=O)[C@]12C[N@H+](Cn3nccc3[N+](=O)[O-])C[C@H]1CCCC2	ZINC000848490197	703557023	/nfs/dbraw/zinc/55/70/23/703557023.db2.gz	DLQOEHKOPBWNCI-BXUZGUMPSA-N	1	1	308.338	1.414	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cn3nccc3[N+](=O)[O-])C[C@H]1CCCC2	ZINC000848490197	703557024	/nfs/dbraw/zinc/55/70/24/703557024.db2.gz	DLQOEHKOPBWNCI-BXUZGUMPSA-N	1	1	308.338	1.414	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852410508	704036503	/nfs/dbraw/zinc/03/65/03/704036503.db2.gz	CDPYSWPJECBZCH-GJZGRUSLSA-N	1	1	310.350	1.102	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000852495719	704062241	/nfs/dbraw/zinc/06/22/41/704062241.db2.gz	MTMYJOHZMGXXQE-BPLDGKMQSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000852498158	704063703	/nfs/dbraw/zinc/06/37/03/704063703.db2.gz	ZSNVSCGAGKAOQS-ZWNOBZJWSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000852498158	704063704	/nfs/dbraw/zinc/06/37/04/704063704.db2.gz	ZSNVSCGAGKAOQS-ZWNOBZJWSA-N	1	1	307.325	1.834	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCCSCC1)c1cccc([N+](=O)[O-])c1	ZINC000870874767	704153813	/nfs/dbraw/zinc/15/38/13/704153813.db2.gz	SVEZAZNRDGFISM-CQSZACIVSA-N	1	1	309.391	1.734	20	5		DDBDMO
O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+]1CC[C@H]2C[C@H]2C1	ZINC000853576542	704274043	/nfs/dbraw/zinc/27/40/43/704274043.db2.gz	PKHWYIUOQXZAQB-QWRGUYRKSA-N	1	1	316.317	1.711	20	5		DDBDMO
O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+]1CC[C@H]2C[C@H]2C1	ZINC000853576542	704274046	/nfs/dbraw/zinc/27/40/46/704274046.db2.gz	PKHWYIUOQXZAQB-QWRGUYRKSA-N	1	1	316.317	1.711	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](C(=O)NC(C)C)C2)c(C)c1[N+](=O)[O-]	ZINC000853603458	704283307	/nfs/dbraw/zinc/28/33/07/704283307.db2.gz	QGHLGBKTOHVOFZ-ZDUSSCGKSA-N	1	1	323.397	1.602	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](C(=O)NC(C)C)C2)c(C)c1[N+](=O)[O-]	ZINC000853603458	704283309	/nfs/dbraw/zinc/28/33/09/704283309.db2.gz	QGHLGBKTOHVOFZ-ZDUSSCGKSA-N	1	1	323.397	1.602	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000880309051	706936259	/nfs/dbraw/zinc/93/62/59/706936259.db2.gz	LRBCLHQURMLASF-NSHDSACASA-N	1	1	322.287	1.753	20	5		DDBDMO
O=C(CC[N@@H+]1CC=C[C@H]1CO)Nc1cc([N+](=O)[O-])ccc1F	ZINC000880488786	706992469	/nfs/dbraw/zinc/99/24/69/706992469.db2.gz	MAXCSNSEVZQFHI-NSHDSACASA-N	1	1	309.297	1.295	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)CCC(C)(C)[N+](=O)[O-])C[C@H](C)O1	ZINC000822314404	704915175	/nfs/dbraw/zinc/91/51/75/704915175.db2.gz	UWHPIUFNYFSIGS-BETUJISGSA-N	1	1	315.414	1.437	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860159903	705117910	/nfs/dbraw/zinc/11/79/10/705117910.db2.gz	IGNKFAYLQRUSCS-DGCLKSJQSA-N	1	1	306.318	1.598	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860159903	705117914	/nfs/dbraw/zinc/11/79/14/705117914.db2.gz	IGNKFAYLQRUSCS-DGCLKSJQSA-N	1	1	306.318	1.598	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000861385135	705452358	/nfs/dbraw/zinc/45/23/58/705452358.db2.gz	NBMQEEADBORTRR-UHFFFAOYSA-N	1	1	316.317	1.643	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827265997	705963860	/nfs/dbraw/zinc/96/38/60/705963860.db2.gz	JKJMPYWRRUFQBX-DGCLKSJQSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297889	705970736	/nfs/dbraw/zinc/97/07/36/705970736.db2.gz	HNVKQNOYTMYAAQ-GHMZBOCLSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297889	705970740	/nfs/dbraw/zinc/97/07/40/705970740.db2.gz	HNVKQNOYTMYAAQ-GHMZBOCLSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297889	705970743	/nfs/dbraw/zinc/97/07/43/705970743.db2.gz	HNVKQNOYTMYAAQ-GHMZBOCLSA-N	1	1	321.381	1.608	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])n1	ZINC000877140099	705994433	/nfs/dbraw/zinc/99/44/33/705994433.db2.gz	MXULUIOGRGXHFX-HNNXBMFYSA-N	1	1	320.324	1.561	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])n1	ZINC000877140099	705994437	/nfs/dbraw/zinc/99/44/37/705994437.db2.gz	MXULUIOGRGXHFX-HNNXBMFYSA-N	1	1	320.324	1.561	20	5		DDBDMO
C/C(=C/C(=O)NCC[N@H+]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000863833368	706024433	/nfs/dbraw/zinc/02/44/33/706024433.db2.gz	PIANAICXVPDSEJ-WQTVUKCASA-N	1	1	319.361	1.181	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000863833493	706024737	/nfs/dbraw/zinc/02/47/37/706024737.db2.gz	QBMUFEZIHUGANZ-WQTVUKCASA-N	1	1	319.361	1.181	20	5		DDBDMO
C[N@H+]1CCCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1	ZINC000877935166	706244906	/nfs/dbraw/zinc/24/49/06/706244906.db2.gz	KVPOFCKLXZCVLN-UHFFFAOYSA-N	1	1	317.349	1.782	20	5		DDBDMO
COCC[N@@H+](C)CCNc1cc(F)c([N+](=O)[O-])cc1CO	ZINC000865502226	706448088	/nfs/dbraw/zinc/44/80/88/706448088.db2.gz	IPKXBMUTIZERER-UHFFFAOYSA-N	1	1	301.318	1.216	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000865608593	706476450	/nfs/dbraw/zinc/47/64/50/706476450.db2.gz	LLRKTLWETGJQLA-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2C[C@@H]3C[C@H]2CN3c2ccccc2)n1	ZINC000880190197	706906024	/nfs/dbraw/zinc/90/60/24/706906024.db2.gz	YOMKCTHRNXTJME-GJZGRUSLSA-N	1	1	313.361	1.754	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000880309927	706936970	/nfs/dbraw/zinc/93/69/70/706936970.db2.gz	MAGQHCRUILQAAF-TXEJJXNPSA-N	1	1	307.325	1.644	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000880309927	706936974	/nfs/dbraw/zinc/93/69/74/706936974.db2.gz	MAGQHCRUILQAAF-TXEJJXNPSA-N	1	1	307.325	1.644	20	5		DDBDMO
Cc1c(C[N@H+](CC(N)=O)C2CCOCC2)cccc1[N+](=O)[O-]	ZINC000880391213	706961038	/nfs/dbraw/zinc/96/10/38/706961038.db2.gz	DFFDYGODQLPMGZ-UHFFFAOYSA-N	1	1	307.350	1.370	20	5		DDBDMO
Cc1c(C[N@@H+](CC(N)=O)C2CCOCC2)cccc1[N+](=O)[O-]	ZINC000880391213	706961039	/nfs/dbraw/zinc/96/10/39/706961039.db2.gz	DFFDYGODQLPMGZ-UHFFFAOYSA-N	1	1	307.350	1.370	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000880428832	706972764	/nfs/dbraw/zinc/97/27/64/706972764.db2.gz	SLXGGNNUNXYSAF-LSDHHAIUSA-N	1	1	310.350	1.709	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880528627	707005284	/nfs/dbraw/zinc/00/52/84/707005284.db2.gz	FJCYPLQFDLTCTP-NILFDRSVSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880528627	707005287	/nfs/dbraw/zinc/00/52/87/707005287.db2.gz	FJCYPLQFDLTCTP-NILFDRSVSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](O)CC3(CCOCC3)C2)cc1	ZINC000880585225	707027783	/nfs/dbraw/zinc/02/77/83/707027783.db2.gz	FSFPIYXVMGDBGZ-HNNXBMFYSA-N	1	1	306.362	1.958	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)CC[C@@H]21	ZINC000872725090	707573352	/nfs/dbraw/zinc/57/33/52/707573352.db2.gz	ORLJVDWTQBFOKT-WFASDCNBSA-N	1	1	315.377	1.928	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c([N+](=O)[O-])c1	ZINC000872781607	707597795	/nfs/dbraw/zinc/59/77/95/707597795.db2.gz	VZKYNHHMICEPEL-STQMWFEESA-N	1	1	318.377	1.627	20	5		DDBDMO
Cc1cc(NCC[N@H+](C)CCOCCO)c(F)cc1[N+](=O)[O-]	ZINC000882951183	707867444	/nfs/dbraw/zinc/86/74/44/707867444.db2.gz	SGXPQTGSETWLMY-UHFFFAOYSA-N	1	1	315.345	1.395	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2	ZINC000882960625	707873771	/nfs/dbraw/zinc/87/37/71/707873771.db2.gz	QDWGREATYHRWAH-VIFPVBQESA-N	1	1	306.322	1.432	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC([N@@H+]3CC[C@@H](O)C3)C2)c1C	ZINC000898279696	708596605	/nfs/dbraw/zinc/59/66/05/708596605.db2.gz	JLMAARFFWNQPRE-CYBMUJFWSA-N	1	1	319.361	1.103	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC([N@H+]3CC[C@@H](O)C3)C2)c1C	ZINC000898279696	708596607	/nfs/dbraw/zinc/59/66/07/708596607.db2.gz	JLMAARFFWNQPRE-CYBMUJFWSA-N	1	1	319.361	1.103	20	5		DDBDMO
Cn1cc(C[C@@H]2CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)cn1	ZINC000886030127	708685216	/nfs/dbraw/zinc/68/52/16/708685216.db2.gz	GWKBFGCEBCBNCQ-LBPRGKRZSA-N	1	1	301.350	1.788	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)cc1[N+](=O)[O-]	ZINC000887939201	709173587	/nfs/dbraw/zinc/17/35/87/709173587.db2.gz	URUXTWPISIZTCA-BLLLJJGKSA-N	1	1	319.361	1.627	20	5		DDBDMO
CN1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC[N@H+](C)CC1	ZINC000888993738	709426144	/nfs/dbraw/zinc/42/61/44/709426144.db2.gz	DUQVSYVOTFNSGH-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CN1CCN(C(=O)c2cc(F)ccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000888993738	709426146	/nfs/dbraw/zinc/42/61/46/709426146.db2.gz	DUQVSYVOTFNSGH-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
C[C@H](NC(=O)C[C@@]1(O)CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000900267394	709512706	/nfs/dbraw/zinc/51/27/06/709512706.db2.gz	FHEOPOIWAPHJJS-LRDDRELGSA-N	1	1	321.377	1.619	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)c1C	ZINC000889636895	709568626	/nfs/dbraw/zinc/56/86/26/709568626.db2.gz	HOINAFBUONVIDC-TZMCWYRMSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)c1C	ZINC000889636895	709568629	/nfs/dbraw/zinc/56/86/29/709568629.db2.gz	HOINAFBUONVIDC-TZMCWYRMSA-N	1	1	321.377	1.661	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000900804820	709767157	/nfs/dbraw/zinc/76/71/57/709767157.db2.gz	NNNONYGNGYBRSE-HZMBPMFUSA-N	1	1	324.356	1.098	20	5		DDBDMO
C[C@@H](NC(=O)[C@H](C)N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000928247989	713157308	/nfs/dbraw/zinc/15/73/08/713157308.db2.gz	GCJFLDMBADPCOF-OLZOCXBDSA-N	1	1	320.393	1.408	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000893872084	710866962	/nfs/dbraw/zinc/86/69/62/710866962.db2.gz	ONWPJBKXHDNZDG-VIFPVBQESA-N	1	1	307.306	1.148	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@@H+]1CC	ZINC000893874481	710869357	/nfs/dbraw/zinc/86/93/57/710869357.db2.gz	XDUPOSSEAFGTHT-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1CC	ZINC000893874481	710869361	/nfs/dbraw/zinc/86/93/61/710869361.db2.gz	XDUPOSSEAFGTHT-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000893942027	710894819	/nfs/dbraw/zinc/89/48/19/710894819.db2.gz	YQFCSHAPEIVHQU-JQWIXIFHSA-N	1	1	320.349	1.225	20	5		DDBDMO
CC1(C)[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)C[C@H]1[NH+]1CCOCC1	ZINC000911837030	711023836	/nfs/dbraw/zinc/02/38/36/711023836.db2.gz	BTWMRJDQWWSYAD-VXGBXAGGSA-N	1	1	323.349	1.417	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(c2ncc([N+](=O)[O-])cc2OC)CC1	ZINC000894272674	711046728	/nfs/dbraw/zinc/04/67/28/711046728.db2.gz	JNHNZRVRWSOABE-UHFFFAOYSA-N	1	1	324.381	1.545	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](CCCO)C2)c1[N+](=O)[O-]	ZINC000894797602	711275178	/nfs/dbraw/zinc/27/51/78/711275178.db2.gz	NTLHPZWDZXLSGK-NSHDSACASA-N	1	1	310.350	1.903	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000913537266	713249053	/nfs/dbraw/zinc/24/90/53/713249053.db2.gz	AGJHOPDGVPDXRD-TXEJJXNPSA-N	1	1	314.345	1.995	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000913537266	713249055	/nfs/dbraw/zinc/24/90/55/713249055.db2.gz	AGJHOPDGVPDXRD-TXEJJXNPSA-N	1	1	314.345	1.995	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000895099617	711410627	/nfs/dbraw/zinc/41/06/27/711410627.db2.gz	KMYRCGIPMVTQIW-PHIMTYICSA-N	1	1	322.365	1.695	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C	ZINC000895735272	711590330	/nfs/dbraw/zinc/59/03/30/711590330.db2.gz	CBRDJOPBCDHFMI-RQJHMYQMSA-N	1	1	307.276	1.852	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1	ZINC000896558121	711751441	/nfs/dbraw/zinc/75/14/41/711751441.db2.gz	YDZHAUNCFOVBHJ-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000896579333	711757507	/nfs/dbraw/zinc/75/75/07/711757507.db2.gz	FQBXIXPPYJPYNC-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc(Cl)c(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000908350609	712749562	/nfs/dbraw/zinc/74/95/62/712749562.db2.gz	ZUTSADOXPZLUGX-PRHODGIISA-N	1	1	324.768	1.607	20	5		DDBDMO
COc1cccc([C@H]2[C@@H](NCC[N+](=O)[O-])CC[N@@H+]2C2CC2)c1	ZINC000930353777	713812173	/nfs/dbraw/zinc/81/21/73/713812173.db2.gz	KGWLYTVHIBTOOE-HOTGVXAUSA-N	1	1	305.378	1.839	20	5		DDBDMO
C[C@](CO)([NH2+]CC[N+](=O)[O-])c1ccc(Br)cc1	ZINC000930451451	713837916	/nfs/dbraw/zinc/83/79/16/713837916.db2.gz	QNIHCYIGDIDMOM-LLVKDONJSA-N	1	1	303.156	1.523	20	5		DDBDMO
CON1CC[C@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000930636365	713883648	/nfs/dbraw/zinc/88/36/48/713883648.db2.gz	GAKYIBRVBFDQKW-HIFRSBDPSA-N	1	1	319.361	1.937	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000930916133	713958285	/nfs/dbraw/zinc/95/82/85/713958285.db2.gz	NJSYFAHHVAZXLF-JMSVASOKSA-N	1	1	321.377	1.948	20	5		DDBDMO
C[C@@H]([NH2+][C@H]1C(=O)NCC12CCOCC2)c1ccccc1[N+](=O)[O-]	ZINC000933038614	714505836	/nfs/dbraw/zinc/50/58/36/714505836.db2.gz	NGZIYLMBPLWHOH-RISCZKNCSA-N	1	1	319.361	1.541	20	5		DDBDMO
C[C@@H]([NH2+][C@@H]1C(=O)NCC12CCOCC2)c1ccccc1[N+](=O)[O-]	ZINC000933038611	714506038	/nfs/dbraw/zinc/50/60/38/714506038.db2.gz	NGZIYLMBPLWHOH-BXUZGUMPSA-N	1	1	319.361	1.541	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C2	ZINC000933754596	714664661	/nfs/dbraw/zinc/66/46/61/714664661.db2.gz	HKRKDAUUICYYHV-NHYWBVRUSA-N	1	1	307.325	1.821	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H]3[C@@H]2CCCN3CCO)cc1	ZINC000934259194	714778389	/nfs/dbraw/zinc/77/83/89/714778389.db2.gz	HHRNWSJIZRUSNC-DLBZAZTESA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)cc1	ZINC000934259194	714778392	/nfs/dbraw/zinc/77/83/92/714778392.db2.gz	HHRNWSJIZRUSNC-DLBZAZTESA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)cc1	ZINC000934259194	714778395	/nfs/dbraw/zinc/77/83/95/714778395.db2.gz	HHRNWSJIZRUSNC-DLBZAZTESA-N	1	1	319.405	1.668	20	5		DDBDMO
C[C@H]1C[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)c2ncnn21	ZINC000925383083	714836879	/nfs/dbraw/zinc/83/68/79/714836879.db2.gz	QRJUMAXHKRFFHI-GWCFXTLKSA-N	1	1	303.322	1.861	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC001164643048	719178193	/nfs/dbraw/zinc/17/81/93/719178193.db2.gz	YWMJDCJFZDVXNV-ZJUUUORDSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC001164643048	719178196	/nfs/dbraw/zinc/17/81/96/719178196.db2.gz	YWMJDCJFZDVXNV-ZJUUUORDSA-N	1	1	308.338	1.305	20	5		DDBDMO
Cc1cc(Cl)nc(N2C[C@H]3OCC[N@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001164665837	719384490	/nfs/dbraw/zinc/38/44/90/719384490.db2.gz	IWTBKWUDDFDAPD-NXEZZACHSA-N	1	1	312.757	1.471	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000589604370	719389274	/nfs/dbraw/zinc/38/92/74/719389274.db2.gz	XZWBNTJGLXWLND-UONOGXRCSA-N	1	1	315.333	1.057	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3nccc4cc([N+](=O)[O-])ccc43)C[C@H]21	ZINC000590694492	719482482	/nfs/dbraw/zinc/48/24/82/719482482.db2.gz	XDWXIXXHPVIZHH-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2nccc(Br)c2[N+](=O)[O-])C1	ZINC001167281293	732896732	/nfs/dbraw/zinc/89/67/32/732896732.db2.gz	RZNNBGPOBSMMPG-ZETCQYMHSA-N	1	1	301.144	1.868	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000894623326	740327819	/nfs/dbraw/zinc/32/78/19/740327819.db2.gz	OMCSQICIQLLHCK-CYBMUJFWSA-N	1	1	322.365	1.034	20	5		DDBDMO
CC(C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C)=C1CCC1	ZINC001126876005	742406277	/nfs/dbraw/zinc/40/62/77/742406277.db2.gz	XCTYMKLTZIYCLC-UHFFFAOYSA-N	1	1	307.354	1.035	20	5		DDBDMO
COc1cccc(NCC2([NH+]3CCCC3)COC2)c1[N+](=O)[O-]	ZINC001168451064	745113218	/nfs/dbraw/zinc/11/32/18/745113218.db2.gz	FSCHAZBTLKTUOY-UHFFFAOYSA-N	1	1	307.350	1.880	20	5		DDBDMO
O=C(NCC1C[NH+](CCc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031660251	747335450	/nfs/dbraw/zinc/33/54/50/747335450.db2.gz	FFCJEGVTERMFRE-CHWSQXEVSA-N	1	1	309.391	1.004	20	5		DDBDMO
Cc1cnc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)s1	ZINC000996429753	749588963	/nfs/dbraw/zinc/58/89/63/749588963.db2.gz	WDPYDMBNDZOCGE-VXGBXAGGSA-N	1	1	324.406	1.197	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccsc2)CC1	ZINC000997773046	751270134	/nfs/dbraw/zinc/27/01/34/751270134.db2.gz	RLAVZPKYGKZHJX-ZIAGYGMSSA-N	1	1	323.418	1.742	20	5		DDBDMO
CCN1CC[C@@]2(C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C)C1=O	ZINC001169025837	762203503	/nfs/dbraw/zinc/20/35/03/762203503.db2.gz	ZGHNKMYSVBISMA-NHIYQJMISA-N	1	1	309.410	1.622	20	5		DDBDMO
CN1CCOC[C@H]1CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001169659969	762582231	/nfs/dbraw/zinc/58/22/31/762582231.db2.gz	KVXTXBFHDJJEBC-GFCCVEGCSA-N	1	1	320.393	1.325	20	5		DDBDMO
CN1CCOC[C@H]1CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001169659969	762582239	/nfs/dbraw/zinc/58/22/39/762582239.db2.gz	KVXTXBFHDJJEBC-GFCCVEGCSA-N	1	1	320.393	1.325	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CC2CCCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139309	760614289	/nfs/dbraw/zinc/61/42/89/760614289.db2.gz	XHCLNTNKLSPGPA-KBUPBQIOSA-N	1	1	309.410	1.859	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](F)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170327847	766253996	/nfs/dbraw/zinc/25/39/96/766253996.db2.gz	IIKWAZPQSJXIMY-VZJVUDMVSA-N	1	1	312.341	1.939	20	5		DDBDMO
CCC/C=C\CC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001147507451	773156202	/nfs/dbraw/zinc/15/62/02/773156202.db2.gz	ONPBBPSBHYQOPQ-ZYDHHDLOSA-N	1	1	321.421	1.932	20	5		DDBDMO
CCC/C=C\CC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147507451	773156205	/nfs/dbraw/zinc/15/62/05/773156205.db2.gz	ONPBBPSBHYQOPQ-ZYDHHDLOSA-N	1	1	321.421	1.932	20	5		DDBDMO
CCC/C=C\CC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147507451	773156207	/nfs/dbraw/zinc/15/62/07/773156207.db2.gz	ONPBBPSBHYQOPQ-ZYDHHDLOSA-N	1	1	321.421	1.932	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cnc(N)c([N+](=O)[O-])c2)C[C@H]1C	ZINC001147741603	773227896	/nfs/dbraw/zinc/22/78/96/773227896.db2.gz	GEKCQQIFFCEZMA-ZYHUDNBSSA-N	1	1	321.381	1.517	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)c1	ZINC001094008249	775323789	/nfs/dbraw/zinc/32/37/89/775323789.db2.gz	JNFXRTYMLGNZNP-UHFFFAOYSA-N	1	1	317.349	1.636	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N(C)CCNC(=O)C[N@H+](C)C(C)C)n1	ZINC001100149888	775735439	/nfs/dbraw/zinc/73/54/39/775735439.db2.gz	UNPXAKHNOQIOOA-UHFFFAOYSA-N	1	1	323.397	1.191	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(CCCO)CC1	ZINC001173221938	777054285	/nfs/dbraw/zinc/05/42/85/777054285.db2.gz	NOYHUXCRNYOVNZ-AWEZNQCLSA-N	1	1	307.394	1.526	20	5		DDBDMO
Cc1ccnc(NCCN(C)C(=O)C[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC001101657613	777352571	/nfs/dbraw/zinc/35/25/71/777352571.db2.gz	GQXKHOYIYPKXHC-UHFFFAOYSA-N	1	1	323.397	1.509	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001101756614	777480111	/nfs/dbraw/zinc/48/01/11/777480111.db2.gz	GEHHHTBVTZSAHY-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC001176556451	778180280	/nfs/dbraw/zinc/18/02/80/778180280.db2.gz	YDQDVIGRLOOVNS-NOLJZWGESA-N	1	1	319.361	1.216	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@@H+](C)CC1(C)C	ZINC001178707908	779153959	/nfs/dbraw/zinc/15/39/59/779153959.db2.gz	BNOWLZIDSRBKLY-ZDUSSCGKSA-N	1	1	307.350	1.673	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+]3CCOC[C@H]3C)CC2)ncc1[N+](=O)[O-]	ZINC001119342776	781413347	/nfs/dbraw/zinc/41/33/47/781413347.db2.gz	LAYZBZHCMZPXDL-LLVKDONJSA-N	1	1	321.381	1.383	20	5		DDBDMO
O=C(NCC1([NH2+]CC2CCCCC2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001273084398	847886047	/nfs/dbraw/zinc/88/60/47/847886047.db2.gz	MWIUUEMNDCVMDI-ZIAGYGMSSA-N	1	1	309.410	1.860	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCn2cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c2)C1	ZINC001328033867	862648725	/nfs/dbraw/zinc/64/87/25/862648725.db2.gz	YFRXEIBYHAXHHW-PHIMTYICSA-N	1	1	324.337	1.643	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)no1	ZINC001141767477	860934546	/nfs/dbraw/zinc/93/45/46/860934546.db2.gz	LVEBSRUMNOXNKG-UHFFFAOYSA-N	1	1	305.294	1.479	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])cc1O[C@H]1CCc2[nH+]ccn2C1	ZINC001225450795	881841960	/nfs/dbraw/zinc/84/19/60/881841960.db2.gz	LHKJGWWMKUDHLV-NSHDSACASA-N	1	1	317.301	1.972	20	5		DDBDMO
COc1nc(-n2cc(CC[NH3+])c3cnccc32)ncc1[N+](=O)[O-]	ZINC001160944743	866200831	/nfs/dbraw/zinc/20/08/31/866200831.db2.gz	WUFYAEVIPSCNRN-UHFFFAOYSA-N	1	1	314.305	1.234	20	5		DDBDMO
C[NH+](C)[C@@H]1CCCC[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC001320786416	867026847	/nfs/dbraw/zinc/02/68/47/867026847.db2.gz	ONEBDZLCOODHQS-ZIAGYGMSSA-N	1	1	307.350	1.903	20	5		DDBDMO
COc1c(O)ccc(CNC[C@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC001336716145	869106610	/nfs/dbraw/zinc/10/66/10/869106610.db2.gz	DCLYOTDEKPCLSM-JTQLQIEISA-N	1	1	309.366	1.881	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C[C@H](C)N(C)C2CC2)c1[N+](=O)[O-]	ZINC001336716145	869106618	/nfs/dbraw/zinc/10/66/18/869106618.db2.gz	DCLYOTDEKPCLSM-JTQLQIEISA-N	1	1	309.366	1.881	20	5		DDBDMO
CCN(C)C(=O)[C@H](C)[NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC001308730789	871525084	/nfs/dbraw/zinc/52/50/84/871525084.db2.gz	WJHGVGZUGLIGOY-VIFPVBQESA-N	1	1	311.338	1.265	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)NCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC001341343885	871615094	/nfs/dbraw/zinc/61/50/94/871615094.db2.gz	JFYXXXOYBVLAAJ-NWANDNLSSA-N	1	1	318.377	1.734	20	5		DDBDMO
CC(C)(F)C(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC001318096420	871743450	/nfs/dbraw/zinc/74/34/50/871743450.db2.gz	MCCHPRIMOZTIDZ-UHFFFAOYSA-N	1	1	309.341	1.891	20	5		DDBDMO
CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])nc3)C[C@H]1[N@H+]2C	ZINC001226712418	882603539	/nfs/dbraw/zinc/60/35/39/882603539.db2.gz	MLJMUDCBYIWFLM-DEQVHRJGSA-N	1	1	321.333	1.535	20	5		DDBDMO
CS[C@@H]1CC[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC001319451833	872635995	/nfs/dbraw/zinc/63/59/95/872635995.db2.gz	QQCUGUIIBJOVSI-WCQYABFASA-N	1	1	311.407	1.972	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2cc3c(cc2[N+](=O)[O-])OCCO3)o1	ZINC001345940439	873566921	/nfs/dbraw/zinc/56/69/21/873566921.db2.gz	CNCZQVBBXFSFMD-UHFFFAOYSA-N	1	1	306.278	1.478	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891814	874300202	/nfs/dbraw/zinc/30/02/02/874300202.db2.gz	VNQDRCAGKMQEMJ-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891814	874300209	/nfs/dbraw/zinc/30/02/09/874300209.db2.gz	VNQDRCAGKMQEMJ-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cn1cc[nH+]c1C[C@H]1CCCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001350473182	875710893	/nfs/dbraw/zinc/71/08/93/875710893.db2.gz	AERZGPSNDQPXIO-LLVKDONJSA-N	1	1	317.349	1.888	20	5		DDBDMO
O=[N+]([O-])c1cnc(O[C@H]2CCc3[nH+]ccn3C2)c2[nH]cnc21	ZINC001227692488	883136287	/nfs/dbraw/zinc/13/62/87/883136287.db2.gz	YZVYWTBEEHMSRK-QMMMGPOBSA-N	1	1	300.278	1.456	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3cccc([N+](=O)[O-])c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233576670	887122503	/nfs/dbraw/zinc/12/25/03/887122503.db2.gz	YLSNELVMFCXEBZ-KDDOJWQBSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3cccc([N+](=O)[O-])c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233576670	887122508	/nfs/dbraw/zinc/12/25/08/887122508.db2.gz	YLSNELVMFCXEBZ-KDDOJWQBSA-N	1	1	321.289	1.686	20	5		DDBDMO
COC(=O)[C@@]1(F)CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596394	896520265	/nfs/dbraw/zinc/52/02/65/896520265.db2.gz	CXYQEQFQJWGSPV-DZGCQCFKSA-N	1	1	308.309	1.649	20	5		DDBDMO
COC(=O)[C@@]1(F)CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596394	896520273	/nfs/dbraw/zinc/52/02/73/896520273.db2.gz	CXYQEQFQJWGSPV-DZGCQCFKSA-N	1	1	308.309	1.649	20	5		DDBDMO
COCCN1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254592937	896521178	/nfs/dbraw/zinc/52/11/78/896521178.db2.gz	HGOASBWURAMGOY-MRXNPFEDSA-N	1	1	305.378	1.326	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC000081792353	192323824	/nfs/dbraw/zinc/32/38/24/192323824.db2.gz	VZFRNUYBOGTUJX-LBPRGKRZSA-N	1	1	320.393	1.899	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000248994361	282125255	/nfs/dbraw/zinc/12/52/55/282125255.db2.gz	XTJXPORVIIWHPV-UXIGCNINSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000295812139	529382961	/nfs/dbraw/zinc/38/29/61/529382961.db2.gz	WZVIFAQIMGZSAK-LLVKDONJSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000295812139	529382962	/nfs/dbraw/zinc/38/29/62/529382962.db2.gz	WZVIFAQIMGZSAK-LLVKDONJSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000452067095	231288930	/nfs/dbraw/zinc/28/89/30/231288930.db2.gz	LWLHJQPXAYUXRN-SMDDNHRTSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000452067095	231288933	/nfs/dbraw/zinc/28/89/33/231288933.db2.gz	LWLHJQPXAYUXRN-SMDDNHRTSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCC[N@H+]1CCO	ZINC000452395050	231376049	/nfs/dbraw/zinc/37/60/49/231376049.db2.gz	VZJZPJYSFNBUNV-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]2OCCC[C@@H]2C1	ZINC000090552771	185302723	/nfs/dbraw/zinc/30/27/23/185302723.db2.gz	BWRJNKKFBHSNNV-TZMCWYRMSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000299455272	529790153	/nfs/dbraw/zinc/79/01/53/529790153.db2.gz	VFAFJPDOBZYZEZ-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000299455272	529790154	/nfs/dbraw/zinc/79/01/54/529790154.db2.gz	VFAFJPDOBZYZEZ-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
CCCN(CC[NH+]1CCCC1)C(=O)c1n[nH]c(CC)c1[N+](=O)[O-]	ZINC000286648817	219103604	/nfs/dbraw/zinc/10/36/04/219103604.db2.gz	DNIUPMPBZBKPEE-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1	ZINC000267258390	282305614	/nfs/dbraw/zinc/30/56/14/282305614.db2.gz	NHUPRCWRMZDGHF-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[N@H+](CCCCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000276449391	282323927	/nfs/dbraw/zinc/32/39/27/282323927.db2.gz	VQQVRLONCQPATB-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[N@@H+](CCCCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000276449391	282323928	/nfs/dbraw/zinc/32/39/28/282323928.db2.gz	VQQVRLONCQPATB-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]([C@H](C)O)C1	ZINC000305655406	282398576	/nfs/dbraw/zinc/39/85/76/282398576.db2.gz	PFCXZYMTTOADHT-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]([C@H](C)O)C1	ZINC000305655406	282398580	/nfs/dbraw/zinc/39/85/80/282398580.db2.gz	PFCXZYMTTOADHT-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000358330240	299122710	/nfs/dbraw/zinc/12/27/10/299122710.db2.gz	OWSNRVJOWXNIJJ-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000287096634	219310677	/nfs/dbraw/zinc/31/06/77/219310677.db2.gz	YZSKYRPDTZJVRU-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000287096634	219310680	/nfs/dbraw/zinc/31/06/80/219310680.db2.gz	YZSKYRPDTZJVRU-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@@H+](C)C1	ZINC000617352616	363067201	/nfs/dbraw/zinc/06/72/01/363067201.db2.gz	DPBMKORTCROPSF-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H]1CSCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000172590331	198118991	/nfs/dbraw/zinc/11/89/91/198118991.db2.gz	DRLUAKVRTAVZJX-YPMHNXCESA-N	1	1	312.391	1.772	20	5		DDBDMO
CCc1ccc(C(=O)NCC[N@@H+](C)CCCOC)cc1[N+](=O)[O-]	ZINC000174286952	198315503	/nfs/dbraw/zinc/31/55/03/198315503.db2.gz	ZSNDBMWMPXMBQT-UHFFFAOYSA-N	1	1	323.393	1.855	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)C2	ZINC000174632177	198362965	/nfs/dbraw/zinc/36/29/65/198362965.db2.gz	OOXWIUOCAOPLPH-NWDGAFQWSA-N	1	1	304.350	1.486	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCc3sccc3C2)c1	ZINC000075718574	353378147	/nfs/dbraw/zinc/37/81/47/353378147.db2.gz	ATDQLKUIRBZFFP-ZDUSSCGKSA-N	1	1	322.390	1.662	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H]1COc2ccccc2O1	ZINC000174809300	198387656	/nfs/dbraw/zinc/38/76/56/198387656.db2.gz	RCDXYNRODRTKOP-ZDUSSCGKSA-N	1	1	318.333	1.563	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000089930603	353783408	/nfs/dbraw/zinc/78/34/08/353783408.db2.gz	XHYRNOWWRRLCJY-JQWIXIFHSA-N	1	1	307.350	1.287	20	5		DDBDMO
Cc1c(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154979082	354210389	/nfs/dbraw/zinc/21/03/89/354210389.db2.gz	RGENMQFYFUQVRX-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1c(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154979082	354210391	/nfs/dbraw/zinc/21/03/91/354210391.db2.gz	RGENMQFYFUQVRX-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000280738395	354423816	/nfs/dbraw/zinc/42/38/16/354423816.db2.gz	LZYSRDOEPPJAEB-OAHLLOKOSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000586801863	354868099	/nfs/dbraw/zinc/86/80/99/354868099.db2.gz	XVBVFEXILPNFQE-GFCCVEGCSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000586801863	354868103	/nfs/dbraw/zinc/86/81/03/354868103.db2.gz	XVBVFEXILPNFQE-GFCCVEGCSA-N	1	1	301.306	1.234	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588861857	354944380	/nfs/dbraw/zinc/94/43/80/354944380.db2.gz	VSYGJQZVQCHZQS-NWDGAFQWSA-N	1	1	323.324	1.015	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588863023	354944556	/nfs/dbraw/zinc/94/45/56/354944556.db2.gz	NYGMJSNDNLUBLN-KGLIPLIRSA-N	1	1	319.361	1.184	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](CO)[C@H](O)C2)cc1	ZINC000588966441	354952677	/nfs/dbraw/zinc/95/26/77/354952677.db2.gz	ZIMUGFGVIKAJEX-IUODEOHRSA-N	1	1	310.350	1.039	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]([NH+](C)C)[C@H]2C)c1[N+](=O)[O-]	ZINC000590403648	355085700	/nfs/dbraw/zinc/08/57/00/355085700.db2.gz	LLZRDAJUGYRHRW-NXEZZACHSA-N	1	1	309.370	1.606	20	5		DDBDMO
COc1cccc2c1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2	ZINC000590759751	355169351	/nfs/dbraw/zinc/16/93/51/355169351.db2.gz	JSBWMEDYJVTWJU-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@](O)(CO)C2)cc1	ZINC000590970138	355225986	/nfs/dbraw/zinc/22/59/86/355225986.db2.gz	FIFSYNUHPOIHCU-HNNXBMFYSA-N	1	1	310.350	1.183	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591083758	355245671	/nfs/dbraw/zinc/24/56/71/355245671.db2.gz	DPLHDZOLGYCNDL-ARLBYUKCSA-N	1	1	315.373	1.861	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[N@H+](C)[C@H]2C1	ZINC000591514540	355322801	/nfs/dbraw/zinc/32/28/01/355322801.db2.gz	GYBHRKWCWKJYFK-DOMZBBRYSA-N	1	1	303.362	1.988	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@H]2CO)c1	ZINC000592999033	355765749	/nfs/dbraw/zinc/76/57/49/355765749.db2.gz	JCBGQEODUPWHGJ-ZDUSSCGKSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@H]2CO)c1	ZINC000592999033	355765753	/nfs/dbraw/zinc/76/57/53/355765753.db2.gz	JCBGQEODUPWHGJ-ZDUSSCGKSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1	ZINC000593019057	355771335	/nfs/dbraw/zinc/77/13/35/355771335.db2.gz	DGQLKQOJIFOPFB-NWDGAFQWSA-N	1	1	321.377	1.906	20	5		DDBDMO
Cc1c(NC(=O)N2CC([N@@H+]3CC[C@@H](O)C3)C2)cccc1[N+](=O)[O-]	ZINC000593136361	355809659	/nfs/dbraw/zinc/80/96/59/355809659.db2.gz	QVMNQFURJHZPJK-GFCCVEGCSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cc1c(NC(=O)N2CC([N@H+]3CC[C@@H](O)C3)C2)cccc1[N+](=O)[O-]	ZINC000593136361	355809662	/nfs/dbraw/zinc/80/96/62/355809662.db2.gz	QVMNQFURJHZPJK-GFCCVEGCSA-N	1	1	320.349	1.186	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593499001	355904890	/nfs/dbraw/zinc/90/48/90/355904890.db2.gz	KPIBXVOZMQALDS-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593504523	355906262	/nfs/dbraw/zinc/90/62/62/355906262.db2.gz	OPANSOWKSDKZJT-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594604121	356262570	/nfs/dbraw/zinc/26/25/70/356262570.db2.gz	QVHCDSNDCRILKO-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=C1NCC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000594959226	356365140	/nfs/dbraw/zinc/36/51/40/356365140.db2.gz	AXSOJNGJQDEEOG-ZDUSSCGKSA-N	1	1	301.302	1.833	20	5		DDBDMO
Cc1noc(C[N@H+]2CCCC[C@@H]2[C@H]2CNC(=O)C2)c1[N+](=O)[O-]	ZINC000595406329	356481572	/nfs/dbraw/zinc/48/15/72/356481572.db2.gz	BXHCMZIXAODAHS-GHMZBOCLSA-N	1	1	308.338	1.382	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC3(COC3)C2)c2c(c1)COCO2	ZINC000595833233	356670599	/nfs/dbraw/zinc/67/05/99/356670599.db2.gz	BOQAXTHVMPBRQI-UHFFFAOYSA-N	1	1	306.318	1.684	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC3(COC3)C2)c2c(c1)COCO2	ZINC000595833233	356670604	/nfs/dbraw/zinc/67/06/04/356670604.db2.gz	BOQAXTHVMPBRQI-UHFFFAOYSA-N	1	1	306.318	1.684	20	5		DDBDMO
CC(C)NC(=O)[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000595851417	356677038	/nfs/dbraw/zinc/67/70/38/356677038.db2.gz	SCYNLXNFNMKQAV-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[N@H+](CC1=CCSC1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595888444	356692714	/nfs/dbraw/zinc/69/27/14/356692714.db2.gz	MCQQTXVCSRJBFU-CYBMUJFWSA-N	1	1	324.402	1.940	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000596119883	356780282	/nfs/dbraw/zinc/78/02/82/356780282.db2.gz	DMEBYVKOUUGEAA-LBPRGKRZSA-N	1	1	304.350	1.367	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596173925	356801545	/nfs/dbraw/zinc/80/15/45/356801545.db2.gz	CBCLDTXAPKKFDQ-JTQLQIEISA-N	1	1	315.333	1.421	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H](C)CO1	ZINC000596432128	356877924	/nfs/dbraw/zinc/87/79/24/356877924.db2.gz	QMHVUIHBEFDTJX-GHMZBOCLSA-N	1	1	322.365	1.215	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H](C)CO1	ZINC000596432128	356877927	/nfs/dbraw/zinc/87/79/27/356877927.db2.gz	QMHVUIHBEFDTJX-GHMZBOCLSA-N	1	1	322.365	1.215	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596336036	356860105	/nfs/dbraw/zinc/86/01/05/356860105.db2.gz	KZGKBECPQAIGHK-NSHDSACASA-N	1	1	306.366	1.978	20	5		DDBDMO
Cc1ccnc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1[N+](=O)[O-]	ZINC000596537459	356910554	/nfs/dbraw/zinc/91/05/54/356910554.db2.gz	GPAZZBLEXFKPBT-ZDUSSCGKSA-N	1	1	306.366	1.334	20	5		DDBDMO
COc1cccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1[N+](=O)[O-]	ZINC000596540543	356911384	/nfs/dbraw/zinc/91/13/84/356911384.db2.gz	UISGTZUNGIDHKQ-CYBMUJFWSA-N	1	1	321.377	1.639	20	5		DDBDMO
CCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@@H]1CC[N@@H+](CC)C1	ZINC000598043207	357440835	/nfs/dbraw/zinc/44/08/35/357440835.db2.gz	RYFBXXWLUQISPZ-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597944573	357394082	/nfs/dbraw/zinc/39/40/82/357394082.db2.gz	FPZDIILZZCGZOR-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000599790198	358059434	/nfs/dbraw/zinc/05/94/34/358059434.db2.gz	BEESUKBQMODZKE-LBPRGKRZSA-N	1	1	322.365	1.400	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(CNC[C@H]3COCC[NH2+]3)o2)c1	ZINC000600678507	358280495	/nfs/dbraw/zinc/28/04/95/358280495.db2.gz	RPUWFGFAXTYVFA-ZDUSSCGKSA-N	1	1	317.345	1.933	20	5		DDBDMO
COC(C[N@@H+](CCCO)Cc1cccc([N+](=O)[O-])c1C)OC	ZINC000180637606	199188833	/nfs/dbraw/zinc/18/88/33/199188833.db2.gz	NOSNEAKQTAFIEM-UHFFFAOYSA-N	1	1	312.366	1.707	20	5		DDBDMO
CC(C)NC(=O)CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601103237	358402572	/nfs/dbraw/zinc/40/25/72/358402572.db2.gz	QWYDSGWTGALUQL-UHFFFAOYSA-N	1	1	302.334	1.892	20	5		DDBDMO
C[C@H](CN1CCOCC1)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601104659	358403662	/nfs/dbraw/zinc/40/36/62/358403662.db2.gz	CFYVGHGTOUPMTM-GFCCVEGCSA-N	1	1	316.361	1.698	20	5		DDBDMO
C[C@@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@H+](C)CCO1	ZINC000601130818	358415271	/nfs/dbraw/zinc/41/52/71/358415271.db2.gz	CHCBZVWZOUYXHE-BDJLRTHQSA-N	1	1	316.361	1.696	20	5		DDBDMO
C[C@@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@@H+](C)CCO1	ZINC000601130818	358415275	/nfs/dbraw/zinc/41/52/75/358415275.db2.gz	CHCBZVWZOUYXHE-BDJLRTHQSA-N	1	1	316.361	1.696	20	5		DDBDMO
C[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCS1(=O)=O	ZINC000601144583	358419378	/nfs/dbraw/zinc/41/93/78/358419378.db2.gz	VFJZELDAIYPJRY-JTQLQIEISA-N	1	1	321.358	1.766	20	5		DDBDMO
CCn1cncc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149179	358422594	/nfs/dbraw/zinc/42/25/94/358422594.db2.gz	KIHUICBJLRHHAN-HNNXBMFYSA-N	1	1	304.350	1.809	20	5		DDBDMO
CC(C)(CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)OCCO	ZINC000601166177	358430064	/nfs/dbraw/zinc/43/00/64/358430064.db2.gz	KRWOIYZWRFZYHO-UHFFFAOYSA-N	1	1	305.334	1.764	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CC[N@H+]4C[C@H](O)C[C@H]4C3)c2c1	ZINC000601186947	358439463	/nfs/dbraw/zinc/43/94/63/358439463.db2.gz	HROASIYTTGZWSJ-QWHCGFSZSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3c(F)cccc3[N+](=O)[O-])C2)C1	ZINC000601596467	358617627	/nfs/dbraw/zinc/61/76/27/358617627.db2.gz	ONZFQMSWXOKCIQ-HNNXBMFYSA-N	1	1	307.325	1.902	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000601776161	358690741	/nfs/dbraw/zinc/69/07/41/358690741.db2.gz	HICOPDMTSNUAEB-BLLLJJGKSA-N	1	1	321.377	1.260	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601975494	358761901	/nfs/dbraw/zinc/76/19/01/358761901.db2.gz	WBJSKTQIJPFUBM-UTUOFQBUSA-N	1	1	305.334	1.500	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CCCC[N@H+]1C	ZINC000602071846	358801710	/nfs/dbraw/zinc/80/17/10/358801710.db2.gz	GYVVJBHJHLDNGZ-ZDUSSCGKSA-N	1	1	307.350	1.704	20	5		DDBDMO
Cn1cc(CN2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])n1	ZINC000602426183	358968333	/nfs/dbraw/zinc/96/83/33/358968333.db2.gz	YQRPENJXBVLTEB-UHFFFAOYSA-N	1	1	315.377	1.646	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000602782542	359187308	/nfs/dbraw/zinc/18/73/08/359187308.db2.gz	CSJMQSHSYFHWGH-KGLIPLIRSA-N	1	1	307.398	1.516	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Nc2c(C)cncc2[N+](=O)[O-])CC1	ZINC000602959344	359323118	/nfs/dbraw/zinc/32/31/18/359323118.db2.gz	TWYGWNMNTCBJJS-UHFFFAOYSA-N	1	1	307.354	1.280	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)CC[N@@H+](C)C1CC1	ZINC000186742887	200001873	/nfs/dbraw/zinc/00/18/73/200001873.db2.gz	ZXRDWHAKFCYECK-LBPRGKRZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000186939485	200034695	/nfs/dbraw/zinc/03/46/95/200034695.db2.gz	HGYMJYAGONHQEE-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
C[N@H+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000603431882	359636705	/nfs/dbraw/zinc/63/67/05/359636705.db2.gz	HUXPYFIJIBPGLU-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)CC[C@@H]21	ZINC000187194760	200075105	/nfs/dbraw/zinc/07/51/05/200075105.db2.gz	DMBWAIRPECDWNB-PWSUYJOCSA-N	1	1	320.349	1.252	20	5		DDBDMO
CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCOC1	ZINC000609631596	360339821	/nfs/dbraw/zinc/33/98/21/360339821.db2.gz	DQTCOJWHSLLRIN-LLVKDONJSA-N	1	1	307.350	1.552	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(C)(C)CO	ZINC000609894816	360362797	/nfs/dbraw/zinc/36/27/97/360362797.db2.gz	AJXNLZKNPSUHHP-UHFFFAOYSA-N	1	1	307.350	1.187	20	5		DDBDMO
O=C(C[N@@H+](CCCO)C1CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610132923	360385292	/nfs/dbraw/zinc/38/52/92/360385292.db2.gz	FOUTXCCCAHKLNS-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@H+](CCCO)C1CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610132923	360385297	/nfs/dbraw/zinc/38/52/97/360385297.db2.gz	FOUTXCCCAHKLNS-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC000610392466	360424858	/nfs/dbraw/zinc/42/48/58/360424858.db2.gz	XWJWSAXKNXKDKS-UHFFFAOYSA-N	1	1	306.366	1.607	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762767	360531387	/nfs/dbraw/zinc/53/13/87/360531387.db2.gz	UDRNEYHHSZMTFO-GXTWGEPZSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762767	360531392	/nfs/dbraw/zinc/53/13/92/360531392.db2.gz	UDRNEYHHSZMTFO-GXTWGEPZSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(NC1CC[NH+](C2CC2)CC1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000610891185	360565639	/nfs/dbraw/zinc/56/56/39/360565639.db2.gz	RWRYTJQYXHWALM-UHFFFAOYSA-N	1	1	305.334	1.657	20	5		DDBDMO
COCC1([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000611178927	360650208	/nfs/dbraw/zinc/65/02/08/360650208.db2.gz	TXBYYQACUQCZKY-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C	ZINC000611088151	360619618	/nfs/dbraw/zinc/61/96/18/360619618.db2.gz	FRUKRSVEBPPYHP-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C	ZINC000611088151	360619623	/nfs/dbraw/zinc/61/96/23/360619623.db2.gz	FRUKRSVEBPPYHP-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
CCO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000612030395	360894251	/nfs/dbraw/zinc/89/42/51/360894251.db2.gz	UMSDEWJTKNQMKR-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000193822763	201128892	/nfs/dbraw/zinc/12/88/92/201128892.db2.gz	MPSIGODNSLCQKD-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000193822763	201128895	/nfs/dbraw/zinc/12/88/95/201128895.db2.gz	MPSIGODNSLCQKD-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C	ZINC000619537147	364052492	/nfs/dbraw/zinc/05/24/92/364052492.db2.gz	ZGUXZJMKMIUAGR-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H](C[NH3+])C1	ZINC000261729549	203103701	/nfs/dbraw/zinc/10/37/01/203103701.db2.gz	HOENHBNUUQHUBQ-ONGXEEELSA-N	1	1	317.349	1.671	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000264683935	204077335	/nfs/dbraw/zinc/07/73/35/204077335.db2.gz	LFYNKGWMZAZFTH-AWEZNQCLSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000274885986	212010390	/nfs/dbraw/zinc/01/03/90/212010390.db2.gz	ORXOYJQCMHZSAQ-SNVBAGLBSA-N	1	1	300.318	1.797	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000274885986	212010391	/nfs/dbraw/zinc/01/03/91/212010391.db2.gz	ORXOYJQCMHZSAQ-SNVBAGLBSA-N	1	1	300.318	1.797	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCc1ccco1	ZINC000282529916	217065416	/nfs/dbraw/zinc/06/54/16/217065416.db2.gz	UXMPSEWYAHDYCA-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCc1ccco1	ZINC000282529916	217065420	/nfs/dbraw/zinc/06/54/20/217065420.db2.gz	UXMPSEWYAHDYCA-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCN(c3nccs3)CC2)c1	ZINC000265968213	205006821	/nfs/dbraw/zinc/00/68/21/205006821.db2.gz	AGORJCQPYXXREN-UHFFFAOYSA-N	1	1	322.394	1.460	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1Cc2ccccc2C1	ZINC000266504462	205394832	/nfs/dbraw/zinc/39/48/32/205394832.db2.gz	AGTQWGMXVJIRTA-MRXNPFEDSA-N	1	1	316.361	1.251	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1[C@H]1CCCOC1	ZINC000566970904	304190753	/nfs/dbraw/zinc/19/07/53/304190753.db2.gz	FTBPAXBKLFNIOO-ZFWWWQNUSA-N	1	1	321.377	1.648	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284408555	218015263	/nfs/dbraw/zinc/01/52/63/218015263.db2.gz	NUHFCYSEFFQDDC-OQPBUACISA-N	1	1	322.340	1.529	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@@H]1O	ZINC000159481162	197357176	/nfs/dbraw/zinc/35/71/76/197357176.db2.gz	OVGNKEVTBYGJGD-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@@H]1O	ZINC000159481162	197357178	/nfs/dbraw/zinc/35/71/78/197357178.db2.gz	OVGNKEVTBYGJGD-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCCC[C@H]1C	ZINC000339003573	250241443	/nfs/dbraw/zinc/24/14/43/250241443.db2.gz	OCJKYRYAEGHHQS-MNOVXSKESA-N	1	1	321.381	1.764	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCO[C@]2(CCCOC2)C1	ZINC000285333977	218385639	/nfs/dbraw/zinc/38/56/39/218385639.db2.gz	OCIHLDHHLDHTFN-MRXNPFEDSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCO[C@]2(CCCOC2)C1	ZINC000285333977	218385642	/nfs/dbraw/zinc/38/56/42/218385642.db2.gz	OCIHLDHHLDHTFN-MRXNPFEDSA-N	1	1	322.361	1.855	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000340407408	251051198	/nfs/dbraw/zinc/05/11/98/251051198.db2.gz	KSMBDZAHCOCBFD-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000340472095	251072501	/nfs/dbraw/zinc/07/25/01/251072501.db2.gz	AOIUPGQMHVSXAJ-LLVKDONJSA-N	1	1	310.354	1.010	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](CC(N)=O)C(C)C)cccc1[N+](=O)[O-]	ZINC000063483186	184282966	/nfs/dbraw/zinc/28/29/66/184282966.db2.gz	LUKYRMAEUBGOKA-UHFFFAOYSA-N	1	1	322.365	1.428	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCNC(=O)CC1	ZINC000065955329	184383604	/nfs/dbraw/zinc/38/36/04/184383604.db2.gz	WZKPUVKNSDKKCU-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1	ZINC000272969445	210352219	/nfs/dbraw/zinc/35/22/19/210352219.db2.gz	BETPXVWPUCPMJR-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451547221	533094834	/nfs/dbraw/zinc/09/48/34/533094834.db2.gz	KOXZQPCGCBWWTQ-BBRMVZONSA-N	1	1	322.361	1.698	20	5		DDBDMO
COC[C@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000452035171	533130230	/nfs/dbraw/zinc/13/02/30/533130230.db2.gz	GDRVOODIDLLGDF-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](F)C1	ZINC000451199594	533138063	/nfs/dbraw/zinc/13/80/63/533138063.db2.gz	RGIFCSRBVPCBFO-SNVBAGLBSA-N	1	1	311.313	1.976	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@H]1CCC[C@H]1O	ZINC000352661575	285205404	/nfs/dbraw/zinc/20/54/04/285205404.db2.gz	UHYODYGAFIUJQW-DDTOSNHZSA-N	1	1	307.350	1.767	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C	ZINC000155115114	197023283	/nfs/dbraw/zinc/02/32/83/197023283.db2.gz	OYFPSVZFWGBIMF-PHIMTYICSA-N	1	1	309.370	1.041	20	5		DDBDMO
COc1cc(C[N@H+](C)CCNC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000352782436	285297553	/nfs/dbraw/zinc/29/75/53/285297553.db2.gz	DOELAEAHAGLPDP-UHFFFAOYSA-N	1	1	310.354	1.306	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCNC(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000352782436	285297554	/nfs/dbraw/zinc/29/75/54/285297554.db2.gz	DOELAEAHAGLPDP-UHFFFAOYSA-N	1	1	310.354	1.306	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000452072014	533673010	/nfs/dbraw/zinc/67/30/10/533673010.db2.gz	TWVVAQHRBWQYIP-JHJVBQTASA-N	1	1	310.350	1.037	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000090460474	407168267	/nfs/dbraw/zinc/16/82/67/407168267.db2.gz	IOUNPRDBBAKCEV-CABCVRRESA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000090460474	407168269	/nfs/dbraw/zinc/16/82/69/407168269.db2.gz	IOUNPRDBBAKCEV-CABCVRRESA-N	1	1	319.361	1.578	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c1	ZINC000057701195	407217274	/nfs/dbraw/zinc/21/72/74/407217274.db2.gz	QLMTWQWNYPKIAH-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000067412549	407273418	/nfs/dbraw/zinc/27/34/18/407273418.db2.gz	NSHJEQRPDLPIMG-CQSZACIVSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000185758368	407493658	/nfs/dbraw/zinc/49/36/58/407493658.db2.gz	BZQBKAUBQQRVSM-JTQLQIEISA-N	1	1	313.379	1.356	20	5		DDBDMO
COCC1=CC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000185895755	407534043	/nfs/dbraw/zinc/53/40/43/407534043.db2.gz	BWEWPABRWIXSIA-UHFFFAOYSA-N	1	1	305.334	1.472	20	5		DDBDMO
COCC1=CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000185895755	407534045	/nfs/dbraw/zinc/53/40/45/407534045.db2.gz	BWEWPABRWIXSIA-UHFFFAOYSA-N	1	1	305.334	1.472	20	5		DDBDMO
C[C@H]1C[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC[NH2+]1	ZINC000261783990	407613908	/nfs/dbraw/zinc/61/39/08/407613908.db2.gz	XCTOCCKWCFBMTC-DTWKUNHWSA-N	1	1	317.342	1.153	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000266758725	407625899	/nfs/dbraw/zinc/62/58/99/407625899.db2.gz	GUPCUFICYSYZNT-AWEZNQCLSA-N	1	1	320.393	1.921	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1	ZINC000115436590	407681391	/nfs/dbraw/zinc/68/13/91/407681391.db2.gz	DEFCFJGWPWKJDD-ZDUSSCGKSA-N	1	1	323.397	1.290	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000179023473	407695819	/nfs/dbraw/zinc/69/58/19/407695819.db2.gz	VTTYTIBOJXOLBU-UHFFFAOYSA-N	1	1	320.353	1.548	20	5		DDBDMO
Cc1c(NC(=O)C(=O)NC[C@H]2CCC[N@@H+]2C)cccc1[N+](=O)[O-]	ZINC000118106460	407890548	/nfs/dbraw/zinc/89/05/48/407890548.db2.gz	TUJBYEUFCHRZBQ-LLVKDONJSA-N	1	1	320.349	1.052	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866036	407957345	/nfs/dbraw/zinc/95/73/45/407957345.db2.gz	KPSHJFXDYIEGPH-NEPJUHHUSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866036	407957349	/nfs/dbraw/zinc/95/73/49/407957349.db2.gz	KPSHJFXDYIEGPH-NEPJUHHUSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[C@@H](C)NC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245433119	407980113	/nfs/dbraw/zinc/98/01/13/407980113.db2.gz	BROSCZJIYGSURI-VXGBXAGGSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[C@@H](C)NC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245433119	407980118	/nfs/dbraw/zinc/98/01/18/407980118.db2.gz	BROSCZJIYGSURI-VXGBXAGGSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CCCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000268158473	407919640	/nfs/dbraw/zinc/91/96/40/407919640.db2.gz	SRGXMGMPZKKUCI-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
CCNC(=O)C[N@H+]1CCCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000268158473	407919645	/nfs/dbraw/zinc/91/96/45/407919645.db2.gz	SRGXMGMPZKKUCI-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](C)C1	ZINC000153896321	407927218	/nfs/dbraw/zinc/92/72/18/407927218.db2.gz	AJQDQOXVUQVKEB-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000118751823	407940407	/nfs/dbraw/zinc/94/04/07/407940407.db2.gz	FOIHHSIMDJBLPM-AWEZNQCLSA-N	1	1	322.365	1.515	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024085	408025236	/nfs/dbraw/zinc/02/52/36/408025236.db2.gz	LNIAOFZVFUROPF-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024085	408025240	/nfs/dbraw/zinc/02/52/40/408025240.db2.gz	LNIAOFZVFUROPF-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](C(N)=O)C1	ZINC000175068268	408042182	/nfs/dbraw/zinc/04/21/82/408042182.db2.gz	JYSINGWBFNHPAC-NSHDSACASA-N	1	1	307.350	1.691	20	5		DDBDMO
C[C@@H](CCO)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272564004	407986326	/nfs/dbraw/zinc/98/63/26/407986326.db2.gz	UQLKYNDKOSPJNU-SMDDNHRTSA-N	1	1	304.350	1.778	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000272577430	407991274	/nfs/dbraw/zinc/99/12/74/407991274.db2.gz	GJQORMICQLVFOZ-WFASDCNBSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000245765076	408065012	/nfs/dbraw/zinc/06/50/12/408065012.db2.gz	JINJVWZMNLFTIV-RKDXNWHRSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000245765076	408065017	/nfs/dbraw/zinc/06/50/17/408065017.db2.gz	JINJVWZMNLFTIV-RKDXNWHRSA-N	1	1	315.757	1.888	20	5		DDBDMO
CSCC[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182024215	408066143	/nfs/dbraw/zinc/06/61/43/408066143.db2.gz	KHFYWDBEZQWPAQ-LLVKDONJSA-N	1	1	300.380	1.629	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000246039183	408126585	/nfs/dbraw/zinc/12/65/85/408126585.db2.gz	QTDCVUWOSYGQTH-CABCVRRESA-N	1	1	319.361	1.811	20	5		DDBDMO
CO[C@@H]1CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000246039183	408126590	/nfs/dbraw/zinc/12/65/90/408126590.db2.gz	QTDCVUWOSYGQTH-CABCVRRESA-N	1	1	319.361	1.811	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000246310950	408216877	/nfs/dbraw/zinc/21/68/77/408216877.db2.gz	ZIRMKDXYAXURSF-DZGCQCFKSA-N	1	1	324.377	1.693	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190840154	408326586	/nfs/dbraw/zinc/32/65/86/408326586.db2.gz	SVIYDAWWXKFAQT-NEPJUHHUSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190840154	408326588	/nfs/dbraw/zinc/32/65/88/408326588.db2.gz	SVIYDAWWXKFAQT-NEPJUHHUSA-N	1	1	307.350	1.402	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1	ZINC000269399816	408296258	/nfs/dbraw/zinc/29/62/58/408296258.db2.gz	URUFPLWWCPLIHL-JTQLQIEISA-N	1	1	300.746	1.776	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2cc[nH]n2)C1	ZINC000131260110	162009552	/nfs/dbraw/zinc/00/95/52/162009552.db2.gz	QUWXKTNIJFDGNH-LBPRGKRZSA-N	1	1	317.349	1.359	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000134733332	162085293	/nfs/dbraw/zinc/08/52/93/162085293.db2.gz	OGUKWXBWHYYDBV-ZDUSSCGKSA-N	1	1	307.398	1.740	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000269547495	408348704	/nfs/dbraw/zinc/34/87/04/408348704.db2.gz	XGDZTEFHWIJXDI-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
CN1CC[NH+](CCCNc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000269650615	408374498	/nfs/dbraw/zinc/37/44/98/408374498.db2.gz	QNCQVNOPFGGTFZ-UHFFFAOYSA-N	1	1	314.336	1.922	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000274574854	408456117	/nfs/dbraw/zinc/45/61/17/408456117.db2.gz	GIXBHDJVRZCXGW-MRXNPFEDSA-N	1	1	322.361	1.873	20	5		DDBDMO
CC[NH+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000264171601	408390327	/nfs/dbraw/zinc/39/03/27/408390327.db2.gz	VZSPDFMNNAGFSA-UHFFFAOYSA-N	1	1	311.313	1.277	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000177007233	408495229	/nfs/dbraw/zinc/49/52/29/408495229.db2.gz	KDVJCBOFNGHVND-NWDGAFQWSA-N	1	1	318.377	1.794	20	5		DDBDMO
CCC[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248070135	408530463	/nfs/dbraw/zinc/53/04/63/408530463.db2.gz	QFYKMKQBPCUQHZ-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248070135	408530470	/nfs/dbraw/zinc/53/04/70/408530470.db2.gz	QFYKMKQBPCUQHZ-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000177213515	408553040	/nfs/dbraw/zinc/55/30/40/408553040.db2.gz	CNXGJJXMYGKGBZ-CMPLNLGQSA-N	1	1	321.381	1.231	20	5		DDBDMO
C[C@H](CCN1CC[NH+](C)CC1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000184290857	408585527	/nfs/dbraw/zinc/58/55/27/408585527.db2.gz	YYSXZEVXPWQYQL-CYBMUJFWSA-N	1	1	320.393	1.351	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCCC[NH+]1CCOCC1	ZINC000192889396	408666384	/nfs/dbraw/zinc/66/63/84/408666384.db2.gz	HVQNTVKRRNWEGY-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000251933782	408791382	/nfs/dbraw/zinc/79/13/82/408791382.db2.gz	UBUONCFZSBKOJG-XNRPHZJLSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cccc(OC)c1[N+](=O)[O-]	ZINC000168307202	408818507	/nfs/dbraw/zinc/81/85/07/408818507.db2.gz	NDYSOTJPMMEURY-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
COCC[NH+]1CCN(c2nc3sccn3c2[N+](=O)[O-])CC1	ZINC000280920249	408859583	/nfs/dbraw/zinc/85/95/83/408859583.db2.gz	GHFVIYNAUYPLGB-UHFFFAOYSA-N	1	1	311.367	1.072	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H](CC[NH3+])C2)c1[N+](=O)[O-]	ZINC000281618133	408897442	/nfs/dbraw/zinc/89/74/42/408897442.db2.gz	BWVQROOECJHRRG-JTQLQIEISA-N	1	1	309.370	1.471	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1csc([N+](=O)[O-])c1	ZINC000189460053	163101885	/nfs/dbraw/zinc/10/18/85/163101885.db2.gz	ZXSDTJMDVLHYGU-NSHDSACASA-N	1	1	313.423	1.933	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1(CO)CCC1	ZINC000292185609	408997154	/nfs/dbraw/zinc/99/71/54/408997154.db2.gz	QXISRPKBQWUZMH-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1(CO)CCC1	ZINC000292185609	408997160	/nfs/dbraw/zinc/99/71/60/408997160.db2.gz	QXISRPKBQWUZMH-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](C)N1CC[NH+](C)CC1	ZINC000287975351	409124840	/nfs/dbraw/zinc/12/48/40/409124840.db2.gz	RBQGCZDGMXWOIK-GFCCVEGCSA-N	1	1	320.393	1.845	20	5		DDBDMO
C[C@@H]1CN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293848462	409192680	/nfs/dbraw/zinc/19/26/80/409192680.db2.gz	AHHJHJISCMAZBT-TXEJJXNPSA-N	1	1	307.350	1.525	20	5		DDBDMO
NC(=O)[C@@]1(O)CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000314841874	164016914	/nfs/dbraw/zinc/01/69/14/164016914.db2.gz	UKBCLNXSZNBWSO-CYBMUJFWSA-N	1	1	313.741	1.060	20	5		DDBDMO
NC(=O)[C@@]1(O)CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000314841874	164016916	/nfs/dbraw/zinc/01/69/16/164016916.db2.gz	UKBCLNXSZNBWSO-CYBMUJFWSA-N	1	1	313.741	1.060	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000295389147	409462243	/nfs/dbraw/zinc/46/22/43/409462243.db2.gz	KZODMTYQMSYXRX-PMPSAXMXSA-N	1	1	321.377	1.033	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CC(O)C1	ZINC000353484995	164123526	/nfs/dbraw/zinc/12/35/26/164123526.db2.gz	LQDHHAMEMBNCQI-UHFFFAOYSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000408029607	164203320	/nfs/dbraw/zinc/20/33/20/164203320.db2.gz	UWLQOFPMZNTXFY-KGLIPLIRSA-N	1	1	304.350	1.655	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408069489	164216532	/nfs/dbraw/zinc/21/65/32/164216532.db2.gz	BVJUOJIYYHSDGS-QWRGUYRKSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408069489	164216535	/nfs/dbraw/zinc/21/65/35/164216535.db2.gz	BVJUOJIYYHSDGS-QWRGUYRKSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000408073602	164218778	/nfs/dbraw/zinc/21/87/78/164218778.db2.gz	QSZLWEPKKSPGMY-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000408073602	164218780	/nfs/dbraw/zinc/21/87/80/164218780.db2.gz	QSZLWEPKKSPGMY-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@@H+](CCCO)C1	ZINC000296420159	409540580	/nfs/dbraw/zinc/54/05/80/409540580.db2.gz	LIWLORGAOSOLCE-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356715586	409545946	/nfs/dbraw/zinc/54/59/46/409545946.db2.gz	SEZIUXJWURPXQU-GFCCVEGCSA-N	1	1	323.397	1.569	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCC[C@H](O)C1	ZINC000304228585	409579365	/nfs/dbraw/zinc/57/93/65/409579365.db2.gz	MLYBWZAXZBQJOR-LBPRGKRZSA-N	1	1	321.333	1.350	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000354008302	409595649	/nfs/dbraw/zinc/59/56/49/409595649.db2.gz	SCCRHAYUKZANOH-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000354147468	409695261	/nfs/dbraw/zinc/69/52/61/409695261.db2.gz	DECPUABOHKDPQQ-OAHLLOKOSA-N	1	1	321.377	1.364	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000356835055	409644689	/nfs/dbraw/zinc/64/46/89/409644689.db2.gz	BFTQUMIKABYBSH-RYUDHWBXSA-N	1	1	323.397	1.349	20	5		DDBDMO
COc1cc(C[N@H+](C)[C@@H](C)C[S@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630492	409773301	/nfs/dbraw/zinc/77/33/01/409773301.db2.gz	FKWJIRCJPGGSPN-FVINQWEUSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H](C)C[S@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630492	409773310	/nfs/dbraw/zinc/77/33/10/409773310.db2.gz	FKWJIRCJPGGSPN-FVINQWEUSA-N	1	1	300.380	1.802	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000354419423	409840263	/nfs/dbraw/zinc/84/02/63/409840263.db2.gz	XEIXMPSMGDFOJP-CYBMUJFWSA-N	1	1	323.397	1.562	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000357005050	409786441	/nfs/dbraw/zinc/78/64/41/409786441.db2.gz	QQQNWFUNWPLTET-IPYPFGDCSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005050	409786448	/nfs/dbraw/zinc/78/64/48/409786448.db2.gz	QQQNWFUNWPLTET-IPYPFGDCSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005050	409786456	/nfs/dbraw/zinc/78/64/56/409786456.db2.gz	QQQNWFUNWPLTET-IPYPFGDCSA-N	1	1	323.393	1.359	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1C	ZINC000354379690	409811019	/nfs/dbraw/zinc/81/10/19/409811019.db2.gz	CHBINFKHNOOXFL-RYUDHWBXSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@H]1CC[N@H+](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000354513301	409911001	/nfs/dbraw/zinc/91/10/01/409911001.db2.gz	OMMLFINIQRIZQO-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000354513301	409911007	/nfs/dbraw/zinc/91/10/07/409911007.db2.gz	OMMLFINIQRIZQO-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
Cn1c(C(=O)N2CCC(Cc3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000332117653	409901182	/nfs/dbraw/zinc/90/11/82/409901182.db2.gz	VPUAKSVLTUDCIL-UHFFFAOYSA-N	1	1	317.349	1.751	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1=O	ZINC000338344860	409927552	/nfs/dbraw/zinc/92/75/52/409927552.db2.gz	CSCSAPHQNFUKHQ-HNNXBMFYSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H]1[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@@H+]1C	ZINC000354548073	409930032	/nfs/dbraw/zinc/93/00/32/409930032.db2.gz	RRUWPZCROHOOCK-MFKMUULPSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H]1[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000354548073	409930038	/nfs/dbraw/zinc/93/00/38/409930038.db2.gz	RRUWPZCROHOOCK-MFKMUULPSA-N	1	1	313.379	1.356	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000298270590	410162529	/nfs/dbraw/zinc/16/25/29/410162529.db2.gz	GPOINSKHXWILSI-NFAWXSAZSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000298270590	410162537	/nfs/dbraw/zinc/16/25/37/410162537.db2.gz	GPOINSKHXWILSI-NFAWXSAZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@@H+](CCNC(=O)COc1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000355202984	410376804	/nfs/dbraw/zinc/37/68/04/410376804.db2.gz	CZVMIGPIUANMKN-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343460460	410469686	/nfs/dbraw/zinc/46/96/86/410469686.db2.gz	RVBOVKYMYFVITK-STQMWFEESA-N	1	1	320.393	1.996	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000352185437	410530203	/nfs/dbraw/zinc/53/02/03/410530203.db2.gz	CJMXVBAGUNIJFI-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343612224	410569682	/nfs/dbraw/zinc/56/96/82/410569682.db2.gz	VNXXGSLPKKRKBI-FZMZJTMJSA-N	1	1	306.366	1.877	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000355592618	410596045	/nfs/dbraw/zinc/59/60/45/410596045.db2.gz	YUMCSRBFQVGRRP-GFCCVEGCSA-N	1	1	321.381	1.344	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@@H](C)O	ZINC000352200656	410545041	/nfs/dbraw/zinc/54/50/41/410545041.db2.gz	BFSLONUDBSZQLE-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@@H](C)O	ZINC000352200656	410545045	/nfs/dbraw/zinc/54/50/45/410545045.db2.gz	BFSLONUDBSZQLE-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COC[C@@H]1CC[N@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000352227377	410562372	/nfs/dbraw/zinc/56/23/72/410562372.db2.gz	NFVBJEKNKVRNDR-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000352227377	410562377	/nfs/dbraw/zinc/56/23/77/410562377.db2.gz	NFVBJEKNKVRNDR-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
O=C(NCc1cnc[nH]1)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000359438983	410659921	/nfs/dbraw/zinc/65/99/21/410659921.db2.gz	MBBONISYDZBYEX-UHFFFAOYSA-N	1	1	312.232	1.849	20	5		DDBDMO
CCN1CC[NH+](CCCNc2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000301302063	410697035	/nfs/dbraw/zinc/69/70/35/410697035.db2.gz	VQQSPUJZJQVGBC-UHFFFAOYSA-N	1	1	310.402	1.076	20	5		DDBDMO
C[C@H]1C[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000352952638	410699241	/nfs/dbraw/zinc/69/92/41/410699241.db2.gz	VXJVMUKNUPRGIM-WDEREUQCSA-N	1	1	313.379	1.356	20	5		DDBDMO
CCOc1cc(N2CC[C@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000301506473	410733299	/nfs/dbraw/zinc/73/32/99/410733299.db2.gz	CXVKJYZEZRNNEK-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@](C)(O)C2)cc1[N+](=O)[O-]	ZINC000355762812	410682689	/nfs/dbraw/zinc/68/26/89/410682689.db2.gz	TTZKHGGXFZLWHU-HNNXBMFYSA-N	1	1	324.333	1.103	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000330534944	410756175	/nfs/dbraw/zinc/75/61/75/410756175.db2.gz	RIGMPZRAQGQFKJ-GFCCVEGCSA-N	1	1	324.381	1.020	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@H+](CCO)[C@H](C)C2)c1	ZINC000302464335	410844904	/nfs/dbraw/zinc/84/49/04/410844904.db2.gz	VAVFUVXHVRMNHZ-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@@H+](CCO)[C@H](C)C2)c1	ZINC000302464335	410844912	/nfs/dbraw/zinc/84/49/12/410844912.db2.gz	VAVFUVXHVRMNHZ-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1ccc(NC(=O)CN2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000330661460	410860071	/nfs/dbraw/zinc/86/00/71/410860071.db2.gz	CJULUEGOVDQBKA-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356150093	410864408	/nfs/dbraw/zinc/86/44/08/410864408.db2.gz	HSPBMPYURKVEER-NSHDSACASA-N	1	1	309.370	1.323	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000341052804	410881585	/nfs/dbraw/zinc/88/15/85/410881585.db2.gz	FXHDSUSTZANVNR-TXEJJXNPSA-N	1	1	309.370	1.170	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1	ZINC000330607326	410822149	/nfs/dbraw/zinc/82/21/49/410822149.db2.gz	LMRNKWVMHAOSGO-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1	ZINC000330607326	410822155	/nfs/dbraw/zinc/82/21/55/410822155.db2.gz	LMRNKWVMHAOSGO-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344127848	410973261	/nfs/dbraw/zinc/97/32/61/410973261.db2.gz	KDROLZXLTLMFNA-OLZOCXBDSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344127848	410973265	/nfs/dbraw/zinc/97/32/65/410973265.db2.gz	KDROLZXLTLMFNA-OLZOCXBDSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H](O)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353528658	411048616	/nfs/dbraw/zinc/04/86/16/411048616.db2.gz	OLRUYFITWCWUOA-SMDDNHRTSA-N	1	1	304.350	1.778	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331294211	411063066	/nfs/dbraw/zinc/06/30/66/411063066.db2.gz	RHWFVLWIWJQEKD-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331294211	411063071	/nfs/dbraw/zinc/06/30/71/411063071.db2.gz	RHWFVLWIWJQEKD-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000331201532	411015697	/nfs/dbraw/zinc/01/56/97/411015697.db2.gz	QJKPRYYDDORZGF-STQMWFEESA-N	1	1	321.377	1.881	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CC2(O)CCC2)c([N+](=O)[O-])c1	ZINC000353489235	411024142	/nfs/dbraw/zinc/02/41/42/411024142.db2.gz	OZALYEDYXVVMCU-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CC2(O)CCC2)c([N+](=O)[O-])c1	ZINC000353489235	411024145	/nfs/dbraw/zinc/02/41/45/411024145.db2.gz	OZALYEDYXVVMCU-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331241398	411035592	/nfs/dbraw/zinc/03/55/92/411035592.db2.gz	NGEDMVUONDYAIN-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000331241398	411035595	/nfs/dbraw/zinc/03/55/95/411035595.db2.gz	NGEDMVUONDYAIN-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331241398	411035597	/nfs/dbraw/zinc/03/55/97/411035597.db2.gz	NGEDMVUONDYAIN-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000356590854	411099874	/nfs/dbraw/zinc/09/98/74/411099874.db2.gz	CDOYAWUZRFZCAX-SNVBAGLBSA-N	1	1	309.370	1.422	20	5		DDBDMO
CCc1nn(C)c(N2CC[N@H+](CCOC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000129168553	196026015	/nfs/dbraw/zinc/02/60/15/196026015.db2.gz	FUPFVHWUUHMGHF-LLVKDONJSA-N	1	1	311.386	1.048	20	5		DDBDMO
CCc1nn(C)c(N2CC[N@@H+](CCOC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000129168553	196026017	/nfs/dbraw/zinc/02/60/17/196026017.db2.gz	FUPFVHWUUHMGHF-LLVKDONJSA-N	1	1	311.386	1.048	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)n1	ZINC000191463023	222102378	/nfs/dbraw/zinc/10/23/78/222102378.db2.gz	PMDUFURWKMGPSQ-SNVBAGLBSA-N	1	1	321.337	1.437	20	5		DDBDMO
CCN1CCC([N@@H+](CCn2cc([N+](=O)[O-])cn2)C2CC2)CC1	ZINC000375006150	418586838	/nfs/dbraw/zinc/58/68/38/418586838.db2.gz	VSAAPTOAZAELGJ-UHFFFAOYSA-N	1	1	307.398	1.740	20	5		DDBDMO
CC[NH+]1CCC(N(CCn2cc([N+](=O)[O-])cn2)C2CC2)CC1	ZINC000375006150	418586840	/nfs/dbraw/zinc/58/68/40/418586840.db2.gz	VSAAPTOAZAELGJ-UHFFFAOYSA-N	1	1	307.398	1.740	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000375035557	418592228	/nfs/dbraw/zinc/59/22/28/418592228.db2.gz	CTNFLEBQLKZOOS-NHYWBVRUSA-N	1	1	318.377	1.485	20	5		DDBDMO
NC(=O)[C@@H]1C[N@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]1C(F)(F)F	ZINC000375385102	418631891	/nfs/dbraw/zinc/63/18/91/418631891.db2.gz	VSAOGSREKMSSTF-NXEZZACHSA-N	1	1	317.267	1.690	20	5		DDBDMO
NC(=O)[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])C[C@H]1C(F)(F)F	ZINC000375385102	418631893	/nfs/dbraw/zinc/63/18/93/418631893.db2.gz	VSAOGSREKMSSTF-NXEZZACHSA-N	1	1	317.267	1.690	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000361567637	418679866	/nfs/dbraw/zinc/67/98/66/418679866.db2.gz	VUEZVENBVWCZCQ-HNNXBMFYSA-N	1	1	320.349	1.121	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H]3C(=O)NC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000368063173	418682922	/nfs/dbraw/zinc/68/29/22/418682922.db2.gz	MLSLBHXJOMLPQM-CHWSQXEVSA-N	1	1	319.361	1.561	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2C(=O)NC[C@H]2C1	ZINC000368072063	418684307	/nfs/dbraw/zinc/68/43/07/418684307.db2.gz	ODNKGJJCUICUSI-WCQYABFASA-N	1	1	305.334	1.171	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](c2ccnn2C)C1	ZINC000371823806	418819132	/nfs/dbraw/zinc/81/91/32/418819132.db2.gz	GZOVUGPXLORWER-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](c2ccnn2C)C1	ZINC000371823806	418819134	/nfs/dbraw/zinc/81/91/34/418819134.db2.gz	GZOVUGPXLORWER-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000364923913	418822173	/nfs/dbraw/zinc/82/21/73/418822173.db2.gz	RYSYZPYTUULFJE-SZTZYQKNSA-N	1	1	319.405	1.997	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@@H]1C[N@H+]3CCC[C@H]3CO1)CCN2	ZINC000365542873	418873547	/nfs/dbraw/zinc/87/35/47/418873547.db2.gz	CBCZIJHOAXOHMA-NWDGAFQWSA-N	1	1	318.377	1.838	20	5		DDBDMO
Cc1cc(NC(=O)C(=O)NCC[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC000411245548	418883473	/nfs/dbraw/zinc/88/34/73/418883473.db2.gz	PBCJFFOMFXFXKU-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
Cc1nc([C@@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365725777	418900170	/nfs/dbraw/zinc/90/01/70/418900170.db2.gz	UWQHXAFYLJYYLO-LLVKDONJSA-N	1	1	306.326	1.362	20	5		DDBDMO
Cc1nc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365725777	418900171	/nfs/dbraw/zinc/90/01/71/418900171.db2.gz	UWQHXAFYLJYYLO-LLVKDONJSA-N	1	1	306.326	1.362	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000365055774	418835247	/nfs/dbraw/zinc/83/52/47/418835247.db2.gz	WJBLFOZWVNJZTE-RYUDHWBXSA-N	1	1	320.349	1.815	20	5		DDBDMO
CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC[N@H+]1C	ZINC000420994082	419426840	/nfs/dbraw/zinc/42/68/40/419426840.db2.gz	BTMPYLSTAUMNRJ-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@H]1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420994082	419426846	/nfs/dbraw/zinc/42/68/46/419426846.db2.gz	BTMPYLSTAUMNRJ-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@H]1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420994082	419426857	/nfs/dbraw/zinc/42/68/57/419426857.db2.gz	BTMPYLSTAUMNRJ-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)C[C@H]1CCC[N@H+]1C	ZINC000420997585	419434722	/nfs/dbraw/zinc/43/47/22/419434722.db2.gz	HGYTVQDGUIUGRL-CQSZACIVSA-N	1	1	320.393	1.868	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000411948242	419514677	/nfs/dbraw/zinc/51/46/77/419514677.db2.gz	UOMRNIVGVCFORE-LBPRGKRZSA-N	1	1	307.350	1.384	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000427324491	419636743	/nfs/dbraw/zinc/63/67/43/419636743.db2.gz	MWISOVJMMYOAGZ-QWRGUYRKSA-N	1	1	307.354	1.168	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000412042129	419581319	/nfs/dbraw/zinc/58/13/19/419581319.db2.gz	TWVVAQHRBWQYIP-AGIUHOORSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC000427708107	419716731	/nfs/dbraw/zinc/71/67/31/419716731.db2.gz	WBYBKPDREIAPCB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000427708107	419716740	/nfs/dbraw/zinc/71/67/40/419716740.db2.gz	WBYBKPDREIAPCB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000428460085	419873243	/nfs/dbraw/zinc/87/32/43/419873243.db2.gz	FYAIIRXUAMBPQI-SDQPKGBYSA-N	1	1	305.378	1.606	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CNCCO3)o2)cc1	ZINC000415096419	419941074	/nfs/dbraw/zinc/94/10/74/419941074.db2.gz	PTEWGVXIPQHWRK-HNNXBMFYSA-N	1	1	317.345	1.933	20	5		DDBDMO
Cc1c(CNC(=O)[C@@H]2CC[NH2+]CC2(F)F)cccc1[N+](=O)[O-]	ZINC000423794522	420189550	/nfs/dbraw/zinc/18/95/50/420189550.db2.gz	DVLISBKLSPKQKM-NSHDSACASA-N	1	1	313.304	1.764	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000416498112	420394304	/nfs/dbraw/zinc/39/43/04/420394304.db2.gz	WLEZEPWPBOQXRX-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
COc1cccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000438786476	420465530	/nfs/dbraw/zinc/46/55/30/420465530.db2.gz	YMHPKXXFIWLTHO-AWEZNQCLSA-N	1	1	320.349	1.293	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NCC[N@H+]3C[C@H]4CC[C@@H](C3)O4)[nH]c2c1	ZINC000450787252	420530531	/nfs/dbraw/zinc/53/05/31/420530531.db2.gz	FCWFNTXMQYMSJK-TXEJJXNPSA-N	1	1	317.349	1.168	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NCC[N@@H+]3C[C@H]4CC[C@@H](C3)O4)[nH]c2c1	ZINC000450787252	420530535	/nfs/dbraw/zinc/53/05/35/420530535.db2.gz	FCWFNTXMQYMSJK-TXEJJXNPSA-N	1	1	317.349	1.168	20	5		DDBDMO
CNc1nc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000457084949	420603993	/nfs/dbraw/zinc/60/39/93/420603993.db2.gz	GYXWGXZXRRVXAJ-NSHDSACASA-N	1	1	321.381	1.586	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CCC[N@@H+]1CCCO	ZINC000452781829	420659616	/nfs/dbraw/zinc/65/96/16/420659616.db2.gz	ISQXBOGSYLMJOX-OAHLLOKOSA-N	1	1	321.377	1.100	20	5		DDBDMO
O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+]1C1CC1	ZINC000492892023	420701251	/nfs/dbraw/zinc/70/12/51/420701251.db2.gz	ODMTVUXGGOZUJS-HNNXBMFYSA-N	1	1	318.377	1.750	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000449696757	421061181	/nfs/dbraw/zinc/06/11/81/421061181.db2.gz	LDYWPVXYQBURSA-NBUZRDOWSA-N	1	1	306.362	1.939	20	5		DDBDMO
CCN1C[C@H]([NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])CC1=O	ZINC000449516711	421019718	/nfs/dbraw/zinc/01/97/18/421019718.db2.gz	HGQBXBIHSMACDE-SNVBAGLBSA-N	1	1	309.322	1.019	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-]	ZINC000456071890	421096429	/nfs/dbraw/zinc/09/64/29/421096429.db2.gz	TXGGSLWQMBYWCT-OAHLLOKOSA-N	1	1	319.365	1.199	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](CO)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000488809135	421119861	/nfs/dbraw/zinc/11/98/61/421119861.db2.gz	SXAZSOFZCYXMOS-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(C)[C@@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000488177655	421073543	/nfs/dbraw/zinc/07/35/43/421073543.db2.gz	FZZUUTDAIFQADI-HNNXBMFYSA-N	1	1	320.393	1.805	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000449786395	421084852	/nfs/dbraw/zinc/08/48/52/421084852.db2.gz	NMYODXAENJIQKC-YVARQFDVSA-N	1	1	305.378	1.606	20	5		DDBDMO
Cc1nc(NCCc2cn3c([nH+]2)CCCC3)ncc1[N+](=O)[O-]	ZINC000450243956	421168666	/nfs/dbraw/zinc/16/86/66/421168666.db2.gz	DGHCWKRVJJSJQA-UHFFFAOYSA-N	1	1	302.338	1.881	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000548822537	421476560	/nfs/dbraw/zinc/47/65/60/421476560.db2.gz	WMFAJLDEORZDJR-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000548822537	421476564	/nfs/dbraw/zinc/47/65/64/421476564.db2.gz	WMFAJLDEORZDJR-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@H]1CN(CC[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CCO1	ZINC000564058985	421566035	/nfs/dbraw/zinc/56/60/35/421566035.db2.gz	VPGLWPNXDQXJBS-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H]1CN(CC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CCO1	ZINC000564058985	421566038	/nfs/dbraw/zinc/56/60/38/421566038.db2.gz	VPGLWPNXDQXJBS-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000531630421	421639722	/nfs/dbraw/zinc/63/97/22/421639722.db2.gz	XPJKPIPHENEIJL-LBPRGKRZSA-N	1	1	306.366	1.840	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000554599988	421654187	/nfs/dbraw/zinc/65/41/87/421654187.db2.gz	PUMHFNUTXAJVQW-LLVKDONJSA-N	1	1	309.370	1.275	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CCC3(O)CCC3)C2)nc1	ZINC000520531258	421754477	/nfs/dbraw/zinc/75/44/77/421754477.db2.gz	HXAWEFMGTVSIGW-GFCCVEGCSA-N	1	1	306.366	1.781	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000543141266	421833930	/nfs/dbraw/zinc/83/39/30/421833930.db2.gz	USEHCVPIPDLEBB-MJBXVCDLSA-N	1	1	324.377	1.427	20	5		DDBDMO
Nc1ccc(N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)nc1[N+](=O)[O-]	ZINC000596163551	422368542	/nfs/dbraw/zinc/36/85/42/422368542.db2.gz	WSDBATKSDYJRSP-OLZOCXBDSA-N	1	1	321.381	1.627	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000596306831	422373638	/nfs/dbraw/zinc/37/36/38/422373638.db2.gz	IQHTWZRORSKDSO-JTQLQIEISA-N	1	1	321.381	1.621	20	5		DDBDMO
CC[C@@]1(O)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000602983368	422440729	/nfs/dbraw/zinc/44/07/29/422440729.db2.gz	IWZIWTXEPXHMNH-XJKSGUPXSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)c1	ZINC000332336396	281007993	/nfs/dbraw/zinc/00/79/93/281007993.db2.gz	VYAMZIJWPVXMIO-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000362985816	300194383	/nfs/dbraw/zinc/19/43/83/300194383.db2.gz	JVZOOQBEOJIVBQ-CVEARBPZSA-N	1	1	317.389	1.775	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000364454398	300399229	/nfs/dbraw/zinc/39/92/29/300399229.db2.gz	KPTBXFIEPGQNKN-JYJNAYRXSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000364454398	300399231	/nfs/dbraw/zinc/39/92/31/300399231.db2.gz	KPTBXFIEPGQNKN-JYJNAYRXSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000364454398	300399235	/nfs/dbraw/zinc/39/92/35/300399235.db2.gz	KPTBXFIEPGQNKN-JYJNAYRXSA-N	1	1	317.389	1.823	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000368587546	301058430	/nfs/dbraw/zinc/05/84/30/301058430.db2.gz	DACMUPGTYLDVJN-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000368587546	301058432	/nfs/dbraw/zinc/05/84/32/301058432.db2.gz	DACMUPGTYLDVJN-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000368587546	301058435	/nfs/dbraw/zinc/05/84/35/301058435.db2.gz	DACMUPGTYLDVJN-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000377651844	302204104	/nfs/dbraw/zinc/20/41/04/302204104.db2.gz	KGAWZKZZVPQTKD-HZPDHXFCSA-N	1	1	308.378	1.969	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@H]12	ZINC000377673044	302209363	/nfs/dbraw/zinc/20/93/63/302209363.db2.gz	RLMNOGOHGSYJAW-RISCZKNCSA-N	1	1	305.334	1.042	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC12CCOCC2	ZINC000378359293	302317312	/nfs/dbraw/zinc/31/73/12/302317312.db2.gz	HDESZGOZDLEYCS-UHFFFAOYSA-N	1	1	307.350	1.402	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000532078035	303274964	/nfs/dbraw/zinc/27/49/64/303274964.db2.gz	IJQDDULYVBYBNF-HZMBPMFUSA-N	1	1	318.377	1.849	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000363398879	307027303	/nfs/dbraw/zinc/02/73/03/307027303.db2.gz	QBJWAAMWMCFAND-SOUVJXGZSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccnc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363398879	307027304	/nfs/dbraw/zinc/02/73/04/307027304.db2.gz	QBJWAAMWMCFAND-SOUVJXGZSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363398879	307027305	/nfs/dbraw/zinc/02/73/05/307027305.db2.gz	QBJWAAMWMCFAND-SOUVJXGZSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](c3ccncn3)C2)n1	ZINC000363428954	307027807	/nfs/dbraw/zinc/02/78/07/307027807.db2.gz	FNFJTZQLRHZKIQ-GFCCVEGCSA-N	1	1	302.338	1.461	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000365078310	307057902	/nfs/dbraw/zinc/05/79/02/307057902.db2.gz	STZDXCWYRUIEIG-GXFFZTMASA-N	1	1	320.349	1.307	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000366416608	307073068	/nfs/dbraw/zinc/07/30/68/307073068.db2.gz	KLWAOEGQSGNUQE-WYUUTHIRSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000366416608	307073069	/nfs/dbraw/zinc/07/30/69/307073069.db2.gz	KLWAOEGQSGNUQE-WYUUTHIRSA-N	1	1	305.334	1.092	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]([C@H]2CCOC2)C1	ZINC000367142504	307087014	/nfs/dbraw/zinc/08/70/14/307087014.db2.gz	XKUSYUFGUVJORP-STQMWFEESA-N	1	1	307.350	1.115	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)c1	ZINC000375962492	307236272	/nfs/dbraw/zinc/23/62/72/307236272.db2.gz	OITWEWJVHKYBFR-HNNXBMFYSA-N	1	1	320.324	1.524	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCc2c[nH+]c3n2CCCC3)n1	ZINC000560394640	307910926	/nfs/dbraw/zinc/91/09/26/307910926.db2.gz	PXJUFKFLBLQMBL-UHFFFAOYSA-N	1	1	318.337	1.274	20	5		DDBDMO
CC(C)n1cc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)nn1	ZINC000561736775	307928985	/nfs/dbraw/zinc/92/89/85/307928985.db2.gz	NTRDLFJLAJDTKX-UHFFFAOYSA-N	1	1	305.338	1.936	20	5		DDBDMO
CNc1nc(C(=O)NC[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000572358499	308218820	/nfs/dbraw/zinc/21/88/20/308218820.db2.gz	DSXVNZXVUZORPD-SNVBAGLBSA-N	1	1	307.354	1.103	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@]1(C)CO	ZINC000595874491	490372126	/nfs/dbraw/zinc/37/21/26/490372126.db2.gz	PCNNODFNRQTKFK-MEDUHNTESA-N	1	1	322.361	1.912	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](F)C2)c([N+](=O)[O-])c1	ZINC000451190033	534066374	/nfs/dbraw/zinc/06/63/74/534066374.db2.gz	GAGVCMGOYWDJDX-SNVBAGLBSA-N	1	1	311.313	1.976	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072367	534298541	/nfs/dbraw/zinc/29/85/41/534298541.db2.gz	WOWDKWGVMPHBNU-UTUOFQBUSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072367	534298543	/nfs/dbraw/zinc/29/85/43/534298543.db2.gz	WOWDKWGVMPHBNU-UTUOFQBUSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000156015273	519675727	/nfs/dbraw/zinc/67/57/27/519675727.db2.gz	AHOWTNUTZTUWSL-NSHDSACASA-N	1	1	322.365	1.546	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1	ZINC000821254662	606701480	/nfs/dbraw/zinc/70/14/80/606701480.db2.gz	OFNLYDRCDBIFEL-VIFPVBQESA-N	1	1	318.341	1.066	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000821242874	606732437	/nfs/dbraw/zinc/73/24/37/606732437.db2.gz	XGIKUCLABASLQB-RNCFNFMXSA-N	1	1	317.353	1.527	20	5		DDBDMO
CCCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278521	697082055	/nfs/dbraw/zinc/08/20/55/697082055.db2.gz	HDEIYJKNYIZPTA-XOUADPBQSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCCC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278521	697082058	/nfs/dbraw/zinc/08/20/58/697082058.db2.gz	HDEIYJKNYIZPTA-XOUADPBQSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278521	697082061	/nfs/dbraw/zinc/08/20/61/697082061.db2.gz	HDEIYJKNYIZPTA-XOUADPBQSA-N	1	1	309.410	1.622	20	5		DDBDMO
CN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000776581635	698120838	/nfs/dbraw/zinc/12/08/38/698120838.db2.gz	FQAHGJLKHUBMJI-HOTGVXAUSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C2CC2)C1	ZINC000776581635	698120840	/nfs/dbraw/zinc/12/08/40/698120840.db2.gz	FQAHGJLKHUBMJI-HOTGVXAUSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C2CC2)C1	ZINC000776581635	698120842	/nfs/dbraw/zinc/12/08/42/698120842.db2.gz	FQAHGJLKHUBMJI-HOTGVXAUSA-N	1	1	305.378	1.797	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000776582117	698121245	/nfs/dbraw/zinc/12/12/45/698121245.db2.gz	QNUIPDIIELLOCW-XHDPSFHLSA-N	1	1	322.361	1.902	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cn[nH]c1	ZINC000782515469	698733621	/nfs/dbraw/zinc/73/36/21/698733621.db2.gz	BMZJUFNEBSCEGG-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000800860783	700250243	/nfs/dbraw/zinc/25/02/43/700250243.db2.gz	XYMZECUPRUYYTJ-CYBMUJFWSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](c3ccnn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000800860783	700250246	/nfs/dbraw/zinc/25/02/46/700250246.db2.gz	XYMZECUPRUYYTJ-CYBMUJFWSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2C[C@@]2(CO)C1	ZINC000782614834	698750925	/nfs/dbraw/zinc/75/09/25/698750925.db2.gz	GLIRPRSPKXWYMV-WBMJQRKESA-N	1	1	319.361	1.546	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2C[C@@]2(CO)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782618720	698751801	/nfs/dbraw/zinc/75/18/01/698751801.db2.gz	OKBGYCILPRLILP-BMIGLBTASA-N	1	1	323.324	1.377	20	5		DDBDMO
CN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000732165313	699548642	/nfs/dbraw/zinc/54/86/42/699548642.db2.gz	DZCMTFNIOPBJBW-LBPRGKRZSA-N	1	1	304.350	1.486	20	5		DDBDMO
O=C(CC[NH+]1CCOCC1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000737870960	699747210	/nfs/dbraw/zinc/74/72/10/699747210.db2.gz	QEDJKMIFJXVHEF-UHFFFAOYSA-N	1	1	305.334	1.206	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637413	699820397	/nfs/dbraw/zinc/82/03/97/699820397.db2.gz	WINGXHOGAYGTTE-QWRGUYRKSA-N	1	1	321.333	1.696	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637413	699820400	/nfs/dbraw/zinc/82/04/00/699820400.db2.gz	WINGXHOGAYGTTE-QWRGUYRKSA-N	1	1	321.333	1.696	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000796081342	699911000	/nfs/dbraw/zinc/91/10/00/699911000.db2.gz	TUNPYINNYUAFOV-HOTGVXAUSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000796081342	699911001	/nfs/dbraw/zinc/91/10/01/699911001.db2.gz	TUNPYINNYUAFOV-HOTGVXAUSA-N	1	1	322.361	1.510	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000743637066	699920985	/nfs/dbraw/zinc/92/09/85/699920985.db2.gz	KXAUUXFULZNAOE-GHMZBOCLSA-N	1	1	306.366	1.698	20	5		DDBDMO
O=C1OCC[C@H]1CC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000753842969	700461737	/nfs/dbraw/zinc/46/17/37/700461737.db2.gz	OIGDRSULLQYKKY-GFCCVEGCSA-N	1	1	320.349	1.065	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C)[C@H](C)C1	ZINC000761077600	700841022	/nfs/dbraw/zinc/84/10/22/700841022.db2.gz	NDZVILHYIJNDOK-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCC[C@@H]2C)n1	ZINC000804520669	701197246	/nfs/dbraw/zinc/19/72/46/701197246.db2.gz	HMIGSVRXFSOQEZ-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406641	701318863	/nfs/dbraw/zinc/31/88/63/701318863.db2.gz	PDVKGQFKAGFYLB-GHMZBOCLSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406641	701318864	/nfs/dbraw/zinc/31/88/64/701318864.db2.gz	PDVKGQFKAGFYLB-GHMZBOCLSA-N	1	1	306.366	1.650	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000807987420	701493548	/nfs/dbraw/zinc/49/35/48/701493548.db2.gz	LHVZBCVGBFYGEC-JTQLQIEISA-N	1	1	324.356	1.872	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)[nH]1	ZINC000839658333	701769032	/nfs/dbraw/zinc/76/90/32/701769032.db2.gz	FAMHGQDRLDNQOP-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658333	701769039	/nfs/dbraw/zinc/76/90/39/701769039.db2.gz	FAMHGQDRLDNQOP-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658333	701769045	/nfs/dbraw/zinc/76/90/45/701769045.db2.gz	FAMHGQDRLDNQOP-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658333	701769047	/nfs/dbraw/zinc/76/90/47/701769047.db2.gz	FAMHGQDRLDNQOP-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658333	701769053	/nfs/dbraw/zinc/76/90/53/701769053.db2.gz	FAMHGQDRLDNQOP-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2C)C1	ZINC000879214390	706616820	/nfs/dbraw/zinc/61/68/20/706616820.db2.gz	QSVROAPUFFUICX-NEPJUHHUSA-N	1	1	319.365	1.278	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccnc(N(C)C)n1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815601375	701902901	/nfs/dbraw/zinc/90/29/01/701902901.db2.gz	URSXFYXKURKTRK-JTQLQIEISA-N	1	1	316.365	1.884	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@](O)(C(F)F)C2)c1	ZINC000831175131	706649952	/nfs/dbraw/zinc/64/99/52/706649952.db2.gz	FVKYSZQPRMFPJK-AAEUAGOBSA-N	1	1	302.277	1.330	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000816954722	702238779	/nfs/dbraw/zinc/23/87/79/702238779.db2.gz	JJNZEHZHEDHZFL-TVQRCGJNSA-N	1	1	320.305	1.279	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000866271484	706662162	/nfs/dbraw/zinc/66/21/62/706662162.db2.gz	MCNYLOYVFFBFGW-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(NCC[NH2+]C3CC3)CC2)cc1	ZINC000817953556	702534999	/nfs/dbraw/zinc/53/49/99/702534999.db2.gz	NZLKZZMJTSJKAZ-UHFFFAOYSA-N	1	1	304.394	1.905	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000879576432	706724999	/nfs/dbraw/zinc/72/49/99/706724999.db2.gz	SCGJMWIDCQPDKF-GXTWGEPZSA-N	1	1	318.377	1.559	20	5		DDBDMO
NS(=O)(=O)CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831538348	706727509	/nfs/dbraw/zinc/72/75/09/706727509.db2.gz	AWZIKRYLTUTKDZ-GFCCVEGCSA-N	1	1	313.379	1.063	20	5		DDBDMO
NS(=O)(=O)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831538348	706727512	/nfs/dbraw/zinc/72/75/12/706727512.db2.gz	AWZIKRYLTUTKDZ-GFCCVEGCSA-N	1	1	313.379	1.063	20	5		DDBDMO
O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000818585464	703931606	/nfs/dbraw/zinc/93/16/06/703931606.db2.gz	CYLGMIOQQIMPAS-SNVBAGLBSA-N	1	1	319.695	1.927	20	5		DDBDMO
CCC[N@@H+]1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979994	704041672	/nfs/dbraw/zinc/04/16/72/704041672.db2.gz	FNOSITSFMQDNHV-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979994	704041676	/nfs/dbraw/zinc/04/16/76/704041676.db2.gz	FNOSITSFMQDNHV-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+][C@@H]2CCn3ccnc32)c1	ZINC000819338136	704110194	/nfs/dbraw/zinc/11/01/94/704110194.db2.gz	WZPIWZSLBTVAJT-TZMCWYRMSA-N	1	1	318.333	1.266	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c(F)c1	ZINC000853966108	704341820	/nfs/dbraw/zinc/34/18/20/704341820.db2.gz	OSYGOKOHBUXAAJ-ZDUSSCGKSA-N	1	1	309.341	1.769	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000821091293	704370930	/nfs/dbraw/zinc/37/09/30/704370930.db2.gz	AQQQGTGLIQSUEJ-GXTWGEPZSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000821091293	704370932	/nfs/dbraw/zinc/37/09/32/704370932.db2.gz	AQQQGTGLIQSUEJ-GXTWGEPZSA-N	1	1	321.377	1.661	20	5		DDBDMO
CC(C)(CCC(=O)N1CCC[C@@H]([NH+]2CCOCC2)C1)[N+](=O)[O-]	ZINC000854726006	704444694	/nfs/dbraw/zinc/44/46/94/704444694.db2.gz	FNXVLIZCPAYKFL-CYBMUJFWSA-N	1	1	313.398	1.145	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000856733289	704535868	/nfs/dbraw/zinc/53/58/68/704535868.db2.gz	WCRYVEJSIIWMFC-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
CCOCC[NH+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC1	ZINC000823232890	705178278	/nfs/dbraw/zinc/17/82/78/705178278.db2.gz	JTSFZRBOEKVITA-UHFFFAOYSA-N	1	1	301.387	1.003	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000874837365	705193741	/nfs/dbraw/zinc/19/37/41/705193741.db2.gz	IGUMGLORBWHUKB-OLZOCXBDSA-N	1	1	321.381	1.222	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCc1ncc(C)c([N+](=O)[O-])c1C	ZINC000860693227	705256791	/nfs/dbraw/zinc/25/67/91/705256791.db2.gz	BCVMZGFCDRPSER-UHFFFAOYSA-N	1	1	304.306	1.855	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000861338951	705433146	/nfs/dbraw/zinc/43/31/46/705433146.db2.gz	KMKMRHBCANVRCQ-HIFRSBDPSA-N	1	1	308.334	1.861	20	5		DDBDMO
Cc1ccc(CNC(=O)C[N@H+](C)[C@H]2CCSC2)cc1[N+](=O)[O-]	ZINC000825648660	705709084	/nfs/dbraw/zinc/70/90/84/705709084.db2.gz	WZRFESVFCFFVAD-ZDUSSCGKSA-N	1	1	323.418	1.957	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000826128928	705775163	/nfs/dbraw/zinc/77/51/63/705775163.db2.gz	WOJMARZIEYJPRE-HUUCEWRRSA-N	1	1	321.377	1.427	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000827035609	705915929	/nfs/dbraw/zinc/91/59/29/705915929.db2.gz	RPHTYFSOPSWULA-WKPIXPDZSA-N	1	1	319.361	1.227	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CC[C@@H]2OCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000876936147	705930137	/nfs/dbraw/zinc/93/01/37/705930137.db2.gz	IMUKAOLHRGDNPV-DIOULYMOSA-N	1	1	319.361	1.406	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000827216576	705952002	/nfs/dbraw/zinc/95/20/02/705952002.db2.gz	ASGRMCVTMMEIEB-ZYHUDNBSSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000827373158	705988143	/nfs/dbraw/zinc/98/81/43/705988143.db2.gz	GWWIERAYORVNBO-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)N(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000877197342	706014549	/nfs/dbraw/zinc/01/45/49/706014549.db2.gz	IEARXBWZMSHOQZ-XFJVYGCCSA-N	1	1	321.377	1.795	20	5		DDBDMO
Cn1nnnc1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000877781223	706209076	/nfs/dbraw/zinc/20/90/76/706209076.db2.gz	WBFIRWXJHVEASK-UHFFFAOYSA-N	1	1	320.328	1.637	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(CO)(CO)CC1	ZINC000877798047	706219278	/nfs/dbraw/zinc/21/92/78/706219278.db2.gz	VZTBBQNFKNDWBJ-UHFFFAOYSA-N	1	1	314.769	1.815	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000830015878	706438012	/nfs/dbraw/zinc/43/80/12/706438012.db2.gz	GFDYBIMLQOTUNX-OTYXRUKQSA-N	1	1	307.325	1.946	20	5		DDBDMO
O=C1OC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CCN12	ZINC000865617154	706478672	/nfs/dbraw/zinc/47/86/72/706478672.db2.gz	VSXNLICHYUPWAC-NSHDSACASA-N	1	1	314.301	1.784	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000836944580	707552370	/nfs/dbraw/zinc/55/23/70/707552370.db2.gz	BAIFWSWFUAMCEW-HIFRSBDPSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000836947563	707552885	/nfs/dbraw/zinc/55/28/85/707552885.db2.gz	IZTRXDGKUCYRCE-SNVBAGLBSA-N	1	1	324.356	1.872	20	5		DDBDMO
Cc1cccc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897220931	708258652	/nfs/dbraw/zinc/25/86/52/708258652.db2.gz	ZSKMHWBJKIKQDQ-ZIAGYGMSSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cc1cnc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897221610	708259276	/nfs/dbraw/zinc/25/92/76/708259276.db2.gz	NSDXAKLRZJVJLE-QWHCGFSZSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1cc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897222104	708260103	/nfs/dbraw/zinc/26/01/03/708260103.db2.gz	RPKBHMHOVNLVHC-HZPDHXFCSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[N@@H+](CCO)CCNc1cccc(Br)c1[N+](=O)[O-]	ZINC000884825366	708388084	/nfs/dbraw/zinc/38/80/84/708388084.db2.gz	SEMOTFPKLJLFKR-UHFFFAOYSA-N	1	1	318.171	1.693	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)CC[N@@H+](C)CCO	ZINC000912598860	713041913	/nfs/dbraw/zinc/04/19/13/713041913.db2.gz	IKBZIENLKVJRRQ-UHFFFAOYSA-N	1	1	309.366	1.208	20	5		DDBDMO
C[C@@H](C(=O)N(C)CC[N@@H+](C)CCO)c1cccc([N+](=O)[O-])c1	ZINC000912604634	713044470	/nfs/dbraw/zinc/04/44/70/713044470.db2.gz	LZFASAJDFLGSFM-GFCCVEGCSA-N	1	1	309.366	1.081	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H](N2CCOCC2)CC1	ZINC000886188161	708711993	/nfs/dbraw/zinc/71/19/93/708711993.db2.gz	MENSLUBVGYBHGT-OAHLLOKOSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](N2CCOCC2)CC1	ZINC000886188161	708711995	/nfs/dbraw/zinc/71/19/95/708711995.db2.gz	MENSLUBVGYBHGT-OAHLLOKOSA-N	1	1	320.393	1.677	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202724	708714090	/nfs/dbraw/zinc/71/40/90/708714090.db2.gz	CKGMAGXJXYAMCP-OCCSQVGLSA-N	1	1	306.366	1.285	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202724	708714091	/nfs/dbraw/zinc/71/40/91/708714091.db2.gz	CKGMAGXJXYAMCP-OCCSQVGLSA-N	1	1	306.366	1.285	20	5		DDBDMO
CC1(C)C(=O)N[C@H]1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886217515	708716916	/nfs/dbraw/zinc/71/69/16/708716916.db2.gz	BCRNCAHOZLJBMU-ZDUSSCGKSA-N	1	1	318.377	1.726	20	5		DDBDMO
Cc1ccc(C(=O)N2CCN(C)CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000888998091	709427726	/nfs/dbraw/zinc/42/77/26/709427726.db2.gz	QURGHLAMMUNHNC-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1ccc(C(=O)N2CCN(C)CC[N@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000888998091	709427729	/nfs/dbraw/zinc/42/77/29/709427729.db2.gz	QURGHLAMMUNHNC-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNc2c([N+](=O)[O-])cnn2C)C[C@@H](C)O1	ZINC000891652290	710257605	/nfs/dbraw/zinc/25/76/05/710257605.db2.gz	ICCRWTHMMCOUOR-GHMZBOCLSA-N	1	1	311.386	1.628	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2C[N@@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000893133768	710559775	/nfs/dbraw/zinc/55/97/75/710559775.db2.gz	COJGWQMCISCXIG-MFKMUULPSA-N	1	1	321.377	1.881	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000893133768	710559776	/nfs/dbraw/zinc/55/97/76/710559776.db2.gz	COJGWQMCISCXIG-MFKMUULPSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928444674	713198724	/nfs/dbraw/zinc/19/87/24/713198724.db2.gz	LQNYSNGWTNEZQQ-VXGBXAGGSA-N	1	1	307.350	1.573	20	5		DDBDMO
COc1c(O)ccc(CN2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000893669906	710770681	/nfs/dbraw/zinc/77/06/81/710770681.db2.gz	XCLBNAQVRRRBRM-GHMZBOCLSA-N	1	1	309.366	1.833	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1	ZINC000893939081	710893042	/nfs/dbraw/zinc/89/30/42/710893042.db2.gz	HFDVBUMDOKJOLS-NHYWBVRUSA-N	1	1	316.361	1.620	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000928555238	713224757	/nfs/dbraw/zinc/22/47/57/713224757.db2.gz	MLPHWUVFSQGBII-NSHDSACASA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000928555238	713224758	/nfs/dbraw/zinc/22/47/58/713224758.db2.gz	MLPHWUVFSQGBII-NSHDSACASA-N	1	1	315.333	1.214	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CC[N@@H+]2C)c1	ZINC000928569237	713232252	/nfs/dbraw/zinc/23/22/52/713232252.db2.gz	LSBCDFVBIXYUSO-LBPRGKRZSA-N	1	1	307.350	1.492	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC000894686700	711238216	/nfs/dbraw/zinc/23/82/16/711238216.db2.gz	ARUBDDFGDXGKMP-NWDGAFQWSA-N	1	1	310.350	1.902	20	5		DDBDMO
Cc1nn(C)c(N[C@H]2CCC[N@@H+]3CCSC[C@H]23)c1[N+](=O)[O-]	ZINC000895571574	711546374	/nfs/dbraw/zinc/54/63/74/711546374.db2.gz	JALQWJJEPPBSMG-WDEREUQCSA-N	1	1	311.411	1.628	20	5		DDBDMO
Cc1nn(C)c(N[C@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-]	ZINC000895571574	711546375	/nfs/dbraw/zinc/54/63/75/711546375.db2.gz	JALQWJJEPPBSMG-WDEREUQCSA-N	1	1	311.411	1.628	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1	ZINC000895772268	711602424	/nfs/dbraw/zinc/60/24/24/711602424.db2.gz	ZSUHNHSOGRWFFC-CYBMUJFWSA-N	1	1	318.377	1.947	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+](C)CCCF)cc1[N+](=O)[O-]	ZINC000895895729	711639754	/nfs/dbraw/zinc/63/97/54/711639754.db2.gz	DTUYSNHDZXTGJE-UHFFFAOYSA-N	1	1	314.313	1.938	20	5		DDBDMO
Cc1ccc(CNC(=O)C2CN(C)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000913754077	713295800	/nfs/dbraw/zinc/29/58/00/713295800.db2.gz	GBWKVAHZDSCSKN-UHFFFAOYSA-N	1	1	320.393	1.013	20	5		DDBDMO
Cn1cc(CNC2CC([NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000906509947	712343558	/nfs/dbraw/zinc/34/35/58/712343558.db2.gz	DRVPSUQKZBARRQ-UHFFFAOYSA-N	1	1	301.350	1.575	20	5		DDBDMO
COc1ccc(NC(=O)C2C[NH+]([C@H]3CCOC3)C2)cc1[N+](=O)[O-]	ZINC000907298833	712536753	/nfs/dbraw/zinc/53/67/53/712536753.db2.gz	IILCSSOBBNSQMG-LBPRGKRZSA-N	1	1	321.333	1.263	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@]1(C)C[C@H](O)C[N@H+]1C	ZINC000908123561	712693415	/nfs/dbraw/zinc/69/34/15/712693415.db2.gz	CUROJBWGSDJAMX-BBRMVZONSA-N	1	1	321.377	1.051	20	5		DDBDMO
COc1ccc(CNC(=O)NC[C@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000914300116	713372984	/nfs/dbraw/zinc/37/29/84/713372984.db2.gz	KDRVQOSGVGNCPU-LLVKDONJSA-N	1	1	308.338	1.107	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N[C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000916330400	713451274	/nfs/dbraw/zinc/45/12/74/713451274.db2.gz	IBLYQISFLGZYIM-GFCCVEGCSA-N	1	1	324.381	1.533	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C	ZINC000930093816	713754889	/nfs/dbraw/zinc/75/48/89/713754889.db2.gz	FSKIAVWRHXKTMN-NWDGAFQWSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000921681049	713841280	/nfs/dbraw/zinc/84/12/80/713841280.db2.gz	PPKIZLWIFJQNTH-RISCZKNCSA-N	1	1	306.366	1.529	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1c1ccnn1C	ZINC000932262637	714294464	/nfs/dbraw/zinc/29/44/64/714294464.db2.gz	OHGDIYCXSXNOQT-CYBMUJFWSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1c1ccnn1C	ZINC000932262637	714294465	/nfs/dbraw/zinc/29/44/65/714294465.db2.gz	OHGDIYCXSXNOQT-CYBMUJFWSA-N	1	1	304.354	1.670	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923278981	714295254	/nfs/dbraw/zinc/29/52/54/714295254.db2.gz	ZLXCUFZLTLQXQN-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923278981	714295256	/nfs/dbraw/zinc/29/52/56/714295256.db2.gz	ZLXCUFZLTLQXQN-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923278981	714295257	/nfs/dbraw/zinc/29/52/57/714295257.db2.gz	ZLXCUFZLTLQXQN-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000923294162	714299919	/nfs/dbraw/zinc/29/99/19/714299919.db2.gz	DJELCRGRRWTWEU-NWDGAFQWSA-N	1	1	321.381	1.222	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000932647227	714374673	/nfs/dbraw/zinc/37/46/73/714374673.db2.gz	NJGYNXUGYHKWID-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933216261	714538831	/nfs/dbraw/zinc/53/88/31/714538831.db2.gz	GNXQRYJQEYQTHY-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933216261	714538833	/nfs/dbraw/zinc/53/88/33/714538833.db2.gz	GNXQRYJQEYQTHY-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H]2C2OCCO2)c1	ZINC000933900309	714696884	/nfs/dbraw/zinc/69/68/84/714696884.db2.gz	JIUMPIXXMAFMMM-KBPBESRZSA-N	1	1	308.334	1.466	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H]2C2OCCO2)c1	ZINC000933900309	714696885	/nfs/dbraw/zinc/69/68/85/714696885.db2.gz	JIUMPIXXMAFMMM-KBPBESRZSA-N	1	1	308.334	1.466	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000935429755	715053180	/nfs/dbraw/zinc/05/31/80/715053180.db2.gz	FJEUQCISPZCDKZ-LSDHHAIUSA-N	1	1	321.377	1.129	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4ccc([N+](=O)[O-])cc4n3)C[C@@H]21	ZINC001164667042	719385331	/nfs/dbraw/zinc/38/53/31/719385331.db2.gz	MNXYLSYULDGMCU-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2	ZINC001164965366	722069251	/nfs/dbraw/zinc/06/92/51/722069251.db2.gz	JTBORYFAKWUHDH-BETUJISGSA-N	1	1	322.340	1.428	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(N3CCc4[nH+]ccn4CC3)c2c1	ZINC001167182139	732809714	/nfs/dbraw/zinc/80/97/14/732809714.db2.gz	HEGDSWIIXKIXRP-UHFFFAOYSA-N	1	1	310.317	1.797	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C(F)F	ZINC001025643783	736807578	/nfs/dbraw/zinc/80/75/78/736807578.db2.gz	ZOMZMLUNZBEJET-GDNZZTSVSA-N	1	1	311.288	1.406	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C1CC1	ZINC001025645523	736808184	/nfs/dbraw/zinc/80/81/84/736808184.db2.gz	OIPJDHLBJTZYEO-NHAGDIPZSA-N	1	1	301.346	1.551	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC001196952426	747018668	/nfs/dbraw/zinc/01/86/68/747018668.db2.gz	HDTLOXMREJVLPU-AWEZNQCLSA-N	1	1	318.333	1.126	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1C[NH+]1CCC(Cc2nn[nH]n2)CC1	ZINC001197439982	747165377	/nfs/dbraw/zinc/16/53/77/747165377.db2.gz	SYRAPECKTJOINY-UHFFFAOYSA-N	1	1	320.328	1.702	20	5		DDBDMO
CC(C)(C)CC[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001205224374	750971244	/nfs/dbraw/zinc/97/12/44/750971244.db2.gz	QUNZHMVPLNVFHD-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045543	762186816	/nfs/dbraw/zinc/18/68/16/762186816.db2.gz	JKJJQMCRXRNLCL-WFASDCNBSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045543	762186819	/nfs/dbraw/zinc/18/68/19/762186819.db2.gz	JKJJQMCRXRNLCL-WFASDCNBSA-N	1	1	320.393	1.996	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169035711	762191562	/nfs/dbraw/zinc/19/15/62/762191562.db2.gz	LGZDZDYTFSIANP-PEBLQZBPSA-N	1	1	312.366	1.084	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@H+]2[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169035711	762191566	/nfs/dbraw/zinc/19/15/66/762191566.db2.gz	LGZDZDYTFSIANP-PEBLQZBPSA-N	1	1	312.366	1.084	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](Oc3ncccn3)C2)C1	ZINC001169053130	762207835	/nfs/dbraw/zinc/20/78/35/762207835.db2.gz	HQHGIWFPRMVVCW-HZSPNIEDSA-N	1	1	306.366	1.765	20	5		DDBDMO
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC000829037766	759863932	/nfs/dbraw/zinc/86/39/32/759863932.db2.gz	MIXZTHJYWZHKFB-YGRLFVJLSA-N	1	1	324.356	1.098	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139114	760613171	/nfs/dbraw/zinc/61/31/71/760613171.db2.gz	RFNFJEQGEWNMBC-AAVRWANBSA-N	1	1	323.780	1.742	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363355	761492426	/nfs/dbraw/zinc/49/24/26/761492426.db2.gz	PGMUUQOWGHFJKP-BPGGGUHBSA-N	1	1	321.352	1.475	20	5		DDBDMO
Cc1cccnc1C[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086363421	761493171	/nfs/dbraw/zinc/49/31/71/761493171.db2.gz	SKERJJLRJIQMCE-RGCMKSIDSA-N	1	1	318.377	1.040	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1nc(Cl)cc(Cl)c1[N+](=O)[O-]	ZINC001156625010	763489791	/nfs/dbraw/zinc/48/97/91/763489791.db2.gz	VMLYMXFTGZGWFJ-UHFFFAOYSA-N	1	1	315.120	1.420	20	5		DDBDMO
COc1ccc(C[C@H](C)N2CC[N@H+]3CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC001170355643	766261628	/nfs/dbraw/zinc/26/16/28/766261628.db2.gz	NNVKFSAQQBSHDU-GXTWGEPZSA-N	1	1	305.378	1.924	20	5		DDBDMO
CC[N@@H+](CCC(N)=O)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170345039	766277369	/nfs/dbraw/zinc/27/73/69/766277369.db2.gz	GWJFHTYXWJWLIF-LLVKDONJSA-N	1	1	309.366	1.732	20	5		DDBDMO
CCC(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC001048630866	769594141	/nfs/dbraw/zinc/59/41/41/769594141.db2.gz	UMEZVGIKZSEHKC-OKILXGFUSA-N	1	1	303.362	1.895	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC001097057204	771610820	/nfs/dbraw/zinc/61/08/20/771610820.db2.gz	ROJYNRAGWMRGRV-HAQNSBGRSA-N	1	1	321.381	1.391	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2(CO)COC2)c1F	ZINC001173190419	777036869	/nfs/dbraw/zinc/03/68/69/777036869.db2.gz	XTNYQYWWNPQXFX-SECBINFHSA-N	1	1	314.313	1.024	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC001173235751	777065021	/nfs/dbraw/zinc/06/50/21/777065021.db2.gz	ZBICMRKMGHMXAD-BSLXNSKLSA-N	1	1	304.346	1.877	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1ccccc1[N+](=O)[O-]	ZINC001267207998	837536208	/nfs/dbraw/zinc/53/62/08/837536208.db2.gz	SMKURLALLKJCCV-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1ccccc1[N+](=O)[O-]	ZINC001267207998	837536216	/nfs/dbraw/zinc/53/62/16/837536216.db2.gz	SMKURLALLKJCCV-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cnon1)Cc1ccc([N+](=O)[O-])cc1	ZINC001266425598	836237116	/nfs/dbraw/zinc/23/71/16/836237116.db2.gz	VGJQFAVQPSQKMG-UHFFFAOYSA-N	1	1	319.321	1.230	20	5		DDBDMO
Cc1ncoc1C[N@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C(C)C	ZINC001267501581	838195399	/nfs/dbraw/zinc/19/53/99/838195399.db2.gz	QZAFUWBTYIKWHG-CHWSQXEVSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1ncoc1C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C	ZINC001267501581	838195403	/nfs/dbraw/zinc/19/54/03/838195403.db2.gz	QZAFUWBTYIKWHG-CHWSQXEVSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1ncoc1C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])C(C)C	ZINC001267501581	838195410	/nfs/dbraw/zinc/19/54/10/838195410.db2.gz	QZAFUWBTYIKWHG-CHWSQXEVSA-N	1	1	324.381	1.365	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC001140951393	860744821	/nfs/dbraw/zinc/74/48/21/860744821.db2.gz	JACLBXZCFOGHDO-FGWVZKOKSA-N	1	1	321.381	1.625	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC001141747793	860927590	/nfs/dbraw/zinc/92/75/90/860927590.db2.gz	IWQQCAPIFBBLQD-QWRGUYRKSA-N	1	1	306.322	1.052	20	5		DDBDMO
CC(C)[C@@](C)(Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(N)=O	ZINC001156653163	863232447	/nfs/dbraw/zinc/23/24/47/863232447.db2.gz	ZDSOBZNWQHSPJO-LQYUOIDQSA-N	1	1	321.381	1.834	20	5		DDBDMO
Cc1cc(C)c(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1	ZINC001157761649	864110922	/nfs/dbraw/zinc/11/09/22/864110922.db2.gz	VUCXBBFYPUCRNL-GDBMZVCRSA-N	1	1	319.405	1.873	20	5		DDBDMO
Cc1ccc(OCC[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157775014	864128613	/nfs/dbraw/zinc/12/86/13/864128613.db2.gz	HRAXSDHDQGPTRQ-HUUCEWRRSA-N	1	1	321.377	1.135	20	5		DDBDMO
COc1ccc([N+](=O)[O-])nc1NCCC[NH+]1CCN(C)CC1	ZINC001161706510	866914685	/nfs/dbraw/zinc/91/46/85/866914685.db2.gz	ZUQNZPSQOXVGFN-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
O=C(NC/C=C/C[NH2+]CCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001321057399	867271567	/nfs/dbraw/zinc/27/15/67/867271567.db2.gz	OQSCBMQGSPHXRD-DPOFCPOHSA-N	1	1	303.362	1.156	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N[C@]1(C)CCC[N@@H+](C)C1	ZINC001162341320	867474582	/nfs/dbraw/zinc/47/45/82/867474582.db2.gz	KLEAAZHIFNNZKH-CQSZACIVSA-N	1	1	308.338	1.673	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3ncc(Cl)cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226129249	882220923	/nfs/dbraw/zinc/22/09/23/882220923.db2.gz	ANWJLTHVWYQXFP-MKPLZMMCSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ncc(Cl)cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226129249	882220939	/nfs/dbraw/zinc/22/09/39/882220939.db2.gz	ANWJLTHVWYQXFP-MKPLZMMCSA-N	1	1	311.725	1.826	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@@H+](C(C)C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC001165200289	869422739	/nfs/dbraw/zinc/42/27/39/869422739.db2.gz	TWFKNBRYSKAGDN-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCCC[N@H+]1C	ZINC001338020098	869748401	/nfs/dbraw/zinc/74/84/01/869748401.db2.gz	BARXBUBEQMJWOE-GFCCVEGCSA-N	1	1	306.366	1.851	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc(Cl)ccc2[N+](=O)[O-])C1	ZINC001226363931	882387799	/nfs/dbraw/zinc/38/77/99/882387799.db2.gz	AIICSLLEAZJGPT-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21	ZINC001301548910	871001389	/nfs/dbraw/zinc/00/13/89/871001389.db2.gz	VRCWTQWLDAOXLO-UHFFFAOYSA-N	1	1	320.349	1.072	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)n1	ZINC001306995044	871390612	/nfs/dbraw/zinc/39/06/12/871390612.db2.gz	JETQVFCEJLQDDN-NSHDSACASA-N	1	1	304.354	1.521	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)[C@@H]1C[N@H+](C)CCN1C	ZINC001308948986	871537616	/nfs/dbraw/zinc/53/76/16/871537616.db2.gz	UWLVGWGTOVMINN-YOEHRIQHSA-N	1	1	320.437	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001308948986	871537639	/nfs/dbraw/zinc/53/76/39/871537639.db2.gz	UWLVGWGTOVMINN-YOEHRIQHSA-N	1	1	320.437	1.936	20	5		DDBDMO
C[N@H+]1CCC[C@H](Oc2[nH]c(=O)nc3ccc([N+](=O)[O-])cc32)C1	ZINC001227093057	882825963	/nfs/dbraw/zinc/82/59/63/882825963.db2.gz	RPFYUYOHDAUPMO-JTQLQIEISA-N	1	1	304.306	1.717	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC001348969838	874902386	/nfs/dbraw/zinc/90/23/86/874902386.db2.gz	JICKUAJEBJEVGG-ABAIWWIYSA-N	1	1	318.377	1.803	20	5		DDBDMO
COC(=O)c1cc(COC[C@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001223690410	881059995	/nfs/dbraw/zinc/05/99/95/881059995.db2.gz	JOOKUEGBQDETKL-CQSZACIVSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cc(COC[C@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001223690410	881060014	/nfs/dbraw/zinc/06/00/14/881060014.db2.gz	JOOKUEGBQDETKL-CQSZACIVSA-N	1	1	324.333	1.229	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc([N+](=O)[O-])cc(F)c2F)C1	ZINC001228015237	883285762	/nfs/dbraw/zinc/28/57/62/883285762.db2.gz	BGGXMOYGFIGHPV-SNVBAGLBSA-N	1	1	302.277	1.973	20	5		DDBDMO
C[NH+]1CCC(Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC001228657453	883600037	/nfs/dbraw/zinc/60/00/37/883600037.db2.gz	IMKSBTPWTKQWMY-UHFFFAOYSA-N	1	1	314.363	1.471	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])c(Cl)n2)C1	ZINC001228937747	883740023	/nfs/dbraw/zinc/74/00/23/883740023.db2.gz	ILLFOOGLVQWJCJ-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
COc1c(C)cc([N+](=O)[O-])c(O[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001229870497	884202110	/nfs/dbraw/zinc/20/21/10/884202110.db2.gz	NKDXKIBVRIDIHB-SECBINFHSA-N	1	1	311.294	1.903	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cocn1)Cc1ccc([N+](=O)[O-])cc1	ZINC001235717267	888911314	/nfs/dbraw/zinc/91/13/14/888911314.db2.gz	ZRHOHUUMYPPRHG-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
COc1ccc(C[C@H](C)N[C@H]2CC[NH2+]C[C@@H]2F)c([N+](=O)[O-])c1	ZINC001246087554	892408119	/nfs/dbraw/zinc/40/81/19/892408119.db2.gz	OZWDOPFCTPYFKC-BPNCWPANSA-N	1	1	311.357	1.824	20	5		DDBDMO
CN1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O	ZINC001254476914	896456071	/nfs/dbraw/zinc/45/60/71/896456071.db2.gz	XDBCOVZAAPFSOU-UHFFFAOYSA-N	1	1	318.377	1.338	20	5		DDBDMO
CN1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1=O	ZINC001254476914	896456077	/nfs/dbraw/zinc/45/60/77/896456077.db2.gz	XDBCOVZAAPFSOU-UHFFFAOYSA-N	1	1	318.377	1.338	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]21	ZINC001254602790	896527350	/nfs/dbraw/zinc/52/73/50/896527350.db2.gz	IXOHNAJWGJBWEP-KBXIAJHMSA-N	1	1	302.330	1.413	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC001262653034	900286705	/nfs/dbraw/zinc/28/67/05/900286705.db2.gz	XHKBYSXPPAIUHU-LBPRGKRZSA-N	1	1	306.366	1.607	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2cncc(F)c2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001280480581	903723190	/nfs/dbraw/zinc/72/31/90/903723190.db2.gz	UQNYQLVTPTYXIA-CHWSQXEVSA-N	1	1	322.340	1.014	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2NCC[N@H+]2CCCOCC2)s1	ZINC000286568891	219058192	/nfs/dbraw/zinc/05/81/92/219058192.db2.gz	FYTIQCMPPFDXBW-UHFFFAOYSA-N	1	1	323.378	1.734	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CCCC[N@@H+]1CCO	ZINC000452390050	231374987	/nfs/dbraw/zinc/37/49/87/231374987.db2.gz	NLVLBCCDCHXJHM-AWEZNQCLSA-N	1	1	321.377	1.100	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CCCC[N@@H+]1CCO	ZINC000452390478	231375345	/nfs/dbraw/zinc/37/53/45/231375345.db2.gz	OFHNHNCEUUGBNP-OAHLLOKOSA-N	1	1	321.377	1.100	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000495231477	529575824	/nfs/dbraw/zinc/57/58/24/529575824.db2.gz	IHZJWKJBYWNLAH-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000495231477	529575828	/nfs/dbraw/zinc/57/58/28/529575828.db2.gz	IHZJWKJBYWNLAH-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC1(C)CN(CCOc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000614920830	362077830	/nfs/dbraw/zinc/07/78/30/362077830.db2.gz	SGAUKADFQRYYOL-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1CCO	ZINC000614920830	362077833	/nfs/dbraw/zinc/07/78/33/362077833.db2.gz	SGAUKADFQRYYOL-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1CCO	ZINC000614920830	362077836	/nfs/dbraw/zinc/07/78/36/362077836.db2.gz	SGAUKADFQRYYOL-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1CC1	ZINC000457211328	529883703	/nfs/dbraw/zinc/88/37/03/529883703.db2.gz	VZXWPVIBLWCJQM-UHFFFAOYSA-N	1	1	324.356	1.920	20	5		DDBDMO
O=C1NCCN1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000289935282	282350706	/nfs/dbraw/zinc/35/07/06/282350706.db2.gz	OOBLEIVJXKTIPG-UHFFFAOYSA-N	1	1	304.350	1.584	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000458207237	530060957	/nfs/dbraw/zinc/06/09/57/530060957.db2.gz	JFNUQVFPJVONCU-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H](CO)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000181714380	199343098	/nfs/dbraw/zinc/34/30/98/199343098.db2.gz	UZOPDBGNQQNURZ-SNVBAGLBSA-N	1	1	311.313	1.377	20	5		DDBDMO
CO[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000267830808	186369749	/nfs/dbraw/zinc/36/97/49/186369749.db2.gz	QYLQBQOUNRRICZ-ZDUSSCGKSA-N	1	1	305.334	1.205	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000267830808	186369750	/nfs/dbraw/zinc/36/97/50/186369750.db2.gz	QYLQBQOUNRRICZ-ZDUSSCGKSA-N	1	1	305.334	1.205	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000172041317	198030731	/nfs/dbraw/zinc/03/07/31/198030731.db2.gz	UTQRTFHLXYIGHF-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
Cc1[nH+]ccn1CCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000047668853	352507431	/nfs/dbraw/zinc/50/74/31/352507431.db2.gz	CLAJSFWPSDXKSI-UHFFFAOYSA-N	1	1	324.362	1.468	20	5		DDBDMO
Cc1cccc(C[NH+]2CCC(NC(=O)[C@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000053506621	352659369	/nfs/dbraw/zinc/65/93/69/352659369.db2.gz	DXIBHCWGSSQEQO-JKSUJKDBSA-N	1	1	317.389	1.741	20	5		DDBDMO
COCC[N@@H+](C)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000054353646	352688310	/nfs/dbraw/zinc/68/83/10/352688310.db2.gz	LIRPOCMCAOPIQF-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
COc1ccc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000057719404	352825820	/nfs/dbraw/zinc/82/58/20/352825820.db2.gz	FXRFCIXWYWMHHG-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000058283672	352841554	/nfs/dbraw/zinc/84/15/54/352841554.db2.gz	PTFOIQJTEVFYLO-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000060759025	352879010	/nfs/dbraw/zinc/87/90/10/352879010.db2.gz	WHOKHPUMAZIVRA-STQMWFEESA-N	1	1	304.350	1.534	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](c1ccco1)[NH+](C)C	ZINC000066041756	352974575	/nfs/dbraw/zinc/97/45/75/352974575.db2.gz	SRDUHXPHMNNTBI-LLVKDONJSA-N	1	1	321.337	1.112	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000067361331	353045503	/nfs/dbraw/zinc/04/55/03/353045503.db2.gz	KLXZKYVHNKTIBK-XHSDSOJGSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000067361331	353045504	/nfs/dbraw/zinc/04/55/04/353045504.db2.gz	KLXZKYVHNKTIBK-XHSDSOJGSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000067361331	353045505	/nfs/dbraw/zinc/04/55/05/353045505.db2.gz	KLXZKYVHNKTIBK-XHSDSOJGSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000173567427	198227959	/nfs/dbraw/zinc/22/79/59/198227959.db2.gz	RRSUIGSWRFNYKB-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000173567427	198227960	/nfs/dbraw/zinc/22/79/60/198227960.db2.gz	RRSUIGSWRFNYKB-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC(C)NC(=O)c1ccc(N2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000073868125	353275087	/nfs/dbraw/zinc/27/50/87/353275087.db2.gz	SUBJRKXUXJJKSM-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
CCCNC(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174249050	198309856	/nfs/dbraw/zinc/30/98/56/198309856.db2.gz	FDFJNCWJWMXQLO-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)COc1ccccc1[N+](=O)[O-])C2	ZINC000174691159	198371119	/nfs/dbraw/zinc/37/11/19/198371119.db2.gz	ZGXWAMBNGHPILU-QWHCGFSZSA-N	1	1	319.361	1.669	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000077528577	353475076	/nfs/dbraw/zinc/47/50/76/353475076.db2.gz	VZUSHBZVCBMAJA-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
Cc1cnc(N2CCN(c3ccc(N)[nH+]c3)CC2)c([N+](=O)[O-])c1	ZINC000078655575	353527046	/nfs/dbraw/zinc/52/70/46/353527046.db2.gz	BLWBMSIHEANVPW-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)C[NH+]1CCN(C)CC1	ZINC000080617564	353618461	/nfs/dbraw/zinc/61/84/61/353618461.db2.gz	MYEWIOCWPGOCNU-CYBMUJFWSA-N	1	1	322.409	1.789	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(c2nc[nH]n2)CC1	ZINC000083446099	353710713	/nfs/dbraw/zinc/71/07/13/353710713.db2.gz	YYFAEQKMADVBOF-UHFFFAOYSA-N	1	1	317.349	1.971	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@@H](C)O)CC2)c(F)cc1[N+](=O)[O-]	ZINC000114014620	353978695	/nfs/dbraw/zinc/97/86/95/353978695.db2.gz	WHLMRUKBDFYSSX-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@@H]21	ZINC000277039162	213257258	/nfs/dbraw/zinc/25/72/58/213257258.db2.gz	HBIMQNHJZWFVRB-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000280236218	354420788	/nfs/dbraw/zinc/42/07/88/354420788.db2.gz	KEGHMGBPNXBHIL-ZYHUDNBSSA-N	1	1	308.334	1.844	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000587416338	354882664	/nfs/dbraw/zinc/88/26/64/354882664.db2.gz	XSIYIENJPXOHHK-LLVKDONJSA-N	1	1	322.365	1.981	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[C@@H]([N@H+]3CC[C@H](O)C3)C2)c1[N+](=O)[O-]	ZINC000588863636	354944607	/nfs/dbraw/zinc/94/46/07/354944607.db2.gz	SGMITZDFPYJMLW-OLZOCXBDSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@@H]2C1	ZINC000590012854	355041555	/nfs/dbraw/zinc/04/15/55/355041555.db2.gz	ZWWMMEGCKZHOJH-IINYFYTJSA-N	1	1	301.350	1.607	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN(C)C[C@H]2CCC[N@H+]2C)c1	ZINC000591505415	355322284	/nfs/dbraw/zinc/32/22/84/355322284.db2.gz	HWYJHODJVYIEAQ-CQSZACIVSA-N	1	1	321.377	1.907	20	5		DDBDMO
CC[C@H](NCC(=O)N1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000591577146	355329750	/nfs/dbraw/zinc/32/97/50/355329750.db2.gz	OWJFMMLSAVSBER-AWEZNQCLSA-N	1	1	306.366	1.067	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@](C)(C(N)=O)C(C)C)c1	ZINC000593027959	355774544	/nfs/dbraw/zinc/77/45/44/355774544.db2.gz	HJOHIALSXIFFSZ-HNNXBMFYSA-N	1	1	323.349	1.371	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C2(CO)CCC2)c1	ZINC000593030718	355775553	/nfs/dbraw/zinc/77/55/53/355775553.db2.gz	PVQGZLCQNCYMLF-UHFFFAOYSA-N	1	1	308.334	1.728	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000593071885	355787545	/nfs/dbraw/zinc/78/75/45/355787545.db2.gz	VMYXVCQUPFIUKS-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000593107004	355799944	/nfs/dbraw/zinc/79/99/44/355799944.db2.gz	DCPFIBUEQJPUTQ-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000593107004	355799948	/nfs/dbraw/zinc/79/99/48/355799948.db2.gz	DCPFIBUEQJPUTQ-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000593588732	355935395	/nfs/dbraw/zinc/93/53/95/355935395.db2.gz	LXBKQCNUTCIOFL-XHDPSFHLSA-N	1	1	321.352	1.829	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCCCC[C@@H]2CO)c1	ZINC000594014450	356086960	/nfs/dbraw/zinc/08/69/60/356086960.db2.gz	DSXLYSZZRUDDDH-CABCVRRESA-N	1	1	324.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](OC3CCC3)C2)c1	ZINC000594027793	356093790	/nfs/dbraw/zinc/09/37/90/356093790.db2.gz	ZVFYKPXMTXZKLD-UKRRQHHQSA-N	1	1	324.381	1.186	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@H](C)O)C1CC1	ZINC000594065081	356103786	/nfs/dbraw/zinc/10/37/86/356103786.db2.gz	ODPVUIZCYUKFTE-NSHDSACASA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C[C@H](C)O)C1CC1	ZINC000594065081	356103789	/nfs/dbraw/zinc/10/37/89/356103789.db2.gz	ODPVUIZCYUKFTE-NSHDSACASA-N	1	1	307.350	1.687	20	5		DDBDMO
CC(C)Oc1nc(N2CC([N@@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000594587286	356257160	/nfs/dbraw/zinc/25/71/60/356257160.db2.gz	YMHBFKRXVCCKMO-GFCCVEGCSA-N	1	1	322.365	1.032	20	5		DDBDMO
CC(C)Oc1nc(N2CC([N@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000594587286	356257163	/nfs/dbraw/zinc/25/71/63/356257163.db2.gz	YMHBFKRXVCCKMO-GFCCVEGCSA-N	1	1	322.365	1.032	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000081579336	192296012	/nfs/dbraw/zinc/29/60/12/192296012.db2.gz	VVPQGLAFBZTBPJ-LLVKDONJSA-N	1	1	322.365	1.237	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000595663731	356599211	/nfs/dbraw/zinc/59/92/11/356599211.db2.gz	SXGHESMEZKADFJ-HNNXBMFYSA-N	1	1	321.333	1.709	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000595663731	356599213	/nfs/dbraw/zinc/59/92/13/356599213.db2.gz	SXGHESMEZKADFJ-HNNXBMFYSA-N	1	1	321.333	1.709	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000595766945	356644342	/nfs/dbraw/zinc/64/43/42/356644342.db2.gz	SRMXFKSCLOKGED-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[N@H+](CC1=CCCOC1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595753717	356637756	/nfs/dbraw/zinc/63/77/56/356637756.db2.gz	SSAOVNHCALRLBL-HNNXBMFYSA-N	1	1	322.361	1.613	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000595783354	356650903	/nfs/dbraw/zinc/65/09/03/356650903.db2.gz	MWDYWEXGRXMKMX-IPYPFGDCSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000595759906	356641055	/nfs/dbraw/zinc/64/10/55/356641055.db2.gz	QVYOBNCNFLYFCW-WBMJQRKESA-N	1	1	319.361	1.892	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595762102	356641745	/nfs/dbraw/zinc/64/17/45/356641745.db2.gz	ZYDPHSWCRAVKSJ-WBMJQRKESA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595762102	356641746	/nfs/dbraw/zinc/64/17/46/356641746.db2.gz	ZYDPHSWCRAVKSJ-WBMJQRKESA-N	1	1	319.361	1.810	20	5		DDBDMO
C[C@@H]1COC2(CCCC2)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595815619	356661857	/nfs/dbraw/zinc/66/18/57/356661857.db2.gz	OTDLWVORBHPVOV-CYBMUJFWSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@@H]1COC2(CCCC2)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595815619	356661858	/nfs/dbraw/zinc/66/18/58/356661858.db2.gz	OTDLWVORBHPVOV-CYBMUJFWSA-N	1	1	321.377	1.790	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000596119882	356780295	/nfs/dbraw/zinc/78/02/95/356780295.db2.gz	DMEBYVKOUUGEAA-GFCCVEGCSA-N	1	1	304.350	1.367	20	5		DDBDMO
O=[N+]([O-])c1cnccc1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000596269020	356838876	/nfs/dbraw/zinc/83/88/76/356838876.db2.gz	QRJIXNGUGVJQPR-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@]1(C)CO	ZINC000597237037	357105862	/nfs/dbraw/zinc/10/58/62/357105862.db2.gz	VZCDNDMKWCXXHT-BDJLRTHQSA-N	1	1	322.361	1.816	20	5		DDBDMO
CC1(C)CC[C@@H](CO)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000598648161	357669340	/nfs/dbraw/zinc/66/93/40/357669340.db2.gz	OETAJHAZPZCUBO-ZDUSSCGKSA-N	1	1	321.377	1.677	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1	ZINC000598559448	357632122	/nfs/dbraw/zinc/63/21/22/357632122.db2.gz	HQSZQOOYZSSJRQ-GFCCVEGCSA-N	1	1	321.381	1.180	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2NCC[N@@H+]2CC[C@@H](O)C2)s1	ZINC000599175671	357840406	/nfs/dbraw/zinc/84/04/06/357840406.db2.gz	HJORLFBIMJVBEM-MRVPVSSYSA-N	1	1	309.351	1.078	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@@H]21	ZINC000599659045	358012634	/nfs/dbraw/zinc/01/26/34/358012634.db2.gz	OAXNDBFFFKBLNB-MGPQQGTHSA-N	1	1	322.365	1.455	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@H]2C[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000599672296	358018721	/nfs/dbraw/zinc/01/87/21/358018721.db2.gz	KXPMNOGLFJGYCA-UPJWGTAASA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000347979517	283314744	/nfs/dbraw/zinc/31/47/44/283314744.db2.gz	RDACQPBGDYQLND-UHFFFAOYSA-N	1	1	320.353	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC1CC([NH+]2CCOCC2)C1	ZINC000600068874	358113804	/nfs/dbraw/zinc/11/38/04/358113804.db2.gz	LNPLNWWVMQTZBX-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCCF)CC1	ZINC000600072597	358115779	/nfs/dbraw/zinc/11/57/79/358115779.db2.gz	YDAKWLSLOXVGTI-UHFFFAOYSA-N	1	1	309.341	1.641	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000600309539	358192208	/nfs/dbraw/zinc/19/22/08/358192208.db2.gz	BMYDQAAVCHGWBL-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600469400	358232538	/nfs/dbraw/zinc/23/25/38/358232538.db2.gz	AOGPSJJDHMVSDC-LBPRGKRZSA-N	1	1	321.381	1.383	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600474539	358234689	/nfs/dbraw/zinc/23/46/89/358234689.db2.gz	XZYSGZMTLAOBHS-LLVKDONJSA-N	1	1	321.381	1.627	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000600996141	358375117	/nfs/dbraw/zinc/37/51/17/358375117.db2.gz	VJVCZFZCXHJOQT-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
CC[C@@H]1C(=O)NCCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601125039	358412845	/nfs/dbraw/zinc/41/28/45/358412845.db2.gz	LYRDXDFJVRNLSU-CYBMUJFWSA-N	1	1	300.318	1.858	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000601967818	358757659	/nfs/dbraw/zinc/75/76/59/358757659.db2.gz	CJFWRDNVWXVBGK-OAHLLOKOSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000602145618	358845295	/nfs/dbraw/zinc/84/52/95/358845295.db2.gz	ZSLXXUWNDQUUFC-LBPRGKRZSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH2+]CCCN2CCC(O)CC2)cc1	ZINC000602523996	359025271	/nfs/dbraw/zinc/02/52/71/359025271.db2.gz	JGKGCPDVOKCXEF-UHFFFAOYSA-N	1	1	307.394	1.574	20	5		DDBDMO
CCCC(=O)NC[C@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602452656	358986442	/nfs/dbraw/zinc/98/64/42/358986442.db2.gz	FKRLAIYQXOBXKT-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602452656	358986447	/nfs/dbraw/zinc/98/64/47/358986447.db2.gz	FKRLAIYQXOBXKT-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
O=C(C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1CC1	ZINC000602667774	359113372	/nfs/dbraw/zinc/11/33/72/359113372.db2.gz	SJGCEWBSAZHIJY-UHFFFAOYSA-N	1	1	317.267	1.982	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCc2ccc(O)cc2C1	ZINC000602794833	359196267	/nfs/dbraw/zinc/19/62/67/359196267.db2.gz	PQZWEJHSNHKFOA-UHFFFAOYSA-N	1	1	302.334	1.864	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2ccc(O)cc2C1	ZINC000602794833	359196271	/nfs/dbraw/zinc/19/62/71/359196271.db2.gz	PQZWEJHSNHKFOA-UHFFFAOYSA-N	1	1	302.334	1.864	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCCO)Cc1ccccc1	ZINC000602786882	359191828	/nfs/dbraw/zinc/19/18/28/359191828.db2.gz	WXGBYJRVEXDKJM-UHFFFAOYSA-N	1	1	318.377	1.984	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCC[C@@H]1[N@@H+]1CC[C@H](O)C1	ZINC000602733346	359155310	/nfs/dbraw/zinc/15/53/10/359155310.db2.gz	BGKQDYINYQPCSE-BBWFWOEESA-N	1	1	319.405	1.981	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCC[C@@H]1[N@H+]1CC[C@H](O)C1	ZINC000602733346	359155312	/nfs/dbraw/zinc/15/53/12/359155312.db2.gz	BGKQDYINYQPCSE-BBWFWOEESA-N	1	1	319.405	1.981	20	5		DDBDMO
CCCNC(=O)C[N@@H+](CCC)CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602767660	359176967	/nfs/dbraw/zinc/17/69/67/359176967.db2.gz	VFWBGFPAVCZGRH-UHFFFAOYSA-N	1	1	311.386	1.338	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC=C(c2ccnn2C)CC1	ZINC000602832928	359225168	/nfs/dbraw/zinc/22/51/68/359225168.db2.gz	TWXWAJKVJKLEPH-UHFFFAOYSA-N	1	1	316.365	1.623	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H]1CCCc2c1cnn2C	ZINC000602802068	359202146	/nfs/dbraw/zinc/20/21/46/359202146.db2.gz	SPTKQVVSPTUVFO-CYBMUJFWSA-N	1	1	318.381	1.843	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCN(C(=O)C2CC2)CC1	ZINC000602814182	359209566	/nfs/dbraw/zinc/20/95/66/359209566.db2.gz	KLSWLOSPUNOCJR-UHFFFAOYSA-N	1	1	321.381	1.044	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(C(=O)C2CC2)CC1	ZINC000602814182	359209569	/nfs/dbraw/zinc/20/95/69/359209569.db2.gz	KLSWLOSPUNOCJR-UHFFFAOYSA-N	1	1	321.381	1.044	20	5		DDBDMO
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602829544	359220952	/nfs/dbraw/zinc/22/09/52/359220952.db2.gz	LKQKWCGMQAZJOW-SZWZKDINSA-N	1	1	306.366	1.455	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602831816	359223904	/nfs/dbraw/zinc/22/39/04/359223904.db2.gz	IFZYVOBZDNMMJN-AWEZNQCLSA-N	1	1	323.397	1.338	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](C)[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602917527	359294185	/nfs/dbraw/zinc/29/41/85/359294185.db2.gz	LZNZIAUFJCVYAF-JGPRNRPPSA-N	1	1	310.354	1.490	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](C)[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602917527	359294187	/nfs/dbraw/zinc/29/41/87/359294187.db2.gz	LZNZIAUFJCVYAF-JGPRNRPPSA-N	1	1	310.354	1.490	20	5		DDBDMO
CC1(C)C[N@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccco1	ZINC000602928004	359298752	/nfs/dbraw/zinc/29/87/52/359298752.db2.gz	VJCRVTDUNVVFBU-JSGCOSHPSA-N	1	1	320.349	1.828	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccco1	ZINC000602928004	359298756	/nfs/dbraw/zinc/29/87/56/359298756.db2.gz	VJCRVTDUNVVFBU-JSGCOSHPSA-N	1	1	320.349	1.828	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602952565	359318425	/nfs/dbraw/zinc/31/84/25/359318425.db2.gz	NPJYSFWTXFODPX-NWDGAFQWSA-N	1	1	321.381	1.667	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC=C(c2cnn(C)c2)C1	ZINC000602883213	359266912	/nfs/dbraw/zinc/26/69/12/359266912.db2.gz	PDDHYDXRRJERFP-UHFFFAOYSA-N	1	1	316.365	1.623	20	5		DDBDMO
COc1cc(Cn2cc(C[NH+]3CCCC3)nn2)ccc1[N+](=O)[O-]	ZINC000603245127	359512120	/nfs/dbraw/zinc/51/21/20/359512120.db2.gz	YEZPOIWRSFIEHG-UHFFFAOYSA-N	1	1	317.349	1.839	20	5		DDBDMO
Cc1c(CC(=O)N(C)CC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000186805236	200014030	/nfs/dbraw/zinc/01/40/30/200014030.db2.gz	BFAONSLHBRFTNQ-UHFFFAOYSA-N	1	1	305.378	1.998	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccncc1)c1c([N+](=O)[O-])ncn1C	ZINC000603399712	359616586	/nfs/dbraw/zinc/61/65/86/359616586.db2.gz	IGMKTBKMIAUKHV-UHFFFAOYSA-N	1	1	318.381	1.682	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1	ZINC000609257614	360277200	/nfs/dbraw/zinc/27/72/00/360277200.db2.gz	DPMJWPHMXFGZLZ-SNVBAGLBSA-N	1	1	302.334	1.900	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000609283848	360286545	/nfs/dbraw/zinc/28/65/45/360286545.db2.gz	FREMKTLZMUTXFV-DZGCQCFKSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)CO	ZINC000609894911	360362618	/nfs/dbraw/zinc/36/26/18/360362618.db2.gz	MVWYKXKDKDSUOZ-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)CO	ZINC000609894911	360362624	/nfs/dbraw/zinc/36/26/24/360362624.db2.gz	MVWYKXKDKDSUOZ-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1cc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC000610489195	360449393	/nfs/dbraw/zinc/44/93/93/360449393.db2.gz	LSBXRSSWQOHHQG-AWEZNQCLSA-N	1	1	320.393	1.989	20	5		DDBDMO
Cc1cnc(NCCCN2CCC[N@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000610284208	360408701	/nfs/dbraw/zinc/40/87/01/360408701.db2.gz	NAFGJPJCIMZARU-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cnc(NCCC[N@H+]2CCCN(C)CC2)c([N+](=O)[O-])c1	ZINC000610284208	360408704	/nfs/dbraw/zinc/40/87/04/360408704.db2.gz	NAFGJPJCIMZARU-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cnc(NCCC[N@@H+]2CCCN(C)CC2)c([N+](=O)[O-])c1	ZINC000610284208	360408708	/nfs/dbraw/zinc/40/87/08/360408708.db2.gz	NAFGJPJCIMZARU-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[N@H+]1C1CC1	ZINC000610654058	360492031	/nfs/dbraw/zinc/49/20/31/360492031.db2.gz	GVVMHBIWPJJXLJ-WDEREUQCSA-N	1	1	321.381	1.268	20	5		DDBDMO
C[NH+](C)CCn1cc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)cn1	ZINC000610891440	360565505	/nfs/dbraw/zinc/56/55/05/360565505.db2.gz	ZBAHCNJEXIKNSG-UHFFFAOYSA-N	1	1	319.321	1.311	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611088226	360620260	/nfs/dbraw/zinc/62/02/60/360620260.db2.gz	KHSBLFOABVWZON-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000611100472	360622781	/nfs/dbraw/zinc/62/27/81/360622781.db2.gz	GLFCHJPYLPDAFV-LLVKDONJSA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000611100472	360622783	/nfs/dbraw/zinc/62/27/83/360622783.db2.gz	GLFCHJPYLPDAFV-LLVKDONJSA-N	1	1	320.349	1.086	20	5		DDBDMO
Nc1c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cccc1[N+](=O)[O-]	ZINC000619252139	363945630	/nfs/dbraw/zinc/94/56/30/363945630.db2.gz	FEUDVSHJUGYHKW-RYUDHWBXSA-N	1	1	322.340	1.435	20	5		DDBDMO
C[C@@H]1C[C@H]1N1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1=O	ZINC000350290211	284178984	/nfs/dbraw/zinc/17/89/84/284178984.db2.gz	UKJSNPDWBKUEHM-GLXFQSAKSA-N	1	1	307.325	1.833	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000264641015	204046353	/nfs/dbraw/zinc/04/63/53/204046353.db2.gz	BWPBBGBLWYNIBY-LLVKDONJSA-N	1	1	323.397	1.875	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	ZINC000183120794	284338092	/nfs/dbraw/zinc/33/80/92/284338092.db2.gz	URVOVVWSZFOTNM-CQSZACIVSA-N	1	1	320.349	1.156	20	5		DDBDMO
C[C@H]1c2ccsc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266382010	205305053	/nfs/dbraw/zinc/30/50/53/205305053.db2.gz	AYSUYPNZTOOVQW-CMPLNLGQSA-N	1	1	322.390	1.833	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@](F)(CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000338587148	250043127	/nfs/dbraw/zinc/04/31/27/250043127.db2.gz	IGMGFEOVSRQURM-AWEZNQCLSA-N	1	1	311.313	1.330	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCS(=O)(=O)C1	ZINC000285212536	218334993	/nfs/dbraw/zinc/33/49/93/218334993.db2.gz	DRVAPGNZRLONCZ-GFCCVEGCSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCS(=O)(=O)C1	ZINC000285212536	218334996	/nfs/dbraw/zinc/33/49/96/218334996.db2.gz	DRVAPGNZRLONCZ-GFCCVEGCSA-N	1	1	312.391	1.504	20	5		DDBDMO
CC(C)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000055901332	184000023	/nfs/dbraw/zinc/00/00/23/184000023.db2.gz	UTOKOSYSVPEPJY-UHFFFAOYSA-N	1	1	309.366	1.807	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCNC(=O)CC2)cccc1[N+](=O)[O-]	ZINC000065955331	184383969	/nfs/dbraw/zinc/38/39/69/184383969.db2.gz	CIWSBQVJSBZUFN-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000066126253	184391127	/nfs/dbraw/zinc/39/11/27/184391127.db2.gz	FBXBEWGKCADHAP-SNVBAGLBSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[C@@H](C)[N@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000066126253	184391129	/nfs/dbraw/zinc/39/11/29/184391129.db2.gz	FBXBEWGKCADHAP-SNVBAGLBSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000066126253	184391131	/nfs/dbraw/zinc/39/11/31/184391131.db2.gz	FBXBEWGKCADHAP-SNVBAGLBSA-N	1	1	319.365	1.931	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000419317798	533220368	/nfs/dbraw/zinc/22/03/68/533220368.db2.gz	APMDUYWKCNIWBP-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@@H](C(=O)NC(N)=O)[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451543171	533236746	/nfs/dbraw/zinc/23/67/46/533236746.db2.gz	BDKDARNXQCSYSH-CMPLNLGQSA-N	1	1	320.349	1.358	20	5		DDBDMO
O=C(C[N@@H+](CCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000071955972	406870524	/nfs/dbraw/zinc/87/05/24/406870524.db2.gz	XTRTWPRVMCCFRV-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
O=C(C[N@H+](CCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000071955972	406870525	/nfs/dbraw/zinc/87/05/25/406870525.db2.gz	XTRTWPRVMCCFRV-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](CCO)C2CC2)c([N+](=O)[O-])c1	ZINC000076992683	406976863	/nfs/dbraw/zinc/97/68/63/406976863.db2.gz	WSFPLZWEXRPYDE-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](CCO)C2CC2)c([N+](=O)[O-])c1	ZINC000076992683	406976865	/nfs/dbraw/zinc/97/68/65/406976865.db2.gz	WSFPLZWEXRPYDE-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CCC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000091028366	407174358	/nfs/dbraw/zinc/17/43/58/407174358.db2.gz	GURCANHVVPWVQH-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CCC[N@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000091028366	407174361	/nfs/dbraw/zinc/17/43/61/407174361.db2.gz	GURCANHVVPWVQH-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000091081888	407177369	/nfs/dbraw/zinc/17/73/69/407177369.db2.gz	XRRSZGRJULLEGD-LBPRGKRZSA-N	1	1	304.354	1.968	20	5		DDBDMO
CC(C)[N@H+](CCc1ccc([N+](=O)[O-])cc1)CCS(C)(=O)=O	ZINC000122515429	407303775	/nfs/dbraw/zinc/30/37/75/407303775.db2.gz	YQBFWTBKOWXWNC-UHFFFAOYSA-N	1	1	314.407	1.892	20	5		DDBDMO
CC(C)[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CCS(C)(=O)=O	ZINC000122515429	407303777	/nfs/dbraw/zinc/30/37/77/407303777.db2.gz	YQBFWTBKOWXWNC-UHFFFAOYSA-N	1	1	314.407	1.892	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000112309049	407425826	/nfs/dbraw/zinc/42/58/26/407425826.db2.gz	ZOEVIOJFIARKTM-UHFFFAOYSA-N	1	1	311.386	1.338	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000170783895	407505180	/nfs/dbraw/zinc/50/51/80/407505180.db2.gz	SNGXOVQLHSZHGS-UHFFFAOYSA-N	1	1	309.322	1.029	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000170783895	407505185	/nfs/dbraw/zinc/50/51/85/407505185.db2.gz	SNGXOVQLHSZHGS-UHFFFAOYSA-N	1	1	309.322	1.029	20	5		DDBDMO
COC[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000265762643	407441853	/nfs/dbraw/zinc/44/18/53/407441853.db2.gz	HISXIZFDRNSJKR-JSGCOSHPSA-N	1	1	310.350	1.303	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000112925488	407449746	/nfs/dbraw/zinc/44/97/46/407449746.db2.gz	YJXBVQLCWVEFKA-UHFFFAOYSA-N	1	1	311.338	1.294	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc([S@](C)=O)cc1	ZINC000178420643	407450193	/nfs/dbraw/zinc/45/01/93/407450193.db2.gz	ZUKPCIWKCMUJBS-QFIPXVFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc([S@](C)=O)cc1	ZINC000178420643	407450197	/nfs/dbraw/zinc/45/01/97/407450197.db2.gz	ZUKPCIWKCMUJBS-QFIPXVFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000112990259	407456307	/nfs/dbraw/zinc/45/63/07/407456307.db2.gz	DMANGPMUGFJYPN-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
COC[C@@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000265794730	407456313	/nfs/dbraw/zinc/45/63/13/407456313.db2.gz	MVLYFBIICQMYGL-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000265794730	407456317	/nfs/dbraw/zinc/45/63/17/407456317.db2.gz	MVLYFBIICQMYGL-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CC[NH3+])CCc2ccccc2)c1[N+](=O)[O-]	ZINC000261707869	407587211	/nfs/dbraw/zinc/58/72/11/407587211.db2.gz	KHHJZHAFFRUYCK-UHFFFAOYSA-N	1	1	317.349	1.270	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000114675648	407596622	/nfs/dbraw/zinc/59/66/22/407596622.db2.gz	TXORDFMORBFHGR-UHFFFAOYSA-N	1	1	311.313	1.277	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCc1cnccn1	ZINC000271321430	407635373	/nfs/dbraw/zinc/63/53/73/407635373.db2.gz	JZIVBOGXNNYYMG-UHFFFAOYSA-N	1	1	302.334	1.938	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000171261789	407643271	/nfs/dbraw/zinc/64/32/71/407643271.db2.gz	HEPBRGGFCJMTPT-CHWSQXEVSA-N	1	1	320.393	1.408	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](C2CC2)CC1	ZINC000174123521	407916319	/nfs/dbraw/zinc/91/63/19/407916319.db2.gz	SDLUXHZSCDNHIB-UHFFFAOYSA-N	1	1	320.349	1.915	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000272570097	407988155	/nfs/dbraw/zinc/98/81/55/407988155.db2.gz	CWQLOFHNJHPERV-WDEREUQCSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000189564091	408052850	/nfs/dbraw/zinc/05/28/50/408052850.db2.gz	ICOIXYYZYNDWIM-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCCOCC1	ZINC000189448482	408021461	/nfs/dbraw/zinc/02/14/61/408021461.db2.gz	BCDHGFFUVAKRQM-AATRIKPKSA-N	1	1	319.361	1.447	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000273339198	408157307	/nfs/dbraw/zinc/15/73/07/408157307.db2.gz	NIMCEMDYUYQEKH-CHWSQXEVSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1CO	ZINC000190429045	408241493	/nfs/dbraw/zinc/24/14/93/408241493.db2.gz	HEWIKXRIRHGSRD-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CC(=O)N1CCOCC1	ZINC000182632345	408212702	/nfs/dbraw/zinc/21/27/02/408212702.db2.gz	PAJNGSHKPKUKQY-CYBMUJFWSA-N	1	1	321.377	1.755	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CC(=O)N1CCOCC1	ZINC000182632345	408212704	/nfs/dbraw/zinc/21/27/04/408212704.db2.gz	PAJNGSHKPKUKQY-CYBMUJFWSA-N	1	1	321.377	1.755	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+](CCCO)Cc2ccccc2)c1	ZINC000268950430	408218492	/nfs/dbraw/zinc/21/84/92/408218492.db2.gz	FCFLEFSEHPCBDC-UHFFFAOYSA-N	1	1	304.350	1.676	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000246673382	408314997	/nfs/dbraw/zinc/31/49/97/408314997.db2.gz	IBVQYERAMSWKOL-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000246673382	408315002	/nfs/dbraw/zinc/31/50/02/408315002.db2.gz	IBVQYERAMSWKOL-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000269459847	408317506	/nfs/dbraw/zinc/31/75/06/408317506.db2.gz	HMGNVBZGGJFJQY-ZJUUUORDSA-N	1	1	321.381	1.796	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](Oc3ccncc3)C2)n1	ZINC000131842679	162024282	/nfs/dbraw/zinc/02/42/82/162024282.db2.gz	FXLFYXUYRUZSKX-CYBMUJFWSA-N	1	1	303.322	1.340	20	5		DDBDMO
CS(=O)(=O)c1cccc(NCC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000137970644	162128958	/nfs/dbraw/zinc/12/89/58/162128958.db2.gz	HPIRLOXTQIEXJY-UHFFFAOYSA-N	1	1	313.379	1.506	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1	ZINC000173751612	162362328	/nfs/dbraw/zinc/36/23/28/162362328.db2.gz	ZHBOBZRHYAULQB-CVEARBPZSA-N	1	1	320.393	1.975	20	5		DDBDMO
NS(=O)(=O)C[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000265205458	408578831	/nfs/dbraw/zinc/57/88/31/408578831.db2.gz	KNNCQVJRERXVMN-LBPRGKRZSA-N	1	1	313.379	1.095	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000265389650	408632406	/nfs/dbraw/zinc/63/24/06/408632406.db2.gz	BZDZHYNSFVCKOU-CYBMUJFWSA-N	1	1	322.365	1.745	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000270874703	408719550	/nfs/dbraw/zinc/71/95/50/408719550.db2.gz	JQFSYHUUKMGFMZ-GJZGRUSLSA-N	1	1	319.361	1.325	20	5		DDBDMO
C[C@@H](C[S@@](C)=O)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000185126373	408764673	/nfs/dbraw/zinc/76/46/73/408764673.db2.gz	NDDLCHFPWBEEST-PRWKNARSSA-N	1	1	300.380	1.672	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCO[C@]3(CCOC3)C2)c1	ZINC000185186697	408777147	/nfs/dbraw/zinc/77/71/47/408777147.db2.gz	OEFRDLYVSZPJEM-OAHLLOKOSA-N	1	1	308.334	1.465	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCO[C@]3(CCOC3)C2)c1	ZINC000185186697	408777150	/nfs/dbraw/zinc/77/71/50/408777150.db2.gz	OEFRDLYVSZPJEM-OAHLLOKOSA-N	1	1	308.334	1.465	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000290863212	408845818	/nfs/dbraw/zinc/84/58/18/408845818.db2.gz	YVJJQCLEYDRNKA-NXEZZACHSA-N	1	1	307.354	1.008	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])c(=O)c3ccccc32)CCO1	ZINC000291703328	408909244	/nfs/dbraw/zinc/90/92/44/408909244.db2.gz	UQHUAOQHUAOBAX-LBPRGKRZSA-N	1	1	317.345	1.630	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])c(=O)c3ccccc32)CCO1	ZINC000291703328	408909247	/nfs/dbraw/zinc/90/92/47/408909247.db2.gz	UQHUAOQHUAOBAX-LBPRGKRZSA-N	1	1	317.345	1.630	20	5		DDBDMO
Cc1cc(OCC(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000281799351	408931213	/nfs/dbraw/zinc/93/12/13/408931213.db2.gz	VGWZIRIIGSBSIT-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
COCC(C)(C)[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000292108555	408981967	/nfs/dbraw/zinc/98/19/67/408981967.db2.gz	ITWPDQNIEYBAOW-UHFFFAOYSA-N	1	1	309.366	1.914	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000292108555	408981968	/nfs/dbraw/zinc/98/19/68/408981968.db2.gz	ITWPDQNIEYBAOW-UHFFFAOYSA-N	1	1	309.366	1.914	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC2=CC[N@@H+](C)CC2)n1	ZINC000286437483	408985245	/nfs/dbraw/zinc/98/52/45/408985245.db2.gz	IMXBNNPPFLIENS-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1	ZINC000292151109	408990850	/nfs/dbraw/zinc/99/08/50/408990850.db2.gz	ILODXHJZCBBUQR-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@@H+]2CC=CCC2)n1	ZINC000287965392	409123632	/nfs/dbraw/zinc/12/36/32/409123632.db2.gz	ZGTLNZZYFQJMND-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@H](n3cc(Cl)cn3)C2)n1	ZINC000289410576	409266012	/nfs/dbraw/zinc/26/60/12/409266012.db2.gz	AGVHIKSNKUIJTR-LLVKDONJSA-N	1	1	310.745	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](n3cc(Cl)cn3)C2)n1	ZINC000289410576	409266015	/nfs/dbraw/zinc/26/60/15/409266015.db2.gz	AGVHIKSNKUIJTR-LLVKDONJSA-N	1	1	310.745	1.588	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573616	409363590	/nfs/dbraw/zinc/36/35/90/409363590.db2.gz	VRLHBEPQIHYMIO-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573616	409363594	/nfs/dbraw/zinc/36/35/94/409363594.db2.gz	VRLHBEPQIHYMIO-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000280628380	409384483	/nfs/dbraw/zinc/38/44/83/409384483.db2.gz	UINXVKUASPUTQO-LBPRGKRZSA-N	1	1	321.377	1.881	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1[nH]ncc1[N+](=O)[O-]	ZINC000280622553	409385971	/nfs/dbraw/zinc/38/59/71/409385971.db2.gz	BRZZPLZYEKNZRP-GFCCVEGCSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000280622553	409385976	/nfs/dbraw/zinc/38/59/76/409385976.db2.gz	BRZZPLZYEKNZRP-GFCCVEGCSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000280622553	409385982	/nfs/dbraw/zinc/38/59/82/409385982.db2.gz	BRZZPLZYEKNZRP-GFCCVEGCSA-N	1	1	321.381	1.845	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3ncc([N+](=O)[O-])cc3Cl)C[C@@H]21	ZINC000284414801	409342299	/nfs/dbraw/zinc/34/22/99/409342299.db2.gz	BUPBFPSAYNBTBK-NWDGAFQWSA-N	1	1	312.757	1.553	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000317844499	164028617	/nfs/dbraw/zinc/02/86/17/164028617.db2.gz	YAJXIMXGAIDACF-GHMZBOCLSA-N	1	1	309.370	1.166	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)n1	ZINC000319187109	164035315	/nfs/dbraw/zinc/03/53/15/164035315.db2.gz	OSBAEQIEXGKSQB-VHSXEESVSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408112160	164231630	/nfs/dbraw/zinc/23/16/30/164231630.db2.gz	IPURNLOLOVAOKJ-SECBINFHSA-N	1	1	303.322	1.247	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408112160	164231632	/nfs/dbraw/zinc/23/16/32/164231632.db2.gz	IPURNLOLOVAOKJ-SECBINFHSA-N	1	1	303.322	1.247	20	5		DDBDMO
CC[N@H+]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000303971318	409555894	/nfs/dbraw/zinc/55/58/94/409555894.db2.gz	DITLNKOXAYNELE-OAHLLOKOSA-N	1	1	323.393	1.362	20	5		DDBDMO
CCN1CCC[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000303971318	409555903	/nfs/dbraw/zinc/55/59/03/409555903.db2.gz	DITLNKOXAYNELE-OAHLLOKOSA-N	1	1	323.393	1.362	20	5		DDBDMO
CCN1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000303971318	409555915	/nfs/dbraw/zinc/55/59/15/409555915.db2.gz	DITLNKOXAYNELE-OAHLLOKOSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@@H]1CN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000296564837	409619665	/nfs/dbraw/zinc/61/96/65/409619665.db2.gz	SHZAWWIPGQLPJB-BETUJISGSA-N	1	1	320.393	1.871	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471795	409658278	/nfs/dbraw/zinc/65/82/78/409658278.db2.gz	LMBGWJCXWGIIQI-FZMZJTMJSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471795	409658284	/nfs/dbraw/zinc/65/82/84/409658284.db2.gz	LMBGWJCXWGIIQI-FZMZJTMJSA-N	1	1	307.350	1.493	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858123	409670584	/nfs/dbraw/zinc/67/05/84/409670584.db2.gz	UALMXNIVYYVRTN-KGLIPLIRSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858123	409670590	/nfs/dbraw/zinc/67/05/90/409670590.db2.gz	UALMXNIVYYVRTN-KGLIPLIRSA-N	1	1	323.349	1.401	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670373	410066276	/nfs/dbraw/zinc/06/62/76/410066276.db2.gz	UOUSVWTYWOMCSV-SLEUVZQESA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670373	410066280	/nfs/dbraw/zinc/06/62/80/410066280.db2.gz	UOUSVWTYWOMCSV-SLEUVZQESA-N	1	1	319.361	1.689	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000346729354	410117867	/nfs/dbraw/zinc/11/78/67/410117867.db2.gz	OGJSTBVDCUNGMH-INIZCTEOSA-N	1	1	321.377	1.055	20	5		DDBDMO
Cc1c(C[N@H+](C)C2CCN(CCO)CC2)cccc1[N+](=O)[O-]	ZINC000357646010	410161529	/nfs/dbraw/zinc/16/15/29/410161529.db2.gz	HNYBBQFEZBITJJ-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
Cc1c(CN(C)C2CC[NH+](CCO)CC2)cccc1[N+](=O)[O-]	ZINC000357646010	410161536	/nfs/dbraw/zinc/16/15/36/410161536.db2.gz	HNYBBQFEZBITJJ-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
C[C@H]1COCCN1CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000332587653	410185020	/nfs/dbraw/zinc/18/50/20/410185020.db2.gz	IHNVKPZXXGFGCG-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H]1COCCN1CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000332587653	410185026	/nfs/dbraw/zinc/18/50/26/410185026.db2.gz	IHNVKPZXXGFGCG-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](C)CC1	ZINC000298642890	410328079	/nfs/dbraw/zinc/32/80/79/410328079.db2.gz	RVFUXRIOZCZBOE-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2[C@H](CO)CC[C@H]2CO)c(Cl)c1	ZINC000347325042	410469642	/nfs/dbraw/zinc/46/96/42/410469642.db2.gz	YUXDSXLPQOMNNS-RYUDHWBXSA-N	1	1	300.742	1.566	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000343459883	410471139	/nfs/dbraw/zinc/47/11/39/410471139.db2.gz	WTJNRUXNCSIALK-YPMHNXCESA-N	1	1	323.397	1.397	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN2C(=O)NC[C@H]2C1	ZINC000347354531	410492903	/nfs/dbraw/zinc/49/29/03/410492903.db2.gz	BRXKZFUUVMRSGX-XCHKQJEOSA-N	1	1	316.361	1.708	20	5		DDBDMO
CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CCN2C(=O)NC[C@H]2C1	ZINC000347354531	410492910	/nfs/dbraw/zinc/49/29/10/410492910.db2.gz	BRXKZFUUVMRSGX-XCHKQJEOSA-N	1	1	316.361	1.708	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000352191171	410532823	/nfs/dbraw/zinc/53/28/23/410532823.db2.gz	SEVXYCHTDBMKNK-SNVBAGLBSA-N	1	1	311.313	1.641	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@@H]2C[NH2+]C[C@H]2C1	ZINC000359308994	410594645	/nfs/dbraw/zinc/59/46/45/410594645.db2.gz	OSVPQFNWOGKSNK-STQMWFEESA-N	1	1	318.377	1.383	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CCC[N@H+]1C	ZINC000343583801	410551590	/nfs/dbraw/zinc/55/15/90/410551590.db2.gz	ZKEAPTRZIIRKNT-GXSJLCMTSA-N	1	1	321.333	1.536	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](CCCNc2ccccc2[N+](=O)[O-])C1	ZINC000301150814	410666217	/nfs/dbraw/zinc/66/62/17/410666217.db2.gz	MWZFBDRWHZCUPS-GFCCVEGCSA-N	1	1	306.366	1.594	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000340098175	410675107	/nfs/dbraw/zinc/67/51/07/410675107.db2.gz	VVPHIMVYLITDJU-TZMCWYRMSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@H](C[NH+](C)C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000343801566	410707930	/nfs/dbraw/zinc/70/79/30/410707930.db2.gz	GBFCSJKFCQNDKR-SSDOTTSWSA-N	1	1	307.397	1.422	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1(S(C)(=O)=O)CC1	ZINC000353041031	410754345	/nfs/dbraw/zinc/75/43/45/410754345.db2.gz	XCTKAFPBROQOCD-VIFPVBQESA-N	1	1	316.354	1.789	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C[C@H](C)O)C[C@H]1C	ZINC000337427432	410775816	/nfs/dbraw/zinc/77/58/16/410775816.db2.gz	SWWNABANKIRICT-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000330571995	410786599	/nfs/dbraw/zinc/78/65/99/410786599.db2.gz	DKAINMBLKOZFIB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000330571995	410786604	/nfs/dbraw/zinc/78/66/04/410786604.db2.gz	DKAINMBLKOZFIB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000359766103	410862414	/nfs/dbraw/zinc/86/24/14/410862414.db2.gz	SMOIAJAEBMRKGP-JTQLQIEISA-N	1	1	310.354	1.546	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000359773409	410867971	/nfs/dbraw/zinc/86/79/71/410867971.db2.gz	ISMVSVWKQFPJLN-SNVBAGLBSA-N	1	1	311.386	1.731	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000330679394	410872801	/nfs/dbraw/zinc/87/28/01/410872801.db2.gz	DIVLJBOKEGAHNX-UHFFFAOYSA-N	1	1	307.354	1.433	20	5		DDBDMO
Cn1nccc1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000348361392	410933946	/nfs/dbraw/zinc/93/39/46/410933946.db2.gz	AWJKKTWDGFGJGY-UHFFFAOYSA-N	1	1	317.349	1.789	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C2)C1	ZINC000356289273	410946504	/nfs/dbraw/zinc/94/65/04/410946504.db2.gz	VWOBSARGDXSIHQ-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000353687325	411110044	/nfs/dbraw/zinc/11/00/44/411110044.db2.gz	IPWGNSBHAPAEBT-UHFFFAOYSA-N	1	1	314.305	1.406	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373929381	418474393	/nfs/dbraw/zinc/47/43/93/418474393.db2.gz	OJIZHBWNPJVSBB-OCCSQVGLSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000374025702	418485303	/nfs/dbraw/zinc/48/53/03/418485303.db2.gz	YMOXRNOFXYZTSN-CQDKDKBSSA-N	1	1	319.361	1.554	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000374025702	418485304	/nfs/dbraw/zinc/48/53/04/418485304.db2.gz	YMOXRNOFXYZTSN-CQDKDKBSSA-N	1	1	319.361	1.554	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+]([C@H]3CCOC3)CC2)c2nonc21	ZINC000366859499	418528158	/nfs/dbraw/zinc/52/81/58/418528158.db2.gz	YNNPSNVPDBQULE-JTQLQIEISA-N	1	1	319.321	1.042	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)cc1F	ZINC000374858537	418570396	/nfs/dbraw/zinc/57/03/96/418570396.db2.gz	CPXWSYPIVISGNT-ZDUSSCGKSA-N	1	1	309.341	1.640	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360937553	418551088	/nfs/dbraw/zinc/55/10/88/418551088.db2.gz	LPROCLPFMDMKRS-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360937553	418551091	/nfs/dbraw/zinc/55/10/91/418551091.db2.gz	LPROCLPFMDMKRS-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360945988	418552183	/nfs/dbraw/zinc/55/21/83/418552183.db2.gz	SUXNAGYZENRUNZ-GXFFZTMASA-N	1	1	318.377	1.849	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000375052992	418596447	/nfs/dbraw/zinc/59/64/47/418596447.db2.gz	DWUBOMYXJFZFGQ-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
CC[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H](C)OC	ZINC000291312705	222306322	/nfs/dbraw/zinc/30/63/22/222306322.db2.gz	TWUHCQHEWCQJPF-QWHCGFSZSA-N	1	1	312.366	1.691	20	5		DDBDMO
Cc1n[nH]cc1C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000375388867	418633866	/nfs/dbraw/zinc/63/38/66/418633866.db2.gz	GLNJMLOLRFWTLN-UHFFFAOYSA-N	1	1	304.354	1.739	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000368066177	418682910	/nfs/dbraw/zinc/68/29/10/418682910.db2.gz	WHBGBACSAMRRDC-HNNXBMFYSA-N	1	1	309.366	1.097	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)CCOc1ccccc1[N+](=O)[O-]	ZINC000361586784	418687433	/nfs/dbraw/zinc/68/74/33/418687433.db2.gz	UJOCKURRZLRCRE-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2c(F)cccc2[N+](=O)[O-])CCOC1	ZINC000362262913	418751367	/nfs/dbraw/zinc/75/13/67/418751367.db2.gz	PTLQFXJUZAWJAR-AWEZNQCLSA-N	1	1	312.297	1.546	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000365668959	418892472	/nfs/dbraw/zinc/89/24/72/418892472.db2.gz	FRJSIHHGNJGEEN-STQMWFEESA-N	1	1	319.361	1.496	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N[C@@H]3CC[N@H+]4CCC[C@H]4C3)nn21	ZINC000372703424	418893757	/nfs/dbraw/zinc/89/37/57/418893757.db2.gz	IDOIEHMCTDHWSJ-MNOVXSKESA-N	1	1	302.338	1.676	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421009410	419446732	/nfs/dbraw/zinc/44/67/32/419446732.db2.gz	QAXQJPDJGVWYRK-DOMZBBRYSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@@H](CCO)CC1	ZINC000421008005	419448045	/nfs/dbraw/zinc/44/80/45/419448045.db2.gz	CXJLJVBUCSCBLY-CYBMUJFWSA-N	1	1	309.366	1.241	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)CC[C@H]1C	ZINC000426899509	419567334	/nfs/dbraw/zinc/56/73/34/419567334.db2.gz	UXUFCCGJMVHLSB-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)n1	ZINC000427844433	419750425	/nfs/dbraw/zinc/75/04/25/419750425.db2.gz	CUKBEFAKMNOQFE-RYUDHWBXSA-N	1	1	323.397	1.756	20	5		DDBDMO
CC(C)([NH2+]CC(=O)NC(=O)NC1CC1)c1ccccc1[N+](=O)[O-]	ZINC000429266450	419993755	/nfs/dbraw/zinc/99/37/55/419993755.db2.gz	UOIKSUTZCIVENW-UHFFFAOYSA-N	1	1	320.349	1.408	20	5		DDBDMO
[NH3+]Cc1cn([C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000415134787	419961297	/nfs/dbraw/zinc/96/12/97/419961297.db2.gz	WDVMAQVRBKXBCK-OAHLLOKOSA-N	1	1	316.365	1.482	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000418997861	420041987	/nfs/dbraw/zinc/04/19/87/420041987.db2.gz	LNTZLNZTSGAUNV-WDEREUQCSA-N	1	1	311.386	1.011	20	5		DDBDMO
C[C@@H]1CCN[C@@H](C)[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420378153	420248834	/nfs/dbraw/zinc/24/88/34/420248834.db2.gz	WXEKLIDPMMSVTP-BFQNTYOBSA-N	1	1	320.393	1.900	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1CCO	ZINC000416288734	420309019	/nfs/dbraw/zinc/30/90/19/420309019.db2.gz	DOQBJUWSBCELLG-ZJUUUORDSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1CCO	ZINC000416288734	420309021	/nfs/dbraw/zinc/30/90/21/420309021.db2.gz	DOQBJUWSBCELLG-ZJUUUORDSA-N	1	1	313.379	1.183	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420604502	420329035	/nfs/dbraw/zinc/32/90/35/420329035.db2.gz	RZELMEBIHLPSPR-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@H](C)[NH+]1CCOCC1	ZINC000301959860	230006130	/nfs/dbraw/zinc/00/61/30/230006130.db2.gz	HIDUFXOOPKJATL-MNOVXSKESA-N	1	1	320.353	1.159	20	5		DDBDMO
CC(=O)c1ccc(NCC[NH+]2CCC(O)CC2)c([N+](=O)[O-])c1	ZINC000450871142	420548983	/nfs/dbraw/zinc/54/89/83/420548983.db2.gz	QNHFMKYJWWVYFX-UHFFFAOYSA-N	1	1	307.350	1.666	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000453014097	420701379	/nfs/dbraw/zinc/70/13/79/420701379.db2.gz	UOHBEDOTMTXWME-TVQRCGJNSA-N	1	1	323.324	1.519	20	5		DDBDMO
CCN1C[C@@H]([NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])CC1=O	ZINC000449516708	421019943	/nfs/dbraw/zinc/01/99/43/421019943.db2.gz	HGQBXBIHSMACDE-JTQLQIEISA-N	1	1	309.322	1.019	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])nc2)C[C@@H]1[NH+]1CCOCC1	ZINC000450397524	421192785	/nfs/dbraw/zinc/19/27/85/421192785.db2.gz	VWFKRBWZRARDEF-JSGCOSHPSA-N	1	1	306.366	1.537	20	5		DDBDMO
Cc1nc(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)ncc1[N+](=O)[O-]	ZINC000450366434	421189910	/nfs/dbraw/zinc/18/99/10/421189910.db2.gz	SZLFFMGXVFENRU-ZDUSSCGKSA-N	1	1	305.382	1.861	20	5		DDBDMO
CN(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000523435961	421239075	/nfs/dbraw/zinc/23/90/75/421239075.db2.gz	ZALUSHDFXLQAMH-HNNXBMFYSA-N	1	1	318.377	1.973	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000562393868	421361711	/nfs/dbraw/zinc/36/17/11/421361711.db2.gz	ZOGVRMRSAAEJKA-CYBMUJFWSA-N	1	1	323.393	1.783	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])c1ccco1	ZINC000548384210	421431063	/nfs/dbraw/zinc/43/10/63/421431063.db2.gz	DGKODOJHLINPGH-SNVBAGLBSA-N	1	1	319.321	1.198	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000563990549	421563587	/nfs/dbraw/zinc/56/35/87/421563587.db2.gz	XDJZLNDGHCTLJG-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)CN1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000517041146	421591239	/nfs/dbraw/zinc/59/12/39/421591239.db2.gz	HEPDTQQGRJYVKG-CQSZACIVSA-N	1	1	323.393	1.359	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777271	421629476	/nfs/dbraw/zinc/62/94/76/421629476.db2.gz	DWYZWLZQBDZSHE-JSGCOSHPSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777271	421629479	/nfs/dbraw/zinc/62/94/79/421629479.db2.gz	DWYZWLZQBDZSHE-JSGCOSHPSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCN1C[C@@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000517173056	421598395	/nfs/dbraw/zinc/59/83/95/421598395.db2.gz	QGODVACJGFNOSE-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[NH+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000517173056	421598398	/nfs/dbraw/zinc/59/83/98/421598398.db2.gz	QGODVACJGFNOSE-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000519580992	421702966	/nfs/dbraw/zinc/70/29/66/421702966.db2.gz	VJFKHQKYXUYZBB-WCQYABFASA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1ccnc([C@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)c1	ZINC000575813474	422330628	/nfs/dbraw/zinc/33/06/28/422330628.db2.gz	XPXNYBUXGBAPRK-ZDUSSCGKSA-N	1	1	301.350	1.984	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000592781329	422335466	/nfs/dbraw/zinc/33/54/66/422335466.db2.gz	ZFFRHLMRCOQYNB-PSASIEDQSA-N	1	1	303.322	1.750	20	5		DDBDMO
Nc1n[nH]c(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)n1	ZINC000595489562	422358242	/nfs/dbraw/zinc/35/82/42/422358242.db2.gz	UQRXHCNQNUAWGZ-UHFFFAOYSA-N	1	1	308.367	1.736	20	5		DDBDMO
C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1C[N@H+](C)CCO1	ZINC000590694558	422322432	/nfs/dbraw/zinc/32/24/32/422322432.db2.gz	PHMSXOGQHWNILY-NHYWBVRUSA-N	1	1	316.361	2.274	20	5		DDBDMO
C[C@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000590694558	422322437	/nfs/dbraw/zinc/32/24/37/422322437.db2.gz	PHMSXOGQHWNILY-NHYWBVRUSA-N	1	1	316.361	2.274	20	5		DDBDMO
CNc1nccc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597861294	422392407	/nfs/dbraw/zinc/39/24/07/422392407.db2.gz	SKUFZEAFGXDXIM-JTQLQIEISA-N	1	1	321.381	1.634	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@]12CCOC2	ZINC000341956075	271259294	/nfs/dbraw/zinc/25/92/94/271259294.db2.gz	SKIYNELTTRYQKY-BBRMVZONSA-N	1	1	322.361	1.589	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+](C3CC3)CC2)c1	ZINC000302094341	274004450	/nfs/dbraw/zinc/00/44/50/274004450.db2.gz	NLGJNRFGGMTILA-UHFFFAOYSA-N	1	1	305.334	1.666	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])c4cnccc43)C[C@@H]21	ZINC000153159575	277131382	/nfs/dbraw/zinc/13/13/82/277131382.db2.gz	VUKRLOGMFPPUQF-HOTGVXAUSA-N	1	1	314.345	1.662	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455657622	277303791	/nfs/dbraw/zinc/30/37/91/277303791.db2.gz	DILMAMPINKGBRY-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[NH2+]1	ZINC000088059422	278438859	/nfs/dbraw/zinc/43/88/59/278438859.db2.gz	VKWCVDIGVLMFHX-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932452	281030020	/nfs/dbraw/zinc/03/00/20/281030020.db2.gz	JHGMMIAMAZEULC-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932452	281030021	/nfs/dbraw/zinc/03/00/21/281030021.db2.gz	JHGMMIAMAZEULC-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000120686133	281123319	/nfs/dbraw/zinc/12/33/19/281123319.db2.gz	MZELINPHZARZCX-AWEZNQCLSA-N	1	1	320.393	1.778	20	5		DDBDMO
O=[N+]([O-])c1ccc(CSC[C@@H](O)C[NH+]2CCOCC2)cc1	ZINC000128868657	281325004	/nfs/dbraw/zinc/32/50/04/281325004.db2.gz	XTFXXWFCGXTSOG-AWEZNQCLSA-N	1	1	312.391	1.521	20	5		DDBDMO
CC[N@H+]1CCc2c(cccc2NC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000362415307	300058138	/nfs/dbraw/zinc/05/81/38/300058138.db2.gz	ZIZIZRDAGXHIMB-UHFFFAOYSA-N	1	1	315.333	1.948	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@H]2C[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000362588267	300102882	/nfs/dbraw/zinc/10/28/82/300102882.db2.gz	KHXCRGXFWCFQNU-CMPLNLGQSA-N	1	1	307.350	1.417	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363616940	300288126	/nfs/dbraw/zinc/28/81/26/300288126.db2.gz	YRKJPJBDRCESJV-HUUCEWRRSA-N	1	1	321.352	1.572	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000368957646	301109934	/nfs/dbraw/zinc/10/99/34/301109934.db2.gz	FAFWREAWUAHILJ-GLQYFDAESA-N	1	1	319.361	1.559	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368966165	301112380	/nfs/dbraw/zinc/11/23/80/301112380.db2.gz	NLCHNDLEPWJAMO-CJNGLKHVSA-N	1	1	323.393	1.017	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@@H]3C2)n1	ZINC000377963505	302257751	/nfs/dbraw/zinc/25/77/51/302257751.db2.gz	UYDKLOYVNBJCGI-MCIONIFRSA-N	1	1	305.382	1.207	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C1CCOCC1	ZINC000532566801	303290620	/nfs/dbraw/zinc/29/06/20/303290620.db2.gz	NVQHSIPWGXGCRC-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1CO	ZINC000362090446	307013996	/nfs/dbraw/zinc/01/39/96/307013996.db2.gz	NHQPITCKCCIFJK-DGCLKSJQSA-N	1	1	319.361	1.044	20	5		DDBDMO
Cn1cc([C@H](CO)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1	ZINC000518397985	307442077	/nfs/dbraw/zinc/44/20/77/307442077.db2.gz	SLWUCSNKDYYQIM-KGLIPLIRSA-N	1	1	302.334	1.639	20	5		DDBDMO
Cc1cnc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000566117597	308043888	/nfs/dbraw/zinc/04/38/88/308043888.db2.gz	VXDXADVTHGTRMK-LLVKDONJSA-N	1	1	323.374	1.889	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000567105347	308071414	/nfs/dbraw/zinc/07/14/14/308071414.db2.gz	BQVPUARPGJKUJE-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(CN2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000451659894	533847193	/nfs/dbraw/zinc/84/71/93/533847193.db2.gz	CMQAYFNMYLCWMG-BETUJISGSA-N	1	1	307.394	1.790	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](O)[C@@H](CO)C1	ZINC000414564654	527528460	/nfs/dbraw/zinc/52/84/60/527528460.db2.gz	XVSSKKCMRHFVMZ-JQIVSHAJSA-N	1	1	306.362	1.673	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000433246382	528024788	/nfs/dbraw/zinc/02/47/88/528024788.db2.gz	LNVPGDBPMAMSOU-AWEZNQCLSA-N	1	1	312.366	1.691	20	5		DDBDMO
CC(C)[N@H+](Cc1cccnc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000305712145	528956862	/nfs/dbraw/zinc/95/68/62/528956862.db2.gz	YFLOAENFMACBBY-OAHLLOKOSA-N	1	1	319.365	1.458	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736453912	598772548	/nfs/dbraw/zinc/77/25/48/598772548.db2.gz	SSKATAFZRRGQAS-UHFFFAOYSA-N	1	1	320.357	1.314	20	5		DDBDMO
C[C@H](CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000820281953	606706068	/nfs/dbraw/zinc/70/60/68/606706068.db2.gz	ZSYFWWKZHZLXJL-MRVPVSSYSA-N	1	1	318.341	1.065	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000820669005	606711577	/nfs/dbraw/zinc/71/15/77/606711577.db2.gz	YKKPZWLSYHOSIN-BDAKNGLRSA-N	1	1	318.341	1.065	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccnn1C	ZINC000774205670	697854800	/nfs/dbraw/zinc/85/48/00/697854800.db2.gz	ZWYGIBALAYHGBX-SNVBAGLBSA-N	1	1	303.322	1.618	20	5		DDBDMO
COC1CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1	ZINC000749939662	700193341	/nfs/dbraw/zinc/19/33/41/700193341.db2.gz	ZQMLCBCQMBTDPL-UHFFFAOYSA-N	1	1	305.338	1.716	20	5		DDBDMO
CO[C@H]1CCC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749949461	700193744	/nfs/dbraw/zinc/19/37/44/700193744.db2.gz	FFSQZPZKGSGUKJ-LBPRGKRZSA-N	1	1	305.338	1.716	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749949461	700193746	/nfs/dbraw/zinc/19/37/46/700193746.db2.gz	FFSQZPZKGSGUKJ-LBPRGKRZSA-N	1	1	305.338	1.716	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)CCCC1	ZINC000750051495	700200937	/nfs/dbraw/zinc/20/09/37/700200937.db2.gz	ZBRLPLYCUJILOY-UHFFFAOYSA-N	1	1	321.333	1.349	20	5		DDBDMO
CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)C(F)(F)F	ZINC000778202614	698249319	/nfs/dbraw/zinc/24/93/19/698249319.db2.gz	CZSPPAGYJMYGSF-NWDGAFQWSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H](O)C(F)(F)F	ZINC000778202614	698249320	/nfs/dbraw/zinc/24/93/20/698249320.db2.gz	CZSPPAGYJMYGSF-NWDGAFQWSA-N	1	1	322.283	1.873	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000780867222	698565858	/nfs/dbraw/zinc/56/58/58/698565858.db2.gz	NIYIPRMQGAXSKH-SECBINFHSA-N	1	1	319.408	1.419	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC(O)C1	ZINC000782543663	698736034	/nfs/dbraw/zinc/73/60/34/698736034.db2.gz	IBYDZQIEAPWKTI-UHFFFAOYSA-N	1	1	311.313	1.518	20	5		DDBDMO
C[C@@H]1CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000782859646	698774040	/nfs/dbraw/zinc/77/40/40/698774040.db2.gz	IQPDYVQCHGUEGB-LLVKDONJSA-N	1	1	307.354	1.254	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)[C@@H](C)C1	ZINC000761075343	700839477	/nfs/dbraw/zinc/83/94/77/700839477.db2.gz	FGXWOGKERPBQMX-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000763876571	700951646	/nfs/dbraw/zinc/95/16/46/700951646.db2.gz	UYGFDXFLXQIWBJ-LSDHHAIUSA-N	1	1	312.366	1.346	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@@H+]1C	ZINC000766207792	701042369	/nfs/dbraw/zinc/04/23/69/701042369.db2.gz	ZUZCRICEWQCUFA-NSHDSACASA-N	1	1	314.345	1.919	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C	ZINC000766207792	701042371	/nfs/dbraw/zinc/04/23/71/701042371.db2.gz	ZUZCRICEWQCUFA-NSHDSACASA-N	1	1	314.345	1.919	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2csc([N+](=O)[O-])c2)CCCOC1	ZINC000770675893	701289228	/nfs/dbraw/zinc/28/92/28/701289228.db2.gz	GJWRUDKAQIQFQL-ZDUSSCGKSA-N	1	1	314.363	1.858	20	5		DDBDMO
Cn1ncc2c1CCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000839625965	701757525	/nfs/dbraw/zinc/75/75/25/701757525.db2.gz	YVRNGRUXMDZMLS-MRXNPFEDSA-N	1	1	316.361	1.810	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000814928224	701772943	/nfs/dbraw/zinc/77/29/43/701772943.db2.gz	BACBENHYZDMYDD-PHIMTYICSA-N	1	1	306.366	1.483	20	5		DDBDMO
Cc1nn(CN2C[C@H]3CC[N@H+](C)[C@H]3C2)c2cc([N+](=O)[O-])ccc12	ZINC000840133213	701988229	/nfs/dbraw/zinc/98/82/29/701988229.db2.gz	QPYRWKBOSNRNDE-WBMJQRKESA-N	1	1	315.377	1.846	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)NCc1ccc(C)c([N+](=O)[O-])c1	ZINC000868216838	702003589	/nfs/dbraw/zinc/00/35/89/702003589.db2.gz	LRGYYXUALCKIIO-UHFFFAOYSA-N	1	1	324.381	1.281	20	5		DDBDMO
Cc1nn(CN(C)C[C@H]2CCC[N@H+]2C)c2ncc([N+](=O)[O-])cc12	ZINC000817371664	702358557	/nfs/dbraw/zinc/35/85/57/702358557.db2.gz	BQERKUSTZGFWMK-GFCCVEGCSA-N	1	1	318.381	1.631	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000814173774	702490686	/nfs/dbraw/zinc/49/06/86/702490686.db2.gz	QASSBLYOYYLOKV-RYKCVBHDSA-N	1	1	302.330	1.959	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000814173774	702490689	/nfs/dbraw/zinc/49/06/89/702490689.db2.gz	QASSBLYOYYLOKV-RYKCVBHDSA-N	1	1	302.330	1.959	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H](CO)C[NH+]2CCCCC2)cc1	ZINC000843112602	702821151	/nfs/dbraw/zinc/82/11/51/702821151.db2.gz	IRMFVOHOFICZPS-ZBFHGGJFSA-N	1	1	323.393	1.065	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000879580627	706727220	/nfs/dbraw/zinc/72/72/20/706727220.db2.gz	IPUKDFVUHYLSFV-FVQBIDKESA-N	1	1	305.378	1.654	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)cc1F	ZINC000866582118	706735131	/nfs/dbraw/zinc/73/51/31/706735131.db2.gz	MPBFTZZHDKJXQH-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)cc1F	ZINC000866582118	706735134	/nfs/dbraw/zinc/73/51/34/706735134.db2.gz	MPBFTZZHDKJXQH-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
CN(C(=O)C[N@@H+]1C[C@@H](O)CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000879620953	706741421	/nfs/dbraw/zinc/74/14/21/706741421.db2.gz	MVJWFCPTKJXLII-AWEZNQCLSA-N	1	1	321.377	1.650	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H](O)CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000879620953	706741425	/nfs/dbraw/zinc/74/14/25/706741425.db2.gz	MVJWFCPTKJXLII-AWEZNQCLSA-N	1	1	321.377	1.650	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000848351488	703542040	/nfs/dbraw/zinc/54/20/40/703542040.db2.gz	DMEYMQSLYYIMTC-LSDHHAIUSA-N	1	1	318.377	1.924	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)N1	ZINC000852297128	704000219	/nfs/dbraw/zinc/00/02/19/704000219.db2.gz	FESLKWLKHLKYJP-OAHLLOKOSA-N	1	1	317.345	1.498	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000818978642	704041062	/nfs/dbraw/zinc/04/10/62/704041062.db2.gz	XUUTXXOVYBHXKP-NSHDSACASA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000818978642	704041064	/nfs/dbraw/zinc/04/10/64/704041064.db2.gz	XUUTXXOVYBHXKP-NSHDSACASA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000818977735	704041281	/nfs/dbraw/zinc/04/12/81/704041281.db2.gz	LEVLANLFTNQCHZ-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000818977735	704041284	/nfs/dbraw/zinc/04/12/84/704041284.db2.gz	LEVLANLFTNQCHZ-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C)C(C)(C)CC1	ZINC000871153022	704231592	/nfs/dbraw/zinc/23/15/92/704231592.db2.gz	CRLMCKCXRVZBBN-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000820272084	704250514	/nfs/dbraw/zinc/25/05/14/704250514.db2.gz	JGIOFBOYOXQOLY-LCGIIJARSA-N	1	1	315.373	1.861	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H]3COC[C@H]3C2)c1	ZINC000853586439	704276425	/nfs/dbraw/zinc/27/64/25/704276425.db2.gz	RMQXRUCMLFGDFL-WCQYABFASA-N	1	1	302.334	1.870	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000855159445	704471532	/nfs/dbraw/zinc/47/15/32/704471532.db2.gz	AMUBXRNLFFMIBM-JTQLQIEISA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860160102	705118397	/nfs/dbraw/zinc/11/83/97/705118397.db2.gz	LCSMLUJYNVFPIH-OPQQBVKSSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860160102	705118398	/nfs/dbraw/zinc/11/83/98/705118398.db2.gz	LCSMLUJYNVFPIH-OPQQBVKSSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000874851036	705204193	/nfs/dbraw/zinc/20/41/93/705204193.db2.gz	ZCGGRJPAIMYLEC-QWHCGFSZSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)C[C@@H]21	ZINC000823933274	705341795	/nfs/dbraw/zinc/34/17/95/705341795.db2.gz	NQBMPQLMPAZNJG-RNCFNFMXSA-N	1	1	305.338	1.345	20	5		DDBDMO
C[C@H](CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000825664408	705710486	/nfs/dbraw/zinc/71/04/86/705710486.db2.gz	FAAVRXXHNGPZMH-QMTHXVAHSA-N	1	1	307.350	1.227	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)C1	ZINC000826796583	705873604	/nfs/dbraw/zinc/87/36/04/705873604.db2.gz	LJFDZXIWHZCJEQ-JTQLQIEISA-N	1	1	311.313	1.184	20	5		DDBDMO
C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)CC1(C)COC1	ZINC000863298543	705894685	/nfs/dbraw/zinc/89/46/85/705894685.db2.gz	FWZHNSCUZZGULV-UHFFFAOYSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)CC1(C)COC1	ZINC000863298543	705894689	/nfs/dbraw/zinc/89/46/89/705894689.db2.gz	FWZHNSCUZZGULV-UHFFFAOYSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)N1CC[NH2+]CC1=O	ZINC000863657722	705978134	/nfs/dbraw/zinc/97/81/34/705978134.db2.gz	DVMNYBBBKHLYQV-VIFPVBQESA-N	1	1	317.305	1.138	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@]1(O)CCc2ccccc21	ZINC000829338052	706320622	/nfs/dbraw/zinc/32/06/22/706320622.db2.gz	QLFNREHEVAQVMW-INIZCTEOSA-N	1	1	316.361	1.557	20	5		DDBDMO
CC(C)[C@H](O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000878251195	706338912	/nfs/dbraw/zinc/33/89/12/706338912.db2.gz	HPDSOKAPRYAFNY-TZMCWYRMSA-N	1	1	308.382	1.883	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)C(=O)CCC(C)(C)[N+](=O)[O-])C[C@H](C)O1	ZINC000830786859	706579413	/nfs/dbraw/zinc/57/94/13/706579413.db2.gz	HTCMXZBOTWCGHJ-BETUJISGSA-N	1	1	315.414	1.390	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)C(=O)CCC(C)(C)[N+](=O)[O-])C[C@H](C)O1	ZINC000830786859	706579416	/nfs/dbraw/zinc/57/94/16/706579416.db2.gz	HTCMXZBOTWCGHJ-BETUJISGSA-N	1	1	315.414	1.390	20	5		DDBDMO
O=C1CC2(CCC2)[N@H+](Cc2ccc([N+](=O)[O-])cc2F)CCN1	ZINC000880169549	706899731	/nfs/dbraw/zinc/89/97/31/706899731.db2.gz	DSNZJODQLHJZPD-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)CCN1	ZINC000880169549	706899733	/nfs/dbraw/zinc/89/97/33/706899733.db2.gz	DSNZJODQLHJZPD-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)C[C@@H]21	ZINC000834310878	707027487	/nfs/dbraw/zinc/02/74/87/707027487.db2.gz	ZJEHKXJIMIGHKM-YGRLFVJLSA-N	1	1	323.324	1.275	20	5		DDBDMO
C[C@@H]([NH2+]CCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872032653	707283240	/nfs/dbraw/zinc/28/32/40/707283240.db2.gz	XGOLQEHBFSVJGX-SECBINFHSA-N	1	1	304.343	1.819	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1nc2sccn2c1[N+](=O)[O-]	ZINC000872779841	707597014	/nfs/dbraw/zinc/59/70/14/707597014.db2.gz	IWZUHWKZZBEOFM-VHSXEESVSA-N	1	1	307.379	1.977	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000838149919	707854833	/nfs/dbraw/zinc/85/48/33/707854833.db2.gz	QVFGMSBKQPIDNR-WFASDCNBSA-N	1	1	321.377	1.476	20	5		DDBDMO
Nc1ccc(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000838911594	708001809	/nfs/dbraw/zinc/00/18/09/708001809.db2.gz	YAKLHZTVHUALBP-TXEJJXNPSA-N	1	1	321.333	1.197	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222607	708260088	/nfs/dbraw/zinc/26/00/88/708260088.db2.gz	WEXNUHHKLXNZFT-OLZOCXBDSA-N	1	1	306.366	1.334	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000885855208	708640352	/nfs/dbraw/zinc/64/03/52/708640352.db2.gz	LCURRHHWJRFSGG-OAHLLOKOSA-N	1	1	319.361	1.578	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(Cc2cccnc2[N+](=O)[O-])[C@H](C)C1	ZINC000886114471	708700709	/nfs/dbraw/zinc/70/07/09/708700709.db2.gz	PTKYOKHFXKWZIG-GFCCVEGCSA-N	1	1	322.365	1.059	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2cccnc2[N+](=O)[O-])[C@H](C)C1	ZINC000886114471	708700710	/nfs/dbraw/zinc/70/07/10/708700710.db2.gz	PTKYOKHFXKWZIG-GFCCVEGCSA-N	1	1	322.365	1.059	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2CSC[C@@H]2C1	ZINC000886568812	708778015	/nfs/dbraw/zinc/77/80/15/708778015.db2.gz	WWTDEZXCZGGUPV-FRRDWIJNSA-N	1	1	324.402	1.629	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@]2(CO)CCC[C@@H]12)Nc1ccccc1[N+](=O)[O-]	ZINC000886628334	708798606	/nfs/dbraw/zinc/79/86/06/708798606.db2.gz	NAUUPLSAABHCKC-GDBMZVCRSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@]2(CO)CCC[C@@H]12)Nc1ccccc1[N+](=O)[O-]	ZINC000886628334	708798608	/nfs/dbraw/zinc/79/86/08/708798608.db2.gz	NAUUPLSAABHCKC-GDBMZVCRSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H](CNC(=O)CC[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000887404416	709037937	/nfs/dbraw/zinc/03/79/37/709037937.db2.gz	DSANOKYOTSGVIA-CYBMUJFWSA-N	1	1	321.377	1.537	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c1C	ZINC000889636820	709568540	/nfs/dbraw/zinc/56/85/40/709568540.db2.gz	HOINAFBUONVIDC-GXTWGEPZSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c1C	ZINC000889636820	709568545	/nfs/dbraw/zinc/56/85/45/709568545.db2.gz	HOINAFBUONVIDC-GXTWGEPZSA-N	1	1	321.377	1.661	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000910281245	709863494	/nfs/dbraw/zinc/86/34/94/709863494.db2.gz	WUBRYEMGKNMRRW-JTQLQIEISA-N	1	1	308.338	1.252	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1	ZINC000891346537	710167038	/nfs/dbraw/zinc/16/70/38/710167038.db2.gz	YRESJGTUXRFOAD-ZDUSSCGKSA-N	1	1	313.333	1.479	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000891508897	710222806	/nfs/dbraw/zinc/22/28/06/710222806.db2.gz	IFDBSKNCYIPGOQ-CYBMUJFWSA-N	1	1	322.365	1.299	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000928438151	713196120	/nfs/dbraw/zinc/19/61/20/713196120.db2.gz	SQQVRENQUJVQMG-DGCLKSJQSA-N	1	1	307.350	1.491	20	5		DDBDMO
COc1c(O)ccc(CNCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000893355038	710614292	/nfs/dbraw/zinc/61/42/92/710614292.db2.gz	BPJVAMSVMSDMTM-LLVKDONJSA-N	1	1	309.366	1.883	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]CCN2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000893355038	710614317	/nfs/dbraw/zinc/61/43/17/710614317.db2.gz	BPJVAMSVMSDMTM-LLVKDONJSA-N	1	1	309.366	1.883	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC(C)([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000913399330	713208255	/nfs/dbraw/zinc/20/82/55/713208255.db2.gz	YAQBBFZUOVJJOJ-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC000894641749	711226862	/nfs/dbraw/zinc/22/68/62/711226862.db2.gz	XIWGEZUGBVUUBY-LBPRGKRZSA-N	1	1	309.366	1.835	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2Cc3c[nH+]cn3C2)c1	ZINC000894995395	711356175	/nfs/dbraw/zinc/35/61/75/711356175.db2.gz	CFLTZRCBWZRZFH-JTQLQIEISA-N	1	1	302.290	1.615	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1	ZINC000896558124	711751426	/nfs/dbraw/zinc/75/14/26/711751426.db2.gz	YDZHAUNCFOVBHJ-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c1	ZINC000905675649	712114465	/nfs/dbraw/zinc/11/44/65/712114465.db2.gz	HZQMESZXYNZYNF-ZBFHGGJFSA-N	1	1	314.345	1.649	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c1	ZINC000905675649	712114467	/nfs/dbraw/zinc/11/44/67/712114467.db2.gz	HZQMESZXYNZYNF-ZBFHGGJFSA-N	1	1	314.345	1.649	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000914432252	713395069	/nfs/dbraw/zinc/39/50/69/713395069.db2.gz	MBOQTXNAQWAPLS-BETUJISGSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccco1	ZINC000917041565	713479456	/nfs/dbraw/zinc/47/94/56/713479456.db2.gz	VOLPYLLYELZMSD-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(=O)NCc1ccco1	ZINC000917041565	713479458	/nfs/dbraw/zinc/47/94/58/713479458.db2.gz	VOLPYLLYELZMSD-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC000929090340	713543767	/nfs/dbraw/zinc/54/37/67/713543767.db2.gz	BDLYBPKHKQYGKA-ZWNOBZJWSA-N	1	1	320.349	1.771	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C	ZINC000930684315	713895899	/nfs/dbraw/zinc/89/58/99/713895899.db2.gz	OVJANDGHURFVPJ-NWDGAFQWSA-N	1	1	301.387	1.746	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000930770130	713916075	/nfs/dbraw/zinc/91/60/75/713916075.db2.gz	VUFUOCDWENYWIM-MFKMUULPSA-N	1	1	320.349	1.771	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCn2cc[nH+]c21	ZINC000931524612	714119104	/nfs/dbraw/zinc/11/91/04/714119104.db2.gz	TUVFXDCQFODREB-UHFFFAOYSA-N	1	1	301.306	1.558	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCn2cc[nH+]c21	ZINC000931525152	714119410	/nfs/dbraw/zinc/11/94/10/714119410.db2.gz	YCIZNKKFQLBXEI-SNVBAGLBSA-N	1	1	301.306	1.639	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CCn3cc[nH+]c32)c1	ZINC000931528224	714120239	/nfs/dbraw/zinc/12/02/39/714120239.db2.gz	WPCCAEACGVSJAR-LBPRGKRZSA-N	1	1	304.306	1.051	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](C3OCCO3)C2)c1	ZINC000932009872	714234039	/nfs/dbraw/zinc/23/40/39/714234039.db2.gz	IVQRCOOMWHDDAU-LBPRGKRZSA-N	1	1	308.334	1.668	20	5		DDBDMO
CCO[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000932972012	714446629	/nfs/dbraw/zinc/44/66/29/714446629.db2.gz	PQULAWRZERQIAO-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000932972012	714446631	/nfs/dbraw/zinc/44/66/31/714446631.db2.gz	PQULAWRZERQIAO-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@H]1CC[C@@H]2C1	ZINC000933709697	714653145	/nfs/dbraw/zinc/65/31/45/714653145.db2.gz	UMDLCUOOHJWRKQ-QVKMIARZSA-N	1	1	320.393	1.520	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1C[C@H](O)C[N@@H+]1C	ZINC000924990280	714718287	/nfs/dbraw/zinc/71/82/87/714718287.db2.gz	UYVVSLXYMFQWSO-STQMWFEESA-N	1	1	321.377	1.315	20	5		DDBDMO
C[C@](CO)([NH2+]CC[N+](=O)[O-])c1cccc(Br)c1	ZINC000934492281	714832961	/nfs/dbraw/zinc/83/29/61/714832961.db2.gz	AVXSQEBUWWLVAX-LLVKDONJSA-N	1	1	303.156	1.523	20	5		DDBDMO
CC(=O)N1CC[C@H]2C[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C[C@H]2CC1	ZINC000946418912	718775209	/nfs/dbraw/zinc/77/52/09/718775209.db2.gz	KCSWGGRFIDKSKV-BETUJISGSA-N	1	1	321.381	1.019	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001105459963	741849087	/nfs/dbraw/zinc/84/90/87/741849087.db2.gz	NBEQBVXAYDYPMU-UHFFFAOYSA-N	1	1	323.397	1.226	20	5		DDBDMO
CCOC(=O)[C@H](CCSC)[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001168978819	762147435	/nfs/dbraw/zinc/14/74/35/762147435.db2.gz	UMZLJSCRDHAOSL-SRVKXCTJSA-N	1	1	304.412	1.706	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCCN(c3ncccn3)CC2)C1	ZINC001169036293	762191769	/nfs/dbraw/zinc/19/17/69/762191769.db2.gz	NGALCJUFXDFBQD-ZIAGYGMSSA-N	1	1	305.382	1.434	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001097190268	756977816	/nfs/dbraw/zinc/97/78/16/756977816.db2.gz	NEMHZIQMNPQIOV-OKILXGFUSA-N	1	1	320.393	1.994	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1	ZINC001048814299	769933613	/nfs/dbraw/zinc/93/36/13/769933613.db2.gz	DBWTUBXISVNDDC-XJFOESAGSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC(C)(C)CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001048814299	769933619	/nfs/dbraw/zinc/93/36/19/769933619.db2.gz	DBWTUBXISVNDDC-XJFOESAGSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001048814299	769933625	/nfs/dbraw/zinc/93/36/25/769933625.db2.gz	DBWTUBXISVNDDC-XJFOESAGSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC001097057229	771610923	/nfs/dbraw/zinc/61/09/23/771610923.db2.gz	SSEQIWGTNMEXOK-JOCQHMNTSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1cc(NCCNC(=O)C[N@H+](C)C2CCC2)ncc1[N+](=O)[O-]	ZINC001094221929	775543878	/nfs/dbraw/zinc/54/38/78/775543878.db2.gz	VMRSBYKLHSLDLH-UHFFFAOYSA-N	1	1	321.381	1.311	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](O)[C@@H](CO)C1)CC2	ZINC001172903299	776916128	/nfs/dbraw/zinc/91/61/28/776916128.db2.gz	GNVMATFAQXNDJV-BFYDXBDKSA-N	1	1	320.389	1.517	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001101705793	777416172	/nfs/dbraw/zinc/41/61/72/777416172.db2.gz	XPUYROSBRXSMJK-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H]([C@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243235	778092617	/nfs/dbraw/zinc/09/26/17/778092617.db2.gz	NJRVTAPAOYXVHT-HZMBPMFUSA-N	1	1	324.337	1.602	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H]([C@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243235	778092628	/nfs/dbraw/zinc/09/26/28/778092628.db2.gz	NJRVTAPAOYXVHT-HZMBPMFUSA-N	1	1	324.337	1.602	20	5		DDBDMO
Nc1ccc[nH+]c1N1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC001154781958	861447883	/nfs/dbraw/zinc/44/78/83/861447883.db2.gz	ACZRUWJUHVHLNZ-UHFFFAOYSA-N	1	1	318.312	1.433	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NC(=O)c1cnn(-c2cc[nH+]cc2)c1	ZINC001272512343	846250664	/nfs/dbraw/zinc/25/06/64/846250664.db2.gz	AUVXNNFGSWBMHN-UHFFFAOYSA-N	1	1	313.277	1.161	20	5		DDBDMO
CN1CCO[C@H](CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001155197298	861827062	/nfs/dbraw/zinc/82/70/62/861827062.db2.gz	KXWXFYTVLUKVRD-MUBLQREKSA-N	1	1	321.381	1.265	20	5		DDBDMO
CCN(CC[NH2+]Cc1csc(C)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273373541	849729181	/nfs/dbraw/zinc/72/91/81/849729181.db2.gz	CLVMCFVMTGSWPN-CHWSQXEVSA-N	1	1	311.407	1.660	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])C1CCCCC1	ZINC001141406192	860844029	/nfs/dbraw/zinc/84/40/29/860844029.db2.gz	NYZTXIZZWKLUIS-LLVKDONJSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[NH2+][C@H]1CCN1c1ccc(-c2ccc(F)c([N+](=O)[O-])c2)nn1	ZINC001156658491	863237241	/nfs/dbraw/zinc/23/72/41/863237241.db2.gz	CGZSANDMJZHMGU-CYBMUJFWSA-N	1	1	303.297	1.947	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@](O)(C3CC3)C2)c1	ZINC001329584582	863738765	/nfs/dbraw/zinc/73/87/65/863738765.db2.gz	VKKATKDRCDDAAW-INIZCTEOSA-N	1	1	320.345	1.728	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@H+]2CCC(C)(C)C2)c(N)c([N+](=O)[O-])c1	ZINC001159011087	865039981	/nfs/dbraw/zinc/03/99/81/865039981.db2.gz	DCJSZMKFUPJFJF-UHFFFAOYSA-N	1	1	320.393	1.947	20	5		DDBDMO
O=[N+]([O-])c1c(N2CCC[N@H+]3CCC[C@H]3C2)nc2ccccn21	ZINC001320811417	867048324	/nfs/dbraw/zinc/04/83/24/867048324.db2.gz	XCBMDTJRDQPOAG-LBPRGKRZSA-N	1	1	301.350	1.917	20	5		DDBDMO
CC(C)(C)[NH+]1CC(Nc2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C1	ZINC001162225493	867358094	/nfs/dbraw/zinc/35/80/94/867358094.db2.gz	IEVDTJWBGNSCQD-UHFFFAOYSA-N	1	1	300.746	1.776	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCN2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001321237940	867429658	/nfs/dbraw/zinc/42/96/58/867429658.db2.gz	WTAUDFRBJQNGTM-UHFFFAOYSA-N	1	1	318.377	1.075	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N[C@]2(C)CCC[N@H+](C)C2)n1	ZINC001162339567	867471847	/nfs/dbraw/zinc/47/18/47/867471847.db2.gz	LYYOFRQKBGDFTQ-CQSZACIVSA-N	1	1	322.369	1.548	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1NCC[C@H]1CC[NH2+]CC1(F)F	ZINC001162811579	867847705	/nfs/dbraw/zinc/84/77/05/867847705.db2.gz	BYKHWXAUPPZRTE-MRVPVSSYSA-N	1	1	301.297	1.619	20	5		DDBDMO
COC(=O)CC(C)(C)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001335183513	868117065	/nfs/dbraw/zinc/11/70/65/868117065.db2.gz	VIZINMBIVDWPGV-ZDUSSCGKSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCC3(C2)OCCO3)ncc1[N+](=O)[O-]	ZINC001166590460	870081778	/nfs/dbraw/zinc/08/17/78/870081778.db2.gz	SJFYJVVDAGQYDA-HWKANZROSA-N	1	1	320.349	1.475	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCNC(=O)C2(C)C)ncc1[N+](=O)[O-]	ZINC001166606520	870094762	/nfs/dbraw/zinc/09/47/62/870094762.db2.gz	LGAFFWUXDLLQEN-FNORWQNLSA-N	1	1	319.365	1.237	20	5		DDBDMO
COC(=O)c1cc(O[C@H]2CC[N@@H+](C)C2)c(OC)cc1[N+](=O)[O-]	ZINC001226440880	882434360	/nfs/dbraw/zinc/43/43/60/882434360.db2.gz	GWJHZQVYZHMNMD-VIFPVBQESA-N	1	1	310.306	1.473	20	5		DDBDMO
CCCN(C(=O)c1cnc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC001299832726	870942945	/nfs/dbraw/zinc/94/29/45/870942945.db2.gz	FHJAFKCAYZTHGM-LLVKDONJSA-N	1	1	307.354	1.128	20	5		DDBDMO
CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])nc3)C[C@H]1[N@H+]2C	ZINC001226712420	882602205	/nfs/dbraw/zinc/60/22/05/882602205.db2.gz	MLJMUDCBYIWFLM-SCUASFONSA-N	1	1	321.333	1.535	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3cc(F)c([N+](=O)[O-])cc3CO)[C@H]2C1	ZINC001348566013	874636254	/nfs/dbraw/zinc/63/62/54/874636254.db2.gz	UGPXSQJVIQVLJA-XHVZSJERSA-N	1	1	309.341	1.978	20	5		DDBDMO
CCC/C=C/CC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001227257415	882936752	/nfs/dbraw/zinc/93/67/52/882936752.db2.gz	ADEGRQLELPQJBU-DPOFCPOHSA-N	1	1	309.410	1.979	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)c2cc(N)c([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC001354178023	877793263	/nfs/dbraw/zinc/79/32/63/877793263.db2.gz	NMTQCFSXVMQIPX-PHIMTYICSA-N	1	1	309.370	1.117	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)c2cc(N)c([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC001354178023	877793283	/nfs/dbraw/zinc/79/32/83/877793283.db2.gz	NMTQCFSXVMQIPX-PHIMTYICSA-N	1	1	309.370	1.117	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC001355171691	878454066	/nfs/dbraw/zinc/45/40/66/878454066.db2.gz	PIISSVFQHQWITE-WCFLWFBJSA-N	1	1	319.361	1.673	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1COC[C@@H]1C[N@H+](C)CCO1	ZINC001223449042	880966097	/nfs/dbraw/zinc/96/60/97/880966097.db2.gz	VNCYULBNXBBCDJ-ZDUSSCGKSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1COC[C@@H]1C[N@@H+](C)CCO1	ZINC001223449042	880966105	/nfs/dbraw/zinc/96/61/05/880966105.db2.gz	VNCYULBNXBBCDJ-ZDUSSCGKSA-N	1	1	324.333	1.229	20	5		DDBDMO
CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cnccc3[N+](=O)[O-])C[C@H]1[N@H+]2C	ZINC001228882865	883712480	/nfs/dbraw/zinc/71/24/80/883712480.db2.gz	QYKDPVXUGPEZAB-VTPLQMEGSA-N	1	1	321.333	1.535	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2c(C(C)=O)cccc2[N+](=O)[O-])C1	ZINC001228978197	883755441	/nfs/dbraw/zinc/75/54/41/883755441.db2.gz	WIVIVFQTSBCCRI-GFCCVEGCSA-N	1	1	308.334	1.897	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2c(C(C)=O)cccc2[N+](=O)[O-])C1	ZINC001228978197	883755453	/nfs/dbraw/zinc/75/54/53/883755453.db2.gz	WIVIVFQTSBCCRI-GFCCVEGCSA-N	1	1	308.334	1.897	20	5		DDBDMO
COC(=O)c1c(O[C@H]2CCc3[nH+]ccn3C2)cccc1[N+](=O)[O-]	ZINC001229049981	883792720	/nfs/dbraw/zinc/79/27/20/883792720.db2.gz	QCCYTWDTHOEEER-JTQLQIEISA-N	1	1	317.301	1.972	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ncnc3cc([N+](=O)[O-])ccc32)C1	ZINC001229403438	883961498	/nfs/dbraw/zinc/96/14/98/883961498.db2.gz	QPTJOYFUHIXLHI-GFCCVEGCSA-N	1	1	318.333	1.638	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1nc3c[nH]cc([N+](=O)[O-])c-3n1)C2	ZINC001230230567	884381277	/nfs/dbraw/zinc/38/12/77/884381277.db2.gz	VBKPKOKFMYOMCF-ILWJIGKKSA-N	1	1	303.322	1.870	20	5		DDBDMO
C[N@H+](CCCNC(=O)C(F)F)Cc1csc([N+](=O)[O-])c1	ZINC001231018258	885139058	/nfs/dbraw/zinc/13/90/58/885139058.db2.gz	VSLKLPXVQPKTKX-UHFFFAOYSA-N	1	1	307.322	1.860	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C(F)F)Cc1csc([N+](=O)[O-])c1	ZINC001231018258	885139066	/nfs/dbraw/zinc/13/90/66/885139066.db2.gz	VSLKLPXVQPKTKX-UHFFFAOYSA-N	1	1	307.322	1.860	20	5		DDBDMO
C[N@H+](CCCNC(=O)c1ccn[nH]1)Cc1csc([N+](=O)[O-])c1	ZINC001234243735	887782806	/nfs/dbraw/zinc/78/28/06/887782806.db2.gz	LAZFBEOPBPXDPJ-UHFFFAOYSA-N	1	1	323.378	1.631	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccn[nH]1)Cc1csc([N+](=O)[O-])c1	ZINC001234243735	887782821	/nfs/dbraw/zinc/78/28/21/887782821.db2.gz	LAZFBEOPBPXDPJ-UHFFFAOYSA-N	1	1	323.378	1.631	20	5		DDBDMO
CCOCCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001235581943	888771739	/nfs/dbraw/zinc/77/17/39/888771739.db2.gz	FFAZLPZNUVRKJY-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
[NH3+]C[C@@]1(N[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CN2CCC1CC2	ZINC001254580889	896512850	/nfs/dbraw/zinc/51/28/50/896512850.db2.gz	HTTVOUBZSLYYPJ-NVXWUHKLSA-N	1	1	316.405	1.075	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12	ZINC001262725517	900337739	/nfs/dbraw/zinc/33/77/39/900337739.db2.gz	YWPUOKDYXNPLGK-RIEGTJTDSA-N	1	1	318.377	1.707	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)ccc1[N+](=O)[O-]	ZINC001262826284	900387611	/nfs/dbraw/zinc/38/76/11/900387611.db2.gz	GXWCKKDOLBDUGO-JHJVBQTASA-N	1	1	319.361	1.673	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCN(C)c1cc(C)c([N+](=O)[O-])cn1	ZINC001263221917	900539445	/nfs/dbraw/zinc/53/94/45/900539445.db2.gz	GNIXKJDAVJFFMI-UHFFFAOYSA-N	1	1	323.397	1.192	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001294503421	915177970	/nfs/dbraw/zinc/17/79/70/915177970.db2.gz	XBFWMEPQCJPFOI-NEPJUHHUSA-N	1	1	319.365	1.271	20	5		DDBDMO
Cc1cc(N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC000278277169	214061655	/nfs/dbraw/zinc/06/16/55/214061655.db2.gz	BHRYIJBITJOIGZ-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000278292693	214071821	/nfs/dbraw/zinc/07/18/21/214071821.db2.gz	CTORGVGFVFUHLJ-UWVGGRQHSA-N	1	1	313.310	1.067	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000278292693	214071823	/nfs/dbraw/zinc/07/18/23/214071823.db2.gz	CTORGVGFVFUHLJ-UWVGGRQHSA-N	1	1	313.310	1.067	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278450935	214161387	/nfs/dbraw/zinc/16/13/87/214161387.db2.gz	LMLUVSRPHJCSQF-UHFFFAOYSA-N	1	1	307.354	1.851	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000278453610	214163039	/nfs/dbraw/zinc/16/30/39/214163039.db2.gz	RDBVZNBEWGGPDU-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000278453610	214163041	/nfs/dbraw/zinc/16/30/41/214163041.db2.gz	RDBVZNBEWGGPDU-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000278453610	214163042	/nfs/dbraw/zinc/16/30/42/214163042.db2.gz	RDBVZNBEWGGPDU-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H](O)C1	ZINC000452073133	231289811	/nfs/dbraw/zinc/28/98/11/231289811.db2.gz	YKGHVHLIJPLEDC-GWCFXTLKSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H](O)C1	ZINC000452073133	231289817	/nfs/dbraw/zinc/28/98/17/231289817.db2.gz	YKGHVHLIJPLEDC-GWCFXTLKSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000495250803	529574984	/nfs/dbraw/zinc/57/49/84/529574984.db2.gz	JKFUQLFBXJVLEQ-DZGCQCFKSA-N	1	1	310.350	1.181	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](CCO)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000614895648	362066476	/nfs/dbraw/zinc/06/64/76/362066476.db2.gz	XMLAXXQMBRZSMI-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](CCO)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000614895648	362066480	/nfs/dbraw/zinc/06/64/80/362066480.db2.gz	XMLAXXQMBRZSMI-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
COC(=O)c1cc(N2CC[N@@H+](C)C[C@H]2C)cc(C)c1[N+](=O)[O-]	ZINC000615494269	362307032	/nfs/dbraw/zinc/30/70/32/362307032.db2.gz	LSTBMBXALMFBRN-LLVKDONJSA-N	1	1	307.350	1.830	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000457392608	232047522	/nfs/dbraw/zinc/04/75/22/232047522.db2.gz	DLLOFXXKVQEHIE-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000181719124	199343658	/nfs/dbraw/zinc/34/36/58/199343658.db2.gz	RTUDZMVWTDWDJC-JTQLQIEISA-N	1	1	313.329	1.765	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000358406309	299143976	/nfs/dbraw/zinc/14/39/76/299143976.db2.gz	CWWGJYUZEAZYNL-NSHDSACASA-N	1	1	307.325	1.629	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+]2CC=CCC2)cc([N+](=O)[O-])c1C	ZINC000279777417	215138490	/nfs/dbraw/zinc/13/84/90/215138490.db2.gz	CCVCHFIOLKJPLR-UHFFFAOYSA-N	1	1	319.361	1.904	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000138226218	186015168	/nfs/dbraw/zinc/01/51/68/186015168.db2.gz	NENGFHYCNVQBEL-SNVBAGLBSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138226218	186015169	/nfs/dbraw/zinc/01/51/69/186015169.db2.gz	NENGFHYCNVQBEL-SNVBAGLBSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138226218	186015171	/nfs/dbraw/zinc/01/51/71/186015171.db2.gz	NENGFHYCNVQBEL-SNVBAGLBSA-N	1	1	309.370	1.558	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)Nc2ccncc2[N+](=O)[O-])CC1	ZINC000358483614	299168697	/nfs/dbraw/zinc/16/86/97/299168697.db2.gz	XDVVMLSSRTVHFO-UHFFFAOYSA-N	1	1	305.338	1.185	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000280086625	215365093	/nfs/dbraw/zinc/36/50/93/215365093.db2.gz	OETZZGNDABLOOQ-ZBFHGGJFSA-N	1	1	324.377	1.571	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC[N@H+](C2CCCC2)CC1	ZINC000172421860	198094411	/nfs/dbraw/zinc/09/44/11/198094411.db2.gz	SWCNSXXKDFBYTH-UHFFFAOYSA-N	1	1	321.381	1.268	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000053678004	352664124	/nfs/dbraw/zinc/66/41/24/352664124.db2.gz	ASQJICWDSOAIJD-GFCCVEGCSA-N	1	1	306.366	1.851	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000052894357	352631078	/nfs/dbraw/zinc/63/10/78/352631078.db2.gz	JNBHHLDVVKIRHJ-ZDUSSCGKSA-N	1	1	314.345	1.927	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[N@H+](C(C)(C)C)CC1	ZINC000063728046	352921349	/nfs/dbraw/zinc/92/13/49/352921349.db2.gz	GUYABQOFFLWTIH-UHFFFAOYSA-N	1	1	323.397	1.433	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])s1	ZINC000061650262	352893169	/nfs/dbraw/zinc/89/31/69/352893169.db2.gz	MRNJLXFDICYABA-UWVGGRQHSA-N	1	1	311.363	1.249	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]2C[NH+]2CCCCC2)c1[N+](=O)[O-]	ZINC000069489945	353162767	/nfs/dbraw/zinc/16/27/67/353162767.db2.gz	CNUARBSWHTZKBC-GFCCVEGCSA-N	1	1	321.381	1.717	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000069530432	353165726	/nfs/dbraw/zinc/16/57/26/353165726.db2.gz	MFNWOOPFSQZOLW-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000074105422	353293042	/nfs/dbraw/zinc/29/30/42/353293042.db2.gz	HCMCREPAJFPRHM-LBPRGKRZSA-N	1	1	307.350	1.435	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000174539691	198349926	/nfs/dbraw/zinc/34/99/26/198349926.db2.gz	RTPQPLLRSVYIOA-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](CO)C1	ZINC000174706294	198372994	/nfs/dbraw/zinc/37/29/94/198372994.db2.gz	ILBHNDWVLRYTQX-NSHDSACASA-N	1	1	323.349	1.246	20	5		DDBDMO
Cc1nn(C)c(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145681	353791570	/nfs/dbraw/zinc/79/15/70/353791570.db2.gz	ZEUDTZFHPMEKEJ-VXGBXAGGSA-N	1	1	309.370	1.302	20	5		DDBDMO
Cc1nn(C)c(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145681	353791573	/nfs/dbraw/zinc/79/15/73/353791573.db2.gz	ZEUDTZFHPMEKEJ-VXGBXAGGSA-N	1	1	309.370	1.302	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2ncc[nH]2)C1	ZINC000090554478	353795837	/nfs/dbraw/zinc/79/58/37/353795837.db2.gz	SLKLQGARMROKPU-GFCCVEGCSA-N	1	1	317.349	1.359	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000108325939	353950820	/nfs/dbraw/zinc/95/08/20/353950820.db2.gz	XYWNVYNCQAKTJV-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000108299167	353949589	/nfs/dbraw/zinc/94/95/89/353949589.db2.gz	WDWPHJIVBATRHB-GFCCVEGCSA-N	1	1	304.350	1.512	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000153753398	354200727	/nfs/dbraw/zinc/20/07/27/354200727.db2.gz	GUAOYOSIEOWSOT-HNNXBMFYSA-N	1	1	305.378	1.936	20	5		DDBDMO
CN(C(=O)C[N@H+](C)C[C@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000305215190	354469449	/nfs/dbraw/zinc/46/94/49/354469449.db2.gz	ICMHYNKYIMXXEQ-AWEZNQCLSA-N	1	1	307.350	1.260	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000305215190	354469452	/nfs/dbraw/zinc/46/94/52/354469452.db2.gz	ICMHYNKYIMXXEQ-AWEZNQCLSA-N	1	1	307.350	1.260	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(N3CCC[N@H+](CCO)CC3)c2c1	ZINC000321661570	354533580	/nfs/dbraw/zinc/53/35/80/354533580.db2.gz	TVAIUACHMCMYAY-UHFFFAOYSA-N	1	1	317.349	1.042	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587192428	354881796	/nfs/dbraw/zinc/88/17/96/354881796.db2.gz	SKQIYFAALSYDDQ-UHFFFAOYSA-N	1	1	312.370	1.050	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000590345170	355075071	/nfs/dbraw/zinc/07/50/71/355075071.db2.gz	UUZAHLAHPMUAJM-LLVKDONJSA-N	1	1	308.338	1.252	20	5		DDBDMO
Cc1c(C(=O)N2CC(C[NH+]3CCOCC3)C2)cccc1[N+](=O)[O-]	ZINC000590392079	355084258	/nfs/dbraw/zinc/08/42/58/355084258.db2.gz	LHQWBQXCGJUAAA-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
C[C@H]1[C@H]([NH+](C)C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000590566934	355115043	/nfs/dbraw/zinc/11/50/43/355115043.db2.gz	SVJYMRHYZUMJDY-TVQRCGJNSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[NH+](C)CCn1cc(Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)cn1	ZINC000590687351	355147760	/nfs/dbraw/zinc/14/77/60/355147760.db2.gz	YLPTYAIXMLQIQX-UHFFFAOYSA-N	1	1	315.337	1.395	20	5		DDBDMO
CN1C[C@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000591037764	355236990	/nfs/dbraw/zinc/23/69/90/355236990.db2.gz	ZMZDFWANZDYMPK-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000591037764	355236992	/nfs/dbraw/zinc/23/69/92/355236992.db2.gz	ZMZDFWANZDYMPK-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000591037764	355236994	/nfs/dbraw/zinc/23/69/94/355236994.db2.gz	ZMZDFWANZDYMPK-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H](CC)CO1	ZINC000593060282	355783760	/nfs/dbraw/zinc/78/37/60/355783760.db2.gz	ZYKUJZVPGOESJM-IACUBPJLSA-N	1	1	312.370	1.042	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000593061323	355784101	/nfs/dbraw/zinc/78/41/01/355784101.db2.gz	IOOPWKWXSNSPQH-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000593061323	355784102	/nfs/dbraw/zinc/78/41/02/355784102.db2.gz	IOOPWKWXSNSPQH-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C(C)(C)C1	ZINC000593337951	355857398	/nfs/dbraw/zinc/85/73/98/355857398.db2.gz	HMTUUAGARNYMTK-UHFFFAOYSA-N	1	1	322.365	1.173	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C(C)(C)C1	ZINC000593337951	355857402	/nfs/dbraw/zinc/85/74/02/355857402.db2.gz	HMTUUAGARNYMTK-UHFFFAOYSA-N	1	1	322.365	1.173	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2nccc(C)c2[N+](=O)[O-])CC1	ZINC000593516772	355910641	/nfs/dbraw/zinc/91/06/41/355910641.db2.gz	GUIMOTLKVLOYQC-UHFFFAOYSA-N	1	1	324.381	1.083	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000593589300	355935401	/nfs/dbraw/zinc/93/54/01/355935401.db2.gz	RNMGIZBSLRAAIC-UHFFFAOYSA-N	1	1	307.325	1.655	20	5		DDBDMO
[NH3+]CCCOC1CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000593725782	355977012	/nfs/dbraw/zinc/97/70/12/355977012.db2.gz	VOXIFIYAFDISMU-UHFFFAOYSA-N	1	1	309.366	1.630	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000593762840	355989957	/nfs/dbraw/zinc/98/99/57/355989957.db2.gz	XGGGUAQWQWOKPZ-UHFFFAOYSA-N	1	1	308.382	1.885	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCC(=O)N(C)C1	ZINC000593994748	356081994	/nfs/dbraw/zinc/08/19/94/356081994.db2.gz	JBIHBEHEJQTNAQ-CYBMUJFWSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H]1CCC(=O)N(C)C1	ZINC000593994748	356081996	/nfs/dbraw/zinc/08/19/96/356081996.db2.gz	JBIHBEHEJQTNAQ-CYBMUJFWSA-N	1	1	307.350	1.656	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC[C@@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000593998410	356083007	/nfs/dbraw/zinc/08/30/07/356083007.db2.gz	JZQPONISBHXGJL-INIZCTEOSA-N	1	1	319.361	1.848	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000593998410	356083011	/nfs/dbraw/zinc/08/30/11/356083011.db2.gz	JZQPONISBHXGJL-INIZCTEOSA-N	1	1	319.361	1.848	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCCCC[C@@H]2CO)c1	ZINC000594014453	356086890	/nfs/dbraw/zinc/08/68/90/356086890.db2.gz	DSXLYSZZRUDDDH-HUUCEWRRSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000594204728	356139182	/nfs/dbraw/zinc/13/91/82/356139182.db2.gz	XSYHNFBNPQEGOI-VXGBXAGGSA-N	1	1	306.366	1.680	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1n[nH]c(C)n1	ZINC000595033450	356375167	/nfs/dbraw/zinc/37/51/67/356375167.db2.gz	LVXJBAAUKWBULA-SECBINFHSA-N	1	1	305.338	1.923	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1nnc(C)[nH]1	ZINC000595033450	356375168	/nfs/dbraw/zinc/37/51/68/356375168.db2.gz	LVXJBAAUKWBULA-SECBINFHSA-N	1	1	305.338	1.923	20	5		DDBDMO
Cc1noc(C[NH2+][C@@H](C2CC2)[C@]2(CO)CCCO2)c1[N+](=O)[O-]	ZINC000595504302	356521515	/nfs/dbraw/zinc/52/15/15/356521515.db2.gz	BJGSSFBCARTKRR-UONOGXRCSA-N	1	1	311.338	1.301	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c1	ZINC000595732270	356626123	/nfs/dbraw/zinc/62/61/23/356626123.db2.gz	KTSCUFBGIORBSZ-HBYGRHMLSA-N	1	1	322.361	1.830	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000595765844	356644228	/nfs/dbraw/zinc/64/42/28/356644228.db2.gz	KGJMEMQSUYSDII-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000595768240	356644898	/nfs/dbraw/zinc/64/48/98/356644898.db2.gz	FWCWDMJZQBLPDO-GXFFZTMASA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000595759903	356641116	/nfs/dbraw/zinc/64/11/16/356641116.db2.gz	QVYOBNCNFLYFCW-BLLLJJGKSA-N	1	1	319.361	1.892	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595836995	356672352	/nfs/dbraw/zinc/67/23/52/356672352.db2.gz	ZQIPEGFZQVMEAB-HZSPNIEDSA-N	1	1	322.361	1.303	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c2c(c1)COCO2	ZINC000595830709	356668168	/nfs/dbraw/zinc/66/81/68/356668168.db2.gz	LGUJHLHFENSEBX-FZMZJTMJSA-N	1	1	320.345	1.930	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595876235	356688352	/nfs/dbraw/zinc/68/83/52/356688352.db2.gz	RCSWIXFKNAAHQK-LRDDRELGSA-N	1	1	321.377	1.874	20	5		DDBDMO
CCC[N@@H+]1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000596064901	356758769	/nfs/dbraw/zinc/75/87/69/356758769.db2.gz	CFRIQBDCNDIZED-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000596064901	356758773	/nfs/dbraw/zinc/75/87/73/356758773.db2.gz	CFRIQBDCNDIZED-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+](C2CC2)C1	ZINC000596091135	356768800	/nfs/dbraw/zinc/76/88/00/356768800.db2.gz	WBAQOBARJUHHLH-JTQLQIEISA-N	1	1	304.350	1.603	20	5		DDBDMO
Cc1cnc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000596538616	356911061	/nfs/dbraw/zinc/91/10/61/356911061.db2.gz	MVFIBNKFMPAREO-CYBMUJFWSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597859016	357361581	/nfs/dbraw/zinc/36/15/81/357361581.db2.gz	PYBRHMJKHBMVGF-SNVBAGLBSA-N	1	1	309.370	1.239	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000598341816	357544048	/nfs/dbraw/zinc/54/40/48/357544048.db2.gz	GLCYCXTYRZPEGH-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000598464234	357591841	/nfs/dbraw/zinc/59/18/41/357591841.db2.gz	CLUHDOKWIBSJTK-UHFFFAOYSA-N	1	1	311.386	1.661	20	5		DDBDMO
O=c1ccc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)n[nH]1	ZINC000599641260	358003181	/nfs/dbraw/zinc/00/31/81/358003181.db2.gz	METOZIFGLVUBQG-LBPRGKRZSA-N	1	1	304.310	1.124	20	5		DDBDMO
O=c1ccc([C@@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)n[nH]1	ZINC000599641260	358003184	/nfs/dbraw/zinc/00/31/84/358003184.db2.gz	METOZIFGLVUBQG-LBPRGKRZSA-N	1	1	304.310	1.124	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@H]2C[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000599644075	358003686	/nfs/dbraw/zinc/00/36/86/358003686.db2.gz	HVFUJOPYGMQLFC-PHIMTYICSA-N	1	1	323.349	1.178	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599670430	358018459	/nfs/dbraw/zinc/01/84/59/358018459.db2.gz	FNOPJDFWEXEUPW-TXEJJXNPSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c1	ZINC000599680547	358023036	/nfs/dbraw/zinc/02/30/36/358023036.db2.gz	GBCFAVZVJLQRTJ-KSZJFAHPSA-N	1	1	322.361	1.180	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H]4CC[C@@H](O)[C@@H]43)nc2c1	ZINC000599682651	358023663	/nfs/dbraw/zinc/02/36/63/358023663.db2.gz	GPYVOMSYEZQQIO-JBCWJZNQSA-N	1	1	302.334	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H]4CC[C@@H](O)[C@@H]43)nc2c1	ZINC000599682651	358023665	/nfs/dbraw/zinc/02/36/65/358023665.db2.gz	GPYVOMSYEZQQIO-JBCWJZNQSA-N	1	1	302.334	1.816	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1	ZINC000180300042	199143247	/nfs/dbraw/zinc/14/32/47/199143247.db2.gz	NFOGWKMMHHMQQV-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@]3(O)CCSC3)c2c1	ZINC000601123824	358411416	/nfs/dbraw/zinc/41/14/16/358411416.db2.gz	LCAFPCPFLSAVFA-CQSZACIVSA-N	1	1	305.359	1.845	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601131510	358415206	/nfs/dbraw/zinc/41/52/06/358415206.db2.gz	ZMDDOVADHKCTCQ-ZYHUDNBSSA-N	1	1	303.318	1.729	20	5		DDBDMO
O=C1CCCN1CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601184258	358437598	/nfs/dbraw/zinc/43/75/98/358437598.db2.gz	KLABAMWNEBAFHU-UHFFFAOYSA-N	1	1	300.318	1.599	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3c(F)cccc3[N+](=O)[O-])[C@@H]2C1	ZINC000601646961	358635007	/nfs/dbraw/zinc/63/50/07/358635007.db2.gz	KIHXAZNRVDKKNZ-GXFFZTMASA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000602037463	358786888	/nfs/dbraw/zinc/78/68/88/358786888.db2.gz	BAGDBMVBTDKVTH-AWEZNQCLSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000602140995	358841139	/nfs/dbraw/zinc/84/11/39/358841139.db2.gz	KCTBZYBDXMLQTK-GFCCVEGCSA-N	1	1	321.381	1.297	20	5		DDBDMO
CCN1CCN([C@H](C)C[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000602513322	359021378	/nfs/dbraw/zinc/02/13/78/359021378.db2.gz	BZTSRZHBKNWOTA-OAHLLOKOSA-N	1	1	320.437	1.753	20	5		DDBDMO
Cn1cc(CN2CC[N@@H+](C)CC23CCCCC3)c([N+](=O)[O-])n1	ZINC000602779713	359185002	/nfs/dbraw/zinc/18/50/02/359185002.db2.gz	NOUVXWGONDYSRV-UHFFFAOYSA-N	1	1	307.398	1.779	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1)C[C@H](C)O	ZINC000602781562	359186099	/nfs/dbraw/zinc/18/60/99/359186099.db2.gz	TVCIFOBKMGTBAA-ZDUSSCGKSA-N	1	1	318.377	1.983	20	5		DDBDMO
CN1C[C@@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CCC1=O	ZINC000602715567	359143849	/nfs/dbraw/zinc/14/38/49/359143849.db2.gz	PPSIGOZTTLTEMR-NSHDSACASA-N	1	1	318.333	1.789	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)CCC1=O	ZINC000602715567	359143854	/nfs/dbraw/zinc/14/38/54/359143854.db2.gz	PPSIGOZTTLTEMR-NSHDSACASA-N	1	1	318.333	1.789	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000602873307	359257410	/nfs/dbraw/zinc/25/74/10/359257410.db2.gz	IVTBKGYKECRNED-ZDUSSCGKSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCN(C)[C@H](C(C)(C)C)C1	ZINC000602873307	359257413	/nfs/dbraw/zinc/25/74/13/359257413.db2.gz	IVTBKGYKECRNED-ZDUSSCGKSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCN(C)[C@H](C(C)(C)C)C1	ZINC000602873307	359257415	/nfs/dbraw/zinc/25/74/15/359257415.db2.gz	IVTBKGYKECRNED-ZDUSSCGKSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1nn(CCC(=O)N(C)CC[N@@H+](C)C2CC2)c(C)c1[N+](=O)[O-]	ZINC000186767136	200007517	/nfs/dbraw/zinc/00/75/17/200007517.db2.gz	NEGIUSZWRZYVQV-UHFFFAOYSA-N	1	1	323.397	1.351	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@@H+](CCOC)C2)cc1[N+](=O)[O-]	ZINC000609347445	360299560	/nfs/dbraw/zinc/29/95/60/360299560.db2.gz	KZBWNCUZHQBOJO-LBPRGKRZSA-N	1	1	322.365	1.087	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000609478984	360311667	/nfs/dbraw/zinc/31/16/67/360311667.db2.gz	AHTAGLBHKYBWAI-NSHDSACASA-N	1	1	321.381	1.485	20	5		DDBDMO
C[N@H+](CCOC(C)(C)C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000610859613	360554562	/nfs/dbraw/zinc/55/45/62/360554562.db2.gz	BRHXMGXWDQWLIA-UHFFFAOYSA-N	1	1	309.366	1.941	20	5		DDBDMO
C[N@@H+](CCOC(C)(C)C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000610859613	360554565	/nfs/dbraw/zinc/55/45/65/360554565.db2.gz	BRHXMGXWDQWLIA-UHFFFAOYSA-N	1	1	309.366	1.941	20	5		DDBDMO
CCc1nn(C)c(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000611280636	360687743	/nfs/dbraw/zinc/68/77/43/360687743.db2.gz	CAMLAWVNKBVCHZ-LBPRGKRZSA-N	1	1	323.397	1.192	20	5		DDBDMO
CCOC(=O)C[C@@H](O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000611237148	360672843	/nfs/dbraw/zinc/67/28/43/360672843.db2.gz	ABZVBMOEDKMAOV-OAHLLOKOSA-N	1	1	322.361	1.873	20	5		DDBDMO
C[C@H]1[NH2+]CCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000193558600	201074883	/nfs/dbraw/zinc/07/48/83/201074883.db2.gz	WKGPLULPBKGMAC-LDYMZIIASA-N	1	1	303.322	1.341	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000194921124	201312409	/nfs/dbraw/zinc/31/24/09/201312409.db2.gz	LDNBQDJBCQBAJT-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000619578848	364070896	/nfs/dbraw/zinc/07/08/96/364070896.db2.gz	SAORSRHOXZELHL-LLVKDONJSA-N	1	1	309.370	1.193	20	5		DDBDMO
Cc1nn(C)cc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534236	193266693	/nfs/dbraw/zinc/26/66/93/193266693.db2.gz	BLVZKPAZVVMCHV-CYBMUJFWSA-N	1	1	316.365	1.718	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](C)CN1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000173399885	296146925	/nfs/dbraw/zinc/14/69/25/296146925.db2.gz	VAEBQHUEWHQDFD-UONOGXRCSA-N	1	1	306.410	1.881	20	5		DDBDMO
C[N@@H+](CCCn1ccnc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271684224	209124844	/nfs/dbraw/zinc/12/48/44/209124844.db2.gz	KLFMPZWVTAARAW-OAHLLOKOSA-N	1	1	304.350	1.847	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000159918913	248313549	/nfs/dbraw/zinc/31/35/49/248313549.db2.gz	RUVOMUIPMDZAMS-GFCCVEGCSA-N	1	1	310.350	1.829	20	5		DDBDMO
CN1CCN(CCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174719862	248378736	/nfs/dbraw/zinc/37/87/36/248378736.db2.gz	JTBDVIKBPWKQSI-UHFFFAOYSA-N	1	1	306.410	1.664	20	5		DDBDMO
CN1CCN(CCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174719862	248378741	/nfs/dbraw/zinc/37/87/41/248378741.db2.gz	JTBDVIKBPWKQSI-UHFFFAOYSA-N	1	1	306.410	1.664	20	5		DDBDMO
C[C@H](CNC(=O)NCCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1	ZINC000105177123	194082146	/nfs/dbraw/zinc/08/21/46/194082146.db2.gz	NTOVWQBMERYRCR-GFCCVEGCSA-N	1	1	320.393	1.919	20	5		DDBDMO
CC(C)(C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000338670296	250084899	/nfs/dbraw/zinc/08/48/99/250084899.db2.gz	BQPFSPNPUCROKD-NWDGAFQWSA-N	1	1	321.381	1.269	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000338677710	250087429	/nfs/dbraw/zinc/08/74/29/250087429.db2.gz	RFUPWIUWBBTOBS-LBPRGKRZSA-N	1	1	323.397	1.375	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000106397045	194206371	/nfs/dbraw/zinc/20/63/71/194206371.db2.gz	OSUSBQCFCWVRAR-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCO[C@@]2(CCCOC2)C1	ZINC000285332870	218386122	/nfs/dbraw/zinc/38/61/22/218386122.db2.gz	OCIHLDHHLDHTFN-INIZCTEOSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCO[C@@]2(CCCOC2)C1	ZINC000285332870	218386125	/nfs/dbraw/zinc/38/61/25/218386125.db2.gz	OCIHLDHHLDHTFN-INIZCTEOSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=C1NCCCC[C@@H]1[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000128736945	284874020	/nfs/dbraw/zinc/87/40/20/284874020.db2.gz	VQBBXXLRHUCNSZ-HNNXBMFYSA-N	1	1	318.377	1.386	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[NH2+]Cc3ccccc32)c1[N+](=O)[O-]	ZINC000269188421	207309161	/nfs/dbraw/zinc/30/91/61/207309161.db2.gz	VNNJQBZEHTTWFG-UHFFFAOYSA-N	1	1	315.333	1.387	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000065670410	184376452	/nfs/dbraw/zinc/37/64/52/184376452.db2.gz	WSBGAHFOXXMEMD-UHFFFAOYSA-N	1	1	309.322	1.079	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000155354134	197047067	/nfs/dbraw/zinc/04/70/67/197047067.db2.gz	IPIWDDOHYMRRPW-LLVKDONJSA-N	1	1	322.365	1.380	20	5		DDBDMO
C[N@@H+](C[C@H](O)CN1CCOc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000352708227	285243862	/nfs/dbraw/zinc/24/38/62/285243862.db2.gz	FOKFKODTDXQGEJ-HNNXBMFYSA-N	1	1	321.377	1.244	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CC2)CC1	ZINC000299357636	533328744	/nfs/dbraw/zinc/32/87/44/533328744.db2.gz	UDYQTKMKNATNJJ-LBPRGKRZSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1	ZINC000569115929	304337001	/nfs/dbraw/zinc/33/70/01/304337001.db2.gz	ARGXHVUPJIMMDD-XJKSGUPXSA-N	1	1	318.421	1.808	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000072061741	406872557	/nfs/dbraw/zinc/87/25/57/406872557.db2.gz	PZNZFAXZPFRYRO-NSHDSACASA-N	1	1	309.370	1.477	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000046988448	407068363	/nfs/dbraw/zinc/06/83/63/407068363.db2.gz	UZIGPMSWTFQQPD-ZDUSSCGKSA-N	1	1	323.397	1.562	20	5		DDBDMO
O=C(NCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1F	ZINC000054125791	407179431	/nfs/dbraw/zinc/17/94/31/407179431.db2.gz	QKDWFAWXLPWXSS-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000055407958	407203378	/nfs/dbraw/zinc/20/33/78/407203378.db2.gz	XOGZHPKFVRGPIG-VXGBXAGGSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CCn1cc([N+](=O)[O-])nc1C)C(C)C	ZINC000102478804	407323502	/nfs/dbraw/zinc/32/35/02/407323502.db2.gz	SVZDAELAEGSVJJ-UHFFFAOYSA-N	1	1	311.386	1.336	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000067807055	407285353	/nfs/dbraw/zinc/28/53/53/407285353.db2.gz	FUSKEUMIKJGYAS-JTQLQIEISA-N	1	1	309.322	1.274	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000067807055	407285355	/nfs/dbraw/zinc/28/53/55/407285355.db2.gz	FUSKEUMIKJGYAS-JTQLQIEISA-N	1	1	309.322	1.274	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1O	ZINC000271012744	407469566	/nfs/dbraw/zinc/46/95/66/407469566.db2.gz	ZWMNPPCSHVPJIQ-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1O	ZINC000271012744	407469571	/nfs/dbraw/zinc/46/95/71/407469571.db2.gz	ZWMNPPCSHVPJIQ-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C	ZINC000112925420	407447805	/nfs/dbraw/zinc/44/78/05/407447805.db2.gz	NSBHRICORPPKQL-UHFFFAOYSA-N	1	1	324.337	1.801	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])cc1OC(F)F	ZINC000114203865	407552294	/nfs/dbraw/zinc/55/22/94/407552294.db2.gz	UTWJHLLXTGODPX-SECBINFHSA-N	1	1	318.276	1.771	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])cc1OC(F)F	ZINC000114203865	407552298	/nfs/dbraw/zinc/55/22/98/407552298.db2.gz	UTWJHLLXTGODPX-SECBINFHSA-N	1	1	318.276	1.771	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000170912351	407552556	/nfs/dbraw/zinc/55/25/56/407552556.db2.gz	WAQUFZKNRYJRHV-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000170912351	407552562	/nfs/dbraw/zinc/55/25/62/407552562.db2.gz	WAQUFZKNRYJRHV-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000266543045	407552963	/nfs/dbraw/zinc/55/29/63/407552963.db2.gz	QWAWGEZLDOUFMY-GFCCVEGCSA-N	1	1	310.350	1.951	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000266111905	407530509	/nfs/dbraw/zinc/53/05/09/407530509.db2.gz	VGVKNXXJQLGLJW-KOLCDFICSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000266111905	407530511	/nfs/dbraw/zinc/53/05/11/407530511.db2.gz	VGVKNXXJQLGLJW-KOLCDFICSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000266111905	407530516	/nfs/dbraw/zinc/53/05/16/407530516.db2.gz	VGVKNXXJQLGLJW-KOLCDFICSA-N	1	1	309.370	1.429	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000114062618	407536615	/nfs/dbraw/zinc/53/66/15/407536615.db2.gz	LVUMSQJTJSQXSU-QWRGUYRKSA-N	1	1	323.349	1.663	20	5		DDBDMO
COc1cc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000171104461	407597854	/nfs/dbraw/zinc/59/78/54/407597854.db2.gz	CFRIQMDDWBTZLV-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
CC(C)(CC(N)=O)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000186253933	407619105	/nfs/dbraw/zinc/61/91/05/407619105.db2.gz	ODQZDUSVAQYDGB-UHFFFAOYSA-N	1	1	319.321	1.388	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-]	ZINC000171397325	407681118	/nfs/dbraw/zinc/68/11/18/407681118.db2.gz	FHWBLZNPIBGIQU-JTQLQIEISA-N	1	1	321.337	1.506	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]2C[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000171665967	407735509	/nfs/dbraw/zinc/73/55/09/407735509.db2.gz	ARXZETMKNIRIDY-NSHDSACASA-N	1	1	321.381	1.581	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000153195447	407776743	/nfs/dbraw/zinc/77/67/43/407776743.db2.gz	XBZSQMVLVPEEKY-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCSC3(CCOCC3)C2)c1	ZINC000186837528	407781587	/nfs/dbraw/zinc/78/15/87/407781587.db2.gz	SWWWZSVTJKUCSY-UHFFFAOYSA-N	1	1	312.395	1.389	20	5		DDBDMO
O=C(NC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000237967217	407858151	/nfs/dbraw/zinc/85/81/51/407858151.db2.gz	BPUBVGYFEJBYDB-ULKQDVFKSA-N	1	1	315.333	1.484	20	5		DDBDMO
[NH3+]C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000238083525	407887230	/nfs/dbraw/zinc/88/72/30/407887230.db2.gz	FQUHQKYKKMEDMO-VIFPVBQESA-N	1	1	303.322	1.282	20	5		DDBDMO
O=C(CC[N@H+]1CCc2n[nH]cc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000118854337	407952865	/nfs/dbraw/zinc/95/28/65/407952865.db2.gz	OSZCPDBHFAVUDL-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000268245210	407967115	/nfs/dbraw/zinc/96/71/15/407967115.db2.gz	VYBAKZSZCWKZTC-BXKDBHETSA-N	1	1	321.381	1.483	20	5		DDBDMO
CN1CCN(CCC[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174726747	407984040	/nfs/dbraw/zinc/98/40/40/407984040.db2.gz	JYRJLVJUXDUQMA-UHFFFAOYSA-N	1	1	320.437	1.707	20	5		DDBDMO
CN1CCN(CCC[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174726747	407984045	/nfs/dbraw/zinc/98/40/45/407984045.db2.gz	JYRJLVJUXDUQMA-UHFFFAOYSA-N	1	1	320.437	1.707	20	5		DDBDMO
C[N@H+]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000273098088	408056546	/nfs/dbraw/zinc/05/65/46/408056546.db2.gz	DQGGPJRCOLHZJQ-CYBMUJFWSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000273098088	408056555	/nfs/dbraw/zinc/05/65/55/408056555.db2.gz	DQGGPJRCOLHZJQ-CYBMUJFWSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000273098088	408056562	/nfs/dbraw/zinc/05/65/62/408056562.db2.gz	DQGGPJRCOLHZJQ-CYBMUJFWSA-N	1	1	323.393	1.361	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000245764863	408063996	/nfs/dbraw/zinc/06/39/96/408063996.db2.gz	JEZKNLTWQLCCKI-VHSXEESVSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000245764863	408064006	/nfs/dbraw/zinc/06/40/06/408064006.db2.gz	JEZKNLTWQLCCKI-VHSXEESVSA-N	1	1	311.338	1.243	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000154863179	408097554	/nfs/dbraw/zinc/09/75/54/408097554.db2.gz	MPIRBIBVYGPGJR-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
C[N@H+](Cc1cccnc1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182250996	408106199	/nfs/dbraw/zinc/10/61/99/408106199.db2.gz	VKRYPAIRIDIRFO-AWEZNQCLSA-N	1	1	317.345	1.862	20	5		DDBDMO
CCC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182266304	408111316	/nfs/dbraw/zinc/11/13/16/408111316.db2.gz	QFWBTHHABKBDED-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182266304	408111323	/nfs/dbraw/zinc/11/13/23/408111323.db2.gz	QFWBTHHABKBDED-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000273339201	408157930	/nfs/dbraw/zinc/15/79/30/408157930.db2.gz	NIMCEMDYUYQEKH-OLZOCXBDSA-N	1	1	310.350	1.303	20	5		DDBDMO
CCOCC[N@@H+](CC)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273346896	408163391	/nfs/dbraw/zinc/16/33/91/408163391.db2.gz	OROZCSRQEZFXAE-CYBMUJFWSA-N	1	1	312.366	1.693	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000140404260	408176284	/nfs/dbraw/zinc/17/62/84/408176284.db2.gz	XYBBPFQOUZZIHP-QWRGUYRKSA-N	1	1	311.386	1.628	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000155600730	408187679	/nfs/dbraw/zinc/18/76/79/408187679.db2.gz	USXGFZMXALEVJX-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
C[C@H]1CSCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000190451036	408247914	/nfs/dbraw/zinc/24/79/14/408247914.db2.gz	QSXMNISTQQEOBK-SNVBAGLBSA-N	1	1	309.391	1.879	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269284684	408252812	/nfs/dbraw/zinc/25/28/12/408252812.db2.gz	MXPBYTSBNKWDRY-KBPBESRZSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284684	408252816	/nfs/dbraw/zinc/25/28/16/408252816.db2.gz	MXPBYTSBNKWDRY-KBPBESRZSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284684	408252823	/nfs/dbraw/zinc/25/28/23/408252823.db2.gz	MXPBYTSBNKWDRY-KBPBESRZSA-N	1	1	305.334	1.657	20	5		DDBDMO
C[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822312	408258277	/nfs/dbraw/zinc/25/82/77/408258277.db2.gz	PLXJOWNWGVAQCV-WDEREUQCSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1	ZINC000182822312	408258282	/nfs/dbraw/zinc/25/82/82/408258282.db2.gz	PLXJOWNWGVAQCV-WDEREUQCSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822312	408258285	/nfs/dbraw/zinc/25/82/85/408258285.db2.gz	PLXJOWNWGVAQCV-WDEREUQCSA-N	1	1	321.381	1.701	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000263666835	408198573	/nfs/dbraw/zinc/19/85/73/408198573.db2.gz	LCJKLHUCUXTDBR-QWRGUYRKSA-N	1	1	323.397	1.731	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccccn3)CC2)n1	ZINC000176190343	408303037	/nfs/dbraw/zinc/30/30/37/408303037.db2.gz	WTKFYEVYACLCFN-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1(CO)CCOCC1	ZINC000191028475	408360943	/nfs/dbraw/zinc/36/09/43/408360943.db2.gz	VMBBTYYNGPJCPX-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209118	408354905	/nfs/dbraw/zinc/35/49/05/408354905.db2.gz	IIRBZIFUPCGPBY-QJPTWQEYSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209118	408354907	/nfs/dbraw/zinc/35/49/07/408354907.db2.gz	IIRBZIFUPCGPBY-QJPTWQEYSA-N	1	1	307.350	1.625	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000173495181	162342972	/nfs/dbraw/zinc/34/29/72/162342972.db2.gz	FTUSMSKCRPNSEQ-GFCCVEGCSA-N	1	1	310.350	1.687	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000183560074	408440417	/nfs/dbraw/zinc/44/04/17/408440417.db2.gz	ZSKUBMASTYDLDP-CYBMUJFWSA-N	1	1	307.354	1.794	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000270045769	408480952	/nfs/dbraw/zinc/48/09/52/408480952.db2.gz	BLNUWMBCSQLXOE-AOOOYVTPSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O)c1nccs1	ZINC000183927718	408509491	/nfs/dbraw/zinc/50/94/91/408509491.db2.gz	LMFATYZBRXUZCH-NSHDSACASA-N	1	1	322.390	1.949	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@H](O)C2CC2)cccc1[N+](=O)[O-]	ZINC000160853094	408529800	/nfs/dbraw/zinc/52/98/00/408529800.db2.gz	ZWJLJSLNDFXJLZ-ABAIWWIYSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(N)=O	ZINC000191705759	408472145	/nfs/dbraw/zinc/47/21/45/408472145.db2.gz	DKLXJJILJAMWGX-UHFFFAOYSA-N	1	1	308.338	1.039	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1C	ZINC000251655659	408783547	/nfs/dbraw/zinc/78/35/47/408783547.db2.gz	HTRFWMIFWMOBLC-HEHGZKQESA-N	1	1	324.377	1.691	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000285924742	408889554	/nfs/dbraw/zinc/88/95/54/408889554.db2.gz	UPXWZPNTQUWKED-KGLIPLIRSA-N	1	1	323.324	1.279	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190840417	163161366	/nfs/dbraw/zinc/16/13/66/163161366.db2.gz	AHQVSVJMRYQPRD-UTUOFQBUSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190840417	163161369	/nfs/dbraw/zinc/16/13/69/163161369.db2.gz	AHQVSVJMRYQPRD-UTUOFQBUSA-N	1	1	307.350	1.482	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1	ZINC000277362746	408926839	/nfs/dbraw/zinc/92/68/39/408926839.db2.gz	CJCZBOOHZVEHTQ-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCCO	ZINC000281818069	408934488	/nfs/dbraw/zinc/93/44/88/408934488.db2.gz	LMZIBWXBVRSNJP-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCCO	ZINC000281818069	408934490	/nfs/dbraw/zinc/93/44/90/408934490.db2.gz	LMZIBWXBVRSNJP-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])s2)CCCO1	ZINC000281999007	408968874	/nfs/dbraw/zinc/96/88/74/408968874.db2.gz	UDJBOBYHJDLXBC-JTQLQIEISA-N	1	1	300.384	1.964	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292078772	408975476	/nfs/dbraw/zinc/97/54/76/408975476.db2.gz	FLJCKMZLTQYALI-HZPDHXFCSA-N	1	1	305.378	1.656	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000282209813	409011522	/nfs/dbraw/zinc/01/15/22/409011522.db2.gz	XWAPLHJJVKLTEZ-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@H](O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000293319462	409088647	/nfs/dbraw/zinc/08/86/47/409088647.db2.gz	XMTJJNMDPJWGSU-AWEZNQCLSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@H](O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000293319462	409088650	/nfs/dbraw/zinc/08/86/50/409088650.db2.gz	XMTJJNMDPJWGSU-AWEZNQCLSA-N	1	1	307.350	1.404	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC[N@@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000287850315	409103564	/nfs/dbraw/zinc/10/35/64/409103564.db2.gz	RZGZFUFTDOIBIK-UHFFFAOYSA-N	1	1	320.349	1.759	20	5		DDBDMO
C[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000283439773	409156249	/nfs/dbraw/zinc/15/62/49/409156249.db2.gz	XMQPVWSNADGTDD-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000283439773	409156252	/nfs/dbraw/zinc/15/62/52/409156252.db2.gz	XMQPVWSNADGTDD-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000283439773	409156253	/nfs/dbraw/zinc/15/62/53/409156253.db2.gz	XMQPVWSNADGTDD-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000295502652	409320836	/nfs/dbraw/zinc/32/08/36/409320836.db2.gz	PIEMXRPWXIXDQC-CYBMUJFWSA-N	1	1	307.350	1.171	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000290448211	409406528	/nfs/dbraw/zinc/40/65/28/409406528.db2.gz	CWCJKQDCJIMTLG-MNOVXSKESA-N	1	1	305.338	1.127	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000317075301	164025286	/nfs/dbraw/zinc/02/52/86/164025286.db2.gz	ZCOPUBFPRKJFTO-QWRGUYRKSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[C@@H]1[C@H](C)N(CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000357033728	164136824	/nfs/dbraw/zinc/13/68/24/164136824.db2.gz	IAPOWWFQHOFVHW-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1nncs1)c1ccc([N+](=O)[O-])cc1	ZINC000296730041	409632109	/nfs/dbraw/zinc/63/21/09/409632109.db2.gz	NXTJKULRNNPNGU-QMMMGPOBSA-N	1	1	307.335	1.736	20	5		DDBDMO
CC(C)[C@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000304315509	409601553	/nfs/dbraw/zinc/60/15/53/409601553.db2.gz	OEGKCHNRGHITIU-DZGCQCFKSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000342558956	409723002	/nfs/dbraw/zinc/72/30/02/409723002.db2.gz	DSUYZFLCFPZAEQ-GWCFXTLKSA-N	1	1	306.366	1.834	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCO[C@H]2CCC[C@H]21	ZINC000331662962	409745996	/nfs/dbraw/zinc/74/59/96/409745996.db2.gz	YOOSLURCAYKTKK-GUTXKFCHSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@H]2CCC[C@H]21	ZINC000331662962	409746004	/nfs/dbraw/zinc/74/60/04/409746004.db2.gz	YOOSLURCAYKTKK-GUTXKFCHSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000332028734	409817274	/nfs/dbraw/zinc/81/72/74/409817274.db2.gz	HUPLBMUBCXJNJY-HUUCEWRRSA-N	1	1	303.362	1.880	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000357159512	409910999	/nfs/dbraw/zinc/91/09/99/409910999.db2.gz	LEWDVUHQPQHWAF-UHFFFAOYSA-N	1	1	309.341	1.831	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000346244098	409871378	/nfs/dbraw/zinc/87/13/78/409871378.db2.gz	UNHIFFSBEGBRHS-CKYFFXLPSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000346244098	409871383	/nfs/dbraw/zinc/87/13/83/409871383.db2.gz	UNHIFFSBEGBRHS-CKYFFXLPSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000346244098	409871387	/nfs/dbraw/zinc/87/13/87/409871387.db2.gz	UNHIFFSBEGBRHS-CKYFFXLPSA-N	1	1	321.381	1.429	20	5		DDBDMO
C[C@@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)CS(C)(=O)=O	ZINC000338370279	409943569	/nfs/dbraw/zinc/94/35/69/409943569.db2.gz	ALWKKVDTFJSGNS-LBPRGKRZSA-N	1	1	314.407	1.750	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)CS(C)(=O)=O	ZINC000338370279	409943574	/nfs/dbraw/zinc/94/35/74/409943574.db2.gz	ALWKKVDTFJSGNS-LBPRGKRZSA-N	1	1	314.407	1.750	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000332250901	410015906	/nfs/dbraw/zinc/01/59/06/410015906.db2.gz	RFKGCWRACCZWPO-SNVBAGLBSA-N	1	1	317.349	1.429	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000332250901	410015911	/nfs/dbraw/zinc/01/59/11/410015911.db2.gz	RFKGCWRACCZWPO-SNVBAGLBSA-N	1	1	317.349	1.429	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000351826459	410267262	/nfs/dbraw/zinc/26/72/62/410267262.db2.gz	KBFVHADWRBKBPM-YGRLFVJLSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[N@@H+](C)CC1	ZINC000298628178	410321132	/nfs/dbraw/zinc/32/11/32/410321132.db2.gz	GUCYLDYTFBQEOG-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000351934580	410350766	/nfs/dbraw/zinc/35/07/66/410350766.db2.gz	IMWYPIVTIAYWBR-HZMBPMFUSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2cccnc2)c1	ZINC000346999098	410298829	/nfs/dbraw/zinc/29/88/29/410298829.db2.gz	PCXYUSDBCOKDFI-CABCVRRESA-N	1	1	317.349	1.384	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000347256273	410424924	/nfs/dbraw/zinc/42/49/24/410424924.db2.gz	IREHYABOFAFXTO-UHFFFAOYSA-N	1	1	314.317	1.170	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000299079980	410511687	/nfs/dbraw/zinc/51/16/87/410511687.db2.gz	HAPSXFFRIPEXDP-QWRGUYRKSA-N	1	1	321.381	1.621	20	5		DDBDMO
COc1c(C(=O)NCCn2cc[nH+]c2C)cccc1[N+](=O)[O-]	ZINC000355451759	410524298	/nfs/dbraw/zinc/52/42/98/410524298.db2.gz	BYIMDDDESFPDMB-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H](C)O	ZINC000352232547	410564684	/nfs/dbraw/zinc/56/46/84/410564684.db2.gz	VMQDASVPSBRZRL-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H](C)O	ZINC000352232547	410564690	/nfs/dbraw/zinc/56/46/90/410564690.db2.gz	VMQDASVPSBRZRL-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1ncnc2cccc([N+](=O)[O-])c21	ZINC000347438914	410545837	/nfs/dbraw/zinc/54/58/37/410545837.db2.gz	WXJXEDILFBPVLY-NSHDSACASA-N	1	1	301.350	2.434	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CCC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000343596266	410561358	/nfs/dbraw/zinc/56/13/58/410561358.db2.gz	GVJTXWZAQRMWTG-JQWIXIFHSA-N	1	1	306.366	1.849	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NCCC[NH+]1CCOCC1	ZINC000301093595	410656273	/nfs/dbraw/zinc/65/62/73/410656273.db2.gz	NWOSZGZGFNRGFU-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](C[C@H](O)Cc1ccccc1)CC2	ZINC000347785900	410720983	/nfs/dbraw/zinc/72/09/83/410720983.db2.gz	OPUQIAHYIIIXBC-MRXNPFEDSA-N	1	1	313.357	1.952	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C[C@H](O)Cc1ccccc1)CC2	ZINC000347785900	410720988	/nfs/dbraw/zinc/72/09/88/410720988.db2.gz	OPUQIAHYIIIXBC-MRXNPFEDSA-N	1	1	313.357	1.952	20	5		DDBDMO
Cc1nc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)ccc1[N+](=O)[O-]	ZINC000301646819	410764082	/nfs/dbraw/zinc/76/40/82/410764082.db2.gz	IDUCGJGORMAGMD-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCNC2=O)cccc1[N+](=O)[O-]	ZINC000340224262	410770298	/nfs/dbraw/zinc/77/02/98/410770298.db2.gz	ZCBLSISZOAKEQP-CYBMUJFWSA-N	1	1	320.349	1.052	20	5		DDBDMO
C[C@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1	ZINC000330560760	410778313	/nfs/dbraw/zinc/77/83/13/410778313.db2.gz	HVPLTSJTTGJUNV-GHMZBOCLSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000330586576	410802281	/nfs/dbraw/zinc/80/22/81/410802281.db2.gz	LSOFUORHDRJYCT-QWHCGFSZSA-N	1	1	320.393	1.582	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[N@H+](C)CC1	ZINC000340309529	410845762	/nfs/dbraw/zinc/84/57/62/410845762.db2.gz	PEHHDWIRJQPZJY-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCCC[C@H]1C	ZINC000356149518	410864247	/nfs/dbraw/zinc/86/42/47/410864247.db2.gz	HCCQAEIFKJKYQX-MNOVXSKESA-N	1	1	309.370	1.321	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000353236582	410870901	/nfs/dbraw/zinc/87/09/01/410870901.db2.gz	SWFCGUJCGKVMOR-BXUZGUMPSA-N	1	1	307.350	1.667	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(O)CCC1	ZINC000353487952	411024895	/nfs/dbraw/zinc/02/48/95/411024895.db2.gz	FSBMPGLSQPDEQW-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(O)CCC1	ZINC000353487952	411024903	/nfs/dbraw/zinc/02/49/03/411024903.db2.gz	FSBMPGLSQPDEQW-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccccc1CC[N@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000295605248	225037870	/nfs/dbraw/zinc/03/78/70/225037870.db2.gz	CQTCVBIBTKZOES-INIZCTEOSA-N	1	1	318.377	1.635	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1CCOc1ccccc1[N+](=O)[O-]	ZINC000419334997	226122184	/nfs/dbraw/zinc/12/21/84/226122184.db2.gz	VYAZMLAXPPUEJS-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C([C@H]1C[C@@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461923	418431877	/nfs/dbraw/zinc/43/18/77/418431877.db2.gz	SIWSWKUMUOWVGP-FZKCQIBNSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461923	418431880	/nfs/dbraw/zinc/43/18/80/418431880.db2.gz	SIWSWKUMUOWVGP-FZKCQIBNSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461923	418431883	/nfs/dbraw/zinc/43/18/83/418431883.db2.gz	SIWSWKUMUOWVGP-FZKCQIBNSA-N	1	1	315.373	1.242	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])s2)[C@@H]1c1cccnc1	ZINC000367157907	418565640	/nfs/dbraw/zinc/56/56/40/418565640.db2.gz	GAKWQVOPMXQYJA-AAEUAGOBSA-N	1	1	319.390	2.551	20	5		DDBDMO
CNc1c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000361172488	418597873	/nfs/dbraw/zinc/59/78/73/418597873.db2.gz	TVIAVRHVJCOFNO-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000375102105	418606112	/nfs/dbraw/zinc/60/61/12/418606112.db2.gz	SAUZYTYIJFLUSV-LLVKDONJSA-N	1	1	320.349	1.314	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H]1c1cc[nH]n1	ZINC000367559643	418610422	/nfs/dbraw/zinc/61/04/22/418610422.db2.gz	OCFRMXDERPVTSW-ZDUSSCGKSA-N	1	1	303.322	1.317	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1cc[nH]n1	ZINC000367559643	418610423	/nfs/dbraw/zinc/61/04/23/418610423.db2.gz	OCFRMXDERPVTSW-ZDUSSCGKSA-N	1	1	303.322	1.317	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CNc1cc[nH+]c(N2CCOCC2)n1	ZINC000352386523	418644637	/nfs/dbraw/zinc/64/46/37/418644637.db2.gz	ZXGQGBKIUDHVST-UHFFFAOYSA-N	1	1	315.333	1.834	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000361422319	418650727	/nfs/dbraw/zinc/65/07/27/418650727.db2.gz	ZRYGHMCAZPLXEI-CYBMUJFWSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@H]([NH2+]Cc2ccccc2)C1	ZINC000361342568	418629983	/nfs/dbraw/zinc/62/99/83/418629983.db2.gz	NLRPSRQTIDVRPF-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](n3cccn3)C2)c1	ZINC000368269709	418712596	/nfs/dbraw/zinc/71/25/96/418712596.db2.gz	NADPGSWZQSMRDC-CABCVRRESA-N	1	1	302.334	1.772	20	5		DDBDMO
COc1cc(C[N@@H+](CCO)[C@@H]2CCO[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000361585428	418686388	/nfs/dbraw/zinc/68/63/88/418686388.db2.gz	IIPOHVDRKVSNAG-DGCLKSJQSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000361593756	418689219	/nfs/dbraw/zinc/68/92/19/418689219.db2.gz	HICVYHGTKJRNPY-UONOGXRCSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@]1(CO)CCOC1	ZINC000411511615	418910516	/nfs/dbraw/zinc/91/05/16/418910516.db2.gz	ZDUDCGUBPACXBA-OAHLLOKOSA-N	1	1	323.349	1.007	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2CC[NH2+][C@H]2C1	ZINC000372871600	418910843	/nfs/dbraw/zinc/91/08/43/418910843.db2.gz	QSCUGXZZQZQJPX-ZANVPECISA-N	1	1	315.333	1.295	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000372973151	418917850	/nfs/dbraw/zinc/91/78/50/418917850.db2.gz	JCTIBSAUMWBMQP-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21	ZINC000425061556	228358174	/nfs/dbraw/zinc/35/81/74/228358174.db2.gz	ZNYYTPDDWHRUFS-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
COC(=O)[C@H]1CN(CCc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)C1	ZINC000411915056	419481763	/nfs/dbraw/zinc/48/17/63/419481763.db2.gz	YJTQYRONLQBYSL-CQSZACIVSA-N	1	1	321.377	1.174	20	5		DDBDMO
COC(=O)[C@@H]1CN(C)CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000411915056	419481766	/nfs/dbraw/zinc/48/17/66/419481766.db2.gz	YJTQYRONLQBYSL-CQSZACIVSA-N	1	1	321.377	1.174	20	5		DDBDMO
COC(=O)[C@@H]1CN(C)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000411915056	419481775	/nfs/dbraw/zinc/48/17/75/419481775.db2.gz	YJTQYRONLQBYSL-CQSZACIVSA-N	1	1	321.377	1.174	20	5		DDBDMO
CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[N@H+]1C	ZINC000420993823	419430422	/nfs/dbraw/zinc/43/04/22/419430422.db2.gz	BIGIXAQKSWVWIJ-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420993823	419430430	/nfs/dbraw/zinc/43/04/30/419430430.db2.gz	BIGIXAQKSWVWIJ-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420993823	419430434	/nfs/dbraw/zinc/43/04/34/419430434.db2.gz	BIGIXAQKSWVWIJ-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)N(C)C)C1	ZINC000411961882	419521645	/nfs/dbraw/zinc/52/16/45/419521645.db2.gz	YLYPPLNVIYSGTJ-LBPRGKRZSA-N	1	1	321.377	1.904	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](CO)[C@@H]1C	ZINC000412067524	419614268	/nfs/dbraw/zinc/61/42/68/419614268.db2.gz	DTNIRYVEFAANPZ-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](CO)[C@@H]1C	ZINC000412067524	419614276	/nfs/dbraw/zinc/61/42/76/419614276.db2.gz	DTNIRYVEFAANPZ-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC(F)(F)C[NH3+]	ZINC000423544466	420078660	/nfs/dbraw/zinc/07/86/60/420078660.db2.gz	OGEXUYQVCZKBSR-UHFFFAOYSA-N	1	1	301.293	1.844	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C(N)=O)CC[C@H]1C	ZINC000430226210	420092940	/nfs/dbraw/zinc/09/29/40/420092940.db2.gz	MSQGDHJVRYWODF-ZYHUDNBSSA-N	1	1	307.350	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)CN	ZINC000420298272	420189018	/nfs/dbraw/zinc/18/90/18/420189018.db2.gz	ZUTYWVCRLGHROK-SNVBAGLBSA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)CN	ZINC000420298272	420189022	/nfs/dbraw/zinc/18/90/22/420189022.db2.gz	ZUTYWVCRLGHROK-SNVBAGLBSA-N	1	1	310.354	1.211	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000430922427	420205740	/nfs/dbraw/zinc/20/57/40/420205740.db2.gz	AGVAOLMMIBAMFG-NEPJUHHUSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(C[NH3+])CC1	ZINC000430606784	420156093	/nfs/dbraw/zinc/15/60/93/420156093.db2.gz	WKNUSTXGPUXZOS-LLVKDONJSA-N	1	1	306.366	1.593	20	5		DDBDMO
CN(C)C[C@@H](O)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000433124557	420247129	/nfs/dbraw/zinc/24/71/29/420247129.db2.gz	DFUFHWRUKBKWQV-SWLSCSKDSA-N	1	1	307.394	1.829	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000433775381	420254344	/nfs/dbraw/zinc/25/43/44/420254344.db2.gz	QUPDZYUWPHOVHM-LLVKDONJSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000433775381	420254346	/nfs/dbraw/zinc/25/43/46/420254346.db2.gz	QUPDZYUWPHOVHM-LLVKDONJSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000433775381	420254350	/nfs/dbraw/zinc/25/43/50/420254350.db2.gz	QUPDZYUWPHOVHM-LLVKDONJSA-N	1	1	321.381	1.750	20	5		DDBDMO
CCc1ccccc1[C@H]([NH3+])CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000423938219	420276395	/nfs/dbraw/zinc/27/63/95/420276395.db2.gz	ISSIYEGDTGPRBE-LLVKDONJSA-N	1	1	303.322	1.310	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CCn2cc[nH+]c2C1	ZINC000420614222	420332288	/nfs/dbraw/zinc/33/22/88/420332288.db2.gz	WKGNUKXTMAWMAZ-SECBINFHSA-N	1	1	301.306	1.317	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000492718832	420640619	/nfs/dbraw/zinc/64/06/19/420640619.db2.gz	LUKSVFFKQPLLRU-FMFIFOJESA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000492718832	420640621	/nfs/dbraw/zinc/64/06/21/420640621.db2.gz	LUKSVFFKQPLLRU-FMFIFOJESA-N	1	1	319.361	1.133	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000455098671	420969047	/nfs/dbraw/zinc/96/90/47/420969047.db2.gz	JZVRXYPPLROUCC-LLVKDONJSA-N	1	1	319.365	1.342	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000455098671	420969049	/nfs/dbraw/zinc/96/90/49/420969049.db2.gz	JZVRXYPPLROUCC-LLVKDONJSA-N	1	1	319.365	1.342	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1	ZINC000493715816	420922354	/nfs/dbraw/zinc/92/23/54/420922354.db2.gz	BLJBJPPVTQTAMZ-QZDDGCDVSA-N	1	1	307.325	1.768	20	5		DDBDMO
O=c1cc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)occ1O	ZINC000488778355	421117522	/nfs/dbraw/zinc/11/75/22/421117522.db2.gz	DGBAYSKHDNZYBG-UHFFFAOYSA-N	1	1	320.305	1.287	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000527054189	421351765	/nfs/dbraw/zinc/35/17/65/421351765.db2.gz	SXVPUPNMLABNJI-LLVKDONJSA-N	1	1	305.334	1.136	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC1	ZINC000574433167	422106383	/nfs/dbraw/zinc/10/63/83/422106383.db2.gz	MBRDMNKVUCYQDG-UHFFFAOYSA-N	1	1	304.310	1.300	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H](C)[NH+]1CC(C)C1	ZINC000581833176	422052397	/nfs/dbraw/zinc/05/23/97/422052397.db2.gz	FLJCBMUXOPSOQF-NSHDSACASA-N	1	1	307.350	1.560	20	5		DDBDMO
CNc1nccc(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597923240	422392452	/nfs/dbraw/zinc/39/24/52/422392452.db2.gz	NLLFVHQDVNARIQ-SNVBAGLBSA-N	1	1	321.381	1.634	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(N)=O	ZINC000342073314	271291747	/nfs/dbraw/zinc/29/17/47/271291747.db2.gz	OXQASRQCAZNFQS-LBPRGKRZSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(N)=O	ZINC000342073314	271291749	/nfs/dbraw/zinc/29/17/49/271291749.db2.gz	OXQASRQCAZNFQS-LBPRGKRZSA-N	1	1	317.349	1.340	20	5		DDBDMO
CSCC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000342316406	271373365	/nfs/dbraw/zinc/37/33/65/271373365.db2.gz	WKKWKYGIILQALP-SNVBAGLBSA-N	1	1	317.436	1.956	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])nc1	ZINC000344444382	272028153	/nfs/dbraw/zinc/02/81/53/272028153.db2.gz	YAEIFGITPZMRMW-ZDUSSCGKSA-N	1	1	321.381	1.344	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C	ZINC000345883203	272356716	/nfs/dbraw/zinc/35/67/16/272356716.db2.gz	YUHOHHCHOJRLKI-NEPJUHHUSA-N	1	1	323.397	1.479	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000346636822	272505353	/nfs/dbraw/zinc/50/53/53/272505353.db2.gz	HYRLTIBECBWALE-RYUDHWBXSA-N	1	1	308.334	1.857	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2C)C[C@@H]1C	ZINC000301776639	274035617	/nfs/dbraw/zinc/03/56/17/274035617.db2.gz	OOBINKIYQHFMOC-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000190856888	274267019	/nfs/dbraw/zinc/26/70/19/274267019.db2.gz	LQDZHFBZMBREHV-VHSXEESVSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000302451479	274364661	/nfs/dbraw/zinc/36/46/61/274364661.db2.gz	SDOGDQRANUIJSO-SNVBAGLBSA-N	1	1	310.310	1.006	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302451479	274364662	/nfs/dbraw/zinc/36/46/62/274364662.db2.gz	SDOGDQRANUIJSO-SNVBAGLBSA-N	1	1	310.310	1.006	20	5		DDBDMO
CC[N@@H+](C)Cc1cccc(CNC(=O)c2[nH]ncc2[N+](=O)[O-])c1	ZINC000138131885	276075970	/nfs/dbraw/zinc/07/59/70/276075970.db2.gz	XYGPGFJEPABQFB-UHFFFAOYSA-N	1	1	317.349	1.700	20	5		DDBDMO
CC[N@H+](C)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1	ZINC000138131885	276075971	/nfs/dbraw/zinc/07/59/71/276075971.db2.gz	XYGPGFJEPABQFB-UHFFFAOYSA-N	1	1	317.349	1.700	20	5		DDBDMO
CC[N@@H+](C)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1	ZINC000138131885	276075972	/nfs/dbraw/zinc/07/59/72/276075972.db2.gz	XYGPGFJEPABQFB-UHFFFAOYSA-N	1	1	317.349	1.700	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000123968189	281181517	/nfs/dbraw/zinc/18/15/17/281181517.db2.gz	CGFLHCXKGLMGIW-PHIMTYICSA-N	1	1	313.379	1.274	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331294209	295286734	/nfs/dbraw/zinc/28/67/34/295286734.db2.gz	RHWFVLWIWJQEKD-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331294209	295286735	/nfs/dbraw/zinc/28/67/35/295286735.db2.gz	RHWFVLWIWJQEKD-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCO[C@@H](C2CC2)C1	ZINC000362577746	300100780	/nfs/dbraw/zinc/10/07/80/300100780.db2.gz	QKJFGHDHQJHFNO-XJKSGUPXSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@@H](C2CC2)C1	ZINC000362577746	300100783	/nfs/dbraw/zinc/10/07/83/300100783.db2.gz	QKJFGHDHQJHFNO-XJKSGUPXSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2[nH+]ccn21	ZINC000368012830	300932940	/nfs/dbraw/zinc/93/29/40/300932940.db2.gz	XZEUSHFYXNFJIZ-CYBMUJFWSA-N	1	1	300.318	1.985	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)O1	ZINC000369039598	301123592	/nfs/dbraw/zinc/12/35/92/301123592.db2.gz	BLTRNTURLNIXKU-HNNXBMFYSA-N	1	1	321.333	1.548	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)O1	ZINC000369039598	301123594	/nfs/dbraw/zinc/12/35/94/301123594.db2.gz	BLTRNTURLNIXKU-HNNXBMFYSA-N	1	1	321.333	1.548	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC2(CCOCC2)O1	ZINC000369292590	301158453	/nfs/dbraw/zinc/15/84/53/301158453.db2.gz	GDLIVUHXJUAXHD-LBPRGKRZSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000369535739	301195725	/nfs/dbraw/zinc/19/57/25/301195725.db2.gz	CDAZQCPDSRIJDA-DZGCQCFKSA-N	1	1	324.381	1.451	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCOC2)O1	ZINC000369546955	301196450	/nfs/dbraw/zinc/19/64/50/301196450.db2.gz	RCXPJEHGLQOKPW-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2Cn2cccn2)c1	ZINC000369996422	301254658	/nfs/dbraw/zinc/25/46/58/301254658.db2.gz	LWPDTHMDDJCBQP-ZDUSSCGKSA-N	1	1	304.354	1.543	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000377058243	302138641	/nfs/dbraw/zinc/13/86/41/302138641.db2.gz	VKAYDHXURRATFT-QWRGUYRKSA-N	1	1	306.322	1.052	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000377567105	302193838	/nfs/dbraw/zinc/19/38/38/302193838.db2.gz	YFYGBXXBKJBZNV-GFCCVEGCSA-N	1	1	313.304	1.593	20	5		DDBDMO
C[C@H]1COCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000378286040	302308426	/nfs/dbraw/zinc/30/84/26/302308426.db2.gz	JDUYRTKVUSPYRD-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000536609379	303365724	/nfs/dbraw/zinc/36/57/24/303365724.db2.gz	ACOKVILHAYUQHL-AWEZNQCLSA-N	1	1	319.409	1.596	20	5		DDBDMO
CCOC(=O)CCC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000373587931	307190856	/nfs/dbraw/zinc/19/08/56/307190856.db2.gz	ZLPALCRXDDSVGM-GFCCVEGCSA-N	1	1	310.354	1.772	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C[C@@H]21	ZINC000375047434	307217918	/nfs/dbraw/zinc/21/79/18/307217918.db2.gz	DDQQTRDWIAFFNO-MNOVXSKESA-N	1	1	302.338	1.168	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]12	ZINC000377632358	307275002	/nfs/dbraw/zinc/27/50/02/307275002.db2.gz	UWTUBQCEGDRUMB-MNOVXSKESA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]12	ZINC000377632358	307275003	/nfs/dbraw/zinc/27/50/03/307275003.db2.gz	UWTUBQCEGDRUMB-MNOVXSKESA-N	1	1	309.753	1.816	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)C[C@H]1CCn2ccnc2C1	ZINC000377642081	307275402	/nfs/dbraw/zinc/27/54/02/307275402.db2.gz	ATLWESPPBDKBTQ-NSHDSACASA-N	1	1	304.354	1.219	20	5		DDBDMO
Cc1ocnc1C[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000571158755	308191492	/nfs/dbraw/zinc/19/14/92/308191492.db2.gz	VIQWTQVTIACHAT-GFCCVEGCSA-N	1	1	307.306	1.421	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000332548289	533853580	/nfs/dbraw/zinc/85/35/80/533853580.db2.gz	HVZIYQGBHGPJMT-CQSZACIVSA-N	1	1	318.377	1.893	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000332548288	533854747	/nfs/dbraw/zinc/85/47/47/533854747.db2.gz	HVZIYQGBHGPJMT-AWEZNQCLSA-N	1	1	318.377	1.893	20	5		DDBDMO
C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1C	ZINC000330786547	534306092	/nfs/dbraw/zinc/30/60/92/534306092.db2.gz	NLNSTOAMWAYRSX-TXEJJXNPSA-N	1	1	307.350	1.525	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000490289085	527828794	/nfs/dbraw/zinc/82/87/94/527828794.db2.gz	FSYKPJDFVVCBPH-OAHLLOKOSA-N	1	1	305.378	1.936	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000459587096	528036253	/nfs/dbraw/zinc/03/62/53/528036253.db2.gz	LDQZXFSQBZWNPB-UHFFFAOYSA-N	1	1	322.365	1.346	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000736452624	598772464	/nfs/dbraw/zinc/77/24/64/598772464.db2.gz	GKVZNDWATVHLCT-UHFFFAOYSA-N	1	1	319.369	1.919	20	5		DDBDMO
COCCCOCC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000091026037	696584239	/nfs/dbraw/zinc/58/42/39/696584239.db2.gz	ZJLWRUDZWRETBP-UHFFFAOYSA-N	1	1	322.365	1.887	20	5		DDBDMO
COCCCOCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000091026037	696584241	/nfs/dbraw/zinc/58/42/41/696584241.db2.gz	ZJLWRUDZWRETBP-UHFFFAOYSA-N	1	1	322.365	1.887	20	5		DDBDMO
C[C@@H](C(=O)OCCn1ccc([N+](=O)[O-])n1)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000748128460	700101343	/nfs/dbraw/zinc/10/13/43/700101343.db2.gz	IOIDTXMQJKHSHP-TUAOUCFPSA-N	1	1	310.354	1.596	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@@H+]1C	ZINC000748348819	700112056	/nfs/dbraw/zinc/11/20/56/700112056.db2.gz	LDKMWCOOFJHLGA-GFCCVEGCSA-N	1	1	316.361	1.712	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000748348819	700112057	/nfs/dbraw/zinc/11/20/57/700112057.db2.gz	LDKMWCOOFJHLGA-GFCCVEGCSA-N	1	1	316.361	1.712	20	5		DDBDMO
CC(C)=CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278418	697081570	/nfs/dbraw/zinc/08/15/70/697081570.db2.gz	BPDSNFYETSSAHV-SRABZTEZSA-N	1	1	321.421	1.788	20	5		DDBDMO
CC(C)=CC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278418	697081572	/nfs/dbraw/zinc/08/15/72/697081572.db2.gz	BPDSNFYETSSAHV-SRABZTEZSA-N	1	1	321.421	1.788	20	5		DDBDMO
CC(C)=CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278418	697081573	/nfs/dbraw/zinc/08/15/73/697081573.db2.gz	BPDSNFYETSSAHV-SRABZTEZSA-N	1	1	321.421	1.788	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]CC2CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983658250	697287131	/nfs/dbraw/zinc/28/71/31/697287131.db2.gz	VORSELFVCNWZJI-KBUPBQIOSA-N	1	1	309.410	1.716	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CC[C@@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000749413539	700163220	/nfs/dbraw/zinc/16/32/20/700163220.db2.gz	MIANDDXFRXGKTM-SNVBAGLBSA-N	1	1	306.366	1.557	20	5		DDBDMO
CC(=O)N1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000776605598	698125920	/nfs/dbraw/zinc/12/59/20/698125920.db2.gz	NLYPSMPRGUUGEA-HNNXBMFYSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC(=O)N1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000776605598	698125923	/nfs/dbraw/zinc/12/59/23/698125923.db2.gz	NLYPSMPRGUUGEA-HNNXBMFYSA-N	1	1	321.377	1.571	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)OCCC[NH+]1CCOCC1	ZINC000778146144	698245255	/nfs/dbraw/zinc/24/52/55/698245255.db2.gz	RWNVOTYINZMXTF-UHFFFAOYSA-N	1	1	309.322	1.056	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)OCCCCn1cc[nH+]c1C	ZINC000778787166	698368802	/nfs/dbraw/zinc/36/88/02/698368802.db2.gz	CZEDDTFTUILKKE-UHFFFAOYSA-N	1	1	321.337	1.628	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](c3ccnn3C)C2)cc1[N+](=O)[O-]	ZINC000800860975	700250290	/nfs/dbraw/zinc/25/02/90/700250290.db2.gz	ZQMUQDIUVBNNEN-GFCCVEGCSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](c3ccnn3C)C2)cc1[N+](=O)[O-]	ZINC000800860975	700250292	/nfs/dbraw/zinc/25/02/92/700250292.db2.gz	ZQMUQDIUVBNNEN-GFCCVEGCSA-N	1	1	304.354	1.670	20	5		DDBDMO
O=C1[C@H]([N@H+]2C[C@@H]3C[C@]3(CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000782613390	698750615	/nfs/dbraw/zinc/75/06/15/698750615.db2.gz	HXIGCXXQUOJDKO-SGIREYDYSA-N	1	1	317.345	1.014	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@@H]1C	ZINC000787237362	699198683	/nfs/dbraw/zinc/19/86/83/699198683.db2.gz	FTZVOTUFUCVZTN-MFKMUULPSA-N	1	1	318.333	1.785	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@@H+]1C	ZINC000742200596	699866755	/nfs/dbraw/zinc/86/67/55/699866755.db2.gz	ZLJSMXICGUYTES-LLVKDONJSA-N	1	1	306.366	1.437	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000742200596	699866758	/nfs/dbraw/zinc/86/67/58/699866758.db2.gz	ZLJSMXICGUYTES-LLVKDONJSA-N	1	1	306.366	1.437	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758285996	700696682	/nfs/dbraw/zinc/69/66/82/700696682.db2.gz	RBFCQABBVYGADP-GHMZBOCLSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758285996	700696686	/nfs/dbraw/zinc/69/66/86/700696686.db2.gz	RBFCQABBVYGADP-GHMZBOCLSA-N	1	1	309.341	2.000	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000765937659	701030378	/nfs/dbraw/zinc/03/03/78/701030378.db2.gz	UQMWLHGUCHJVET-WDEREUQCSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000765937656	701030413	/nfs/dbraw/zinc/03/04/13/701030413.db2.gz	UQMWLHGUCHJVET-GHMZBOCLSA-N	1	1	306.366	1.732	20	5		DDBDMO
COC(=O)[C@@]1(C)CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839665960	701772301	/nfs/dbraw/zinc/77/23/01/701772301.db2.gz	JJUMYRBMWKJWQP-HOCLYGCPSA-N	1	1	322.361	1.903	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879363377	706661848	/nfs/dbraw/zinc/66/18/48/706661848.db2.gz	SEFUTVWMMWMWCL-SMDDNHRTSA-N	1	1	314.769	1.813	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879363377	706661849	/nfs/dbraw/zinc/66/18/49/706661849.db2.gz	SEFUTVWMMWMWCL-SMDDNHRTSA-N	1	1	314.769	1.813	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000842046557	702663159	/nfs/dbraw/zinc/66/31/59/702663159.db2.gz	DCKUMLCRSMDHSE-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000842046557	702663162	/nfs/dbraw/zinc/66/31/62/702663162.db2.gz	DCKUMLCRSMDHSE-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OC[C@@H]1CC[N@@H+](C)[C@@H]1C	ZINC000845816590	703206260	/nfs/dbraw/zinc/20/62/60/703206260.db2.gz	WKNHJBGVOFSZEL-PWSUYJOCSA-N	1	1	310.354	1.373	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000846920836	703351833	/nfs/dbraw/zinc/35/18/33/703351833.db2.gz	OHDNONXBUJAWFG-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000869786176	703853528	/nfs/dbraw/zinc/85/35/28/703853528.db2.gz	VJALKVSLCUHXSM-LBPRGKRZSA-N	1	1	307.350	1.170	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[N@H+](CC3CC3)C2)c1	ZINC000819040286	704057258	/nfs/dbraw/zinc/05/72/58/704057258.db2.gz	ZAQDOKWNMAOFQM-GDBMZVCRSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000819040286	704057263	/nfs/dbraw/zinc/05/72/63/704057263.db2.gz	ZAQDOKWNMAOFQM-GDBMZVCRSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000852495441	704062003	/nfs/dbraw/zinc/06/20/03/704062003.db2.gz	KXFFXVZGFSMXHA-YUELXQCFSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000852495720	704062232	/nfs/dbraw/zinc/06/22/32/704062232.db2.gz	MTMYJOHZMGXXQE-SNPRPXQTSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000870853591	704145390	/nfs/dbraw/zinc/14/53/90/704145390.db2.gz	UMCKNHOBRUUSNY-JRPNMDOOSA-N	1	1	307.350	1.405	20	5		DDBDMO
CN(C[C@H]1CCCCO1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870871637	704152107	/nfs/dbraw/zinc/15/21/07/704152107.db2.gz	IXGPRTFMIMCAFM-ZBFHGGJFSA-N	1	1	321.377	1.796	20	5		DDBDMO
CCN(C[C@@H]1CCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870875364	704153762	/nfs/dbraw/zinc/15/37/62/704153762.db2.gz	LUKUNUFUXKUTHQ-BLLLJJGKSA-N	1	1	321.377	1.654	20	5		DDBDMO
CN1CC(C[N@H+](C)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1	ZINC000853553953	704267281	/nfs/dbraw/zinc/26/72/81/704267281.db2.gz	WTJBWBZOSHPGOG-UHFFFAOYSA-N	1	1	315.377	1.909	20	5		DDBDMO
CN1CC(C[N@@H+](C)Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)C1	ZINC000853553953	704267283	/nfs/dbraw/zinc/26/72/83/704267283.db2.gz	WTJBWBZOSHPGOG-UHFFFAOYSA-N	1	1	315.377	1.909	20	5		DDBDMO
Cc1cccc(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000821588011	704425218	/nfs/dbraw/zinc/42/52/18/704425218.db2.gz	WOBLRBZRZGZJGG-BETUJISGSA-N	1	1	320.345	1.923	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867188237	706918687	/nfs/dbraw/zinc/91/86/87/706918687.db2.gz	WEFPIJJBOZJQGQ-GHMZBOCLSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@H](C)[NH+]1CCOCC1	ZINC000823130187	705148277	/nfs/dbraw/zinc/14/82/77/705148277.db2.gz	VRWYNQLYUVLKFJ-RYUDHWBXSA-N	1	1	301.387	1.047	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C	ZINC000824657290	705500825	/nfs/dbraw/zinc/50/08/25/705500825.db2.gz	CHQXJGJTDFBRDW-NSHDSACASA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825380312	705658394	/nfs/dbraw/zinc/65/83/94/705658394.db2.gz	YCWNKQBVMNGOGD-AWEZNQCLSA-N	1	1	318.333	1.340	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC1	ZINC000826573310	705817865	/nfs/dbraw/zinc/81/78/65/705817865.db2.gz	CPDJEHGSDHJYTB-UHFFFAOYSA-N	1	1	315.414	1.391	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826722478	705857809	/nfs/dbraw/zinc/85/78/09/705857809.db2.gz	QVTVHFREGAESHG-BXUZGUMPSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000826970468	705903017	/nfs/dbraw/zinc/90/30/17/705903017.db2.gz	MPINPKCLVFHPEF-HCKVZZMMSA-N	1	1	319.361	1.370	20	5		DDBDMO
CO[C@@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000876955680	705937123	/nfs/dbraw/zinc/93/71/23/705937123.db2.gz	AMSUYRLCFUEGOZ-GDBMZVCRSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000827290331	705969206	/nfs/dbraw/zinc/96/92/06/705969206.db2.gz	SWEQCZYCCNCYMZ-ZYHUDNBSSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2C)C1	ZINC000827328349	705976194	/nfs/dbraw/zinc/97/61/94/705976194.db2.gz	DWTPPJCEGZMBLM-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC000827363733	705985307	/nfs/dbraw/zinc/98/53/07/705985307.db2.gz	CABPIJKYHGOBSC-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000828687128	706217427	/nfs/dbraw/zinc/21/74/27/706217427.db2.gz	ZZPGKKRUOIRGEZ-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000879923222	706820600	/nfs/dbraw/zinc/82/06/00/706820600.db2.gz	CLOCPDSNWIYGID-UHFFFAOYSA-N	1	1	311.313	1.624	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000836849441	707529529	/nfs/dbraw/zinc/52/95/29/707529529.db2.gz	PWNYCWPEPGOKEF-XHDPSFHLSA-N	1	1	318.377	1.437	20	5		DDBDMO
CC(=O)c1c(NCC[N@@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000882235422	707552060	/nfs/dbraw/zinc/55/20/60/707552060.db2.gz	ORTOAHDQQWNBAW-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CC(=O)c1c(NCC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000882235422	707552065	/nfs/dbraw/zinc/55/20/65/707552065.db2.gz	ORTOAHDQQWNBAW-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000882481755	707652597	/nfs/dbraw/zinc/65/25/97/707652597.db2.gz	VDJLNOMYXMXTBE-LLVKDONJSA-N	1	1	309.391	1.897	20	5		DDBDMO
CC(C)CNC(=O)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000885937800	708666649	/nfs/dbraw/zinc/66/66/49/708666649.db2.gz	KHMXWOXPQGRVFL-UHFFFAOYSA-N	1	1	320.393	1.974	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@@H+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886027721	708684102	/nfs/dbraw/zinc/68/41/02/708684102.db2.gz	HWLMICZNDAHMHK-UHFFFAOYSA-N	1	1	315.333	1.125	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@H+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886027721	708684104	/nfs/dbraw/zinc/68/41/04/708684104.db2.gz	HWLMICZNDAHMHK-UHFFFAOYSA-N	1	1	315.333	1.125	20	5		DDBDMO
CCC1([NH+]2CCC2)CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC000899563063	709113244	/nfs/dbraw/zinc/11/32/44/709113244.db2.gz	RTPSDTVYJIQDAN-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
C[C@H](NC(=O)C[C@]1(O)CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000900267393	709512654	/nfs/dbraw/zinc/51/26/54/709512654.db2.gz	FHEOPOIWAPHJJS-BLLLJJGKSA-N	1	1	321.377	1.619	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099389	713129995	/nfs/dbraw/zinc/12/99/95/713129995.db2.gz	JTYUCHPVIXRPDE-VHSXEESVSA-N	1	1	311.363	1.497	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099389	713129996	/nfs/dbraw/zinc/12/99/96/713129996.db2.gz	JTYUCHPVIXRPDE-VHSXEESVSA-N	1	1	311.363	1.497	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640406	710835390	/nfs/dbraw/zinc/83/53/90/710835390.db2.gz	YNQFIRYNLAILAR-OCCSQVGLSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640406	710835392	/nfs/dbraw/zinc/83/53/92/710835392.db2.gz	YNQFIRYNLAILAR-OCCSQVGLSA-N	1	1	317.349	1.920	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-]	ZINC000928553729	713223432	/nfs/dbraw/zinc/22/34/32/713223432.db2.gz	DIXFWTYMYMAMMU-VIFPVBQESA-N	1	1	315.732	1.750	20	5		DDBDMO
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@@H+]1C	ZINC000928569793	713233193	/nfs/dbraw/zinc/23/31/93/713233193.db2.gz	RGLXLMCQQFYNDL-ZYHUDNBSSA-N	1	1	309.391	1.896	20	5		DDBDMO
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+]1C	ZINC000928569793	713233196	/nfs/dbraw/zinc/23/31/96/713233196.db2.gz	RGLXLMCQQFYNDL-ZYHUDNBSSA-N	1	1	309.391	1.896	20	5		DDBDMO
Nc1ccc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)nc1[N+](=O)[O-]	ZINC000895567629	711544768	/nfs/dbraw/zinc/54/47/68/711544768.db2.gz	GFEKGOCBMAVIJC-QWRGUYRKSA-N	1	1	309.395	1.564	20	5		DDBDMO
Cc1nn(C)c(N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)c1[N+](=O)[O-]	ZINC000895571572	711546099	/nfs/dbraw/zinc/54/60/99/711546099.db2.gz	JALQWJJEPPBSMG-MNOVXSKESA-N	1	1	311.411	1.628	20	5		DDBDMO
Cc1nn(C)c(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)c1[N+](=O)[O-]	ZINC000895571572	711546100	/nfs/dbraw/zinc/54/61/00/711546100.db2.gz	JALQWJJEPPBSMG-MNOVXSKESA-N	1	1	311.411	1.628	20	5		DDBDMO
C[N@@H+](CC(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000913660238	713276771	/nfs/dbraw/zinc/27/67/71/713276771.db2.gz	SAQZRWNBKYIWDX-MRXNPFEDSA-N	1	1	321.377	1.403	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000896581027	711758030	/nfs/dbraw/zinc/75/80/30/711758030.db2.gz	FUJHYOMQCJFABI-TZMCWYRMSA-N	1	1	320.393	1.267	20	5		DDBDMO
CCO[C@H](C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CN(C)C	ZINC000905581902	712085752	/nfs/dbraw/zinc/08/57/52/712085752.db2.gz	ZPCMKYYWNGWQMR-HUUCEWRRSA-N	1	1	311.382	1.185	20	5		DDBDMO
C[N@@H+](Cc1cn(Cc2cccnc2[N+](=O)[O-])nn1)C(C)(C)C	ZINC000905815271	712154293	/nfs/dbraw/zinc/15/42/93/712154293.db2.gz	KJWYIPGULJVVPK-UHFFFAOYSA-N	1	1	304.354	1.860	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC000929090339	713543772	/nfs/dbraw/zinc/54/37/72/713543772.db2.gz	BDLYBPKHKQYGKA-MFKMUULPSA-N	1	1	320.349	1.771	20	5		DDBDMO
C[C@@](CO)([NH2+]Cc1cnn(CCF)c1)c1cccc([N+](=O)[O-])c1	ZINC000922308261	714017381	/nfs/dbraw/zinc/01/73/81/714017381.db2.gz	WNHNZUXWNYOICT-HNNXBMFYSA-N	1	1	322.340	1.758	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000931207518	714036819	/nfs/dbraw/zinc/03/68/19/714036819.db2.gz	XNQPZJVTMGIDTA-CYBMUJFWSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000931207518	714036823	/nfs/dbraw/zinc/03/68/23/714036823.db2.gz	XNQPZJVTMGIDTA-CYBMUJFWSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459852	714102740	/nfs/dbraw/zinc/10/27/40/714102740.db2.gz	BEZZIGKDRYGVHU-QMTHXVAHSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459852	714102742	/nfs/dbraw/zinc/10/27/42/714102742.db2.gz	BEZZIGKDRYGVHU-QMTHXVAHSA-N	1	1	302.334	1.971	20	5		DDBDMO
CCOc1cc(NC(=O)NC[C@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000931903647	714209250	/nfs/dbraw/zinc/20/92/50/714209250.db2.gz	OYMVLNHVUGYSAL-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000932346793	714314958	/nfs/dbraw/zinc/31/49/58/714314958.db2.gz	KUWZHCYPKDBHCG-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114482	714744962	/nfs/dbraw/zinc/74/49/62/714744962.db2.gz	JCDOJVLCJOUKJX-RBSFLKMASA-N	1	1	319.361	1.809	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114482	714744965	/nfs/dbraw/zinc/74/49/65/714744965.db2.gz	JCDOJVLCJOUKJX-RBSFLKMASA-N	1	1	319.361	1.809	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000935479316	715065764	/nfs/dbraw/zinc/06/57/64/715065764.db2.gz	SQXNEUMYGXWSBY-CABCVRRESA-N	1	1	303.362	1.907	20	5		DDBDMO
COc1nc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)ccc1[N+](=O)[O-]	ZINC001164770652	721282423	/nfs/dbraw/zinc/28/24/23/721282423.db2.gz	WCWFBYODTXVCDI-UHFFFAOYSA-N	1	1	318.377	1.921	20	5		DDBDMO
O=C(Cc1cnc[nH]1)NCCC[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC001167352705	733275952	/nfs/dbraw/zinc/27/59/52/733275952.db2.gz	JSYMLYHINIALIG-UHFFFAOYSA-N	1	1	317.349	1.157	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)N2C/C=C/Cl	ZINC001039583279	735103512	/nfs/dbraw/zinc/10/35/12/735103512.db2.gz	KBWCYMQQKSOUMM-OAIRPBAWSA-N	1	1	313.785	1.469	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nnc([C@H](C)[N+](=O)[O-])n2C)[C@H](C)C1	ZINC001121389462	782487979	/nfs/dbraw/zinc/48/79/79/782487979.db2.gz	SBVMYGZGDPWITD-WOPDTQHZSA-N	1	1	310.402	1.319	20	5		DDBDMO
Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ccc([N+](=O)[O-])nc1)C2	ZINC001186895567	744462296	/nfs/dbraw/zinc/46/22/96/744462296.db2.gz	HQNFTUZJJCUTQM-NSHDSACASA-N	1	1	317.349	1.456	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)C1CCC1	ZINC001031511199	746923171	/nfs/dbraw/zinc/92/31/71/746923171.db2.gz	YECNLFHQTBURPC-UHFFFAOYSA-N	1	1	303.362	1.943	20	5		DDBDMO
Cc1cc(C)cc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001031660624	747335793	/nfs/dbraw/zinc/33/57/93/747335793.db2.gz	MTFSGZZUBNHBHD-HZPDHXFCSA-N	1	1	317.389	1.517	20	5		DDBDMO
Cc1ncc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)o1	ZINC001034644378	750626189	/nfs/dbraw/zinc/62/61/89/750626189.db2.gz	FUGXGOCQIYABMV-HBJVGIJOSA-N	1	1	322.365	1.165	20	5		DDBDMO
Cc1nc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)co1	ZINC001034644881	750627222	/nfs/dbraw/zinc/62/72/22/750627222.db2.gz	MUSATBLAPUOPHA-HBJVGIJOSA-N	1	1	322.365	1.165	20	5		DDBDMO
O=C1CC[C@H]2[C@H](CC[N@@H+]2[C@@H]2CC[C@H](C[N+](=O)[O-])C2)N1CC1CC1	ZINC001169019304	762199353	/nfs/dbraw/zinc/19/93/53/762199353.db2.gz	HOAZBEKFZLGCFT-FZKCQIBNSA-N	1	1	321.421	1.907	20	5		DDBDMO
COc1cccc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169053578	762208631	/nfs/dbraw/zinc/20/86/31/762208631.db2.gz	IZFUONYPSVFUIN-HZSPNIEDSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H](Oc3cnccn3)C2)C1	ZINC001169053887	762208729	/nfs/dbraw/zinc/20/87/29/762208729.db2.gz	JYLIBIAEYKRAEZ-MCIONIFRSA-N	1	1	306.366	1.765	20	5		DDBDMO
Cc1c(NC(=O)C[N@H+](C)[C@@H]2CCC[C@H]2O)cccc1[N+](=O)[O-]	ZINC001135484060	771530196	/nfs/dbraw/zinc/53/01/96/771530196.db2.gz	UQAUNHSRMGCYMS-ZIAGYGMSSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC001097038003	771590507	/nfs/dbraw/zinc/59/05/07/771590507.db2.gz	SWYYOUFUANEYLT-JOCQHMNTSA-N	1	1	320.393	1.994	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001136922229	772211081	/nfs/dbraw/zinc/21/10/81/772211081.db2.gz	AMYYMIPUZRVKFL-QMTHXVAHSA-N	1	1	306.366	1.589	20	5		DDBDMO
[NH3+][C@@H]1C[C@H]1NC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC001173008121	776960455	/nfs/dbraw/zinc/96/04/55/776960455.db2.gz	NCYUCUUHRJXYGK-CHWSQXEVSA-N	1	1	312.320	1.531	20	5		DDBDMO
CCN(CC)CCNC(=[NH2+])N[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173218466	777049610	/nfs/dbraw/zinc/04/96/10/777049610.db2.gz	BFGGTDHZVUVHEM-CYBMUJFWSA-N	1	1	321.425	1.982	20	5		DDBDMO
Cc1cnc(NCCN(C)C(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC001101657858	777355061	/nfs/dbraw/zinc/35/50/61/777355061.db2.gz	UQLUQNPMWKMHGZ-UHFFFAOYSA-N	1	1	323.397	1.509	20	5		DDBDMO
Cc1cnc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001178458792	779058960	/nfs/dbraw/zinc/05/89/60/779058960.db2.gz	YILJKLMEMMMNDT-CHWSQXEVSA-N	1	1	324.381	1.414	20	5		DDBDMO
Cc1ccc(F)cc1C[NH2+]C/C=C\CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268544107	840422968	/nfs/dbraw/zinc/42/29/68/840422968.db2.gz	ZHGZZWFUYQTLER-OKYAQOQYSA-N	1	1	321.352	1.561	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3cc([N+](=O)[O-])cc(Cl)[n+]3[O-])C[C@H]21	ZINC001157271042	863700893	/nfs/dbraw/zinc/70/08/93/863700893.db2.gz	HGXSPGPUIWXBTK-GXSJLCMTSA-N	1	1	312.757	1.412	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccccc1C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767857	864117635	/nfs/dbraw/zinc/11/76/35/864117635.db2.gz	YGMKUNDEXNDRKC-HZPDHXFCSA-N	1	1	317.389	1.825	20	5		DDBDMO
CSc1nc(Cl)c([N+](=O)[O-])c(N[C@@H](N)CCC[NH3+])n1	ZINC001159780356	865519393	/nfs/dbraw/zinc/51/93/93/865519393.db2.gz	YIDIZZGHUNKUKS-RXMQYKEDSA-N	1	1	306.779	1.196	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1nc(Cl)nc2ccc([N+](=O)[O-])cc21	ZINC001159786275	865522638	/nfs/dbraw/zinc/52/26/38/865522638.db2.gz	XMNOBXLZZGQKLI-SNVBAGLBSA-N	1	1	310.745	1.627	20	5		DDBDMO
C[C@@H]1CN(c2cc(N)c([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC001336650331	869074007	/nfs/dbraw/zinc/07/40/07/869074007.db2.gz	DKVRFWSGKARLRX-NSHDSACASA-N	1	1	305.382	1.883	20	5		DDBDMO
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[NH+](C)C	ZINC001336779629	869136472	/nfs/dbraw/zinc/13/64/72/869136472.db2.gz	VQNCFAMUSVNLNR-TZMCWYRMSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@H](C[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CN(C)C	ZINC001336779629	869136478	/nfs/dbraw/zinc/13/64/78/869136478.db2.gz	VQNCFAMUSVNLNR-TZMCWYRMSA-N	1	1	311.382	1.122	20	5		DDBDMO
CC(C)[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1C	ZINC001165199351	869422975	/nfs/dbraw/zinc/42/29/75/869422975.db2.gz	RAYDYMCVWBOMJD-SNVBAGLBSA-N	1	1	309.326	1.817	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ncc1NCC[C@@H]1CCC[N@@H+](C)C1	ZINC001165300483	869507585	/nfs/dbraw/zinc/50/75/85/869507585.db2.gz	PFMDDDAYBUGUDM-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c1	ZINC001337678387	869592038	/nfs/dbraw/zinc/59/20/38/869592038.db2.gz	HTXRCCITBIOMGR-IAQYHMDHSA-N	1	1	308.382	1.650	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC)C1	ZINC001339468483	870512283	/nfs/dbraw/zinc/51/22/83/870512283.db2.gz	VPCCTRLFFYPMPB-CHWSQXEVSA-N	1	1	324.429	1.804	20	5		DDBDMO
C[C@@H](c1nnc(N2CC[N@H+](C3CCC3)C[C@H](C)C2)n1C)[N+](=O)[O-]	ZINC001339670215	870619388	/nfs/dbraw/zinc/61/93/88/870619388.db2.gz	XTGJCMIDGUKNOV-RYUDHWBXSA-N	1	1	322.413	1.463	20	5		DDBDMO
C[C@@H]1COCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC001341004482	871462862	/nfs/dbraw/zinc/46/28/62/871462862.db2.gz	HHWPXGALRIUCIH-XHDPSFHLSA-N	1	1	307.350	1.264	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@@H+](C)CCO	ZINC001310687923	871645637	/nfs/dbraw/zinc/64/56/37/871645637.db2.gz	CFXGFLVJEJICMB-UHFFFAOYSA-N	1	1	310.354	1.257	20	5		DDBDMO
O=C(CC[NH+]1CCOCC1)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001318795914	872275866	/nfs/dbraw/zinc/27/58/66/872275866.db2.gz	WRHHNQNGJARDFK-UHFFFAOYSA-N	1	1	305.334	1.159	20	5		DDBDMO
COC(=O)c1ccc(CO[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001223413081	880951678	/nfs/dbraw/zinc/95/16/78/880951678.db2.gz	ILRIEJCUYIUGRM-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc2c(c1)nc(=O)[nH]c2O[C@H](C)C[N+](C)(C)C	ZINC001230206034	884375914	/nfs/dbraw/zinc/37/59/14/884375914.db2.gz	YZZJRHIWPSFGTD-SNVBAGLBSA-O	1	1	320.369	1.596	20	5		DDBDMO
OC[C@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@H]1O	ZINC001232219393	886165227	/nfs/dbraw/zinc/16/52/27/886165227.db2.gz	TZIRRFBKKKXJGR-GDBMZVCRSA-N	1	1	309.369	1.568	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])N1CC([N@@H+](C)[C@H]2CCOC2)C1	ZINC001254560871	896503088	/nfs/dbraw/zinc/50/30/88/896503088.db2.gz	YRCBPKGSOPROFU-HIFRSBDPSA-N	1	1	319.405	1.931	20	5		DDBDMO
C[C@]1(CO)CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1O	ZINC001254592066	896521418	/nfs/dbraw/zinc/52/14/18/896521418.db2.gz	ABVXNTGSQXHNHO-ARFHVFGLSA-N	1	1	306.362	1.127	20	5		DDBDMO
CCOC(=O)[C@H]1[C@@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]21	ZINC001254606470	896528413	/nfs/dbraw/zinc/52/84/13/896528413.db2.gz	GTPHTMKUKYAWHD-WCVJEAGWSA-N	1	1	316.357	1.803	20	5		DDBDMO
C[N@@H+](C1CN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)[C@H]1CCOC1	ZINC001254604609	896528815	/nfs/dbraw/zinc/52/88/15/896528815.db2.gz	WWFNXFGEJQDQEA-HOTGVXAUSA-N	1	1	317.389	1.467	20	5		DDBDMO
C[C@@H]1C[N@H+](CCc2nnc(-c3ccc([N+](=O)[O-])o3)o2)C[C@H](C)O1	ZINC001258013262	898015565	/nfs/dbraw/zinc/01/55/65/898015565.db2.gz	VFTBJYHQHSJAHQ-AOOOYVTPSA-N	1	1	322.321	1.890	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC000081792357	192324658	/nfs/dbraw/zinc/32/46/58/192324658.db2.gz	VZFRNUYBOGTUJX-GFCCVEGCSA-N	1	1	320.393	1.899	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425060097	529465904	/nfs/dbraw/zinc/46/59/04/529465904.db2.gz	UJUOQJMRRSUWFL-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425060097	529465906	/nfs/dbraw/zinc/46/59/06/529465906.db2.gz	UJUOQJMRRSUWFL-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000425060097	529465907	/nfs/dbraw/zinc/46/59/07/529465907.db2.gz	UJUOQJMRRSUWFL-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CO[C@]1(C)C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090551325	185302798	/nfs/dbraw/zinc/30/27/98/185302798.db2.gz	FCFXUGVRJZIKLR-XJKSGUPXSA-N	1	1	323.393	1.892	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000181562094	199318277	/nfs/dbraw/zinc/31/82/77/199318277.db2.gz	ZGOFVNJCMWRHLN-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985273	529801243	/nfs/dbraw/zinc/80/12/43/529801243.db2.gz	TZOSZQQBOBTPFZ-JKSUJKDBSA-N	1	1	305.378	1.628	20	5		DDBDMO
CN1CC[C@@](O)(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985273	529801245	/nfs/dbraw/zinc/80/12/45/529801245.db2.gz	TZOSZQQBOBTPFZ-JKSUJKDBSA-N	1	1	305.378	1.628	20	5		DDBDMO
CN(C)c1ccccc1C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000288998624	282300247	/nfs/dbraw/zinc/30/02/47/282300247.db2.gz	MECVVPGRVRWLOJ-UHFFFAOYSA-N	1	1	303.366	1.989	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1(CO)CCC1	ZINC000429227231	529943430	/nfs/dbraw/zinc/94/34/30/529943430.db2.gz	NWGGWHOFGCSFJQ-CYBMUJFWSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC(C)NC(=O)c1ccc(N2CC[N@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000615494249	362307255	/nfs/dbraw/zinc/30/72/55/362307255.db2.gz	IOYGRPGQPQFJOC-LBPRGKRZSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC(C)NC(=O)c1ccc(N2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000615494249	362307258	/nfs/dbraw/zinc/30/72/58/362307258.db2.gz	IOYGRPGQPQFJOC-LBPRGKRZSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC[N@@H+]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000616376529	362666707	/nfs/dbraw/zinc/66/67/07/362666707.db2.gz	UAZHNTZRGHPQCK-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
CC[N@H+]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000616376529	362666710	/nfs/dbraw/zinc/66/67/10/362666710.db2.gz	UAZHNTZRGHPQCK-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
C[NH+](C)C1(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CCCC1	ZINC000272640283	210042989	/nfs/dbraw/zinc/04/29/89/210042989.db2.gz	XKXZZKGQYJCMCB-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCc3cn[nH]c3)C2)nc1	ZINC000459386772	233152838	/nfs/dbraw/zinc/15/28/38/233152838.db2.gz	YOMQYNYVMYDKKM-LBPRGKRZSA-N	1	1	302.338	1.442	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+][C@@H]1CCC[C@H]1O)c1cccc([N+](=O)[O-])c1	ZINC000459586262	233338039	/nfs/dbraw/zinc/33/80/39/233338039.db2.gz	KSKXHYZSZBKHHP-KFWWJZLASA-N	1	1	316.361	1.921	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1nc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000287185899	219366463	/nfs/dbraw/zinc/36/64/63/219366463.db2.gz	ZTZHNFFVWLFDRG-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)CN1CC[NH+](C)CC1	ZINC000287208642	219382651	/nfs/dbraw/zinc/38/26/51/219382651.db2.gz	IGJJTNGWMJPGHO-GFCCVEGCSA-N	1	1	320.393	1.845	20	5		DDBDMO
C[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000172461532	198100444	/nfs/dbraw/zinc/10/04/44/198100444.db2.gz	WGMBSWDNGKEHGB-JTQLQIEISA-N	1	1	313.379	1.354	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000032429830	352279594	/nfs/dbraw/zinc/27/95/94/352279594.db2.gz	JTKQKUSGKNJMLF-RWMBFGLXSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000032429830	352279598	/nfs/dbraw/zinc/27/95/98/352279598.db2.gz	JTKQKUSGKNJMLF-RWMBFGLXSA-N	1	1	321.377	1.822	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000043147332	352363029	/nfs/dbraw/zinc/36/30/29/352363029.db2.gz	GCKHWEUJHSZDSI-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
O=C(NCC1([NH+]2CCSCC2)CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000044521420	352387345	/nfs/dbraw/zinc/38/73/45/352387345.db2.gz	FNIXITJXMUASFJ-VXGBXAGGSA-N	1	1	313.423	1.129	20	5		DDBDMO
O=C(CCNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000057553760	352820356	/nfs/dbraw/zinc/82/03/56/352820356.db2.gz	AUURCQFOPPDLOT-GFCCVEGCSA-N	1	1	318.377	1.750	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000173268689	198203469	/nfs/dbraw/zinc/20/34/69/198203469.db2.gz	HMWCTSGXEGCCLG-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000173268689	198203471	/nfs/dbraw/zinc/20/34/71/198203471.db2.gz	HMWCTSGXEGCCLG-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000067837656	353070287	/nfs/dbraw/zinc/07/02/87/353070287.db2.gz	SONSJJQFVUKQLN-HOTGVXAUSA-N	1	1	317.389	1.680	20	5		DDBDMO
NS(=O)(=O)C[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000074288258	353304105	/nfs/dbraw/zinc/30/41/05/353304105.db2.gz	MPGLIMQJZCPZOA-NSHDSACASA-N	1	1	313.379	1.095	20	5		DDBDMO
CCC[N@H+]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000078251325	353506803	/nfs/dbraw/zinc/50/68/03/353506803.db2.gz	UQMKEMRIIOUGJF-UHFFFAOYSA-N	1	1	306.366	1.616	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C1	ZINC000078583676	353523046	/nfs/dbraw/zinc/52/30/46/353523046.db2.gz	ZQJYWOQPFDPQLO-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
Cc1nn(C)c(N2CCC[N@H+](C3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000077990254	353500361	/nfs/dbraw/zinc/50/03/61/353500361.db2.gz	VHYHPNPZRIZJPZ-UHFFFAOYSA-N	1	1	323.397	1.328	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000126045319	354049889	/nfs/dbraw/zinc/04/98/89/354049889.db2.gz	JJJKVGCRRFHSLG-GFCCVEGCSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000145704605	354157650	/nfs/dbraw/zinc/15/76/50/354157650.db2.gz	RAUQUTIQQYZGMZ-ZIAGYGMSSA-N	1	1	323.418	1.742	20	5		DDBDMO
Cc1cccc(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000153796802	354201196	/nfs/dbraw/zinc/20/11/96/354201196.db2.gz	MTLKZMVBEPOREX-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cccc(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000153796802	354201198	/nfs/dbraw/zinc/20/11/98/354201198.db2.gz	MTLKZMVBEPOREX-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@H](CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000292896211	354452556	/nfs/dbraw/zinc/45/25/56/354452556.db2.gz	ACFNPOSTOPGWTI-ZDUSSCGKSA-N	1	1	321.377	1.652	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(C(=O)c3cc([N+](=O)[O-])c[nH]3)CC2)c1	ZINC000332398814	234911093	/nfs/dbraw/zinc/91/10/93/234911093.db2.gz	RFPAYLVXEUZIEQ-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](CC3CC3)C2)n1	ZINC000587973721	354888064	/nfs/dbraw/zinc/88/80/64/354888064.db2.gz	XVYBWTYTNUQCFN-NSHDSACASA-N	1	1	320.349	1.673	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H]2CCC[C@H]2O)c1	ZINC000589501228	354996699	/nfs/dbraw/zinc/99/66/99/354996699.db2.gz	GMMBCECPNNLSRF-IUODEOHRSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)[C@@H]2C1	ZINC000590044697	355042448	/nfs/dbraw/zinc/04/24/48/355042448.db2.gz	MFTWICXGYRRWNP-BXUZGUMPSA-N	1	1	314.345	1.852	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590044224	355042580	/nfs/dbraw/zinc/04/25/80/355042580.db2.gz	ISKOCPSNGZIHLT-OCCSQVGLSA-N	1	1	319.361	1.308	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000590045624	355043151	/nfs/dbraw/zinc/04/31/51/355043151.db2.gz	SKKDWERJXVPTKH-WHOFXGATSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC(C)(C)CO	ZINC000590655940	355138577	/nfs/dbraw/zinc/13/85/77/355138577.db2.gz	ZCTMIWALLOAVSV-UHFFFAOYSA-N	1	1	310.350	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=N[C@@H]3CC[N@@H+](CC4CC4)C3)[nH]c2c1	ZINC000590689625	355148511	/nfs/dbraw/zinc/14/85/11/355148511.db2.gz	IXDHXCACWLSAME-LLVKDONJSA-N	1	1	301.350	1.789	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c1	ZINC000591505241	355322128	/nfs/dbraw/zinc/32/21/28/355322128.db2.gz	TUHUIZSJGQFRAO-RYUDHWBXSA-N	1	1	322.361	1.832	20	5		DDBDMO
C[C@H]1CC2(C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CCOCC2	ZINC000592183076	355527682	/nfs/dbraw/zinc/52/76/82/355527682.db2.gz	QZAUSFSTTUEVCZ-JSGCOSHPSA-N	1	1	324.381	1.043	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000593064987	355784982	/nfs/dbraw/zinc/78/49/82/355784982.db2.gz	VLCKHGDNBKUVJI-UONOGXRCSA-N	1	1	323.349	1.005	20	5		DDBDMO
COCCOCC[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000593114605	355803674	/nfs/dbraw/zinc/80/36/74/355803674.db2.gz	BVWTUECLAYLSDM-UHFFFAOYSA-N	1	1	323.393	1.375	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C	ZINC000593188342	355820498	/nfs/dbraw/zinc/82/04/98/355820498.db2.gz	DHWAWRGMLVUYSP-IJLUTSLNSA-N	1	1	323.397	1.429	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593519675	355912147	/nfs/dbraw/zinc/91/21/47/355912147.db2.gz	AOBQPXFRMSGWTM-QMTHXVAHSA-N	1	1	321.352	1.875	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000593455561	355890524	/nfs/dbraw/zinc/89/05/24/355890524.db2.gz	WEWXEMXIJMKCMV-CQSZACIVSA-N	1	1	321.352	1.877	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCCC[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000594016621	356089330	/nfs/dbraw/zinc/08/93/30/356089330.db2.gz	ANVXTVLFXQWGQQ-HNNXBMFYSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1	ZINC000594056825	356101146	/nfs/dbraw/zinc/10/11/46/356101146.db2.gz	ZDMUANCVQLISCI-SNVBAGLBSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1	ZINC000594056825	356101152	/nfs/dbraw/zinc/10/11/52/356101152.db2.gz	ZDMUANCVQLISCI-SNVBAGLBSA-N	1	1	318.333	1.990	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCC(=O)N(C)C1=O	ZINC000595042999	356376125	/nfs/dbraw/zinc/37/61/25/356376125.db2.gz	DKPLGODMRPSMAR-JOYOIKCWSA-N	1	1	321.333	1.401	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595318269	356447298	/nfs/dbraw/zinc/44/72/98/356447298.db2.gz	TVDCJMJHVWDSIV-GFCCVEGCSA-N	1	1	322.365	1.726	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595318269	356447304	/nfs/dbraw/zinc/44/73/04/356447304.db2.gz	TVDCJMJHVWDSIV-GFCCVEGCSA-N	1	1	322.365	1.726	20	5		DDBDMO
Cc1noc(C[NH2+][C@H](C2CC2)[C@@]2(CO)CCCO2)c1[N+](=O)[O-]	ZINC000595504301	356521966	/nfs/dbraw/zinc/52/19/66/356521966.db2.gz	BJGSSFBCARTKRR-KGLIPLIRSA-N	1	1	311.338	1.301	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595500165	356519727	/nfs/dbraw/zinc/51/97/27/356519727.db2.gz	XMOXYHLJCQWIBE-NSHDSACASA-N	1	1	308.338	1.336	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@H](C(=O)N3CCCC3)C2)c1[N+](=O)[O-]	ZINC000595500165	356519732	/nfs/dbraw/zinc/51/97/32/356519732.db2.gz	XMOXYHLJCQWIBE-NSHDSACASA-N	1	1	308.338	1.336	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c1[N+](=O)[O-]	ZINC000595528002	356534610	/nfs/dbraw/zinc/53/46/10/356534610.db2.gz	PYZVJSDWAHZNQM-QJPTWQEYSA-N	1	1	311.338	1.253	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595756048	356637717	/nfs/dbraw/zinc/63/77/17/356637717.db2.gz	CLCKXVTXSKVLDJ-BLLLJJGKSA-N	1	1	319.361	1.689	20	5		DDBDMO
O=C(CC[N@H+]1CCC2(COC2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595834298	356670113	/nfs/dbraw/zinc/67/01/13/356670113.db2.gz	OIIKSTAHCPMVFK-UHFFFAOYSA-N	1	1	305.334	1.646	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC4(COC4)C3)n2)cc1	ZINC000595835709	356671517	/nfs/dbraw/zinc/67/15/17/356671517.db2.gz	WYVOWIUBRDKAML-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC4(COC4)C3)n2)cc1	ZINC000595835709	356671519	/nfs/dbraw/zinc/67/15/19/356671519.db2.gz	WYVOWIUBRDKAML-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829826	356668287	/nfs/dbraw/zinc/66/82/87/356668287.db2.gz	ILBFDPUHCPWWIL-RYUDHWBXSA-N	1	1	305.334	1.502	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829826	356668291	/nfs/dbraw/zinc/66/82/91/356668291.db2.gz	ILBFDPUHCPWWIL-RYUDHWBXSA-N	1	1	305.334	1.502	20	5		DDBDMO
CC12CC(C1)C[N@@H+]2CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595917365	356704118	/nfs/dbraw/zinc/70/41/18/356704118.db2.gz	YXTBXMBELXECDN-UHFFFAOYSA-N	1	1	301.346	1.968	20	5		DDBDMO
CC12CC(C1)C[N@H+]2CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595917365	356704123	/nfs/dbraw/zinc/70/41/23/356704123.db2.gz	YXTBXMBELXECDN-UHFFFAOYSA-N	1	1	301.346	1.968	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@@H]21	ZINC000596170407	356800953	/nfs/dbraw/zinc/80/09/53/356800953.db2.gz	ZLDJJQKPHSKJST-RISCZKNCSA-N	1	1	318.377	1.614	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000596309369	356853425	/nfs/dbraw/zinc/85/34/25/356853425.db2.gz	ZWZQPMFAGLRANO-JTQLQIEISA-N	1	1	321.381	1.621	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]3COC[C@H]3C1)OCCO2	ZINC000597231769	357103639	/nfs/dbraw/zinc/10/36/39/357103639.db2.gz	QPCOVUIOGUDPJM-DGCLKSJQSA-N	1	1	320.345	1.834	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC3(C2)CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000597666646	357275684	/nfs/dbraw/zinc/27/56/84/357275684.db2.gz	LHXMSXQJSQXPAX-UHFFFAOYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)(C)[N@@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000597924406	357383552	/nfs/dbraw/zinc/38/35/52/357383552.db2.gz	QTWGNTWODCRWDZ-NSHDSACASA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000597924406	357383555	/nfs/dbraw/zinc/38/35/55/357383555.db2.gz	QTWGNTWODCRWDZ-NSHDSACASA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000597925366	357385035	/nfs/dbraw/zinc/38/50/35/357385035.db2.gz	NVQHULWRXQKFFS-GFCCVEGCSA-N	1	1	321.377	1.963	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CC[N@H+](C2CCCCC2)C1	ZINC000598218487	357497299	/nfs/dbraw/zinc/49/72/99/357497299.db2.gz	GFYIFECFMIPLJL-GFCCVEGCSA-N	1	1	321.381	1.315	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])nc2C)C1	ZINC000598341378	357543878	/nfs/dbraw/zinc/54/38/78/357543878.db2.gz	ADCAFGLKQWERSU-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)[C@H]2C[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000599651376	358008334	/nfs/dbraw/zinc/00/83/34/358008334.db2.gz	GLHYKGCNFYALPO-TXEJJXNPSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[N@H+](CCN)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000600718066	358294121	/nfs/dbraw/zinc/29/41/21/358294121.db2.gz	VDFHWJWLWFKZIH-UHFFFAOYSA-N	1	1	310.354	1.213	20	5		DDBDMO
CC[N@@H+](CCN)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000600718066	358294127	/nfs/dbraw/zinc/29/41/27/358294127.db2.gz	VDFHWJWLWFKZIH-UHFFFAOYSA-N	1	1	310.354	1.213	20	5		DDBDMO
CC(C)N1CC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O	ZINC000601116909	358409600	/nfs/dbraw/zinc/40/96/00/358409600.db2.gz	RMRVVEDGQFUVLK-HNNXBMFYSA-N	1	1	314.345	1.986	20	5		DDBDMO
CC[NH+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1	ZINC000601098679	358402105	/nfs/dbraw/zinc/40/21/05/358402105.db2.gz	DGKLOSLXXOIMNP-UHFFFAOYSA-N	1	1	307.276	1.489	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280705261	215806707	/nfs/dbraw/zinc/80/67/07/215806707.db2.gz	ISWGOMXRJUYGSB-OAHLLOKOSA-N	1	1	320.349	1.039	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@@](O)(CO)C3)c2c1	ZINC000601173787	358432853	/nfs/dbraw/zinc/43/28/53/358432853.db2.gz	HJDJZZQPMNDLCJ-HNNXBMFYSA-N	1	1	303.318	1.467	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1=O	ZINC000601970793	358759251	/nfs/dbraw/zinc/75/92/51/358759251.db2.gz	QAJUUATZNRONTQ-HNNXBMFYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCCCNC(=O)C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602438512	358976888	/nfs/dbraw/zinc/97/68/88/358976888.db2.gz	FDQOPKCJKKJMSW-UHFFFAOYSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCOC(=O)CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])CC1CC1	ZINC000602450909	358984723	/nfs/dbraw/zinc/98/47/23/358984723.db2.gz	LQUYBSQNVLFXDK-UHFFFAOYSA-N	1	1	310.354	1.494	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000602669475	359115327	/nfs/dbraw/zinc/11/53/27/359115327.db2.gz	XOAODBILAHYYAQ-STQMWFEESA-N	1	1	308.382	1.967	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602687451	359125965	/nfs/dbraw/zinc/12/59/65/359125965.db2.gz	WMROOACAHWDTER-NSHDSACASA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602687451	359125969	/nfs/dbraw/zinc/12/59/69/359125969.db2.gz	WMROOACAHWDTER-NSHDSACASA-N	1	1	320.349	1.234	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000602702315	359134592	/nfs/dbraw/zinc/13/45/92/359134592.db2.gz	RNZCGOXHRKMXLB-AWEZNQCLSA-N	1	1	302.334	1.982	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](Oc3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000602702315	359134598	/nfs/dbraw/zinc/13/45/98/359134598.db2.gz	RNZCGOXHRKMXLB-AWEZNQCLSA-N	1	1	302.334	1.982	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@@H]2C1	ZINC000602796894	359198883	/nfs/dbraw/zinc/19/88/83/359198883.db2.gz	UFYWZRMHBVPWPM-MCIONIFRSA-N	1	1	324.381	1.368	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@@H]2C1	ZINC000602796894	359198886	/nfs/dbraw/zinc/19/88/86/359198886.db2.gz	UFYWZRMHBVPWPM-MCIONIFRSA-N	1	1	324.381	1.368	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CCC2(CCC[N@@H+]2C)CC1	ZINC000602801060	359201538	/nfs/dbraw/zinc/20/15/38/359201538.db2.gz	ZEVHXBSCRDZPDM-UHFFFAOYSA-N	1	1	307.398	1.660	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000602874811	359257560	/nfs/dbraw/zinc/25/75/60/359257560.db2.gz	RXDOQPQAVRNISH-TXEJJXNPSA-N	1	1	320.393	1.608	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](O)C[C@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602901551	359283461	/nfs/dbraw/zinc/28/34/61/359283461.db2.gz	ZZASTAKXRNCCNN-IUODEOHRSA-N	1	1	310.350	1.311	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000186782832	200009405	/nfs/dbraw/zinc/00/94/05/200009405.db2.gz	XOESCZNWQSUUFI-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2C[C@@H]3C[C@H]2C[N@H+]3Cc2ccccc2)nc1	ZINC000603417404	359627029	/nfs/dbraw/zinc/62/70/29/359627029.db2.gz	YVAIIMLCFCNJMH-KBPBESRZSA-N	1	1	311.345	1.848	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000609257965	360278683	/nfs/dbraw/zinc/27/86/83/360278683.db2.gz	XYBHVQZVGCUKFM-VIFPVBQESA-N	1	1	307.306	1.148	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2C)C1	ZINC000609269840	360285385	/nfs/dbraw/zinc/28/53/85/360285385.db2.gz	YDDLJIYVPZJVJP-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCOC1	ZINC000609631760	360339901	/nfs/dbraw/zinc/33/99/01/360339901.db2.gz	VPCPNGQEWWRJNU-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609584797	360329090	/nfs/dbraw/zinc/32/90/90/360329090.db2.gz	IWBWVYPYXQCXTN-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H](O)C1CC1	ZINC000610572866	360473623	/nfs/dbraw/zinc/47/36/23/360473623.db2.gz	PCWYNLYEAVHLFY-DZGCQCFKSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCOC1	ZINC000612059420	360904000	/nfs/dbraw/zinc/90/40/00/360904000.db2.gz	RSACOTZNVOHBFT-KGLIPLIRSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000193389463	201043107	/nfs/dbraw/zinc/04/31/07/201043107.db2.gz	LJCNPWNMZRQJME-CYBMUJFWSA-N	1	1	321.425	1.863	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000618875008	363781509	/nfs/dbraw/zinc/78/15/09/363781509.db2.gz	UGYXEYOVXGPKHI-PHIMTYICSA-N	1	1	305.334	1.237	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619253543	363946894	/nfs/dbraw/zinc/94/68/94/363946894.db2.gz	YTAIDAHXHDPLKB-CABCVRRESA-N	1	1	321.352	1.782	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000619450048	364017175	/nfs/dbraw/zinc/01/71/75/364017175.db2.gz	HUDLJPNBUHETGI-PHIMTYICSA-N	1	1	305.334	1.237	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+](CC)C2CC2)c1[N+](=O)[O-]	ZINC000264649479	204053850	/nfs/dbraw/zinc/05/38/50/204053850.db2.gz	DXNVZELMKTUDGG-UHFFFAOYSA-N	1	1	309.370	1.485	20	5		DDBDMO
C[C@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000288343473	220096493	/nfs/dbraw/zinc/09/64/93/220096493.db2.gz	JXMCWJSRBAIJOQ-SMDDNHRTSA-N	1	1	319.361	1.999	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000288470088	220162765	/nfs/dbraw/zinc/16/27/65/220162765.db2.gz	ORTNRKABGKNQEZ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000288470088	220162770	/nfs/dbraw/zinc/16/27/70/220162770.db2.gz	ORTNRKABGKNQEZ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1nn(C)c(C(=O)Nc2cc[nH+]c(N(C)C)c2)c1[N+](=O)[O-]	ZINC000267381289	206025139	/nfs/dbraw/zinc/02/51/39/206025139.db2.gz	ZFPUWEONPGCJSX-UHFFFAOYSA-N	1	1	304.310	1.350	20	5		DDBDMO
Cn1c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)ccc1[N+](=O)[O-]	ZINC000336944003	249294427	/nfs/dbraw/zinc/29/44/27/249294427.db2.gz	LYTHAQRJNGWFSB-NSHDSACASA-N	1	1	306.322	1.559	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000042723100	183302218	/nfs/dbraw/zinc/30/22/18/183302218.db2.gz	LKYZHXXKETWFFO-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@](F)(CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000338587152	250042728	/nfs/dbraw/zinc/04/27/28/250042728.db2.gz	IGMGFEOVSRQURM-CQSZACIVSA-N	1	1	311.313	1.330	20	5		DDBDMO
CC[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@@H](C)O	ZINC000105825353	194137516	/nfs/dbraw/zinc/13/75/16/194137516.db2.gz	ZLMUXWNHUOOKLZ-UKRRQHHQSA-N	1	1	307.394	1.872	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000340921067	251277953	/nfs/dbraw/zinc/27/79/53/251277953.db2.gz	XLEBANITEIXGNR-CMPLNLGQSA-N	1	1	321.333	1.348	20	5		DDBDMO
CCC[N@@H+](CCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000117335523	194815329	/nfs/dbraw/zinc/81/53/29/194815329.db2.gz	TVEKBXFCDNQSJE-UHFFFAOYSA-N	1	1	323.349	1.597	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1CCCc2[nH+]ccn21	ZINC000352472827	285076308	/nfs/dbraw/zinc/07/63/08/285076308.db2.gz	KQQZDCJJCYFPPH-CYBMUJFWSA-N	1	1	300.318	1.985	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCC1CCC1	ZINC000352543614	285129662	/nfs/dbraw/zinc/12/96/62/285129662.db2.gz	HGWDHEGNYNQVJR-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCC1CCC1	ZINC000352543614	285129664	/nfs/dbraw/zinc/12/96/64/285129664.db2.gz	HGWDHEGNYNQVJR-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451547223	533095542	/nfs/dbraw/zinc/09/55/42/533095542.db2.gz	KOXZQPCGCBWWTQ-CJNGLKHVSA-N	1	1	322.361	1.698	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H]1CCC[C@H]1O	ZINC000352660392	285204729	/nfs/dbraw/zinc/20/47/29/285204729.db2.gz	NUEHBPXFQUBLAS-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1[nH+]ccn1CCN1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352675266	285217015	/nfs/dbraw/zinc/21/70/15/285217015.db2.gz	FOYAEJPSPBBGFR-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
COc1cc(C[N@@H+](C)C[C@H]2CCN(C(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000352765925	285286088	/nfs/dbraw/zinc/28/60/88/285286088.db2.gz	APMYHTHAQWMQFV-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000352783387	285298422	/nfs/dbraw/zinc/29/84/22/285298422.db2.gz	XYLTUYKSUSAAAS-WDEREUQCSA-N	1	1	309.341	1.827	20	5		DDBDMO
CO[C@@H]1C[C@@H]([N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C12CCC2	ZINC000451836353	533530587	/nfs/dbraw/zinc/53/05/87/533530587.db2.gz	BMXPNAAKLHINKJ-BFHYXJOUSA-N	1	1	324.381	1.042	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[NH+](C3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000299533516	533660301	/nfs/dbraw/zinc/66/03/01/533660301.db2.gz	MNTLRGMZDHUUPX-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000452072015	533673382	/nfs/dbraw/zinc/67/33/82/533673382.db2.gz	TWVVAQHRBWQYIP-UPJWGTAASA-N	1	1	310.350	1.037	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000013693507	406865995	/nfs/dbraw/zinc/86/59/95/406865995.db2.gz	QKDKIBULJWOHNH-UHFFFAOYSA-N	1	1	315.333	1.291	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1	ZINC000037647823	406992328	/nfs/dbraw/zinc/99/23/28/406992328.db2.gz	XRGUUUNRYZGTAI-JTQLQIEISA-N	1	1	313.379	1.362	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H](C(N)=O)CC[C@H]2C)cc1[N+](=O)[O-]	ZINC000103284351	407335722	/nfs/dbraw/zinc/33/57/22/407335722.db2.gz	CYMNYYJODXLQQZ-PWSUYJOCSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000124983237	407375122	/nfs/dbraw/zinc/37/51/22/407375122.db2.gz	RYCULNAIMWTWFD-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000124983237	407375123	/nfs/dbraw/zinc/37/51/23/407375123.db2.gz	RYCULNAIMWTWFD-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000265794799	407455510	/nfs/dbraw/zinc/45/55/10/407455510.db2.gz	MYMBIOUOXNCPSH-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H](C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000266541454	407551519	/nfs/dbraw/zinc/55/15/19/407551519.db2.gz	QCHAPEJHYKOPMU-CJNGLKHVSA-N	1	1	318.377	1.888	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1O	ZINC000271347255	407647462	/nfs/dbraw/zinc/64/74/62/407647462.db2.gz	PGOWBHLFANAJPY-ZWNOBZJWSA-N	1	1	310.350	1.815	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000115435570	407680636	/nfs/dbraw/zinc/68/06/36/407680636.db2.gz	PPDZJVOHHBJMFH-GFCCVEGCSA-N	1	1	323.397	1.327	20	5		DDBDMO
CC[C@H]1CN(c2nccc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000115517105	407687779	/nfs/dbraw/zinc/68/77/79/407687779.db2.gz	PCIZZRZAIWXZTP-ZDUSSCGKSA-N	1	1	308.382	1.845	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@@H]1C	ZINC000117285214	407818294	/nfs/dbraw/zinc/81/82/94/407818294.db2.gz	ZAWLYFQZOVEYOO-LBPRGKRZSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@@H]1C	ZINC000117285214	407818299	/nfs/dbraw/zinc/81/82/99/407818299.db2.gz	ZAWLYFQZOVEYOO-LBPRGKRZSA-N	1	1	321.377	1.696	20	5		DDBDMO
CC(=O)NCCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173472825	407880808	/nfs/dbraw/zinc/88/08/08/407880808.db2.gz	WZRBFZVCFLVUER-LBPRGKRZSA-N	1	1	307.354	1.002	20	5		DDBDMO
C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCCNC1=O	ZINC000153985362	407946854	/nfs/dbraw/zinc/94/68/54/407946854.db2.gz	INPQNSPQKYHIRA-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCCNC1=O	ZINC000153985362	407946861	/nfs/dbraw/zinc/94/68/61/407946861.db2.gz	INPQNSPQKYHIRA-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1[nH]ncc1[N+](=O)[O-])C1CCCCC1	ZINC000134960433	407954385	/nfs/dbraw/zinc/95/43/85/407954385.db2.gz	RCXZDHVYKPROOM-UHFFFAOYSA-N	1	1	309.370	1.702	20	5		DDBDMO
C[N@H+](CCCNC(=O)c1n[nH]cc1[N+](=O)[O-])C1CCCCC1	ZINC000134960433	407954392	/nfs/dbraw/zinc/95/43/92/407954392.db2.gz	RCXZDHVYKPROOM-UHFFFAOYSA-N	1	1	309.370	1.702	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1n[nH]cc1[N+](=O)[O-])C1CCCCC1	ZINC000134960433	407954398	/nfs/dbraw/zinc/95/43/98/407954398.db2.gz	RCXZDHVYKPROOM-UHFFFAOYSA-N	1	1	309.370	1.702	20	5		DDBDMO
Cc1c(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000154024629	407955164	/nfs/dbraw/zinc/95/51/64/407955164.db2.gz	NSXBPFQOMKQSSA-SCRDCRAPSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1c(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000154024629	407955179	/nfs/dbraw/zinc/95/51/79/407955179.db2.gz	NSXBPFQOMKQSSA-SCRDCRAPSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000154057678	407962114	/nfs/dbraw/zinc/96/21/14/407962114.db2.gz	RJPBPZLNLBXRJR-OAHLLOKOSA-N	1	1	321.377	1.772	20	5		DDBDMO
Cn1cc([C@H]2C[NH2+]CCN2C(=O)c2csc([N+](=O)[O-])c2)cn1	ZINC000181330664	407982017	/nfs/dbraw/zinc/98/20/17/407982017.db2.gz	ZEPSXCHONSRGOP-LLVKDONJSA-N	1	1	321.362	1.177	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000180854385	407925060	/nfs/dbraw/zinc/92/50/60/407925060.db2.gz	XSNCBTBHPRGMNV-UWVGGRQHSA-N	1	1	304.350	1.532	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000268171916	407925817	/nfs/dbraw/zinc/92/58/17/407925817.db2.gz	QTWXJGVYMYZILG-QMTHXVAHSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272583422	407995079	/nfs/dbraw/zinc/99/50/79/407995079.db2.gz	SCPUYFHGWOPXRK-SNVBAGLBSA-N	1	1	313.304	1.755	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](CC(N)=O)C1	ZINC000175227488	408082380	/nfs/dbraw/zinc/08/23/80/408082380.db2.gz	YHOAXYVTQRDGGQ-NSHDSACASA-N	1	1	307.350	1.691	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](OCCO)C1	ZINC000175236182	408084757	/nfs/dbraw/zinc/08/47/57/408084757.db2.gz	OQIPSRYHPSMBEQ-HNNXBMFYSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](OCCO)C1	ZINC000175236182	408084761	/nfs/dbraw/zinc/08/47/61/408084761.db2.gz	OQIPSRYHPSMBEQ-HNNXBMFYSA-N	1	1	324.377	1.967	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[N@H+]2CCC[C@@H]2C1	ZINC000182240979	408101938	/nfs/dbraw/zinc/10/19/38/408101938.db2.gz	USQXRHZWBVNUCK-ZIAGYGMSSA-N	1	1	321.377	1.115	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC1CCOCC1	ZINC000182327765	408128783	/nfs/dbraw/zinc/12/87/83/408128783.db2.gz	BRYXPVRCDXDQOW-AWEZNQCLSA-N	1	1	324.377	1.693	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000155525965	408178015	/nfs/dbraw/zinc/17/80/15/408178015.db2.gz	SUENZZMPOSULBG-HIFRSBDPSA-N	1	1	319.361	1.695	20	5		DDBDMO
CC[N@@H+](CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-])C1CC1	ZINC000190171408	408182240	/nfs/dbraw/zinc/18/22/40/408182240.db2.gz	APONCDIHUFDLOP-UHFFFAOYSA-N	1	1	308.338	1.673	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ncc([N+](=O)[O-])cc3C(N)=O)CC[C@H]21	ZINC000268841225	408216311	/nfs/dbraw/zinc/21/63/11/408216311.db2.gz	ORDNHJNRPJQWCJ-GXFFZTMASA-N	1	1	319.365	1.009	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000269486721	408327098	/nfs/dbraw/zinc/32/70/98/408327098.db2.gz	WYYQNNQBUAIJTO-UHFFFAOYSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[NH+](C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000269486721	408327114	/nfs/dbraw/zinc/32/71/14/408327114.db2.gz	WYYQNNQBUAIJTO-UHFFFAOYSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O	ZINC000246736791	408327550	/nfs/dbraw/zinc/32/75/50/408327550.db2.gz	FXMPYNZSXRJGBW-GXTWGEPZSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1C	ZINC000269338966	408272474	/nfs/dbraw/zinc/27/24/74/408272474.db2.gz	BOFAGCIDDGIGHX-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1C	ZINC000269338966	408272478	/nfs/dbraw/zinc/27/24/78/408272478.db2.gz	BOFAGCIDDGIGHX-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
CCC[C@H]1CN(c2ncc([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000273948041	408299783	/nfs/dbraw/zinc/29/97/83/408299783.db2.gz	MKHZVNSZCZMZOZ-LBPRGKRZSA-N	1	1	309.370	1.322	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+]2CCCC[C@@H]2C1	ZINC000176833776	408454254	/nfs/dbraw/zinc/45/42/54/408454254.db2.gz	QQYIQOGNKPVBQL-GFCCVEGCSA-N	1	1	304.350	1.487	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+]2CCCC[C@@H]2C1	ZINC000176833776	408454263	/nfs/dbraw/zinc/45/42/63/408454263.db2.gz	QQYIQOGNKPVBQL-GFCCVEGCSA-N	1	1	304.350	1.487	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)ccc1O	ZINC000177050049	408505751	/nfs/dbraw/zinc/50/57/51/408505751.db2.gz	RKZGVOUSPCVLIO-UHFFFAOYSA-N	1	1	306.322	1.638	20	5		DDBDMO
C[C@@H](c1ccncc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270551594	408575195	/nfs/dbraw/zinc/57/51/95/408575195.db2.gz	BLHSPPCOVNJLTH-SMDDNHRTSA-N	1	1	305.338	1.240	20	5		DDBDMO
COC[C@@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000265211755	408580465	/nfs/dbraw/zinc/58/04/65/408580465.db2.gz	VOUIKPXEVMITEM-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)n1	ZINC000248663926	408612355	/nfs/dbraw/zinc/61/23/55/408612355.db2.gz	KHRLFCIDMYATHE-VXGBXAGGSA-N	1	1	323.397	1.661	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270761444	408670362	/nfs/dbraw/zinc/67/03/62/408670362.db2.gz	MTKAFFZOLWEBHW-GHMZBOCLSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[C@H](O)CC1	ZINC000275905569	408714821	/nfs/dbraw/zinc/71/48/21/408714821.db2.gz	SOEQNLYZTVVHCH-BPLDGKMQSA-N	1	1	324.377	1.570	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000251696820	408785855	/nfs/dbraw/zinc/78/58/55/408785855.db2.gz	IRBPJCRBIVCFJP-NEPJUHHUSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000251696820	408785857	/nfs/dbraw/zinc/78/58/57/408785857.db2.gz	IRBPJCRBIVCFJP-NEPJUHHUSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000164178076	408795561	/nfs/dbraw/zinc/79/55/61/408795561.db2.gz	GDDDNOYPMJEKNM-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000164178076	408795564	/nfs/dbraw/zinc/79/55/64/408795564.db2.gz	GDDDNOYPMJEKNM-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000164178076	408795567	/nfs/dbraw/zinc/79/55/67/408795567.db2.gz	GDDDNOYPMJEKNM-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](O)[C@@H](C)C1	ZINC000249598807	408748865	/nfs/dbraw/zinc/74/88/65/408748865.db2.gz	XQEUANFUPUBRKP-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C1CC1	ZINC000290833417	408841749	/nfs/dbraw/zinc/84/17/49/408841749.db2.gz	UXFPDBAXXIBVPH-CYBMUJFWSA-N	1	1	317.349	1.308	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2C[NH+](CC3(O)CCOCC3)C2)cc1	ZINC000276393833	408847857	/nfs/dbraw/zinc/84/78/57/408847857.db2.gz	SHEUFUQBYGNUBA-UHFFFAOYSA-N	1	1	308.334	1.199	20	5		DDBDMO
C[C@@H]1CC[NH2+][C@@H](C)[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000286095782	408922529	/nfs/dbraw/zinc/92/25/29/408922529.db2.gz	NJHBXOXQICRBMS-ZDMBXUJBSA-N	1	1	317.349	1.587	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@H+](C3CC3)CC2)ccc1[N+](=O)[O-]	ZINC000194674914	163292223	/nfs/dbraw/zinc/29/22/23/163292223.db2.gz	URQBTPAUYGHSFP-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000277721541	408999008	/nfs/dbraw/zinc/99/90/08/408999008.db2.gz	JFNYJKUPLUQVRD-KOLCDFICSA-N	1	1	322.287	1.427	20	5		DDBDMO
CC[N@@H+](CCNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-])C1CC1	ZINC000287718405	409080483	/nfs/dbraw/zinc/08/04/83/409080483.db2.gz	FSJGDHSNKPQJDU-UHFFFAOYSA-N	1	1	322.365	1.981	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000293974581	409218931	/nfs/dbraw/zinc/21/89/31/409218931.db2.gz	UYRLUIOKSDHMQK-LSDHHAIUSA-N	1	1	319.361	1.530	20	5		DDBDMO
CN(C[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000289306650	409245948	/nfs/dbraw/zinc/24/59/48/409245948.db2.gz	ATAPEEKYMCFMHU-OAHLLOKOSA-N	1	1	307.394	1.524	20	5		DDBDMO
Cc1c(C[N@H+](C)[C@H]2CCN3CCO[C@H]2C3)cccc1[N+](=O)[O-]	ZINC000295056434	409311417	/nfs/dbraw/zinc/31/14/17/409311417.db2.gz	AZFQBNRVCAZILP-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000280537995	409347494	/nfs/dbraw/zinc/34/74/94/409347494.db2.gz	PLMLNRRPYFNXOW-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000280537995	409347501	/nfs/dbraw/zinc/34/75/01/409347501.db2.gz	PLMLNRRPYFNXOW-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000285393347	409425782	/nfs/dbraw/zinc/42/57/82/409425782.db2.gz	XGDODKWQKXMXBR-KBPBESRZSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[C@H](CCC[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000313633749	164010711	/nfs/dbraw/zinc/01/07/11/164010711.db2.gz	HJXPKXZBZKJZHS-MRVPVSSYSA-N	1	1	305.331	1.140	20	5		DDBDMO
Nc1c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000317069886	164025563	/nfs/dbraw/zinc/02/55/63/164025563.db2.gz	JHEDHRGBJPQLLU-NSHDSACASA-N	1	1	304.350	1.487	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@H+]2C)n1	ZINC000319331327	164036112	/nfs/dbraw/zinc/03/61/12/164036112.db2.gz	RQRARFNGMINGKT-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000321307592	164043765	/nfs/dbraw/zinc/04/37/65/164043765.db2.gz	CRQAVIMZPOZAPU-AAEUAGOBSA-N	1	1	318.377	1.876	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000357033730	164136788	/nfs/dbraw/zinc/13/67/88/164136788.db2.gz	IAPOWWFQHOFVHW-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)CN(C)C	ZINC000344855577	409532270	/nfs/dbraw/zinc/53/22/70/409532270.db2.gz	GJJFEKCRZUZRGL-WDBUWWRISA-N	1	1	307.394	1.900	20	5		DDBDMO
C[N@@H+](CC(C)(C)O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000304737532	409641137	/nfs/dbraw/zinc/64/11/37/409641137.db2.gz	SNZZUVMELBEAEU-CYBMUJFWSA-N	1	1	307.350	1.403	20	5		DDBDMO
COc1c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000356745533	409570522	/nfs/dbraw/zinc/57/05/22/409570522.db2.gz	OJECNHLAZLKMMZ-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000354405381	409831053	/nfs/dbraw/zinc/83/10/53/409831053.db2.gz	UQPXDKDFALEWRQ-JQWIXIFHSA-N	1	1	323.397	1.582	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1	ZINC000342870933	409962177	/nfs/dbraw/zinc/96/21/77/409962177.db2.gz	BXMBYNJVOBLLNZ-JTQLQIEISA-N	1	1	302.334	1.758	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1C	ZINC000357460898	410051844	/nfs/dbraw/zinc/05/18/44/410051844.db2.gz	RRFGCWKBNDADCO-VHSXEESVSA-N	1	1	307.354	1.008	20	5		DDBDMO
CCC[C@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@H+]1CCOC	ZINC000346650303	410058916	/nfs/dbraw/zinc/05/89/16/410058916.db2.gz	GLWCVTISFIXVIT-AWEZNQCLSA-N	1	1	308.382	1.927	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000332671547	410203762	/nfs/dbraw/zinc/20/37/62/410203762.db2.gz	ZQYJLPVWNKONAF-RYUDHWBXSA-N	1	1	319.361	1.912	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000298776304	410392228	/nfs/dbraw/zinc/39/22/28/410392228.db2.gz	DCVSZQLNBCNSEK-LLVKDONJSA-N	1	1	321.333	1.418	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343441163	410453573	/nfs/dbraw/zinc/45/35/73/410453573.db2.gz	BXNVMZSQHMQHPT-RISCZKNCSA-N	1	1	307.350	1.573	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CC[NH2+]CC1(F)F	ZINC000343446740	410458634	/nfs/dbraw/zinc/45/86/34/410458634.db2.gz	BTJINMSUCSXYKB-NSHDSACASA-N	1	1	313.304	1.498	20	5		DDBDMO
Cc1cc(NC(=O)c2nn(C)cc2[N+](=O)[O-])cn2cc[nH+]c12	ZINC000355430141	410511856	/nfs/dbraw/zinc/51/18/56/410511856.db2.gz	JPVVVNXERYXBLN-UHFFFAOYSA-N	1	1	300.278	1.537	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000352187445	410534230	/nfs/dbraw/zinc/53/42/30/410534230.db2.gz	RVSQBMIKZPBOPA-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000299238407	410576157	/nfs/dbraw/zinc/57/61/57/410576157.db2.gz	VVEIUZWBABYRMX-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
CNC(=O)c1ccc(NC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000301208213	410674880	/nfs/dbraw/zinc/67/48/80/410674880.db2.gz	QSUUCKRHZVLQKG-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)Cc2cc(O)ccc2[N+](=O)[O-])[N@H+](C)C1	ZINC000330444179	410696406	/nfs/dbraw/zinc/69/64/06/410696406.db2.gz	GIDLSECHRZNAJI-JSGCOSHPSA-N	1	1	309.366	1.451	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)Cc2cc(O)ccc2[N+](=O)[O-])[N@@H+](C)C1	ZINC000330444179	410696412	/nfs/dbraw/zinc/69/64/12/410696412.db2.gz	GIDLSECHRZNAJI-JSGCOSHPSA-N	1	1	309.366	1.451	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000302451478	410842642	/nfs/dbraw/zinc/84/26/42/410842642.db2.gz	SDOGDQRANUIJSO-JTQLQIEISA-N	1	1	310.310	1.006	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302451478	410842648	/nfs/dbraw/zinc/84/26/48/410842648.db2.gz	SDOGDQRANUIJSO-JTQLQIEISA-N	1	1	310.310	1.006	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000353205191	410850172	/nfs/dbraw/zinc/85/01/72/410850172.db2.gz	OVFIVLSTNXZBLK-NSHDSACASA-N	1	1	323.349	1.860	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000302750018	410858456	/nfs/dbraw/zinc/85/84/56/410858456.db2.gz	GWKLHYSZFDCPBI-MWLCHTKSSA-N	1	1	320.349	1.814	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000344085595	410947432	/nfs/dbraw/zinc/94/74/32/410947432.db2.gz	SLPDWASCHPXQQN-GLQYFDAESA-N	1	1	319.361	1.260	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000356509436	411061646	/nfs/dbraw/zinc/06/16/46/411061646.db2.gz	FLMDJMGJDFCSGF-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000356509436	411061650	/nfs/dbraw/zinc/06/16/50/411061650.db2.gz	FLMDJMGJDFCSGF-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCCS2(=O)=O)c(F)c1	ZINC000344296286	411077094	/nfs/dbraw/zinc/07/70/94/411077094.db2.gz	BCUIWLHTZVHIGJ-GFCCVEGCSA-N	1	1	316.354	1.791	20	5		DDBDMO
Cc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010076	226003463	/nfs/dbraw/zinc/00/34/63/226003463.db2.gz	YFVAZCJARKURGQ-NWDGAFQWSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1cc(N2C[C@H](C)[N@H+](CCO)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010076	226003465	/nfs/dbraw/zinc/00/34/65/226003465.db2.gz	YFVAZCJARKURGQ-NWDGAFQWSA-N	1	1	311.357	1.934	20	5		DDBDMO
O=C([C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1)N1CCCC1	ZINC000360851937	418532625	/nfs/dbraw/zinc/53/26/25/418532625.db2.gz	SPGJPYRQAZWEFV-AWEZNQCLSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=C([C@@H]1CCCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1)N1CCCC1	ZINC000360851937	418532627	/nfs/dbraw/zinc/53/26/27/418532627.db2.gz	SPGJPYRQAZWEFV-AWEZNQCLSA-N	1	1	321.381	1.268	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@]2(C1)CCC[N@H+](C)C2	ZINC000294231590	418583691	/nfs/dbraw/zinc/58/36/91/418583691.db2.gz	RNIGAPARVNNCMZ-OAHLLOKOSA-N	1	1	321.381	1.044	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c1	ZINC000375466475	418642914	/nfs/dbraw/zinc/64/29/14/418642914.db2.gz	UTCJBFGAKJUZCT-LLVKDONJSA-N	1	1	318.337	1.541	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](O)C1(C)C	ZINC000361420904	418649566	/nfs/dbraw/zinc/64/95/66/418649566.db2.gz	QAXSHOGOBAIZDJ-CYBMUJFWSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](O)C1(C)C	ZINC000361420904	418649569	/nfs/dbraw/zinc/64/95/69/418649569.db2.gz	QAXSHOGOBAIZDJ-CYBMUJFWSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@@H]([NH2+]Cc2ccccc2)C1	ZINC000361342566	418630023	/nfs/dbraw/zinc/63/00/23/418630023.db2.gz	NLRPSRQTIDVRPF-KFWWJZLASA-N	1	1	303.362	1.432	20	5		DDBDMO
COc1cc(C[N@@H+](CCO)[C@H]2CCO[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000361585430	418686046	/nfs/dbraw/zinc/68/60/46/418686046.db2.gz	IIPOHVDRKVSNAG-YPMHNXCESA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1cc(C[N@@H+](C)C2(CO)CCOCC2)ccc1[N+](=O)[O-]	ZINC000362050258	418744836	/nfs/dbraw/zinc/74/48/36/418744836.db2.gz	NTOPZQZPADPFTM-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000364985508	418828973	/nfs/dbraw/zinc/82/89/73/418828973.db2.gz	QYMHSAMEYILDQI-SNVBAGLBSA-N	1	1	315.320	1.766	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000372973150	418917460	/nfs/dbraw/zinc/91/74/60/418917460.db2.gz	JCTIBSAUMWBMQP-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@@H+](CCCF)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000420976228	419397993	/nfs/dbraw/zinc/39/79/93/419397993.db2.gz	SFSHQXMUEQVTJR-UHFFFAOYSA-N	1	1	319.358	1.165	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1CCO	ZINC000426266025	419428141	/nfs/dbraw/zinc/42/81/41/419428141.db2.gz	INNOIXYUSGPGHF-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1CCO	ZINC000426266025	419428150	/nfs/dbraw/zinc/42/81/50/419428150.db2.gz	INNOIXYUSGPGHF-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000421008938	419446298	/nfs/dbraw/zinc/44/62/98/419446298.db2.gz	HHEWYXVBYPLVEQ-YGRLFVJLSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000421008938	419446306	/nfs/dbraw/zinc/44/63/06/419446306.db2.gz	HHEWYXVBYPLVEQ-YGRLFVJLSA-N	1	1	308.334	1.807	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1C[C@@H](C)[N@H+](CCO)C[C@H]1C	ZINC000418122954	419553557	/nfs/dbraw/zinc/55/35/57/419553557.db2.gz	YGKIXUWHGVKXNG-ZIAGYGMSSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1(CN)CCC1	ZINC000420319524	420204463	/nfs/dbraw/zinc/20/44/63/420204463.db2.gz	AKTDJUXRXSTUMY-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1(CN)CCC1	ZINC000420319524	420204466	/nfs/dbraw/zinc/20/44/66/420204466.db2.gz	AKTDJUXRXSTUMY-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)C1CC([NH3+])C1	ZINC000420323270	420208928	/nfs/dbraw/zinc/20/89/28/420208928.db2.gz	BFUXUTZHYLWIES-UHFFFAOYSA-N	1	1	322.365	1.354	20	5		DDBDMO
Cc1ccsc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000438781967	420465855	/nfs/dbraw/zinc/46/58/55/420465855.db2.gz	AAUIHMJDCILHFT-GFCCVEGCSA-N	1	1	310.379	1.654	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000457084525	420604937	/nfs/dbraw/zinc/60/49/37/420604937.db2.gz	LOJAIMPTDCJHML-AWEZNQCLSA-N	1	1	321.377	1.915	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000452069486	420619414	/nfs/dbraw/zinc/61/94/14/420619414.db2.gz	PZPKGFHNALMULA-NEPJUHHUSA-N	1	1	310.350	1.685	20	5		DDBDMO
CC[N@H+]1CC[C@@H](NC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000493700486	420919302	/nfs/dbraw/zinc/91/93/02/420919302.db2.gz	XREIQTVPRSKORQ-DIECRNLCSA-N	1	1	307.325	1.958	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@](O)(CO)C1	ZINC000459727659	420858633	/nfs/dbraw/zinc/85/86/33/420858633.db2.gz	RADGWICRIFVNAM-OIQJVACTSA-N	1	1	306.362	1.817	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCCC1	ZINC000449093012	420949248	/nfs/dbraw/zinc/94/92/48/420949248.db2.gz	NUYUDQLDHRTGPJ-UKRRQHHQSA-N	1	1	307.394	1.572	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])NC[C@@H](O)C[NH+]1CCCC1	ZINC000449093012	420949250	/nfs/dbraw/zinc/94/92/50/420949250.db2.gz	NUYUDQLDHRTGPJ-UKRRQHHQSA-N	1	1	307.394	1.572	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000488799332	421118140	/nfs/dbraw/zinc/11/81/40/421118140.db2.gz	KJQKZVIWGSCKEF-DGCLKSJQSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@H+]1CCO	ZINC000456220279	421125884	/nfs/dbraw/zinc/12/58/84/421125884.db2.gz	DKYOPRBZSBGLHW-TXEJJXNPSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC000456220279	421125887	/nfs/dbraw/zinc/12/58/87/421125887.db2.gz	DKYOPRBZSBGLHW-TXEJJXNPSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000456340487	421143652	/nfs/dbraw/zinc/14/36/52/421143652.db2.gz	DMAYOKSFELMQFK-LLVKDONJSA-N	1	1	309.370	1.193	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000456340487	421143655	/nfs/dbraw/zinc/14/36/55/421143655.db2.gz	DMAYOKSFELMQFK-LLVKDONJSA-N	1	1	309.370	1.193	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000456346708	421144962	/nfs/dbraw/zinc/14/49/62/421144962.db2.gz	IZODHVMDSDDVTK-LBPRGKRZSA-N	1	1	306.366	1.855	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000456346708	421144966	/nfs/dbraw/zinc/14/49/66/421144966.db2.gz	IZODHVMDSDDVTK-LBPRGKRZSA-N	1	1	306.366	1.855	20	5		DDBDMO
COCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000490065429	421188431	/nfs/dbraw/zinc/18/84/31/421188431.db2.gz	WHLRLPIYPYEFKF-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
COCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000490043245	421187060	/nfs/dbraw/zinc/18/70/60/421187060.db2.gz	BFCPJTYOEJVIHJ-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[C@H](CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[N@@H+](C)C1CC1	ZINC000524359403	421258598	/nfs/dbraw/zinc/25/85/98/421258598.db2.gz	SUFDPVCYNDQZKS-SECBINFHSA-N	1	1	321.333	1.536	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]1(C)CO	ZINC000546105719	421285107	/nfs/dbraw/zinc/28/51/07/421285107.db2.gz	XFKWRXBLJKMOBS-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]1(C)CO	ZINC000546105719	421285111	/nfs/dbraw/zinc/28/51/11/421285111.db2.gz	XFKWRXBLJKMOBS-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000525291585	421285761	/nfs/dbraw/zinc/28/57/61/421285761.db2.gz	KMTVASBYQLHLIX-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000526026668	421324607	/nfs/dbraw/zinc/32/46/07/421324607.db2.gz	YSJZUOFDGSTGER-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000547755797	421363371	/nfs/dbraw/zinc/36/33/71/421363371.db2.gz	AFWFOVWHCOSHSN-AXFHLTTASA-N	1	1	309.370	1.414	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000519643609	421713326	/nfs/dbraw/zinc/71/33/26/421713326.db2.gz	WSUGYLISVYPOJL-OLZOCXBDSA-N	1	1	320.393	1.996	20	5		DDBDMO
CNc1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000520371551	421748255	/nfs/dbraw/zinc/74/82/55/421748255.db2.gz	XGPMTTOAUPVEFC-CYBMUJFWSA-N	1	1	318.377	1.945	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000522167699	421817771	/nfs/dbraw/zinc/81/77/71/421817771.db2.gz	YXZPBYLRAOAIBT-SNVBAGLBSA-N	1	1	308.338	1.156	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCN1CCCC1=O	ZINC000522165427	421817799	/nfs/dbraw/zinc/81/77/99/421817799.db2.gz	SCGUNYMQGZFZFE-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000522188790	421819155	/nfs/dbraw/zinc/81/91/55/421819155.db2.gz	IPOGNXAPVPBNEK-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000580929552	421865137	/nfs/dbraw/zinc/86/51/37/421865137.db2.gz	AELAQLHYCOGKQJ-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC3CCC2(C[NH3+])CC3)c1[N+](=O)[O-]	ZINC000581436403	421972744	/nfs/dbraw/zinc/97/27/44/421972744.db2.gz	GUTNKHSTDHEGBF-UHFFFAOYSA-N	1	1	321.381	1.614	20	5		DDBDMO
C[C@H]1OCC[NH2+][C@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000343921694	271909265	/nfs/dbraw/zinc/90/92/65/271909265.db2.gz	VFKPXCAFZKVMBN-IUODEOHRSA-N	1	1	321.377	1.411	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000264553280	277045281	/nfs/dbraw/zinc/04/52/81/277045281.db2.gz	SBTYMDMGBUGNEY-OAHLLOKOSA-N	1	1	319.409	1.596	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000272672220	278000710	/nfs/dbraw/zinc/00/07/10/278000710.db2.gz	TYOQGPOYXPPVKK-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000272672220	278000711	/nfs/dbraw/zinc/00/07/11/278000711.db2.gz	TYOQGPOYXPPVKK-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000272672220	278000714	/nfs/dbraw/zinc/00/07/14/278000714.db2.gz	TYOQGPOYXPPVKK-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
Cn1ccnc1[C@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000261746498	294436271	/nfs/dbraw/zinc/43/62/71/294436271.db2.gz	OQDMUYAUXDNCTE-SECBINFHSA-N	1	1	321.362	1.177	20	5		DDBDMO
CCOc1ccc(C(=O)NC[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000354233670	298375617	/nfs/dbraw/zinc/37/56/17/298375617.db2.gz	AMGAJODIZOSZPC-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)Nc1ccc([N+](=O)[O-])cc1	ZINC000363094665	300209850	/nfs/dbraw/zinc/20/98/50/300209850.db2.gz	GGYUPMQZFODIRT-KGLIPLIRSA-N	1	1	320.349	1.580	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000363099275	300210960	/nfs/dbraw/zinc/21/09/60/300210960.db2.gz	FQVFTMVTMDHMAQ-STQMWFEESA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCOCC1	ZINC000363379029	300259860	/nfs/dbraw/zinc/25/98/60/300259860.db2.gz	JQLNMWGOJHXXRL-UHFFFAOYSA-N	1	1	307.350	1.954	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2cccs2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000368804895	301090056	/nfs/dbraw/zinc/09/00/56/301090056.db2.gz	JTJXZFHMJMFIFD-STQMWFEESA-N	1	1	309.391	1.494	20	5		DDBDMO
O=C(N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)c1cc([N+](=O)[O-])c[nH]1	ZINC000531918229	303265943	/nfs/dbraw/zinc/26/59/43/303265943.db2.gz	APWQKZBWFCKHIR-TZMCWYRMSA-N	1	1	322.365	1.296	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000532909338	303301692	/nfs/dbraw/zinc/30/16/92/303301692.db2.gz	FJRGVMMFGFAROE-NSHDSACASA-N	1	1	323.397	1.901	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1CO	ZINC000362075629	307013103	/nfs/dbraw/zinc/01/31/03/307013103.db2.gz	ISMIGBUSOBAZOO-WCQYABFASA-N	1	1	319.361	1.044	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000362254292	307015651	/nfs/dbraw/zinc/01/56/51/307015651.db2.gz	ZFTWMTJZXLPMRR-GFCCVEGCSA-N	1	1	308.382	1.737	20	5		DDBDMO
COc1ccc(C[NH2+][C@@H]2CCc3cn[nH]c3C2)cc1[N+](=O)[O-]	ZINC000363938666	307038209	/nfs/dbraw/zinc/03/82/09/307038209.db2.gz	PIERUSWZGFHYBY-GFCCVEGCSA-N	1	1	302.334	1.974	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCCC2	ZINC000367642907	307099958	/nfs/dbraw/zinc/09/99/58/307099958.db2.gz	JTIJXUCDNOEYII-UHFFFAOYSA-N	1	1	315.333	1.640	20	5		DDBDMO
O=C(NCc1c[nH+]c2n1CCCC2)Nc1ccncc1[N+](=O)[O-]	ZINC000375425101	307225645	/nfs/dbraw/zinc/22/56/45/307225645.db2.gz	IVFYYQAWAHJKJR-UHFFFAOYSA-N	1	1	316.321	1.266	20	5		DDBDMO
O=C(N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])[nH]1	ZINC000531665064	307621696	/nfs/dbraw/zinc/62/16/96/307621696.db2.gz	PIVDEXDLUCWNTJ-DGCLKSJQSA-N	1	1	322.365	1.296	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000576974353	308353817	/nfs/dbraw/zinc/35/38/17/308353817.db2.gz	ZDJLATICECYHGE-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCN(c3[nH]cc[nH+]3)CC2)c(F)c1	ZINC000582368111	326020663	/nfs/dbraw/zinc/02/06/63/326020663.db2.gz	VQYAXIPHHXFKIJ-UHFFFAOYSA-N	1	1	305.313	1.779	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@H](O)C[C@@H]1[C@@H]1CCCOC1	ZINC000451300860	534887302	/nfs/dbraw/zinc/88/73/02/534887302.db2.gz	MREMEGJMKQVKRJ-IIAWOOMASA-N	1	1	306.362	1.957	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-]	ZINC000176801737	697406442	/nfs/dbraw/zinc/40/64/42/697406442.db2.gz	YVPDCSSKVPRWKT-UHFFFAOYSA-N	1	1	313.329	1.350	20	5		DDBDMO
Cc1cc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000749388546	700161014	/nfs/dbraw/zinc/16/10/14/700161014.db2.gz	ZJAHZXWXDHPHCQ-LBPRGKRZSA-N	1	1	318.377	1.794	20	5		DDBDMO
COCC[N@@H+](C)CCC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526262	699321306	/nfs/dbraw/zinc/32/13/06/699321306.db2.gz	ONTOHIGVDKCQEX-LBPRGKRZSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCC[N@H+](C)CCCN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526262	699321310	/nfs/dbraw/zinc/32/13/10/699321310.db2.gz	ONTOHIGVDKCQEX-LBPRGKRZSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCC[N@@H+](C)CCCN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526262	699321314	/nfs/dbraw/zinc/32/13/14/699321314.db2.gz	ONTOHIGVDKCQEX-LBPRGKRZSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCCN(C)CCC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526262	699321318	/nfs/dbraw/zinc/32/13/18/699321318.db2.gz	ONTOHIGVDKCQEX-LBPRGKRZSA-N	1	1	310.398	1.796	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000788884097	699344559	/nfs/dbraw/zinc/34/45/59/699344559.db2.gz	GKLLPUKOZPYGBM-QMMMGPOBSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1CNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000788884097	699344557	/nfs/dbraw/zinc/34/45/57/699344557.db2.gz	GKLLPUKOZPYGBM-QMMMGPOBSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000793934996	699787923	/nfs/dbraw/zinc/78/79/23/699787923.db2.gz	JDLQHQHFLKWDPH-MNOVXSKESA-N	1	1	304.350	1.201	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000802135883	700370669	/nfs/dbraw/zinc/37/06/69/700370669.db2.gz	BLZPXUWXMZVQGP-AWEZNQCLSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000802135883	700370671	/nfs/dbraw/zinc/37/06/71/700370671.db2.gz	BLZPXUWXMZVQGP-AWEZNQCLSA-N	1	1	308.334	1.861	20	5		DDBDMO
C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CC(O)C1	ZINC000759874927	700778878	/nfs/dbraw/zinc/77/88/78/700778878.db2.gz	STFJULTUSMQTNU-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])C1CC(O)C1	ZINC000759874927	700778880	/nfs/dbraw/zinc/77/88/80/700778880.db2.gz	STFJULTUSMQTNU-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761074559	700839083	/nfs/dbraw/zinc/83/90/83/700839083.db2.gz	CRUHNLGPUIYJJU-GFCCVEGCSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCN(C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761074559	700839085	/nfs/dbraw/zinc/83/90/85/700839085.db2.gz	CRUHNLGPUIYJJU-GFCCVEGCSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCN(C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761074559	700839088	/nfs/dbraw/zinc/83/90/88/700839088.db2.gz	CRUHNLGPUIYJJU-GFCCVEGCSA-N	1	1	320.393	1.868	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000804520571	701197386	/nfs/dbraw/zinc/19/73/86/701197386.db2.gz	GEWLUOKDGQLKFQ-LLVKDONJSA-N	1	1	322.365	1.981	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000804777707	701211941	/nfs/dbraw/zinc/21/19/41/701211941.db2.gz	JCEATWGOIDGPEV-LBPRGKRZSA-N	1	1	306.366	1.781	20	5		DDBDMO
C[NH+](C)CCCOc1cccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000840339582	702075592	/nfs/dbraw/zinc/07/55/92/702075592.db2.gz	XCIWCTGPPNEESQ-ZIAGYGMSSA-N	1	1	307.350	1.621	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC000866204651	706648149	/nfs/dbraw/zinc/64/81/49/706648149.db2.gz	FMUURESLXBONGC-FZMZJTMJSA-N	1	1	318.377	1.485	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)c(N)c([N+](=O)[O-])c1	ZINC000816949335	702233458	/nfs/dbraw/zinc/23/34/58/702233458.db2.gz	TUIPTCMYZSUVIR-GXFFZTMASA-N	1	1	304.350	1.262	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H](CO)C[NH+]2CCCCC2)c1	ZINC000843113555	702821560	/nfs/dbraw/zinc/82/15/60/702821560.db2.gz	WZPCSHJMYZXRBC-GDBMZVCRSA-N	1	1	323.393	1.065	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2C[C@H]3[C@@H](C2)C3(F)F)c1	ZINC000844448733	703033046	/nfs/dbraw/zinc/03/30/46/703033046.db2.gz	GSFHVDIUPZWQGM-WCFLWFBJSA-N	1	1	314.288	1.531	20	5		DDBDMO
COCCC[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848474620	703554634	/nfs/dbraw/zinc/55/46/34/703554634.db2.gz	FFFXIHNSNCUYBI-HNNXBMFYSA-N	1	1	321.377	1.837	20	5		DDBDMO
C[N@H+](CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H]1CCOC1	ZINC000848478689	703555011	/nfs/dbraw/zinc/55/50/11/703555011.db2.gz	QURMULKENIFCHM-HUUCEWRRSA-N	1	1	319.361	1.589	20	5		DDBDMO
C[N@@H+](CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H]1CCOC1	ZINC000848478689	703555013	/nfs/dbraw/zinc/55/50/13/703555013.db2.gz	QURMULKENIFCHM-HUUCEWRRSA-N	1	1	319.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](Cn3ccnn3)C2)c1	ZINC000852314409	704007743	/nfs/dbraw/zinc/00/77/43/704007743.db2.gz	SKLMQWZKHGTNQG-WFASDCNBSA-N	1	1	317.349	1.242	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534769	704069817	/nfs/dbraw/zinc/06/98/17/704069817.db2.gz	PNXFOWLMAUMQOX-FZMZJTMJSA-N	1	1	307.306	1.971	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534769	704069818	/nfs/dbraw/zinc/06/98/18/704069818.db2.gz	PNXFOWLMAUMQOX-FZMZJTMJSA-N	1	1	307.306	1.971	20	5		DDBDMO
Cc1cc(C[C@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819177548	704082147	/nfs/dbraw/zinc/08/21/47/704082147.db2.gz	OFNDMLVRVBEVSI-BONVTDFDSA-N	1	1	304.350	1.881	20	5		DDBDMO
CC[C@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870861548	704148050	/nfs/dbraw/zinc/14/80/50/704148050.db2.gz	BPPDIXCZNGWPER-ZFWWWQNUSA-N	1	1	307.350	1.406	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000855165888	704471954	/nfs/dbraw/zinc/47/19/54/704471954.db2.gz	ZTRFKZQOFIPPEU-SECBINFHSA-N	1	1	324.356	1.919	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000822301750	704910860	/nfs/dbraw/zinc/91/08/60/704910860.db2.gz	YXEZIJRQLLCYAS-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CCCOCC1	ZINC000822301750	704910863	/nfs/dbraw/zinc/91/08/63/704910863.db2.gz	YXEZIJRQLLCYAS-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836389	705193558	/nfs/dbraw/zinc/19/35/58/705193558.db2.gz	CCQQCIVJAKQEKN-NEPJUHHUSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874836389	705193560	/nfs/dbraw/zinc/19/35/60/705193560.db2.gz	CCQQCIVJAKQEKN-NEPJUHHUSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836389	705193564	/nfs/dbraw/zinc/19/35/64/705193564.db2.gz	CCQQCIVJAKQEKN-NEPJUHHUSA-N	1	1	321.381	1.579	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000874845925	705200851	/nfs/dbraw/zinc/20/08/51/705200851.db2.gz	YUROPSXLQFQSHA-CABCVRRESA-N	1	1	319.361	1.669	20	5		DDBDMO
CO[C@@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000876955683	705937175	/nfs/dbraw/zinc/93/71/75/705937175.db2.gz	AMSUYRLCFUEGOZ-ZBFHGGJFSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827244431	705958881	/nfs/dbraw/zinc/95/88/81/705958881.db2.gz	AKXCSFVTEVAQMZ-BPLDGKMQSA-N	1	1	319.361	1.181	20	5		DDBDMO
CCOC(=O)[C@H](C)C1C[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000871993182	707272177	/nfs/dbraw/zinc/27/21/77/707272177.db2.gz	MHTJCIKNHLKMQT-IAQYHMDHSA-N	1	1	322.361	1.759	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](c2ccccn2)C1	ZINC000878553789	706425794	/nfs/dbraw/zinc/42/57/94/706425794.db2.gz	RUNVCLBSDZQOJO-ZDUSSCGKSA-N	1	1	301.350	1.984	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN1	ZINC000880169332	706899292	/nfs/dbraw/zinc/89/92/92/706899292.db2.gz	QVCSXPIJVQBBTG-CQSZACIVSA-N	1	1	319.361	1.373	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000837609791	707695177	/nfs/dbraw/zinc/69/51/77/707695177.db2.gz	PYUCAOIOIKCZHT-LLVKDONJSA-N	1	1	310.354	1.748	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000882957617	707871040	/nfs/dbraw/zinc/87/10/40/707871040.db2.gz	HKAOYMRMEVMAMK-CYBMUJFWSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ccc4nonc4c3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896912419	708180539	/nfs/dbraw/zinc/18/05/39/708180539.db2.gz	XKDLMCQFQFUMHP-OTYXRUKQSA-N	1	1	303.322	1.519	20	5		DDBDMO
Cn1cc(COC(=O)CC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])n1	ZINC000884504574	708318270	/nfs/dbraw/zinc/31/82/70/708318270.db2.gz	LYAZYUVNFSVZON-GFCCVEGCSA-N	1	1	310.354	1.636	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N(C)CC[N@@H+](C)CCO)c1[N+](=O)[O-]	ZINC000912607700	713047049	/nfs/dbraw/zinc/04/70/49/713047049.db2.gz	JWWYPQBAADSPDP-UHFFFAOYSA-N	1	1	313.329	1.038	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886341153	708745706	/nfs/dbraw/zinc/74/57/06/708745706.db2.gz	QPVDBLPQFOYRSP-PHIMTYICSA-N	1	1	305.334	1.884	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000886592997	708785441	/nfs/dbraw/zinc/78/54/41/708785441.db2.gz	GMYOLXGHHNUJGO-GFCCVEGCSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000886592997	708785444	/nfs/dbraw/zinc/78/54/44/708785444.db2.gz	GMYOLXGHHNUJGO-GFCCVEGCSA-N	1	1	320.393	1.979	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1	ZINC000887934536	709170716	/nfs/dbraw/zinc/17/07/16/709170716.db2.gz	LHZPMTVPCLNEPU-MEDUHNTESA-N	1	1	319.361	1.627	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC000887938028	709173099	/nfs/dbraw/zinc/17/30/99/709173099.db2.gz	WBAQVTVCBJTYOO-MEDUHNTESA-N	1	1	319.361	1.627	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c1C	ZINC000889636893	709568527	/nfs/dbraw/zinc/56/85/27/709568527.db2.gz	HOINAFBUONVIDC-JSGCOSHPSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c1C	ZINC000889636893	709568532	/nfs/dbraw/zinc/56/85/32/709568532.db2.gz	HOINAFBUONVIDC-JSGCOSHPSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1c(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)cccc1[N+](=O)[O-]	ZINC000902342972	710723279	/nfs/dbraw/zinc/72/32/79/710723279.db2.gz	LMTMIOYMJMHNTA-UHFFFAOYSA-N	1	1	307.350	1.542	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928453866	713204124	/nfs/dbraw/zinc/20/41/24/713204124.db2.gz	OWSUDWXEZYAJAP-RYUDHWBXSA-N	1	1	306.366	1.606	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[NH2+]Cc2ccccc21	ZINC000911761489	710970052	/nfs/dbraw/zinc/97/00/52/710970052.db2.gz	QMAUTUUGADMJIH-UHFFFAOYSA-N	1	1	315.333	1.236	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000912021303	711126446	/nfs/dbraw/zinc/12/64/46/711126446.db2.gz	KCVDNBDOXQCWKG-ZOWXZIJZSA-N	1	1	321.377	1.569	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000912237607	711238061	/nfs/dbraw/zinc/23/80/61/711238061.db2.gz	LYDOVHZBXBCKGQ-HNNXBMFYSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@H]2Cc3c[nH+]cn3C2)c(Br)c1	ZINC000894995584	711355909	/nfs/dbraw/zinc/35/59/09/711355909.db2.gz	DEISYQDDPDUMOI-ZETCQYMHSA-N	1	1	324.138	1.986	20	5		DDBDMO
CCOC(=O)c1ccnc(N[C@H]2CC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000895739038	711591703	/nfs/dbraw/zinc/59/17/03/711591703.db2.gz	AMOJNYWTCWUWIP-KOLCDFICSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[C@]1(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)CCC[NH2+]C1	ZINC000904343604	711843704	/nfs/dbraw/zinc/84/37/04/711843704.db2.gz	WECBBEZFANWSCT-HNNXBMFYSA-N	1	1	307.398	1.818	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC2	ZINC000931196522	714031312	/nfs/dbraw/zinc/03/13/12/714031312.db2.gz	JGXXPAIJQVZAKD-UHFFFAOYSA-N	1	1	318.333	1.471	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC2	ZINC000931196522	714031313	/nfs/dbraw/zinc/03/13/13/714031313.db2.gz	JGXXPAIJQVZAKD-UHFFFAOYSA-N	1	1	318.333	1.471	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)Cc2c[nH]nc21	ZINC000931459971	714102672	/nfs/dbraw/zinc/10/26/72/714102672.db2.gz	CPFNJDDRWVUTRU-HZMBPMFUSA-N	1	1	302.334	1.971	20	5		DDBDMO
O=C(CCN1CCn2cc[nH+]c21)Nc1cc([N+](=O)[O-])ccc1F	ZINC000931521453	714118289	/nfs/dbraw/zinc/11/82/89/714118289.db2.gz	JBZNSIIJNVNOKW-UHFFFAOYSA-N	1	1	319.296	1.779	20	5		DDBDMO
Cc1nc(N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)n[nH]1	ZINC000931625779	714141503	/nfs/dbraw/zinc/14/15/03/714141503.db2.gz	HMFOCJKORBKRKS-UHFFFAOYSA-N	1	1	316.365	1.386	20	5		DDBDMO
CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1	ZINC000923279992	714295713	/nfs/dbraw/zinc/29/57/13/714295713.db2.gz	VYIQEPVYYNYJPW-CQSZACIVSA-N	1	1	309.366	1.018	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000933252498	714547506	/nfs/dbraw/zinc/54/75/06/714547506.db2.gz	WZCZONOXYVYTPU-HNNXBMFYSA-N	1	1	322.409	1.419	20	5		DDBDMO
CC(C)C[C@H]1CN(C)CC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000933252498	714547509	/nfs/dbraw/zinc/54/75/09/714547509.db2.gz	WZCZONOXYVYTPU-HNNXBMFYSA-N	1	1	322.409	1.419	20	5		DDBDMO
CC(C)C[C@H]1CN(C)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000933252498	714547513	/nfs/dbraw/zinc/54/75/13/714547513.db2.gz	WZCZONOXYVYTPU-HNNXBMFYSA-N	1	1	322.409	1.419	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@H]2C[C@@H]2CCCO2)c1	ZINC000933677969	714646220	/nfs/dbraw/zinc/64/62/20/714646220.db2.gz	SERZTNXEOSAVJB-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@H]2C[C@@H]2CCCO2)c1	ZINC000933677969	714646222	/nfs/dbraw/zinc/64/62/22/714646222.db2.gz	SERZTNXEOSAVJB-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2C[C@H]2CCCO2)c1	ZINC000933677963	714646375	/nfs/dbraw/zinc/64/63/75/714646375.db2.gz	SERZTNXEOSAVJB-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2C[C@H]2CCCO2)c1	ZINC000933677963	714646376	/nfs/dbraw/zinc/64/63/76/714646376.db2.gz	SERZTNXEOSAVJB-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C2	ZINC000933759775	714665813	/nfs/dbraw/zinc/66/58/13/714665813.db2.gz	KTTXCDLVZNFUJY-BONVTDFDSA-N	1	1	307.325	1.821	20	5		DDBDMO
Cc1nc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)ncc1[N+](=O)[O-]	ZINC001164774701	721301751	/nfs/dbraw/zinc/30/17/51/721301751.db2.gz	IFHFXSOOQBEJNY-UHFFFAOYSA-N	1	1	303.366	1.615	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2cc([N+](=O)[O-])cc(Br)[n+]2[O-])C1	ZINC001167278781	732888649	/nfs/dbraw/zinc/88/86/49/732888649.db2.gz	RUFYRBKJKYZZOC-ZETCQYMHSA-N	1	1	317.143	1.107	20	5		DDBDMO
CO[C@@H]1CC[NH2+][C@@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)C1	ZINC001212240504	747104332	/nfs/dbraw/zinc/10/43/32/747104332.db2.gz	ALHJPZUGDKGNLQ-RKDXNWHRSA-N	1	1	323.284	1.618	20	5		DDBDMO
Cc1nc(C)c(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)o1	ZINC000996428840	749586981	/nfs/dbraw/zinc/58/69/81/749586981.db2.gz	ITFPAWGQCNIMTJ-CHWSQXEVSA-N	1	1	322.365	1.037	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCCC2CCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000673085	762077882	/nfs/dbraw/zinc/07/78/82/762077882.db2.gz	DTQSWYDQQIQUNZ-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCC1=CC[N@H+](CCCC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000673085	762077888	/nfs/dbraw/zinc/07/78/88/762077888.db2.gz	DTQSWYDQQIQUNZ-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCCC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000673085	762077897	/nfs/dbraw/zinc/07/78/97/762077897.db2.gz	DTQSWYDQQIQUNZ-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
CC(=O)N1CCC2(CC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)CC1	ZINC001035143677	751225158	/nfs/dbraw/zinc/22/51/58/751225158.db2.gz	PHVZMQHYVQULKA-UHFFFAOYSA-N	1	1	321.381	1.163	20	5		DDBDMO
CC(=O)N1CCC2(CC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)CC1	ZINC001035143677	751225161	/nfs/dbraw/zinc/22/51/61/751225161.db2.gz	PHVZMQHYVQULKA-UHFFFAOYSA-N	1	1	321.381	1.163	20	5		DDBDMO
O=C1c2ccccc2[C@@H]2C[N@@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CCN12	ZINC001169010275	762177894	/nfs/dbraw/zinc/17/78/94/762177894.db2.gz	CCIKQPDPOMNBPE-WWGRRREGSA-N	1	1	315.373	1.945	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045537	762186338	/nfs/dbraw/zinc/18/63/38/762186338.db2.gz	JKJJQMCRXRNLCL-SWLSCSKDSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045537	762186341	/nfs/dbraw/zinc/18/63/41/762186341.db2.gz	JKJJQMCRXRNLCL-SWLSCSKDSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=C(c1cccs1)N1CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169039583	762193602	/nfs/dbraw/zinc/19/36/02/762193602.db2.gz	RCRAUJOLVYRIKH-OLZOCXBDSA-N	1	1	323.418	1.951	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169017558	762197750	/nfs/dbraw/zinc/19/77/50/762197750.db2.gz	AOKLOEYQEHEVGY-QEJZJMRPSA-N	1	1	322.409	1.801	20	5		DDBDMO
Cc1noc([C@]23COC[C@H]2C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C3)n1	ZINC001169019991	762199918	/nfs/dbraw/zinc/19/99/18/762199918.db2.gz	HMMQDZCPHPEFHA-GUIRCDHDSA-N	1	1	322.365	1.023	20	5		DDBDMO
Cc1nccnc1O[C@@H]1CC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169051991	762206944	/nfs/dbraw/zinc/20/69/44/762206944.db2.gz	DYYQVNSAPAUZHP-MELADBBJSA-N	1	1	306.366	1.684	20	5		DDBDMO
COc1cnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054634	762209697	/nfs/dbraw/zinc/20/96/97/762209697.db2.gz	NBNGEQKJJFLVTF-FRRDWIJNSA-N	1	1	322.365	1.384	20	5		DDBDMO
Cc1cncc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001086082921	760942992	/nfs/dbraw/zinc/94/29/92/760942992.db2.gz	HWJBRIFELFQUPV-FAAHXZRKSA-N	1	1	318.377	1.040	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCC(=O)N(C)CC2)c([N+](=O)[O-])c1	ZINC001170347577	766278002	/nfs/dbraw/zinc/27/80/02/766278002.db2.gz	RZWVFLNUKQKILS-LBPRGKRZSA-N	1	1	321.377	1.699	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC001170347545	766278090	/nfs/dbraw/zinc/27/80/90/766278090.db2.gz	RTRXKOKQNNSVKK-CMPLNLGQSA-N	1	1	307.350	1.342	20	5		DDBDMO
CCC[N@H+](C)CC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001148638052	773560378	/nfs/dbraw/zinc/56/03/78/773560378.db2.gz	AAHCLCAKHRHJTE-UHFFFAOYSA-N	1	1	308.382	1.142	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001148638052	773560382	/nfs/dbraw/zinc/56/03/82/773560382.db2.gz	AAHCLCAKHRHJTE-UHFFFAOYSA-N	1	1	308.382	1.142	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCO[C@@H](CO)C1)CC2	ZINC001172902811	776915694	/nfs/dbraw/zinc/91/56/94/776915694.db2.gz	CRIBLMPUUYPQDC-GOEBONIOSA-N	1	1	306.362	1.535	20	5		DDBDMO
Cc1nnc2n1CC[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2	ZINC001173228836	777062301	/nfs/dbraw/zinc/06/23/01/777062301.db2.gz	ZFGPHOOZPIHMCV-LLVKDONJSA-N	1	1	301.350	1.942	20	5		DDBDMO
Cc1nnc2n1CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2	ZINC001173228836	777062302	/nfs/dbraw/zinc/06/23/02/777062302.db2.gz	ZFGPHOOZPIHMCV-LLVKDONJSA-N	1	1	301.350	1.942	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(CCC[NH3+])CC1	ZINC001173232676	777063263	/nfs/dbraw/zinc/06/32/63/777063263.db2.gz	FMOKQLQOWGDMBK-CQSZACIVSA-N	1	1	306.410	1.492	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C\CNC(=O)CC1CCC1	ZINC001268519868	840362457	/nfs/dbraw/zinc/36/24/57/840362457.db2.gz	GNNVKIDRVXLTDC-IHWYPQMZSA-N	1	1	321.381	1.281	20	5		DDBDMO
O=C1O[C@H](C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC001327224320	861975741	/nfs/dbraw/zinc/97/57/41/861975741.db2.gz	PSLQSKDBEBGPJD-OAHLLOKOSA-N	1	1	317.345	1.936	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC001327224320	861975743	/nfs/dbraw/zinc/97/57/43/861975743.db2.gz	PSLQSKDBEBGPJD-OAHLLOKOSA-N	1	1	317.345	1.936	20	5		DDBDMO
COc1nc(C)nc(N[C@H]2C[C@H]3CC[N@@H+](C2)[C@@H]3C)c1[N+](=O)[O-]	ZINC001170965546	850741611	/nfs/dbraw/zinc/74/16/11/850741611.db2.gz	UAEYCIJAOCILRP-IEBDPFPHSA-N	1	1	307.354	1.596	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CC1CCCCC1)C2	ZINC001072724697	857641812	/nfs/dbraw/zinc/64/18/12/857641812.db2.gz	BGYVZPGUBJBBLD-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CC1CCCCC1)C2	ZINC001072724697	857641818	/nfs/dbraw/zinc/64/18/18/857641818.db2.gz	BGYVZPGUBJBBLD-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CC1CCCCC1)C2	ZINC001072724697	857641821	/nfs/dbraw/zinc/64/18/21/857641821.db2.gz	BGYVZPGUBJBBLD-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
Cc1cc(N[C@H]2CC[N@H+](C)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC001156581764	863165718	/nfs/dbraw/zinc/16/57/18/863165718.db2.gz	ZXYXTEVJDFBMOA-ZDUSSCGKSA-N	1	1	313.361	1.898	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H]2CCC[N@@H+](C)[C@@H]2C1	ZINC001157259093	863688077	/nfs/dbraw/zinc/68/80/77/863688077.db2.gz	CQCIZUODGUGMID-GXFFZTMASA-N	1	1	320.349	1.307	20	5		DDBDMO
Cc1nc(C)c(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])s1	ZINC001157761402	864110627	/nfs/dbraw/zinc/11/06/27/864110627.db2.gz	RAEUDMWPONKZMA-GHMZBOCLSA-N	1	1	312.395	1.021	20	5		DDBDMO
CNc1c(C(=O)NCC[N@H+]2CC[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC001320379467	866692068	/nfs/dbraw/zinc/69/20/68/866692068.db2.gz	UXLPKYCCRPIZKE-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC001320547818	866816458	/nfs/dbraw/zinc/81/64/58/866816458.db2.gz	LHTGXXIPCBPPHO-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@@H]1C	ZINC001320547818	866816484	/nfs/dbraw/zinc/81/64/84/866816484.db2.gz	LHTGXXIPCBPPHO-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1nn(CN2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC001334748325	867809832	/nfs/dbraw/zinc/80/98/32/867809832.db2.gz	OSEVXSJYWMIWHO-BFHYXJOUSA-N	1	1	307.398	1.719	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2c([N+](=O)[O-])cnn2C)CC1	ZINC001335532541	868366224	/nfs/dbraw/zinc/36/62/24/868366224.db2.gz	BRCXQDQUYFENLH-NSHDSACASA-N	1	1	309.370	1.018	20	5		DDBDMO
Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ncc([N+](=O)[O-])s1)C2	ZINC001163636082	868579164	/nfs/dbraw/zinc/57/91/64/868579164.db2.gz	VLXXAUUBZHLADC-SECBINFHSA-N	1	1	323.378	1.518	20	5		DDBDMO
Cc1nonc1CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001164066027	868923086	/nfs/dbraw/zinc/92/30/86/868923086.db2.gz	VKEZQQLGVQAWSK-UHFFFAOYSA-N	1	1	303.322	1.886	20	5		DDBDMO
Cc1nonc1CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001164066027	868923088	/nfs/dbraw/zinc/92/30/88/868923088.db2.gz	VKEZQQLGVQAWSK-UHFFFAOYSA-N	1	1	303.322	1.886	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNc2ccc([N+](=O)[O-])c(C(N)=O)n2)C1	ZINC001165260876	869474485	/nfs/dbraw/zinc/47/44/85/869474485.db2.gz	KMLSVRJIOOCEGR-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
COC(=O)C1([NH3+])CCN(c2cc(Cl)ncc2[N+](=O)[O-])CC1	ZINC001166794689	870256706	/nfs/dbraw/zinc/25/67/06/870256706.db2.gz	IDAIPKBELRROOL-UHFFFAOYSA-N	1	1	314.729	1.114	20	5		DDBDMO
CC/C=C\CC[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001205224670	871443278	/nfs/dbraw/zinc/44/32/78/871443278.db2.gz	WEXJYHMMVRYBPO-LPUOJRKPSA-N	1	1	309.410	1.836	20	5		DDBDMO
CCOC(=O)c1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC001346046555	873600878	/nfs/dbraw/zinc/60/08/78/873600878.db2.gz	XUQIHCLFQVYZQF-UHFFFAOYSA-N	1	1	304.306	1.784	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC001353285481	877228781	/nfs/dbraw/zinc/22/87/81/877228781.db2.gz	NQVUXIRYFZSNKY-CYZMBNFOSA-N	1	1	319.361	1.673	20	5		DDBDMO
CCCSc1nc(O[C@@H]2C[NH2+]C[C@@H]2F)c([N+](=O)[O-])c(=O)[nH]1	ZINC001217998448	877366012	/nfs/dbraw/zinc/36/60/12/877366012.db2.gz	QBXFQMXUYGCWOW-NKWVEPMBSA-N	1	1	318.330	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCOC[C@@H](O)C3)CC2)cc1	ZINC001254473572	896456758	/nfs/dbraw/zinc/45/67/58/896456758.db2.gz	GAKAXENKYYNZGN-INIZCTEOSA-N	1	1	321.377	1.257	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)c1	ZINC001262826142	900387554	/nfs/dbraw/zinc/38/75/54/900387554.db2.gz	CTNNKWSMTICKHI-KWCYVHTRSA-N	1	1	303.362	1.973	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H]2C[N@H+](C)CC2(C)C)cccc1[N+](=O)[O-]	ZINC001303989923	903187625	/nfs/dbraw/zinc/18/76/25/903187625.db2.gz	UMNAGWXHERRSBP-CQSZACIVSA-N	1	1	305.378	1.902	20	5		DDBDMO
Cc1ncccc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001280813586	904076224	/nfs/dbraw/zinc/07/62/24/904076224.db2.gz	DVPBLTGQEGDVJV-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
Cc1ncccc1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280813586	904076232	/nfs/dbraw/zinc/07/62/32/904076232.db2.gz	DVPBLTGQEGDVJV-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
Cc1ncccc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001280813586	904076242	/nfs/dbraw/zinc/07/62/42/904076242.db2.gz	DVPBLTGQEGDVJV-HUUCEWRRSA-N	1	1	320.393	1.336	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC000425048873	529822537	/nfs/dbraw/zinc/82/25/37/529822537.db2.gz	CYCSHRHOYUKHGO-TVQRCGJNSA-N	1	1	322.340	1.482	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[N@@H+](C)C1	ZINC000301981076	529932939	/nfs/dbraw/zinc/93/29/39/529932939.db2.gz	IOXWGGWJCMXXIW-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
C[N@H+](CCc1cnccn1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444684589	529938430	/nfs/dbraw/zinc/93/84/30/529938430.db2.gz	NDXIVPYOCAKXBS-UHFFFAOYSA-N	1	1	312.333	1.936	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444684589	529938432	/nfs/dbraw/zinc/93/84/32/529938432.db2.gz	NDXIVPYOCAKXBS-UHFFFAOYSA-N	1	1	312.333	1.936	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000458178850	530060425	/nfs/dbraw/zinc/06/04/25/530060425.db2.gz	XEUUUKAKUIFLAQ-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[C@H]1[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851882	232112695	/nfs/dbraw/zinc/11/26/95/232112695.db2.gz	QGAUUEZTJRLKKA-CHWSQXEVSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851882	232112699	/nfs/dbraw/zinc/11/26/99/232112699.db2.gz	QGAUUEZTJRLKKA-CHWSQXEVSA-N	1	1	324.377	1.834	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1	ZINC000616369949	362664753	/nfs/dbraw/zinc/66/47/53/362664753.db2.gz	DZZABXWMAGTHBS-GFCCVEGCSA-N	1	1	320.349	1.673	20	5		DDBDMO
C[C@H]1NC(=O)N(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O	ZINC000459427955	233187425	/nfs/dbraw/zinc/18/74/25/233187425.db2.gz	AMEBRLFUXHFBCT-LLVKDONJSA-N	1	1	320.349	1.009	20	5		DDBDMO
C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)C[NH+]1CCOCC1	ZINC000150713045	186059156	/nfs/dbraw/zinc/05/91/56/186059156.db2.gz	JEZKURJDINMBPA-ZDUSSCGKSA-N	1	1	321.377	1.222	20	5		DDBDMO
CC(C)(C(N)=O)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000266862479	186363299	/nfs/dbraw/zinc/36/32/99/186363299.db2.gz	KSGBNBIQNDEYHK-UHFFFAOYSA-N	1	1	320.393	1.019	20	5		DDBDMO
C[N@H+]1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1	ZINC000015261222	352154321	/nfs/dbraw/zinc/15/43/21/352154321.db2.gz	FTGBTDKLZRSTJZ-UHFFFAOYSA-N	1	1	307.350	1.599	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000491290268	234125977	/nfs/dbraw/zinc/12/59/77/234125977.db2.gz	BORHBTLREBYFSH-DAXSKMNVSA-N	1	1	301.346	1.915	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CCC[C@@H](C)C1	ZINC000068575522	353121433	/nfs/dbraw/zinc/12/14/33/353121433.db2.gz	LBKDMAXGXIILGW-GFCCVEGCSA-N	1	1	323.397	1.338	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C[C@@H](C)O)C(C)C	ZINC000072610941	353204330	/nfs/dbraw/zinc/20/43/30/353204330.db2.gz	OSVRGCPACXAOKS-GFCCVEGCSA-N	1	1	309.366	1.933	20	5		DDBDMO
Cn1cc(CC[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000072665166	353207861	/nfs/dbraw/zinc/20/78/61/353207861.db2.gz	FBXFJFOMKCVVEJ-ZDUSSCGKSA-N	1	1	316.365	1.452	20	5		DDBDMO
NS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000074288260	353304435	/nfs/dbraw/zinc/30/44/35/353304435.db2.gz	MPGLIMQJZCPZOA-LLVKDONJSA-N	1	1	313.379	1.095	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@]3(CCCOC3)C2)c1	ZINC000355776139	291003976	/nfs/dbraw/zinc/00/39/76/291003976.db2.gz	BBSUGMQCQXLIPY-GJZGRUSLSA-N	1	1	324.381	1.045	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083170727	353706218	/nfs/dbraw/zinc/70/62/18/353706218.db2.gz	FNRXNPQHMWKNTR-NXEZZACHSA-N	1	1	318.333	1.822	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@@H+]2CCO[C@@H](C)C2)CC1	ZINC000092612371	353863410	/nfs/dbraw/zinc/86/34/10/353863410.db2.gz	CGFSSRDJVYMUJC-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369236	354224211	/nfs/dbraw/zinc/22/42/11/354224211.db2.gz	LVHPFGXRKVIJEU-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369236	354224214	/nfs/dbraw/zinc/22/42/14/354224214.db2.gz	LVHPFGXRKVIJEU-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
CC(=O)c1cc(N2CC[NH+](C(C)(C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000587979222	354888853	/nfs/dbraw/zinc/88/88/53/354888853.db2.gz	CRQKZXFOEHTEPK-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C[C@H]1C	ZINC000588006067	354892725	/nfs/dbraw/zinc/89/27/25/354892725.db2.gz	PRHHALNBVDCFBU-SNVBAGLBSA-N	1	1	317.349	1.774	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	ZINC000346297772	283062463	/nfs/dbraw/zinc/06/24/63/283062463.db2.gz	PJGCKEOKZKFGMJ-OAHLLOKOSA-N	1	1	307.325	1.902	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H]2C[N@H+](C)C[C@@H]21	ZINC000590011322	355040846	/nfs/dbraw/zinc/04/08/46/355040846.db2.gz	HYVXHWXAYNKYOL-DOMZBBRYSA-N	1	1	318.377	1.478	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000590522887	355107959	/nfs/dbraw/zinc/10/79/59/355107959.db2.gz	DIOAERDSMRAYFP-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000590522887	355107960	/nfs/dbraw/zinc/10/79/60/355107960.db2.gz	DIOAERDSMRAYFP-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cn1c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-]	ZINC000495123616	235128452	/nfs/dbraw/zinc/12/84/52/235128452.db2.gz	VELDELJYKJMJJZ-NWDGAFQWSA-N	1	1	306.366	1.490	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000590402427	355085750	/nfs/dbraw/zinc/08/57/50/355085750.db2.gz	UCFTWWSWWZLAFS-GJZGRUSLSA-N	1	1	319.361	1.530	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000590776513	355176354	/nfs/dbraw/zinc/17/63/54/355176354.db2.gz	GCLFWAPAFFINBM-RISCZKNCSA-N	1	1	305.334	1.136	20	5		DDBDMO
CCCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@H]1CC[N@@H+](C)C1	ZINC000592831715	355706808	/nfs/dbraw/zinc/70/68/08/355706808.db2.gz	NVTPHJANTDJFSQ-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC(C)O[C@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000593055557	355781394	/nfs/dbraw/zinc/78/13/94/355781394.db2.gz	LQBZPPXGOBDPGM-KBPBESRZSA-N	1	1	312.370	1.042	20	5		DDBDMO
CN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000593056962	355782787	/nfs/dbraw/zinc/78/27/87/355782787.db2.gz	BYHRPGHXFXGLCU-CQSZACIVSA-N	1	1	321.352	1.972	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCC[N@@H+](C)CC(C)C)c1[N+](=O)[O-]	ZINC000593757039	355988137	/nfs/dbraw/zinc/98/81/37/355988137.db2.gz	PBJQGVZGNMCWPT-UHFFFAOYSA-N	1	1	311.386	1.588	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000594195395	356136060	/nfs/dbraw/zinc/13/60/60/356136060.db2.gz	GKRZYTBDVXILAL-TZMCWYRMSA-N	1	1	304.350	1.737	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000594617040	356267039	/nfs/dbraw/zinc/26/70/39/356267039.db2.gz	ZLVXERSBHYTLKY-SNVBAGLBSA-N	1	1	308.334	1.711	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000594617040	356267041	/nfs/dbraw/zinc/26/70/41/356267041.db2.gz	ZLVXERSBHYTLKY-SNVBAGLBSA-N	1	1	308.334	1.711	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)c([N+](=O)[O-])s1	ZINC000601338522	358505668	/nfs/dbraw/zinc/50/56/68/358505668.db2.gz	XWMTZKYDPKKUIO-YUMQZZPRSA-N	1	1	319.408	1.336	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(Cn3cncn3)CC2)c1[N+](=O)[O-]	ZINC000595444965	356495268	/nfs/dbraw/zinc/49/52/68/356495268.db2.gz	IAVQGAXSBHGBEA-UHFFFAOYSA-N	1	1	306.326	1.395	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000595446564	356496557	/nfs/dbraw/zinc/49/65/57/356496557.db2.gz	MDDYBXVNNXUSEW-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
Cc1noc(CN2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000595452136	356498277	/nfs/dbraw/zinc/49/82/77/356498277.db2.gz	YHRJQUCHUKEAEL-JTQLQIEISA-N	1	1	312.370	1.168	20	5		DDBDMO
COC[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccco1	ZINC000184630068	199743434	/nfs/dbraw/zinc/74/34/34/199743434.db2.gz	MEPLNKFEUXBJCN-LBPRGKRZSA-N	1	1	307.306	1.327	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC2(COC2)C1	ZINC000595836002	356671638	/nfs/dbraw/zinc/67/16/38/356671638.db2.gz	YBQGMZUSHNLBBS-UHFFFAOYSA-N	1	1	319.361	1.954	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000595825004	356665815	/nfs/dbraw/zinc/66/58/15/356665815.db2.gz	BVEYSDXKDQTYKE-HNNXBMFYSA-N	1	1	320.393	1.825	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000595826498	356665869	/nfs/dbraw/zinc/66/58/69/356665869.db2.gz	ABFDGELDKBEDBR-CHWSQXEVSA-N	1	1	322.361	1.951	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H]4COC[C@H]4C3)nc2c1	ZINC000595827689	356667121	/nfs/dbraw/zinc/66/71/21/356667121.db2.gz	DADYNDDEXCZDIT-GHMZBOCLSA-N	1	1	302.334	1.939	20	5		DDBDMO
Cc1cc(N2CC(C[NH+]3CCOCC3)C2)c(F)cc1[N+](=O)[O-]	ZINC000596239252	356828991	/nfs/dbraw/zinc/82/89/91/356828991.db2.gz	DQDPIWAIKSLADK-UHFFFAOYSA-N	1	1	309.341	1.811	20	5		DDBDMO
CCOc1cc(C[N@@H+]2C[C@@H](OC)[C@@H](OC)C2)ccc1[N+](=O)[O-]	ZINC000276836528	213124117	/nfs/dbraw/zinc/12/41/17/213124117.db2.gz	BQMYTUPANALLHT-GASCZTMLSA-N	1	1	310.350	1.839	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](OC)[C@@H](OC)C2)ccc1[N+](=O)[O-]	ZINC000276836528	213124118	/nfs/dbraw/zinc/12/41/18/213124118.db2.gz	BQMYTUPANALLHT-GASCZTMLSA-N	1	1	310.350	1.839	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)C2(CO)CCOCC2)ccc1[N+](=O)[O-]	ZINC000276830554	213120488	/nfs/dbraw/zinc/12/04/88/213120488.db2.gz	BBHWYPTYKRUGRC-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@@H]1CC[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[NH2+]1	ZINC000599104014	357816534	/nfs/dbraw/zinc/81/65/34/357816534.db2.gz	KWXRKXMUODMBIB-BDAKNGLRSA-N	1	1	317.342	1.153	20	5		DDBDMO
Cn1cc(CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)nn1	ZINC000599338786	357899824	/nfs/dbraw/zinc/89/98/24/357899824.db2.gz	HBBRDYHMGLFCRN-UHFFFAOYSA-N	1	1	301.350	1.930	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599624804	357997450	/nfs/dbraw/zinc/99/74/50/357997450.db2.gz	WSELLIRYEIUORU-WQVCFCJDSA-N	1	1	308.378	1.969	20	5		DDBDMO
Cc1cc(NC(=O)NCC[N@H+]2CC[C@@H](O)C2)ccc1[N+](=O)[O-]	ZINC000599768903	358053670	/nfs/dbraw/zinc/05/36/70/358053670.db2.gz	RCANJDFDSYHLSC-GFCCVEGCSA-N	1	1	308.338	1.091	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600312318	358191814	/nfs/dbraw/zinc/19/18/14/358191814.db2.gz	DZZYAYVHDKHJBU-LLVKDONJSA-N	1	1	323.397	1.903	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600469398	358232103	/nfs/dbraw/zinc/23/21/03/358232103.db2.gz	AOGPSJJDHMVSDC-GFCCVEGCSA-N	1	1	321.381	1.383	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccncc1	ZINC000348130396	283383730	/nfs/dbraw/zinc/38/37/30/283383730.db2.gz	VTIUUDRNUZFUKD-UHFFFAOYSA-N	1	1	302.334	1.674	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000602131707	358835170	/nfs/dbraw/zinc/83/51/70/358835170.db2.gz	GMJOGJJBHNBYIF-LLVKDONJSA-N	1	1	304.350	1.216	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3ccn[nH]3)CC2)cn1	ZINC000602510348	359020444	/nfs/dbraw/zinc/02/04/44/359020444.db2.gz	GYTODZIFHGUBPI-UHFFFAOYSA-N	1	1	302.338	1.472	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000602669472	359115315	/nfs/dbraw/zinc/11/53/15/359115315.db2.gz	XOAODBILAHYYAQ-OLZOCXBDSA-N	1	1	308.382	1.967	20	5		DDBDMO
COCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccco1	ZINC000602763640	359174145	/nfs/dbraw/zinc/17/41/45/359174145.db2.gz	REUDJNDKMQGYFV-UHFFFAOYSA-N	1	1	308.338	1.841	20	5		DDBDMO
COCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccco1	ZINC000602763640	359174149	/nfs/dbraw/zinc/17/41/49/359174149.db2.gz	REUDJNDKMQGYFV-UHFFFAOYSA-N	1	1	308.338	1.841	20	5		DDBDMO
COC(=O)C1C[C@@H](C)[NH+](Cc2cn(C)nc2[N+](=O)[O-])[C@H](C)C1	ZINC000602917528	359294286	/nfs/dbraw/zinc/29/42/86/359294286.db2.gz	LZNZIAUFJCVYAF-NXEZZACHSA-N	1	1	310.354	1.490	20	5		DDBDMO
CCn1nc(C)c(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)c1C	ZINC000602925968	359296980	/nfs/dbraw/zinc/29/69/80/359296980.db2.gz	MHRDIJVKMOJFME-UHFFFAOYSA-N	1	1	306.370	1.757	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@]2(C)C(=O)NC(=O)[C@]2(C)C1	ZINC000602937110	359306504	/nfs/dbraw/zinc/30/65/04/359306504.db2.gz	QIGDTKNJHJIJRX-GTTSAUCSSA-N	1	1	317.345	1.640	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](OC)C[C@@]1(C)CO	ZINC000602964701	359327899	/nfs/dbraw/zinc/32/78/99/359327899.db2.gz	SFVDFVLKXSZJPP-ZFWWWQNUSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](OC)C[C@@]1(C)CO	ZINC000602964701	359327902	/nfs/dbraw/zinc/32/79/02/359327902.db2.gz	SFVDFVLKXSZJPP-ZFWWWQNUSA-N	1	1	310.350	1.575	20	5		DDBDMO
CCN(CC)C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602965909	359329121	/nfs/dbraw/zinc/32/91/21/359329121.db2.gz	QURBLKYQBGXJIO-OAHLLOKOSA-N	1	1	309.366	1.260	20	5		DDBDMO
O=[N+]([O-])c1cc(Cn2cc(C[N@H+]3CCC[C@H]3CO)nn2)cs1	ZINC000603206262	359481090	/nfs/dbraw/zinc/48/10/90/359481090.db2.gz	ONBWHSOTVNMRBB-LBPRGKRZSA-N	1	1	323.378	1.253	20	5		DDBDMO
O=[N+]([O-])c1cc(Cn2cc(C[N@@H+]3CCC[C@H]3CO)nn2)cs1	ZINC000603206262	359481092	/nfs/dbraw/zinc/48/10/92/359481092.db2.gz	ONBWHSOTVNMRBB-LBPRGKRZSA-N	1	1	323.378	1.253	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000187273270	200086823	/nfs/dbraw/zinc/08/68/23/200086823.db2.gz	QOMOFGOVFPBIEH-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000609450185	360307878	/nfs/dbraw/zinc/30/78/78/360307878.db2.gz	HFCHPKKWYYBAGU-LLVKDONJSA-N	1	1	318.377	1.945	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000609450185	360307882	/nfs/dbraw/zinc/30/78/82/360307882.db2.gz	HFCHPKKWYYBAGU-LLVKDONJSA-N	1	1	318.377	1.945	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3cccnc3[N+](=O)[O-])C2)CC1	ZINC000609571063	360326394	/nfs/dbraw/zinc/32/63/94/360326394.db2.gz	MPRYIBUDMAUPJL-GFCCVEGCSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@@H](Nc3cccnc3[N+](=O)[O-])C2)CC1	ZINC000609571063	360326397	/nfs/dbraw/zinc/32/63/97/360326397.db2.gz	MPRYIBUDMAUPJL-GFCCVEGCSA-N	1	1	305.382	1.570	20	5		DDBDMO
CC[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611092337	360621765	/nfs/dbraw/zinc/62/17/65/360621765.db2.gz	QKKQKMQZEULANC-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611092337	360621773	/nfs/dbraw/zinc/62/17/73/360621773.db2.gz	QKKQKMQZEULANC-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611092337	360621779	/nfs/dbraw/zinc/62/17/79/360621779.db2.gz	QKKQKMQZEULANC-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611271426	360685317	/nfs/dbraw/zinc/68/53/17/360685317.db2.gz	GJZJSTUQHPOAAH-NSHDSACASA-N	1	1	308.334	1.834	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@]3(CCOC3)C1)OCCO2	ZINC000611275640	360686859	/nfs/dbraw/zinc/68/68/59/360686859.db2.gz	PMGWRLMSVRSWEQ-INIZCTEOSA-N	1	1	320.345	1.978	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000193690641	201105617	/nfs/dbraw/zinc/10/56/17/201105617.db2.gz	QWMQDBUVFDWWRX-LLVKDONJSA-N	1	1	322.365	1.403	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[NH+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000193674299	201101649	/nfs/dbraw/zinc/10/16/49/201101649.db2.gz	FUGAFMXZTPEWME-UHFFFAOYSA-N	1	1	306.322	1.783	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000275353040	212286586	/nfs/dbraw/zinc/28/65/86/212286586.db2.gz	KDNZTUBVVMWABI-ZJUUUORDSA-N	1	1	315.320	1.764	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000275353040	212286584	/nfs/dbraw/zinc/28/65/84/212286584.db2.gz	KDNZTUBVVMWABI-ZJUUUORDSA-N	1	1	315.320	1.764	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000275022293	212078674	/nfs/dbraw/zinc/07/86/74/212078674.db2.gz	UKWLBCIZJSUHOK-UHFFFAOYSA-N	1	1	316.317	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000275022293	212078677	/nfs/dbraw/zinc/07/86/77/212078677.db2.gz	UKWLBCIZJSUHOK-UHFFFAOYSA-N	1	1	316.317	1.245	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc(OC)c1	ZINC000350732030	284251096	/nfs/dbraw/zinc/25/10/96/284251096.db2.gz	IVCYIICJCGZMBZ-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000264897421	204248237	/nfs/dbraw/zinc/24/82/37/204248237.db2.gz	KXWNIFBZDGRIHN-UHFFFAOYSA-N	1	1	306.366	1.851	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000288496017	220179664	/nfs/dbraw/zinc/17/96/64/220179664.db2.gz	QAFYQCBWQHZQEH-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2csc([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000284653449	218116145	/nfs/dbraw/zinc/11/61/45/218116145.db2.gz	NIYZOBCOGCEVGU-QWRGUYRKSA-N	1	1	313.379	1.447	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000104887604	194050054	/nfs/dbraw/zinc/05/00/54/194050054.db2.gz	HLVKLSXJWZAAEQ-NSHDSACASA-N	1	1	308.382	1.946	20	5		DDBDMO
Cc1c(NC(=O)N2CC[NH+](C[C@H](C)O)CC2)cccc1[N+](=O)[O-]	ZINC000284778124	218173314	/nfs/dbraw/zinc/17/33/14/218173314.db2.gz	QDGMGYXTSXPFBD-NSHDSACASA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000285090719	218287279	/nfs/dbraw/zinc/28/72/79/218287279.db2.gz	DMCBIJLQIVNOMV-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](CO)[C@@H]2CCCO2)c(F)c1	ZINC000352403963	285027775	/nfs/dbraw/zinc/02/77/75/285027775.db2.gz	ZVWOFLRGOOESDQ-OLZOCXBDSA-N	1	1	302.277	1.503	20	5		DDBDMO
CC(C)C[N@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000272982295	210362300	/nfs/dbraw/zinc/36/23/00/210362300.db2.gz	DGZNDPNZSGYPCV-UHFFFAOYSA-N	1	1	300.380	1.956	20	5		DDBDMO
CC(C)C[N@@H+](C)CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000272982295	210362303	/nfs/dbraw/zinc/36/23/03/210362303.db2.gz	DGZNDPNZSGYPCV-UHFFFAOYSA-N	1	1	300.380	1.956	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2cn[nH]c2)CC1	ZINC000298188782	285165879	/nfs/dbraw/zinc/16/58/79/285165879.db2.gz	WQVNKAZHHZMTGT-UHFFFAOYSA-N	1	1	302.338	1.078	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1	ZINC000451341751	285189432	/nfs/dbraw/zinc/18/94/32/285189432.db2.gz	LQYRKOANRNAYGL-RBSFLKMASA-N	1	1	308.382	1.807	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@]3(CNC(=O)C3)C2)ccc1[N+](=O)[O-]	ZINC000352772214	285290192	/nfs/dbraw/zinc/29/01/92/285290192.db2.gz	QEVFHXTYHQHGJV-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
C[C@@H](CO)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000289486959	221011871	/nfs/dbraw/zinc/01/18/71/221011871.db2.gz	RESVVNXATQVARE-NSHDSACASA-N	1	1	304.350	1.808	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000282318096	296517176	/nfs/dbraw/zinc/51/71/76/296517176.db2.gz	TUUXIGVOZKDVGI-CYBMUJFWSA-N	1	1	306.366	1.538	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000013694375	406865932	/nfs/dbraw/zinc/86/59/32/406865932.db2.gz	PNAALWOGUBCTBX-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
CC(C)OC(=O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665349	406884279	/nfs/dbraw/zinc/88/42/79/406884279.db2.gz	ONFNCDJTVUTWMG-LBPRGKRZSA-N	1	1	322.365	1.818	20	5		DDBDMO
CN(C(=O)C[N@H+](C)C[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1	ZINC000076299276	406962292	/nfs/dbraw/zinc/96/22/92/406962292.db2.gz	RICJNQHBPFZCQZ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1	ZINC000076299276	406962295	/nfs/dbraw/zinc/96/22/95/406962295.db2.gz	RICJNQHBPFZCQZ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000051556034	407141454	/nfs/dbraw/zinc/14/14/54/407141454.db2.gz	AAESGRFUUFXDJT-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000123323789	407325638	/nfs/dbraw/zinc/32/56/38/407325638.db2.gz	QWGILHCXAKEIEZ-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
COCCC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000067378313	407272058	/nfs/dbraw/zinc/27/20/58/407272058.db2.gz	SQEBOBXQAWEDOZ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
O=C(C[N@@H+](CCO)C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000067965716	407291751	/nfs/dbraw/zinc/29/17/51/407291751.db2.gz	STKCBWWPUNRETE-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
O=C(C[N@H+](CCO)C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000067965716	407291752	/nfs/dbraw/zinc/29/17/52/407291752.db2.gz	STKCBWWPUNRETE-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)C1CCCC1	ZINC000103716578	407343155	/nfs/dbraw/zinc/34/31/55/407343155.db2.gz	GGCIINZREOPYSJ-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000124134955	407349733	/nfs/dbraw/zinc/34/97/33/407349733.db2.gz	VBHZHDNBKSZFOV-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000124134955	407349735	/nfs/dbraw/zinc/34/97/35/407349735.db2.gz	VBHZHDNBKSZFOV-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@H](C[S@@](C)=O)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000126469399	407414011	/nfs/dbraw/zinc/41/40/11/407414011.db2.gz	LLGLWCJQYKMWLV-YBTHPKLGSA-N	1	1	300.380	1.672	20	5		DDBDMO
CC1(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC[NH2+]CC1	ZINC000261626989	407557667	/nfs/dbraw/zinc/55/76/67/407557667.db2.gz	HGHUXKJXVFSIJK-UHFFFAOYSA-N	1	1	317.342	1.154	20	5		DDBDMO
C[C@@H](CCN1CCN(C)CC1)[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC000185881738	407528712	/nfs/dbraw/zinc/52/87/12/407528712.db2.gz	AOZMVZGJULSKNE-AWEZNQCLSA-N	1	1	306.410	1.710	20	5		DDBDMO
CCc1ccc(C(=O)N[C@@H]2CC[N@@H+](CCOC)C2)cc1[N+](=O)[O-]	ZINC000266873076	407657483	/nfs/dbraw/zinc/65/74/83/407657483.db2.gz	ANLYUSRQTIDWTK-CQSZACIVSA-N	1	1	321.377	1.608	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H](C)[NH2+]1	ZINC000130948235	407714751	/nfs/dbraw/zinc/71/47/51/407714751.db2.gz	QYDVNICIAQGITE-QWRGUYRKSA-N	1	1	313.379	1.107	20	5		DDBDMO
COc1cc(C(=O)N(C)CC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000186727994	407759136	/nfs/dbraw/zinc/75/91/36/407759136.db2.gz	NJWRTOXASMQMKI-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000116891063	407792923	/nfs/dbraw/zinc/79/29/23/407792923.db2.gz	VXMYHPBLYAPWAB-PWSUYJOCSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000116891063	407792931	/nfs/dbraw/zinc/79/29/31/407792931.db2.gz	VXMYHPBLYAPWAB-PWSUYJOCSA-N	1	1	313.379	1.279	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CCN1CC(F)F	ZINC000153588820	407858390	/nfs/dbraw/zinc/85/83/90/407858390.db2.gz	ICTNTRPPDPOREL-NSHDSACASA-N	1	1	317.340	1.453	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CCN1CC(F)F	ZINC000153588820	407858398	/nfs/dbraw/zinc/85/83/98/407858398.db2.gz	ICTNTRPPDPOREL-NSHDSACASA-N	1	1	317.340	1.453	20	5		DDBDMO
Cc1cc(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000153623185	407865164	/nfs/dbraw/zinc/86/51/64/407865164.db2.gz	KZRKFLOZAOBYCW-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cc(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000153623185	407865170	/nfs/dbraw/zinc/86/51/70/407865170.db2.gz	KZRKFLOZAOBYCW-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000268248150	407967353	/nfs/dbraw/zinc/96/73/53/407967353.db2.gz	WKVDDGCYFPWOSJ-XHDPSFHLSA-N	1	1	303.362	1.736	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000153962843	407942298	/nfs/dbraw/zinc/94/22/98/407942298.db2.gz	TZMOLVKYLBOCPY-OAHLLOKOSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000245639002	408032612	/nfs/dbraw/zinc/03/26/12/408032612.db2.gz	ARJHYFJUWAIJNK-MXWKQRLJSA-N	1	1	309.370	1.414	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC2([NH+](C)C)CCC2)c1[N+](=O)[O-]	ZINC000189523763	408041010	/nfs/dbraw/zinc/04/10/10/408041010.db2.gz	VPMYDOKITGTKFJ-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000154790389	408085013	/nfs/dbraw/zinc/08/50/13/408085013.db2.gz	FHNPWBRMICQDSH-NSHDSACASA-N	1	1	322.365	1.380	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1	ZINC000151126250	408262696	/nfs/dbraw/zinc/26/26/96/408262696.db2.gz	LFIJQUXASUMZDR-CYBMUJFWSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176225434	408316133	/nfs/dbraw/zinc/31/61/33/408316133.db2.gz	XWQBMPHZOWHVEN-ZDUSSCGKSA-N	1	1	323.397	1.276	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000269459838	408316675	/nfs/dbraw/zinc/31/66/75/408316675.db2.gz	HMGNVBZGGJFJQY-NXEZZACHSA-N	1	1	321.381	1.796	20	5		DDBDMO
O=C(C[NH2+][C@H](CO)c1ccccc1)Nc1ccccc1[N+](=O)[O-]	ZINC000182898416	408278615	/nfs/dbraw/zinc/27/86/15/408278615.db2.gz	QKBXPONARBPNJK-CQSZACIVSA-N	1	1	315.329	1.857	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000246545897	408289702	/nfs/dbraw/zinc/28/97/02/408289702.db2.gz	QMPVBLWYBQFYSK-JQWIXIFHSA-N	1	1	304.350	1.486	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000269406773	408297163	/nfs/dbraw/zinc/29/71/63/408297163.db2.gz	UQYMYKWVCLDNDH-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000269412474	408299018	/nfs/dbraw/zinc/29/90/18/408299018.db2.gz	VSBDKUSWYQDCLU-LLVKDONJSA-N	1	1	323.397	1.903	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269621935	408363912	/nfs/dbraw/zinc/36/39/12/408363912.db2.gz	BJCXZGMPKCVCEE-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269621935	408363917	/nfs/dbraw/zinc/36/39/17/408363917.db2.gz	BJCXZGMPKCVCEE-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000176943927	408482502	/nfs/dbraw/zinc/48/25/02/408482502.db2.gz	OYOLABUSISJQGD-NSHDSACASA-N	1	1	323.397	1.588	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000264404878	408477054	/nfs/dbraw/zinc/47/70/54/408477054.db2.gz	FJQKKONJSBSPPN-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248459347	408572286	/nfs/dbraw/zinc/57/22/86/408572286.db2.gz	NNXLKUZEMWOHGU-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCOC1	ZINC000248462286	408574746	/nfs/dbraw/zinc/57/47/46/408574746.db2.gz	PTSJNEOHNTWFTD-ZIAGYGMSSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000265228344	408583663	/nfs/dbraw/zinc/58/36/63/408583663.db2.gz	QDTSMRWHICWHRK-UHFFFAOYSA-N	1	1	307.394	1.873	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)CCNc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000192476902	408595806	/nfs/dbraw/zinc/59/58/06/408595806.db2.gz	ZOJUXMBVQQVKHQ-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC000270470375	408541325	/nfs/dbraw/zinc/54/13/25/408541325.db2.gz	HKMLFYIKCRYTOE-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000248837352	408644649	/nfs/dbraw/zinc/64/46/49/408644649.db2.gz	OQQUABFCAZSULY-RYUDHWBXSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000162670374	408726369	/nfs/dbraw/zinc/72/63/69/408726369.db2.gz	WGGAEJYSPPVETO-PWSUYJOCSA-N	1	1	319.365	1.407	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249558773	408742879	/nfs/dbraw/zinc/74/28/79/408742879.db2.gz	KVSLQAPEGLWDSI-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249558773	408742882	/nfs/dbraw/zinc/74/28/82/408742882.db2.gz	KVSLQAPEGLWDSI-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1O	ZINC000270839075	408701656	/nfs/dbraw/zinc/70/16/56/408701656.db2.gz	DUBCZFTUOQZMBS-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1O	ZINC000249599045	408749319	/nfs/dbraw/zinc/74/93/19/408749319.db2.gz	XQKFUJGWWZLFAB-KYOSRNDESA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@](C)(O)C1	ZINC000177983933	408750564	/nfs/dbraw/zinc/75/05/64/408750564.db2.gz	RPJIKRUQQIEKCB-MEBBXXQBSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@](C)(O)C1	ZINC000177983933	408750572	/nfs/dbraw/zinc/75/05/72/408750572.db2.gz	RPJIKRUQQIEKCB-MEBBXXQBSA-N	1	1	323.349	1.387	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC(F)(F)[C@H](CO)C2)c1	ZINC000291749667	408916972	/nfs/dbraw/zinc/91/69/72/408916972.db2.gz	KLEZNGPASRVKMM-AAEUAGOBSA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC(F)(F)[C@H](CO)C2)c1	ZINC000291749667	408916974	/nfs/dbraw/zinc/91/69/74/408916974.db2.gz	KLEZNGPASRVKMM-AAEUAGOBSA-N	1	1	316.304	1.578	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C2)C1	ZINC000292058286	408971666	/nfs/dbraw/zinc/97/16/66/408971666.db2.gz	APDXXZVHVVEUPZ-OAHLLOKOSA-N	1	1	307.325	1.902	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000286428200	408982938	/nfs/dbraw/zinc/98/29/38/408982938.db2.gz	IRGUNVOBFGSNHB-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCC(N)=O	ZINC000286434915	408984380	/nfs/dbraw/zinc/98/43/80/408984380.db2.gz	LHWXRVXXKUXLGX-UHFFFAOYSA-N	1	1	308.338	1.039	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000277693891	408992923	/nfs/dbraw/zinc/99/29/23/408992923.db2.gz	ZWTCOLWLEMLUKP-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
C[C@@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000293331378	409091305	/nfs/dbraw/zinc/09/13/05/409091305.db2.gz	GNSGIIAPTLFDFG-GUTXKFCHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)N1C	ZINC000293331378	409091308	/nfs/dbraw/zinc/09/13/08/409091308.db2.gz	GNSGIIAPTLFDFG-GUTXKFCHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)N1C	ZINC000293331378	409091311	/nfs/dbraw/zinc/09/13/11/409091311.db2.gz	GNSGIIAPTLFDFG-GUTXKFCHSA-N	1	1	323.393	1.359	20	5		DDBDMO
COCCOCC[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000289035351	409210814	/nfs/dbraw/zinc/21/08/14/409210814.db2.gz	PFCBZVXAVAJBGW-UHFFFAOYSA-N	1	1	316.329	1.837	20	5		DDBDMO
COCCOCC[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000289035351	409210817	/nfs/dbraw/zinc/21/08/17/409210817.db2.gz	PFCBZVXAVAJBGW-UHFFFAOYSA-N	1	1	316.329	1.837	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000290185282	409315451	/nfs/dbraw/zinc/31/54/51/409315451.db2.gz	RHLRGAHFVFGAOM-UHFFFAOYSA-N	1	1	322.409	1.137	20	5		DDBDMO
CN(CCCNC(=O)Cc1cccc([N+](=O)[O-])c1)CC[NH+](C)C	ZINC000290185282	409315452	/nfs/dbraw/zinc/31/54/52/409315452.db2.gz	RHLRGAHFVFGAOM-UHFFFAOYSA-N	1	1	322.409	1.137	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH2+]C[C@](C)(F)C2)c1[N+](=O)[O-]	ZINC000295221627	409382716	/nfs/dbraw/zinc/38/27/16/409382716.db2.gz	MTWNCPNVCUMRFO-ZDUSSCGKSA-N	1	1	313.333	1.044	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)c1[N+](=O)[O-]	ZINC000295221627	409382720	/nfs/dbraw/zinc/38/27/20/409382720.db2.gz	MTWNCPNVCUMRFO-ZDUSSCGKSA-N	1	1	313.333	1.044	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290624886	409466656	/nfs/dbraw/zinc/46/66/56/409466656.db2.gz	LVNWSEMRXUOHKJ-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1(O)CCC1	ZINC000353484957	164123487	/nfs/dbraw/zinc/12/34/87/164123487.db2.gz	LJBQFBFIFMFONE-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1(O)CCC1	ZINC000353484957	164123489	/nfs/dbraw/zinc/12/34/89/164123489.db2.gz	LJBQFBFIFMFONE-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CN1CC[NH+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CC1	ZINC000296240637	409475151	/nfs/dbraw/zinc/47/51/51/409475151.db2.gz	FFRINMICMXKBCD-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
C[C@@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000342346037	409582085	/nfs/dbraw/zinc/58/20/85/409582085.db2.gz	HQINPSLYZLQCFW-NSHDSACASA-N	1	1	322.365	1.074	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000348928387	409595507	/nfs/dbraw/zinc/59/55/07/409595507.db2.gz	PZTJFUSTZUQMMZ-UHFFFAOYSA-N	1	1	324.381	1.567	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)CC[C@H]1C	ZINC000354006986	409595750	/nfs/dbraw/zinc/59/57/50/409595750.db2.gz	OFVGNGXVFMHWQK-LLVKDONJSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000331533974	409611221	/nfs/dbraw/zinc/61/12/21/409611221.db2.gz	POWVGFFLXBATOO-NOZJJQNGSA-N	1	1	307.325	1.946	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000356853678	409664617	/nfs/dbraw/zinc/66/46/17/409664617.db2.gz	OCQLLPAPJFTRSG-RYUDHWBXSA-N	1	1	307.350	1.525	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000324105240	409921900	/nfs/dbraw/zinc/92/19/00/409921900.db2.gz	JUGGCXKZCCFSMY-CQSZACIVSA-N	1	1	319.365	1.554	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357425033	410033544	/nfs/dbraw/zinc/03/35/44/410033544.db2.gz	RNABGSZGIMXGOO-CHWSQXEVSA-N	1	1	321.377	1.963	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CCC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000357682298	410185388	/nfs/dbraw/zinc/18/53/88/410185388.db2.gz	KERITXAMEGWMQK-ONGXEEELSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[C@H]([NH3+])[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000351753341	410210071	/nfs/dbraw/zinc/21/00/71/410210071.db2.gz	FDSJLQOFXHIFOL-DTWKUNHWSA-N	1	1	303.322	1.280	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CCC[N@@H+](C)CC1	ZINC000298912125	410447129	/nfs/dbraw/zinc/44/71/29/410447129.db2.gz	DECASMGLPXAVHK-UHFFFAOYSA-N	1	1	322.365	1.451	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000347387460	410515141	/nfs/dbraw/zinc/51/51/41/410515141.db2.gz	ZWBCDWJGGLZYMM-IPJDOKCGSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN(CCO)[C@@H](C)C1	ZINC000347387460	410515152	/nfs/dbraw/zinc/51/51/52/410515152.db2.gz	ZWBCDWJGGLZYMM-IPJDOKCGSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCN(CCO)[C@@H](C)C1	ZINC000347387460	410515157	/nfs/dbraw/zinc/51/51/57/410515157.db2.gz	ZWBCDWJGGLZYMM-IPJDOKCGSA-N	1	1	319.405	1.997	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000352185436	410529916	/nfs/dbraw/zinc/52/99/16/410529916.db2.gz	CJMXVBAGUNIJFI-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1CO[C@H](CO)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243511	410670077	/nfs/dbraw/zinc/67/00/77/410670077.db2.gz	HGVHLLITUISMBA-RYUDHWBXSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1CO[C@H](CO)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243511	410670081	/nfs/dbraw/zinc/67/00/81/410670081.db2.gz	HGVHLLITUISMBA-RYUDHWBXSA-N	1	1	323.349	1.005	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@H]3CCC[NH2+]3)CC2)c1[N+](=O)[O-]	ZINC000353068157	410767345	/nfs/dbraw/zinc/76/73/45/410767345.db2.gz	QMQOSLPKSVOLQB-LLVKDONJSA-N	1	1	307.354	1.231	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)CC2(C)C)c(C)c1[N+](=O)[O-]	ZINC000330580962	410797607	/nfs/dbraw/zinc/79/76/07/410797607.db2.gz	UAZQNBHMFTXHLT-UHFFFAOYSA-N	1	1	323.397	1.351	20	5		DDBDMO
COc1cc(N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935489	410832894	/nfs/dbraw/zinc/83/28/94/410832894.db2.gz	RLDRMVVBQWTPIS-OTYXRUKQSA-N	1	1	313.329	1.874	20	5		DDBDMO
COc1cc(N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935489	410832909	/nfs/dbraw/zinc/83/29/09/410832909.db2.gz	RLDRMVVBQWTPIS-OTYXRUKQSA-N	1	1	313.329	1.874	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)CC[N@H+]1CCO	ZINC000302397745	410842893	/nfs/dbraw/zinc/84/28/93/410842893.db2.gz	JJDSQMJWOUWVMY-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000330649746	410851644	/nfs/dbraw/zinc/85/16/44/410851644.db2.gz	JELPDOFQFIXSMW-UXIGCNINSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000330667350	410862192	/nfs/dbraw/zinc/86/21/92/410862192.db2.gz	IUQOJZKRNTXDDC-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000330667350	410862195	/nfs/dbraw/zinc/86/21/95/410862195.db2.gz	IUQOJZKRNTXDDC-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000330667350	410862202	/nfs/dbraw/zinc/86/22/02/410862202.db2.gz	IUQOJZKRNTXDDC-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](C)c1cnn(C)c1	ZINC000348307509	410908858	/nfs/dbraw/zinc/90/88/58/410908858.db2.gz	MARAAYRSUFFCHK-LLVKDONJSA-N	1	1	317.349	1.926	20	5		DDBDMO
Cc1nn(CCC(=O)NCC[N@@H+]2CC=CCC2)c(C)c1[N+](=O)[O-]	ZINC000348356593	410932455	/nfs/dbraw/zinc/93/24/55/410932455.db2.gz	ZQFQOJXNCBZXOR-UHFFFAOYSA-N	1	1	321.381	1.176	20	5		DDBDMO
Cc1c(CNC(=O)[C@H](C)[NH+]2CCSCC2)cccc1[N+](=O)[O-]	ZINC000331105410	410950059	/nfs/dbraw/zinc/95/00/59/410950059.db2.gz	GFBWXTTURJJWMJ-LBPRGKRZSA-N	1	1	323.418	1.957	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000331113755	410956688	/nfs/dbraw/zinc/95/66/88/410956688.db2.gz	JKJYWGGVMMUSOP-VIFPVBQESA-N	1	1	313.304	1.578	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000331113755	410956690	/nfs/dbraw/zinc/95/66/90/410956690.db2.gz	JKJYWGGVMMUSOP-VIFPVBQESA-N	1	1	313.304	1.578	20	5		DDBDMO
COCCOCC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000344113320	410963381	/nfs/dbraw/zinc/96/33/81/410963381.db2.gz	LXHIQWZEGRWDKE-UHFFFAOYSA-N	1	1	308.338	1.566	20	5		DDBDMO
COCCOCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000344113320	410963385	/nfs/dbraw/zinc/96/33/85/410963385.db2.gz	LXHIQWZEGRWDKE-UHFFFAOYSA-N	1	1	308.338	1.566	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000344133176	410979068	/nfs/dbraw/zinc/97/90/68/410979068.db2.gz	PVXWHSINWAOKJG-MCIONIFRSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@H]1n1ccnc1	ZINC000129820508	196078131	/nfs/dbraw/zinc/07/81/31/196078131.db2.gz	DBNCRLPUSOSBBL-STQMWFEESA-N	1	1	304.354	1.571	20	5		DDBDMO
C[C@H](NC(=O)N1CC[NH2+]C[C@](C)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000417140702	225222755	/nfs/dbraw/zinc/22/27/55/225222755.db2.gz	QJVVFHKGURGKJK-NHYWBVRUSA-N	1	1	324.356	1.999	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000373795776	418459760	/nfs/dbraw/zinc/45/97/60/418459760.db2.gz	GCQQIUNHGYKOJF-HNNXBMFYSA-N	1	1	324.381	1.451	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](CCOC)[C@H](C)C1	ZINC000192568326	418523591	/nfs/dbraw/zinc/52/35/91/418523591.db2.gz	UIZOSUXAAVFQQE-LLVKDONJSA-N	1	1	311.386	1.277	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](CCOC)[C@H](C)C1	ZINC000192568326	418523594	/nfs/dbraw/zinc/52/35/94/418523594.db2.gz	UIZOSUXAAVFQQE-LLVKDONJSA-N	1	1	311.386	1.277	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@H](Nc3ncccc3[N+](=O)[O-])C2)CC1	ZINC000361029341	418569802	/nfs/dbraw/zinc/56/98/02/418569802.db2.gz	AOUGICQIIVVVPA-LBPRGKRZSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3ncccc3[N+](=O)[O-])C2)CC1	ZINC000361029341	418569805	/nfs/dbraw/zinc/56/98/05/418569805.db2.gz	AOUGICQIIVVVPA-LBPRGKRZSA-N	1	1	305.382	1.570	20	5		DDBDMO
COc1ccc(CN[C@@H]2CCOC[C@@H]2[C@@H](C)[NH3+])cc1[N+](=O)[O-]	ZINC000422945645	227273719	/nfs/dbraw/zinc/27/37/19/227273719.db2.gz	NOEDKENZSZCAOH-RAIGVLPGSA-N	1	1	309.366	1.445	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@@H]21	ZINC000371559691	418800835	/nfs/dbraw/zinc/80/08/35/418800835.db2.gz	AHDIACKQTAIOBH-MFKMUULPSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000420930641	419361386	/nfs/dbraw/zinc/36/13/86/419361386.db2.gz	CRRPVFNDTKNSIB-STQMWFEESA-N	1	1	321.377	1.874	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411745431	419396198	/nfs/dbraw/zinc/39/61/98/419396198.db2.gz	MFXWUPZIRWMTAL-CYBMUJFWSA-N	1	1	307.350	1.769	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@@H](NC(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000420956239	419384271	/nfs/dbraw/zinc/38/42/71/419384271.db2.gz	MVCCUFBUUAUBEJ-CYBMUJFWSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](NC(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000420956239	419384278	/nfs/dbraw/zinc/38/42/78/419384278.db2.gz	MVCCUFBUUAUBEJ-CYBMUJFWSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000420993405	419429509	/nfs/dbraw/zinc/42/95/09/419429509.db2.gz	ATBYJVMNQOVPLL-DOMZBBRYSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000412029096	419575195	/nfs/dbraw/zinc/57/51/95/419575195.db2.gz	COODFZNKXOBVAJ-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000412029096	419575200	/nfs/dbraw/zinc/57/52/00/419575200.db2.gz	COODFZNKXOBVAJ-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@H](NC(=O)N1CC[NH2+]C[C@](C)(F)C1)c1ccc([N+](=O)[O-])cc1	ZINC000418228602	419631201	/nfs/dbraw/zinc/63/12/01/419631201.db2.gz	FAZSUIHYJXBKST-NHYWBVRUSA-N	1	1	324.356	1.999	20	5		DDBDMO
COC[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCO1	ZINC000434790408	229332631	/nfs/dbraw/zinc/33/26/31/229332631.db2.gz	UJXFIFFABINDMG-ZIAGYGMSSA-N	1	1	320.349	1.755	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000430971484	420227805	/nfs/dbraw/zinc/22/78/05/420227805.db2.gz	NNOWZNOXHUSDNJ-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[NH2+]C[C@H]2c2ccccc2)c1[N+](=O)[O-]	ZINC000423992481	420296637	/nfs/dbraw/zinc/29/66/37/420296637.db2.gz	GFTFMJOCCDTLAD-LBPRGKRZSA-N	1	1	315.333	1.413	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000457072505	420602398	/nfs/dbraw/zinc/60/23/98/420602398.db2.gz	IYUORHMWUCSNGH-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CCCC2(C)C)ccc1[N+](=O)[O-]	ZINC000457057173	420598226	/nfs/dbraw/zinc/59/82/26/420598226.db2.gz	MQLYYRCIGNJCGB-UHFFFAOYSA-N	1	1	321.381	1.636	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000440960648	420621730	/nfs/dbraw/zinc/62/17/30/420621730.db2.gz	RSDNCQPTSUYMEF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000440960648	420621734	/nfs/dbraw/zinc/62/17/34/420621734.db2.gz	RSDNCQPTSUYMEF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC[NH3+])C1	ZINC000443065896	420741368	/nfs/dbraw/zinc/74/13/68/420741368.db2.gz	CRPMLZFNSRDGPR-QWHCGFSZSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)C1	ZINC000493046673	420743651	/nfs/dbraw/zinc/74/36/51/420743651.db2.gz	KJVNOAOTUOMQJW-LLYBFZRZSA-N	1	1	307.325	1.768	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000454747709	420918807	/nfs/dbraw/zinc/91/88/07/420918807.db2.gz	CAXAUMQMJWENAA-CMPLNLGQSA-N	1	1	319.365	1.388	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](CCO)C[C@@H]1C	ZINC000455200298	420981737	/nfs/dbraw/zinc/98/17/37/420981737.db2.gz	VJMGOEJDVFQUJN-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](CCO)C[C@@H]1C	ZINC000455200298	420981740	/nfs/dbraw/zinc/98/17/40/420981740.db2.gz	VJMGOEJDVFQUJN-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(N)=O)c1ccccn1	ZINC000449364563	420999283	/nfs/dbraw/zinc/99/92/83/420999283.db2.gz	SHYAZWFTNGFCJI-XHDPSFHLSA-N	1	1	314.345	1.737	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC(=O)N(CC)C1	ZINC000449518210	421019477	/nfs/dbraw/zinc/01/94/77/421019477.db2.gz	NDFXXICYJBYOEQ-GFCCVEGCSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000449536579	421024322	/nfs/dbraw/zinc/02/43/22/421024322.db2.gz	FMDMPXJEPMOXPD-LAMLHYTJSA-N	1	1	319.405	1.995	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c1	ZINC000456217698	421124402	/nfs/dbraw/zinc/12/44/02/421124402.db2.gz	XXPKMEIHSUCUBX-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)c1	ZINC000456217698	421124404	/nfs/dbraw/zinc/12/44/04/421124404.db2.gz	XXPKMEIHSUCUBX-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000455879217	421072751	/nfs/dbraw/zinc/07/27/51/421072751.db2.gz	CBBPRZDXJQOUEJ-NXEZZACHSA-N	1	1	319.365	1.387	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000456335301	421144203	/nfs/dbraw/zinc/14/42/03/421144203.db2.gz	AJDZELPTNPCLNK-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456357979	421149556	/nfs/dbraw/zinc/14/95/56/421149556.db2.gz	STPCNWPTICWYJX-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
C[NH+]1CCN(CCC(C)(C)Nc2ccc([N+](=O)[O-])nc2)CC1	ZINC000450459825	421200271	/nfs/dbraw/zinc/20/02/71/421200271.db2.gz	LUGCEDAXKXMZBB-UHFFFAOYSA-N	1	1	307.398	1.818	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000562927002	421426994	/nfs/dbraw/zinc/42/69/94/421426994.db2.gz	ZRVNHMVCPJJIDQ-LLVKDONJSA-N	1	1	306.366	1.836	20	5		DDBDMO
Nc1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)ccn1	ZINC000555512389	421680182	/nfs/dbraw/zinc/68/01/82/421680182.db2.gz	JXVHWAGXLIUUBR-UHFFFAOYSA-N	1	1	314.349	1.289	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C(C)(C)C1	ZINC000556804198	421739654	/nfs/dbraw/zinc/73/96/54/421739654.db2.gz	BYBBAIHVWASHOZ-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C(C)(C)C1	ZINC000556804198	421739655	/nfs/dbraw/zinc/73/96/55/421739655.db2.gz	BYBBAIHVWASHOZ-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000558756535	421824858	/nfs/dbraw/zinc/82/48/58/421824858.db2.gz	GRAONBGMRCDRHV-QWHCGFSZSA-N	1	1	315.333	1.146	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000521300910	421780401	/nfs/dbraw/zinc/78/04/01/421780401.db2.gz	GKEIASKKCOPTKE-AWEZNQCLSA-N	1	1	305.378	1.998	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000521839200	421800915	/nfs/dbraw/zinc/80/09/15/421800915.db2.gz	QMIIWNPEQWXBOE-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000521839200	421800916	/nfs/dbraw/zinc/80/09/16/421800916.db2.gz	QMIIWNPEQWXBOE-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000114726426	263337683	/nfs/dbraw/zinc/33/76/83/263337683.db2.gz	CLRAUQLTURPLIU-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000114726426	263337687	/nfs/dbraw/zinc/33/76/87/263337687.db2.gz	CLRAUQLTURPLIU-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
COCC[NH+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1	ZINC000291587988	274030005	/nfs/dbraw/zinc/03/00/05/274030005.db2.gz	HDVYPIZCMTXLLX-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000079385182	274037266	/nfs/dbraw/zinc/03/72/66/274037266.db2.gz	CNDAYPGLPHEOSU-UHFFFAOYSA-N	1	1	309.366	1.380	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1(C(N)=O)CCCC1	ZINC000430208339	274099557	/nfs/dbraw/zinc/09/95/57/274099557.db2.gz	UONWDQNGTMTZPX-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1(C(N)=O)CCCC1	ZINC000430208339	274099559	/nfs/dbraw/zinc/09/95/59/274099559.db2.gz	UONWDQNGTMTZPX-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000193822702	276178899	/nfs/dbraw/zinc/17/88/99/276178899.db2.gz	GZJMJBOTALXQPC-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000193822702	276178900	/nfs/dbraw/zinc/17/89/00/276178900.db2.gz	GZJMJBOTALXQPC-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4cc([N+](=O)[O-])ccc4n3)C[C@H]21	ZINC000301658148	277131361	/nfs/dbraw/zinc/13/13/61/277131361.db2.gz	LTIMTAYWLLBBPA-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C(C)(C)C(=O)N(C)C	ZINC000114458659	281074895	/nfs/dbraw/zinc/07/48/95/281074895.db2.gz	QSRIHRVNNHPCCY-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000122604867	281158899	/nfs/dbraw/zinc/15/88/99/281158899.db2.gz	OUCRHFDGFCBMEJ-OAHLLOKOSA-N	1	1	318.377	1.757	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000152092123	281718448	/nfs/dbraw/zinc/71/84/48/281718448.db2.gz	XUTVJHJJODOXNK-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
CC(C)[NH2+]C1(CO)CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000573016695	304570359	/nfs/dbraw/zinc/57/03/59/304570359.db2.gz	ZHWORCGXUGBPLZ-UHFFFAOYSA-N	1	1	323.393	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362096546	300004018	/nfs/dbraw/zinc/00/40/18/300004018.db2.gz	MWQTVAKGOCOSDS-GRYCIOLGSA-N	1	1	307.350	1.482	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000362718786	300122205	/nfs/dbraw/zinc/12/22/05/300122205.db2.gz	BJRFOMPVGFFEQN-QWHCGFSZSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000362718786	300122206	/nfs/dbraw/zinc/12/22/06/300122206.db2.gz	BJRFOMPVGFFEQN-QWHCGFSZSA-N	1	1	319.361	1.578	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000368953014	301109457	/nfs/dbraw/zinc/10/94/57/301109457.db2.gz	ZGWFQIKJCFYHNR-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
Cc1c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cccc1[N+](=O)[O-]	ZINC000368976267	301115717	/nfs/dbraw/zinc/11/57/17/301115717.db2.gz	VGECAVZOBQBKCJ-GUTXKFCHSA-N	1	1	303.362	1.989	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000368976929	301115988	/nfs/dbraw/zinc/11/59/88/301115988.db2.gz	ZVOQIXYJCRFJCJ-ATGSNQNLSA-N	1	1	319.361	1.214	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1	ZINC000376501003	302085648	/nfs/dbraw/zinc/08/56/48/302085648.db2.gz	NEWDPVPLOCRQIT-UHFFFAOYSA-N	1	1	307.354	1.361	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000538714003	303389991	/nfs/dbraw/zinc/38/99/91/303389991.db2.gz	GFVUDZNREXXXAJ-NHYWBVRUSA-N	1	1	318.377	1.803	20	5		DDBDMO
Cc1cc(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)ncc1[N+](=O)[O-]	ZINC000364887495	307052406	/nfs/dbraw/zinc/05/24/06/307052406.db2.gz	JEHNEPJRDCNOHA-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1cc(N[C@@H]2CCN(C3CC[NH+](C)CC3)C2)ncc1[N+](=O)[O-]	ZINC000364887495	307052407	/nfs/dbraw/zinc/05/24/07/307052407.db2.gz	JEHNEPJRDCNOHA-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000364894535	307052803	/nfs/dbraw/zinc/05/28/03/307052803.db2.gz	KJRYQMPIIXWBNE-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
COc1cccc(N2CCC[N@H+]([C@@H](C)CO)CC2)c1[N+](=O)[O-]	ZINC000364976289	307055679	/nfs/dbraw/zinc/05/56/79/307055679.db2.gz	DNDLKTBZEIFXGP-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1	ZINC000370997932	307140201	/nfs/dbraw/zinc/14/02/01/307140201.db2.gz	KLUGQRORYKFZAE-CSOLROPVSA-N	1	1	306.362	1.721	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@H]12	ZINC000377683740	307275796	/nfs/dbraw/zinc/27/57/96/307275796.db2.gz	UZVIEAWEUMLMOZ-RYUDHWBXSA-N	1	1	305.334	1.042	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H](c3nnc[nH]3)C2)c1	ZINC000377988177	307279705	/nfs/dbraw/zinc/27/97/05/307279705.db2.gz	JNRZXPBBYFVXEG-GFCCVEGCSA-N	1	1	317.349	1.971	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@@H+](CC=Cc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000570112889	308158998	/nfs/dbraw/zinc/15/89/98/308158998.db2.gz	KLZREBRAKKDVSR-CWNOIDMWSA-N	1	1	316.361	1.706	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@H+](CC=Cc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000570112889	308159000	/nfs/dbraw/zinc/15/90/00/308159000.db2.gz	KLZREBRAKKDVSR-CWNOIDMWSA-N	1	1	316.361	1.706	20	5		DDBDMO
CNc1ccc(C(=O)NCC[NH+]2CCSCC2)cc1[N+](=O)[O-]	ZINC000389117673	325774120	/nfs/dbraw/zinc/77/41/20/325774120.db2.gz	OAPYLOCDOKAASJ-UHFFFAOYSA-N	1	1	324.406	1.415	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H](CO)COC(C)C)ccc1[N+](=O)[O-]	ZINC000433162281	533794479	/nfs/dbraw/zinc/79/44/79/533794479.db2.gz	UEBRZSPUVKBCRH-CYBMUJFWSA-N	1	1	312.366	1.821	20	5		DDBDMO
CCO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000451546095	527764177	/nfs/dbraw/zinc/76/41/77/527764177.db2.gz	RUWREUVSSJMUOK-XHDPSFHLSA-N	1	1	321.377	1.941	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000490294145	528737493	/nfs/dbraw/zinc/73/74/93/528737493.db2.gz	ZKUYPJUEFUNPMX-LBPRGKRZSA-N	1	1	308.338	1.108	20	5		DDBDMO
CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](C)CO	ZINC000292861306	528890759	/nfs/dbraw/zinc/89/07/59/528890759.db2.gz	AFYSJANYDQVGNK-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](C)CO	ZINC000292861306	528890762	/nfs/dbraw/zinc/89/07/62/528890762.db2.gz	AFYSJANYDQVGNK-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CCN(CC)C(=O)[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000174860233	535470212	/nfs/dbraw/zinc/47/02/12/535470212.db2.gz	NUVNTLBBUXAJDB-CYBMUJFWSA-N	1	1	309.370	1.124	20	5		DDBDMO
CC[N@@H+]1C[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@@H](C)C1	ZINC000821242876	606732150	/nfs/dbraw/zinc/73/21/50/606732150.db2.gz	XGIKUCLABASLQB-ZANVPECISA-N	1	1	317.353	1.527	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000797731691	700021935	/nfs/dbraw/zinc/02/19/35/700021935.db2.gz	CPUIWWJQQQSAFE-GFCCVEGCSA-N	1	1	307.350	1.445	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000797731691	700021936	/nfs/dbraw/zinc/02/19/36/700021936.db2.gz	CPUIWWJQQQSAFE-GFCCVEGCSA-N	1	1	307.350	1.445	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000101953272	696609461	/nfs/dbraw/zinc/60/94/61/696609461.db2.gz	SLQSTRYDYLUUAJ-UHFFFAOYSA-N	1	1	313.329	1.569	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@H]2CCCCNC2=O)cc1[N+](=O)[O-]	ZINC000105613019	696623907	/nfs/dbraw/zinc/62/39/07/696623907.db2.gz	HAYSAKDHCRWCPX-LBPRGKRZSA-N	1	1	307.350	1.704	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H]2CCCCNC2=O)cc1[N+](=O)[O-]	ZINC000105613019	696623908	/nfs/dbraw/zinc/62/39/08/696623908.db2.gz	HAYSAKDHCRWCPX-LBPRGKRZSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCOC[C@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000177629440	697414509	/nfs/dbraw/zinc/41/45/09/697414509.db2.gz	JPZHQFUPNRQVLF-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000177629440	697414511	/nfs/dbraw/zinc/41/45/11/697414511.db2.gz	JPZHQFUPNRQVLF-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
CC[N@H+](Cc1cnn(C)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776273992	698091033	/nfs/dbraw/zinc/09/10/33/698091033.db2.gz	AXGSRGHDSOMRKZ-OAHLLOKOSA-N	1	1	304.350	1.884	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776583089	698121746	/nfs/dbraw/zinc/12/17/46/698121746.db2.gz	ZLXFRRANJPGGTM-QKCSRTOESA-N	1	1	307.350	1.214	20	5		DDBDMO
CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000750066375	700202059	/nfs/dbraw/zinc/20/20/59/700202059.db2.gz	ISYXXUOBHMDGHR-HZPDHXFCSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1	ZINC000750066375	700202061	/nfs/dbraw/zinc/20/20/61/700202061.db2.gz	ISYXXUOBHMDGHR-HZPDHXFCSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1	ZINC000750066375	700202064	/nfs/dbraw/zinc/20/20/64/700202064.db2.gz	ISYXXUOBHMDGHR-HZPDHXFCSA-N	1	1	305.378	1.797	20	5		DDBDMO
Cc1nn(CN2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c(C)c1[N+](=O)[O-]	ZINC000247049839	698360281	/nfs/dbraw/zinc/36/02/81/698360281.db2.gz	UDZUMXOGBZWUGH-UONOGXRCSA-N	1	1	307.398	1.782	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1O	ZINC000782524608	698734415	/nfs/dbraw/zinc/73/44/15/698734415.db2.gz	OMGPJTVWRLUXRF-TVQRCGJNSA-N	1	1	311.313	1.375	20	5		DDBDMO
O=[N+]([O-])c1ccn(C2CC[NH+](CN3CCOC3=S)CC2)n1	ZINC000782859198	698774017	/nfs/dbraw/zinc/77/40/17/698774017.db2.gz	FPLHOESANVPYNW-UHFFFAOYSA-N	1	1	311.367	1.003	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000783923323	698892747	/nfs/dbraw/zinc/89/27/47/698892747.db2.gz	YCYQHUUJOBDBAJ-SNVBAGLBSA-N	1	1	321.333	1.538	20	5		DDBDMO
C[C@H](C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])S(C)(=O)=O	ZINC000704906189	699238630	/nfs/dbraw/zinc/23/86/30/699238630.db2.gz	HMTQHGGTGJYSRU-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC000789955454	699425178	/nfs/dbraw/zinc/42/51/78/699425178.db2.gz	OUDYDADAMZPDGF-JTQLQIEISA-N	1	1	310.310	1.539	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)CO	ZINC000736310940	699723629	/nfs/dbraw/zinc/72/36/29/699723629.db2.gz	ACFXBSGGDKJEAM-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+](C[C@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794632452	699820141	/nfs/dbraw/zinc/82/01/41/699820141.db2.gz	PJIBAODOCUFDTM-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
CC[N@@H+](C[C@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794632452	699820143	/nfs/dbraw/zinc/82/01/43/699820143.db2.gz	PJIBAODOCUFDTM-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)Cc2ccccc21	ZINC000744385198	699947451	/nfs/dbraw/zinc/94/74/51/699947451.db2.gz	MZKFFYHYVHAYNT-DOMZBBRYSA-N	1	1	316.361	1.772	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCC3OCCCO3)C2)nc1	ZINC000754652250	700516949	/nfs/dbraw/zinc/51/69/49/700516949.db2.gz	MDEWSJXAQGUMLF-LBPRGKRZSA-N	1	1	322.365	1.629	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000755921150	700592390	/nfs/dbraw/zinc/59/23/90/700592390.db2.gz	KMBCAAZGTTZBMM-LLVKDONJSA-N	1	1	312.333	1.970	20	5		DDBDMO
COCCN(CC(C)C)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867946623	701847227	/nfs/dbraw/zinc/84/72/27/701847227.db2.gz	SOGMYGGINGFILI-MRXNPFEDSA-N	1	1	323.393	1.900	20	5		DDBDMO
C[C@H](NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576033	701898449	/nfs/dbraw/zinc/89/84/49/701898449.db2.gz	HKIVUIJNQFUYRK-FPMFFAJLSA-N	1	1	320.393	1.691	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H]1CN2CCC[C@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576033	701898453	/nfs/dbraw/zinc/89/84/53/701898453.db2.gz	HKIVUIJNQFUYRK-FPMFFAJLSA-N	1	1	320.393	1.691	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000812333335	702157454	/nfs/dbraw/zinc/15/74/54/702157454.db2.gz	XPKDYKNHSVNQRR-PWSUYJOCSA-N	1	1	305.334	1.324	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000812333335	702157455	/nfs/dbraw/zinc/15/74/55/702157455.db2.gz	XPKDYKNHSVNQRR-PWSUYJOCSA-N	1	1	305.334	1.324	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000866209644	706649708	/nfs/dbraw/zinc/64/97/08/706649708.db2.gz	UOGOAHRHDBXVSX-JQWIXIFHSA-N	1	1	320.349	1.307	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000816953657	702237298	/nfs/dbraw/zinc/23/72/98/702237298.db2.gz	LOOSPBQXZXQKGV-XHDPSFHLSA-N	1	1	318.377	1.437	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(NC[C@@H]3CCC[NH2+]3)CC2)cc1	ZINC000841036689	702318256	/nfs/dbraw/zinc/31/82/56/702318256.db2.gz	VUCUTBYAUQKUDG-AWEZNQCLSA-N	1	1	304.394	1.905	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000879571938	706722084	/nfs/dbraw/zinc/72/20/84/706722084.db2.gz	USADZQFHIBHPLU-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000879580630	706727192	/nfs/dbraw/zinc/72/71/92/706727192.db2.gz	IPUKDFVUHYLSFV-VNQPRFMTSA-N	1	1	305.378	1.654	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000846053390	703231055	/nfs/dbraw/zinc/23/10/55/703231055.db2.gz	QEQSDXJFSWPSTJ-GHMZBOCLSA-N	1	1	300.742	1.830	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000846053390	703231056	/nfs/dbraw/zinc/23/10/56/703231056.db2.gz	QEQSDXJFSWPSTJ-GHMZBOCLSA-N	1	1	300.742	1.830	20	5		DDBDMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000847935837	703485483	/nfs/dbraw/zinc/48/54/83/703485483.db2.gz	BLVSDEUKZPLKLN-UHFFFAOYSA-N	1	1	319.296	1.419	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@@H+](CC(C)(C)O)C2)cc([N+](=O)[O-])c1	ZINC000869781406	703851216	/nfs/dbraw/zinc/85/12/16/703851216.db2.gz	NQOQEWMTGNRHFX-ZDUSSCGKSA-N	1	1	321.377	1.478	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+](CCOCCO)C2CCC2)cc1	ZINC000852289832	703998134	/nfs/dbraw/zinc/99/81/34/703998134.db2.gz	DHKVJGGSPAUNAN-MRXNPFEDSA-N	1	1	324.377	1.492	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[N@H+]3CCCC[C@@H]23)c1	ZINC000818959296	704035509	/nfs/dbraw/zinc/03/55/09/704035509.db2.gz	HQCBESFHOLHNNH-HRCADAONSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCN3CCCC[C@@H]23)c1	ZINC000818959296	704035510	/nfs/dbraw/zinc/03/55/10/704035510.db2.gz	HQCBESFHOLHNNH-HRCADAONSA-N	1	1	305.378	1.845	20	5		DDBDMO
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000852414979	704038978	/nfs/dbraw/zinc/03/89/78/704038978.db2.gz	CBIVOSSFBCHDLD-CMPLNLGQSA-N	1	1	314.725	1.668	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852695837	704101466	/nfs/dbraw/zinc/10/14/66/704101466.db2.gz	GYLQUSUNUYXAAK-YUTCNCBUSA-N	1	1	308.334	1.512	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870912457	704165635	/nfs/dbraw/zinc/16/56/35/704165635.db2.gz	IAUVTJQTFATHKH-GDBMZVCRSA-N	1	1	321.377	1.652	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])nc1Br)C1CC1	ZINC000853064642	704191304	/nfs/dbraw/zinc/19/13/04/704191304.db2.gz	JVKOCKUBRMSBFY-MRVPVSSYSA-N	1	1	319.159	1.009	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@H]2COCCO2)c2cc([N+](=O)[O-])ccc12	ZINC000853556730	704268056	/nfs/dbraw/zinc/26/80/56/704268056.db2.gz	CGFUJXMFEWOYBZ-ZDUSSCGKSA-N	1	1	320.349	1.558	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@H]2COCCO2)c2cc([N+](=O)[O-])ccc12	ZINC000853556730	704268057	/nfs/dbraw/zinc/26/80/57/704268057.db2.gz	CGFUJXMFEWOYBZ-ZDUSSCGKSA-N	1	1	320.349	1.558	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)CC1(O)CCC1)C2	ZINC000859208956	704821609	/nfs/dbraw/zinc/82/16/09/704821609.db2.gz	VABIJGZKLLMEAX-CYBMUJFWSA-N	1	1	306.362	1.619	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)CC1(O)CCC1)C2	ZINC000859208956	704821614	/nfs/dbraw/zinc/82/16/14/704821614.db2.gz	VABIJGZKLLMEAX-CYBMUJFWSA-N	1	1	306.362	1.619	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[NH+](C[C@@H]2CCCO2)CC1)[N+](=O)[O-]	ZINC000822218445	704894868	/nfs/dbraw/zinc/89/48/68/704894868.db2.gz	LIALSBBBJISPRA-ZDUSSCGKSA-N	1	1	313.398	1.145	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179356	705163041	/nfs/dbraw/zinc/16/30/41/705163041.db2.gz	MBSPJRJIJYEQHA-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179356	705163048	/nfs/dbraw/zinc/16/30/48/705163048.db2.gz	MBSPJRJIJYEQHA-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179356	705163052	/nfs/dbraw/zinc/16/30/52/705163052.db2.gz	MBSPJRJIJYEQHA-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)n1	ZINC000874827015	705185513	/nfs/dbraw/zinc/18/55/13/705185513.db2.gz	AGNBGIWHFWJHRN-MNOVXSKESA-N	1	1	307.354	1.120	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000874827729	705186085	/nfs/dbraw/zinc/18/60/85/705186085.db2.gz	SWYYQWWTDQFOBI-RBSFLKMASA-N	1	1	319.361	1.323	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848394	705202396	/nfs/dbraw/zinc/20/23/96/705202396.db2.gz	SGBVGBZXBBYDNV-KGLIPLIRSA-N	1	1	318.377	1.945	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848711	705202554	/nfs/dbraw/zinc/20/25/54/705202554.db2.gz	GMDIGNFSLFCPRD-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000861352438	705441512	/nfs/dbraw/zinc/44/15/12/705441512.db2.gz	JDISQSIEPGTBPT-RISCZKNCSA-N	1	1	302.371	1.474	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825471961	705677392	/nfs/dbraw/zinc/67/73/92/705677392.db2.gz	FVZGOJPTJOZFHC-WFASDCNBSA-N	1	1	321.377	1.475	20	5		DDBDMO
CC(C)CNC(=O)C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000876559864	705758063	/nfs/dbraw/zinc/75/80/63/705758063.db2.gz	HPAPPUVIKJMYNR-UHFFFAOYSA-N	1	1	323.397	1.313	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)CCN1CCOCC1	ZINC000876680816	705816239	/nfs/dbraw/zinc/81/62/39/705816239.db2.gz	JOEVMLOBAHTFQW-UHFFFAOYSA-N	1	1	307.394	1.976	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@@H]3CCN(C4CC4)C3)C2)c1	ZINC000876930253	705928595	/nfs/dbraw/zinc/92/85/95/705928595.db2.gz	UPOAZEQOUPRXCS-DCBWTQNWSA-N	1	1	305.382	1.569	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c(N)c([N+](=O)[O-])c1	ZINC000827312340	705973427	/nfs/dbraw/zinc/97/34/27/705973427.db2.gz	UNMORWJSMQSIBG-YPMHNXCESA-N	1	1	318.377	1.652	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827331139	705977582	/nfs/dbraw/zinc/97/75/82/705977582.db2.gz	WSHUUTLNZSDACW-MFKMUULPSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1ccc(O[C@H]2CC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)nc1	ZINC000877657199	706172024	/nfs/dbraw/zinc/17/20/24/706172024.db2.gz	ARPZARQTSYHPGZ-ZDUSSCGKSA-N	1	1	317.349	1.685	20	5		DDBDMO
Cc1ccc(O[C@H]2CC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)nc1	ZINC000877657199	706172028	/nfs/dbraw/zinc/17/20/28/706172028.db2.gz	ARPZARQTSYHPGZ-ZDUSSCGKSA-N	1	1	317.349	1.685	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000829449527	706334971	/nfs/dbraw/zinc/33/49/71/706334971.db2.gz	CEDNZBPSZOMRCU-RBSFLKMASA-N	1	1	303.362	1.909	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3cc(F)c([N+](=O)[O-])cc3CO)C2)C1	ZINC000865827388	706538265	/nfs/dbraw/zinc/53/82/65/706538265.db2.gz	JUVAAIWUGLIJHB-OAHLLOKOSA-N	1	1	309.341	1.758	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC3(C2)C[NH+](Cc2ccccc2)C3)nc1	ZINC000865999942	706590165	/nfs/dbraw/zinc/59/01/65/706590165.db2.gz	LCVFUKBCIHQHTN-UHFFFAOYSA-N	1	1	311.345	1.707	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880134674	706886394	/nfs/dbraw/zinc/88/63/94/706886394.db2.gz	OIYAJPRLQNJLJW-GJZGRUSLSA-N	1	1	318.377	1.702	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000832359075	706896990	/nfs/dbraw/zinc/89/69/90/706896990.db2.gz	BTCDHDOMXOUJHS-FZMZJTMJSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000832359075	706896994	/nfs/dbraw/zinc/89/69/94/706896994.db2.gz	BTCDHDOMXOUJHS-FZMZJTMJSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](CF)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000880297008	706932040	/nfs/dbraw/zinc/93/20/40/706932040.db2.gz	IQHYOJSFNOSNNZ-NSHDSACASA-N	1	1	307.325	1.775	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](CF)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000880297008	706932042	/nfs/dbraw/zinc/93/20/42/706932042.db2.gz	IQHYOJSFNOSNNZ-NSHDSACASA-N	1	1	307.325	1.775	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CO)c1ccccc1	ZINC000880460704	706981927	/nfs/dbraw/zinc/98/19/27/706981927.db2.gz	BNSOSEYWAZWBGQ-HNNXBMFYSA-N	1	1	304.350	1.847	20	5		DDBDMO
O=c1c(Cl)cc([N+](=O)[O-])cn1Cc1[nH+]ccn1CC(F)F	ZINC000871654170	707154987	/nfs/dbraw/zinc/15/49/87/707154987.db2.gz	OZGTVLRIZSAZLG-UHFFFAOYSA-N	1	1	318.667	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)Cn2cc(C[NH+]3CCCC3)nn2)cc1	ZINC000881397501	707234201	/nfs/dbraw/zinc/23/42/01/707234201.db2.gz	BZKJKQCDVDYRQX-OAHLLOKOSA-N	1	1	317.349	1.516	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]C[C@H]1C[C@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000872126479	707297987	/nfs/dbraw/zinc/29/79/87/707297987.db2.gz	KQSCMFBJTVJIGU-CQDKDKBSSA-N	1	1	316.361	1.778	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000872757692	707587349	/nfs/dbraw/zinc/58/73/49/707587349.db2.gz	FNUAAPNAHQSWOG-UONOGXRCSA-N	1	1	319.361	1.443	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-]	ZINC000883893570	708077296	/nfs/dbraw/zinc/07/72/96/708077296.db2.gz	NRNGQFXMOGTTDZ-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=S)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000884004341	708098889	/nfs/dbraw/zinc/09/88/89/708098889.db2.gz	SZJNDARHAXPXCX-LLVKDONJSA-N	1	1	323.422	1.948	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])[C@@]12CC[N@@H+](C1)CCC2	ZINC000896694028	708122058	/nfs/dbraw/zinc/12/20/58/708122058.db2.gz	RDZSATPWJFSQLH-INIZCTEOSA-N	1	1	303.362	1.739	20	5		DDBDMO
CC(C)(CCC(=O)NC[C@@H]1CC[N@H+]1C1CCOCC1)[N+](=O)[O-]	ZINC000885888707	708655306	/nfs/dbraw/zinc/65/53/06/708655306.db2.gz	OBMICPHHFMYOQY-ZDUSSCGKSA-N	1	1	313.398	1.191	20	5		DDBDMO
Cc1c(CC(=O)N[C@H]2CCC[N@H+](CCF)C2)cccc1[N+](=O)[O-]	ZINC000898494385	708657197	/nfs/dbraw/zinc/65/71/97/708657197.db2.gz	AIERBNDACIWHEI-AWEZNQCLSA-N	1	1	323.368	1.996	20	5		DDBDMO
Cc1c(CC(=O)N[C@H]2CCC[N@@H+](CCF)C2)cccc1[N+](=O)[O-]	ZINC000898494385	708657199	/nfs/dbraw/zinc/65/71/99/708657199.db2.gz	AIERBNDACIWHEI-AWEZNQCLSA-N	1	1	323.368	1.996	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1cccnc1[N+](=O)[O-]	ZINC000886176598	708710196	/nfs/dbraw/zinc/71/01/96/708710196.db2.gz	HAIUUMGEKVZOPI-ZDUSSCGKSA-N	1	1	320.393	1.675	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105961	713132613	/nfs/dbraw/zinc/13/26/13/713132613.db2.gz	XKHQFWOFKJFFJN-WCQYABFASA-N	1	1	322.390	1.299	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105961	713132615	/nfs/dbraw/zinc/13/26/15/713132615.db2.gz	XKHQFWOFKJFFJN-WCQYABFASA-N	1	1	322.390	1.299	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2C)[C@@H](C)C1	ZINC000910291696	709870964	/nfs/dbraw/zinc/87/09/64/709870964.db2.gz	DUHQUBQGQZAVEW-NSHDSACASA-N	1	1	306.366	1.855	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1=O	ZINC000892007844	710351745	/nfs/dbraw/zinc/35/17/45/710351745.db2.gz	NMFSBDGZPSIMNM-LLVKDONJSA-N	1	1	316.361	1.953	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1C	ZINC000928444034	713198484	/nfs/dbraw/zinc/19/84/84/713198484.db2.gz	IJXRACWCVXEBRK-CABZTGNLSA-N	1	1	311.313	1.322	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+][C@H](C)c1cc(OC)cc([N+](=O)[O-])c1	ZINC000903086832	711028067	/nfs/dbraw/zinc/02/80/67/711028067.db2.gz	ANFBQHFTGIIINN-SNVBAGLBSA-N	1	1	316.379	1.689	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H](C)[C@@](C)(CO)C2)c1[N+](=O)[O-]	ZINC000895455597	711516475	/nfs/dbraw/zinc/51/64/75/711516475.db2.gz	CFMMLIRKVBKSCM-MEBBXXQBSA-N	1	1	310.350	1.759	20	5		DDBDMO
Cn1cc(C[N@H+]2C[C@H]3C[C@@]3(O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000895645426	711567703	/nfs/dbraw/zinc/56/77/03/711567703.db2.gz	BYDIDGHSTNMBGT-CZUORRHYSA-N	1	1	314.345	1.562	20	5		DDBDMO
COc1ccc2ncc([N+](=O)[O-])c(NC[C@H]3CC[N@H+]3C)c2c1	ZINC000895768126	711600693	/nfs/dbraw/zinc/60/06/93/711600693.db2.gz	WUCDQCWBOVWUCZ-SNVBAGLBSA-N	1	1	302.334	1.690	20	5		DDBDMO
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[N@@H+](C)CCN1C	ZINC000896570058	711754975	/nfs/dbraw/zinc/75/49/75/711754975.db2.gz	XCFKTFONGULAJX-IINYFYTJSA-N	1	1	324.356	1.098	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000915212686	713412874	/nfs/dbraw/zinc/41/28/74/713412874.db2.gz	KXEFHESWALLSIM-UHFFFAOYSA-N	1	1	307.354	1.623	20	5		DDBDMO
CC[NH+]1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929110711	713548397	/nfs/dbraw/zinc/54/83/97/713548397.db2.gz	FUTJHLCMZUGKHH-HUUCEWRRSA-N	1	1	303.362	1.862	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000921204311	713721252	/nfs/dbraw/zinc/72/12/52/713721252.db2.gz	YIASJXWGIQYKAS-UHFFFAOYSA-N	1	1	317.349	1.155	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)NC[C@@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000921336894	713738326	/nfs/dbraw/zinc/73/83/26/713738326.db2.gz	ZLTQDTUEILAPKS-YPMHNXCESA-N	1	1	306.366	1.968	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](CC[N+](=O)[O-])C[C@H]1c1ccc(Cl)cc1	ZINC000930882730	713949059	/nfs/dbraw/zinc/94/90/59/713949059.db2.gz	JPPKBUWZYNQYOZ-QWHCGFSZSA-N	1	1	312.753	1.805	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](CC[N+](=O)[O-])C[C@H]1c1ccc(Cl)cc1	ZINC000930882730	713949061	/nfs/dbraw/zinc/94/90/61/713949061.db2.gz	JPPKBUWZYNQYOZ-QWHCGFSZSA-N	1	1	312.753	1.805	20	5		DDBDMO
O=C1[C@H](N2CCn3cc[nH+]c32)CCN1c1cccc([N+](=O)[O-])c1	ZINC000931521357	714118284	/nfs/dbraw/zinc/11/82/84/714118284.db2.gz	FYSDVCUCKBFHSR-CYBMUJFWSA-N	1	1	313.317	1.417	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCn2cc[nH+]c21	ZINC000931523492	714119089	/nfs/dbraw/zinc/11/90/89/714119089.db2.gz	DBWQFNOLEDKQIB-SNVBAGLBSA-N	1	1	301.306	1.639	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@@H]2CC[N@@H+]2C2CCOCC2)cc1	ZINC000922951104	714196289	/nfs/dbraw/zinc/19/62/89/714196289.db2.gz	JMZRZJLKSXTHNR-INIZCTEOSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@@H]2CC[N@H+]2C2CCOCC2)cc1	ZINC000922951104	714196291	/nfs/dbraw/zinc/19/62/91/714196291.db2.gz	JMZRZJLKSXTHNR-INIZCTEOSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934258283	714777523	/nfs/dbraw/zinc/77/75/23/714777523.db2.gz	CMKGNSJLIGXJAX-HOTGVXAUSA-N	1	1	323.368	1.765	20	5		DDBDMO
C[C@]1(C2CC2)COCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000934478511	714829783	/nfs/dbraw/zinc/82/97/83/714829783.db2.gz	UZBVNBUARHGTOM-OAHLLOKOSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[C@]1(C2CC2)COCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000934478511	714829784	/nfs/dbraw/zinc/82/97/84/714829784.db2.gz	UZBVNBUARHGTOM-OAHLLOKOSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000925408922	714846153	/nfs/dbraw/zinc/84/61/53/714846153.db2.gz	MQODXDMWPYNNOP-CQSZACIVSA-N	1	1	318.377	1.973	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H](O)[C@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570368	714854134	/nfs/dbraw/zinc/85/41/34/714854134.db2.gz	DXABTQLKKXUEBN-MFKMUULPSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@H](O)[C@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570368	714854135	/nfs/dbraw/zinc/85/41/35/714854135.db2.gz	DXABTQLKKXUEBN-MFKMUULPSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C1CCC1	ZINC001025646196	736807691	/nfs/dbraw/zinc/80/76/91/736807691.db2.gz	FMFUJIJPGHWJGE-FOLVSLTJSA-N	1	1	315.373	1.941	20	5		DDBDMO
Cc1ccc(C)c(OCC[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001126943993	742944034	/nfs/dbraw/zinc/94/40/34/742944034.db2.gz	ZGIVFGZBZUUKJS-ZIAGYGMSSA-N	1	1	321.377	1.053	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134279	743705395	/nfs/dbraw/zinc/70/53/95/743705395.db2.gz	GUQDOYDNBAQSQB-WCQYABFASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134279	743705399	/nfs/dbraw/zinc/70/53/99/743705399.db2.gz	GUQDOYDNBAQSQB-WCQYABFASA-N	1	1	300.742	1.566	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC001121698902	744859922	/nfs/dbraw/zinc/85/99/22/744859922.db2.gz	LUVJVWAONGESML-SDDRHHMPSA-N	1	1	308.386	1.166	20	5		DDBDMO
Cc1[nH]c(Cn2nc(-c3ccccc3[N+](=O)[O-])oc2=O)c(C)[nH+]1	ZINC001189276385	744868140	/nfs/dbraw/zinc/86/81/40/744868140.db2.gz	LZAAXCPEXIEUOK-UHFFFAOYSA-N	1	1	315.289	1.800	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC001197759198	747248270	/nfs/dbraw/zinc/24/82/70/747248270.db2.gz	OTLFCZBNPTZINZ-LBPRGKRZSA-N	1	1	322.365	1.367	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC001198872654	747642188	/nfs/dbraw/zinc/64/21/88/747642188.db2.gz	QYVFUANWQYDFHN-AWEZNQCLSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+]Cc2nc(Br)c[nH]2)c1	ZINC001201192430	748431304	/nfs/dbraw/zinc/43/13/04/748431304.db2.gz	OBCSARRMLMRTBE-UHFFFAOYSA-N	1	1	315.131	1.067	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@@H+]1C	ZINC001117752469	748996573	/nfs/dbraw/zinc/99/65/73/748996573.db2.gz	GYPLEYUNRXAUKA-SNVBAGLBSA-N	1	1	324.356	1.576	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C	ZINC001117752469	748996577	/nfs/dbraw/zinc/99/65/77/748996577.db2.gz	GYPLEYUNRXAUKA-SNVBAGLBSA-N	1	1	324.356	1.576	20	5		DDBDMO
O=C(NCC1=CCN(Cc2nccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000669708	762075588	/nfs/dbraw/zinc/07/55/88/762075588.db2.gz	KIUUNNJVLVFZNJ-VXGBXAGGSA-N	1	1	322.390	1.057	20	5		DDBDMO
[NH3+]C1(c2cccnc2)CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001168992059	762165630	/nfs/dbraw/zinc/16/56/30/762165630.db2.gz	JFHAJNCAOBBSHF-UKRRQHHQSA-N	1	1	304.394	1.777	20	5		DDBDMO
C[N@@H+](C1CN(C(=O)OC(C)(C)C)C1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169038238	762193668	/nfs/dbraw/zinc/19/36/68/762193668.db2.gz	XGUXSHACXFZCFQ-VXGBXAGGSA-N	1	1	313.398	1.983	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169024540	762201856	/nfs/dbraw/zinc/20/18/56/762201856.db2.gz	WWLWBWAIEZAOJF-AVGNSLFASA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169024540	762201859	/nfs/dbraw/zinc/20/18/59/762201859.db2.gz	WWLWBWAIEZAOJF-AVGNSLFASA-N	1	1	323.397	1.289	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](Oc3ncc(F)cn3)C2)C1	ZINC001169054388	762210317	/nfs/dbraw/zinc/21/03/17/762210317.db2.gz	LTEJMGNVMCYJCB-KGYLQXTDSA-N	1	1	310.329	1.514	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086082757	760941862	/nfs/dbraw/zinc/94/18/62/760941862.db2.gz	CLPOAHRNWIBLGH-LXTVHRRPSA-N	1	1	303.362	1.336	20	5		DDBDMO
Cc1csc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)n1	ZINC001086083211	760943277	/nfs/dbraw/zinc/94/32/77/760943277.db2.gz	QUHXRIIMRORRRN-WRWGMCAJSA-N	1	1	324.406	1.101	20	5		DDBDMO
Cc1ncsc1C[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086363249	761492850	/nfs/dbraw/zinc/49/28/50/761492850.db2.gz	JXAWRZAUIWPMJK-DDHJBXDOSA-N	1	1	324.406	1.101	20	5		DDBDMO
N=C(NCCCC[NH3+])Nc1cnc2cc([N+](=O)[O-])ccc2n1	ZINC001157093924	764411671	/nfs/dbraw/zinc/41/16/71/764411671.db2.gz	JQPHEHCDNHRDOU-UHFFFAOYSA-N	1	1	303.326	1.213	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCOC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334099	766256859	/nfs/dbraw/zinc/25/68/59/766256859.db2.gz	BLDCXUKLPVYLEM-WCQYABFASA-N	1	1	310.350	1.228	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CCC1(C)CC1	ZINC001146463408	772868413	/nfs/dbraw/zinc/86/84/13/772868413.db2.gz	ATMYJQBVDCJSAO-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1	ZINC001148757055	773594592	/nfs/dbraw/zinc/59/45/92/773594592.db2.gz	DHJNYZBPHUSARY-SSDOTTSWSA-N	1	1	301.734	1.185	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCC2	ZINC001177740371	778717869	/nfs/dbraw/zinc/71/78/69/778717869.db2.gz	KGVHUMBNERAYFF-UHFFFAOYSA-N	1	1	300.318	1.596	20	5		DDBDMO
C[N@H+](CCNC(=O)[C@H]1[C@@H]2COC[C@@H]21)Cc1cccc([N+](=O)[O-])c1	ZINC001266311697	836101928	/nfs/dbraw/zinc/10/19/28/836101928.db2.gz	FZQSXRONGUOAPS-FICVDOATSA-N	1	1	319.361	1.035	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@H]1[C@@H]2COC[C@@H]21)Cc1cccc([N+](=O)[O-])c1	ZINC001266311697	836101936	/nfs/dbraw/zinc/10/19/36/836101936.db2.gz	FZQSXRONGUOAPS-FICVDOATSA-N	1	1	319.361	1.035	20	5		DDBDMO
CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cnon1	ZINC001268251823	839895126	/nfs/dbraw/zinc/89/51/26/839895126.db2.gz	IWXZXVKAEOQNSL-UHFFFAOYSA-N	1	1	319.321	1.182	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cnon1	ZINC001268251823	839895139	/nfs/dbraw/zinc/89/51/39/839895139.db2.gz	IWXZXVKAEOQNSL-UHFFFAOYSA-N	1	1	319.321	1.182	20	5		DDBDMO
CN(CCC[NH2+]Cc1cc(C2CC2)no1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268790110	840814794	/nfs/dbraw/zinc/81/47/94/840814794.db2.gz	BGLNNRYHUAXXGI-TZMCWYRMSA-N	1	1	322.365	1.155	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2ccc(Cl)cc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001269411720	841621028	/nfs/dbraw/zinc/62/10/28/841621028.db2.gz	QSMGJYFQEZUECP-CHWSQXEVSA-N	1	1	323.780	1.744	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001150119814	862100200	/nfs/dbraw/zinc/10/02/00/862100200.db2.gz	LJLLJXDRMCAQIV-XPTSAGLGSA-N	1	1	304.350	1.390	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1	ZINC001161177858	859980635	/nfs/dbraw/zinc/98/06/35/859980635.db2.gz	VSRQIVCGIHPEHE-NSHDSACASA-N	1	1	320.349	1.815	20	5		DDBDMO
COC(=O)c1ccnc(NCc2ccc(N)[nH+]c2C)c1[N+](=O)[O-]	ZINC001156981293	863494303	/nfs/dbraw/zinc/49/43/03/863494303.db2.gz	YJHPWNLOVWPFOA-UHFFFAOYSA-N	1	1	317.305	1.674	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@H]21	ZINC001157264857	863692442	/nfs/dbraw/zinc/69/24/42/863692442.db2.gz	GEPSZCIJDYKNPW-MWLCHTKSSA-N	1	1	312.757	1.412	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@H]21	ZINC001157264857	863692451	/nfs/dbraw/zinc/69/24/51/863692451.db2.gz	GEPSZCIJDYKNPW-MWLCHTKSSA-N	1	1	312.757	1.412	20	5		DDBDMO
Cc1ccc(CNC(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)cc1[N+](=O)[O-]	ZINC001329585020	863739037	/nfs/dbraw/zinc/73/90/37/863739037.db2.gz	XLBLZNNGEQUETB-HIFRSBDPSA-N	1	1	318.377	1.749	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2C	ZINC001332401689	865814122	/nfs/dbraw/zinc/81/41/22/865814122.db2.gz	KHYRDRSRDPNIIW-CABCVRRESA-N	1	1	318.377	1.945	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC001320547817	866817885	/nfs/dbraw/zinc/81/78/85/866817885.db2.gz	LHTGXXIPCBPPHO-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C	ZINC001320547817	866817903	/nfs/dbraw/zinc/81/79/03/866817903.db2.gz	LHTGXXIPCBPPHO-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CCN(CC[NH2+]CCc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001320735365	866992011	/nfs/dbraw/zinc/99/20/11/866992011.db2.gz	XQYUMFDUNSIKDJ-UKRRQHHQSA-N	1	1	323.368	1.472	20	5		DDBDMO
COC(=O)c1ccnc(N[C@]2(C)CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001162338156	867468859	/nfs/dbraw/zinc/46/88/59/867468859.db2.gz	XCWWSNHXPHFJFD-CQSZACIVSA-N	1	1	308.338	1.673	20	5		DDBDMO
[NH3+][C@@H]1CN(c2ncnc3cccc([N+](=O)[O-])c32)CCC1(F)F	ZINC001164327711	869130732	/nfs/dbraw/zinc/13/07/32/869130732.db2.gz	PYEFTNUKTOUYNU-SNVBAGLBSA-N	1	1	309.276	1.711	20	5		DDBDMO
NC(=O)COC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC001337383564	869462799	/nfs/dbraw/zinc/46/27/99/869462799.db2.gz	YMVFJLPWVAEKCP-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC001338464794	869992877	/nfs/dbraw/zinc/99/28/77/869992877.db2.gz	QRRKFOLAYBPVNA-IACUBPJLSA-N	1	1	321.352	1.733	20	5		DDBDMO
Cc1ocnc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001317440900	870840829	/nfs/dbraw/zinc/84/08/29/870840829.db2.gz	TZVFFJXMRFOROV-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
Cc1ocnc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001317440900	870840845	/nfs/dbraw/zinc/84/08/45/870840845.db2.gz	TZVFFJXMRFOROV-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001303799163	871155620	/nfs/dbraw/zinc/15/56/20/871155620.db2.gz	DHFCYMBXQYIYGB-BXKDBHETSA-N	1	1	311.769	2.000	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC001340735208	871318016	/nfs/dbraw/zinc/31/80/16/871318016.db2.gz	JWSUNMMMAIWADB-IINYFYTJSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC001340735208	871318032	/nfs/dbraw/zinc/31/80/32/871318032.db2.gz	JWSUNMMMAIWADB-IINYFYTJSA-N	1	1	322.365	1.085	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NC)[C@H](C)C1	ZINC001341741367	871799122	/nfs/dbraw/zinc/79/91/22/871799122.db2.gz	DPSUNRURBOALAY-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NC)[C@H](C)C1	ZINC001341741367	871799142	/nfs/dbraw/zinc/79/91/42/871799142.db2.gz	DPSUNRURBOALAY-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
Nc1cc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc[nH+]1	ZINC001318518769	872124836	/nfs/dbraw/zinc/12/48/36/872124836.db2.gz	IUVNNYSXELAWCD-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[N@@H+]2CCN1C[C@@H]2C	ZINC001345491715	873421819	/nfs/dbraw/zinc/42/18/19/873421819.db2.gz	PILBQZUMSUJYME-SMDDNHRTSA-N	1	1	304.350	1.230	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3[O-])[C@@H]2C1	ZINC001347597694	874207000	/nfs/dbraw/zinc/20/70/00/874207000.db2.gz	RYERSXZWKPHXGH-ZWKOPEQDSA-N	1	1	305.334	1.370	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3nc4c(cccc4[N+](=O)[O-])o3)[C@H]1CC(=O)C2	ZINC001227235408	882924059	/nfs/dbraw/zinc/92/40/59/882924059.db2.gz	CXVVKDLJEIZCCS-KDDOJWQBSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nc4c(cccc4[N+](=O)[O-])o3)[C@H]1CC(=O)C2	ZINC001227235408	882924066	/nfs/dbraw/zinc/92/40/66/882924066.db2.gz	CXVVKDLJEIZCCS-KDDOJWQBSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1CC[C@H](Oc2ccc(Br)nc2[N+](=O)[O-])C1	ZINC001227256349	882935901	/nfs/dbraw/zinc/93/59/01/882935901.db2.gz	GPUXVINVWWIVTI-ZETCQYMHSA-N	1	1	302.128	1.835	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3nccc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228014392	883287401	/nfs/dbraw/zinc/28/74/01/883287401.db2.gz	KDVZYRWAXWNGNB-WHGOUJPWSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nccc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228014392	883287421	/nfs/dbraw/zinc/28/74/21/883287421.db2.gz	KDVZYRWAXWNGNB-WHGOUJPWSA-N	1	1	311.725	1.826	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1-c1noc([C@@H]2C[C@@H](F)CC[NH2+]2)n1	ZINC001247753057	893346016	/nfs/dbraw/zinc/34/60/16/893346016.db2.gz	ZNNCYQFDLAWVTQ-XPUUQOCRSA-N	1	1	311.248	1.942	20	5		DDBDMO
C[C@@H](NC(=O)NCC[N@H+]1CC[C@@H](O)C1)c1ccccc1[N+](=O)[O-]	ZINC001248414398	893629891	/nfs/dbraw/zinc/62/98/91/893629891.db2.gz	FRHGCICRFHQHGU-VXGBXAGGSA-N	1	1	322.365	1.022	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+]([C@H](C)Cc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC001254558393	896502440	/nfs/dbraw/zinc/50/24/40/896502440.db2.gz	FUOYAEFTABCYJB-PBOSXPJTSA-N	1	1	304.346	1.877	20	5		DDBDMO
CC(=O)N(C)[C@@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254611677	896532830	/nfs/dbraw/zinc/53/28/30/896532830.db2.gz	QZEULWTXESPNMS-HZPDHXFCSA-N	1	1	303.362	1.615	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[C@@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001293928022	914777808	/nfs/dbraw/zinc/77/78/08/914777808.db2.gz	LVTLVHMJSRGTFY-JTQLQIEISA-N	1	1	321.333	1.662	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457353	231102112	/nfs/dbraw/zinc/10/21/12/231102112.db2.gz	MGWQVHCBVYCNJO-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457353	231102116	/nfs/dbraw/zinc/10/21/16/231102116.db2.gz	MGWQVHCBVYCNJO-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCOCC23CCCCC3)c1	ZINC000451817931	231202873	/nfs/dbraw/zinc/20/28/73/231202873.db2.gz	UQVIXPCJMWZJJD-CQSZACIVSA-N	1	1	324.381	1.187	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083173254	185215848	/nfs/dbraw/zinc/21/58/48/185215848.db2.gz	SUXVVMBZZPBTLA-SECBINFHSA-N	1	1	307.306	1.977	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000451263372	529481494	/nfs/dbraw/zinc/48/14/94/529481494.db2.gz	YUTPSTXYJUQYIG-MGPQQGTHSA-N	1	1	324.377	1.427	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC[C@H](CCCO)C1	ZINC000452126061	231312106	/nfs/dbraw/zinc/31/21/06/231312106.db2.gz	TZIQTMRWBLGYAA-KBPBESRZSA-N	1	1	324.377	1.429	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000252013752	282207967	/nfs/dbraw/zinc/20/79/67/282207967.db2.gz	XXJNXROHGCNSKT-GDBMZVCRSA-N	1	1	324.377	1.571	20	5		DDBDMO
CC1(C)CN(c2ccc([N+](=O)[O-])c(N)c2F)CC[N@@H+]1CCO	ZINC000614829305	362041880	/nfs/dbraw/zinc/04/18/80/362041880.db2.gz	QRITUZUXQRLGLE-UHFFFAOYSA-N	1	1	312.345	1.209	20	5		DDBDMO
CC1(C)CN(c2ccc([N+](=O)[O-])c(N)c2F)CC[N@H+]1CCO	ZINC000614829305	362041883	/nfs/dbraw/zinc/04/18/83/362041883.db2.gz	QRITUZUXQRLGLE-UHFFFAOYSA-N	1	1	312.345	1.209	20	5		DDBDMO
CS[C@@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090564467	185303917	/nfs/dbraw/zinc/30/39/17/185303917.db2.gz	AUBHMNFJFBKWOJ-CYBMUJFWSA-N	1	1	311.407	1.974	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCO[C@@H](Cc3ccccc3)C2)n1	ZINC000181545889	199314376	/nfs/dbraw/zinc/31/43/76/199314376.db2.gz	QQUHRFVBOZMCRQ-HNNXBMFYSA-N	1	1	316.361	1.735	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCO[C@@H](Cc3ccccc3)C2)n1	ZINC000181545889	199314377	/nfs/dbraw/zinc/31/43/77/199314377.db2.gz	QQUHRFVBOZMCRQ-HNNXBMFYSA-N	1	1	316.361	1.735	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000330889534	232140473	/nfs/dbraw/zinc/14/04/73/232140473.db2.gz	BJXQGIRQTPTWCZ-MFKMUULPSA-N	1	1	323.397	1.397	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+](C)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272582820	210000516	/nfs/dbraw/zinc/00/05/16/210000516.db2.gz	UKZSLMFTBDSIEX-LLVKDONJSA-N	1	1	307.350	1.714	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272582820	210000520	/nfs/dbraw/zinc/00/05/20/210000520.db2.gz	UKZSLMFTBDSIEX-LLVKDONJSA-N	1	1	307.350	1.714	20	5		DDBDMO
Cc1c(CNC(=O)NCC[N@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000358449186	299155438	/nfs/dbraw/zinc/15/54/38/299155438.db2.gz	SOXUSZCMHTUYHT-UHFFFAOYSA-N	1	1	306.366	1.797	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ncc([N+](=O)[O-])cc3C(N)=O)CC[C@@H]21	ZINC000133704045	186008635	/nfs/dbraw/zinc/00/86/35/186008635.db2.gz	ORDNHJNRPJQWCJ-GWCFXTLKSA-N	1	1	319.365	1.009	20	5		DDBDMO
CN(C)CC(C)(C)[NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000459544356	233298886	/nfs/dbraw/zinc/29/88/86/233298886.db2.gz	DLJNXUJTODUXNK-UHFFFAOYSA-N	1	1	320.393	1.414	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000272463660	209869636	/nfs/dbraw/zinc/86/96/36/209869636.db2.gz	OUJJYRCAUYOZJU-JTQLQIEISA-N	1	1	304.350	1.391	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O	ZINC000159581520	186128749	/nfs/dbraw/zinc/12/87/49/186128749.db2.gz	OOWAGRPRUYSLNB-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000181885472	186215490	/nfs/dbraw/zinc/21/54/90/186215490.db2.gz	HUSMQMGKFPYENC-UHFFFAOYSA-N	1	1	317.292	1.878	20	5		DDBDMO
C[C@H]([NH2+][C@@H](CO)c1cnn(C)c1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284983351	186562114	/nfs/dbraw/zinc/56/21/14/186562114.db2.gz	GFNYMNOZRHTYML-ZANVPECISA-N	1	1	305.338	1.295	20	5		DDBDMO
Cc1cc(OCC(=O)N2CCC[N@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000020497316	352171110	/nfs/dbraw/zinc/17/11/10/352171110.db2.gz	JJPVRGUDPZEEBA-UHFFFAOYSA-N	1	1	307.350	1.446	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCOC1	ZINC000052071046	352599298	/nfs/dbraw/zinc/59/92/98/352599298.db2.gz	GUIPMQLYMTZGHR-HIFRSBDPSA-N	1	1	324.377	1.693	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC[N@H+](C)C1CC1	ZINC000067717779	353064524	/nfs/dbraw/zinc/06/45/24/353064524.db2.gz	OOQWJZNQIKWZRT-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000067792355	353067551	/nfs/dbraw/zinc/06/75/51/353067551.db2.gz	IJWJYRPJHXOLSZ-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1	ZINC000067795916	353067967	/nfs/dbraw/zinc/06/79/67/353067967.db2.gz	NGZCCQJLIFHMAS-DZGCQCFKSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000358562893	299198496	/nfs/dbraw/zinc/19/84/96/299198496.db2.gz	AJFOMDDOBZUNFW-SECBINFHSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000358562893	299198500	/nfs/dbraw/zinc/19/85/00/299198500.db2.gz	AJFOMDDOBZUNFW-SECBINFHSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[C@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000074099416	353291505	/nfs/dbraw/zinc/29/15/05/353291505.db2.gz	BXVXZPYAQLGVKQ-GFCCVEGCSA-N	1	1	320.393	1.919	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC[NH+](CCO)CC3)c2c1	ZINC000074401175	353311239	/nfs/dbraw/zinc/31/12/39/353311239.db2.gz	ODFPBGOKARQAQA-UHFFFAOYSA-N	1	1	302.334	1.257	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000174473437	198338271	/nfs/dbraw/zinc/33/82/71/198338271.db2.gz	CWGQFEKWTDUFDR-ZDUSSCGKSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000617722404	363254283	/nfs/dbraw/zinc/25/42/83/363254283.db2.gz	SLCXCTWOLYOSIY-CHWSQXEVSA-N	1	1	321.377	1.223	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000087191150	353747933	/nfs/dbraw/zinc/74/79/33/353747933.db2.gz	CDHUZOQHUQWXIL-CYBMUJFWSA-N	1	1	303.362	1.880	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000091676988	353833738	/nfs/dbraw/zinc/83/37/38/353833738.db2.gz	DQHFUNQBYVCOQC-VXGBXAGGSA-N	1	1	323.397	1.556	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000091676988	353833740	/nfs/dbraw/zinc/83/37/40/353833740.db2.gz	DQHFUNQBYVCOQC-VXGBXAGGSA-N	1	1	323.397	1.556	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000124591907	354040219	/nfs/dbraw/zinc/04/02/19/354040219.db2.gz	XETQCLXKWVIFPZ-UHFFFAOYSA-N	1	1	304.350	1.313	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCC[N@H+]1C	ZINC000139638770	354130449	/nfs/dbraw/zinc/13/04/49/354130449.db2.gz	CASWZTAWUYCYKL-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739521	354201035	/nfs/dbraw/zinc/20/10/35/354201035.db2.gz	DYOOXXGQBNOPRR-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739521	354201039	/nfs/dbraw/zinc/20/10/39/354201039.db2.gz	DYOOXXGQBNOPRR-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H](O)C1CC1	ZINC000305721031	354471231	/nfs/dbraw/zinc/47/12/31/354471231.db2.gz	IIVOKQRTTSZROA-QMTHXVAHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305721031	354471233	/nfs/dbraw/zinc/47/12/33/354471233.db2.gz	IIVOKQRTTSZROA-QMTHXVAHSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[N@H+]3C[C@H](O)C[C@H]3C2)c(Cl)c1	ZINC000405284043	354677942	/nfs/dbraw/zinc/67/79/42/354677942.db2.gz	WWWBRVSAMQISCC-QWHCGFSZSA-N	1	1	311.769	1.499	20	5		DDBDMO
Nc1cc(NC[C@@H]2CC[N@H+](C3CC3)C2)cc(CO)c1[N+](=O)[O-]	ZINC000587178312	354881878	/nfs/dbraw/zinc/88/18/78/354881878.db2.gz	FEQANMCDGPPXJP-JTQLQIEISA-N	1	1	306.366	1.566	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588861862	354944493	/nfs/dbraw/zinc/94/44/93/354944493.db2.gz	VSYGJQZVQCHZQS-VXGBXAGGSA-N	1	1	323.324	1.015	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000590402428	355085536	/nfs/dbraw/zinc/08/55/36/355085536.db2.gz	UCFTWWSWWZLAFS-HUUCEWRRSA-N	1	1	319.361	1.530	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000590537463	355109180	/nfs/dbraw/zinc/10/91/80/355109180.db2.gz	JMHBBNQJBQUVED-WCQYABFASA-N	1	1	308.313	1.248	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)[C@H]2C1	ZINC000590445468	355098881	/nfs/dbraw/zinc/09/88/81/355098881.db2.gz	MYSYZPLZJCWVOV-BMIGLBTASA-N	1	1	314.345	1.852	20	5		DDBDMO
C[C@H]1COCCN1CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332593736	235164721	/nfs/dbraw/zinc/16/47/21/235164721.db2.gz	KDVLQYKCKWKIBC-LBPRGKRZSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@H]1COCCN1CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332593736	235164723	/nfs/dbraw/zinc/16/47/23/235164723.db2.gz	KDVLQYKCKWKIBC-LBPRGKRZSA-N	1	1	306.366	1.069	20	5		DDBDMO
CC(C)[C@@H]1[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CC=CC2	ZINC000592446777	355586976	/nfs/dbraw/zinc/58/69/76/355586976.db2.gz	XCNPQBAADKEHJK-GJZGRUSLSA-N	1	1	320.393	1.829	20	5		DDBDMO
C[C@@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000593448321	355887904	/nfs/dbraw/zinc/88/79/04/355887904.db2.gz	QKGUPGHPFCHLQU-JTQLQIEISA-N	1	1	309.341	1.875	20	5		DDBDMO
C[C@@H]1CN(c2ccnc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CCO	ZINC000593468917	355895421	/nfs/dbraw/zinc/89/54/21/355895421.db2.gz	GAEWDFKGGWTRBO-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594081518	356108425	/nfs/dbraw/zinc/10/84/25/356108425.db2.gz	OFPMLORGBRPJLP-WCQYABFASA-N	1	1	319.365	1.550	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594059074	356103162	/nfs/dbraw/zinc/10/31/62/356103162.db2.gz	PDXZNOHRVCFFSK-QWHCGFSZSA-N	1	1	320.349	1.186	20	5		DDBDMO
CNc1ccc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cc1[N+](=O)[O-]	ZINC000565197097	304051107	/nfs/dbraw/zinc/05/11/07/304051107.db2.gz	WIHVKXMCWFEQGX-QWHCGFSZSA-N	1	1	318.377	1.945	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000594419171	356204437	/nfs/dbraw/zinc/20/44/37/356204437.db2.gz	OJMRLSQAHZWMIK-OLZOCXBDSA-N	1	1	318.377	1.924	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595741717	356631118	/nfs/dbraw/zinc/63/11/18/356631118.db2.gz	DCMWJXGXHHLLFO-VXGBXAGGSA-N	1	1	321.377	1.790	20	5		DDBDMO
CCOc1cc(C[NH+]2CCC(O)(CO)CC2)ccc1[N+](=O)[O-]	ZINC000595734030	356627414	/nfs/dbraw/zinc/62/74/14/356627414.db2.gz	SZBYTSFXCRGNHO-UHFFFAOYSA-N	1	1	310.350	1.313	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2[C@H](C)O)c1	ZINC000595767432	356643626	/nfs/dbraw/zinc/64/36/26/356643626.db2.gz	XHFZXNAVNZBIRN-GXFFZTMASA-N	1	1	308.334	1.727	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000595771473	356645496	/nfs/dbraw/zinc/64/54/96/356645496.db2.gz	PKEUKCPIBCBDEC-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000595774553	356647405	/nfs/dbraw/zinc/64/74/05/356647405.db2.gz	VEEXRDXNEYTKNT-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2	ZINC000595760622	356641924	/nfs/dbraw/zinc/64/19/24/356641924.db2.gz	UWYPFBDHFMEFMV-BBRMVZONSA-N	1	1	320.345	1.930	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000595849630	356676415	/nfs/dbraw/zinc/67/64/15/356676415.db2.gz	UWAYOLXVSLALJJ-BJHJDKERSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@]1(C)CO	ZINC000595872679	356686565	/nfs/dbraw/zinc/68/65/65/356686565.db2.gz	KQFWZSHIPVPKLP-BLLLJJGKSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@]1(C)CO	ZINC000595872679	356686571	/nfs/dbraw/zinc/68/65/71/356686571.db2.gz	KQFWZSHIPVPKLP-BLLLJJGKSA-N	1	1	321.377	1.508	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1c(Cl)cncc1[N+](=O)[O-]	ZINC000596073316	356762487	/nfs/dbraw/zinc/76/24/87/356762487.db2.gz	IPYFTAIFWJOPER-UHFFFAOYSA-N	1	1	302.762	1.445	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596265786	356838055	/nfs/dbraw/zinc/83/80/55/356838055.db2.gz	MGLZUYXMSHMAET-LBPRGKRZSA-N	1	1	306.366	1.613	20	5		DDBDMO
Cc1cc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ncc1[N+](=O)[O-]	ZINC000596537185	356910146	/nfs/dbraw/zinc/91/01/46/356910146.db2.gz	BYXHGLCNEMUJQK-CYBMUJFWSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000596815462	356983622	/nfs/dbraw/zinc/98/36/22/356983622.db2.gz	AJTQZUFRAYXIBV-NSHDSACASA-N	1	1	321.381	1.654	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+](C)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000597603808	357250984	/nfs/dbraw/zinc/25/09/84/357250984.db2.gz	DYOBGHRWLUHRIW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](C)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000597603808	357250987	/nfs/dbraw/zinc/25/09/87/357250987.db2.gz	DYOBGHRWLUHRIW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](C)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000597603808	357250989	/nfs/dbraw/zinc/25/09/89/357250989.db2.gz	DYOBGHRWLUHRIW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597945947	357394011	/nfs/dbraw/zinc/39/40/11/357394011.db2.gz	KYAIOCCKIRDARM-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)CCCC(=O)NC)ccc1[N+](=O)[O-]	ZINC000276828309	213118882	/nfs/dbraw/zinc/11/88/82/213118882.db2.gz	ANTIYZWDHIDDNJ-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000598343145	357545536	/nfs/dbraw/zinc/54/55/36/357545536.db2.gz	RHPZVGRGYKPJOM-SNVBAGLBSA-N	1	1	317.349	1.685	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000598560407	357633162	/nfs/dbraw/zinc/63/31/62/357633162.db2.gz	LDDMUVIXRVISLB-GFCCVEGCSA-N	1	1	321.381	1.478	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-]	ZINC000292364530	223025580	/nfs/dbraw/zinc/02/55/80/223025580.db2.gz	WHDZNWWUSNGCOW-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
Cc1ccnc(N2CCC([NH+]3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000599104706	357816759	/nfs/dbraw/zinc/81/67/59/357816759.db2.gz	NFXMKICNOOVNSJ-UHFFFAOYSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[NH+]1CCN(CC2CN(c3ccc(F)cc3[N+](=O)[O-])C2)CC1	ZINC000599109937	357818348	/nfs/dbraw/zinc/81/83/48/357818348.db2.gz	YKWNXBBNMSTBJD-UHFFFAOYSA-N	1	1	308.357	1.418	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@H](O)C2)cc1OC(F)F	ZINC000599199649	357847315	/nfs/dbraw/zinc/84/73/15/357847315.db2.gz	OKHXORDZWDOXKY-JTQLQIEISA-N	1	1	317.292	1.675	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2CC[C@H](O)C2)c(C(F)(F)F)c1	ZINC000599200123	357847828	/nfs/dbraw/zinc/84/78/28/357847828.db2.gz	XGBJSYLRPJWXDQ-VIFPVBQESA-N	1	1	320.271	1.487	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(C)COC1	ZINC000599571544	357979484	/nfs/dbraw/zinc/97/94/84/357979484.db2.gz	KUVUUMXVSGAJKM-LLVKDONJSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc(N)cc1[N+](=O)[O-]	ZINC000286281618	291130800	/nfs/dbraw/zinc/13/08/00/291130800.db2.gz	IBWNSJVEFAXPOF-AAEUAGOBSA-N	1	1	306.366	1.476	20	5		DDBDMO
CC(=O)N1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000601098630	358401464	/nfs/dbraw/zinc/40/14/64/358401464.db2.gz	BJYQCENNKUMQKJ-UHFFFAOYSA-N	1	1	300.318	1.812	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181151804	199257574	/nfs/dbraw/zinc/25/75/74/199257574.db2.gz	KJFQPMGMTFAQBS-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](CO)C1	ZINC000601979257	358763681	/nfs/dbraw/zinc/76/36/81/358763681.db2.gz	BTZODQJXCPWCPW-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@@H](CO)C1	ZINC000601979257	358763684	/nfs/dbraw/zinc/76/36/84/358763684.db2.gz	BTZODQJXCPWCPW-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
CCOC(=O)CC1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602442014	358978917	/nfs/dbraw/zinc/97/89/17/358978917.db2.gz	IOYLZAXQQUVMTP-UHFFFAOYSA-N	1	1	310.354	1.494	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602453996	358987531	/nfs/dbraw/zinc/98/75/31/358987531.db2.gz	LTYGUHTXYCDPPR-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H](C[N@@H+](C)CC2CC2)C1	ZINC000602784241	359188783	/nfs/dbraw/zinc/18/87/83/359188783.db2.gz	RHYUXCCVFNBEGB-HNNXBMFYSA-N	1	1	321.425	1.763	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)C[C@H]1CO	ZINC000602931251	359300970	/nfs/dbraw/zinc/30/09/70/359300970.db2.gz	NTBRUIXSNRDESD-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)C[C@H]1CO	ZINC000602931251	359300973	/nfs/dbraw/zinc/30/09/73/359300973.db2.gz	NTBRUIXSNRDESD-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]1C[N@H+](CC(C)(C)O)CCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000186901315	200028303	/nfs/dbraw/zinc/02/83/03/200028303.db2.gz	BTBJVIYSMFFKAZ-JTQLQIEISA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000186901315	200028304	/nfs/dbraw/zinc/02/83/04/200028304.db2.gz	BTBJVIYSMFFKAZ-JTQLQIEISA-N	1	1	311.338	1.105	20	5		DDBDMO
CO[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000189318114	200381093	/nfs/dbraw/zinc/38/10/93/200381093.db2.gz	UBUONCFZSBKOJG-INWMFGNUSA-N	1	1	324.377	1.691	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000610910068	360570382	/nfs/dbraw/zinc/57/03/82/360570382.db2.gz	NJHXJLHTICBRFG-GFCCVEGCSA-N	1	1	309.341	1.640	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000611256835	360680817	/nfs/dbraw/zinc/68/08/17/360680817.db2.gz	JCSZOHFHATYCQE-QWRGUYRKSA-N	1	1	306.366	1.483	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000611296529	360692991	/nfs/dbraw/zinc/69/29/91/360692991.db2.gz	OBTRIUBXJWHWSQ-HNNXBMFYSA-N	1	1	320.393	1.989	20	5		DDBDMO
O=C1N[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]2CO1	ZINC000281306442	216227044	/nfs/dbraw/zinc/22/70/44/216227044.db2.gz	QADWBLCTZYNVIM-MFKMUULPSA-N	1	1	309.297	1.664	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]2CO1	ZINC000281306442	216227045	/nfs/dbraw/zinc/22/70/45/216227045.db2.gz	QADWBLCTZYNVIM-MFKMUULPSA-N	1	1	309.297	1.664	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000193359076	201037304	/nfs/dbraw/zinc/03/73/04/201037304.db2.gz	ZYLHPDUEVNGNPL-LLVKDONJSA-N	1	1	322.365	1.690	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000613233718	361340515	/nfs/dbraw/zinc/34/05/15/361340515.db2.gz	XIWSRVOAGLCZLN-LBPRGKRZSA-N	1	1	318.377	1.851	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000193651105	201096363	/nfs/dbraw/zinc/09/63/63/201096363.db2.gz	IWAZEAFHFGTYAG-LLVKDONJSA-N	1	1	322.365	1.499	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619254977	363946537	/nfs/dbraw/zinc/94/65/37/363946537.db2.gz	ROJGCUDFHWSZFV-HIFRSBDPSA-N	1	1	321.352	1.782	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275347805	212283977	/nfs/dbraw/zinc/28/39/77/212283977.db2.gz	JAPOOYRZSSNTPK-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275347805	212283979	/nfs/dbraw/zinc/28/39/79/212283979.db2.gz	JAPOOYRZSSNTPK-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@H](O)CC2)c([N+](=O)[O-])c1	ZINC000293131635	223410487	/nfs/dbraw/zinc/41/04/87/223410487.db2.gz	MXEYIXUNUVRPPJ-LBPRGKRZSA-N	1	1	310.350	1.829	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])CC1	ZINC000349969037	284122658	/nfs/dbraw/zinc/12/26/58/284122658.db2.gz	FHCVEWHCCYGBSE-UHFFFAOYSA-N	1	1	321.381	1.823	20	5		DDBDMO
Cc1n[nH]cc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534887	193266656	/nfs/dbraw/zinc/26/66/56/193266656.db2.gz	BWRWCAWEZPUBBM-GFCCVEGCSA-N	1	1	302.338	1.708	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000264595003	204016928	/nfs/dbraw/zinc/01/69/28/204016928.db2.gz	AYWYXVQJSNDVTL-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000266480783	205376907	/nfs/dbraw/zinc/37/69/07/205376907.db2.gz	SWXUSVXOTYHJJO-HNNXBMFYSA-N	1	1	304.350	1.593	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1Cc2ccccc2C1	ZINC000266504457	205395092	/nfs/dbraw/zinc/39/50/92/205395092.db2.gz	AGTQWGMXVJIRTA-INIZCTEOSA-N	1	1	316.361	1.251	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]2Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000267465605	206087490	/nfs/dbraw/zinc/08/74/90/206087490.db2.gz	RVBYTOZUBMSKCM-NSHDSACASA-N	1	1	318.337	1.436	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000267599238	206164796	/nfs/dbraw/zinc/16/47/96/206164796.db2.gz	JBFABSXIDMFDPH-YPMHNXCESA-N	1	1	320.393	1.731	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000261732114	296228066	/nfs/dbraw/zinc/22/80/66/296228066.db2.gz	MAIBBBLIJBJANC-NSHDSACASA-N	1	1	318.358	1.838	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284408554	218014949	/nfs/dbraw/zinc/01/49/49/218014949.db2.gz	NUHFCYSEFFQDDC-ISVAXAHUSA-N	1	1	322.340	1.529	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000104672917	194024427	/nfs/dbraw/zinc/02/44/27/194024427.db2.gz	KAJADZKRLDYALD-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000104672917	194024429	/nfs/dbraw/zinc/02/44/29/194024429.db2.gz	KAJADZKRLDYALD-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)c(N)c([N+](=O)[O-])c1	ZINC000104897064	194051308	/nfs/dbraw/zinc/05/13/08/194051308.db2.gz	MJFPIJRNQITTNS-JTQLQIEISA-N	1	1	306.366	1.698	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H]3OCCN(C)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000284699811	218139220	/nfs/dbraw/zinc/13/92/20/218139220.db2.gz	IJXQQJVAFCZVEJ-JKSUJKDBSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000105825380	194138680	/nfs/dbraw/zinc/13/86/80/194138680.db2.gz	CQQJVZJJQAKOOM-UKRRQHHQSA-N	1	1	307.394	1.872	20	5		DDBDMO
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC000285077626	218282252	/nfs/dbraw/zinc/28/22/52/218282252.db2.gz	RUCPQXRSHYCBEH-NSHDSACASA-N	1	1	319.321	1.478	20	5		DDBDMO
O=C1CCC(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)CC1	ZINC000298036625	284784778	/nfs/dbraw/zinc/78/47/78/284784778.db2.gz	GTTIEKZQJKFSTC-UHFFFAOYSA-N	1	1	318.377	1.871	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1	ZINC000110007025	194303073	/nfs/dbraw/zinc/30/30/73/194303073.db2.gz	KRQTYFVJTXQOKC-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000066126254	184391013	/nfs/dbraw/zinc/39/10/13/184391013.db2.gz	FBXBEWGKCADHAP-JTQLQIEISA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[C@H](C)[N@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000066126254	184391014	/nfs/dbraw/zinc/39/10/14/184391014.db2.gz	FBXBEWGKCADHAP-JTQLQIEISA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000066126254	184391015	/nfs/dbraw/zinc/39/10/15/184391015.db2.gz	FBXBEWGKCADHAP-JTQLQIEISA-N	1	1	319.365	1.931	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157305927	197177929	/nfs/dbraw/zinc/17/79/29/197177929.db2.gz	SCUBNYFGNCYQMZ-OCCSQVGLSA-N	1	1	321.381	1.124	20	5		DDBDMO
CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000154925132	197006104	/nfs/dbraw/zinc/00/61/04/197006104.db2.gz	IYGCODNEPSMXDP-LLVKDONJSA-N	1	1	323.397	1.948	20	5		DDBDMO
CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000154925132	197006106	/nfs/dbraw/zinc/00/61/06/197006106.db2.gz	IYGCODNEPSMXDP-LLVKDONJSA-N	1	1	323.397	1.948	20	5		DDBDMO
CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000154925132	197006108	/nfs/dbraw/zinc/00/61/08/197006108.db2.gz	IYGCODNEPSMXDP-LLVKDONJSA-N	1	1	323.397	1.948	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](CO)COC(C)C	ZINC000433153526	533218898	/nfs/dbraw/zinc/21/88/98/533218898.db2.gz	PTGLRJZLOFYCMI-CQSZACIVSA-N	1	1	312.366	1.821	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](CO)COC(C)C	ZINC000433153526	533218901	/nfs/dbraw/zinc/21/89/01/533218901.db2.gz	PTGLRJZLOFYCMI-CQSZACIVSA-N	1	1	312.366	1.821	20	5		DDBDMO
C[C@H](O)CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000353520546	285781773	/nfs/dbraw/zinc/78/17/73/285781773.db2.gz	PMLJMNZEVFRHLV-FZMZJTMJSA-N	1	1	304.350	1.778	20	5		DDBDMO
[NH3+]CC(F)(F)CC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000568995631	304328184	/nfs/dbraw/zinc/32/81/84/304328184.db2.gz	KLLWOBQYVPXKGY-UHFFFAOYSA-N	1	1	302.281	1.107	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCS(=O)(=O)C1	ZINC000069144136	406687138	/nfs/dbraw/zinc/68/71/38/406687138.db2.gz	MYWPHWZTMVBVMX-LLVKDONJSA-N	1	1	314.363	1.270	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H]1CCCO1	ZINC000076299734	406962207	/nfs/dbraw/zinc/96/22/07/406962207.db2.gz	JACNUHYUQQGZNZ-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1CCCO1	ZINC000076299734	406962208	/nfs/dbraw/zinc/96/22/08/406962208.db2.gz	JACNUHYUQQGZNZ-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000090554574	407169441	/nfs/dbraw/zinc/16/94/41/407169441.db2.gz	RXXQAWZWGBXOIU-CFVMTHIKSA-N	1	1	321.377	1.502	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCN(CC(F)F)CC2)c1	ZINC000091084463	407177032	/nfs/dbraw/zinc/17/70/32/407177032.db2.gz	VCJYBEOWWHEHPF-UHFFFAOYSA-N	1	1	303.313	1.064	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCN(CC(F)F)CC2)c1	ZINC000091084463	407177035	/nfs/dbraw/zinc/17/70/35/407177035.db2.gz	VCJYBEOWWHEHPF-UHFFFAOYSA-N	1	1	303.313	1.064	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N1C[C@H]2CCC[C@@H](C1)[NH2+]2	ZINC000124662939	407365503	/nfs/dbraw/zinc/36/55/03/407365503.db2.gz	XMXOZHUNTUXIOZ-PHIMTYICSA-N	1	1	311.363	1.110	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000108566545	407388334	/nfs/dbraw/zinc/38/83/34/407388334.db2.gz	WZPLDULUABCJAH-CYBMUJFWSA-N	1	1	306.366	1.736	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000111265911	407403745	/nfs/dbraw/zinc/40/37/45/407403745.db2.gz	IMYRYRYBWOLBGF-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[NH+]1CCN([C@H]2CCCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000127027289	407425961	/nfs/dbraw/zinc/42/59/61/407425961.db2.gz	FXPCDCBJBWTJIZ-HNNXBMFYSA-N	1	1	319.409	1.596	20	5		DDBDMO
COc1cc(C[NH+]2CCC(CO)CC2)c([N+](=O)[O-])cc1OC	ZINC000127067174	407427571	/nfs/dbraw/zinc/42/75/71/407427571.db2.gz	BDONJWOEUIBSMR-UHFFFAOYSA-N	1	1	310.350	1.816	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@@H]2C1	ZINC000178632991	407519296	/nfs/dbraw/zinc/51/92/96/407519296.db2.gz	OTVMHRMIFUDWKR-CHWSQXEVSA-N	1	1	318.377	1.702	20	5		DDBDMO
CCN1CC[NH+]([C@@H]2CCN(c3cc(C)c([N+](=O)[O-])cn3)C2)CC1	ZINC000266849205	407654165	/nfs/dbraw/zinc/65/41/65/407654165.db2.gz	QLNZZVLQAASNNO-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000261984791	407702259	/nfs/dbraw/zinc/70/22/59/407702259.db2.gz	AVGVVOVSORCOSH-XJKSGUPXSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000261984791	407702263	/nfs/dbraw/zinc/70/22/63/407702263.db2.gz	AVGVVOVSORCOSH-XJKSGUPXSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000187280438	407840644	/nfs/dbraw/zinc/84/06/44/407840644.db2.gz	ZUZLXQKUEMCSLT-WXJAXGNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000187280438	407840645	/nfs/dbraw/zinc/84/06/45/407840645.db2.gz	ZUZLXQKUEMCSLT-WXJAXGNASA-N	1	1	319.361	1.133	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000133550734	407857534	/nfs/dbraw/zinc/85/75/34/407857534.db2.gz	YXRJVUHWJAOUHU-CMPLNLGQSA-N	1	1	318.377	1.992	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000173715084	407895373	/nfs/dbraw/zinc/89/53/73/407895373.db2.gz	KNMYGBMURUTIJY-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000272493326	407946358	/nfs/dbraw/zinc/94/63/58/407946358.db2.gz	CPQSZZCAQHMBKT-YGRLFVJLSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000272493326	407946363	/nfs/dbraw/zinc/94/63/63/407946363.db2.gz	CPQSZZCAQHMBKT-YGRLFVJLSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000272506525	407953857	/nfs/dbraw/zinc/95/38/57/407953857.db2.gz	JHLUUSGATXIKIQ-PWSUYJOCSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000272506525	407953860	/nfs/dbraw/zinc/95/38/60/407953860.db2.gz	JHLUUSGATXIKIQ-PWSUYJOCSA-N	1	1	307.350	1.855	20	5		DDBDMO
O=C(C[N@@H+](CCCCO)C1CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000118844251	407955124	/nfs/dbraw/zinc/95/51/24/407955124.db2.gz	SZEAHMWWLRNWEW-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(C[N@H+](CCCCO)C1CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000118844251	407955128	/nfs/dbraw/zinc/95/51/28/407955128.db2.gz	SZEAHMWWLRNWEW-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H](C)NC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245433118	407977716	/nfs/dbraw/zinc/97/77/16/407977716.db2.gz	BROSCZJIYGSURI-NWDGAFQWSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[C@H](C)NC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245433118	407977725	/nfs/dbraw/zinc/97/77/25/407977725.db2.gz	BROSCZJIYGSURI-NWDGAFQWSA-N	1	1	321.381	1.391	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000134624426	407918168	/nfs/dbraw/zinc/91/81/68/407918168.db2.gz	OVTZDWVUJZGSED-ZDUSSCGKSA-N	1	1	316.361	1.829	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1CC[NH+](CCO)CC1	ZINC000175062925	408042306	/nfs/dbraw/zinc/04/23/06/408042306.db2.gz	NMOSAGBBSUJWKY-UHFFFAOYSA-N	1	1	309.366	1.103	20	5		DDBDMO
CC[C@@]1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000135700829	408049438	/nfs/dbraw/zinc/04/94/38/408049438.db2.gz	WGWXTUYPBZTOOJ-BBRMVZONSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000135700829	408049444	/nfs/dbraw/zinc/04/94/44/408049444.db2.gz	WGWXTUYPBZTOOJ-BBRMVZONSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272577426	407991642	/nfs/dbraw/zinc/99/16/42/407991642.db2.gz	GJQORMICQLVFOZ-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@@H]1O	ZINC000182256751	408107292	/nfs/dbraw/zinc/10/72/92/408107292.db2.gz	NZUIBEWWRDPCIU-IPYPFGDCSA-N	1	1	324.377	1.427	20	5		DDBDMO
COc1ccc(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000155075873	408123225	/nfs/dbraw/zinc/12/32/25/408123225.db2.gz	QEYZWTYELLIKIS-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000190201352	408188495	/nfs/dbraw/zinc/18/84/95/408188495.db2.gz	GKUMNAZMSCZYPM-JTQLQIEISA-N	1	1	304.350	1.391	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000269322688	408268984	/nfs/dbraw/zinc/26/89/84/408268984.db2.gz	BTBHBPLJDJFSNT-VIFPVBQESA-N	1	1	309.370	1.654	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000273674896	408285493	/nfs/dbraw/zinc/28/54/93/408285493.db2.gz	YDVNYZKTOZYGDU-LLVKDONJSA-N	1	1	313.379	1.167	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000246556327	408290399	/nfs/dbraw/zinc/29/03/99/408290399.db2.gz	KSAGSJCWHRTRND-XJKSGUPXSA-N	1	1	319.409	1.740	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000134708993	162085266	/nfs/dbraw/zinc/08/52/66/162085266.db2.gz	IZMWMRJFHTVUOP-ZDUSSCGKSA-N	1	1	307.398	1.740	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccccc1	ZINC000158946623	408370987	/nfs/dbraw/zinc/37/09/87/408370987.db2.gz	VFXVVWUATPWWTL-GFCCVEGCSA-N	1	1	317.349	1.221	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1C	ZINC000274660454	408486163	/nfs/dbraw/zinc/48/61/63/408486163.db2.gz	YSMGRNGSUQXUFB-GHMZBOCLSA-N	1	1	306.366	1.732	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000177213530	408552752	/nfs/dbraw/zinc/55/27/52/408552752.db2.gz	CNXGJJXMYGKGBZ-JQWIXIFHSA-N	1	1	321.381	1.231	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2	ZINC000274943389	408572348	/nfs/dbraw/zinc/57/23/48/408572348.db2.gz	FTNHLXGXWPGXAB-UHFFFAOYSA-N	1	1	316.317	1.115	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000248674784	408614102	/nfs/dbraw/zinc/61/41/02/408614102.db2.gz	CMFKGAQTQTZNQR-OAHLLOKOSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000248674784	408614107	/nfs/dbraw/zinc/61/41/07/408614107.db2.gz	CMFKGAQTQTZNQR-OAHLLOKOSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000248674784	408614113	/nfs/dbraw/zinc/61/41/13/408614113.db2.gz	CMFKGAQTQTZNQR-OAHLLOKOSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270858192	408712011	/nfs/dbraw/zinc/71/20/11/408712011.db2.gz	HTSLTFKLXPPEAY-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270858192	408712015	/nfs/dbraw/zinc/71/20/15/408712015.db2.gz	HTSLTFKLXPPEAY-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@@H](NC(=O)[C@H]1C[N@H+](CC)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177789115	408713691	/nfs/dbraw/zinc/71/36/91/408713691.db2.gz	LTXOLJLUKDMAAT-HUUCEWRRSA-N	1	1	321.377	1.883	20	5		DDBDMO
CC[C@@H](NC(=O)[C@H]1C[N@@H+](CC)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177789115	408713696	/nfs/dbraw/zinc/71/36/96/408713696.db2.gz	LTXOLJLUKDMAAT-HUUCEWRRSA-N	1	1	321.377	1.883	20	5		DDBDMO
CO[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C	ZINC000251697201	408785501	/nfs/dbraw/zinc/78/55/01/408785501.db2.gz	JTFVLQOWJJIDGS-IUODEOHRSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C	ZINC000251697201	408785504	/nfs/dbraw/zinc/78/55/04/408785504.db2.gz	JTFVLQOWJJIDGS-IUODEOHRSA-N	1	1	321.377	1.914	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001139	408755111	/nfs/dbraw/zinc/75/51/11/408755111.db2.gz	BQXDVDZVXPOLJA-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001139	408755115	/nfs/dbraw/zinc/75/51/15/408755115.db2.gz	BQXDVDZVXPOLJA-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001139	408755117	/nfs/dbraw/zinc/75/51/17/408755117.db2.gz	BQXDVDZVXPOLJA-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000276510832	408872592	/nfs/dbraw/zinc/87/25/92/408872592.db2.gz	DTXNBLDIJCIQQA-NSHDSACASA-N	1	1	308.338	1.673	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000194747249	163295880	/nfs/dbraw/zinc/29/58/80/163295880.db2.gz	DXWIZJDRNLQLCR-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000291992230	408957663	/nfs/dbraw/zinc/95/76/63/408957663.db2.gz	WXKLQIDYYJDNME-KBPBESRZSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H](C)C1	ZINC000286392599	408976645	/nfs/dbraw/zinc/97/66/45/408976645.db2.gz	HAZWBTDMWYBFJD-GFCCVEGCSA-N	1	1	321.377	1.987	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000277929622	409035826	/nfs/dbraw/zinc/03/58/26/409035826.db2.gz	UEXBVVYLMBBCLP-SNVBAGLBSA-N	1	1	305.338	1.604	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000277926126	409036443	/nfs/dbraw/zinc/03/64/43/409036443.db2.gz	HJITYOKZFJMPDL-LBPRGKRZSA-N	1	1	307.350	1.354	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H](C)CO	ZINC000293540480	409134308	/nfs/dbraw/zinc/13/43/08/409134308.db2.gz	XYVYYICFYUNISA-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)n1	ZINC000287723355	409082323	/nfs/dbraw/zinc/08/23/23/409082323.db2.gz	FKUQSNPAWRNZQE-VHSXEESVSA-N	1	1	320.349	1.814	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NCC2=CC[N@@H+](C)CC2)c1	ZINC000283207998	409111511	/nfs/dbraw/zinc/11/15/11/409111511.db2.gz	RIWFPPZWBAYPBM-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C2)C1	ZINC000293861858	409195990	/nfs/dbraw/zinc/19/59/90/409195990.db2.gz	KQOLGHFJYFBELY-HNNXBMFYSA-N	1	1	304.350	1.345	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000279486159	409224323	/nfs/dbraw/zinc/22/43/23/409224323.db2.gz	RENRAPWRKUQVIZ-TVQRCGJNSA-N	1	1	324.356	1.728	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)CNc3ccccc3[N+](=O)[O-])C2)C1	ZINC000293919228	409206861	/nfs/dbraw/zinc/20/68/61/409206861.db2.gz	PFPIDGCDDYQZME-MRXNPFEDSA-N	1	1	318.377	1.561	20	5		DDBDMO
CN1CC[NH+](CCNc2ccc([N+](=O)[O-])c3cnccc23)CC1	ZINC000280260655	409280873	/nfs/dbraw/zinc/28/08/73/409280873.db2.gz	CCDDMILFZBTARL-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422424	409309657	/nfs/dbraw/zinc/30/96/57/409309657.db2.gz	LYDYQVQSSKOKNT-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422424	409309658	/nfs/dbraw/zinc/30/96/58/409309658.db2.gz	LYDYQVQSSKOKNT-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000290225738	409326984	/nfs/dbraw/zinc/32/69/84/409326984.db2.gz	VMOHSKNMDWWIFJ-UHFFFAOYSA-N	1	1	322.409	1.137	20	5		DDBDMO
CN(CCCNC(=O)Cc1ccccc1[N+](=O)[O-])CC[NH+](C)C	ZINC000290225738	409326991	/nfs/dbraw/zinc/32/69/91/409326991.db2.gz	VMOHSKNMDWWIFJ-UHFFFAOYSA-N	1	1	322.409	1.137	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000295210655	409378183	/nfs/dbraw/zinc/37/81/83/409378183.db2.gz	LMGYJRCGKBGZQI-LQYUOIDQSA-N	1	1	307.325	1.768	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198842	164026053	/nfs/dbraw/zinc/02/60/53/164026053.db2.gz	NMIWHHPMHQMUFW-WDMOLILDSA-N	1	1	305.334	1.236	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198842	164026057	/nfs/dbraw/zinc/02/60/57/164026057.db2.gz	NMIWHHPMHQMUFW-WDMOLILDSA-N	1	1	305.334	1.236	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C[N@@H+](C)C(C)C)n1	ZINC000319808622	164038726	/nfs/dbraw/zinc/03/87/26/164038726.db2.gz	ZGKWMCHXTPVKBW-JTQLQIEISA-N	1	1	310.354	1.917	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000322339199	164047059	/nfs/dbraw/zinc/04/70/59/164047059.db2.gz	BPZNZCQJDOXCJM-WDEREUQCSA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1cn(C[C@H](O)C[N@H+]2CCc3ccccc3C2)nc1[N+](=O)[O-]	ZINC000362330340	164156437	/nfs/dbraw/zinc/15/64/37/164156437.db2.gz	PSJLOTRDHNHEIG-OAHLLOKOSA-N	1	1	316.361	1.519	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(Cc3cc([O-])ccc3[N+](=O)[O-])[C@H]2C1	ZINC000407999006	164193343	/nfs/dbraw/zinc/19/33/43/164193343.db2.gz	SORWLXFFJBWCFM-LSDHHAIUSA-N	1	1	307.350	1.205	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000407999006	164193348	/nfs/dbraw/zinc/19/33/48/164193348.db2.gz	SORWLXFFJBWCFM-LSDHHAIUSA-N	1	1	307.350	1.205	20	5		DDBDMO
CC[N@H+]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000303971317	409555437	/nfs/dbraw/zinc/55/54/37/409555437.db2.gz	DITLNKOXAYNELE-HNNXBMFYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CCN1CCC[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000303971317	409555445	/nfs/dbraw/zinc/55/54/45/409555445.db2.gz	DITLNKOXAYNELE-HNNXBMFYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CCN1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000303971317	409555455	/nfs/dbraw/zinc/55/54/55/409555455.db2.gz	DITLNKOXAYNELE-HNNXBMFYSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[N@H+](Cc1ccc(F)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304290950	409597732	/nfs/dbraw/zinc/59/77/32/409597732.db2.gz	GNVBVCABYHPNED-AWEZNQCLSA-N	1	1	308.313	1.423	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2C2CCOCC2)c1	ZINC000348946812	409601425	/nfs/dbraw/zinc/60/14/25/409601425.db2.gz	HLNCJNFAGKKWQM-CABCVRRESA-N	1	1	324.381	1.043	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000346057074	409742129	/nfs/dbraw/zinc/74/21/29/409742129.db2.gz	UJAWROYQPHOHLL-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1OC	ZINC000357170829	409918560	/nfs/dbraw/zinc/91/85/60/409918560.db2.gz	LVSIYPWRGBOAMY-JTQLQIEISA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1OC	ZINC000357170829	409918567	/nfs/dbraw/zinc/91/85/67/409918567.db2.gz	LVSIYPWRGBOAMY-JTQLQIEISA-N	1	1	323.349	1.388	20	5		DDBDMO
C[N@@H+]1CC=C(CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000354622322	409973577	/nfs/dbraw/zinc/97/35/77/409973577.db2.gz	KNHMSTOEAOPIPJ-UHFFFAOYSA-N	1	1	317.392	1.197	20	5		DDBDMO
C[C@@H]1CCNC(=O)[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332215409	409982851	/nfs/dbraw/zinc/98/28/51/409982851.db2.gz	WPRQSTJYAHDYLW-AMIZOPFISA-N	1	1	303.322	1.085	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332228479	409995728	/nfs/dbraw/zinc/99/57/28/409995728.db2.gz	LIEXJGVTLDXTAY-QWRGUYRKSA-N	1	1	303.366	1.996	20	5		DDBDMO
C[N@H+]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000298072228	410102327	/nfs/dbraw/zinc/10/23/27/410102327.db2.gz	CRBOYSLTIYOAHH-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CN1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000298072228	410102331	/nfs/dbraw/zinc/10/23/31/410102331.db2.gz	CRBOYSLTIYOAHH-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CN1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000298072228	410102335	/nfs/dbraw/zinc/10/23/35/410102335.db2.gz	CRBOYSLTIYOAHH-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
Nc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000298746872	410379185	/nfs/dbraw/zinc/37/91/85/410379185.db2.gz	UXLCKKDRVNBIOG-GFCCVEGCSA-N	1	1	314.349	1.653	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)Nc1c[nH+]ccc1-n1cccn1	ZINC000358621627	410497175	/nfs/dbraw/zinc/49/71/75/410497175.db2.gz	YGZJOZYWSYNHSE-UHFFFAOYSA-N	1	1	313.277	1.011	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000330436399	410689979	/nfs/dbraw/zinc/68/99/79/410689979.db2.gz	MMIPFIFGOJRHSM-LLVKDONJSA-N	1	1	309.370	1.127	20	5		DDBDMO
COCCn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cn1	ZINC000337270155	410683741	/nfs/dbraw/zinc/68/37/41/410683741.db2.gz	ZMDUVYLSRLJZDA-UHFFFAOYSA-N	1	1	308.313	1.867	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2ccc([N+](=O)[O-])n2C)C[C@H](C)O1	ZINC000330535287	410756969	/nfs/dbraw/zinc/75/69/69/410756969.db2.gz	JDLRAVUEVMZUJK-TXEJJXNPSA-N	1	1	324.381	1.162	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343914970	410803202	/nfs/dbraw/zinc/80/32/02/410803202.db2.gz	WJUIARQZKPMYLV-IUODEOHRSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344032850	410908775	/nfs/dbraw/zinc/90/87/75/410908775.db2.gz	DXYADTZBPRABOV-PKIAMQTDSA-N	1	1	319.361	1.625	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ncccn2)n1	ZINC000580661002	422947194	/nfs/dbraw/zinc/94/71/94/422947194.db2.gz	ZPSQVWMXBWWMEI-NWDGAFQWSA-N	1	1	302.338	1.855	20	5		DDBDMO
C[C@H]1COCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000295615548	225051255	/nfs/dbraw/zinc/05/12/55/225051255.db2.gz	DOCQAEIIZUNIJZ-JTQLQIEISA-N	1	1	311.313	1.783	20	5		DDBDMO
C[C@H]1COCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000295615548	225051258	/nfs/dbraw/zinc/05/12/58/225051258.db2.gz	DOCQAEIIZUNIJZ-JTQLQIEISA-N	1	1	311.313	1.783	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCn3c[nH+]cc3C2)n1	ZINC000350889819	306758796	/nfs/dbraw/zinc/75/87/96/306758796.db2.gz	NWAQTLGKKJPFBK-QMMMGPOBSA-N	1	1	315.293	1.305	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000367164090	418565047	/nfs/dbraw/zinc/56/50/47/418565047.db2.gz	GJZUVZLCBUOWFK-UHFFFAOYSA-N	1	1	308.382	1.460	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1c1nc(Cc2ccc([N+](=O)[O-])cn2)no1	ZINC000361262701	418614447	/nfs/dbraw/zinc/61/44/47/418614447.db2.gz	OOIHAIMKVUPMRK-CABZTGNLSA-N	1	1	303.322	1.629	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2C(=O)NC[C@H]2C1	ZINC000368230637	418707445	/nfs/dbraw/zinc/70/74/45/418707445.db2.gz	DYQZQBXUCHKQSW-JSGCOSHPSA-N	1	1	319.361	1.561	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583378	418685857	/nfs/dbraw/zinc/68/58/57/418685857.db2.gz	LMAOJIYEEQJBBP-IINYFYTJSA-N	1	1	320.349	1.443	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583378	418685860	/nfs/dbraw/zinc/68/58/60/418685860.db2.gz	LMAOJIYEEQJBBP-IINYFYTJSA-N	1	1	320.349	1.443	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000361588129	418687138	/nfs/dbraw/zinc/68/71/38/418687138.db2.gz	XQZHCFNGGAAHAH-XJKSGUPXSA-N	1	1	324.377	1.835	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000364924585	418822567	/nfs/dbraw/zinc/82/25/67/418822567.db2.gz	AXJYWWQSPNTYKW-QEJZJMRPSA-N	1	1	303.362	1.723	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](n3cncn3)C2)cc1	ZINC000372483321	418875905	/nfs/dbraw/zinc/87/59/05/418875905.db2.gz	UIJHTGYPADMOLL-CQSZACIVSA-N	1	1	317.349	1.902	20	5		DDBDMO
CC[C@H]1C(=O)NCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411292470	418889507	/nfs/dbraw/zinc/88/95/07/418889507.db2.gz	MRLRRCDBKMBNRK-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
CC[C@H]1C(=O)NCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411292470	418889509	/nfs/dbraw/zinc/88/95/09/418889509.db2.gz	MRLRRCDBKMBNRK-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])CC2)C1CC1	ZINC000372840595	418907418	/nfs/dbraw/zinc/90/74/18/418907418.db2.gz	VWHYNTQPSQAING-YUTCNCBUSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@H+](C[C@@H]1CC12CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840595	418907420	/nfs/dbraw/zinc/90/74/20/418907420.db2.gz	VWHYNTQPSQAING-YUTCNCBUSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840595	418907422	/nfs/dbraw/zinc/90/74/22/418907422.db2.gz	VWHYNTQPSQAING-YUTCNCBUSA-N	1	1	307.394	1.375	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@]12CCOC2)Nc1ccc([N+](=O)[O-])cc1	ZINC000421016429	419452802	/nfs/dbraw/zinc/45/28/02/419452802.db2.gz	JDSXRFSFFZGQGX-HNNXBMFYSA-N	1	1	305.334	1.788	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1	ZINC000429021286	419963674	/nfs/dbraw/zinc/96/36/74/419963674.db2.gz	PSNWQGQYJUZGEN-INIZCTEOSA-N	1	1	315.377	1.999	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@H]2COCCO2)CC1	ZINC000354616990	306780251	/nfs/dbraw/zinc/78/02/51/306780251.db2.gz	WHRLLDXQHIETOP-ZDUSSCGKSA-N	1	1	307.350	1.132	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000430928492	420210359	/nfs/dbraw/zinc/21/03/59/420210359.db2.gz	UFNYFSBWXSMQLC-CYBMUJFWSA-N	1	1	320.393	1.773	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC([NH3+])CC1	ZINC000430662791	420173401	/nfs/dbraw/zinc/17/34/01/420173401.db2.gz	JACXDHQTZWHLAY-UHFFFAOYSA-N	1	1	306.366	1.655	20	5		DDBDMO
CCOC(=O)c1cc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000450774689	420527374	/nfs/dbraw/zinc/52/73/74/420527374.db2.gz	DKZWJMAVTQVMSS-XHDPSFHLSA-N	1	1	319.361	1.912	20	5		DDBDMO
CC(C)c1ccc(C(=O)NC[C@@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000439715098	420532933	/nfs/dbraw/zinc/53/29/33/420532933.db2.gz	DDFKINXTFFLAEJ-INIZCTEOSA-N	1	1	321.377	1.515	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1	ZINC000452982816	420695192	/nfs/dbraw/zinc/69/51/92/420695192.db2.gz	BBQPOTZJWNHTBS-IINYFYTJSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000493134899	420764617	/nfs/dbraw/zinc/76/46/17/420764617.db2.gz	WAAYCDOUBMNUSO-WHIKILRWSA-N	1	1	301.346	1.771	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H](CO)[C@@H]1CCCO1	ZINC000447911293	420816939	/nfs/dbraw/zinc/81/69/39/420816939.db2.gz	ZMWAQJXWMDWBER-YPMHNXCESA-N	1	1	300.742	1.878	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000454376810	420849891	/nfs/dbraw/zinc/84/98/91/420849891.db2.gz	SVXJJVSKXZDPLH-SNVBAGLBSA-N	1	1	307.354	1.246	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000493442112	420851759	/nfs/dbraw/zinc/85/17/59/420851759.db2.gz	JANCTOQYPNFLPO-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000493442112	420851761	/nfs/dbraw/zinc/85/17/61/420851761.db2.gz	JANCTOQYPNFLPO-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000455996166	421085950	/nfs/dbraw/zinc/08/59/50/421085950.db2.gz	OZMSABPLEXPVTN-GWCFXTLKSA-N	1	1	319.365	1.198	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000456371176	421153392	/nfs/dbraw/zinc/15/33/92/421153392.db2.gz	GUASNUDPDQILOS-JTQLQIEISA-N	1	1	307.354	1.128	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000456371176	421153397	/nfs/dbraw/zinc/15/33/97/421153397.db2.gz	GUASNUDPDQILOS-JTQLQIEISA-N	1	1	307.354	1.128	20	5		DDBDMO
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NCC[NH+]1CCC1	ZINC000450202927	421162682	/nfs/dbraw/zinc/16/26/82/421162682.db2.gz	PWJBBLPUXZUVLK-UHFFFAOYSA-N	1	1	305.334	1.380	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000524720578	421268233	/nfs/dbraw/zinc/26/82/33/421268233.db2.gz	YRCCZXZAQNUHRW-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000524790868	421272300	/nfs/dbraw/zinc/27/23/00/421272300.db2.gz	WRLFAJGOGRHBOQ-NSHDSACASA-N	1	1	313.379	1.215	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000546103351	421284105	/nfs/dbraw/zinc/28/41/05/421284105.db2.gz	OIKBKMZESPWIAQ-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000546103351	421284108	/nfs/dbraw/zinc/28/41/08/421284108.db2.gz	OIKBKMZESPWIAQ-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548386067	421431040	/nfs/dbraw/zinc/43/10/40/421431040.db2.gz	YGYPHONTTFSNJH-MNOVXSKESA-N	1	1	321.381	1.422	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CN1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000515017675	421473366	/nfs/dbraw/zinc/47/33/66/421473366.db2.gz	CUIHFXCNWDGCTE-CQSZACIVSA-N	1	1	305.378	1.408	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000563990553	421563895	/nfs/dbraw/zinc/56/38/95/421563895.db2.gz	XDJZLNDGHCTLJG-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000571541937	421725825	/nfs/dbraw/zinc/72/58/25/421725825.db2.gz	BOJZXXUGUOASSU-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
C[C@@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+](C2CC2)C1	ZINC000575873025	422341928	/nfs/dbraw/zinc/34/19/28/422341928.db2.gz	PJNPGKWQCVAWOG-NSHDSACASA-N	1	1	316.365	1.558	20	5		DDBDMO
Cc1nc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594591805	422351357	/nfs/dbraw/zinc/35/13/57/422351357.db2.gz	LGTFJSZVWXHBHU-UTUOFQBUSA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1nc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594591805	422351358	/nfs/dbraw/zinc/35/13/58/422351358.db2.gz	LGTFJSZVWXHBHU-UTUOFQBUSA-N	1	1	308.382	2.208	20	5		DDBDMO
CNc1nccc(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597923239	422392159	/nfs/dbraw/zinc/39/21/59/422392159.db2.gz	NLLFVHQDVNARIQ-JTQLQIEISA-N	1	1	321.381	1.634	20	5		DDBDMO
COC(=O)c1ccnc(NCCC[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000598588736	422397441	/nfs/dbraw/zinc/39/74/41/422397441.db2.gz	BVQNAMVEBXCWKM-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(NCC[N@H+]3CCCOCC3)c2c1	ZINC000614982510	422495455	/nfs/dbraw/zinc/49/54/55/422495455.db2.gz	APYAKCZASPBHJJ-UHFFFAOYSA-N	1	1	317.349	1.672	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CCNCC1([NH3+])CCC1	ZINC000342097560	271296832	/nfs/dbraw/zinc/29/68/32/271296832.db2.gz	IDUXMWISTDLAOW-UHFFFAOYSA-N	1	1	322.365	1.403	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]CC1(N)CCC1	ZINC000342097560	271296836	/nfs/dbraw/zinc/29/68/36/271296836.db2.gz	IDUXMWISTDLAOW-UHFFFAOYSA-N	1	1	322.365	1.403	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CCCCS2(=O)=O)cs1	ZINC000344355425	272005959	/nfs/dbraw/zinc/00/59/59/272005959.db2.gz	LKXVUDZUWLBNLF-SNVBAGLBSA-N	1	1	304.393	1.713	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000344410911	272018372	/nfs/dbraw/zinc/01/83/72/272018372.db2.gz	CDBBRCINZCOVMW-BETUJISGSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000344671125	272085399	/nfs/dbraw/zinc/08/53/99/272085399.db2.gz	NNNWQHLQNGWAOM-ZDUSSCGKSA-N	1	1	323.397	1.418	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000346050856	272399365	/nfs/dbraw/zinc/39/93/65/272399365.db2.gz	RIDGHJDJRIVRCO-NEPJUHHUSA-N	1	1	323.397	1.431	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000299569155	277075831	/nfs/dbraw/zinc/07/58/31/277075831.db2.gz	TWYBBGBPBNPAGH-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000357312603	299005965	/nfs/dbraw/zinc/00/59/65/299005965.db2.gz	JNAMULTUGNQHIS-UWVGGRQHSA-N	1	1	305.338	1.127	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000363053467	300204424	/nfs/dbraw/zinc/20/44/24/300204424.db2.gz	LBUZUQZNJMDXED-OAHLLOKOSA-N	1	1	303.362	1.834	20	5		DDBDMO
CCn1ccc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000574911960	304697018	/nfs/dbraw/zinc/69/70/18/304697018.db2.gz	JRYFUUWOMBXMLG-ZDUSSCGKSA-N	1	1	320.349	1.341	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@@H]3CCCCCC[C@@H]32)c1	ZINC000375852254	302004745	/nfs/dbraw/zinc/00/47/45/302004745.db2.gz	WLCXRYGDGQNBPW-CFVMTHIKSA-N	1	1	308.382	1.807	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]12	ZINC000377717982	302218608	/nfs/dbraw/zinc/21/86/08/302218608.db2.gz	CWZIFSXAVOLACA-IUODEOHRSA-N	1	1	319.361	1.432	20	5		DDBDMO
Cc1cc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)ccc1F	ZINC000444739333	302394543	/nfs/dbraw/zinc/39/45/43/302394543.db2.gz	ADNONFMTAHSAHZ-CQSZACIVSA-N	1	1	322.340	1.732	20	5		DDBDMO
COc1c(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356544308	306855191	/nfs/dbraw/zinc/85/51/91/306855191.db2.gz	QTUVKWIBOCUSFL-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH]n1	ZINC000363366752	307026696	/nfs/dbraw/zinc/02/66/96/307026696.db2.gz	JRRSYQMPHPLBTH-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)n[nH]1	ZINC000363366752	307026697	/nfs/dbraw/zinc/02/66/97/307026697.db2.gz	JRRSYQMPHPLBTH-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n[nH]1	ZINC000363366752	307026698	/nfs/dbraw/zinc/02/66/98/307026698.db2.gz	JRRSYQMPHPLBTH-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@]3(CNC(=O)O3)C2)cc1[N+](=O)[O-]	ZINC000372747318	307174571	/nfs/dbraw/zinc/17/45/71/307174571.db2.gz	XVKUTRLIRWYKEN-HNNXBMFYSA-N	1	1	305.334	1.978	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@]3(CNC(=O)O3)C2)cc1[N+](=O)[O-]	ZINC000372747318	307174572	/nfs/dbraw/zinc/17/45/72/307174572.db2.gz	XVKUTRLIRWYKEN-HNNXBMFYSA-N	1	1	305.334	1.978	20	5		DDBDMO
Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000373798625	307195472	/nfs/dbraw/zinc/19/54/72/307195472.db2.gz	SNAQHXUZKQFKST-XNISGKROSA-N	1	1	315.373	1.795	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(Cc1ccccn1)[C@H]1CCC[NH2+]CC1	ZINC000375270750	307220044	/nfs/dbraw/zinc/22/00/44/307220044.db2.gz	VSNQKELPBSFYLM-RRFJBIMHSA-N	1	1	318.377	1.218	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000377601546	307274663	/nfs/dbraw/zinc/27/46/63/307274663.db2.gz	CGIUAJSHCMCEIW-VIFPVBQESA-N	1	1	308.294	1.200	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000377632360	307275092	/nfs/dbraw/zinc/27/50/92/307275092.db2.gz	UWTUBQCEGDRUMB-WDEREUQCSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000377632360	307275093	/nfs/dbraw/zinc/27/50/93/307275093.db2.gz	UWTUBQCEGDRUMB-WDEREUQCSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@H]12	ZINC000377647621	307275573	/nfs/dbraw/zinc/27/55/73/307275573.db2.gz	FSEYZLZFOIDPIT-JQWIXIFHSA-N	1	1	320.305	1.071	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@H]12	ZINC000377647621	307275574	/nfs/dbraw/zinc/27/55/74/307275574.db2.gz	FSEYZLZFOIDPIT-JQWIXIFHSA-N	1	1	320.305	1.071	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CC3(CO)COC3)C2)cc1	ZINC000574129197	308261899	/nfs/dbraw/zinc/26/18/99/308261899.db2.gz	DCTQIXSBBOXCFO-CQSZACIVSA-N	1	1	306.362	1.783	20	5		DDBDMO
Cc1c(CC(=O)N[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331426594	533838989	/nfs/dbraw/zinc/83/89/89/533838989.db2.gz	VCCZXDJVSPJGCL-ZDUSSCGKSA-N	1	1	303.362	1.799	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820686	521850561	/nfs/dbraw/zinc/85/05/61/521850561.db2.gz	VFVWBQRLPQETAJ-YGRLFVJLSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820686	521850574	/nfs/dbraw/zinc/85/05/74/521850574.db2.gz	VFVWBQRLPQETAJ-YGRLFVJLSA-N	1	1	322.365	1.085	20	5		DDBDMO
O=[N+]([O-])c1cc(Br)cnc1NCC[NH+]1CCC1	ZINC000431415512	534879714	/nfs/dbraw/zinc/87/97/14/534879714.db2.gz	ADQMJHFEBMZODT-UHFFFAOYSA-N	1	1	301.144	1.870	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@H+](CCCO)C2)c([N+](=O)[O-])c1	ZINC000295010718	534882124	/nfs/dbraw/zinc/88/21/24/534882124.db2.gz	SLMXSDIUKVCGAC-LLVKDONJSA-N	1	1	324.337	1.762	20	5		DDBDMO
CC(C)(C[NH+]1CCOCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000413967017	527083280	/nfs/dbraw/zinc/08/32/80/527083280.db2.gz	NRYLPFQYTQEZQY-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000299592612	527800242	/nfs/dbraw/zinc/80/02/42/527800242.db2.gz	FWIWMZCPQYWZKY-UHFFFAOYSA-N	1	1	301.368	1.133	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000330825860	527928283	/nfs/dbraw/zinc/92/82/83/527928283.db2.gz	IITFEEWEBYUZRJ-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000433165945	528009953	/nfs/dbraw/zinc/00/99/53/528009953.db2.gz	JGCJBLGHAHMGIU-CQSZACIVSA-N	1	1	312.366	1.691	20	5		DDBDMO
CCC[C@H](O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000296670101	528245586	/nfs/dbraw/zinc/24/55/86/528245586.db2.gz	GSORQUTXKARZSE-ZDUSSCGKSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000736571074	598499481	/nfs/dbraw/zinc/49/94/81/598499481.db2.gz	PHRRYZCGNLGANA-VIFPVBQESA-N	1	1	318.341	1.066	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)NCc1ccccn1)c1ccccc1[N+](=O)[O-]	ZINC000746048414	700003739	/nfs/dbraw/zinc/00/37/39/700003739.db2.gz	IGKZZFKJKHRDNU-LBPRGKRZSA-N	1	1	314.345	1.957	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964241	696378771	/nfs/dbraw/zinc/37/87/71/696378771.db2.gz	UJZCOFAZXRSHMP-QWHCGFSZSA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964241	696378772	/nfs/dbraw/zinc/37/87/72/696378772.db2.gz	UJZCOFAZXRSHMP-QWHCGFSZSA-N	1	1	323.397	1.766	20	5		DDBDMO
COCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000980577555	696804873	/nfs/dbraw/zinc/80/48/73/696804873.db2.gz	SGRDVXSVOOJKOU-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COCC(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000980577555	696804876	/nfs/dbraw/zinc/80/48/76/696804876.db2.gz	SGRDVXSVOOJKOU-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
O=C1N[C@H]2CC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000799179990	700126816	/nfs/dbraw/zinc/12/68/16/700126816.db2.gz	GPGSDKKNWTUGQP-SKDRFNHKSA-N	1	1	309.297	1.664	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000799179990	700126817	/nfs/dbraw/zinc/12/68/17/700126817.db2.gz	GPGSDKKNWTUGQP-SKDRFNHKSA-N	1	1	309.297	1.664	20	5		DDBDMO
Cc1nn(C[N@H+]2CCOCC[C@@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000774650750	697907307	/nfs/dbraw/zinc/90/73/07/697907307.db2.gz	RQFIMQUUVBCDFL-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCOCC[C@@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000774650750	697907309	/nfs/dbraw/zinc/90/73/09/697907309.db2.gz	RQFIMQUUVBCDFL-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749939811	700193286	/nfs/dbraw/zinc/19/32/86/700193286.db2.gz	UGPQXLDFYZBIES-SNVBAGLBSA-N	1	1	319.321	1.100	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749939811	700193288	/nfs/dbraw/zinc/19/32/88/700193288.db2.gz	UGPQXLDFYZBIES-SNVBAGLBSA-N	1	1	319.321	1.100	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000800374542	700219119	/nfs/dbraw/zinc/21/91/19/700219119.db2.gz	RTVUHMXMGJIIPE-XEZPLFJOSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC1(O)CCOCC1	ZINC000781966864	698667608	/nfs/dbraw/zinc/66/76/08/698667608.db2.gz	QBAGZWNZCPXVFM-AWEZNQCLSA-N	1	1	310.350	1.102	20	5		DDBDMO
Cc1sc(C(=O)OCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000750876924	700253006	/nfs/dbraw/zinc/25/30/06/700253006.db2.gz	CIYTXTXHZAXYCJ-UHFFFAOYSA-N	1	1	314.363	1.844	20	5		DDBDMO
COc1ccc2c(c1)CC[N@@H+](Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000783981583	698898494	/nfs/dbraw/zinc/89/84/94/698898494.db2.gz	YNBPDCNXXOFGCG-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000783981583	698898499	/nfs/dbraw/zinc/89/84/99/698898499.db2.gz	YNBPDCNXXOFGCG-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000786190881	699133133	/nfs/dbraw/zinc/13/31/33/699133133.db2.gz	OOXHKPMGVAPKSV-CABCVRRESA-N	1	1	310.350	1.366	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1C	ZINC000787328292	699206068	/nfs/dbraw/zinc/20/60/68/699206068.db2.gz	QKQBRDZKFRECBF-LERXQTSPSA-N	1	1	308.334	1.512	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000787329721	699206132	/nfs/dbraw/zinc/20/61/32/699206132.db2.gz	DEYFIXNZNRPAFU-ATGSNQNLSA-N	1	1	319.361	1.214	20	5		DDBDMO
Cc1c(C(=O)OCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000735893098	699709035	/nfs/dbraw/zinc/70/90/35/699709035.db2.gz	BNPKAEPUXHENKC-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000743637068	699921045	/nfs/dbraw/zinc/92/10/45/699921045.db2.gz	KXAUUXFULZNAOE-QWRGUYRKSA-N	1	1	306.366	1.698	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000796575365	699939816	/nfs/dbraw/zinc/93/98/16/699939816.db2.gz	OILNKEAFOLEXGZ-CQDKDKBSSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)Cc2ccccc21	ZINC000744385199	699947494	/nfs/dbraw/zinc/94/74/94/699947494.db2.gz	MZKFFYHYVHAYNT-IUODEOHRSA-N	1	1	316.361	1.772	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248481	700557968	/nfs/dbraw/zinc/55/79/68/700557968.db2.gz	NUTDEGVQLGLRCS-DZGCQCFKSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000755248481	700557969	/nfs/dbraw/zinc/55/79/69/700557969.db2.gz	NUTDEGVQLGLRCS-DZGCQCFKSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000761074705	700839615	/nfs/dbraw/zinc/83/96/15/700839615.db2.gz	FDRSQCOXOXFEPJ-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000761074705	700839617	/nfs/dbraw/zinc/83/96/17/700839617.db2.gz	FDRSQCOXOXFEPJ-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000761074705	700839619	/nfs/dbraw/zinc/83/96/19/700839619.db2.gz	FDRSQCOXOXFEPJ-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)N2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761076321	700840476	/nfs/dbraw/zinc/84/04/76/700840476.db2.gz	NRRLOSOLCXRHFT-YPMHNXCESA-N	1	1	320.393	1.866	20	5		DDBDMO
Cn1ccnc1[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000767116953	701084820	/nfs/dbraw/zinc/08/48/20/701084820.db2.gz	OSEKGCIFCAJLBZ-HIFRSBDPSA-N	1	1	316.361	1.851	20	5		DDBDMO
Cc1cccc(NCCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[nH+]1	ZINC000804452139	701191502	/nfs/dbraw/zinc/19/15/02/701191502.db2.gz	CCPNYQIGUQSMFJ-UHFFFAOYSA-N	1	1	317.349	1.897	20	5		DDBDMO
Cc1ccc([C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+]2CCCC2)o1	ZINC000839621514	701756651	/nfs/dbraw/zinc/75/66/51/701756651.db2.gz	AWEGIPOKBNRLKE-UPJWGTAASA-N	1	1	307.350	1.506	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000839693873	701786860	/nfs/dbraw/zinc/78/68/60/701786860.db2.gz	RTFCTUSZDBIPCR-BYCMXARLSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000839693873	701786864	/nfs/dbraw/zinc/78/68/64/701786864.db2.gz	RTFCTUSZDBIPCR-BYCMXARLSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CC[C@@]2(CCOC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000867956015	701852665	/nfs/dbraw/zinc/85/26/65/701852665.db2.gz	JRGPGFAYQNYDMO-JKSUJKDBSA-N	1	1	319.361	1.408	20	5		DDBDMO
CCN(C[C@H]1CCCO1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867970188	701862982	/nfs/dbraw/zinc/86/29/82/701862982.db2.gz	YRBNEPMMHNJUEQ-GDBMZVCRSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc(F)c([N+](=O)[O-])cc3CO)CC[C@H]21	ZINC000866209022	706649197	/nfs/dbraw/zinc/64/91/97/706649197.db2.gz	NEVSYRSBRFUYLY-ZWNOBZJWSA-N	1	1	309.341	1.757	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN[C@H](CO)C[NH+]2CCCCC2)cc1	ZINC000843112600	702821218	/nfs/dbraw/zinc/82/12/18/702821218.db2.gz	IRMFVOHOFICZPS-GOEBONIOSA-N	1	1	323.393	1.065	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC000843893515	702938939	/nfs/dbraw/zinc/93/89/39/702938939.db2.gz	OGNNCZXIKKXBTD-GXFFZTMASA-N	1	1	307.325	1.818	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1	ZINC000844435306	703031465	/nfs/dbraw/zinc/03/14/65/703031465.db2.gz	BWQDBZZCPDJUCQ-RYUDHWBXSA-N	1	1	316.308	1.273	20	5		DDBDMO
CC(C)[C@H]1CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000879600434	706734107	/nfs/dbraw/zinc/73/41/07/706734107.db2.gz	DSZVMHCACQMVPF-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
C[C@@H]1CN(Cc2cc(F)ccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000831792003	706781202	/nfs/dbraw/zinc/78/12/02/706781202.db2.gz	XWHQOWSUYRKTSQ-TXEJJXNPSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852436526	704047955	/nfs/dbraw/zinc/04/79/55/704047955.db2.gz	INPYGQXUUOINRZ-KGLIPLIRSA-N	1	1	321.333	1.155	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CC[N@H+](CC3CC3)C2)cc1	ZINC000819039571	704056745	/nfs/dbraw/zinc/05/67/45/704056745.db2.gz	RWDVJMDVCPPHRG-GOEBONIOSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CC[N@@H+](CC3CC3)C2)cc1	ZINC000819039571	704056748	/nfs/dbraw/zinc/05/67/48/704056748.db2.gz	RWDVJMDVCPPHRG-GOEBONIOSA-N	1	1	305.378	1.702	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000853966233	704341625	/nfs/dbraw/zinc/34/16/25/704341625.db2.gz	QKCVPHRRPMETOK-HNNXBMFYSA-N	1	1	305.378	1.939	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(NCC[N@@H+]3CC[C@H](O)C3)sc2c1	ZINC000858868126	704766616	/nfs/dbraw/zinc/76/66/16/704766616.db2.gz	VNGOJRMPHUPKGD-JTQLQIEISA-N	1	1	308.363	1.683	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC1	ZINC000822768459	705032134	/nfs/dbraw/zinc/03/21/34/705032134.db2.gz	ROIXTISUABPVND-UHFFFAOYSA-N	1	1	301.387	1.003	20	5		DDBDMO
COc1cc(COC(=O)Cn2c[nH+]cc2C)ccc1[N+](=O)[O-]	ZINC000859947463	705049803	/nfs/dbraw/zinc/04/98/03/705049803.db2.gz	GFCGLEDDLRVBKY-UHFFFAOYSA-N	1	1	305.290	1.852	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000823113408	705143783	/nfs/dbraw/zinc/14/37/83/705143783.db2.gz	XIVHQOZSCMMKSN-LBPRGKRZSA-N	1	1	301.387	1.049	20	5		DDBDMO
C[N@@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836658	705193701	/nfs/dbraw/zinc/19/37/01/705193701.db2.gz	HOCSLVMOBSCQKT-KBPBESRZSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836658	705193704	/nfs/dbraw/zinc/19/37/04/705193704.db2.gz	HOCSLVMOBSCQKT-KBPBESRZSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000874850086	705203577	/nfs/dbraw/zinc/20/35/77/705203577.db2.gz	NUJBKPZLAIGDOE-STQMWFEESA-N	1	1	304.350	1.486	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000823968188	705347182	/nfs/dbraw/zinc/34/71/82/705347182.db2.gz	MNTNISDNQSXLPM-ZJUUUORDSA-N	1	1	307.354	1.733	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825118400	705604061	/nfs/dbraw/zinc/60/40/61/705604061.db2.gz	SMTZNJCTSZGBEJ-ILXRZTDVSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000863322441	705900831	/nfs/dbraw/zinc/90/08/31/705900831.db2.gz	VOZAAMIGDRFXOF-SECBINFHSA-N	1	1	313.741	1.045	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2C)C1	ZINC000827328341	705976300	/nfs/dbraw/zinc/97/63/00/705976300.db2.gz	DWTPPJCEGZMBLM-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000877786411	706211826	/nfs/dbraw/zinc/21/18/26/706211826.db2.gz	GKRMQNRSOYMDJL-UHFFFAOYSA-N	1	1	311.313	1.624	20	5		DDBDMO
C[C@H](NC[C@H]1C[N@@H+](C)CCN1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036704	707284246	/nfs/dbraw/zinc/28/42/46/707284246.db2.gz	VKXWGKMFSIKDOI-RYUDHWBXSA-N	1	1	310.373	1.630	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000837175150	707592041	/nfs/dbraw/zinc/59/20/41/707592041.db2.gz	PBWPMFOCBVAEGR-UHFFFAOYSA-N	1	1	324.356	1.920	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1nc2sccn2c1[N+](=O)[O-]	ZINC000872779842	707597065	/nfs/dbraw/zinc/59/70/65/707597065.db2.gz	IWZUHWKZZBEOFM-ZJUUUORDSA-N	1	1	307.379	1.977	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872781506	707597413	/nfs/dbraw/zinc/59/74/13/707597413.db2.gz	UQKWXPOCQJOZJA-QWRGUYRKSA-N	1	1	302.338	1.310	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000882480312	707650317	/nfs/dbraw/zinc/65/03/17/707650317.db2.gz	PWFVRBAXXPUEMC-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
Cc1cc(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)cc([N+](=O)[O-])c1	ZINC000838909599	708001938	/nfs/dbraw/zinc/00/19/38/708001938.db2.gz	RSSLECPCGCLVTD-OTVXOJSOSA-N	1	1	320.345	1.923	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222605	708259832	/nfs/dbraw/zinc/25/98/32/708259832.db2.gz	WEXNUHHKLXNZFT-CHWSQXEVSA-N	1	1	306.366	1.334	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@@H]([C@H]2CCCN(Cc3cccnc3[N+](=O)[O-])C2)C1	ZINC000886839776	708858623	/nfs/dbraw/zinc/85/86/23/708858623.db2.gz	LVBXBWGPVGWLNV-NWANDNLSSA-N	1	1	320.393	1.708	20	5		DDBDMO
O=C1C[C@H]([N@@H+]2CC[C@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303592	709012272	/nfs/dbraw/zinc/01/22/72/709012272.db2.gz	XFUJJEKFCRKDRJ-MFKMUULPSA-N	1	1	321.308	1.518	20	5		DDBDMO
O=C1C[C@H]([N@H+]2CC[C@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303592	709012274	/nfs/dbraw/zinc/01/22/74/709012274.db2.gz	XFUJJEKFCRKDRJ-MFKMUULPSA-N	1	1	321.308	1.518	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C1C[NH+]([C@@H]2CCOC2)C1	ZINC000899910615	709234902	/nfs/dbraw/zinc/23/49/02/709234902.db2.gz	KAPCFLKNVFAGJZ-CYBMUJFWSA-N	1	1	305.334	1.562	20	5		DDBDMO
Cc1cccc(C(=O)N2CCN(C)CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000888996719	709427550	/nfs/dbraw/zinc/42/75/50/709427550.db2.gz	CBJBWNZKYUOXLW-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1cccc(C(=O)N2CCN(C)CC[N@H+](C)CC2)c1[N+](=O)[O-]	ZINC000888996719	709427551	/nfs/dbraw/zinc/42/75/51/709427551.db2.gz	CBJBWNZKYUOXLW-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000928247988	713157455	/nfs/dbraw/zinc/15/74/55/713157455.db2.gz	GCJFLDMBADPCOF-CHWSQXEVSA-N	1	1	320.393	1.408	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NC1CCN(C2CC[NH+](C)CC2)CC1	ZINC000892154115	710382452	/nfs/dbraw/zinc/38/24/52/710382452.db2.gz	VUGATXQQNRNJIW-UHFFFAOYSA-N	1	1	322.413	1.299	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1C	ZINC000928438955	713196605	/nfs/dbraw/zinc/19/66/05/713196605.db2.gz	VFZNLKJHLJPXBT-WDEREUQCSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[N@@H+]1CCCC[C@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F	ZINC000911477205	710814261	/nfs/dbraw/zinc/81/42/61/710814261.db2.gz	UEYYNIMRRBDYFC-LBPRGKRZSA-N	1	1	313.304	1.974	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F	ZINC000911477205	710814262	/nfs/dbraw/zinc/81/42/62/710814262.db2.gz	UEYYNIMRRBDYFC-LBPRGKRZSA-N	1	1	313.304	1.974	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2OC)C[C@@H]1C	ZINC000894350675	711081156	/nfs/dbraw/zinc/08/11/56/711081156.db2.gz	RTRFGLKLYPJROI-TXEJJXNPSA-N	1	1	324.381	1.544	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2OC)C[C@@H]1C	ZINC000894350675	711081161	/nfs/dbraw/zinc/08/11/61/711081161.db2.gz	RTRFGLKLYPJROI-TXEJJXNPSA-N	1	1	324.381	1.544	20	5		DDBDMO
COC[C@@H](CO)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000894620515	711219190	/nfs/dbraw/zinc/21/91/90/711219190.db2.gz	UVWISHLNGFFGQC-SNVBAGLBSA-N	1	1	308.256	1.711	20	5		DDBDMO
O=[N+]([O-])CCNc1ccc(N2CCOCC2)c2cc[nH+]cc12	ZINC000905300675	711997434	/nfs/dbraw/zinc/99/74/34/711997434.db2.gz	KFJGWAOZDKBLFP-UHFFFAOYSA-N	1	1	302.334	1.760	20	5		DDBDMO
C[C@H](NC(=O)C1CN(C)CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000908511390	712793196	/nfs/dbraw/zinc/79/31/96/712793196.db2.gz	DKTVABFYGRQOIW-LBPRGKRZSA-N	1	1	320.393	1.265	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-]	ZINC000922164754	713980134	/nfs/dbraw/zinc/98/01/34/713980134.db2.gz	RHRWMDDCHAYKRJ-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@H+](C)[C@@H](CO)C1	ZINC000931408731	714087780	/nfs/dbraw/zinc/08/77/80/714087780.db2.gz	DRZWCMSTMDMYBH-OAHLLOKOSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C)[C@@H](CO)C1	ZINC000931408731	714087783	/nfs/dbraw/zinc/08/77/83/714087783.db2.gz	DRZWCMSTMDMYBH-OAHLLOKOSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000933372687	714574659	/nfs/dbraw/zinc/57/46/59/714574659.db2.gz	UPNUBXYBWPCHSM-YPMHNXCESA-N	1	1	323.397	1.431	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2	ZINC000933758444	714665502	/nfs/dbraw/zinc/66/55/02/714665502.db2.gz	ATDPCLIDBPVLHX-LRDDRELGSA-N	1	1	319.361	1.561	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCC[N@H+]1CCCC(C)(C)C1	ZINC000935679046	715116114	/nfs/dbraw/zinc/11/61/14/715116114.db2.gz	WBMCNXXJXRPHBY-UHFFFAOYSA-N	1	1	323.397	1.338	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CCCCC2)C1	ZINC000950055719	720469839	/nfs/dbraw/zinc/46/98/39/720469839.db2.gz	NFCOAKGURLNSHK-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
Cc1ccccc1CCC[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126938510	742872232	/nfs/dbraw/zinc/87/22/32/742872232.db2.gz	CDGQJUNPVCDEDV-HUUCEWRRSA-N	1	1	305.378	1.299	20	5		DDBDMO
COC1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC001122028787	745051821	/nfs/dbraw/zinc/05/18/21/745051821.db2.gz	RJEVIVSSVVBRED-HNNXBMFYSA-N	1	1	307.350	1.406	20	5		DDBDMO
Cc1cc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)s1	ZINC001031660948	747333455	/nfs/dbraw/zinc/33/34/55/747333455.db2.gz	XZKPQYACBHLWFN-ZIAGYGMSSA-N	1	1	323.418	1.578	20	5		DDBDMO
O=C(NCc1ccc(C[NH2+]CC2CCC2)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034815714	750916431	/nfs/dbraw/zinc/91/64/31/750916431.db2.gz	BTIFREWGSXSUQT-HZPDHXFCSA-N	1	1	317.389	1.858	20	5		DDBDMO
CCOC(=O)[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)C1CCOCC1	ZINC001168977383	762147111	/nfs/dbraw/zinc/14/71/11/762147111.db2.gz	BDBHWWROLXYGIF-IACUBPJLSA-N	1	1	314.382	1.380	20	5		DDBDMO
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169007215	762175069	/nfs/dbraw/zinc/17/50/69/762175069.db2.gz	LWUCKTKQSZHBRU-XQLPTFJDSA-N	1	1	317.389	1.713	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@]3(CCN3c3ncccn3)C2)C1	ZINC001169019736	762199833	/nfs/dbraw/zinc/19/98/33/762199833.db2.gz	JEJZIQYLZAAPHA-FMKPAKJESA-N	1	1	317.393	1.577	20	5		DDBDMO
Cc1nccnc1O[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169051989	762206848	/nfs/dbraw/zinc/20/68/48/762206848.db2.gz	DYYQVNSAPAUZHP-BFHYXJOUSA-N	1	1	306.366	1.684	20	5		DDBDMO
O=C(NC1CC1)[C@H]1C[C@H]2C[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2C1	ZINC001169023545	762201311	/nfs/dbraw/zinc/20/13/11/762201311.db2.gz	OYWUCPYYTJYXPR-AQDIXCGQSA-N	1	1	321.421	1.668	20	5		DDBDMO
CCOCc1ncn2c1C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169025768	762203692	/nfs/dbraw/zinc/20/36/92/762203692.db2.gz	UVKOYHBALNIAKV-STQMWFEESA-N	1	1	308.382	1.681	20	5		DDBDMO
CCOCc1ncn2c1C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169025768	762203699	/nfs/dbraw/zinc/20/36/99/762203699.db2.gz	UVKOYHBALNIAKV-STQMWFEESA-N	1	1	308.382	1.681	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@H](Oc3ncccn3)C2)C1	ZINC001169053132	762207977	/nfs/dbraw/zinc/20/79/77/762207977.db2.gz	HQHGIWFPRMVVCW-MCIONIFRSA-N	1	1	306.366	1.765	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC001133015246	769406661	/nfs/dbraw/zinc/40/66/61/769406661.db2.gz	YGRAFQXCQHWJFD-SNVBAGLBSA-N	1	1	322.321	1.635	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC001133015246	769406669	/nfs/dbraw/zinc/40/66/69/769406669.db2.gz	YGRAFQXCQHWJFD-SNVBAGLBSA-N	1	1	322.321	1.635	20	5		DDBDMO
CCC(=O)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048630615	769593698	/nfs/dbraw/zinc/59/36/98/769593698.db2.gz	LRVXMDWQDOAGCW-TXEJJXNPSA-N	1	1	309.391	1.957	20	5		DDBDMO
CCC(=O)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048630615	769593710	/nfs/dbraw/zinc/59/37/10/769593710.db2.gz	LRVXMDWQDOAGCW-TXEJJXNPSA-N	1	1	309.391	1.957	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC001097053150	771599907	/nfs/dbraw/zinc/59/99/07/771599907.db2.gz	LPVBEKKKFYVWQE-HAQNSBGRSA-N	1	1	321.381	1.391	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1cc2ncnc(Cl)c2cc1[N+](=O)[O-]	ZINC001159783465	771924053	/nfs/dbraw/zinc/92/40/53/771924053.db2.gz	CXGASTJZVZHZHN-NSHDSACASA-N	1	1	310.745	1.627	20	5		DDBDMO
C[C@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907532	776917941	/nfs/dbraw/zinc/91/79/41/776917941.db2.gz	GXQVGZYIALVFLJ-FZMZJTMJSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907532	776917950	/nfs/dbraw/zinc/91/79/50/776917950.db2.gz	GXQVGZYIALVFLJ-FZMZJTMJSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCN1CCN(C)CC1	ZINC001173211127	777067406	/nfs/dbraw/zinc/06/74/06/777067406.db2.gz	PQPBNUFXAINJFH-AWEZNQCLSA-N	1	1	306.410	1.363	20	5		DDBDMO
O=C1O[C@@H](C[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC001327224099	861976248	/nfs/dbraw/zinc/97/62/48/861976248.db2.gz	PSLQSKDBEBGPJD-HNNXBMFYSA-N	1	1	317.345	1.936	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC001327224099	861976256	/nfs/dbraw/zinc/97/62/56/861976256.db2.gz	PSLQSKDBEBGPJD-HNNXBMFYSA-N	1	1	317.345	1.936	20	5		DDBDMO
CCC(C)(CC)C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001151593351	862863085	/nfs/dbraw/zinc/86/30/85/862863085.db2.gz	GKAXSYWVCPONEF-UHFFFAOYSA-N	1	1	311.386	1.360	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc([N+](=O)[O-])c(-c2ccccc2)n1	ZINC001156628431	863206440	/nfs/dbraw/zinc/20/64/40/863206440.db2.gz	SPYWHQIPKNHKNS-UHFFFAOYSA-N	1	1	322.328	1.781	20	5		DDBDMO
O=C(NCCC[NH2+]CC/C=C/c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767502	864117694	/nfs/dbraw/zinc/11/76/94/864117694.db2.gz	PCNYGMQTINUUFC-HWYYHXQYSA-N	1	1	317.389	1.851	20	5		DDBDMO
O=C(NCCC[NH2+]CCCc1cccc(F)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767745	864118899	/nfs/dbraw/zinc/11/88/99/864118899.db2.gz	SKSVLCJMXAOGFY-HUUCEWRRSA-N	1	1	323.368	1.519	20	5		DDBDMO
CC[C@H](C)[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(N)=O	ZINC001158276840	864534898	/nfs/dbraw/zinc/53/48/98/864534898.db2.gz	ROOARYAUDUJNRW-KKPYEMJRSA-N	1	1	321.381	1.834	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCNc1c(Cl)[n+]([O-])ccc1[N+](=O)[O-]	ZINC001160965316	866226189	/nfs/dbraw/zinc/22/61/89/866226189.db2.gz	WXGBQPFYNROWBX-SECBINFHSA-N	1	1	300.746	1.778	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)CN1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001333586567	866860905	/nfs/dbraw/zinc/86/09/05/866860905.db2.gz	JZVGQGLLYKGAGR-INIZCTEOSA-N	1	1	307.394	1.654	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC001335117117	868076713	/nfs/dbraw/zinc/07/67/13/868076713.db2.gz	KNCAUYVTBUACJQ-CHWSQXEVSA-N	1	1	309.341	1.769	20	5		DDBDMO
COC(=O)Cc1ccc(O[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001226213697	882282827	/nfs/dbraw/zinc/28/28/27/882282827.db2.gz	FTWKUEIRTOLYTK-GFCCVEGCSA-N	1	1	308.334	1.783	20	5		DDBDMO
COc1cccc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC001338084762	869791036	/nfs/dbraw/zinc/79/10/36/869791036.db2.gz	SFRITYOSQOMIAC-AAEUAGOBSA-N	1	1	308.382	1.650	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H](C)[C@H]1C[N@H+](C)CCN1C	ZINC001338083934	869791531	/nfs/dbraw/zinc/79/15/31/869791531.db2.gz	LTUGOHOVOAPTHT-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001338083934	869791536	/nfs/dbraw/zinc/79/15/36/869791536.db2.gz	LTUGOHOVOAPTHT-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C	ZINC001340012699	870837548	/nfs/dbraw/zinc/83/75/48/870837548.db2.gz	TVFQQSITVPWUBU-OLZOCXBDSA-N	1	1	324.429	1.426	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccnc1	ZINC001317540435	871027589	/nfs/dbraw/zinc/02/75/89/871027589.db2.gz	KGVYRRXTGDWPLZ-ZIAGYGMSSA-N	1	1	306.366	1.075	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001317540435	871027614	/nfs/dbraw/zinc/02/76/14/871027614.db2.gz	KGVYRRXTGDWPLZ-ZIAGYGMSSA-N	1	1	306.366	1.075	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001317540435	871027637	/nfs/dbraw/zinc/02/76/37/871027637.db2.gz	KGVYRRXTGDWPLZ-ZIAGYGMSSA-N	1	1	306.366	1.075	20	5		DDBDMO
COC(=O)Cc1ccc(N2C[C@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC001307122390	871398841	/nfs/dbraw/zinc/39/88/41/871398841.db2.gz	JILOIGGWCUXALI-DOMZBBRYSA-N	1	1	319.361	1.451	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1Cn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC001307312918	871419419	/nfs/dbraw/zinc/41/94/19/871419419.db2.gz	WTOSOGOLIBDPCF-NSHDSACASA-N	1	1	324.337	1.928	20	5		DDBDMO
CC[N@H+]1CCCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC(C)C)CC1	ZINC001342909966	872433619	/nfs/dbraw/zinc/43/36/19/872433619.db2.gz	RVOONFGEHGRVKL-CYBMUJFWSA-N	1	1	324.429	1.804	20	5		DDBDMO
CCn1nccc1C[NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC001206720665	872531791	/nfs/dbraw/zinc/53/17/91/872531791.db2.gz	LGJRAHMGEGPPAF-UHFFFAOYSA-N	1	1	306.322	1.815	20	5		DDBDMO
Cc1cnc(CO[C@H](C)C[NH+]2CCOCC2)c(C)c1[N+](=O)[O-]	ZINC001224184944	881260996	/nfs/dbraw/zinc/26/09/96/881260996.db2.gz	ZVYGNFLOIPVCHT-GFCCVEGCSA-N	1	1	309.366	1.844	20	5		DDBDMO
O=[N+]([O-])c1cnc(O[C@@H]2CCc3[nH+]ccn3C2)c2[nH]cnc21	ZINC001227692485	883136120	/nfs/dbraw/zinc/13/61/20/883136120.db2.gz	YZVYWTBEEHMSRK-MRVPVSSYSA-N	1	1	300.278	1.456	20	5		DDBDMO
COCCCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001234397659	887935524	/nfs/dbraw/zinc/93/55/24/887935524.db2.gz	HJJRWPFSSCTXLU-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
COc1ccc(C[C@@H](C)[NH2+][C@H]2CNCCC2=O)c([N+](=O)[O-])c1	ZINC001246294592	892520356	/nfs/dbraw/zinc/52/03/56/892520356.db2.gz	RIJBOVZNQNFTEJ-MFKMUULPSA-N	1	1	307.350	1.055	20	5		DDBDMO
COc1ccc(C[C@@H](C)N[C@H]2C[NH2+]CCC2=O)c([N+](=O)[O-])c1	ZINC001246294592	892520365	/nfs/dbraw/zinc/52/03/65/892520365.db2.gz	RIJBOVZNQNFTEJ-MFKMUULPSA-N	1	1	307.350	1.055	20	5		DDBDMO
CN[C@@H](CCCC[NH3+])c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247821256	893383961	/nfs/dbraw/zinc/38/39/61/893383961.db2.gz	QDOBSQXYYYVVKK-VIFPVBQESA-N	1	1	324.316	1.568	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3C[C@H](F)C[C@H]3CO)CC2)cc1	ZINC001254476643	896457147	/nfs/dbraw/zinc/45/71/47/896457147.db2.gz	VBRIJEVUWVHYRR-WBMJQRKESA-N	1	1	323.368	1.968	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(C3COC3)CC1)C2	ZINC001254599210	896524714	/nfs/dbraw/zinc/52/47/14/896524714.db2.gz	MFARSYOPCKFBKI-OAHLLOKOSA-N	1	1	303.362	1.078	20	5		DDBDMO
Cc1cc(NC(=O)C[C@@]2(O)CCC[N@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001264010894	900870813	/nfs/dbraw/zinc/87/08/13/900870813.db2.gz	OEDKJKJTHDFMCV-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)CO	ZINC000248985804	282123995	/nfs/dbraw/zinc/12/39/95/282123995.db2.gz	WGOCPRNAGCYJAW-NXEZZACHSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)CO	ZINC000248985804	282123997	/nfs/dbraw/zinc/12/39/97/282123997.db2.gz	WGOCPRNAGCYJAW-NXEZZACHSA-N	1	1	302.758	1.812	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000495196474	529440461	/nfs/dbraw/zinc/44/04/61/529440461.db2.gz	UQCXNGAEEFFTEL-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000495196474	529440462	/nfs/dbraw/zinc/44/04/62/529440462.db2.gz	UQCXNGAEEFFTEL-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000295716171	529503291	/nfs/dbraw/zinc/50/32/91/529503291.db2.gz	NPCIKBZWBGXZGR-LBPRGKRZSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000491745143	529803101	/nfs/dbraw/zinc/80/31/01/529803101.db2.gz	NTIKCVAUNSIPHG-USEMIUTHSA-N	1	1	307.325	1.815	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cccc([N+](=O)[O-])c1N)C1CC1	ZINC000457173046	529883972	/nfs/dbraw/zinc/88/39/72/529883972.db2.gz	VJJYXCHOQAFPLQ-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](CO)CC(C)(C)C	ZINC000451787209	529939472	/nfs/dbraw/zinc/93/94/72/529939472.db2.gz	JIRMTCMDTUNMDX-ZDUSSCGKSA-N	1	1	311.382	1.485	20	5		DDBDMO
CCOC(=O)c1cc(N2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000615494256	362307096	/nfs/dbraw/zinc/30/70/96/362307096.db2.gz	JNFKRGRGCGEVHU-LLVKDONJSA-N	1	1	307.350	1.912	20	5		DDBDMO
C[NH+](C)CC(C)(C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000457203894	232013411	/nfs/dbraw/zinc/01/34/11/232013411.db2.gz	JDWIONWILHNSHZ-UHFFFAOYSA-N	1	1	305.338	1.541	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000458175577	530055074	/nfs/dbraw/zinc/05/50/74/530055074.db2.gz	CSYGQFXJFPLEGA-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-]	ZINC000491889106	530063180	/nfs/dbraw/zinc/06/31/80/530063180.db2.gz	UURSUSVHMRGDDF-VGVVRCBHSA-N	1	1	307.325	1.958	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000330889570	232140009	/nfs/dbraw/zinc/14/00/09/232140009.db2.gz	BMNRAYCQQARCQI-QWRGUYRKSA-N	1	1	309.370	1.125	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330915846	232160647	/nfs/dbraw/zinc/16/06/47/232160647.db2.gz	URUDUWLRVLFSNW-NWDGAFQWSA-N	1	1	306.366	1.606	20	5		DDBDMO
CC[N@@H+]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000616376530	362666503	/nfs/dbraw/zinc/66/65/03/362666503.db2.gz	UAZHNTZRGHPQCK-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CC[N@H+]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000616376530	362666506	/nfs/dbraw/zinc/66/65/06/362666506.db2.gz	UAZHNTZRGHPQCK-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CS(=O)(=O)C1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CCC1	ZINC000279647833	215030096	/nfs/dbraw/zinc/03/00/96/215030096.db2.gz	DPODZKSYXBVIJK-UHFFFAOYSA-N	1	1	304.393	1.713	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(C)C	ZINC000341867812	282500299	/nfs/dbraw/zinc/50/02/99/282500299.db2.gz	DXPPNBIPVDRLCU-ZDUSSCGKSA-N	1	1	322.365	1.202	20	5		DDBDMO
CCn1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)c1	ZINC000616786119	362817962	/nfs/dbraw/zinc/81/79/62/362817962.db2.gz	KDEMHWQVJNOZCL-UHFFFAOYSA-N	1	1	304.350	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](O)C(C)(C)C1	ZINC000279892495	215212207	/nfs/dbraw/zinc/21/22/07/215212207.db2.gz	UTQUEMFBGFGHDF-AWEZNQCLSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2CCO[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000026342630	352207795	/nfs/dbraw/zinc/20/77/95/352207795.db2.gz	ZMSLPPVIJASQBJ-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCO[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000026342630	352207797	/nfs/dbraw/zinc/20/77/97/352207797.db2.gz	ZMSLPPVIJASQBJ-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[NH+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1	ZINC000028707098	352231729	/nfs/dbraw/zinc/23/17/29/352231729.db2.gz	XVRRTWVJBQOZBH-UHFFFAOYSA-N	1	1	318.377	1.629	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000053678007	352663599	/nfs/dbraw/zinc/66/35/99/352663599.db2.gz	ASQJICWDSOAIJD-LBPRGKRZSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCOc1ccccc1[N+](=O)[O-])C1CC1	ZINC000058857002	352854530	/nfs/dbraw/zinc/85/45/30/352854530.db2.gz	FIALAGGNWKPIFE-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000066137799	352979099	/nfs/dbraw/zinc/97/90/99/352979099.db2.gz	BURPGBDVGAZKQL-GFCCVEGCSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)C1CC1	ZINC000069442612	353161723	/nfs/dbraw/zinc/16/17/23/353161723.db2.gz	GFGNPXBAAGMHNI-UHFFFAOYSA-N	1	1	321.377	1.746	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CC=CCC1	ZINC000491989715	234353397	/nfs/dbraw/zinc/35/33/97/234353397.db2.gz	HTOPRPAXZVCTES-FPLPWBNLSA-N	1	1	301.346	1.986	20	5		DDBDMO
Cc1[nH+]cn(CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1C	ZINC000182100298	199386881	/nfs/dbraw/zinc/38/68/81/199386881.db2.gz	JUUYVVBHEPWPHZ-UHFFFAOYSA-N	1	1	309.347	1.882	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@H](CO)C1	ZINC000174709866	198373110	/nfs/dbraw/zinc/37/31/10/198373110.db2.gz	RPDNBHCHDYGKQG-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@H](CO)C1	ZINC000174709866	198373111	/nfs/dbraw/zinc/37/31/11/198373111.db2.gz	RPDNBHCHDYGKQG-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000077555743	353475534	/nfs/dbraw/zinc/47/55/34/353475534.db2.gz	MPUMEBHXDNTISZ-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
CN(C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[C@@H]1CCC[N@@H+](C)C1	ZINC000182168416	199397196	/nfs/dbraw/zinc/39/71/96/199397196.db2.gz	YXIUUOMAPFVKPA-LLVKDONJSA-N	1	1	321.333	1.490	20	5		DDBDMO
CN(CC(=O)NCC[N@@H+](C)C1CC1)c1ccccc1[N+](=O)[O-]	ZINC000079738804	353574917	/nfs/dbraw/zinc/57/49/17/353574917.db2.gz	PVCGFQLQYRODRN-UHFFFAOYSA-N	1	1	306.366	1.241	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000617722405	363253649	/nfs/dbraw/zinc/25/36/49/363253649.db2.gz	SLCXCTWOLYOSIY-OLZOCXBDSA-N	1	1	321.377	1.223	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000089265531	353763835	/nfs/dbraw/zinc/76/38/35/353763835.db2.gz	JCWQSDFUPDQIFZ-LBPRGKRZSA-N	1	1	307.350	1.668	20	5		DDBDMO
COC[C@@](C)(CCO)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000085904225	353738543	/nfs/dbraw/zinc/73/85/43/353738543.db2.gz	OAAGWLVZKSRKEG-CQSZACIVSA-N	1	1	309.322	1.613	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@H](O)C1	ZINC000093344416	353897964	/nfs/dbraw/zinc/89/79/64/353897964.db2.gz	LIASSDBOXRMLCT-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000109689363	353957350	/nfs/dbraw/zinc/95/73/50/353957350.db2.gz	KYBLBXUEWPENRT-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ncnc2ccc([N+](=O)[O-])cc21	ZINC000321498352	354532755	/nfs/dbraw/zinc/53/27/55/354532755.db2.gz	SPSKAAKMGIOIEN-GFCCVEGCSA-N	1	1	316.365	1.196	20	5		DDBDMO
CN1CCN(C)[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000321498352	354532758	/nfs/dbraw/zinc/53/27/58/354532758.db2.gz	SPSKAAKMGIOIEN-GFCCVEGCSA-N	1	1	316.365	1.196	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000321498352	354532761	/nfs/dbraw/zinc/53/27/61/354532761.db2.gz	SPSKAAKMGIOIEN-GFCCVEGCSA-N	1	1	316.365	1.196	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000321498352	354532766	/nfs/dbraw/zinc/53/27/66/354532766.db2.gz	SPSKAAKMGIOIEN-GFCCVEGCSA-N	1	1	316.365	1.196	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000588026870	354895725	/nfs/dbraw/zinc/89/57/25/354895725.db2.gz	QGHXPIVXLNLINE-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000588026870	354895727	/nfs/dbraw/zinc/89/57/27/354895727.db2.gz	QGHXPIVXLNLINE-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
Nc1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc(CO)c1[N+](=O)[O-]	ZINC000587309777	354881859	/nfs/dbraw/zinc/88/18/59/354881859.db2.gz	QUGNMBCJONQTNA-AAEUAGOBSA-N	1	1	306.366	1.708	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CCCO)C2CC2)c1	ZINC000589499937	354996986	/nfs/dbraw/zinc/99/69/86/354996986.db2.gz	LOAGMCVFNDASPP-UHFFFAOYSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCCO)C2CC2)c1	ZINC000589499937	354996989	/nfs/dbraw/zinc/99/69/89/354996989.db2.gz	LOAGMCVFNDASPP-UHFFFAOYSA-N	1	1	308.334	1.728	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000590522996	355107813	/nfs/dbraw/zinc/10/78/13/355107813.db2.gz	RYFQDHRKVXSRIC-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000590522996	355107816	/nfs/dbraw/zinc/10/78/16/355107816.db2.gz	RYFQDHRKVXSRIC-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC000590445088	355098432	/nfs/dbraw/zinc/09/84/32/355098432.db2.gz	MZZOLIKOZFCJBD-YPMHNXCESA-N	1	1	319.361	1.770	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000590655893	355138427	/nfs/dbraw/zinc/13/84/27/355138427.db2.gz	CRLUBNDLXSHCSK-GXTWGEPZSA-N	1	1	322.361	1.974	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000591687929	355363235	/nfs/dbraw/zinc/36/32/35/355363235.db2.gz	IRHQYYRGUWIWLY-HNNXBMFYSA-N	1	1	312.329	1.777	20	5		DDBDMO
[NH3+]CC[C@@H]1CCCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000592432156	355581727	/nfs/dbraw/zinc/58/17/27/355581727.db2.gz	GKNPKCTXDUTKPH-LBPRGKRZSA-N	1	1	321.377	1.927	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000077912036	191795038	/nfs/dbraw/zinc/79/50/38/191795038.db2.gz	XGEDZBOZCUREAJ-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000592996532	355765584	/nfs/dbraw/zinc/76/55/84/355765584.db2.gz	GFXINAGYJJZBAO-CQSZACIVSA-N	1	1	305.382	1.206	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593613126	355942919	/nfs/dbraw/zinc/94/29/19/355942919.db2.gz	IBNQYKPMVPYTHP-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)C(C)(C)C2)c1	ZINC000593985858	356079722	/nfs/dbraw/zinc/07/97/22/356079722.db2.gz	MXZZZTNNRDHCCN-UHFFFAOYSA-N	1	1	321.377	1.907	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1	ZINC000594056508	356101584	/nfs/dbraw/zinc/10/15/84/356101584.db2.gz	WJQQRSWUGZKUAB-JTQLQIEISA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1	ZINC000594056508	356101591	/nfs/dbraw/zinc/10/15/91/356101591.db2.gz	WJQQRSWUGZKUAB-JTQLQIEISA-N	1	1	318.333	1.990	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C[C@H](C)O)C1CC1	ZINC000594065474	356104066	/nfs/dbraw/zinc/10/40/66/356104066.db2.gz	PYAAJNFXOZPKHJ-NSHDSACASA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C[C@H](C)O)C1CC1	ZINC000594065474	356104069	/nfs/dbraw/zinc/10/40/69/356104069.db2.gz	PYAAJNFXOZPKHJ-NSHDSACASA-N	1	1	307.350	1.687	20	5		DDBDMO
O=[N+]([O-])c1cccc(-n2cc(C[N@H+]3CCC[C@@H]3CO)nn2)c1	ZINC000594639849	356269144	/nfs/dbraw/zinc/26/91/44/356269144.db2.gz	FQPYKJNERSWXCP-CQSZACIVSA-N	1	1	303.322	1.132	20	5		DDBDMO
O=[N+]([O-])c1cccc(-n2cc(C[N@@H+]3CCC[C@@H]3CO)nn2)c1	ZINC000594639849	356269147	/nfs/dbraw/zinc/26/91/47/356269147.db2.gz	FQPYKJNERSWXCP-CQSZACIVSA-N	1	1	303.322	1.132	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(=O)NCC1CC1	ZINC000595035613	356375209	/nfs/dbraw/zinc/37/52/09/356375209.db2.gz	YCYUIZUUDFVXJO-SNVBAGLBSA-N	1	1	307.350	1.780	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c(C)cc1[N+](=O)[O-]	ZINC000595103996	356382748	/nfs/dbraw/zinc/38/27/48/356382748.db2.gz	AIXKVJSZNMRFNH-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CC1(C)CN(Cc2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000595467164	356503842	/nfs/dbraw/zinc/50/38/42/356503842.db2.gz	IUTMFYUGZVQHRH-UHFFFAOYSA-N	1	1	311.357	1.622	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@H](N3CCOCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000595493927	356516737	/nfs/dbraw/zinc/51/67/37/356516737.db2.gz	XEORYTOFGUISES-CMPLNLGQSA-N	1	1	310.354	1.186	20	5		DDBDMO
Cc1noc(C[N@@H+]2C[C@H](N3CCOCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000595493927	356516739	/nfs/dbraw/zinc/51/67/39/356516739.db2.gz	XEORYTOFGUISES-CMPLNLGQSA-N	1	1	310.354	1.186	20	5		DDBDMO
CCO[C@@H]1C[C@@H]([NH2+]Cc2onc(C)c2[N+](=O)[O-])[C@@H]1SC	ZINC000595556412	356549129	/nfs/dbraw/zinc/54/91/29/356549129.db2.gz	DRUCQAJZLNXXNQ-LNLATYFQSA-N	1	1	301.368	1.890	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@](CO)(OC)C1	ZINC000595664116	356599313	/nfs/dbraw/zinc/59/93/13/356599313.db2.gz	YCLGCQYOUHPQNV-MRXNPFEDSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@](CO)(OC)C1	ZINC000595664116	356599316	/nfs/dbraw/zinc/59/93/16/356599316.db2.gz	YCLGCQYOUHPQNV-MRXNPFEDSA-N	1	1	324.377	1.967	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@]4(O)C[C@H]4C3)n2)cc1	ZINC000595758414	356640108	/nfs/dbraw/zinc/64/01/08/356640108.db2.gz	QLAHDOASQOCGDG-XHDPSFHLSA-N	1	1	316.317	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@]4(O)C[C@H]4C3)n2)cc1	ZINC000595758414	356640113	/nfs/dbraw/zinc/64/01/13/356640113.db2.gz	QLAHDOASQOCGDG-XHDPSFHLSA-N	1	1	316.317	1.602	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC3(COC3)C2)c([N+](=O)[O-])c1	ZINC000595836089	356671325	/nfs/dbraw/zinc/67/13/25/356671325.db2.gz	ZJTPASYUOJTHGF-UHFFFAOYSA-N	1	1	308.334	1.705	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595856223	356679447	/nfs/dbraw/zinc/67/94/47/356679447.db2.gz	LCOKASNGIQSZSS-BJHJDKERSA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595856223	356679452	/nfs/dbraw/zinc/67/94/52/356679452.db2.gz	LCOKASNGIQSZSS-BJHJDKERSA-N	1	1	308.334	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H]4COC[C@@H]4C3)nc2c1	ZINC000595827691	356666654	/nfs/dbraw/zinc/66/66/54/356666654.db2.gz	DADYNDDEXCZDIT-MNOVXSKESA-N	1	1	302.334	1.939	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000596305881	356852012	/nfs/dbraw/zinc/85/20/12/356852012.db2.gz	BXWYJXHZABGSRC-SECBINFHSA-N	1	1	307.354	1.373	20	5		DDBDMO
CNC(=O)C[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000597249964	357109427	/nfs/dbraw/zinc/10/94/27/357109427.db2.gz	PAXUXYSVYQTBQK-UHFFFAOYSA-N	1	1	317.349	1.173	20	5		DDBDMO
CNC(=O)C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000597249964	357109430	/nfs/dbraw/zinc/10/94/30/357109430.db2.gz	PAXUXYSVYQTBQK-UHFFFAOYSA-N	1	1	317.349	1.173	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@@]2(CC[N@H+](C)C2)C1	ZINC000597716749	357299769	/nfs/dbraw/zinc/29/97/69/357299769.db2.gz	UBISLZBRIGFCEI-HNNXBMFYSA-N	1	1	321.381	1.044	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C	ZINC000597859330	357361623	/nfs/dbraw/zinc/36/16/23/357361623.db2.gz	UOYDIHCPVZBIJL-LLVKDONJSA-N	1	1	309.370	1.089	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000597862297	357363238	/nfs/dbraw/zinc/36/32/38/357363238.db2.gz	ZOALUTIAGDDXKF-SNVBAGLBSA-N	1	1	322.365	1.546	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597922501	357382441	/nfs/dbraw/zinc/38/24/41/357382441.db2.gz	DXKBIFOBTVBAOG-SNVBAGLBSA-N	1	1	309.370	1.239	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598559701	357631989	/nfs/dbraw/zinc/63/19/89/357631989.db2.gz	YOEBPJLMWXUPBA-LLVKDONJSA-N	1	1	307.354	1.170	20	5		DDBDMO
Cc1nccnc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000598671905	357679794	/nfs/dbraw/zinc/67/97/94/357679794.db2.gz	FILJOHDJYDCDCQ-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1nccnc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000598671905	357679797	/nfs/dbraw/zinc/67/97/97/357679797.db2.gz	FILJOHDJYDCDCQ-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
CC(C)c1ncc2c(n1)CC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000598937868	357764663	/nfs/dbraw/zinc/76/46/63/357764663.db2.gz	SWQPVMNUGKOKPI-UHFFFAOYSA-N	1	1	316.365	1.763	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc2cnccc2c1[N+](=O)[O-]	ZINC000599042201	357800874	/nfs/dbraw/zinc/80/08/74/357800874.db2.gz	FNRXPZJTTQZTDX-CYBMUJFWSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC2(CCCCC2)C1	ZINC000179217980	199000211	/nfs/dbraw/zinc/00/02/11/199000211.db2.gz	IKDBUHIFZSAKIQ-UHFFFAOYSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC2(CCCCC2)C1	ZINC000179217980	199000213	/nfs/dbraw/zinc/00/02/13/199000213.db2.gz	IKDBUHIFZSAKIQ-UHFFFAOYSA-N	1	1	321.377	1.792	20	5		DDBDMO
COC(=O)c1cc(NCC[N@H+]2CC[C@H](O)C2)cc(C)c1[N+](=O)[O-]	ZINC000599200110	357847920	/nfs/dbraw/zinc/84/79/20/357847920.db2.gz	WXFUCCUVFZSSPY-LBPRGKRZSA-N	1	1	323.349	1.168	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000599567328	357976807	/nfs/dbraw/zinc/97/68/07/357976807.db2.gz	NTFUNVIYEXXJJH-OAHLLOKOSA-N	1	1	308.334	1.667	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2c(O)cccc2C1	ZINC000599649046	358006930	/nfs/dbraw/zinc/00/69/30/358006930.db2.gz	WYXUFMSDDPDWPG-UHFFFAOYSA-N	1	1	315.329	1.520	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2c(O)cccc2C1	ZINC000599649046	358006933	/nfs/dbraw/zinc/00/69/33/358006933.db2.gz	WYXUFMSDDPDWPG-UHFFFAOYSA-N	1	1	315.329	1.520	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000599843879	358068562	/nfs/dbraw/zinc/06/85/62/358068562.db2.gz	PWAIMLFNPXZVRP-UHFFFAOYSA-N	1	1	318.337	1.160	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3COCC[NH2+]3)o2)cc1	ZINC000600679078	358281120	/nfs/dbraw/zinc/28/11/20/358281120.db2.gz	ZATHKFXMNFPVTQ-ZDUSSCGKSA-N	1	1	317.345	1.933	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1c(N)cccc1[N+](=O)[O-])c1ccco1	ZINC000180595119	199181671	/nfs/dbraw/zinc/18/16/71/199181671.db2.gz	WWEWMOSPLFJYQE-LBPRGKRZSA-N	1	1	318.333	1.803	20	5		DDBDMO
CCC(=O)N1CC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1	ZINC000601129856	358414160	/nfs/dbraw/zinc/41/41/60/358414160.db2.gz	NKGYRQMYBWJBIQ-LLVKDONJSA-N	1	1	314.345	1.988	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000601187107	358439195	/nfs/dbraw/zinc/43/91/95/358439195.db2.gz	ODUYUUWFUDRXMZ-UHFFFAOYSA-N	1	1	306.366	1.485	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000601774750	358690134	/nfs/dbraw/zinc/69/01/34/358690134.db2.gz	DJZOKPUHORONQY-XFJVYGCCSA-N	1	1	321.377	1.259	20	5		DDBDMO
CC(C)N(C)C(=O)C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602448969	358983665	/nfs/dbraw/zinc/98/36/65/358983665.db2.gz	XFAKFMLCMPUFEX-UHFFFAOYSA-N	1	1	323.397	1.407	20	5		DDBDMO
CO[C@H](C[NH+]1CC(Oc2ccc([N+](=O)[O-])cc2)C1)[C@@H]1CCOC1	ZINC000602689098	359127061	/nfs/dbraw/zinc/12/70/61/359127061.db2.gz	QSPULLAVXWQNIN-MLGOLLRUSA-N	1	1	322.361	1.709	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@]2(CCSC2)C1	ZINC000602853468	359240403	/nfs/dbraw/zinc/24/04/03/359240403.db2.gz	ZQUZCISAYZNLSH-CYBMUJFWSA-N	1	1	312.395	1.308	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@]2(CCSC2)C1	ZINC000602853468	359240408	/nfs/dbraw/zinc/24/04/08/359240408.db2.gz	ZQUZCISAYZNLSH-CYBMUJFWSA-N	1	1	312.395	1.308	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2cc[nH]c(=O)c2C1	ZINC000602820461	359214101	/nfs/dbraw/zinc/21/41/01/359214101.db2.gz	LUEIOHQJOPYTEK-UHFFFAOYSA-N	1	1	303.322	1.259	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000186766731	200006018	/nfs/dbraw/zinc/00/60/18/200006018.db2.gz	OCOBPGYHCOFUTJ-UHFFFAOYSA-N	1	1	306.366	1.220	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000186932185	200033477	/nfs/dbraw/zinc/03/34/77/200033477.db2.gz	SOJYVZOMZFLQHB-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000186932185	200033478	/nfs/dbraw/zinc/03/34/78/200033478.db2.gz	SOJYVZOMZFLQHB-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000187259680	200084891	/nfs/dbraw/zinc/08/48/91/200084891.db2.gz	UXDZFZLGJBRBKF-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000187259680	200084893	/nfs/dbraw/zinc/08/48/93/200084893.db2.gz	UXDZFZLGJBRBKF-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000281133972	216101014	/nfs/dbraw/zinc/10/10/14/216101014.db2.gz	NSJKTCUDDJCMLO-AWEZNQCLSA-N	1	1	322.321	1.461	20	5		DDBDMO
CO[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1C	ZINC000189318133	200381045	/nfs/dbraw/zinc/38/10/45/200381045.db2.gz	UBUONCFZSBKOJG-NOLJZWGESA-N	1	1	324.377	1.691	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2cccnc2[N+](=O)[O-])CC1	ZINC000609111602	360260464	/nfs/dbraw/zinc/26/04/64/360260464.db2.gz	PIQMSQXLXHZROA-ZDUSSCGKSA-N	1	1	307.398	1.675	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H]([NH2+]C(C)C)C2)c1[N+](=O)[O-]	ZINC000609476891	360311827	/nfs/dbraw/zinc/31/18/27/360311827.db2.gz	YEMCCKLJZKAJFI-LLVKDONJSA-N	1	1	323.397	1.873	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)Nc1c[nH+]ccc1-n1cccn1	ZINC000609506143	360316158	/nfs/dbraw/zinc/31/61/58/360316158.db2.gz	QNXLCQWGYZJHAT-UHFFFAOYSA-N	1	1	312.289	1.766	20	5		DDBDMO
COCC1([N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000611178625	360650059	/nfs/dbraw/zinc/65/00/59/360650059.db2.gz	HVQZXUBLJCISEK-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
COCC1([N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000611178625	360650071	/nfs/dbraw/zinc/65/00/71/360650071.db2.gz	HVQZXUBLJCISEK-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c(F)cc1[N+](=O)[O-]	ZINC000292689339	223202618	/nfs/dbraw/zinc/20/26/18/223202618.db2.gz	RKWLPQWSIPODIZ-CYBMUJFWSA-N	1	1	324.356	1.794	20	5		DDBDMO
Cc1cc(N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000292713161	223213409	/nfs/dbraw/zinc/21/34/09/223213409.db2.gz	SVHQUAJLFACGAS-RYUDHWBXSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)cccc1[N+](=O)[O-]	ZINC000619873382	364170564	/nfs/dbraw/zinc/17/05/64/364170564.db2.gz	IIIDYFHGYCPEHA-ZDUSSCGKSA-N	1	1	318.377	1.023	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](O)CC1	ZINC000293061560	223377937	/nfs/dbraw/zinc/37/79/37/223377937.db2.gz	IMNDROKKUWQIEM-SMDDNHRTSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](O)CC1	ZINC000293061560	223377939	/nfs/dbraw/zinc/37/79/39/223377939.db2.gz	IMNDROKKUWQIEM-SMDDNHRTSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000264670900	204067799	/nfs/dbraw/zinc/06/77/99/204067799.db2.gz	JGUCPROXTSTKGH-LBPRGKRZSA-N	1	1	306.366	1.781	20	5		DDBDMO
COc1ccc(NC(=O)NC[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000274879556	212003991	/nfs/dbraw/zinc/00/39/91/212003991.db2.gz	HTFCEOYJEXLGRG-SNVBAGLBSA-N	1	1	308.338	1.677	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cccc(C)c1[N+](=O)[O-]	ZINC000266150300	205139670	/nfs/dbraw/zinc/13/96/70/205139670.db2.gz	KJWMOLGNRBTUAP-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000288397142	220132422	/nfs/dbraw/zinc/13/24/22/220132422.db2.gz	LANCHZNUJLCTMQ-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C3CC3)C2)n1	ZINC000336858942	249266599	/nfs/dbraw/zinc/26/65/99/249266599.db2.gz	CYOFCGGTDQOVNZ-VIFPVBQESA-N	1	1	306.322	1.425	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000274031423	211290045	/nfs/dbraw/zinc/29/00/45/211290045.db2.gz	QLQDDFJCJZDPDN-CQSZACIVSA-N	1	1	318.377	1.673	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@@H+](CC)CC2)c1[N+](=O)[O-]	ZINC000159523860	197360574	/nfs/dbraw/zinc/36/05/74/197360574.db2.gz	ODAYTMWOGXFRQL-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+](CC)CC2)c1[N+](=O)[O-]	ZINC000159523860	197360576	/nfs/dbraw/zinc/36/05/76/197360576.db2.gz	ODAYTMWOGXFRQL-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+](CC)CC2)c1[N+](=O)[O-]	ZINC000159523860	197360578	/nfs/dbraw/zinc/36/05/78/197360578.db2.gz	ODAYTMWOGXFRQL-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)C[C@@H](C)O	ZINC000159511200	197360112	/nfs/dbraw/zinc/36/01/12/197360112.db2.gz	BNGSIJQWKLOQOQ-ZJUUUORDSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)C[C@@H](C)O	ZINC000159511200	197360114	/nfs/dbraw/zinc/36/01/14/197360114.db2.gz	BNGSIJQWKLOQOQ-ZJUUUORDSA-N	1	1	311.338	1.243	20	5		DDBDMO
CC[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000105825382	194138034	/nfs/dbraw/zinc/13/80/34/194138034.db2.gz	CQQJVZJJQAKOOM-HIFRSBDPSA-N	1	1	307.394	1.872	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])n[nH]1)Cc1ccccc1	ZINC000285102151	218291314	/nfs/dbraw/zinc/29/13/14/218291314.db2.gz	MBJUIUCZBJMKRT-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000106791613	194252751	/nfs/dbraw/zinc/25/27/51/194252751.db2.gz	RUYWCFUMTFOBIK-GFCCVEGCSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000340921179	251277673	/nfs/dbraw/zinc/27/76/73/251277673.db2.gz	XLEBANITEIXGNR-PWSUYJOCSA-N	1	1	321.333	1.348	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000341106283	251383526	/nfs/dbraw/zinc/38/35/26/251383526.db2.gz	WKAZQVMWPSDXQI-NWDGAFQWSA-N	1	1	306.366	1.321	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@@H](C)C1	ZINC000288645824	220318774	/nfs/dbraw/zinc/31/87/74/220318774.db2.gz	ZLMKWPBDVAJDTF-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@@H](C)C1	ZINC000288645824	220318779	/nfs/dbraw/zinc/31/87/79/220318779.db2.gz	ZLMKWPBDVAJDTF-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)nc1	ZINC000274025829	285177328	/nfs/dbraw/zinc/17/73/28/285177328.db2.gz	WMZDQTWLXRGZIE-RISCZKNCSA-N	1	1	303.366	1.838	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000352661543	285205626	/nfs/dbraw/zinc/20/56/26/285205626.db2.gz	UALZPJGHNAVZEL-KGLIPLIRSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452071336	533328355	/nfs/dbraw/zinc/32/83/55/533328355.db2.gz	UMKDNEFYWOJEQQ-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452071336	533328367	/nfs/dbraw/zinc/32/83/67/533328367.db2.gz	UMKDNEFYWOJEQQ-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000299690375	533547790	/nfs/dbraw/zinc/54/77/90/533547790.db2.gz	VWTLYVGPBKJMKC-OLZOCXBDSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1c(CC(=O)N2CC[NH2+]C[C@H]2C(F)F)cccc1[N+](=O)[O-]	ZINC000568856995	304316203	/nfs/dbraw/zinc/31/62/03/304316203.db2.gz	JDIAPHCBGGXWIN-LBPRGKRZSA-N	1	1	313.304	1.511	20	5		DDBDMO
CCCC[N@@H+](CCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000076951312	406975584	/nfs/dbraw/zinc/97/55/84/406975584.db2.gz	GFXXQCJNDRKGIH-UHFFFAOYSA-N	1	1	321.377	1.578	20	5		DDBDMO
CCCC[N@@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000076951266	406976226	/nfs/dbraw/zinc/97/62/26/406976226.db2.gz	SNQKTZREWSJCKZ-UHFFFAOYSA-N	1	1	309.366	1.652	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000053349351	407167336	/nfs/dbraw/zinc/16/73/36/407167336.db2.gz	ZKSMZHBZXUUALB-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000122383538	407299028	/nfs/dbraw/zinc/29/90/28/407299028.db2.gz	HLLLRBSUBOLHMP-LLVKDONJSA-N	1	1	309.370	1.323	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000111267801	407403700	/nfs/dbraw/zinc/40/37/00/407403700.db2.gz	JLSMYSHONQUFFX-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000112309380	407425830	/nfs/dbraw/zinc/42/58/30/407425830.db2.gz	ADFWWSRVZWKKAT-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
CCCC[N@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000112309380	407425831	/nfs/dbraw/zinc/42/58/31/407425831.db2.gz	ADFWWSRVZWKKAT-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000112309380	407425832	/nfs/dbraw/zinc/42/58/32/407425832.db2.gz	ADFWWSRVZWKKAT-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
CC[N@H+](Cc1cnn(C)c1)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178580355	407499866	/nfs/dbraw/zinc/49/98/66/407499866.db2.gz	KQZNJXASPNFUEL-HNNXBMFYSA-N	1	1	304.350	1.884	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000265762645	407441784	/nfs/dbraw/zinc/44/17/84/407441784.db2.gz	HISXIZFDRNSJKR-OCCSQVGLSA-N	1	1	310.350	1.303	20	5		DDBDMO
CN1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1	ZINC000128243428	407512795	/nfs/dbraw/zinc/51/27/95/407512795.db2.gz	QMNJULSZSZJFJZ-UHFFFAOYSA-N	1	1	310.329	1.310	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000171128418	407606961	/nfs/dbraw/zinc/60/69/61/407606961.db2.gz	JOHHEZULBPAPOS-UHFFFAOYSA-N	1	1	301.368	1.273	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000178866883	407634208	/nfs/dbraw/zinc/63/42/08/407634208.db2.gz	DPESEKAWIDKYPG-ZFWWWQNUSA-N	1	1	308.334	1.513	20	5		DDBDMO
Cc1ccnc(N2CCC([N@@H+](C)CCCO)CC2)c1[N+](=O)[O-]	ZINC000115519878	407687972	/nfs/dbraw/zinc/68/79/72/407687972.db2.gz	WZXBENGNEVUXOB-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000272066273	407761884	/nfs/dbraw/zinc/76/18/84/407761884.db2.gz	BMKRHOJSSPOLQX-SECBINFHSA-N	1	1	321.362	1.424	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CCCn1cc[nH+]c1C	ZINC000153669932	407874076	/nfs/dbraw/zinc/87/40/76/407874076.db2.gz	MKQGKAUGHOOAAF-UHFFFAOYSA-N	1	1	320.353	1.153	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000272499376	407949067	/nfs/dbraw/zinc/94/90/67/407949067.db2.gz	DLLOUYOSBCQEPA-XQQFMLRXSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]([C@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000272499374	407950828	/nfs/dbraw/zinc/95/08/28/407950828.db2.gz	DLLOUYOSBCQEPA-RWMBFGLXSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000268162284	407922652	/nfs/dbraw/zinc/92/26/52/407922652.db2.gz	CZEFGTNBLRUUKA-FZMZJTMJSA-N	1	1	303.362	1.736	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000272570094	407989353	/nfs/dbraw/zinc/98/93/53/407989353.db2.gz	CWQLOFHNJHPERV-QWRGUYRKSA-N	1	1	306.366	1.732	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000175239103	408085488	/nfs/dbraw/zinc/08/54/88/408085488.db2.gz	VPLXMZAZNHIVHC-NSHDSACASA-N	1	1	320.349	1.121	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000175239103	408085494	/nfs/dbraw/zinc/08/54/94/408085494.db2.gz	VPLXMZAZNHIVHC-NSHDSACASA-N	1	1	320.349	1.121	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000136171079	408086024	/nfs/dbraw/zinc/08/60/24/408086024.db2.gz	KNVDZKVPTDSYKV-QEJZJMRPSA-N	1	1	324.377	1.570	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000155564188	408180800	/nfs/dbraw/zinc/18/08/00/408180800.db2.gz	XQKQCFZMWYUWDA-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000246398241	408245850	/nfs/dbraw/zinc/24/58/50/408245850.db2.gz	FGQZCAKNIMSQHN-ZYHUDNBSSA-N	1	1	306.366	1.589	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000175994830	408260622	/nfs/dbraw/zinc/26/06/22/408260622.db2.gz	MDXVWLHZKUAQGE-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1CCOCC1	ZINC000155951313	408228306	/nfs/dbraw/zinc/22/83/06/408228306.db2.gz	LOFZDICNQLRPCR-OAHLLOKOSA-N	1	1	324.377	1.693	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000246747650	408331172	/nfs/dbraw/zinc/33/11/72/408331172.db2.gz	NNIFFYSRNKUJNV-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000246747650	408331175	/nfs/dbraw/zinc/33/11/75/408331175.db2.gz	NNIFFYSRNKUJNV-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@@](C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(N)=O	ZINC000133103481	162050663	/nfs/dbraw/zinc/05/06/63/162050663.db2.gz	BMQRJIFJLYYFPX-CQSZACIVSA-N	1	1	309.322	1.205	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000247301405	408447458	/nfs/dbraw/zinc/44/74/58/408447458.db2.gz	PBCGEQMXEZFIFI-GXTWGEPZSA-N	1	1	318.377	1.733	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000274555569	408448760	/nfs/dbraw/zinc/44/87/60/408448760.db2.gz	YLLDYAPQSJLIQB-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000183555106	408440001	/nfs/dbraw/zinc/44/00/01/408440001.db2.gz	LKYWIPUPRNYJEG-GHMZBOCLSA-N	1	1	307.354	1.936	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000247389997	408462521	/nfs/dbraw/zinc/46/25/21/408462521.db2.gz	QIDCXTLBTPEKTI-GXTWGEPZSA-N	1	1	305.378	1.982	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000176868370	408463034	/nfs/dbraw/zinc/46/30/34/408463034.db2.gz	NKLJEFKFQBVKBO-WDEREUQCSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402018	408475966	/nfs/dbraw/zinc/47/59/66/408475966.db2.gz	HSGGWECHQXAKEF-YPMHNXCESA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402018	408475971	/nfs/dbraw/zinc/47/59/71/408475971.db2.gz	HSGGWECHQXAKEF-YPMHNXCESA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCCC[C@@H]21	ZINC000248404803	408561411	/nfs/dbraw/zinc/56/14/11/408561411.db2.gz	AIGNUCMCBSSGLY-FAAHXZRKSA-N	1	1	308.382	1.663	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCc3n[nH]cc3C2)c1	ZINC000270544375	408571147	/nfs/dbraw/zinc/57/11/47/408571147.db2.gz	LRVNQMSLOGHYKL-CYBMUJFWSA-N	1	1	318.333	1.116	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCc3n[nH]cc3C2)c1	ZINC000270544375	408571152	/nfs/dbraw/zinc/57/11/52/408571152.db2.gz	LRVNQMSLOGHYKL-CYBMUJFWSA-N	1	1	318.333	1.116	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248466414	408574184	/nfs/dbraw/zinc/57/41/84/408574184.db2.gz	SIPZURBNOKEKJI-UONOGXRCSA-N	1	1	324.377	1.693	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000177144774	408533750	/nfs/dbraw/zinc/53/37/50/408533750.db2.gz	YYCGSTDKPLKFKD-VHSXEESVSA-N	1	1	321.381	1.625	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)[C@@H]2CSC[NH2+]2)c([N+](=O)[O-])c1	ZINC000161541069	408612618	/nfs/dbraw/zinc/61/26/18/408612618.db2.gz	ZCHKUMGFPPXHED-LBPRGKRZSA-N	1	1	324.406	1.484	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COC[C@H]1CCCO1	ZINC000248784320	408631581	/nfs/dbraw/zinc/63/15/81/408631581.db2.gz	XLFIXPBKJDHMEO-LSDHHAIUSA-N	1	1	324.377	1.583	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]1CO	ZINC000248958884	408667966	/nfs/dbraw/zinc/66/79/66/408667966.db2.gz	QPTVSRPXTLNHJM-IINYFYTJSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]1CO	ZINC000248958884	408667969	/nfs/dbraw/zinc/66/79/69/408667969.db2.gz	QPTVSRPXTLNHJM-IINYFYTJSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162634794	408720590	/nfs/dbraw/zinc/72/05/90/408720590.db2.gz	XKDLGVXEIWZEKE-CYBMUJFWSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162634794	408720594	/nfs/dbraw/zinc/72/05/94/408720594.db2.gz	XKDLGVXEIWZEKE-CYBMUJFWSA-N	1	1	307.350	1.769	20	5		DDBDMO
CN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1=O	ZINC000265650085	408731443	/nfs/dbraw/zinc/73/14/43/408731443.db2.gz	NQUXQIHPOLCOHZ-CYBMUJFWSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000249527346	408737519	/nfs/dbraw/zinc/73/75/19/408737519.db2.gz	AGGVRCOBRWMDOF-BZPMIXESSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000249146433	408699257	/nfs/dbraw/zinc/69/92/57/408699257.db2.gz	ULPXXBLXQSENTR-GXSJLCMTSA-N	1	1	308.338	1.108	20	5		DDBDMO
[NH3+][C@H]1CC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@@H]12	ZINC000185130845	408765208	/nfs/dbraw/zinc/76/52/08/408765208.db2.gz	NBERQTNIEKNCIX-FXAINCCUSA-N	1	1	315.333	1.280	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280876165	408851481	/nfs/dbraw/zinc/85/14/81/408851481.db2.gz	ZUNTWEIMAUDJGS-BONVTDFDSA-N	1	1	320.349	1.119	20	5		DDBDMO
Cc1ccnc(NCCN2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000281600977	408895166	/nfs/dbraw/zinc/89/51/66/408895166.db2.gz	IADAEEADYXXLBI-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(N)c2F)[C@H](C)C1	ZINC000281611730	408896682	/nfs/dbraw/zinc/89/66/82/408896682.db2.gz	ZEULRBKZEWHTSF-NXEZZACHSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)C1	ZINC000291757939	408918947	/nfs/dbraw/zinc/91/89/47/408918947.db2.gz	UOCMNPPLXIUUFI-MRXNPFEDSA-N	1	1	318.377	1.832	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000193652402	163264997	/nfs/dbraw/zinc/26/49/97/163264997.db2.gz	XPJPKFKRSZKPJW-TXEJJXNPSA-N	1	1	304.350	1.027	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCCO	ZINC000281925832	408955348	/nfs/dbraw/zinc/95/53/48/408955348.db2.gz	SDYLLMJWPDPTPZ-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000286380141	408974055	/nfs/dbraw/zinc/97/40/55/408974055.db2.gz	GQCPNUWKIGOSSU-UKRRQHHQSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000282094576	408990499	/nfs/dbraw/zinc/99/04/99/408990499.db2.gz	OWOJEYKSQXETGV-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
COCCO[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000278037457	409055550	/nfs/dbraw/zinc/05/55/50/409055550.db2.gz	BZOGZTXUHWQUBM-ZBFHGGJFSA-N	1	1	324.377	1.441	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@H](O)CC2)c([N+](=O)[O-])c1	ZINC000293131632	409055777	/nfs/dbraw/zinc/05/57/77/409055777.db2.gz	MXEYIXUNUVRPPJ-GFCCVEGCSA-N	1	1	310.350	1.829	20	5		DDBDMO
C[C@@H](C[NH+]1CCN(C)CC1)Nc1c2c(ccc1[N+](=O)[O-])NCC2	ZINC000278163265	409075876	/nfs/dbraw/zinc/07/58/76/409075876.db2.gz	CGKBLWLXMRMJJC-LBPRGKRZSA-N	1	1	319.409	1.611	20	5		DDBDMO
C[C@H](C[NH+]1CCN(C)CC1)Nc1c2c(ccc1[N+](=O)[O-])NCC2	ZINC000278163260	409076175	/nfs/dbraw/zinc/07/61/75/409076175.db2.gz	CGKBLWLXMRMJJC-GFCCVEGCSA-N	1	1	319.409	1.611	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+](C)C2)c1	ZINC000283411240	409151386	/nfs/dbraw/zinc/15/13/86/409151386.db2.gz	HYTWVARPICUUDJ-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
O=c1nc([C@@H]2CCCCN2Cc2cccc([N+](=O)[O-])c2)[nH][n-]1	ZINC000289047482	409211873	/nfs/dbraw/zinc/21/18/73/409211873.db2.gz	BWJRJJLBFAOHQQ-LBPRGKRZSA-N	1	1	303.322	1.733	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000280721281	409425208	/nfs/dbraw/zinc/42/52/08/409425208.db2.gz	IAYJDADTFAWPQV-DZGCQCFKSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC(C)[C@H](CNc1ccc([N+](=O)[O-])nc1)N1CC[NH+](C)CC1	ZINC000315971642	164020781	/nfs/dbraw/zinc/02/07/81/164020781.db2.gz	VHMLGBSBUNAPCE-AWEZNQCLSA-N	1	1	307.398	1.674	20	5		DDBDMO
CNc1c(C(=O)NCCn2cc[nH+]c2C)cccc1[N+](=O)[O-]	ZINC000320794416	164042925	/nfs/dbraw/zinc/04/29/25/164042925.db2.gz	GJGBFPWCRNFLJF-UHFFFAOYSA-N	1	1	303.322	1.571	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]2OCC[N@@H+](C)[C@H]2C1	ZINC000408028979	164202327	/nfs/dbraw/zinc/20/23/27/164202327.db2.gz	VMODWNOVYOAALR-RYUDHWBXSA-N	1	1	309.370	1.029	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)CN(C)C	ZINC000344855572	409532728	/nfs/dbraw/zinc/53/27/28/409532728.db2.gz	GJJFEKCRZUZRGL-LPDYGMJQSA-N	1	1	307.394	1.900	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@H]3CCCOC3)C2)nc1	ZINC000331461066	409532850	/nfs/dbraw/zinc/53/28/50/409532850.db2.gz	JJJPGOIZHQZKRY-OLZOCXBDSA-N	1	1	306.366	1.903	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000356765383	409584171	/nfs/dbraw/zinc/58/41/71/409584171.db2.gz	KILOQOKVQZKXNI-ZDUSSCGKSA-N	1	1	322.409	1.876	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000342452885	409643395	/nfs/dbraw/zinc/64/33/95/409643395.db2.gz	QPLOYVQMBSLFLY-WCQYABFASA-N	1	1	319.361	1.573	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@H]2C)n1	ZINC000332027109	409814630	/nfs/dbraw/zinc/81/46/30/409814630.db2.gz	UHCQXTOZBHWWMH-NEPJUHHUSA-N	1	1	321.381	1.510	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@H]2C)n1	ZINC000332027109	409814635	/nfs/dbraw/zinc/81/46/35/409814635.db2.gz	UHCQXTOZBHWWMH-NEPJUHHUSA-N	1	1	321.381	1.510	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H](c2ccccc2)C1	ZINC000354521307	409915517	/nfs/dbraw/zinc/91/55/17/409915517.db2.gz	NHZDAZDFWUSWHK-AAEUAGOBSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[C@@H](O)CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000354731845	410045787	/nfs/dbraw/zinc/04/57/87/410045787.db2.gz	LQVQSNXHKQEYIB-CYBMUJFWSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000343034850	410091172	/nfs/dbraw/zinc/09/11/72/410091172.db2.gz	BHSHHDXRYNXIFA-NSHDSACASA-N	1	1	307.350	1.300	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000343034850	410091176	/nfs/dbraw/zinc/09/11/76/410091176.db2.gz	BHSHHDXRYNXIFA-NSHDSACASA-N	1	1	307.350	1.300	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H](CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000298085592	410105476	/nfs/dbraw/zinc/10/54/76/410105476.db2.gz	HQAOSMTZCLYWPR-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091608	410108403	/nfs/dbraw/zinc/10/84/03/410108403.db2.gz	RZYJRFAKINTBDQ-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091608	410108405	/nfs/dbraw/zinc/10/84/05/410108405.db2.gz	RZYJRFAKINTBDQ-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCCC[C@H]1C	ZINC000343076663	410125635	/nfs/dbraw/zinc/12/56/35/410125635.db2.gz	NHECTAVUUKKFOV-NEPJUHHUSA-N	1	1	308.382	1.926	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(=O)n(CCCn2cc[nH+]c2C)c1	ZINC000298521168	410269806	/nfs/dbraw/zinc/26/98/06/410269806.db2.gz	TXDUPZLCHBCKAA-UHFFFAOYSA-N	1	1	320.305	1.138	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)CO	ZINC000298535606	410279118	/nfs/dbraw/zinc/27/91/18/410279118.db2.gz	MOVLKYWXRQEAOV-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](C)CC1	ZINC000298638734	410324192	/nfs/dbraw/zinc/32/41/92/410324192.db2.gz	OWLFWOPRWHEZMV-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)N1C	ZINC000339617410	410331706	/nfs/dbraw/zinc/33/17/06/410331706.db2.gz	NIWCFUDNCHPELC-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000355084260	410304520	/nfs/dbraw/zinc/30/45/20/410304520.db2.gz	XAMSFDHVEFIBBS-INIZCTEOSA-N	1	1	322.361	1.873	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000355084260	410304526	/nfs/dbraw/zinc/30/45/26/410304526.db2.gz	XAMSFDHVEFIBBS-INIZCTEOSA-N	1	1	322.361	1.873	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000355376254	410481090	/nfs/dbraw/zinc/48/10/90/410481090.db2.gz	XEPFMWCKHRBWAD-HUUCEWRRSA-N	1	1	319.361	1.530	20	5		DDBDMO
CC(C)[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761721	410679057	/nfs/dbraw/zinc/67/90/57/410679057.db2.gz	SVXYYAOUBPXEOD-CJNGLKHVSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761721	410679061	/nfs/dbraw/zinc/67/90/61/410679061.db2.gz	SVXYYAOUBPXEOD-CJNGLKHVSA-N	1	1	324.377	1.691	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000330571997	410788422	/nfs/dbraw/zinc/78/84/22/410788422.db2.gz	DKAINMBLKOZFIB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000330571997	410788428	/nfs/dbraw/zinc/78/84/28/410788428.db2.gz	DKAINMBLKOZFIB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000330586592	410801571	/nfs/dbraw/zinc/80/15/71/410801571.db2.gz	LTWHXYXSZQRZMB-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
COc1cc(N2C[C@@H]3[C@H](C2)OCC[N@H+]3C)c(F)cc1[N+](=O)[O-]	ZINC000301943197	410833306	/nfs/dbraw/zinc/83/33/06/410833306.db2.gz	XYMNQXUWVUXUFE-OCCSQVGLSA-N	1	1	311.313	1.262	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000330618868	410833846	/nfs/dbraw/zinc/83/38/46/410833846.db2.gz	YUJMBMKAWQWJLW-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000330618868	410833852	/nfs/dbraw/zinc/83/38/52/410833852.db2.gz	YUJMBMKAWQWJLW-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(c3ncc([N+](=O)[O-])cn3)CC2)c1	ZINC000302230574	410843737	/nfs/dbraw/zinc/84/37/37/410843737.db2.gz	RTEWFRVLPPSXBQ-UHFFFAOYSA-N	1	1	300.322	1.415	20	5		DDBDMO
C[C@@H]1[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@@H+]1C	ZINC000343962360	410851411	/nfs/dbraw/zinc/85/14/11/410851411.db2.gz	BXKSCESVHMZYQB-ZWNOBZJWSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H]1[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343962360	410851414	/nfs/dbraw/zinc/85/14/14/410851414.db2.gz	BXKSCESVHMZYQB-ZWNOBZJWSA-N	1	1	313.379	1.356	20	5		DDBDMO
COc1c(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000331053725	410921427	/nfs/dbraw/zinc/92/14/27/410921427.db2.gz	JNVHOMPLGILSJB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000331053725	410921430	/nfs/dbraw/zinc/92/14/30/410921430.db2.gz	JNVHOMPLGILSJB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC(C[NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000331211112	411020589	/nfs/dbraw/zinc/02/05/89/411020589.db2.gz	IMYITUKZYLKUEO-UHFFFAOYSA-N	1	1	323.397	1.855	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)[C@@H]2CCC[N@@H+]2C)c([N+](=O)[O-])c1	ZINC000129192526	196027505	/nfs/dbraw/zinc/02/75/05/196027505.db2.gz	RGMMVGKBMSTYMA-AWEZNQCLSA-N	1	1	320.393	1.916	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CSc1ccc([N+](=O)[O-])cn1	ZINC000580660282	422947037	/nfs/dbraw/zinc/94/70/37/422947037.db2.gz	YZHRIAPBYPRZAN-NSHDSACASA-N	1	1	301.368	1.021	20	5		DDBDMO
Cn1c(Cl)cnc1C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC001120557896	782021797	/nfs/dbraw/zinc/02/17/97/782021797.db2.gz	BZJFYYGUGYEACG-NSHDSACASA-N	1	1	310.741	1.805	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000419000367	226002006	/nfs/dbraw/zinc/00/20/06/226002006.db2.gz	OGAHVCDWMXBZHS-WDEREUQCSA-N	1	1	319.365	1.362	20	5		DDBDMO
C[C@@H]1C[C@@]2(CCO1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000374018910	418483588	/nfs/dbraw/zinc/48/35/88/418483588.db2.gz	QCDWTCAAEFIBHI-NFAWXSAZSA-N	1	1	324.381	1.450	20	5		DDBDMO
C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000374018910	418483590	/nfs/dbraw/zinc/48/35/90/418483590.db2.gz	QCDWTCAAEFIBHI-NFAWXSAZSA-N	1	1	324.381	1.450	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)CC12CCCCC2	ZINC000360757875	418509182	/nfs/dbraw/zinc/50/91/82/418509182.db2.gz	ZECXHVLPWAZXEY-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)n1	ZINC000191633042	222106430	/nfs/dbraw/zinc/10/64/30/222106430.db2.gz	YSHDXJJSJXCBME-NWDGAFQWSA-N	1	1	323.397	1.614	20	5		DDBDMO
CC1(C)OCC(CO)([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)CO1	ZINC000291118672	222150390	/nfs/dbraw/zinc/15/03/90/222150390.db2.gz	LFWXBGMPDVLVLE-UHFFFAOYSA-N	1	1	314.313	1.338	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000361408637	418645080	/nfs/dbraw/zinc/64/50/80/418645080.db2.gz	PLLQRABNSLHNKS-GFCCVEGCSA-N	1	1	318.333	1.990	20	5		DDBDMO
O=C1NCCN1[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000361309789	418623926	/nfs/dbraw/zinc/62/39/26/418623926.db2.gz	MTTVHTNQIUPWCJ-AWEZNQCLSA-N	1	1	304.350	1.584	20	5		DDBDMO
O=C1NCCN1[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000361309789	418623929	/nfs/dbraw/zinc/62/39/29/418623929.db2.gz	MTTVHTNQIUPWCJ-AWEZNQCLSA-N	1	1	304.350	1.584	20	5		DDBDMO
CCCCNC(=O)[C@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399831	418634354	/nfs/dbraw/zinc/63/43/54/418634354.db2.gz	AXNSRNNSIYELME-STQMWFEESA-N	1	1	323.397	1.733	20	5		DDBDMO
CCCCNC(=O)[C@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399831	418634355	/nfs/dbraw/zinc/63/43/55/418634355.db2.gz	AXNSRNNSIYELME-STQMWFEESA-N	1	1	323.397	1.733	20	5		DDBDMO
CC(C)N(C)C(=O)[C@@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400321	418635333	/nfs/dbraw/zinc/63/53/33/418635333.db2.gz	BUPXGKJSNJVKFQ-CHWSQXEVSA-N	1	1	323.397	1.684	20	5		DDBDMO
CC(C)N(C)C(=O)[C@@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400321	418635337	/nfs/dbraw/zinc/63/53/37/418635337.db2.gz	BUPXGKJSNJVKFQ-CHWSQXEVSA-N	1	1	323.397	1.684	20	5		DDBDMO
NC(=O)[C@@H]1C[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]1C(F)(F)F	ZINC000375414055	418637354	/nfs/dbraw/zinc/63/73/54/418637354.db2.gz	YGWMNAJERLAMPA-GHMZBOCLSA-N	1	1	317.267	1.690	20	5		DDBDMO
NC(=O)[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C[C@H]1C(F)(F)F	ZINC000375414055	418637356	/nfs/dbraw/zinc/63/73/56/418637356.db2.gz	YGWMNAJERLAMPA-GHMZBOCLSA-N	1	1	317.267	1.690	20	5		DDBDMO
[NH3+]C[C@H]1CC[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000382486484	418731458	/nfs/dbraw/zinc/73/14/58/418731458.db2.gz	GTGOHOPRRAUTAQ-IUCAKERBSA-N	1	1	317.342	1.140	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)n1	ZINC000371212642	418768813	/nfs/dbraw/zinc/76/88/13/418768813.db2.gz	MDCIAERFIMMAFQ-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411916388	419481400	/nfs/dbraw/zinc/48/14/00/419481400.db2.gz	YORGXYDTGKKMLP-BPNCWPANSA-N	1	1	323.349	1.003	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411916388	419481409	/nfs/dbraw/zinc/48/14/09/419481409.db2.gz	YORGXYDTGKKMLP-BPNCWPANSA-N	1	1	323.349	1.003	20	5		DDBDMO
Cc1cn(Cc2ccc(C[NH+]3CCOCC3)cc2)nc1[N+](=O)[O-]	ZINC000421220176	419525719	/nfs/dbraw/zinc/52/57/19/419525719.db2.gz	WMFKETWPUJOSST-UHFFFAOYSA-N	1	1	316.361	1.980	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](C(C)C)C2)n1	ZINC000427493198	419672207	/nfs/dbraw/zinc/67/22/07/419672207.db2.gz	RRDPVDWHKWOOFL-LLVKDONJSA-N	1	1	309.370	1.223	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)n1	ZINC000427493198	419672213	/nfs/dbraw/zinc/67/22/13/419672213.db2.gz	RRDPVDWHKWOOFL-LLVKDONJSA-N	1	1	309.370	1.223	20	5		DDBDMO
COc1cc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000421703783	419686715	/nfs/dbraw/zinc/68/67/15/419686715.db2.gz	NAJBVFHIGVKWHZ-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000418996943	420041938	/nfs/dbraw/zinc/04/19/38/420041938.db2.gz	FSHWWNFVEOOGTB-NXEZZACHSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000418996943	420041942	/nfs/dbraw/zinc/04/19/42/420041942.db2.gz	FSHWWNFVEOOGTB-NXEZZACHSA-N	1	1	312.345	1.207	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000416494278	420392699	/nfs/dbraw/zinc/39/26/99/420392699.db2.gz	IFBPDHFAUPNDBA-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)[C@@H](C)O1	ZINC000446061669	230223060	/nfs/dbraw/zinc/22/30/60/230223060.db2.gz	RCNGODKAIKJIBX-SYQHCUMBSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)[C@@H](C)O1	ZINC000446061669	230223065	/nfs/dbraw/zinc/22/30/65/230223065.db2.gz	RCNGODKAIKJIBX-SYQHCUMBSA-N	1	1	324.377	1.832	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000457091916	420606742	/nfs/dbraw/zinc/60/67/42/420606742.db2.gz	NCESVUBDLGOOMX-GFCCVEGCSA-N	1	1	307.350	1.855	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000457091916	420606745	/nfs/dbraw/zinc/60/67/45/420606745.db2.gz	NCESVUBDLGOOMX-GFCCVEGCSA-N	1	1	307.350	1.855	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000457024176	420589934	/nfs/dbraw/zinc/58/99/34/420589934.db2.gz	OEMUMFXBRNVOFY-LBPRGKRZSA-N	1	1	301.306	1.105	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000457097816	420612875	/nfs/dbraw/zinc/61/28/75/420612875.db2.gz	LDOXRAZDETWXRL-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000457097816	420612877	/nfs/dbraw/zinc/61/28/77/420612877.db2.gz	LDOXRAZDETWXRL-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]21	ZINC000452973685	420692383	/nfs/dbraw/zinc/69/23/83/420692383.db2.gz	KHZMSAZXLRTBOF-RISCZKNCSA-N	1	1	307.325	1.439	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](CO)[C@H]3CCCO3)nc2c1	ZINC000447902563	420813360	/nfs/dbraw/zinc/81/33/60/420813360.db2.gz	FKGKRJNAFDZGLW-NWDGAFQWSA-N	1	1	307.306	1.366	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@@H](O)[C@H](CO)C3)o2)c1	ZINC000459694208	420849595	/nfs/dbraw/zinc/84/95/95/420849595.db2.gz	GDAOKEYKYPTNSD-SWLSCSKDSA-N	1	1	318.329	1.640	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+](C)C(C)C)c([N+](=O)[O-])cc1F	ZINC000448982439	420928601	/nfs/dbraw/zinc/92/86/01/420928601.db2.gz	XHDBVFXBJKGNDA-UHFFFAOYSA-N	1	1	313.329	1.813	20	5		DDBDMO
Cc1ccc(CNC[C@H]2CCC[N@@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449387360	421001778	/nfs/dbraw/zinc/00/17/78/421001778.db2.gz	LDVDOKAWWRTBAU-OAHLLOKOSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1ccc(CNC[C@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449387360	421001783	/nfs/dbraw/zinc/00/17/83/421001783.db2.gz	LDVDOKAWWRTBAU-OAHLLOKOSA-N	1	1	307.394	1.840	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000449576333	421031100	/nfs/dbraw/zinc/03/11/00/421031100.db2.gz	RTGBMYCVDZHSQW-ZDUSSCGKSA-N	1	1	314.292	1.090	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000549638910	421504173	/nfs/dbraw/zinc/50/41/73/421504173.db2.gz	DGQTZCHJUUJBLG-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000549638910	421504175	/nfs/dbraw/zinc/50/41/75/421504175.db2.gz	DGQTZCHJUUJBLG-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000553544879	421619388	/nfs/dbraw/zinc/61/93/88/421619388.db2.gz	OKQUGQJDPCUPAD-SECBINFHSA-N	1	1	303.322	1.751	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000569019763	421624416	/nfs/dbraw/zinc/62/44/16/421624416.db2.gz	OJJQZOPFZDXZAL-NSHDSACASA-N	1	1	321.381	1.636	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cn2)CCCO1	ZINC000555762503	421690335	/nfs/dbraw/zinc/69/03/35/421690335.db2.gz	SKVXZIHZEGMDDH-LBPRGKRZSA-N	1	1	322.365	1.221	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000571541933	421725505	/nfs/dbraw/zinc/72/55/05/421725505.db2.gz	BOJZXXUGUOASSU-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)n1	ZINC000539023426	421746508	/nfs/dbraw/zinc/74/65/08/421746508.db2.gz	CZSGZSVCBUALRO-UHFFFAOYSA-N	1	1	309.370	1.275	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCCN1CCN(c2[nH]cc[nH+]2)CC1	ZINC000572194387	421768565	/nfs/dbraw/zinc/76/85/65/421768565.db2.gz	XYPCWAOPYOGXJE-UHFFFAOYSA-N	1	1	317.349	1.519	20	5		DDBDMO
C[N@H+]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000557334218	421769148	/nfs/dbraw/zinc/76/91/48/421769148.db2.gz	DAFPTFBAUJWPAX-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000557334218	421769150	/nfs/dbraw/zinc/76/91/50/421769150.db2.gz	DAFPTFBAUJWPAX-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000557334218	421769154	/nfs/dbraw/zinc/76/91/54/421769154.db2.gz	DAFPTFBAUJWPAX-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000572395925	421784569	/nfs/dbraw/zinc/78/45/69/421784569.db2.gz	OXPXGHVEKIQFEQ-CQSZACIVSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000572395925	421784571	/nfs/dbraw/zinc/78/45/71/421784571.db2.gz	OXPXGHVEKIQFEQ-CQSZACIVSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000577817921	422432993	/nfs/dbraw/zinc/43/29/93/422432993.db2.gz	HRKOQQKWWFOWGU-UHFFFAOYSA-N	1	1	307.335	1.342	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000597860962	422392253	/nfs/dbraw/zinc/39/22/53/422392253.db2.gz	QJOFBPKBEAYUJV-VIFPVBQESA-N	1	1	307.354	1.175	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000578160507	422512198	/nfs/dbraw/zinc/51/21/98/422512198.db2.gz	LUMBCZVYLRHWHR-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)[C@H](C)C1	ZINC000341772127	271206936	/nfs/dbraw/zinc/20/69/36/271206936.db2.gz	MUVXKRORYVVYFJ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)[C@H](C)C1	ZINC000341772127	271206937	/nfs/dbraw/zinc/20/69/37/271206937.db2.gz	MUVXKRORYVVYFJ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-]	ZINC000344618702	272072000	/nfs/dbraw/zinc/07/20/00/272072000.db2.gz	PSFYCCFLWSFHBT-LLVKDONJSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000345913768	272363644	/nfs/dbraw/zinc/36/36/44/272363644.db2.gz	WANITMJPBZLHSB-QWRGUYRKSA-N	1	1	309.370	1.041	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000345971486	272379343	/nfs/dbraw/zinc/37/93/43/272379343.db2.gz	VEPSMEUYDGFAGB-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
CCOCC[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000153718962	273699962	/nfs/dbraw/zinc/69/99/62/273699962.db2.gz	HTCZYRDGZMIXJH-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
C[C@@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1CCO	ZINC000432169837	274366221	/nfs/dbraw/zinc/36/62/21/274366221.db2.gz	NEYZOLLTTSKBTA-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
COC(=O)[C@H]1CN(c2cc(C)ccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000413508299	277362862	/nfs/dbraw/zinc/36/28/62/277362862.db2.gz	XIOQXUORHFIXGK-GFCCVEGCSA-N	1	1	307.350	1.444	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCOC1	ZINC000247019086	282029218	/nfs/dbraw/zinc/02/92/18/282029218.db2.gz	LSBBIXZBEFWHTH-GXTWGEPZSA-N	1	1	310.350	1.303	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000363026610	300200482	/nfs/dbraw/zinc/20/04/82/300200482.db2.gz	JVZMEJZCHFFVGX-HIFRSBDPSA-N	1	1	303.362	1.880	20	5		DDBDMO
CC(C)OC(=O)CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000364324177	300376212	/nfs/dbraw/zinc/37/62/12/300376212.db2.gz	LIWRERDPRKHYBO-LBPRGKRZSA-N	1	1	310.354	1.770	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000368458389	301032519	/nfs/dbraw/zinc/03/25/19/301032519.db2.gz	OBFDXTDCDNPENG-OAHLLOKOSA-N	1	1	321.377	1.363	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000368587548	301058467	/nfs/dbraw/zinc/05/84/67/301058467.db2.gz	DACMUPGTYLDVJN-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000368587548	301058469	/nfs/dbraw/zinc/05/84/69/301058469.db2.gz	DACMUPGTYLDVJN-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000368587548	301058472	/nfs/dbraw/zinc/05/84/72/301058472.db2.gz	DACMUPGTYLDVJN-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000369334506	301166947	/nfs/dbraw/zinc/16/69/47/301166947.db2.gz	GBDQBFXRUNEDQX-UHFFFAOYSA-N	1	1	309.370	1.126	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)CCO1	ZINC000370055776	301267723	/nfs/dbraw/zinc/26/77/23/301267723.db2.gz	MYYFBSUGLAEDII-GFCCVEGCSA-N	1	1	323.397	1.013	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000372933795	301633162	/nfs/dbraw/zinc/63/31/62/301633162.db2.gz	QQRQIOYPVFIMLG-GJZGRUSLSA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1C[N@H+](C)CCN1C	ZINC000531970540	303268268	/nfs/dbraw/zinc/26/82/68/303268268.db2.gz	CRTUHCUNKJGXHM-HIFRSBDPSA-N	1	1	306.410	1.800	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532143143	303277154	/nfs/dbraw/zinc/27/71/54/303277154.db2.gz	ILDQSLNUEIAVRC-LBPRGKRZSA-N	1	1	306.366	1.936	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000532311601	303282347	/nfs/dbraw/zinc/28/23/47/303282347.db2.gz	AYXOSJNZTDWXIW-LBPRGKRZSA-N	1	1	308.382	1.641	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000534338944	303332043	/nfs/dbraw/zinc/33/20/43/303332043.db2.gz	GVUNNXQILANMBS-NWDGAFQWSA-N	1	1	321.377	1.697	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC1	ZINC000535329640	303346377	/nfs/dbraw/zinc/34/63/77/303346377.db2.gz	LCAKEPIYPUUSNZ-UHFFFAOYSA-N	1	1	321.333	1.144	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@]1(CO)CCc2ccccc21	ZINC000362390961	307020407	/nfs/dbraw/zinc/02/04/07/307020407.db2.gz	FUYZOLMYNROSRX-OAHLLOKOSA-N	1	1	302.334	1.252	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000366584304	307076846	/nfs/dbraw/zinc/07/68/46/307076846.db2.gz	FIBVPLVQBQOHHL-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000366584304	307076847	/nfs/dbraw/zinc/07/68/47/307076847.db2.gz	FIBVPLVQBQOHHL-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
Cn1ccnc1C[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000367090194	307085514	/nfs/dbraw/zinc/08/55/14/307085514.db2.gz	VZMBTHBYAXXROO-LBPRGKRZSA-N	1	1	318.381	1.517	20	5		DDBDMO
Cn1ccnc1C[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000367090194	307085515	/nfs/dbraw/zinc/08/55/15/307085515.db2.gz	VZMBTHBYAXXROO-LBPRGKRZSA-N	1	1	318.381	1.517	20	5		DDBDMO
COC[C@H]1CCCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000372087788	307163033	/nfs/dbraw/zinc/16/30/33/307163033.db2.gz	GSTZMEXQAHWQNY-LBPRGKRZSA-N	1	1	321.377	1.942	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000373269965	307183162	/nfs/dbraw/zinc/18/31/62/307183162.db2.gz	IPWYIMZGESAPDA-CQSZACIVSA-N	1	1	307.306	1.850	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000373269965	307183163	/nfs/dbraw/zinc/18/31/63/307183163.db2.gz	IPWYIMZGESAPDA-CQSZACIVSA-N	1	1	307.306	1.850	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](O)C2(CC2)C1	ZINC000373514603	307189626	/nfs/dbraw/zinc/18/96/26/307189626.db2.gz	UYZVHVCRXBTXFZ-GWCFXTLKSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](O)C2(CC2)C1	ZINC000373514603	307189627	/nfs/dbraw/zinc/18/96/27/307189627.db2.gz	UYZVHVCRXBTXFZ-GWCFXTLKSA-N	1	1	305.334	1.379	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000510145122	307398816	/nfs/dbraw/zinc/39/88/16/307398816.db2.gz	QQZUTWDZULVTBZ-TXEJJXNPSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C1	ZINC000510145122	307398818	/nfs/dbraw/zinc/39/88/18/307398818.db2.gz	QQZUTWDZULVTBZ-TXEJJXNPSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000567345835	308078739	/nfs/dbraw/zinc/07/87/39/308078739.db2.gz	VTVMCALZTVGXPL-UMVBOHGHSA-N	1	1	323.393	1.407	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000569805245	308149783	/nfs/dbraw/zinc/14/97/83/308149783.db2.gz	QYIGVLBVDZLTKC-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](CO)[C@H](O)C1	ZINC000574228350	308265823	/nfs/dbraw/zinc/26/58/23/308265823.db2.gz	ZBXWQMNEJKGHPQ-IUODEOHRSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CO)[C@H](O)C1	ZINC000574228350	308265824	/nfs/dbraw/zinc/26/58/24/308265824.db2.gz	ZBXWQMNEJKGHPQ-IUODEOHRSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1COC1	ZINC000451284648	528475023	/nfs/dbraw/zinc/47/50/23/528475023.db2.gz	JWJXFIAYRIROBD-UHFFFAOYSA-N	1	1	321.333	1.614	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000443956867	528938307	/nfs/dbraw/zinc/93/83/07/528938307.db2.gz	DOYVDBKEOVXUFJ-UHFFFAOYSA-N	1	1	321.381	1.623	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)COc1ccc(C=O)cc1[N+](=O)[O-]	ZINC000112928984	696653634	/nfs/dbraw/zinc/65/36/34/696653634.db2.gz	BTXKWHGWCMUHTA-UHFFFAOYSA-N	1	1	323.349	1.243	20	5		DDBDMO
CCOC(C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)OCC	ZINC000124994207	696748198	/nfs/dbraw/zinc/74/81/98/696748198.db2.gz	VAUTUHLBYRFDBB-LBPRGKRZSA-N	1	1	324.381	1.875	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2CO1	ZINC000799179865	700126678	/nfs/dbraw/zinc/12/66/78/700126678.db2.gz	ZTBZGQUGFDAXPJ-XBFCOCLRSA-N	1	1	321.333	1.059	20	5		DDBDMO
Cn1ccnc1[C@@H](N[C@@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000780764750	698558220	/nfs/dbraw/zinc/55/82/20/698558220.db2.gz	PVXHBMAJFBIZAR-HIFRSBDPSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@@H](N[C@@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000780765200	698558565	/nfs/dbraw/zinc/55/85/65/698558565.db2.gz	WYDDVCKNDXLRGL-HIFRSBDPSA-N	1	1	315.377	1.711	20	5		DDBDMO
O=C(OCCn1ccc([N+](=O)[O-])n1)[C@@H]1CCC[N@H+]1C1CCCC1	ZINC000786893830	699177320	/nfs/dbraw/zinc/17/73/20/699177320.db2.gz	XKCGNMCHYNBHNW-ZDUSSCGKSA-N	1	1	322.365	1.742	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000705386550	699240809	/nfs/dbraw/zinc/24/08/09/699240809.db2.gz	HSJZUYMHOXTWRB-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000705386550	699240811	/nfs/dbraw/zinc/24/08/11/699240811.db2.gz	HSJZUYMHOXTWRB-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CCN(c2[nH]cc[nH+]2)CC1	ZINC000788002908	699265974	/nfs/dbraw/zinc/26/59/74/699265974.db2.gz	CNNFZTAOUPGYBJ-UHFFFAOYSA-N	1	1	305.313	1.779	20	5		DDBDMO
C[N@@H+](CC1CC1)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000726586342	699369103	/nfs/dbraw/zinc/36/91/03/699369103.db2.gz	WLIRFIUHVDDKTJ-UHFFFAOYSA-N	1	1	318.333	1.663	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000794709144	699826257	/nfs/dbraw/zinc/82/62/57/699826257.db2.gz	CQBLKGSHFSOTSU-AWEZNQCLSA-N	1	1	303.322	1.099	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](CCOc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000794964467	699838120	/nfs/dbraw/zinc/83/81/20/699838120.db2.gz	RAZKJEKSQNRBHP-YABSGUDNSA-N	1	1	306.318	1.324	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000795751074	699889494	/nfs/dbraw/zinc/88/94/94/699889494.db2.gz	VLAISABETZSMLS-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000795751074	699889497	/nfs/dbraw/zinc/88/94/97/699889497.db2.gz	VLAISABETZSMLS-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000762814237	700908353	/nfs/dbraw/zinc/90/83/53/700908353.db2.gz	BFZJTXSPQZFYPV-MRVPVSSYSA-N	1	1	321.362	1.376	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000762814237	700908354	/nfs/dbraw/zinc/90/83/54/700908354.db2.gz	BFZJTXSPQZFYPV-MRVPVSSYSA-N	1	1	321.362	1.376	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839524541	701723989	/nfs/dbraw/zinc/72/39/89/701723989.db2.gz	MBOLJWVVDLJXAC-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839524541	701723997	/nfs/dbraw/zinc/72/39/97/701723997.db2.gz	MBOLJWVVDLJXAC-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839524541	701723999	/nfs/dbraw/zinc/72/39/99/701723999.db2.gz	MBOLJWVVDLJXAC-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839568218	701739363	/nfs/dbraw/zinc/73/93/63/701739363.db2.gz	OBYUGTCXURKAEV-SPWCGHHHSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568218	701739368	/nfs/dbraw/zinc/73/93/68/701739368.db2.gz	OBYUGTCXURKAEV-SPWCGHHHSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568218	701739374	/nfs/dbraw/zinc/73/93/74/701739374.db2.gz	OBYUGTCXURKAEV-SPWCGHHHSA-N	1	1	303.362	1.603	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCC(=O)N1	ZINC000839671024	701776149	/nfs/dbraw/zinc/77/61/49/701776149.db2.gz	XXRQWNAXSOWXOL-DZGCQCFKSA-N	1	1	321.377	1.617	20	5		DDBDMO
C[C@@H]1CSCCN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867927795	701835027	/nfs/dbraw/zinc/83/50/27/701835027.db2.gz	OMWUBFXVHLOEEN-QMTHXVAHSA-N	1	1	309.391	1.733	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2[C@H](O)c2ccccc2)c1	ZINC000879245410	706627590	/nfs/dbraw/zinc/62/75/90/706627590.db2.gz	XLWALMHTLCZDBB-HZPDHXFCSA-N	1	1	316.361	1.989	20	5		DDBDMO
Cc1nn(CN2CC[C@@]3(C2)CCC[N@H+](C)C3)c(C)c1[N+](=O)[O-]	ZINC000840085367	701959297	/nfs/dbraw/zinc/95/92/97/701959297.db2.gz	DATOHZGAJRIAAR-HNNXBMFYSA-N	1	1	307.398	1.783	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)C[C@@H]21	ZINC000840136537	701990506	/nfs/dbraw/zinc/99/05/06/701990506.db2.gz	ZSJNZYXXPBBZHX-ABAIWWIYSA-N	1	1	301.350	1.538	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000879271759	706636160	/nfs/dbraw/zinc/63/61/60/706636160.db2.gz	ZKOUDBYYZSQTNY-UHFFFAOYSA-N	1	1	321.333	1.192	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2ccc(C)cc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000840361690	702083775	/nfs/dbraw/zinc/08/37/75/702083775.db2.gz	ZKTSIJJHWYKGBP-LBPRGKRZSA-N	1	1	307.350	1.444	20	5		DDBDMO
COC(=O)Cc1ccc(N(C)C[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000817131926	702281592	/nfs/dbraw/zinc/28/15/92/702281592.db2.gz	VRBFMCINBWHEHF-CYBMUJFWSA-N	1	1	321.377	1.841	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000817489880	702390668	/nfs/dbraw/zinc/39/06/68/702390668.db2.gz	HWTAYIDIUISLHH-LLVKDONJSA-N	1	1	322.321	1.669	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000817489881	702391342	/nfs/dbraw/zinc/39/13/42/702391342.db2.gz	HWTAYIDIUISLHH-NSHDSACASA-N	1	1	322.321	1.669	20	5		DDBDMO
COCCCC[N@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000841692455	702540742	/nfs/dbraw/zinc/54/07/42/702540742.db2.gz	QPNONFMCOYSVSM-UHFFFAOYSA-N	1	1	309.322	1.819	20	5		DDBDMO
COCCCC[N@@H+](C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000841692455	702540748	/nfs/dbraw/zinc/54/07/48/702540748.db2.gz	QPNONFMCOYSVSM-UHFFFAOYSA-N	1	1	309.322	1.819	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]2CSC[C@H]2C1	ZINC000879564387	706718783	/nfs/dbraw/zinc/71/87/83/706718783.db2.gz	ZQNKABISTZYTBL-NWDGAFQWSA-N	1	1	309.391	1.441	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000866540342	706724527	/nfs/dbraw/zinc/72/45/27/706724527.db2.gz	LYAKAWKTDUMUGS-IINYFYTJSA-N	1	1	321.352	1.875	20	5		DDBDMO
C[C@@H]1C[C@@H]1C(N)=[NH+]O[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000848518516	703560377	/nfs/dbraw/zinc/56/03/77/703560377.db2.gz	KRVCARVVVUYWBQ-JIMOISOXSA-N	1	1	318.333	1.855	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000848788546	703589314	/nfs/dbraw/zinc/58/93/14/703589314.db2.gz	ZLHDTVUZSHVMGT-UHFFFAOYSA-N	1	1	319.321	1.714	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccnn1C	ZINC000879686201	706758980	/nfs/dbraw/zinc/75/89/80/706758980.db2.gz	VUNHUAHVVPIVRL-NSHDSACASA-N	1	1	317.349	1.642	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000869801142	703854854	/nfs/dbraw/zinc/85/48/54/703854854.db2.gz	FGDYLNBIFMJXDH-SLBVQIDZSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801142	703854855	/nfs/dbraw/zinc/85/48/55/703854855.db2.gz	FGDYLNBIFMJXDH-SLBVQIDZSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801142	703854858	/nfs/dbraw/zinc/85/48/58/703854858.db2.gz	FGDYLNBIFMJXDH-SLBVQIDZSA-N	1	1	317.389	1.536	20	5		DDBDMO
CC1(C)OC[C@@H](C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851843156	703868686	/nfs/dbraw/zinc/86/86/86/703868686.db2.gz	ATWWYMWDOLCOQL-WCQYABFASA-N	1	1	322.365	1.628	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000818585725	703931565	/nfs/dbraw/zinc/93/15/65/703931565.db2.gz	NSCHDZWIMICSSO-JTQLQIEISA-N	1	1	319.695	1.927	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)N1	ZINC000852298783	704001348	/nfs/dbraw/zinc/00/13/48/704001348.db2.gz	HZFSKBDDKVKRFH-UHFFFAOYSA-N	1	1	317.345	1.843	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+][C@H]1CCn2ccnc21	ZINC000819337787	704109555	/nfs/dbraw/zinc/10/95/55/704109555.db2.gz	PHCQPLBIQNUYBF-RYUDHWBXSA-N	1	1	318.333	1.266	20	5		DDBDMO
CC(C)N1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000870863486	704148701	/nfs/dbraw/zinc/14/87/01/704148701.db2.gz	KGUUVMHNFMOROR-MRXNPFEDSA-N	1	1	320.393	1.321	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000870885057	704157189	/nfs/dbraw/zinc/15/71/89/704157189.db2.gz	AGLRRNHDFYEVGA-SGIREYDYSA-N	1	1	321.377	1.795	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853513119	704255695	/nfs/dbraw/zinc/25/56/95/704255695.db2.gz	VAHUMNSRBDOHNO-TXEJJXNPSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853513119	704255698	/nfs/dbraw/zinc/25/56/98/704255698.db2.gz	VAHUMNSRBDOHNO-TXEJJXNPSA-N	1	1	317.349	1.920	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@H](C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)CC2	ZINC000854495679	704407830	/nfs/dbraw/zinc/40/78/30/704407830.db2.gz	QLSCNQAGUQAVJM-SNVBAGLBSA-N	1	1	315.333	1.883	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000855285640	704477259	/nfs/dbraw/zinc/47/72/59/704477259.db2.gz	HLZFOLXZGDWMJX-VIFPVBQESA-N	1	1	307.354	1.175	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC2CC([NH+]3CCOCC3)C2)c([N+](=O)[O-])c1	ZINC000858601455	704732991	/nfs/dbraw/zinc/73/29/91/704732991.db2.gz	YXOORQCVCJOCMP-UHFFFAOYSA-N	1	1	322.321	1.778	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1	ZINC000859888456	705031213	/nfs/dbraw/zinc/03/12/13/705031213.db2.gz	CTVTWRWJGBRGTR-DQMOJMCFSA-N	1	1	324.402	1.614	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2ccc([N+](=O)[O-])s2)no1	ZINC000823069117	705129823	/nfs/dbraw/zinc/12/98/23/705129823.db2.gz	FJFIMERZTWFFIF-LURJTMIESA-N	1	1	312.307	1.659	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179358	705163308	/nfs/dbraw/zinc/16/33/08/705163308.db2.gz	MBSPJRJIJYEQHA-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179358	705163309	/nfs/dbraw/zinc/16/33/09/705163309.db2.gz	MBSPJRJIJYEQHA-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179358	705163310	/nfs/dbraw/zinc/16/33/10/705163310.db2.gz	MBSPJRJIJYEQHA-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000874850682	705203414	/nfs/dbraw/zinc/20/34/14/705203414.db2.gz	VUUDOEHAABRUPN-LSDHHAIUSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823933803	705341674	/nfs/dbraw/zinc/34/16/74/705341674.db2.gz	WSPGPHDGCGSROW-LLVKDONJSA-N	1	1	307.354	1.735	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)C2)C1	ZINC000823933351	705341852	/nfs/dbraw/zinc/34/18/52/705341852.db2.gz	PIJNLFMEDBBLBV-HNNXBMFYSA-N	1	1	319.365	1.737	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C1CC1	ZINC000823997762	705351176	/nfs/dbraw/zinc/35/11/76/705351176.db2.gz	HHAKODTWYJMATJ-UHFFFAOYSA-N	1	1	307.354	1.783	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000876172442	705647587	/nfs/dbraw/zinc/64/75/87/705647587.db2.gz	VYPWGGDWVPOVSS-UHFFFAOYSA-N	1	1	306.366	1.750	20	5		DDBDMO
C[C@@H](CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000825664406	705710626	/nfs/dbraw/zinc/71/06/26/705710626.db2.gz	FAAVRXXHNGPZMH-HZMBPMFUSA-N	1	1	307.350	1.227	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825970059	705752945	/nfs/dbraw/zinc/75/29/45/705752945.db2.gz	USNJYLOMLVRRAR-SWLSCSKDSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)CC1(C)COC1	ZINC000863298747	705894660	/nfs/dbraw/zinc/89/46/60/705894660.db2.gz	MBSZEHVLAXIYOL-UHFFFAOYSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC[C@H]21	ZINC000827234539	705957301	/nfs/dbraw/zinc/95/73/01/705957301.db2.gz	YIUJSOWODZCCQP-GXTWGEPZSA-N	1	1	321.352	1.829	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000877875786	706230156	/nfs/dbraw/zinc/23/01/56/706230156.db2.gz	RQLYKLFSRBTRLW-DOMZBBRYSA-N	1	1	318.333	1.066	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000879925017	706821194	/nfs/dbraw/zinc/82/11/94/706821194.db2.gz	ZCEOKBCAMZPQIU-UHFFFAOYSA-N	1	1	323.349	1.493	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136797	706888080	/nfs/dbraw/zinc/88/80/80/706888080.db2.gz	SGDINAJZXIAXOI-XHSDSOJGSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136797	706888081	/nfs/dbraw/zinc/88/80/81/706888081.db2.gz	SGDINAJZXIAXOI-XHSDSOJGSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136797	706888082	/nfs/dbraw/zinc/88/80/82/706888082.db2.gz	SGDINAJZXIAXOI-XHSDSOJGSA-N	1	1	305.378	1.797	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000882483095	707653257	/nfs/dbraw/zinc/65/32/57/707653257.db2.gz	QUHQNFUGDKADNU-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000837478086	707659570	/nfs/dbraw/zinc/65/95/70/707659570.db2.gz	SNEBUNMUULEAOB-CYBMUJFWSA-N	1	1	324.381	1.988	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000882491504	707662420	/nfs/dbraw/zinc/66/24/20/707662420.db2.gz	GTOPKTBKRYTEHX-GFCCVEGCSA-N	1	1	307.350	1.492	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000882495372	707665849	/nfs/dbraw/zinc/66/58/49/707665849.db2.gz	YHLZDHWDSQPEMX-CQSZACIVSA-N	1	1	319.361	1.768	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000882495372	707665852	/nfs/dbraw/zinc/66/58/52/707665852.db2.gz	YHLZDHWDSQPEMX-CQSZACIVSA-N	1	1	319.361	1.768	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)n1	ZINC000897221939	708259593	/nfs/dbraw/zinc/25/95/93/708259593.db2.gz	QOMCJTZXKNQCEC-CHWSQXEVSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000897249092	708268654	/nfs/dbraw/zinc/26/86/54/708268654.db2.gz	LRGXXUHCPBAKCF-UHFFFAOYSA-N	1	1	304.354	1.781	20	5		DDBDMO
C[N@@H+](CCO)CCNc1cccc(C(F)(F)F)c1[N+](=O)[O-]	ZINC000884826290	708388949	/nfs/dbraw/zinc/38/89/49/708388949.db2.gz	VOBJWKJMZNWBEU-UHFFFAOYSA-N	1	1	307.272	1.950	20	5		DDBDMO
C/C(=C/C(=O)N(C)CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])cc1	ZINC000912605268	713045296	/nfs/dbraw/zinc/04/52/96/713045296.db2.gz	LBKRBOFWQWUPJC-SEYXRHQNSA-N	1	1	321.377	1.381	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885980286	708675660	/nfs/dbraw/zinc/67/56/60/708675660.db2.gz	XXJRVNAKPZMFNO-ZDUSSCGKSA-N	1	1	320.393	1.974	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885980286	708675662	/nfs/dbraw/zinc/67/56/62/708675662.db2.gz	XXJRVNAKPZMFNO-ZDUSSCGKSA-N	1	1	320.393	1.974	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887924531	709165128	/nfs/dbraw/zinc/16/51/28/709165128.db2.gz	OSNCCZIYIKOEGD-XPKDYRNWSA-N	1	1	319.361	1.038	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[NH+](Cc3ccsc3)CC2)c1	ZINC000912861294	713109992	/nfs/dbraw/zinc/10/99/92/713109992.db2.gz	KOUVPGHPNIEWIO-UHFFFAOYSA-N	1	1	307.379	1.628	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@@H](C)C1	ZINC000910286378	709866790	/nfs/dbraw/zinc/86/67/90/709866790.db2.gz	AANMWWMHJDDIEK-JTQLQIEISA-N	1	1	309.370	1.193	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000928431803	713192880	/nfs/dbraw/zinc/19/28/80/713192880.db2.gz	HAPXCSUVRZWZBK-KCJUWKMLSA-N	1	1	311.313	1.565	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000928434472	713194510	/nfs/dbraw/zinc/19/45/10/713194510.db2.gz	DZEZKJQHPJYNKJ-WPRPVWTQSA-N	1	1	307.306	1.146	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C	ZINC000928438604	713195855	/nfs/dbraw/zinc/19/58/55/713195855.db2.gz	GIDSEGYKKFEHRN-SKDRFNHKSA-N	1	1	324.356	1.622	20	5		DDBDMO
COc1c(O)ccc(CN2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000895013940	711368568	/nfs/dbraw/zinc/36/85/68/711368568.db2.gz	ZNCWXWGNECFSLB-WCQYABFASA-N	1	1	321.377	1.835	20	5		DDBDMO
CC(C)NC(=O)c1ccc(NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895776592	711603971	/nfs/dbraw/zinc/60/39/71/711603971.db2.gz	KNLBFGQWGJWFEQ-LBPRGKRZSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000895776366	711604089	/nfs/dbraw/zinc/60/40/89/711604089.db2.gz	HUNLXVVCAHWUHM-GFCCVEGCSA-N	1	1	304.350	1.603	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000913933988	713321859	/nfs/dbraw/zinc/32/18/59/713321859.db2.gz	YCFXHZKTPVRYJD-NSHDSACASA-N	1	1	307.354	1.010	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CC[N@@H+](C)[C@H]1C	ZINC000914290939	713371504	/nfs/dbraw/zinc/37/15/04/713371504.db2.gz	FIQKQXVWVFYDJR-GWCFXTLKSA-N	1	1	322.365	1.495	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000929626563	713654158	/nfs/dbraw/zinc/65/41/58/713654158.db2.gz	ANRDCQWHCDNRBZ-LLVKDONJSA-N	1	1	322.283	1.654	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000929626563	713654161	/nfs/dbraw/zinc/65/41/61/713654161.db2.gz	ANRDCQWHCDNRBZ-LLVKDONJSA-N	1	1	322.283	1.654	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000930619596	713879126	/nfs/dbraw/zinc/87/91/26/713879126.db2.gz	WTVCTQLUOLWRDV-LLVKDONJSA-N	1	1	307.354	1.358	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000923315323	714309033	/nfs/dbraw/zinc/30/90/33/714309033.db2.gz	HJNJXAVMBZPZIC-QWHCGFSZSA-N	1	1	319.361	1.669	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCNCC[NH2+]CC1	ZINC000923461892	714363907	/nfs/dbraw/zinc/36/39/07/714363907.db2.gz	YGHCWOYKPURSBI-UHFFFAOYSA-N	1	1	322.409	1.377	20	5		DDBDMO
CCC1(CC)CNC(=O)[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1OC	ZINC000933281617	714553483	/nfs/dbraw/zinc/55/34/83/714553483.db2.gz	HUHKYWINLXBAIS-AWEZNQCLSA-N	1	1	321.377	1.998	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc4ncc([N+](=O)[O-])n4n3)[C@@H]2C1	ZINC001120921986	782236804	/nfs/dbraw/zinc/23/68/04/782236804.db2.gz	FZYWWZUJUTUFHW-HBNTYKKESA-N	1	1	302.338	1.390	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC001121198266	782405152	/nfs/dbraw/zinc/40/51/52/782405152.db2.gz	GKCMRVLRHFYRKH-MELADBBJSA-N	1	1	303.362	1.594	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3=CCCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775613	736853561	/nfs/dbraw/zinc/85/35/61/736853561.db2.gz	IPBHALIYZDYAOJ-QMIVOQANSA-N	1	1	305.378	1.198	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CC3=CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775613	736853564	/nfs/dbraw/zinc/85/35/64/736853564.db2.gz	IPBHALIYZDYAOJ-QMIVOQANSA-N	1	1	305.378	1.198	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3=CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775613	736853569	/nfs/dbraw/zinc/85/35/69/736853569.db2.gz	IPBHALIYZDYAOJ-QMIVOQANSA-N	1	1	305.378	1.198	20	5		DDBDMO
COc1nc(C)nc(NCC[NH+]2CCSCC2)c1[N+](=O)[O-]	ZINC001167832494	738953566	/nfs/dbraw/zinc/95/35/66/738953566.db2.gz	HIVSNWCFHBQEOL-UHFFFAOYSA-N	1	1	313.383	1.163	20	5		DDBDMO
N=C(NCCCC[NH3+])Nc1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC001167878801	739168741	/nfs/dbraw/zinc/16/87/41/739168741.db2.gz	POHAFSMLGIEPAC-UHFFFAOYSA-N	1	1	320.275	1.684	20	5		DDBDMO
C[C@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000697579785	742099267	/nfs/dbraw/zinc/09/92/67/742099267.db2.gz	NHDGRMSDNGPUQV-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC([NH2+]C2COC2)C1	ZINC001187724943	744597133	/nfs/dbraw/zinc/59/71/33/744597133.db2.gz	UZZSRQDVIVAEHP-UHFFFAOYSA-N	1	1	317.267	1.791	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001193897166	746231106	/nfs/dbraw/zinc/23/11/06/746231106.db2.gz	BKEPZGVATJVOPQ-QWRGUYRKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2C(=O)OC[C@@H]2C1	ZINC001196675128	746932804	/nfs/dbraw/zinc/93/28/04/746932804.db2.gz	LCSMLUJYNVFPIH-NRUUGDAUSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2C(=O)OC[C@@H]2C1	ZINC001196675128	746932806	/nfs/dbraw/zinc/93/28/06/746932806.db2.gz	LCSMLUJYNVFPIH-NRUUGDAUSA-N	1	1	319.317	1.027	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1CCCCCC1	ZINC001124631785	748375169	/nfs/dbraw/zinc/37/51/69/748375169.db2.gz	QJSGAFIUFPMOCG-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
Cc1cccnc1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000996429646	749587926	/nfs/dbraw/zinc/58/79/26/749587926.db2.gz	QSWFTKAXNLDXQN-UKRRQHHQSA-N	1	1	318.377	1.136	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169057454	762210733	/nfs/dbraw/zinc/21/07/33/762210733.db2.gz	VKUNMPJXBZNVAU-FRRDWIJNSA-N	1	1	322.365	1.384	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC001170329050	766253766	/nfs/dbraw/zinc/25/37/66/766253766.db2.gz	NPTGKPDHZGDQSQ-WCQYABFASA-N	1	1	321.377	1.732	20	5		DDBDMO
COc1ccc(C[C@@H](C)N2CC[N@H+]3CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC001170355646	766261852	/nfs/dbraw/zinc/26/18/52/766261852.db2.gz	NNVKFSAQQBSHDU-TZMCWYRMSA-N	1	1	305.378	1.924	20	5		DDBDMO
CCCc1nc(C)c(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001157767824	766566387	/nfs/dbraw/zinc/56/63/87/766566387.db2.gz	WCBKKWMKBBGUML-VXGBXAGGSA-N	1	1	324.381	1.197	20	5		DDBDMO
CCOC(=O)C1=C(Nc2nc([N+](=O)[O-])ccc2OC)CC[NH2+]C1	ZINC001170516268	767741379	/nfs/dbraw/zinc/74/13/79/767741379.db2.gz	SQTQLTAHKXBSBM-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC001096243376	768740807	/nfs/dbraw/zinc/74/08/07/768740807.db2.gz	UBCUXHSIZJGVRD-UHFFFAOYSA-N	1	1	324.356	1.382	20	5		DDBDMO
CCCC(C)(C)C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001133173334	769548402	/nfs/dbraw/zinc/54/84/02/769548402.db2.gz	XXJHBNYRDHKSPR-UHFFFAOYSA-N	1	1	311.386	1.360	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3=CCCCC3)C[C@@H]2C1	ZINC001048813113	769931554	/nfs/dbraw/zinc/93/15/54/769931554.db2.gz	AGCYXODMANZFKF-QKPAOTATSA-N	1	1	319.405	1.542	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CC3=CCCCC3)C[C@@H]2C1	ZINC001048813113	769931564	/nfs/dbraw/zinc/93/15/64/769931564.db2.gz	AGCYXODMANZFKF-QKPAOTATSA-N	1	1	319.405	1.542	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3=CCCCC3)C[C@@H]2C1	ZINC001048813113	769931573	/nfs/dbraw/zinc/93/15/73/769931573.db2.gz	AGCYXODMANZFKF-QKPAOTATSA-N	1	1	319.405	1.542	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1	ZINC001145018213	772756169	/nfs/dbraw/zinc/75/61/69/772756169.db2.gz	UQIRLYVQLGZYDQ-SSDOTTSWSA-N	1	1	301.734	1.043	20	5		DDBDMO
[NH3+]Cc1nccnc1Nc1ccc2nsnc2c1[N+](=O)[O-]	ZINC001171447611	775970941	/nfs/dbraw/zinc/97/09/41/775970941.db2.gz	JJWWUGFKPDUNTN-UHFFFAOYSA-N	1	1	303.307	1.592	20	5		DDBDMO
CCN(CCNC(=O)CC[N@@H+](C)CC)c1ccc([N+](=O)[O-])cn1	ZINC001100607414	776360044	/nfs/dbraw/zinc/36/00/44/776360044.db2.gz	ZGWSSOFJCKNDDO-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
COC(=O)N1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001173225959	777061375	/nfs/dbraw/zinc/06/13/75/777061375.db2.gz	KIXJOVHVAHCPIF-GFCCVEGCSA-N	1	1	307.350	1.910	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(c3cncn3C)CC2)c([N+](=O)[O-])n1	ZINC001176978879	778364886	/nfs/dbraw/zinc/36/48/86/778364886.db2.gz	XTMSHIMKAFCOGL-UHFFFAOYSA-N	1	1	304.354	1.441	20	5		DDBDMO
C[C@](O)(C[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307068	781400469	/nfs/dbraw/zinc/40/04/69/781400469.db2.gz	ZOSCEALOKGQACL-IRXDYDNUSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@](O)(C[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307068	781400476	/nfs/dbraw/zinc/40/04/76/781400476.db2.gz	ZOSCEALOKGQACL-IRXDYDNUSA-N	1	1	320.389	1.865	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(NCCn2cc[nH+]c2C)n1	ZINC001156008877	862628886	/nfs/dbraw/zinc/62/88/86/862628886.db2.gz	FBRSAAYCVQHMST-UHFFFAOYSA-N	1	1	319.325	1.269	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12	ZINC001124003005	859519191	/nfs/dbraw/zinc/51/91/91/859519191.db2.gz	LTZJFFNLQYMPOH-BYCMXARLSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])C1CCCCC1	ZINC001141406193	860843325	/nfs/dbraw/zinc/84/33/25/860843325.db2.gz	NYZTXIZZWKLUIS-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21	ZINC001325865953	860901576	/nfs/dbraw/zinc/90/15/76/860901576.db2.gz	ZKOXUTBAQBAZHI-XHDPSFHLSA-N	1	1	318.377	1.803	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)nc(NCC2([NH+]3CCCC3)COC2)c1	ZINC001157650280	864011663	/nfs/dbraw/zinc/01/16/63/864011663.db2.gz	NYJPEPKLOIGRAO-UHFFFAOYSA-N	1	1	312.757	1.920	20	5		DDBDMO
CC(C)c1cccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])n1	ZINC001157761039	864111564	/nfs/dbraw/zinc/11/15/64/864111564.db2.gz	KWHHEPIWIJRKBW-UKRRQHHQSA-N	1	1	320.393	1.466	20	5		DDBDMO
COCc1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157767298	864118296	/nfs/dbraw/zinc/11/82/96/864118296.db2.gz	KYGLKXPIVAAYML-HUUCEWRRSA-N	1	1	321.377	1.094	20	5		DDBDMO
COCC(=O)N(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC001332675919	866052696	/nfs/dbraw/zinc/05/26/96/866052696.db2.gz	GZIHYZNWFNPOAU-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1NCC[NH+]1CCC(F)(F)CC1	ZINC001160751894	866098381	/nfs/dbraw/zinc/09/83/81/866098381.db2.gz	DVONJMHNQMHRSD-UHFFFAOYSA-N	1	1	301.297	1.715	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2ccnc(Cl)c2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001323437305	866609943	/nfs/dbraw/zinc/60/99/43/866609943.db2.gz	GZTKOKLWWYNTBW-GHMZBOCLSA-N	1	1	324.768	1.139	20	5		DDBDMO
COc1ccc(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001322505772	868209218	/nfs/dbraw/zinc/20/92/18/868209218.db2.gz	QQTPMPOAYRHYIH-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@H]1C	ZINC001322508683	868211326	/nfs/dbraw/zinc/21/13/26/868211326.db2.gz	DSCBPRSDGRWPMN-MEBBXXQBSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[C@H]1C[C@@H](CO)N(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001164151867	868974521	/nfs/dbraw/zinc/97/45/21/868974521.db2.gz	DBOSYTQWDJNDET-JQBPPHQNSA-N	1	1	306.366	1.729	20	5		DDBDMO
COc1ccnc(NCC2(N(C)C)CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC001164206993	869013655	/nfs/dbraw/zinc/01/36/55/869013655.db2.gz	OYELXHSGAFMNOC-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
O=C(NCCNc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2)C(F)(F)F	ZINC001164246034	869054953	/nfs/dbraw/zinc/05/49/53/869054953.db2.gz	KHZYAVKIJIGOPJ-UHFFFAOYSA-N	1	1	318.255	1.288	20	5		DDBDMO
NC(=O)[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC001336722629	869108341	/nfs/dbraw/zinc/10/83/41/869108341.db2.gz	LDSOAJAYSIVSNB-GJZGRUSLSA-N	1	1	315.329	1.444	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3nc4ccccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC001338161461	869841408	/nfs/dbraw/zinc/84/14/08/869841408.db2.gz	CNOLYLVQGTYZJV-TUAOUCFPSA-N	1	1	301.350	1.995	20	5		DDBDMO
Cn1nccc1C(=O)NCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001317440444	870839814	/nfs/dbraw/zinc/83/98/14/870839814.db2.gz	DDERHWWRSQFCEU-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C1	ZINC001306055476	871318505	/nfs/dbraw/zinc/31/85/05/871318505.db2.gz	FWCCERMIFNZKCF-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccnn1	ZINC001307718359	871449977	/nfs/dbraw/zinc/44/99/77/871449977.db2.gz	ZNEAISKXCXXBJK-UHFFFAOYSA-N	1	1	315.333	1.498	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cccnn1	ZINC001307718359	871449995	/nfs/dbraw/zinc/44/99/95/871449995.db2.gz	ZNEAISKXCXXBJK-UHFFFAOYSA-N	1	1	315.333	1.498	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1O	ZINC001307740899	871451634	/nfs/dbraw/zinc/45/16/34/871451634.db2.gz	JUMIOICVQZMKOO-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1O	ZINC001307740899	871451641	/nfs/dbraw/zinc/45/16/41/871451641.db2.gz	JUMIOICVQZMKOO-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](c3ncccn3)C2)cc1	ZINC001308111074	871472039	/nfs/dbraw/zinc/47/20/39/871472039.db2.gz	BMDWUSCEEIVSQE-ZFWWWQNUSA-N	1	1	314.345	1.908	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@H](CO)[C@@H](CCO)C2)cc1[N+](=O)[O-]	ZINC001308164983	871475036	/nfs/dbraw/zinc/47/50/36/871475036.db2.gz	WWGLQOVHGPDMKT-QWHCGFSZSA-N	1	1	310.350	1.026	20	5		DDBDMO
COc1cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)ncc1[N+](=O)[O-]	ZINC001226581121	882522241	/nfs/dbraw/zinc/52/22/41/882522241.db2.gz	LJSPLOPFWUNYTB-IYYTYJHQSA-N	1	1	307.306	1.181	20	5		DDBDMO
COc1cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)ncc1[N+](=O)[O-]	ZINC001226581121	882522249	/nfs/dbraw/zinc/52/22/49/882522249.db2.gz	LJSPLOPFWUNYTB-IYYTYJHQSA-N	1	1	307.306	1.181	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC001342865378	872418534	/nfs/dbraw/zinc/41/85/34/872418534.db2.gz	ZYRPYLHEFVJZQU-OKILXGFUSA-N	1	1	318.377	1.340	20	5		DDBDMO
COC(=O)[C@@H](O[C@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC001223644522	881039130	/nfs/dbraw/zinc/03/91/30/881039130.db2.gz	VHJWCLKWPXEDKR-FZMZJTMJSA-N	1	1	308.334	1.920	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)Oc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC001227744698	883155751	/nfs/dbraw/zinc/15/57/51/883155751.db2.gz	HWPUGRNQLAFQDM-SNVBAGLBSA-N	1	1	306.322	1.571	20	5		DDBDMO
OC[C@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@@H]1O	ZINC001232218319	886166617	/nfs/dbraw/zinc/16/66/17/886166617.db2.gz	FUPHJKIPJQJFDN-WBVHZDCISA-N	1	1	323.396	1.958	20	5		DDBDMO
C[N@H+]1CC[C@@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1	ZINC001234363077	887907144	/nfs/dbraw/zinc/90/71/44/887907144.db2.gz	XGEBWMVCIITNMU-CYBMUJFWSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CCNC3(CC[NH2+]CC3)C1)C2	ZINC001246608209	892734692	/nfs/dbraw/zinc/73/46/92/892734692.db2.gz	YAIPCBBJVBSRGW-INIZCTEOSA-N	1	1	316.405	1.089	20	5		DDBDMO
CC[N@@H+](CCC(N)=O)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478593	896456287	/nfs/dbraw/zinc/45/62/87/896456287.db2.gz	HHEQQMKLDVMYSC-UHFFFAOYSA-N	1	1	320.393	1.761	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(CO)[C@H](O)C1	ZINC001254553297	896498785	/nfs/dbraw/zinc/49/87/85/896498785.db2.gz	UQIKMOKMRJMVPR-WQVCFCJDSA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC([N@@H+](C)[C@H]2CCOC2)C1	ZINC001254560873	896502547	/nfs/dbraw/zinc/50/25/47/896502547.db2.gz	YRCBPKGSOPROFU-ZFWWWQNUSA-N	1	1	319.405	1.931	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254604016	896527760	/nfs/dbraw/zinc/52/77/60/896527760.db2.gz	SHIZFXYRKMPSHF-HUUCEWRRSA-N	1	1	301.346	1.369	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254604016	896527767	/nfs/dbraw/zinc/52/77/67/896527767.db2.gz	SHIZFXYRKMPSHF-HUUCEWRRSA-N	1	1	301.346	1.369	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC(C)C)C[C@H]1C	ZINC001263415596	900605057	/nfs/dbraw/zinc/60/50/57/900605057.db2.gz	HFMFGEIQCCKOEG-OLZOCXBDSA-N	1	1	324.429	1.802	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CC=C(Cl)Cl)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001265538995	902112398	/nfs/dbraw/zinc/11/23/98/902112398.db2.gz	TXXVVFXQZVIKSO-BZNPZCIMSA-N	1	1	308.165	1.207	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000449696756	230634132	/nfs/dbraw/zinc/63/41/32/230634132.db2.gz	LDYWPVXYQBURSA-MQDFFIGUSA-N	1	1	306.362	1.939	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)c1cccc([N+](=O)[O-])c1	ZINC000452343743	231352626	/nfs/dbraw/zinc/35/26/26/231352626.db2.gz	BPJNGAHNVUZXLA-AWEZNQCLSA-N	1	1	307.350	1.171	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1	ZINC000254999222	282223811	/nfs/dbraw/zinc/22/38/11/282223811.db2.gz	MIUWXOPADNWVIN-WAYWQWQTSA-N	1	1	319.361	1.399	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000614923431	362079468	/nfs/dbraw/zinc/07/94/68/362079468.db2.gz	LKTDBKAZOAFGMS-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000430971485	529993011	/nfs/dbraw/zinc/99/30/11/529993011.db2.gz	NNOWZNOXHUSDNJ-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)n1	ZINC000286752863	219146858	/nfs/dbraw/zinc/14/68/58/219146858.db2.gz	YVELIWOYXVZFRK-NXEZZACHSA-N	1	1	322.287	1.284	20	5		DDBDMO
NC(=O)[C@@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[NH2+]1	ZINC000341416836	282462077	/nfs/dbraw/zinc/46/20/77/282462077.db2.gz	IZFBNNMUIDIYRB-QMMMGPOBSA-N	1	1	319.148	1.165	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F	ZINC000279764197	215127369	/nfs/dbraw/zinc/12/73/69/215127369.db2.gz	RTQWDPGADYSEJR-LBPRGKRZSA-N	1	1	311.357	1.886	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1F	ZINC000279764197	215127372	/nfs/dbraw/zinc/12/73/72/215127372.db2.gz	RTQWDPGADYSEJR-LBPRGKRZSA-N	1	1	311.357	1.886	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cnccn3)CC2)nc1	ZINC000601253065	358464300	/nfs/dbraw/zinc/46/43/00/358464300.db2.gz	CSUCRHRJQCPJKK-UHFFFAOYSA-N	1	1	314.349	1.145	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000041886319	352317336	/nfs/dbraw/zinc/31/73/36/352317336.db2.gz	WXVBURMFQPYVBI-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000041966712	352321093	/nfs/dbraw/zinc/32/10/93/352321093.db2.gz	VKUFOQPMWPOYIH-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000057553944	352820307	/nfs/dbraw/zinc/82/03/07/352820307.db2.gz	JEIVVEOGSREHEI-NSHDSACASA-N	1	1	305.334	1.327	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000058274586	352841517	/nfs/dbraw/zinc/84/15/17/352841517.db2.gz	QQHNDUUYQQFNFF-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C	ZINC000067830440	353069640	/nfs/dbraw/zinc/06/96/40/353069640.db2.gz	YUHOHHCHOJRLKI-NWDGAFQWSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCCn1cc[nH+]c1C	ZINC000069001955	353140414	/nfs/dbraw/zinc/14/04/14/353140414.db2.gz	YIXIPXKVLOFIBZ-UHFFFAOYSA-N	1	1	320.353	1.201	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000173711153	198243030	/nfs/dbraw/zinc/24/30/30/198243030.db2.gz	ASJDOCCJCMMNCH-ZDUSSCGKSA-N	1	1	320.393	1.489	20	5		DDBDMO
O=C1CCCN1CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665037	353207880	/nfs/dbraw/zinc/20/78/80/353207880.db2.gz	XWOLIFAPHRBQEC-LBPRGKRZSA-N	1	1	319.365	1.098	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074321176	353306643	/nfs/dbraw/zinc/30/66/43/353306643.db2.gz	IBNWUIPUGGONBL-LBPRGKRZSA-N	1	1	321.381	1.430	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H](C[N@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074321176	353306645	/nfs/dbraw/zinc/30/66/45/353306645.db2.gz	IBNWUIPUGGONBL-LBPRGKRZSA-N	1	1	321.381	1.430	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074321176	353306647	/nfs/dbraw/zinc/30/66/47/353306647.db2.gz	IBNWUIPUGGONBL-LBPRGKRZSA-N	1	1	321.381	1.430	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)ncc1[N+](=O)[O-]	ZINC000074746518	353328337	/nfs/dbraw/zinc/32/83/37/353328337.db2.gz	JNNIOAJXXZYKNQ-LBPRGKRZSA-N	1	1	321.381	1.298	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCCC1	ZINC000075645595	353373778	/nfs/dbraw/zinc/37/37/78/353373778.db2.gz	CUYUASODADZSNY-CQSZACIVSA-N	1	1	312.370	1.043	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](CO)C1	ZINC000174706308	198372766	/nfs/dbraw/zinc/37/27/66/198372766.db2.gz	ILBHNDWVLRYTQX-LLVKDONJSA-N	1	1	323.349	1.246	20	5		DDBDMO
Cc1cnc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c([N+](=O)[O-])c1	ZINC000078664103	353527549	/nfs/dbraw/zinc/52/75/49/353527549.db2.gz	IWLFBPLTDKCJQD-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
COC(=O)C[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090524749	353794666	/nfs/dbraw/zinc/79/46/66/353794666.db2.gz	CNGDYGUXHPAYFH-LBPRGKRZSA-N	1	1	323.349	1.174	20	5		DDBDMO
COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000093279005	353891402	/nfs/dbraw/zinc/89/14/02/353891402.db2.gz	XJZINQNZSHETMX-LBPRGKRZSA-N	1	1	324.381	1.703	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000108325936	353950783	/nfs/dbraw/zinc/95/07/83/353950783.db2.gz	XYWNVYNCQAKTJV-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H](O)[C@@H](O)C2)o1	ZINC000093483656	353901511	/nfs/dbraw/zinc/90/15/11/353901511.db2.gz	ZMZQFPLYUMHOJL-OKILXGFUSA-N	1	1	304.302	1.392	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000139421137	354127973	/nfs/dbraw/zinc/12/79/73/354127973.db2.gz	HNJWQCGMBKLLCG-GFCCVEGCSA-N	1	1	321.381	1.400	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000154690685	354207717	/nfs/dbraw/zinc/20/77/17/354207717.db2.gz	JUYJFLYYQLDMHT-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000154690685	354207722	/nfs/dbraw/zinc/20/77/22/354207722.db2.gz	JUYJFLYYQLDMHT-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[C@@H](O)C[C@@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157104937	354223743	/nfs/dbraw/zinc/22/37/43/354223743.db2.gz	SINQPIQYFFDDFG-UKRRQHHQSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H](O)C[C@@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157104937	354223747	/nfs/dbraw/zinc/22/37/47/354223747.db2.gz	SINQPIQYFFDDFG-UKRRQHHQSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157313186	354224316	/nfs/dbraw/zinc/22/43/16/354224316.db2.gz	OOLNTIGGWVKKCX-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157313186	354224320	/nfs/dbraw/zinc/22/43/20/354224320.db2.gz	OOLNTIGGWVKKCX-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[C@H]1C[C@H]([NH3+])CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237617094	354344650	/nfs/dbraw/zinc/34/46/50/354344650.db2.gz	ZSGAGBBGMRRYHH-DTWKUNHWSA-N	1	1	303.322	1.423	20	5		DDBDMO
NC(=O)c1ccnc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-]	ZINC000357238759	291027744	/nfs/dbraw/zinc/02/77/44/291027744.db2.gz	MXCAZRGIYDRPCJ-VIFPVBQESA-N	1	1	316.321	1.196	20	5		DDBDMO
COc1cc(C[N@H+](C)CCO)c([N+](=O)[O-])cc1OC(F)F	ZINC000073368109	191309671	/nfs/dbraw/zinc/30/96/71/191309671.db2.gz	KKXQYGVWILVFKH-UHFFFAOYSA-N	1	1	306.265	1.629	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCO)c([N+](=O)[O-])cc1OC(F)F	ZINC000073368109	191309674	/nfs/dbraw/zinc/30/96/74/191309674.db2.gz	KKXQYGVWILVFKH-UHFFFAOYSA-N	1	1	306.265	1.629	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000589184434	354969643	/nfs/dbraw/zinc/96/96/43/354969643.db2.gz	LBKLXNFVXGYSQE-TXEJJXNPSA-N	1	1	308.334	1.975	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000589184434	354969645	/nfs/dbraw/zinc/96/96/45/354969645.db2.gz	LBKLXNFVXGYSQE-TXEJJXNPSA-N	1	1	308.334	1.975	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@H](C)C(=O)OC)c1	ZINC000589495881	354995780	/nfs/dbraw/zinc/99/57/80/354995780.db2.gz	HOZWFASHPQYTGR-JTQLQIEISA-N	1	1	324.333	1.622	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(C(N)=O)CC2)c1	ZINC000589494766	354995839	/nfs/dbraw/zinc/99/58/39/354995839.db2.gz	ZUEVDYNVPHUDKG-UHFFFAOYSA-N	1	1	321.333	1.079	20	5		DDBDMO
Cn1c(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)ccc1[N+](=O)[O-]	ZINC000590347933	355074848	/nfs/dbraw/zinc/07/48/48/355074848.db2.gz	NJHWEFRAYYFWEN-UHFFFAOYSA-N	1	1	320.393	1.881	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000590585762	355121005	/nfs/dbraw/zinc/12/10/05/355121005.db2.gz	RXNINGNNXHIFDR-MNOVXSKESA-N	1	1	320.349	1.449	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)[C@H]2C1	ZINC000590446392	355099825	/nfs/dbraw/zinc/09/98/25/355099825.db2.gz	TVSMNOSSPTXYPE-RNCFNFMXSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)[C@H]2C1	ZINC000590446392	355099826	/nfs/dbraw/zinc/09/98/26/355099826.db2.gz	TVSMNOSSPTXYPE-RNCFNFMXSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)[C@H]2C1	ZINC000590446392	355099828	/nfs/dbraw/zinc/09/98/28/355099828.db2.gz	TVSMNOSSPTXYPE-RNCFNFMXSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[NH2+]CC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000592428348	355580633	/nfs/dbraw/zinc/58/06/33/355580633.db2.gz	AQJHTDPNGKXAFT-UHFFFAOYSA-N	1	1	321.377	1.797	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)CCO	ZINC000593108166	355800850	/nfs/dbraw/zinc/80/08/50/355800850.db2.gz	UNHPRRAIAGDRHK-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000593340085	355858407	/nfs/dbraw/zinc/85/84/07/355858407.db2.gz	TXGPNPXRCWREFL-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000593340085	355858413	/nfs/dbraw/zinc/85/84/13/355858413.db2.gz	TXGPNPXRCWREFL-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000593555493	355923968	/nfs/dbraw/zinc/92/39/68/355923968.db2.gz	BKCJPFOQCNGHNB-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1	ZINC000594065075	356103326	/nfs/dbraw/zinc/10/33/26/356103326.db2.gz	OABGGTCGZFOGPL-SNVBAGLBSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1	ZINC000594065075	356103328	/nfs/dbraw/zinc/10/33/28/356103328.db2.gz	OABGGTCGZFOGPL-SNVBAGLBSA-N	1	1	318.333	1.990	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594200390	356138571	/nfs/dbraw/zinc/13/85/71/356138571.db2.gz	LRQWSSHZPJDCFR-STQMWFEESA-N	1	1	306.366	1.680	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@H](CN3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000595326043	356450417	/nfs/dbraw/zinc/45/04/17/356450417.db2.gz	ILYSOYQCKQPKEW-GFCCVEGCSA-N	1	1	310.354	1.045	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@H](CN3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000595326043	356450421	/nfs/dbraw/zinc/45/04/21/356450421.db2.gz	ILYSOYQCKQPKEW-GFCCVEGCSA-N	1	1	310.354	1.045	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595298323	356439010	/nfs/dbraw/zinc/43/90/10/356439010.db2.gz	QKAAAHFGRLSSTN-LLVKDONJSA-N	1	1	310.354	1.629	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595298323	356439012	/nfs/dbraw/zinc/43/90/12/356439012.db2.gz	QKAAAHFGRLSSTN-LLVKDONJSA-N	1	1	310.354	1.629	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H](C[NH2+]C)C2)c1[N+](=O)[O-]	ZINC000236884130	202051877	/nfs/dbraw/zinc/05/18/77/202051877.db2.gz	CLBORPWYKUAMPG-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2	ZINC000595690094	356611153	/nfs/dbraw/zinc/61/11/53/356611153.db2.gz	UIOHBXODLGLESR-GASCZTMLSA-N	1	1	307.350	1.115	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@](CO)(OC)C1	ZINC000595659797	356595770	/nfs/dbraw/zinc/59/57/70/356595770.db2.gz	PIMZPZPNAAGXCP-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@](CO)(OC)C1	ZINC000595659797	356595775	/nfs/dbraw/zinc/59/57/75/356595775.db2.gz	PIMZPZPNAAGXCP-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595737067	356629212	/nfs/dbraw/zinc/62/92/12/356629212.db2.gz	GOECIWRFBOWWRU-QWHCGFSZSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@]3(O)C[C@H]3C2)c2c(c1)COCO2	ZINC000595770518	356645940	/nfs/dbraw/zinc/64/59/40/356645940.db2.gz	WYRRKWALCCQFJX-SWLSCSKDSA-N	1	1	306.318	1.418	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(O)C[C@H]3C2)c2c(c1)COCO2	ZINC000595770518	356645941	/nfs/dbraw/zinc/64/59/41/356645941.db2.gz	WYRRKWALCCQFJX-SWLSCSKDSA-N	1	1	306.318	1.418	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000595850346	356677251	/nfs/dbraw/zinc/67/72/51/356677251.db2.gz	YIFALSXDDGGYIU-TXEJJXNPSA-N	1	1	308.334	1.857	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NCc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595873596	356687158	/nfs/dbraw/zinc/68/71/58/356687158.db2.gz	NCNMTUMRAVPKLS-UHFFFAOYSA-N	1	1	322.409	1.904	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c1	ZINC000595860919	356681181	/nfs/dbraw/zinc/68/11/81/356681181.db2.gz	NBEQAVFLSDIWMR-MEDUHNTESA-N	1	1	322.361	1.832	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1	ZINC000595867505	356684542	/nfs/dbraw/zinc/68/45/42/356684542.db2.gz	NOESAXJUQZPLHU-INIZCTEOSA-N	1	1	305.378	1.626	20	5		DDBDMO
Nc1ccc(N2CC[NH+](Cc3cccs3)CC2)nc1[N+](=O)[O-]	ZINC000596058844	356756165	/nfs/dbraw/zinc/75/61/65/356756165.db2.gz	JYRYWIWTJGXTQO-UHFFFAOYSA-N	1	1	319.390	1.956	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@H](C)CO1	ZINC000596432283	356878756	/nfs/dbraw/zinc/87/87/56/356878756.db2.gz	RTUXGABZVDQRSF-GHMZBOCLSA-N	1	1	324.381	1.190	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@H](C)CO1	ZINC000596432283	356878757	/nfs/dbraw/zinc/87/87/57/356878757.db2.gz	RTUXGABZVDQRSF-GHMZBOCLSA-N	1	1	324.381	1.190	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000596309370	356853588	/nfs/dbraw/zinc/85/35/88/356853588.db2.gz	ZWZQPMFAGLRANO-SNVBAGLBSA-N	1	1	321.381	1.621	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596537467	356910269	/nfs/dbraw/zinc/91/02/69/356910269.db2.gz	GRLYCYZYOPBORJ-ZDUSSCGKSA-N	1	1	309.341	1.769	20	5		DDBDMO
Nc1c(F)c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000596538494	356911407	/nfs/dbraw/zinc/91/14/07/356911407.db2.gz	LFRPZLWVTAJDFK-NSHDSACASA-N	1	1	324.356	1.352	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](C(=O)OC)C2)ccc1[N+](=O)[O-]	ZINC000276854794	213134556	/nfs/dbraw/zinc/13/45/56/213134556.db2.gz	FIEIYECCZRHPFC-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCN(C(=O)c1cccc([N+](=O)[O-])c1OC)[C@H]1CC[N@@H+](C)C1	ZINC000597943936	357392384	/nfs/dbraw/zinc/39/23/84/357392384.db2.gz	BCAISPCHHSAIES-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC3(CCOCC3)CC[C@H]2CO)n1	ZINC000599542839	357967770	/nfs/dbraw/zinc/96/77/70/357967770.db2.gz	FBAUDQZHJPWQSV-ZDUSSCGKSA-N	1	1	324.381	1.045	20	5		DDBDMO
O=C(NC1CC([NH+]2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000600068747	358114130	/nfs/dbraw/zinc/11/41/30/358114130.db2.gz	KSWZULSOZQOERT-UHFFFAOYSA-N	1	1	305.334	1.188	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000600316295	358195039	/nfs/dbraw/zinc/19/50/39/358195039.db2.gz	ZDPDXERXOUDAHD-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180545286	199174147	/nfs/dbraw/zinc/17/41/47/199174147.db2.gz	WQRUBPNGLYTCSS-GHMZBOCLSA-N	1	1	321.381	1.422	20	5		DDBDMO
CN1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCC1=O	ZINC000601195491	358442636	/nfs/dbraw/zinc/44/26/36/358442636.db2.gz	QBXLXNASFRSIMQ-UHFFFAOYSA-N	1	1	300.318	1.812	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000601174669	358433641	/nfs/dbraw/zinc/43/36/41/358433641.db2.gz	ZGEGZZBJDZIFOR-UHFFFAOYSA-N	1	1	324.356	1.820	20	5		DDBDMO
COC[C@H]1C[C@@H](O)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601184581	358438548	/nfs/dbraw/zinc/43/85/48/358438548.db2.gz	MJUXHRBBHPCKPJ-VXGBXAGGSA-N	1	1	303.318	1.729	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601975492	358762166	/nfs/dbraw/zinc/76/21/66/358762166.db2.gz	WBJSKTQIJPFUBM-SDDRHHMPSA-N	1	1	305.334	1.500	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](n2ccnn2)C1	ZINC000602848523	359235691	/nfs/dbraw/zinc/23/56/91/359235691.db2.gz	VXRNMFDHIXDHOK-LBPRGKRZSA-N	1	1	305.342	1.028	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000618467677	363642691	/nfs/dbraw/zinc/64/26/91/363642691.db2.gz	PFKXCJSWCJEBBJ-WCQYABFASA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000618467677	363642696	/nfs/dbraw/zinc/64/26/96/363642696.db2.gz	PFKXCJSWCJEBBJ-WCQYABFASA-N	1	1	307.350	1.352	20	5		DDBDMO
C[N@@H+](Cc1ccns1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000602879627	359262810	/nfs/dbraw/zinc/26/28/10/359262810.db2.gz	IVIQWDXGYSRGKC-GFCCVEGCSA-N	1	1	323.374	1.923	20	5		DDBDMO
C[N@H+](Cc1ccns1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000602879627	359262816	/nfs/dbraw/zinc/26/28/16/359262816.db2.gz	IVIQWDXGYSRGKC-GFCCVEGCSA-N	1	1	323.374	1.923	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C	ZINC000603396397	359613717	/nfs/dbraw/zinc/61/37/17/359613717.db2.gz	ICBVGDJBWUUVAI-WDEREUQCSA-N	1	1	309.370	1.240	20	5		DDBDMO
COc1cc(OCC(=O)N[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000604460832	359752935	/nfs/dbraw/zinc/75/29/35/359752935.db2.gz	BJGBKDWZTXLCMQ-LLVKDONJSA-N	1	1	323.349	1.193	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000604278246	359731996	/nfs/dbraw/zinc/73/19/96/359731996.db2.gz	XTTSHDRRJFMUCQ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@H]1CCC[N@H+](C)C1	ZINC000604278246	359731998	/nfs/dbraw/zinc/73/19/98/359731998.db2.gz	XTTSHDRRJFMUCQ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609399946	360304047	/nfs/dbraw/zinc/30/40/47/360304047.db2.gz	WQHFQAPPSRXFHA-AWEZNQCLSA-N	1	1	318.377	1.878	20	5		DDBDMO
Cc1nn(C)c(NCCCN2CCC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000609630890	360338558	/nfs/dbraw/zinc/33/85/58/360338558.db2.gz	CWJJKJHVFUXOJF-UHFFFAOYSA-N	1	1	310.402	1.076	20	5		DDBDMO
Cc1nn(C)c(NCCC[N@@H+]2CCCN(C)CC2)c1[N+](=O)[O-]	ZINC000609630890	360338559	/nfs/dbraw/zinc/33/85/59/360338559.db2.gz	CWJJKJHVFUXOJF-UHFFFAOYSA-N	1	1	310.402	1.076	20	5		DDBDMO
Cc1nn(C)c(NCCC[N@H+]2CCCN(C)CC2)c1[N+](=O)[O-]	ZINC000609630890	360338561	/nfs/dbraw/zinc/33/85/61/360338561.db2.gz	CWJJKJHVFUXOJF-UHFFFAOYSA-N	1	1	310.402	1.076	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000610240093	360395260	/nfs/dbraw/zinc/39/52/60/360395260.db2.gz	VJKUAIPGGHSDKO-AWEZNQCLSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@@H]1COCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610990904	360592176	/nfs/dbraw/zinc/59/21/76/360592176.db2.gz	UFQGIZKERFOUGH-TZMCWYRMSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000611084575	360617551	/nfs/dbraw/zinc/61/75/51/360617551.db2.gz	FMRQNGCXOFELML-LLVKDONJSA-N	1	1	306.366	1.485	20	5		DDBDMO
COC1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611253205	360679619	/nfs/dbraw/zinc/67/96/19/360679619.db2.gz	SOQKFPAUCIFQNN-UHFFFAOYSA-N	1	1	308.334	1.977	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NCC[NH+]2CCCC2)cc1[N+](=O)[O-]	ZINC000193655567	201095919	/nfs/dbraw/zinc/09/59/19/201095919.db2.gz	WWYLRCGVGUCAMK-UHFFFAOYSA-N	1	1	313.379	1.277	20	5		DDBDMO
CC1(C)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O	ZINC000619221242	363937631	/nfs/dbraw/zinc/93/76/31/363937631.db2.gz	BKKPHJKRJNWJTA-AWEZNQCLSA-N	1	1	308.334	1.569	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O	ZINC000619221242	363937636	/nfs/dbraw/zinc/93/76/36/363937636.db2.gz	BKKPHJKRJNWJTA-AWEZNQCLSA-N	1	1	308.334	1.569	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252702	363945961	/nfs/dbraw/zinc/94/59/61/363945961.db2.gz	NOMUVPMXMVGGIY-GXTWGEPZSA-N	1	1	307.325	1.853	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619574254	364067592	/nfs/dbraw/zinc/06/75/92/364067592.db2.gz	LKWHLJZCHSUKJP-QWRGUYRKSA-N	1	1	313.354	1.915	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1C[N@H+]2CCN1CCC2	ZINC000619874129	364170499	/nfs/dbraw/zinc/17/04/99/364170499.db2.gz	ZJEBTIXRMGTBLS-AWEZNQCLSA-N	1	1	318.377	1.023	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000359223198	299363228	/nfs/dbraw/zinc/36/32/28/299363228.db2.gz	HRHVIYOEYKUGJY-LBPRGKRZSA-N	1	1	304.350	1.631	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]([NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000264677130	204072108	/nfs/dbraw/zinc/07/21/08/204072108.db2.gz	NWEIAFMODPHHJM-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
Cc1n[nH]c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266081593	205082684	/nfs/dbraw/zinc/08/26/84/205082684.db2.gz	DOFNDYPQOKPLRG-LLVKDONJSA-N	1	1	309.370	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000266081593	205082686	/nfs/dbraw/zinc/08/26/86/205082686.db2.gz	DOFNDYPQOKPLRG-LLVKDONJSA-N	1	1	309.370	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266081593	205082687	/nfs/dbraw/zinc/08/26/87/205082687.db2.gz	DOFNDYPQOKPLRG-LLVKDONJSA-N	1	1	309.370	1.573	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000282825243	217275821	/nfs/dbraw/zinc/27/58/21/217275821.db2.gz	YWTZTHYUIRYVLR-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccccc2[N+](=O)[O-])[N@@H+](C)C1	ZINC000284594778	218093811	/nfs/dbraw/zinc/09/38/11/218093811.db2.gz	JEIPQAZFDABESJ-RYUDHWBXSA-N	1	1	307.350	1.386	20	5		DDBDMO
CCn1nccc1CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000338569690	250035059	/nfs/dbraw/zinc/03/50/59/250035059.db2.gz	LIWJWHLDPSMIQC-UHFFFAOYSA-N	1	1	301.350	1.807	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000106393826	194205961	/nfs/dbraw/zinc/20/59/61/194205961.db2.gz	CFDKGQSRSXCDMX-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
COc1cc(N2CC[C@@H]3OCC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000285209721	218334514	/nfs/dbraw/zinc/33/45/14/218334514.db2.gz	WYZSXQOYXVBSFE-KBPBESRZSA-N	1	1	307.350	1.513	20	5		DDBDMO
Cc1cccc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000285350942	218392874	/nfs/dbraw/zinc/39/28/74/218392874.db2.gz	ULYQQCFHADZPFB-KGLIPLIRSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1	ZINC000061468573	184171349	/nfs/dbraw/zinc/17/13/49/184171349.db2.gz	FDNNJDYJENIEAY-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CO[C@@H]1C[C@H]([N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C12CCC2	ZINC000451836357	532953437	/nfs/dbraw/zinc/95/34/37/532953437.db2.gz	BMXPNAAKLHINKJ-MELADBBJSA-N	1	1	324.381	1.042	20	5		DDBDMO
O=C(NCC1CC1)[C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157698412	197208921	/nfs/dbraw/zinc/20/89/21/197208921.db2.gz	HXBJSHOREQNDHV-CYBMUJFWSA-N	1	1	321.381	1.030	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NC[C@H]2C[NH2+]CCCO2)n1	ZINC000423493212	285168537	/nfs/dbraw/zinc/16/85/37/285168537.db2.gz	PPHYMRREQARMEF-HZSPNIEDSA-N	1	1	323.397	1.243	20	5		DDBDMO
CC[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](C)C1	ZINC000352689902	285230536	/nfs/dbraw/zinc/23/05/36/285230536.db2.gz	DKHYIGCHSAULNM-LLVKDONJSA-N	1	1	303.366	1.997	20	5		DDBDMO
O=c1nc([C@@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)[nH][nH]1	ZINC000289571824	221076741	/nfs/dbraw/zinc/07/67/41/221076741.db2.gz	YMHWMZQSQUHUHU-GFCCVEGCSA-N	1	1	317.349	1.428	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000290036971	221394539	/nfs/dbraw/zinc/39/45/39/221394539.db2.gz	IQGCWSHHARHIIA-UHFFFAOYSA-N	1	1	316.321	1.672	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950684	533662420	/nfs/dbraw/zinc/66/24/20/533662420.db2.gz	HZBXNAMLXDEURZ-GXSJLCMTSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950684	533662427	/nfs/dbraw/zinc/66/24/27/533662427.db2.gz	HZBXNAMLXDEURZ-GXSJLCMTSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950684	533662433	/nfs/dbraw/zinc/66/24/33/533662433.db2.gz	HZBXNAMLXDEURZ-GXSJLCMTSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331950684	533662435	/nfs/dbraw/zinc/66/24/35/533662435.db2.gz	HZBXNAMLXDEURZ-GXSJLCMTSA-N	1	1	307.354	1.325	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338379989	297123773	/nfs/dbraw/zinc/12/37/73/297123773.db2.gz	QUMJPYBBQCMTDQ-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC[NH+]1CCOCC1	ZINC000114374051	407567551	/nfs/dbraw/zinc/56/75/51/407567551.db2.gz	PYHMIDVSMXQSII-NSHDSACASA-N	1	1	322.365	1.139	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1	ZINC000070077002	406808404	/nfs/dbraw/zinc/80/84/04/406808404.db2.gz	VQFUDNYLCHZVGK-PHIMTYICSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cc1nn(C)c(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000072015988	406871362	/nfs/dbraw/zinc/87/13/62/406871362.db2.gz	JZJMTHJYKCSJQU-ZDUSSCGKSA-N	1	1	324.429	1.321	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000073991422	406898655	/nfs/dbraw/zinc/89/86/55/406898655.db2.gz	WHVJUKOBDKNFMQ-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000073991422	406898658	/nfs/dbraw/zinc/89/86/58/406898658.db2.gz	WHVJUKOBDKNFMQ-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000073991422	406898661	/nfs/dbraw/zinc/89/86/61/406898661.db2.gz	WHVJUKOBDKNFMQ-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
C[N@H+](C[C@H]1CCCO1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000067379401	407272035	/nfs/dbraw/zinc/27/20/35/407272035.db2.gz	UIOMHPVRAMROAO-HUUCEWRRSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[N@@H+](C[C@H]1CCCO1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000067379401	407272037	/nfs/dbraw/zinc/27/20/37/407272037.db2.gz	UIOMHPVRAMROAO-HUUCEWRRSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000123856866	407340919	/nfs/dbraw/zinc/34/09/19/407340919.db2.gz	GNRNVFNFHCPTHX-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000123856866	407340920	/nfs/dbraw/zinc/34/09/20/407340920.db2.gz	GNRNVFNFHCPTHX-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000170793231	407509248	/nfs/dbraw/zinc/50/92/48/407509248.db2.gz	HETSLZJVLYWTBI-UHFFFAOYSA-N	1	1	319.321	1.213	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000170793231	407509252	/nfs/dbraw/zinc/50/92/52/407509252.db2.gz	HETSLZJVLYWTBI-UHFFFAOYSA-N	1	1	319.321	1.213	20	5		DDBDMO
CC(C)(C)S(=O)(=O)CC[NH2+]Cc1ccccc1[N+](=O)[O-]	ZINC000113344695	407496654	/nfs/dbraw/zinc/49/66/54/407496654.db2.gz	FMMMOSDCKABWAA-UHFFFAOYSA-N	1	1	300.380	1.898	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C	ZINC000186487659	407679426	/nfs/dbraw/zinc/67/94/26/407679426.db2.gz	AEUAVUKWMKYAIH-QMTHXVAHSA-N	1	1	317.349	1.739	20	5		DDBDMO
CC[N@@H+](CC(=O)NCCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC000178981588	407680471	/nfs/dbraw/zinc/68/04/71/407680471.db2.gz	RCVDSVCPXVCGLD-UHFFFAOYSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000187129148	407820651	/nfs/dbraw/zinc/82/06/51/407820651.db2.gz	WMZXDRJGAZQYTH-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000187129148	407820655	/nfs/dbraw/zinc/82/06/55/407820655.db2.gz	WMZXDRJGAZQYTH-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@]3(CCOC3)C2)c1	ZINC000153605228	407862265	/nfs/dbraw/zinc/86/22/65/407862265.db2.gz	AWLGLJXJMURAHC-ZBFHGGJFSA-N	1	1	322.361	1.447	20	5		DDBDMO
CC(=O)NCCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173472845	407881543	/nfs/dbraw/zinc/88/15/43/407881543.db2.gz	WZRBFZVCFLVUER-GFCCVEGCSA-N	1	1	307.354	1.002	20	5		DDBDMO
CCC[N@@H+](CC(=O)N(C)C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153758411	407894758	/nfs/dbraw/zinc/89/47/58/407894758.db2.gz	KHCKSYMLTNYFKM-AWEZNQCLSA-N	1	1	309.366	1.428	20	5		DDBDMO
CCC[N@H+](CC(=O)N(C)C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153758411	407894763	/nfs/dbraw/zinc/89/47/63/407894763.db2.gz	KHCKSYMLTNYFKM-AWEZNQCLSA-N	1	1	309.366	1.428	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccccc1	ZINC000245419092	407971710	/nfs/dbraw/zinc/97/17/10/407971710.db2.gz	GWEXASAPDQAIKV-WQVCFCJDSA-N	1	1	316.361	1.845	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@H]1CCCC[C@H]1O	ZINC000272451911	407929256	/nfs/dbraw/zinc/92/92/56/407929256.db2.gz	CHDQCEJBJNBSJL-TZMCWYRMSA-N	1	1	309.366	1.239	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000268188008	407937617	/nfs/dbraw/zinc/93/76/17/407937617.db2.gz	DQSHJAHXMZOSKC-LLVKDONJSA-N	1	1	321.381	1.479	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1ccccc1[N+](=O)[O-])[C@@H]1CCSC1	ZINC000154541158	408047854	/nfs/dbraw/zinc/04/78/54/408047854.db2.gz	RNXGTYRKXNAAPA-GFCCVEGCSA-N	1	1	309.391	1.648	20	5		DDBDMO
C[N@@H+](CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000272591137	407998598	/nfs/dbraw/zinc/99/85/98/407998598.db2.gz	TUTLAQZWYNICED-UHFFFAOYSA-N	1	1	313.304	1.897	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]2OCCC[C@H]2C1	ZINC000245571837	408018617	/nfs/dbraw/zinc/01/86/17/408018617.db2.gz	BWRJNKKFBHSNNV-GXTWGEPZSA-N	1	1	307.350	1.257	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CC(N)=O)C1	ZINC000175227470	408084459	/nfs/dbraw/zinc/08/44/59/408084459.db2.gz	YHOAXYVTQRDGGQ-LLVKDONJSA-N	1	1	307.350	1.691	20	5		DDBDMO
CO[C@@H](C)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000182341651	408130704	/nfs/dbraw/zinc/13/07/04/408130704.db2.gz	CDYHPKGCIFQJJB-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCS1	ZINC000246141449	408154392	/nfs/dbraw/zinc/15/43/92/408154392.db2.gz	NRLGFJOABQUVQI-DGCLKSJQSA-N	1	1	312.391	1.772	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NCC[N@H+](C)C(C)C	ZINC000155595521	408186944	/nfs/dbraw/zinc/18/69/44/408186944.db2.gz	XVKYHAZPZGGMFB-UHFFFAOYSA-N	1	1	315.395	1.522	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000175729247	408188719	/nfs/dbraw/zinc/18/87/19/408188719.db2.gz	BYCCSKXKZZMPGR-IUCAKERBSA-N	1	1	307.354	1.235	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000263766884	408248025	/nfs/dbraw/zinc/24/80/25/408248025.db2.gz	RYVIKWWHQIPFSS-UHFFFAOYSA-N	1	1	317.349	1.685	20	5		DDBDMO
CC[N@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000263766884	408248031	/nfs/dbraw/zinc/24/80/31/408248031.db2.gz	RYVIKWWHQIPFSS-UHFFFAOYSA-N	1	1	317.349	1.685	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000263766884	408248037	/nfs/dbraw/zinc/24/80/37/408248037.db2.gz	RYVIKWWHQIPFSS-UHFFFAOYSA-N	1	1	317.349	1.685	20	5		DDBDMO
C[C@H](NC(=O)c1[nH]ncc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822353	408258015	/nfs/dbraw/zinc/25/80/15/408258015.db2.gz	PLXJOWNWGVAQCV-QWRGUYRKSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1	ZINC000182822353	408258019	/nfs/dbraw/zinc/25/80/19/408258019.db2.gz	PLXJOWNWGVAQCV-QWRGUYRKSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000182822353	408258027	/nfs/dbraw/zinc/25/80/27/408258027.db2.gz	PLXJOWNWGVAQCV-QWRGUYRKSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[N@@H+](CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2)C1CC1	ZINC000263674484	408200461	/nfs/dbraw/zinc/20/04/61/408200461.db2.gz	HAHPWYWZAJOPKU-UHFFFAOYSA-N	1	1	304.350	1.986	20	5		DDBDMO
C[C@H]1C[NH+](CCCNc2ncc([N+](=O)[O-])s2)C[C@H](C)O1	ZINC000190312637	408219711	/nfs/dbraw/zinc/21/97/11/408219711.db2.gz	DFGLEORXZWKCOC-UWVGGRQHSA-N	1	1	300.384	1.963	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])c[nH]c3=O)CC[C@@H]21	ZINC000150969470	408235586	/nfs/dbraw/zinc/23/55/86/408235586.db2.gz	TVIXZFJGYRUCQB-GWCFXTLKSA-N	1	1	320.349	1.252	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@@H]1CO	ZINC000190405216	408236392	/nfs/dbraw/zinc/23/63/92/408236392.db2.gz	ROEFFTLLCMCLJV-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCCC(=O)NC[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176225535	408315543	/nfs/dbraw/zinc/31/55/43/408315543.db2.gz	LFIMEOLMMKXXMZ-CYBMUJFWSA-N	1	1	323.397	1.420	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269333254	408273905	/nfs/dbraw/zinc/27/39/05/408273905.db2.gz	AUCGKSRMPUCEEX-GHMZBOCLSA-N	1	1	323.397	1.900	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1C	ZINC000246850733	408353408	/nfs/dbraw/zinc/35/34/08/408353408.db2.gz	FHQKHSPZYMQJET-DGCLKSJQSA-N	1	1	323.397	1.335	20	5		DDBDMO
COCCC[N@@H+](CCOC)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269673344	408386675	/nfs/dbraw/zinc/38/66/75/408386675.db2.gz	OIJYPOMPDYHCHJ-OAHLLOKOSA-N	1	1	312.366	1.613	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000247598777	408497844	/nfs/dbraw/zinc/49/78/44/408497844.db2.gz	OVSZKHUTDFOXHO-NWANDNLSSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000247598777	408497849	/nfs/dbraw/zinc/49/78/49/408497849.db2.gz	OVSZKHUTDFOXHO-NWANDNLSSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[NH+](C)[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000264502051	408514591	/nfs/dbraw/zinc/51/45/91/408514591.db2.gz	YFARPEDMWLGIMG-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
COc1cc(C[NH+]2CCC(C(N)=O)CC2)c([N+](=O)[O-])cc1F	ZINC000184234148	408576400	/nfs/dbraw/zinc/57/64/00/408576400.db2.gz	RMVCIIOTBYLZIZ-UHFFFAOYSA-N	1	1	311.313	1.440	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@H](C)C1	ZINC000275372760	408585772	/nfs/dbraw/zinc/58/57/72/408585772.db2.gz	NSTMBWMPTMBHEY-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@H](C)C1	ZINC000275372760	408585775	/nfs/dbraw/zinc/58/57/75/408585775.db2.gz	NSTMBWMPTMBHEY-ZJUUUORDSA-N	1	1	314.773	1.535	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000161317740	408587757	/nfs/dbraw/zinc/58/77/57/408587757.db2.gz	OFPVHTSTMMLHCK-NSHDSACASA-N	1	1	308.386	1.747	20	5		DDBDMO
CCOc1cccc(N2CC[NH+](C[C@@H](C)O)CC2)c1[N+](=O)[O-]	ZINC000275476836	408590890	/nfs/dbraw/zinc/59/08/90/408590890.db2.gz	BVMQYWZSQWREEP-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000264698902	408544460	/nfs/dbraw/zinc/54/44/60/408544460.db2.gz	VVWYBIJBFQBSDC-VIFPVBQESA-N	1	1	309.370	1.483	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000248910864	408660965	/nfs/dbraw/zinc/66/09/65/408660965.db2.gz	IXZDEASTPPHPHQ-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
CO[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C	ZINC000251697202	408786445	/nfs/dbraw/zinc/78/64/45/408786445.db2.gz	JTFVLQOWJJIDGS-SWLSCSKDSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C	ZINC000251697202	408786447	/nfs/dbraw/zinc/78/64/47/408786447.db2.gz	JTFVLQOWJJIDGS-SWLSCSKDSA-N	1	1	321.377	1.914	20	5		DDBDMO
COc1cc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000194539688	408786637	/nfs/dbraw/zinc/78/66/37/408786637.db2.gz	PWZOSBOVOWJVID-BETUJISGSA-N	1	1	321.377	1.605	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000185311532	408794721	/nfs/dbraw/zinc/79/47/21/408794721.db2.gz	DPTKGNYWVGRBSF-LLVKDONJSA-N	1	1	321.381	1.280	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000177989368	408752446	/nfs/dbraw/zinc/75/24/46/408752446.db2.gz	MASKDINFEUFIKL-ZUZCIYMTSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000177989368	408752450	/nfs/dbraw/zinc/75/24/50/408752450.db2.gz	MASKDINFEUFIKL-ZUZCIYMTSA-N	1	1	323.349	1.387	20	5		DDBDMO
COCC[NH+]1CCN(c2ncnc3sc([N+](=O)[O-])cc32)CC1	ZINC000286036520	408911826	/nfs/dbraw/zinc/91/18/26/408911826.db2.gz	GWXOMBCFDZQXSC-UHFFFAOYSA-N	1	1	323.378	1.368	20	5		DDBDMO
C[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O	ZINC000189881895	163123211	/nfs/dbraw/zinc/12/32/11/163123211.db2.gz	LYTPFWYFHASZGP-CYBMUJFWSA-N	1	1	307.394	1.872	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[NH+]2CCC1CC2	ZINC000191080224	163170695	/nfs/dbraw/zinc/17/06/95/163170695.db2.gz	VOOLJULHKJJKTI-UHFFFAOYSA-N	1	1	311.363	1.064	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000281842917	408940411	/nfs/dbraw/zinc/94/04/11/408940411.db2.gz	YPJZGIBJCQSNMP-ZWNOBZJWSA-N	1	1	307.350	1.693	20	5		DDBDMO
Cc1nn(C)c(N2CC([N@@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC000286296834	408957692	/nfs/dbraw/zinc/95/76/92/408957692.db2.gz	JFNPWRZQJYGONI-UHFFFAOYSA-N	1	1	315.377	1.957	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000286380129	408974162	/nfs/dbraw/zinc/97/41/62/408974162.db2.gz	GQCPNUWKIGOSSU-DZGCQCFKSA-N	1	1	323.393	1.361	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000277926118	409036069	/nfs/dbraw/zinc/03/60/69/409036069.db2.gz	HJITYOKZFJMPDL-GFCCVEGCSA-N	1	1	307.350	1.354	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@@H](O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000293319467	409088840	/nfs/dbraw/zinc/08/88/40/409088840.db2.gz	XMTJJNMDPJWGSU-CQSZACIVSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@H](O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000293319467	409088842	/nfs/dbraw/zinc/08/88/42/409088842.db2.gz	XMTJJNMDPJWGSU-CQSZACIVSA-N	1	1	307.350	1.404	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2[NH2+]CC[C@H]2C1	ZINC000293348111	409095885	/nfs/dbraw/zinc/09/58/85/409095885.db2.gz	JVKUNBLDPVIUAQ-JOYOIKCWSA-N	1	1	315.333	1.295	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000294042200	409231561	/nfs/dbraw/zinc/23/15/61/409231561.db2.gz	SMRZAQOEGHFFAJ-BETUJISGSA-N	1	1	321.377	1.915	20	5		DDBDMO
O=CN1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000294163985	409252265	/nfs/dbraw/zinc/25/22/65/409252265.db2.gz	IPTOKVWJNZHAQS-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
CC(C)(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(N)=O	ZINC000284157727	409286624	/nfs/dbraw/zinc/28/66/24/409286624.db2.gz	PYJFASLTYIPVOB-LLVKDONJSA-N	1	1	310.310	1.493	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000303047224	409528000	/nfs/dbraw/zinc/52/80/00/409528000.db2.gz	WXFJIQWSDCGWCJ-NWDGAFQWSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000303047224	409528003	/nfs/dbraw/zinc/52/80/03/409528003.db2.gz	WXFJIQWSDCGWCJ-NWDGAFQWSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CCC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717256	409639784	/nfs/dbraw/zinc/63/97/84/409639784.db2.gz	NLQOMXZSKVCMJJ-WFASDCNBSA-N	1	1	319.361	1.404	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717256	409639789	/nfs/dbraw/zinc/63/97/89/409639789.db2.gz	NLQOMXZSKVCMJJ-WFASDCNBSA-N	1	1	319.361	1.404	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000356851425	409659944	/nfs/dbraw/zinc/65/99/44/409659944.db2.gz	MPTRJULPERWSEL-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@@H+]1C	ZINC000356851425	409659950	/nfs/dbraw/zinc/65/99/50/409659950.db2.gz	MPTRJULPERWSEL-BDAKNGLRSA-N	1	1	310.329	1.481	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@H]1C(C)(C)O)c1ccc([N+](=O)[O-])cc1	ZINC000305468895	409754802	/nfs/dbraw/zinc/75/48/02/409754802.db2.gz	XNLXJZRPCSGMCY-CQSZACIVSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1	ZINC000357308590	409967000	/nfs/dbraw/zinc/96/70/00/409967000.db2.gz	WNYSRUZWRVXNEZ-WDEREUQCSA-N	1	1	321.381	1.621	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2c([N+](=O)[O-])ncn2C)CC1	ZINC000342822152	409925530	/nfs/dbraw/zinc/92/55/30/409925530.db2.gz	QQGLRTDUZREDNW-LBPRGKRZSA-N	1	1	310.402	1.014	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(c3nc(C)cc(C)c3[N+](=O)[O-])[C@@H]2C1	ZINC000338734769	410034082	/nfs/dbraw/zinc/03/40/82/410034082.db2.gz	SZHZXKIUGRLADI-ZIAGYGMSSA-N	1	1	320.393	1.906	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1	ZINC000357457929	410051945	/nfs/dbraw/zinc/05/19/45/410051945.db2.gz	WSCRCDGBGZIOJR-INIZCTEOSA-N	1	1	316.361	1.913	20	5		DDBDMO
COc1c(C(=O)NCC[N@@H+]2CC=CCC2)cccc1[N+](=O)[O-]	ZINC000357636366	410153449	/nfs/dbraw/zinc/15/34/49/410153449.db2.gz	QEABSUIHDPOBSX-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H](C)O1	ZINC000298842987	410420072	/nfs/dbraw/zinc/42/00/72/410420072.db2.gz	IMKLYGUKAZJWAE-PHIMTYICSA-N	1	1	310.354	1.152	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000347196001	410383374	/nfs/dbraw/zinc/38/33/74/410383374.db2.gz	AVTHKQBOZCDTJZ-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790192	410400719	/nfs/dbraw/zinc/40/07/19/410400719.db2.gz	JMXYLJIUKWVAQU-WDEREUQCSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790192	410400727	/nfs/dbraw/zinc/40/07/27/410400727.db2.gz	JMXYLJIUKWVAQU-WDEREUQCSA-N	1	1	321.333	1.417	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000343444155	410458805	/nfs/dbraw/zinc/45/88/05/410458805.db2.gz	BACASZCRRBFRGP-ZYHUDNBSSA-N	1	1	309.370	1.089	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000339759399	410443346	/nfs/dbraw/zinc/44/33/46/410443346.db2.gz	ZEMSGDWNZBFYSL-UHFFFAOYSA-N	1	1	323.393	1.567	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000355602898	410601513	/nfs/dbraw/zinc/60/15/13/410601513.db2.gz	WHZWUSXATYUURM-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@H+]1CCCC(C)(C)C1	ZINC000347425392	410541991	/nfs/dbraw/zinc/54/19/91/410541991.db2.gz	HXYNXDWBQXWLBB-UHFFFAOYSA-N	1	1	323.397	1.338	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1ncnc2cccc([N+](=O)[O-])c21	ZINC000347438909	410546108	/nfs/dbraw/zinc/54/61/08/410546108.db2.gz	WXJXEDILFBPVLY-LLVKDONJSA-N	1	1	301.350	2.434	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3cccc(F)c3[N+](=O)[O-])CC2)C1	ZINC000301285355	410689765	/nfs/dbraw/zinc/68/97/65/410689765.db2.gz	LNMLZXQKTZWBOO-ZDUSSCGKSA-N	1	1	322.384	1.950	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000301310487	410695489	/nfs/dbraw/zinc/69/54/89/410695489.db2.gz	ZRFOBRKCJCYHBM-AWEZNQCLSA-N	1	1	304.394	1.811	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000330534945	410756815	/nfs/dbraw/zinc/75/68/15/410756815.db2.gz	RIGMPZRAQGQFKJ-LBPRGKRZSA-N	1	1	324.381	1.020	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)C[C@@H]1C	ZINC000330664889	410860813	/nfs/dbraw/zinc/86/08/13/410860813.db2.gz	GSBIUPYNXNFQJF-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)C[C@@H]1C	ZINC000330680326	410873328	/nfs/dbraw/zinc/87/33/28/410873328.db2.gz	YLXIWHRSGMWGIC-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C)C[C@@H]1C	ZINC000330680326	410873336	/nfs/dbraw/zinc/87/33/36/410873336.db2.gz	YLXIWHRSGMWGIC-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)C[C@@H]1C	ZINC000330680326	410873344	/nfs/dbraw/zinc/87/33/44/410873344.db2.gz	YLXIWHRSGMWGIC-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000359785336	410878770	/nfs/dbraw/zinc/87/87/70/410878770.db2.gz	CSPMZIZKNVCDIJ-UHFFFAOYSA-N	1	1	318.337	1.239	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000359947266	410967309	/nfs/dbraw/zinc/96/73/09/410967309.db2.gz	ZSPUINYWDHOQSN-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000359947266	410967311	/nfs/dbraw/zinc/96/73/11/410967311.db2.gz	ZSPUINYWDHOQSN-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000356509432	411062242	/nfs/dbraw/zinc/06/22/42/411062242.db2.gz	FLMDJMGJDFCSGF-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000356509432	411062244	/nfs/dbraw/zinc/06/22/44/411062244.db2.gz	FLMDJMGJDFCSGF-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(O)CCC1	ZINC000353478640	411017364	/nfs/dbraw/zinc/01/73/64/411017364.db2.gz	FMYOJKOLWXZICB-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(O)CCC1	ZINC000353478640	411017368	/nfs/dbraw/zinc/01/73/68/411017368.db2.gz	FMYOJKOLWXZICB-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000331208985	411021081	/nfs/dbraw/zinc/02/10/81/411021081.db2.gz	WHJBVOMOGOBAQI-QWHCGFSZSA-N	1	1	321.377	1.833	20	5		DDBDMO
O=C(NCCC[NH+]1CCOCC1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000344202036	411023476	/nfs/dbraw/zinc/02/34/76/411023476.db2.gz	AHHQXNPBMIJMBS-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000344370454	411096401	/nfs/dbraw/zinc/09/64/01/411096401.db2.gz	HXIQAROTPOZZGG-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000344370454	411096405	/nfs/dbraw/zinc/09/64/05/411096405.db2.gz	HXIQAROTPOZZGG-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1ccc(C[N@H+](C)C[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	ZINC000353766009	411126167	/nfs/dbraw/zinc/12/61/67/411126167.db2.gz	FXHQZEUANCKDFC-ZDUSSCGKSA-N	1	1	312.391	1.770	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	ZINC000353766009	411126168	/nfs/dbraw/zinc/12/61/68/411126168.db2.gz	FXHQZEUANCKDFC-ZDUSSCGKSA-N	1	1	312.391	1.770	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)n1	ZINC000191758236	222108956	/nfs/dbraw/zinc/10/89/56/222108956.db2.gz	XMAHFNPZSNKWDS-LBPRGKRZSA-N	1	1	323.397	1.806	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)n1	ZINC000191842518	222109926	/nfs/dbraw/zinc/10/99/26/222109926.db2.gz	LAXKJRAHLXQQOY-GFCCVEGCSA-N	1	1	323.397	1.519	20	5		DDBDMO
CC(C)N(C)C(=O)[C@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400323	418634521	/nfs/dbraw/zinc/63/45/21/418634521.db2.gz	BUPXGKJSNJVKFQ-QWHCGFSZSA-N	1	1	323.397	1.684	20	5		DDBDMO
CC(C)N(C)C(=O)[C@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400323	418634524	/nfs/dbraw/zinc/63/45/24/418634524.db2.gz	BUPXGKJSNJVKFQ-QWHCGFSZSA-N	1	1	323.397	1.684	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])c1	ZINC000367982416	418668375	/nfs/dbraw/zinc/66/83/75/418668375.db2.gz	JEHRQCUPTWCVQO-NSHDSACASA-N	1	1	323.349	1.180	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000375720846	418675935	/nfs/dbraw/zinc/67/59/35/418675935.db2.gz	STEMPIVLYGMUAE-UHFFFAOYSA-N	1	1	322.365	1.499	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)[C@H]1CCO[C@@H]1C	ZINC000361586105	418687808	/nfs/dbraw/zinc/68/78/08/418687808.db2.gz	LCDRNXUQOOIHQK-RISCZKNCSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)[C@H]1CCO[C@@H]1C	ZINC000361586105	418687810	/nfs/dbraw/zinc/68/78/10/418687810.db2.gz	LCDRNXUQOOIHQK-RISCZKNCSA-N	1	1	310.350	1.575	20	5		DDBDMO
O=[N+]([O-])c1ccn(C2CC[NH+](CCN3CCCCC3)CC2)n1	ZINC000365507153	418868827	/nfs/dbraw/zinc/86/88/27/418868827.db2.gz	GPSWAAKSHYPRPJ-UHFFFAOYSA-N	1	1	307.398	1.914	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(C2CCOCC2)CC1	ZINC000372728017	418896339	/nfs/dbraw/zinc/89/63/39/418896339.db2.gz	QTPSCXCYIFKNJB-UHFFFAOYSA-N	1	1	308.382	1.967	20	5		DDBDMO
CCCCCNC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373229418	418932708	/nfs/dbraw/zinc/93/27/08/418932708.db2.gz	KWOSKYWUWUXTRD-UHFFFAOYSA-N	1	1	323.397	1.735	20	5		DDBDMO
O=[N+]([O-])c1cn(Cc2ccc(C[NH+]3CCOCC3)cc2)cn1	ZINC000421847637	419749532	/nfs/dbraw/zinc/74/95/32/419749532.db2.gz	XWFSAFWUXSOIBI-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CNCCO3)o2)cc1	ZINC000415096420	419940247	/nfs/dbraw/zinc/94/02/47/419940247.db2.gz	PTEWGVXIPQHWRK-OAHLLOKOSA-N	1	1	317.345	1.933	20	5		DDBDMO
CNC(=O)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000430244147	420095051	/nfs/dbraw/zinc/09/50/51/420095051.db2.gz	WWECYPYMBZHDDX-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)ccc1[N+](=O)[O-]	ZINC000301659662	229804982	/nfs/dbraw/zinc/80/49/82/229804982.db2.gz	TWNSYRMWLSPTLW-LBPRGKRZSA-N	1	1	320.393	1.988	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439163691	420482848	/nfs/dbraw/zinc/48/28/48/420482848.db2.gz	SYJUZZKADIOSDK-LBPRGKRZSA-N	1	1	320.393	1.862	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H](CO)[C@H](O)C3)o2)cc1	ZINC000459718021	420856399	/nfs/dbraw/zinc/85/63/99/420856399.db2.gz	XHCSYBPJSKIOHS-IUODEOHRSA-N	1	1	318.329	1.640	20	5		DDBDMO
CCOC(=O)[C@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CC12COC2	ZINC000449355950	420995800	/nfs/dbraw/zinc/99/58/00/420995800.db2.gz	ALSZDKBBTFKIBP-CYBMUJFWSA-N	1	1	320.345	1.606	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@@H]2CCCC[N@H+]2CCO)c(F)c1	ZINC000449394343	421003912	/nfs/dbraw/zinc/00/39/12/421003912.db2.gz	NTLPDSHHHAJCSZ-AWEZNQCLSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@@H]2CCCC[N@@H+]2CCO)c(F)c1	ZINC000449394343	421003916	/nfs/dbraw/zinc/00/39/16/421003916.db2.gz	NTLPDSHHHAJCSZ-AWEZNQCLSA-N	1	1	311.357	1.670	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CO)[C@H]1C	ZINC000488725275	421107855	/nfs/dbraw/zinc/10/78/55/421107855.db2.gz	ALCAOBWMBAYRQG-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](CO)[C@H]1C	ZINC000488725275	421107859	/nfs/dbraw/zinc/10/78/59/421107859.db2.gz	ALCAOBWMBAYRQG-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000456205055	421119306	/nfs/dbraw/zinc/11/93/06/421119306.db2.gz	BBLHIFLKSWMFIS-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000456205055	421119309	/nfs/dbraw/zinc/11/93/09/421119309.db2.gz	BBLHIFLKSWMFIS-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000455818477	421065951	/nfs/dbraw/zinc/06/59/51/421065951.db2.gz	MGXQEPGMZSMXNO-NSHDSACASA-N	1	1	321.381	1.445	20	5		DDBDMO
Cc1nc(N2CCC[C@H](Cc3[nH+]ccn3C)C2)ncc1[N+](=O)[O-]	ZINC000450384813	421191670	/nfs/dbraw/zinc/19/16/70/421191670.db2.gz	CEQIYBURPAHTQM-GFCCVEGCSA-N	1	1	316.365	1.886	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000524776430	421270937	/nfs/dbraw/zinc/27/09/37/421270937.db2.gz	DZSBPPOVUJPDPN-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000548125581	421404873	/nfs/dbraw/zinc/40/48/73/421404873.db2.gz	XLDPXAYESZUCKX-CYBMUJFWSA-N	1	1	323.397	1.514	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CCO1	ZINC000564058983	421566728	/nfs/dbraw/zinc/56/67/28/421566728.db2.gz	VPGLWPNXDQXJBS-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CCO1	ZINC000564058983	421566731	/nfs/dbraw/zinc/56/67/31/421566731.db2.gz	VPGLWPNXDQXJBS-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000531633385	421640732	/nfs/dbraw/zinc/64/07/32/421640732.db2.gz	NSUPXZBNLWTDIF-CYBMUJFWSA-N	1	1	322.365	1.076	20	5		DDBDMO
C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ncnn1C	ZINC000518758828	421665957	/nfs/dbraw/zinc/66/59/57/421665957.db2.gz	CTHHHBZDDYCSLR-SNVBAGLBSA-N	1	1	318.337	1.403	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000517214014	421600105	/nfs/dbraw/zinc/60/01/05/421600105.db2.gz	HKYSAFNLDVCULA-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000536639860	421723446	/nfs/dbraw/zinc/72/34/46/421723446.db2.gz	APQSADAIZHZYTN-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000536639860	421723448	/nfs/dbraw/zinc/72/34/48/421723448.db2.gz	APQSADAIZHZYTN-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
C[N@@H+](CCNc1ccc(N)c([N+](=O)[O-])n1)Cc1ccc(F)cc1	ZINC000596151102	422366340	/nfs/dbraw/zinc/36/63/40/422366340.db2.gz	NMMLZVYNZVROEV-UHFFFAOYSA-N	1	1	319.340	2.255	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])cn2C)CCCO1	ZINC000578386602	422560635	/nfs/dbraw/zinc/56/06/35/422560635.db2.gz	QGCYQDKFOQPMGQ-LBPRGKRZSA-N	1	1	324.381	1.164	20	5		DDBDMO
Cc1c(NC(=O)CCNCC2([NH3+])CCC2)cccc1[N+](=O)[O-]	ZINC000342135750	271313335	/nfs/dbraw/zinc/31/33/35/271313335.db2.gz	QBPYOUNXGLJZLU-UHFFFAOYSA-N	1	1	306.366	1.703	20	5		DDBDMO
Cc1c(NC(=O)CC[NH2+]CC2(N)CCC2)cccc1[N+](=O)[O-]	ZINC000342135750	271313339	/nfs/dbraw/zinc/31/33/39/271313339.db2.gz	QBPYOUNXGLJZLU-UHFFFAOYSA-N	1	1	306.366	1.703	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000153858751	273719212	/nfs/dbraw/zinc/71/92/12/273719212.db2.gz	GMKYJQBZKXGILH-NSHDSACASA-N	1	1	314.773	1.536	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CCC[N@@H+](CCO)CC1	ZINC000175093914	274053137	/nfs/dbraw/zinc/05/31/37/274053137.db2.gz	UJGUIXXOCSCTMB-UHFFFAOYSA-N	1	1	309.366	1.246	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[N@@H+]2CCC[C@@H]2CO)nc1	ZINC000301526269	275036287	/nfs/dbraw/zinc/03/62/87/275036287.db2.gz	JFGYDYIJSBVXJC-ZIAGYGMSSA-N	1	1	306.366	1.415	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000408067305	276041034	/nfs/dbraw/zinc/04/10/34/276041034.db2.gz	BNZRVIHDUNNBKK-NXEZZACHSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000408067305	276041036	/nfs/dbraw/zinc/04/10/36/276041036.db2.gz	BNZRVIHDUNNBKK-NXEZZACHSA-N	1	1	309.370	1.606	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[NH+]3CCOCC3)C2)n1	ZINC000125591524	281011169	/nfs/dbraw/zinc/01/11/69/281011169.db2.gz	KIPGIZZTYXCTJP-AWEZNQCLSA-N	1	1	320.393	1.847	20	5		DDBDMO
CC[C@@H](C(N)=O)[N@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000364366516	300385076	/nfs/dbraw/zinc/38/50/76/300385076.db2.gz	PTMPKUPGHFICHV-ZDUSSCGKSA-N	1	1	318.377	1.838	20	5		DDBDMO
CC[C@@H](C(N)=O)[N@@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000364366516	300385078	/nfs/dbraw/zinc/38/50/78/300385078.db2.gz	PTMPKUPGHFICHV-ZDUSSCGKSA-N	1	1	318.377	1.838	20	5		DDBDMO
O=C(C[N@H+]1CC[C@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000368475527	301036053	/nfs/dbraw/zinc/03/60/53/301036053.db2.gz	TZCFCMGTRVHHPH-OAHLLOKOSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000368475527	301036055	/nfs/dbraw/zinc/03/60/55/301036055.db2.gz	TZCFCMGTRVHHPH-OAHLLOKOSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]3COC[C@H]32)c1	ZINC000368519558	301047129	/nfs/dbraw/zinc/04/71/29/301047129.db2.gz	QUANIECLBTVHRC-JGGQBBKZSA-N	1	1	322.361	1.445	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCO[C@H]3CCC[C@H]32)c([N+](=O)[O-])c1	ZINC000369473838	301189501	/nfs/dbraw/zinc/18/95/01/301189501.db2.gz	UFPJXCZFQYOQHD-HIFRSBDPSA-N	1	1	319.361	1.837	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000377362863	302172835	/nfs/dbraw/zinc/17/28/35/302172835.db2.gz	QSSHTEFZDMSRPO-ZJUUUORDSA-N	1	1	305.338	1.127	20	5		DDBDMO
C[NH+](C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000377688091	302212274	/nfs/dbraw/zinc/21/22/74/302212274.db2.gz	IHMBXLLDENHMKW-TUVASFSCSA-N	1	1	303.362	1.386	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000531193719	303234563	/nfs/dbraw/zinc/23/45/63/303234563.db2.gz	XHWGZEULNLNWJZ-NEPJUHHUSA-N	1	1	306.366	1.632	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000532397892	303284989	/nfs/dbraw/zinc/28/49/89/303284989.db2.gz	RQYDDURUGJALKF-TXEJJXNPSA-N	1	1	322.365	1.219	20	5		DDBDMO
Cn1cc(C(C)(C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cn1	ZINC000547413713	303528772	/nfs/dbraw/zinc/52/87/72/303528772.db2.gz	QIWAKEYVFFBWOQ-UHFFFAOYSA-N	1	1	317.349	1.452	20	5		DDBDMO
Cn1nccc1[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000363428795	307027906	/nfs/dbraw/zinc/02/79/06/307027906.db2.gz	CRWFOOHRAXBMLC-GFCCVEGCSA-N	1	1	304.354	1.404	20	5		DDBDMO
Cn1ccnc1C[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000367090193	307085422	/nfs/dbraw/zinc/08/54/22/307085422.db2.gz	VZMBTHBYAXXROO-GFCCVEGCSA-N	1	1	318.381	1.517	20	5		DDBDMO
Cn1ccnc1C[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000367090193	307085423	/nfs/dbraw/zinc/08/54/23/307085423.db2.gz	VZMBTHBYAXXROO-GFCCVEGCSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327768	307205926	/nfs/dbraw/zinc/20/59/26/307205926.db2.gz	IORIEYDAQSQEDX-WFASDCNBSA-N	1	1	319.361	1.668	20	5		DDBDMO
C[C@@H]1COCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327768	307205927	/nfs/dbraw/zinc/20/59/27/307205927.db2.gz	IORIEYDAQSQEDX-WFASDCNBSA-N	1	1	319.361	1.668	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O	ZINC000576479978	308318086	/nfs/dbraw/zinc/31/80/86/308318086.db2.gz	JNVXJSQBJHMXLE-JTQLQIEISA-N	1	1	303.746	1.111	20	5		DDBDMO
C[C@H]1CN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC[N@@H+]1CCO	ZINC000576579710	308324487	/nfs/dbraw/zinc/32/44/87/308324487.db2.gz	JYCLYESVUJGCPL-LBPRGKRZSA-N	1	1	320.393	1.371	20	5		DDBDMO
C[C@H]1CN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC[N@H+]1CCO	ZINC000576579710	308324488	/nfs/dbraw/zinc/32/44/88/308324488.db2.gz	JYCLYESVUJGCPL-LBPRGKRZSA-N	1	1	320.393	1.371	20	5		DDBDMO
Cc1nn(C)c(N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000582940396	337220003	/nfs/dbraw/zinc/22/00/03/337220003.db2.gz	XYNFRDJSZJPTMR-NSHDSACASA-N	1	1	307.398	1.947	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(C(=O)c4n[nH]cc4[N+](=O)[O-])C[C@]2(C1)CCCC3	ZINC001120757299	782124811	/nfs/dbraw/zinc/12/48/11/782124811.db2.gz	YROQTHDWRSVSKY-GASCZTMLSA-N	1	1	319.365	1.266	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](c3nnc[nH]3)C2)cc1[N+](=O)[O-]	ZINC000425355469	490249614	/nfs/dbraw/zinc/24/96/14/490249614.db2.gz	LTVWAGOZHLZUCL-NSHDSACASA-N	1	1	303.322	1.711	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000305768954	534030361	/nfs/dbraw/zinc/03/03/61/534030361.db2.gz	VJXIKCWAOIZXTL-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CC(C)(C)O)CC2)c1	ZINC000321070622	534316772	/nfs/dbraw/zinc/31/67/72/534316772.db2.gz	KINWXFQWDWCQOD-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1CCO	ZINC000416731803	534361554	/nfs/dbraw/zinc/36/15/54/534361554.db2.gz	ORGDMNPVXXSNTO-NEPJUHHUSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1CCO	ZINC000416731803	534361561	/nfs/dbraw/zinc/36/15/61/534361561.db2.gz	ORGDMNPVXXSNTO-NEPJUHHUSA-N	1	1	322.365	1.514	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC000331931230	534714530	/nfs/dbraw/zinc/71/45/30/534714530.db2.gz	NXOOEPZMKMQWMT-UHFFFAOYSA-N	1	1	318.337	1.609	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-]	ZINC000299652233	534775778	/nfs/dbraw/zinc/77/57/78/534775778.db2.gz	PPSLNMMTVMAOQL-UHFFFAOYSA-N	1	1	317.349	1.941	20	5		DDBDMO
CC[N@H+]1CC[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000413826056	527854100	/nfs/dbraw/zinc/85/41/00/527854100.db2.gz	AFENZBMADOVWCN-AWEZNQCLSA-N	1	1	318.377	1.757	20	5		DDBDMO
C[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCOC1	ZINC000106857668	696628090	/nfs/dbraw/zinc/62/80/90/696628090.db2.gz	IYKBSVNIDDGUFR-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
C[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCOC1	ZINC000106857668	696628092	/nfs/dbraw/zinc/62/80/92/696628092.db2.gz	IYKBSVNIDDGUFR-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000176105364	697401645	/nfs/dbraw/zinc/40/16/45/697401645.db2.gz	OHTWCNIRCFIQPZ-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
CN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000776581636	698121111	/nfs/dbraw/zinc/12/11/11/698121111.db2.gz	FQAHGJLKHUBMJI-HZPDHXFCSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C2CC2)C1	ZINC000776581636	698121114	/nfs/dbraw/zinc/12/11/14/698121114.db2.gz	FQAHGJLKHUBMJI-HZPDHXFCSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C2CC2)C1	ZINC000776581636	698121115	/nfs/dbraw/zinc/12/11/15/698121115.db2.gz	FQAHGJLKHUBMJI-HZPDHXFCSA-N	1	1	305.378	1.797	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000786193004	699133638	/nfs/dbraw/zinc/13/36/38/699133638.db2.gz	VYNCWUNIDXTWLO-GJZGRUSLSA-N	1	1	310.350	1.366	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000711727605	699259899	/nfs/dbraw/zinc/25/98/99/699259899.db2.gz	SKVXXMAYMJRCQB-PELKAZGASA-N	1	1	318.782	1.771	20	5		DDBDMO
C[C@@H]1CC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000726590693	699369599	/nfs/dbraw/zinc/36/95/99/699369599.db2.gz	QORFNAGFDWEQSE-LLVKDONJSA-N	1	1	318.333	1.663	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000726590693	699369602	/nfs/dbraw/zinc/36/96/02/699369602.db2.gz	QORFNAGFDWEQSE-LLVKDONJSA-N	1	1	318.333	1.663	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000802139489	700372744	/nfs/dbraw/zinc/37/27/44/700372744.db2.gz	CQNBCHBRSRLAEK-HNNXBMFYSA-N	1	1	322.361	1.790	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CC=C(C)CC2)c(N)c([N+](=O)[O-])c1	ZINC000762709378	700903535	/nfs/dbraw/zinc/90/35/35/700903535.db2.gz	VEKCTLWXSPVQKD-UHFFFAOYSA-N	1	1	318.377	1.867	20	5		DDBDMO
C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@]1(CO)CCOC1	ZINC000763880990	700951657	/nfs/dbraw/zinc/95/16/57/700951657.db2.gz	KRTHVYCOCOKXLP-CYBMUJFWSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@]1(CO)CCOC1	ZINC000763880990	700951658	/nfs/dbraw/zinc/95/16/58/700951658.db2.gz	KRTHVYCOCOKXLP-CYBMUJFWSA-N	1	1	300.742	1.831	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000765937658	701030604	/nfs/dbraw/zinc/03/06/04/701030604.db2.gz	UQMWLHGUCHJVET-QWRGUYRKSA-N	1	1	306.366	1.732	20	5		DDBDMO
Cc1nonc1C[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000809744242	701684817	/nfs/dbraw/zinc/68/48/17/701684817.db2.gz	CIYZOQIYMNOYAK-SECBINFHSA-N	1	1	319.321	1.793	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000804350539	701181693	/nfs/dbraw/zinc/18/16/93/701181693.db2.gz	QKRBSIAHFJVSHS-UHFFFAOYSA-N	1	1	312.326	1.883	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCC(=O)N1	ZINC000839671025	701775454	/nfs/dbraw/zinc/77/54/54/701775454.db2.gz	XXRQWNAXSOWXOL-HIFRSBDPSA-N	1	1	321.377	1.617	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000867945023	701846471	/nfs/dbraw/zinc/84/64/71/701846471.db2.gz	OHMZJSURKUKOKP-RWSFTLGLSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[N@H+]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])CCC1(C)C	ZINC000866113064	706621920	/nfs/dbraw/zinc/62/19/20/706621920.db2.gz	RKNNNBVQAYKVKO-UHFFFAOYSA-N	1	1	306.366	1.614	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@H]21	ZINC000866210231	706649488	/nfs/dbraw/zinc/64/94/88/706649488.db2.gz	ZTVKBWRTQQZKTQ-QMTHXVAHSA-N	1	1	306.366	1.200	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@@H]21	ZINC000866210232	706649525	/nfs/dbraw/zinc/64/95/25/706649525.db2.gz	ZTVKBWRTQQZKTQ-YGRLFVJLSA-N	1	1	306.366	1.200	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](n3cccn3)C2)cc1	ZINC000812876673	702256937	/nfs/dbraw/zinc/25/69/37/702256937.db2.gz	OGRVMWVDKNDWRN-GJZGRUSLSA-N	1	1	302.334	1.772	20	5		DDBDMO
COc1cc(Cc2noc(C3([NH3+])CC3)n2)c([N+](=O)[O-])c(OC)c1	ZINC000843226232	702846085	/nfs/dbraw/zinc/84/60/85/702846085.db2.gz	XAUMJLXCEVSRQN-UHFFFAOYSA-N	1	1	320.305	1.534	20	5		DDBDMO
C[C@@H]1C[C@H](C[NH3+])C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000843362906	702866902	/nfs/dbraw/zinc/86/69/02/702866902.db2.gz	UNHAUDYIRSHNQE-GHMZBOCLSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000879572789	706722540	/nfs/dbraw/zinc/72/25/40/706722540.db2.gz	RIDSMFZWWURFQI-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
CON(C)C(=O)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831539499	706728092	/nfs/dbraw/zinc/72/80/92/706728092.db2.gz	SIWUMORMCLKVJY-ZDUSSCGKSA-N	1	1	307.350	1.794	20	5		DDBDMO
CON(C)C(=O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831539499	706728094	/nfs/dbraw/zinc/72/80/94/706728094.db2.gz	SIWUMORMCLKVJY-ZDUSSCGKSA-N	1	1	307.350	1.794	20	5		DDBDMO
CC1(C)C[C@H](O)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879614940	706738805	/nfs/dbraw/zinc/73/88/05/706738805.db2.gz	CKUFJPJTQLUXPA-KBPBESRZSA-N	1	1	324.377	1.427	20	5		DDBDMO
COCCC[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848474621	703554675	/nfs/dbraw/zinc/55/46/75/703554675.db2.gz	FFFXIHNSNCUYBI-OAHLLOKOSA-N	1	1	321.377	1.837	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000869781557	703851348	/nfs/dbraw/zinc/85/13/48/703851348.db2.gz	RJASTAFHZYPGCU-LBPRGKRZSA-N	1	1	321.377	1.478	20	5		DDBDMO
CC1(C)OC[C@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)O1	ZINC000852150841	703946126	/nfs/dbraw/zinc/94/61/26/703946126.db2.gz	AKGMPAJUHDFKLT-LBPRGKRZSA-N	1	1	322.365	1.263	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1c[nH]cn1	ZINC000852288235	703997684	/nfs/dbraw/zinc/99/76/84/703997684.db2.gz	LXVFZFOPNGYQRV-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1c[nH]cn1	ZINC000852288235	703997688	/nfs/dbraw/zinc/99/76/88/703997688.db2.gz	LXVFZFOPNGYQRV-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cnc[nH]1	ZINC000852288235	703997692	/nfs/dbraw/zinc/99/76/92/703997692.db2.gz	LXVFZFOPNGYQRV-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cnc[nH]1	ZINC000852288235	703997695	/nfs/dbraw/zinc/99/76/95/703997695.db2.gz	LXVFZFOPNGYQRV-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
CCC[N@@H+]1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979992	704041623	/nfs/dbraw/zinc/04/16/23/704041623.db2.gz	FNOSITSFMQDNHV-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979992	704041627	/nfs/dbraw/zinc/04/16/27/704041627.db2.gz	FNOSITSFMQDNHV-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c1	ZINC000818986350	704043205	/nfs/dbraw/zinc/04/32/05/704043205.db2.gz	MDRQUWGJTPBOFQ-ARFHVFGLSA-N	1	1	321.377	1.081	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CN3CCC[C@H]3CO2)c1	ZINC000818986350	704043208	/nfs/dbraw/zinc/04/32/08/704043208.db2.gz	MDRQUWGJTPBOFQ-ARFHVFGLSA-N	1	1	321.377	1.081	20	5		DDBDMO
CN(C)c1nc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cs1	ZINC000819128160	704073065	/nfs/dbraw/zinc/07/30/65/704073065.db2.gz	GDZRSXBQNMRTMV-ZDUSSCGKSA-N	1	1	322.390	1.941	20	5		DDBDMO
Cc1cc(C[C@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000819176516	704081652	/nfs/dbraw/zinc/08/16/52/704081652.db2.gz	FCIVOQBBWVMQDM-BONVTDFDSA-N	1	1	304.350	1.881	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@H]1CC[N@@H+](CC)C1	ZINC000855490881	704487487	/nfs/dbraw/zinc/48/74/87/704487487.db2.gz	LGRBEUSZTVFDPO-LBPRGKRZSA-N	1	1	306.366	1.733	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccncc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000855528893	704490916	/nfs/dbraw/zinc/49/09/16/704490916.db2.gz	JQVKTQOHZPTCDW-HUUCEWRRSA-N	1	1	318.377	1.075	20	5		DDBDMO
C[C@@H]([NH2+][C@H](CO)c1ccnn1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000858435831	704710888	/nfs/dbraw/zinc/71/08/88/704710888.db2.gz	UXTFIGKDAYFTIT-BXKDBHETSA-N	1	1	305.338	1.295	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000880439805	706977161	/nfs/dbraw/zinc/97/71/61/706977161.db2.gz	KKKXJTYLJFOVQR-JHJVBQTASA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@](O)(c3ccccc3)C2)n1	ZINC000859585811	704943875	/nfs/dbraw/zinc/94/38/75/704943875.db2.gz	CYNLNNOECVNSAF-INIZCTEOSA-N	1	1	316.361	1.775	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000874836915	705193607	/nfs/dbraw/zinc/19/36/07/705193607.db2.gz	IDKKXSPBGAGTDT-NWDGAFQWSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000874850085	705203231	/nfs/dbraw/zinc/20/32/31/705203231.db2.gz	NUJBKPZLAIGDOE-QWHCGFSZSA-N	1	1	304.350	1.486	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000861386678	705453041	/nfs/dbraw/zinc/45/30/41/705453041.db2.gz	KBUJUJHAKDRBRD-UHFFFAOYSA-N	1	1	308.290	1.229	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825378907	705658515	/nfs/dbraw/zinc/65/85/15/705658515.db2.gz	IXCDWRQYSZWIDU-SMDDNHRTSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000862793315	705799709	/nfs/dbraw/zinc/79/97/09/705799709.db2.gz	MONQSOJZCPMAPL-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
Cc1nn(C[N@@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c2cc([N+](=O)[O-])ccc12	ZINC000863338959	705906517	/nfs/dbraw/zinc/90/65/17/705906517.db2.gz	XPRRLXUJQHWVTD-ZWNOBZJWSA-N	1	1	316.317	1.315	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c2cc([N+](=O)[O-])ccc12	ZINC000863338959	705906521	/nfs/dbraw/zinc/90/65/21/705906521.db2.gz	XPRRLXUJQHWVTD-ZWNOBZJWSA-N	1	1	316.317	1.315	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000827374741	705988940	/nfs/dbraw/zinc/98/89/40/705988940.db2.gz	PPCLBPGGUZHLBR-UONOGXRCSA-N	1	1	303.362	1.690	20	5		DDBDMO
CCOC(=O)[C@@H](C)C1C[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000871993184	707272703	/nfs/dbraw/zinc/27/27/03/707272703.db2.gz	MHTJCIKNHLKMQT-XHDPSFHLSA-N	1	1	322.361	1.759	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2CCC(CO)(CO)CC2)cc1Cl	ZINC000877798037	706219208	/nfs/dbraw/zinc/21/92/08/706219208.db2.gz	GFMHIVMXKZRBJM-UHFFFAOYSA-N	1	1	314.769	1.815	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000829449524	706334946	/nfs/dbraw/zinc/33/49/46/706334946.db2.gz	CEDNZBPSZOMRCU-ILXRZTDVSA-N	1	1	303.362	1.909	20	5		DDBDMO
O=C1[C@H]([N@H+]2CC[C@@H](CF)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000880296674	706932047	/nfs/dbraw/zinc/93/20/47/706932047.db2.gz	FSVYVZSPYRBSOS-SMDDNHRTSA-N	1	1	307.325	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cn2cc(C[NH+]3CCCC3)nn2)cc1F	ZINC000881213968	707155623	/nfs/dbraw/zinc/15/56/23/707155623.db2.gz	VZYZLPFCQLLKEI-UHFFFAOYSA-N	1	1	305.313	1.970	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000882766582	707783073	/nfs/dbraw/zinc/78/30/73/707783073.db2.gz	LIVGHCPKKWCRKY-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000882766582	707783075	/nfs/dbraw/zinc/78/30/75/707783075.db2.gz	LIVGHCPKKWCRKY-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[C@](O)(C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(F)F	ZINC000885935286	708666262	/nfs/dbraw/zinc/66/62/62/708666262.db2.gz	HGQQXSSGELMJIT-AWEZNQCLSA-N	1	1	315.320	1.733	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000886863815	708870321	/nfs/dbraw/zinc/87/03/21/708870321.db2.gz	URKAKMZKGVMWSD-NSHDSACASA-N	1	1	309.322	1.404	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)C[C@H]1CO	ZINC000912739801	713079631	/nfs/dbraw/zinc/07/96/31/713079631.db2.gz	HQIDKFGNWOXHQI-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C[C@H]1CO	ZINC000912739801	713079634	/nfs/dbraw/zinc/07/96/34/713079634.db2.gz	HQIDKFGNWOXHQI-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C	ZINC000900159756	709311034	/nfs/dbraw/zinc/31/10/34/709311034.db2.gz	PVFIATGNZBNBEY-IUODEOHRSA-N	1	1	307.350	1.008	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@H](O)C[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000900267540	709512433	/nfs/dbraw/zinc/51/24/33/709512433.db2.gz	HQYHBQJVYCXDMH-XEGUGMAKSA-N	1	1	307.350	1.227	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC([NH+]3CCC3)CC2)c1[N+](=O)[O-]	ZINC000912876248	713113116	/nfs/dbraw/zinc/11/31/16/713113116.db2.gz	CSRBBNHHRVGRMA-UHFFFAOYSA-N	1	1	321.381	1.752	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000892418659	710434231	/nfs/dbraw/zinc/43/42/31/710434231.db2.gz	RZWLIUXWTUALKB-GXTWGEPZSA-N	1	1	304.350	1.440	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CCN(C[C@@H]3CCCC[NH2+]C3)C2)nc1	ZINC000903739894	711262745	/nfs/dbraw/zinc/26/27/45/711262745.db2.gz	AXMSJKFAXPKWHH-KGLIPLIRSA-N	1	1	319.409	1.866	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H](CO)[C@H]2C)c1[N+](=O)[O-]	ZINC000894940593	711330259	/nfs/dbraw/zinc/33/02/59/711330259.db2.gz	UHQNOCLNVBUOGF-ZYHUDNBSSA-N	1	1	310.350	1.902	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@@H+](C)[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545979	713253184	/nfs/dbraw/zinc/25/31/84/713253184.db2.gz	DZAWFIZLIYTBBQ-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@H+](C)[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545979	713253186	/nfs/dbraw/zinc/25/31/86/713253186.db2.gz	DZAWFIZLIYTBBQ-RZXPCSSPSA-N	1	1	319.361	1.133	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000896580798	711758323	/nfs/dbraw/zinc/75/83/23/711758323.db2.gz	IYKJTLDPURECNG-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000913930633	713321439	/nfs/dbraw/zinc/32/14/39/713321439.db2.gz	KEDWXUQPKIHLSM-RISCZKNCSA-N	1	1	321.381	1.399	20	5		DDBDMO
C[C@@](CO)([NH2+]CC[N+](=O)[O-])c1ccc(Br)cc1	ZINC000930451454	713838194	/nfs/dbraw/zinc/83/81/94/713838194.db2.gz	QNIHCYIGDIDMOM-NSHDSACASA-N	1	1	303.156	1.523	20	5		DDBDMO
Cc1nc2c(c(=O)[nH]1)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2	ZINC000931317903	714065025	/nfs/dbraw/zinc/06/50/25/714065025.db2.gz	INCKUEXYHIFNTF-UHFFFAOYSA-N	1	1	300.318	1.957	20	5		DDBDMO
Cc1nc2c(c(=O)[nH]1)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2	ZINC000931317903	714065028	/nfs/dbraw/zinc/06/50/28/714065028.db2.gz	INCKUEXYHIFNTF-UHFFFAOYSA-N	1	1	300.318	1.957	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)n1	ZINC000923269892	714291619	/nfs/dbraw/zinc/29/16/19/714291619.db2.gz	WHNZBYVKPVZMHC-MNOVXSKESA-N	1	1	307.354	1.120	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000923274473	714293540	/nfs/dbraw/zinc/29/35/40/714293540.db2.gz	NOZCNCASXPGFGG-NWDGAFQWSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000923274473	714293542	/nfs/dbraw/zinc/29/35/42/714293542.db2.gz	NOZCNCASXPGFGG-NWDGAFQWSA-N	1	1	305.334	1.609	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@@H]1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923369577	714330726	/nfs/dbraw/zinc/33/07/26/714330726.db2.gz	KZNCDGMDVNUSMO-WFASDCNBSA-N	1	1	323.393	1.312	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000933560410	714617123	/nfs/dbraw/zinc/61/71/23/714617123.db2.gz	UWINTAAYUBDXEA-KCPJHIHWSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000933560410	714617125	/nfs/dbraw/zinc/61/71/25/714617125.db2.gz	UWINTAAYUBDXEA-KCPJHIHWSA-N	1	1	303.362	1.861	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@H]1C[C@@H]1CCCO1	ZINC000933684388	714647842	/nfs/dbraw/zinc/64/78/42/714647842.db2.gz	ARKIRYPUHBUNEN-KGLIPLIRSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@H]1C[C@@H]1CCCO1	ZINC000933684388	714647844	/nfs/dbraw/zinc/64/78/44/714647844.db2.gz	ARKIRYPUHBUNEN-KGLIPLIRSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1nc(N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923258	721849045	/nfs/dbraw/zinc/84/90/45/721849045.db2.gz	UPJXCWCOVAEYTF-LSDHHAIUSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1nc(N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923258	721849048	/nfs/dbraw/zinc/84/90/48/721849048.db2.gz	UPJXCWCOVAEYTF-LSDHHAIUSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1c(C)c(N2CC[NH+](C[C@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC001165038252	721911621	/nfs/dbraw/zinc/91/16/21/721911621.db2.gz	MLUBVLGUZPJVHN-CQSZACIVSA-N	1	1	320.393	1.908	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC001121197464	782403672	/nfs/dbraw/zinc/40/36/72/782403672.db2.gz	ASSVUBAEDOONDS-ZLKJLUDKSA-N	1	1	319.361	1.673	20	5		DDBDMO
Cc1cccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001025775358	736852519	/nfs/dbraw/zinc/85/25/19/736852519.db2.gz	RYLOMLOEHWKWFU-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
Cc1cccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001025775358	736852524	/nfs/dbraw/zinc/85/25/24/736852524.db2.gz	RYLOMLOEHWKWFU-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
Cc1cccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001025775358	736852532	/nfs/dbraw/zinc/85/25/32/736852532.db2.gz	RYLOMLOEHWKWFU-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
CCC/C=C\CC[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001200471364	748265320	/nfs/dbraw/zinc/26/53/20/748265320.db2.gz	FPNNULGSUSBUSD-ZYDHHDLOSA-N	1	1	309.410	1.979	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCN(C)c1ncccc1[N+](=O)[O-]	ZINC001095605317	750073204	/nfs/dbraw/zinc/07/32/04/750073204.db2.gz	FLEBRHROAIIJKR-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
CCOC(=O)C1=C(O)CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169029689	762186590	/nfs/dbraw/zinc/18/65/90/762186590.db2.gz	VFSCUCSJTKGPJQ-JHJVBQTASA-N	1	1	312.366	1.276	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169017560	762198309	/nfs/dbraw/zinc/19/83/09/762198309.db2.gz	AOKLOEYQEHEVGY-SNPRPXQTSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCn1nnc2c1CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@@H]2COC	ZINC001169022286	762200666	/nfs/dbraw/zinc/20/06/66/762200666.db2.gz	RQTAVOGLFBBUGT-YRGRVCCFSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1CC[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@@H]2COC	ZINC001169022286	762200671	/nfs/dbraw/zinc/20/06/71/762200671.db2.gz	RQTAVOGLFBBUGT-YRGRVCCFSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCc1ncnc2c1CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169022088	762201144	/nfs/dbraw/zinc/20/11/44/762201144.db2.gz	MUIQWQQEPFJXOS-QWHCGFSZSA-N	1	1	304.394	1.885	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CC2CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086084454	760945139	/nfs/dbraw/zinc/94/51/39/760945139.db2.gz	RVSYIQJUTPENSI-LXTVHRRPSA-N	1	1	309.410	1.716	20	5		DDBDMO
Cc1nc(Cl)nc(N2C[C@@H]3CCC[N@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001157261462	764729440	/nfs/dbraw/zinc/72/94/40/764729440.db2.gz	RJNHITOONJUISB-VHSXEESVSA-N	1	1	311.773	1.877	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CCCC3CCC3)C[C@@H]2C1	ZINC001048814643	769933745	/nfs/dbraw/zinc/93/37/45/769933745.db2.gz	VQBISLMMABXXGF-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CCCC3CCC3)C[C@@H]2C1	ZINC001048814643	769933753	/nfs/dbraw/zinc/93/37/53/769933753.db2.gz	VQBISLMMABXXGF-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CCCC3CCC3)C[C@@H]2C1	ZINC001048814643	769933760	/nfs/dbraw/zinc/93/37/60/769933760.db2.gz	VQBISLMMABXXGF-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1	ZINC001170900528	771898953	/nfs/dbraw/zinc/89/89/53/771898953.db2.gz	VKSVOVPJBCVIDZ-SNVBAGLBSA-N	1	1	308.260	1.929	20	5		DDBDMO
Cc1nc(NCCNC(=O)C[N@H+](C)C2CCC2)ccc1[N+](=O)[O-]	ZINC001094221799	775543513	/nfs/dbraw/zinc/54/35/13/775543513.db2.gz	RHBKZYSTEFYZIH-UHFFFAOYSA-N	1	1	321.381	1.311	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001094517600	775975850	/nfs/dbraw/zinc/97/58/50/775975850.db2.gz	ZNZDMCHMEWRVKB-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](C)(CO)[C@@H](O)C1	ZINC001173223391	777056934	/nfs/dbraw/zinc/05/69/34/777056934.db2.gz	ZNSRRHMZRJZCMO-UHOFOFEASA-N	1	1	308.378	1.591	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+](C)CCN1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230953	777063490	/nfs/dbraw/zinc/06/34/90/777063490.db2.gz	GYMSYWLIQDHJTM-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](C)CCN1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230953	777063493	/nfs/dbraw/zinc/06/34/93/777063493.db2.gz	GYMSYWLIQDHJTM-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1	ZINC001101704314	777413715	/nfs/dbraw/zinc/41/37/15/777413715.db2.gz	BAMPLOPYNFRKSE-UHFFFAOYSA-N	1	1	308.382	1.807	20	5		DDBDMO
O=C(NCC1([NH2+]CCCF)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001115530537	780217517	/nfs/dbraw/zinc/21/75/17/780217517.db2.gz	CFUQLAUGWQOOCY-VXGBXAGGSA-N	1	1	301.362	1.420	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC001266254850	835993216	/nfs/dbraw/zinc/99/32/16/835993216.db2.gz	XMGGCWCZXKTZTQ-UHFFFAOYSA-N	1	1	320.393	1.239	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CC(C)(C)O)Cc1ccc([N+](=O)[O-])cc1	ZINC001266388141	836196438	/nfs/dbraw/zinc/19/64/38/836196438.db2.gz	SUCYROAQCHUSLG-UHFFFAOYSA-N	1	1	323.393	1.694	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)CC(C)(C)O	ZINC001268235838	839869316	/nfs/dbraw/zinc/86/93/16/839869316.db2.gz	PCFQJUHSSZRRTI-UHFFFAOYSA-N	1	1	323.393	1.646	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC001327617511	862321482	/nfs/dbraw/zinc/32/14/82/862321482.db2.gz	SUTBYDWDJDYHGD-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCCC1CCC1)C2	ZINC001072726023	857642218	/nfs/dbraw/zinc/64/22/18/857642218.db2.gz	XWPBCBWHVDRPCF-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CCCC1CCC1)C2	ZINC001072726023	857642223	/nfs/dbraw/zinc/64/22/23/857642223.db2.gz	XWPBCBWHVDRPCF-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCCC1CCC1)C2	ZINC001072726023	857642227	/nfs/dbraw/zinc/64/22/27/857642227.db2.gz	XWPBCBWHVDRPCF-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])nc2C)C(C)(C)C1	ZINC001156827423	863371370	/nfs/dbraw/zinc/37/13/70/863371370.db2.gz	DNYXBSOALJLGHD-LBPRGKRZSA-N	1	1	323.397	1.336	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)n1	ZINC001157263711	863690676	/nfs/dbraw/zinc/69/06/76/863690676.db2.gz	BLGDZVAIBDNVEI-QWRGUYRKSA-N	1	1	307.354	1.232	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1ncc([N+](=O)[O-])cc1C	ZINC001159453428	865308483	/nfs/dbraw/zinc/30/84/83/865308483.db2.gz	QPLTYOMXVSWRJS-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
Cc1nsc(C)c1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001277055666	881913220	/nfs/dbraw/zinc/91/32/20/881913220.db2.gz	SUJOOQYXELBFPU-ZYHUDNBSSA-N	1	1	324.406	1.164	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H]1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001161042338	866310520	/nfs/dbraw/zinc/31/05/20/866310520.db2.gz	MHTHJFACDMPZMD-GKUNOOHESA-N	1	1	320.349	1.743	20	5		DDBDMO
C[N@@H+]1CCCC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022415	868684903	/nfs/dbraw/zinc/68/49/03/868684903.db2.gz	XYWIZRYWSFNJMA-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022415	868684911	/nfs/dbraw/zinc/68/49/11/868684911.db2.gz	XYWIZRYWSFNJMA-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC001164401246	869179386	/nfs/dbraw/zinc/17/93/86/869179386.db2.gz	WSEYNHTZIAUDPS-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
Cc1ncoc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494772	869233468	/nfs/dbraw/zinc/23/34/68/869233468.db2.gz	RLDPJEHEKWVBNH-VXGBXAGGSA-N	1	1	322.365	1.024	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCN(CCF)CC2)ncc1[N+](=O)[O-]	ZINC001165102815	869377490	/nfs/dbraw/zinc/37/74/90/869377490.db2.gz	MRSCFGMVWNTRNX-HWKANZROSA-N	1	1	323.372	1.614	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC001297359024	870002030	/nfs/dbraw/zinc/00/20/30/870002030.db2.gz	KPMWHRDDXGVVBJ-TZMCWYRMSA-N	1	1	322.340	1.435	20	5		DDBDMO
NC(=O)[C@H]1CN(c2ccc3ccc4cccnc4c3n2)CC[NH2+]1	ZINC001166723920	870193419	/nfs/dbraw/zinc/19/34/19/870193419.db2.gz	NQHPTGPOIZTHPZ-CYBMUJFWSA-N	1	1	307.357	1.047	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@@H]1C	ZINC001339340145	870452086	/nfs/dbraw/zinc/45/20/86/870452086.db2.gz	MOXKTVBMGJSKGB-AVGNSLFASA-N	1	1	324.429	1.802	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1	ZINC001298334972	870477962	/nfs/dbraw/zinc/47/79/62/870477962.db2.gz	UULLNWLTKGCFHS-RYUDHWBXSA-N	1	1	323.324	1.228	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CC[N@H+]2C[C@@H](F)C[C@H]2C1	ZINC001298334972	870477965	/nfs/dbraw/zinc/47/79/65/870477965.db2.gz	UULLNWLTKGCFHS-RYUDHWBXSA-N	1	1	323.324	1.228	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])cc1C(=O)NCC(F)(F)C[NH3+]	ZINC001353613407	877449498	/nfs/dbraw/zinc/44/94/98/877449498.db2.gz	OAYYFAPFBYVBMB-UHFFFAOYSA-N	1	1	305.306	1.641	20	5		DDBDMO
CC(=O)OC[C@H]([NH3+])C(=O)Nc1cc2cccnc2c2ncccc12	ZINC001218979258	877849319	/nfs/dbraw/zinc/84/93/19/877849319.db2.gz	IVCUPLLQTJGKBN-ZDUSSCGKSA-N	1	1	324.340	1.612	20	5		DDBDMO
Cc1nc(O[C@@H]2[C@@H]3CCC[C@H]2C[N@@H+](C)C3)c([N+](=O)[O-])c(=O)[nH]1	ZINC001229378387	883952193	/nfs/dbraw/zinc/95/21/93/883952193.db2.gz	LGPROPQCHRJJTK-PEGIJTEDSA-N	1	1	308.338	1.508	20	5		DDBDMO
Cc1nc(O[C@@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c([N+](=O)[O-])c(=O)[nH]1	ZINC001229378387	883952199	/nfs/dbraw/zinc/95/21/99/883952199.db2.gz	LGPROPQCHRJJTK-PEGIJTEDSA-N	1	1	308.338	1.508	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1nc2c[nH]cc([N+](=O)[O-])c-2n1	ZINC001230231462	884381522	/nfs/dbraw/zinc/38/15/22/884381522.db2.gz	KKVKIWCBEQOFRM-MSRIBSCDSA-N	1	1	317.349	1.975	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC001292121277	913618394	/nfs/dbraw/zinc/61/83/94/913618394.db2.gz	BODYNMRKDSLSAX-LLVKDONJSA-N	1	1	319.361	1.960	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+](C2CC2)C1	ZINC001292121278	913619500	/nfs/dbraw/zinc/61/95/00/913619500.db2.gz	BODYNMRKDSLSAX-NSHDSACASA-N	1	1	319.361	1.960	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1nc2ccc(C[NH+](C)C)cc2[nH]1	ZINC001251784927	894814414	/nfs/dbraw/zinc/81/44/14/894814414.db2.gz	NGDGRHHXJVBJIL-UHFFFAOYSA-N	1	1	300.322	1.933	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)[C@](C)(CO)C1	ZINC001254553826	896499012	/nfs/dbraw/zinc/49/90/12/896499012.db2.gz	ZQALIKTUIKTVQP-WQVCFCJDSA-N	1	1	308.378	1.591	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254599698	896525525	/nfs/dbraw/zinc/52/55/25/896525525.db2.gz	PAFWHLFEUPVTHR-WFASDCNBSA-N	1	1	304.346	1.947	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCC[C@@H](n3cncn3)C1)C2	ZINC001254604343	896527533	/nfs/dbraw/zinc/52/75/33/896527533.db2.gz	VUOYQSNAEDPGDC-HZPDHXFCSA-N	1	1	313.361	1.991	20	5		DDBDMO
CCN1C[C@@H]2C[NH+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2C1	ZINC001254610651	896530563	/nfs/dbraw/zinc/53/05/63/896530563.db2.gz	MGUOIRDTPNIZHY-BFYDXBDKSA-N	1	1	301.390	1.946	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])c2cccnc21	ZINC001262371464	900135577	/nfs/dbraw/zinc/13/55/77/900135577.db2.gz	MFVQOFDEUHDOPL-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
Cc1c(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC001263980533	900854439	/nfs/dbraw/zinc/85/44/39/900854439.db2.gz	YCHIWWFHESJOCV-IACUBPJLSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[C@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)[NH+]1CCOCC1	ZINC000278376202	214126324	/nfs/dbraw/zinc/12/63/24/214126324.db2.gz	DTEKGMJHBFBTON-QWRGUYRKSA-N	1	1	319.365	1.992	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1O	ZINC000614661515	361968047	/nfs/dbraw/zinc/96/80/47/361968047.db2.gz	KLGVOJKKCKPLNO-GWCFXTLKSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1O	ZINC000614661515	361968054	/nfs/dbraw/zinc/96/80/54/361968054.db2.gz	KLGVOJKKCKPLNO-GWCFXTLKSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+]1C	ZINC000090551642	185302772	/nfs/dbraw/zinc/30/27/72/185302772.db2.gz	NNRGUYRPHWFPJU-STQMWFEESA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@H]1C[C@@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551642	185302773	/nfs/dbraw/zinc/30/27/73/185302773.db2.gz	NNRGUYRPHWFPJU-STQMWFEESA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551642	185302774	/nfs/dbraw/zinc/30/27/74/185302774.db2.gz	NNRGUYRPHWFPJU-STQMWFEESA-N	1	1	308.382	1.171	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000272809069	210211342	/nfs/dbraw/zinc/21/13/42/210211342.db2.gz	IWSBTQUUXYHOHR-GFCCVEGCSA-N	1	1	320.349	1.915	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000331844450	529793747	/nfs/dbraw/zinc/79/37/47/529793747.db2.gz	UCVZSXPOONHHRC-JTQLQIEISA-N	1	1	302.334	1.758	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(C)(C)CO	ZINC000451248824	529871492	/nfs/dbraw/zinc/87/14/92/529871492.db2.gz	PCCHEKMZZZUOJF-UHFFFAOYSA-N	1	1	309.366	1.874	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000279739385	215106029	/nfs/dbraw/zinc/10/60/29/215106029.db2.gz	OOTJFTHMYNRQMO-AWEZNQCLSA-N	1	1	323.393	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](O)C(C)(C)C1	ZINC000279816735	215172689	/nfs/dbraw/zinc/17/26/89/215172689.db2.gz	QGCHQCSPVKMDHY-MFKMUULPSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](O)C(C)(C)C1	ZINC000279816735	215172693	/nfs/dbraw/zinc/17/26/93/215172693.db2.gz	QGCHQCSPVKMDHY-MFKMUULPSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000159733741	186138018	/nfs/dbraw/zinc/13/80/18/186138018.db2.gz	LMGJGBSJFCDXNN-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
CC[C@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)CC[N@H+]1C[C@@H](C)O	ZINC000266849090	186358374	/nfs/dbraw/zinc/35/83/74/186358374.db2.gz	QBOPVBYYCFYYRJ-OLZOCXBDSA-N	1	1	308.382	1.580	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](OC)C1	ZINC000267839554	186372270	/nfs/dbraw/zinc/37/22/70/186372270.db2.gz	UDTLKZJMRWVYEJ-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000280086609	215365577	/nfs/dbraw/zinc/36/55/77/215365577.db2.gz	OETZZGNDABLOOQ-GDBMZVCRSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000036830941	352296327	/nfs/dbraw/zinc/29/63/27/352296327.db2.gz	ZLLXNAPIDRQLBT-BETUJISGSA-N	1	1	321.377	1.824	20	5		DDBDMO
COC[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172890037	198164028	/nfs/dbraw/zinc/16/40/28/198164028.db2.gz	HBATWPMFRKLTNA-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172890037	198164030	/nfs/dbraw/zinc/16/40/30/198164030.db2.gz	HBATWPMFRKLTNA-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
CNc1ccc(C(=O)NCCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000047676809	352508196	/nfs/dbraw/zinc/50/81/96/352508196.db2.gz	NBMMTPIQPRDQQY-UHFFFAOYSA-N	1	1	317.349	1.962	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NCCn1cc[nH+]c1C	ZINC000052229695	352604565	/nfs/dbraw/zinc/60/45/65/352604565.db2.gz	XOSRESCDUDALAL-UHFFFAOYSA-N	1	1	319.321	1.930	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000063665365	352918737	/nfs/dbraw/zinc/91/87/37/352918737.db2.gz	KGQOLYTWQWWBLR-ZDUSSCGKSA-N	1	1	323.397	1.562	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](C)N1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000173390577	198209433	/nfs/dbraw/zinc/20/94/33/198209433.db2.gz	NLXSAWLBIPJLLC-ZIAGYGMSSA-N	1	1	306.410	1.881	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cnccn1	ZINC000174653028	198365934	/nfs/dbraw/zinc/36/59/34/198365934.db2.gz	DNKYIJWLSQBBSB-UHFFFAOYSA-N	1	1	315.333	1.845	20	5		DDBDMO
Cc1cnc(N2CCN(c3[nH+]ccn3C)CC2)c([N+](=O)[O-])c1	ZINC000078665344	353527476	/nfs/dbraw/zinc/52/74/76/353527476.db2.gz	QVOOMGOJFIZRJY-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@@H](O)CN2CCOCC2)cc1[N+](=O)[O-]	ZINC000093583317	353902447	/nfs/dbraw/zinc/90/24/47/353902447.db2.gz	DBXZYOZVTUAGHG-OAHLLOKOSA-N	1	1	323.393	1.028	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@@H]2O)c1	ZINC000585800601	354849082	/nfs/dbraw/zinc/84/90/82/354849082.db2.gz	ASSFKBLNZGTBAM-ZNMIVQPWSA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2[C@@H]2CCCC[C@@H]2O)c1	ZINC000585800601	354849084	/nfs/dbraw/zinc/84/90/84/354849084.db2.gz	ASSFKBLNZGTBAM-ZNMIVQPWSA-N	1	1	324.381	1.043	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@H](O)C2CC2)c1	ZINC000589516402	354999099	/nfs/dbraw/zinc/99/90/99/354999099.db2.gz	URFIWRTTWZFSHS-AWEZNQCLSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H](O)C2CC2)c1	ZINC000589516402	354999104	/nfs/dbraw/zinc/99/91/04/354999104.db2.gz	URFIWRTTWZFSHS-AWEZNQCLSA-N	1	1	308.334	1.584	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC000590010686	355040360	/nfs/dbraw/zinc/04/03/60/355040360.db2.gz	OTTZBKPGGDFLLC-JSGCOSHPSA-N	1	1	318.377	1.478	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000590045783	355043828	/nfs/dbraw/zinc/04/38/28/355043828.db2.gz	WDLCLIMWJLGGEL-SWLSCSKDSA-N	1	1	319.361	1.445	20	5		DDBDMO
Cc1ccc(C(=O)N2CC(C[NH+]3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000590392180	355083988	/nfs/dbraw/zinc/08/39/88/355083988.db2.gz	CICHXJQNTUAJIZ-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C2)C1	ZINC000590141948	355053220	/nfs/dbraw/zinc/05/32/20/355053220.db2.gz	VWQFUFAALZEUKO-OAHLLOKOSA-N	1	1	316.365	1.560	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000590446395	355099390	/nfs/dbraw/zinc/09/93/90/355099390.db2.gz	TVSMNOSSPTXYPE-TVQRCGJNSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000590446395	355099393	/nfs/dbraw/zinc/09/93/93/355099393.db2.gz	TVSMNOSSPTXYPE-TVQRCGJNSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000590446395	355099397	/nfs/dbraw/zinc/09/93/97/355099397.db2.gz	TVSMNOSSPTXYPE-TVQRCGJNSA-N	1	1	315.333	1.247	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1cccnc1[N+](=O)[O-])C(C)C	ZINC000590707277	355152889	/nfs/dbraw/zinc/15/28/89/355152889.db2.gz	HJKUSXMSCCSNIZ-LBPRGKRZSA-N	1	1	310.354	1.579	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000592423663	355578542	/nfs/dbraw/zinc/57/85/42/355578542.db2.gz	CVRXMBRFVQTQSM-LLVKDONJSA-N	1	1	321.377	1.925	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cnn(C)c2)c1	ZINC000593025034	355772571	/nfs/dbraw/zinc/77/25/71/355772571.db2.gz	RHCLMNQKJHPWEQ-JTQLQIEISA-N	1	1	318.333	1.966	20	5		DDBDMO
CC[C@@H]1CO[C@@H](CC)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000593058260	355782560	/nfs/dbraw/zinc/78/25/60/355782560.db2.gz	KBGSRWKILUBZRK-OCCSQVGLSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@@H]1CO[C@@H](CC)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000593058260	355782562	/nfs/dbraw/zinc/78/25/62/355782562.db2.gz	KBGSRWKILUBZRK-OCCSQVGLSA-N	1	1	309.366	1.646	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2C[C@H]1C[S@]2=O)Nc1ccccc1[N+](=O)[O-]	ZINC000593104225	355799294	/nfs/dbraw/zinc/79/92/94/355799294.db2.gz	XUJBMGFLXUSUBV-WEVHURDZSA-N	1	1	323.374	1.129	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000593106712	355800107	/nfs/dbraw/zinc/80/01/07/355800107.db2.gz	BAVGZDBWGAKCNZ-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000593106712	355800110	/nfs/dbraw/zinc/80/01/10/355800110.db2.gz	BAVGZDBWGAKCNZ-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593503435	355905818	/nfs/dbraw/zinc/90/58/18/355905818.db2.gz	KNMTXBJPBDYPPZ-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000593573235	355930310	/nfs/dbraw/zinc/93/03/10/355930310.db2.gz	VWKNNMAZCWBHRY-MNOVXSKESA-N	1	1	309.341	1.827	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000593458030	355891516	/nfs/dbraw/zinc/89/15/16/355891516.db2.gz	OIGIOTPJMKESSB-UHFFFAOYSA-N	1	1	309.341	1.831	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](N2CCOCC2)C1	ZINC000593995887	356081882	/nfs/dbraw/zinc/08/18/82/356081882.db2.gz	DAGXSPRORDMQFX-HNNXBMFYSA-N	1	1	305.378	1.891	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C[C@H](C)O)C2CC2)c1	ZINC000594057484	356102775	/nfs/dbraw/zinc/10/27/75/356102775.db2.gz	FXQSCHSXCNXLBB-JTQLQIEISA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@H](C)O)C2CC2)c1	ZINC000594057484	356102778	/nfs/dbraw/zinc/10/27/78/356102778.db2.gz	FXQSCHSXCNXLBB-JTQLQIEISA-N	1	1	308.334	1.727	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)CC1C[NH+](C)C1	ZINC000594847942	356336234	/nfs/dbraw/zinc/33/62/34/356336234.db2.gz	YAIFITWZCKECRR-UHFFFAOYSA-N	1	1	313.379	1.085	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1[N+](=O)[O-]	ZINC000595605762	356573290	/nfs/dbraw/zinc/57/32/90/356573290.db2.gz	FXXVXFIGDJUPCZ-CYBMUJFWSA-N	1	1	317.349	1.717	20	5		DDBDMO
C[C@@H](CO)[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595679780	356608267	/nfs/dbraw/zinc/60/82/67/356608267.db2.gz	YCZWQXSMSAQCKQ-FZMZJTMJSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000595744148	356632567	/nfs/dbraw/zinc/63/25/67/356632567.db2.gz	TVXJDOXJUXFWST-IATRGZMQSA-N	1	1	324.377	1.283	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3COC[C@]3(C)C2)c([N+](=O)[O-])c1	ZINC000595762098	356641869	/nfs/dbraw/zinc/64/18/69/356641869.db2.gz	ZXPOWZPUZRFGGD-WBMJQRKESA-N	1	1	322.361	1.951	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(COC2)C1	ZINC000595833481	356670078	/nfs/dbraw/zinc/67/00/78/356670078.db2.gz	KORNYVQGAPVJAC-NSHDSACASA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC2(COC2)C1	ZINC000595833481	356670081	/nfs/dbraw/zinc/67/00/81/356670081.db2.gz	KORNYVQGAPVJAC-NSHDSACASA-N	1	1	305.334	1.644	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000595823895	356665135	/nfs/dbraw/zinc/66/51/35/356665135.db2.gz	SYMVQVISVGYNDO-CYBMUJFWSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000595823895	356665137	/nfs/dbraw/zinc/66/51/37/356665137.db2.gz	SYMVQVISVGYNDO-CYBMUJFWSA-N	1	1	306.366	1.783	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H]2COC[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595826937	356665938	/nfs/dbraw/zinc/66/59/38/356665938.db2.gz	BESAWYNBWBZWAS-STQMWFEESA-N	1	1	319.361	1.892	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595869411	356686175	/nfs/dbraw/zinc/68/61/75/356686175.db2.gz	CWGFIAOHWNAVAQ-HSMVNMDESA-N	1	1	321.377	1.872	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](F)[C@H](N)C1	ZINC000595907458	356700747	/nfs/dbraw/zinc/70/07/47/356700747.db2.gz	UULMAFVUBRJTTL-CHWSQXEVSA-N	1	1	324.356	1.603	20	5		DDBDMO
CC(C)[C@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000596066581	356759353	/nfs/dbraw/zinc/75/93/53/356759353.db2.gz	GNFIFLIJFYVVGO-LBPRGKRZSA-N	1	1	310.354	1.464	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C2)C1	ZINC000596242838	356829758	/nfs/dbraw/zinc/82/97/58/356829758.db2.gz	ARNHOWRHHKRLGP-MRXNPFEDSA-N	1	1	318.377	1.616	20	5		DDBDMO
C[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CC[N@H+](C2CCC2)C1	ZINC000596241229	356829853	/nfs/dbraw/zinc/82/98/53/356829853.db2.gz	PQDBRYFSUFYABK-LLVKDONJSA-N	1	1	305.382	1.883	20	5		DDBDMO
CC[N@H+]1CCCN(c2nccc(C(N)=O)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000596269594	356838739	/nfs/dbraw/zinc/83/87/39/356838739.db2.gz	UTFJBNONMWGNSU-JTQLQIEISA-N	1	1	307.354	1.009	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C2([NH+](C)C)CC2)cc([N+](=O)[O-])c1	ZINC000597264984	357113994	/nfs/dbraw/zinc/11/39/94/357113994.db2.gz	GSRHMJVKDFDFOH-UHFFFAOYSA-N	1	1	307.306	1.414	20	5		DDBDMO
CCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597947224	357394536	/nfs/dbraw/zinc/39/45/36/357394536.db2.gz	WABXGJMKMGWTNT-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000598341624	357544461	/nfs/dbraw/zinc/54/44/61/357544461.db2.gz	DWFRANBJCXIICE-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1nccc(C(=O)OC)c1[N+](=O)[O-]	ZINC000598588079	357642149	/nfs/dbraw/zinc/64/21/49/357642149.db2.gz	YWWYDNQTDWJAFD-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CCc3c[nH+]cn3C2)c1[N+](=O)[O-]	ZINC000598625016	357659701	/nfs/dbraw/zinc/65/97/01/357659701.db2.gz	JSYKRPBJBCTTBB-VIFPVBQESA-N	1	1	317.305	1.400	20	5		DDBDMO
CCOC(=O)c1cc(NCC[N@H+]2CC[C@@H](O)C2)ccc1[N+](=O)[O-]	ZINC000599175700	357840453	/nfs/dbraw/zinc/84/04/53/357840453.db2.gz	INSCOMUYUHALKK-GFCCVEGCSA-N	1	1	323.349	1.250	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@@H]3C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000600190937	358150837	/nfs/dbraw/zinc/15/08/37/358150837.db2.gz	JSMKEBPMXYHHPJ-TXEJJXNPSA-N	1	1	306.318	1.598	20	5		DDBDMO
C[C@@H]([NH3+])[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000237358475	202242576	/nfs/dbraw/zinc/24/25/76/202242576.db2.gz	ZGLPHFSHTJEFLM-ZJUUUORDSA-N	1	1	317.349	1.671	20	5		DDBDMO
CN1CCC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O	ZINC000601125892	358412602	/nfs/dbraw/zinc/41/26/02/358412602.db2.gz	RLLLUUVABYEBKU-AWEZNQCLSA-N	1	1	300.318	1.598	20	5		DDBDMO
CN1CC[C@H]([NH+]2CCC(Nc3sccc3[N+](=O)[O-])CC2)C1=O	ZINC000601177572	358435177	/nfs/dbraw/zinc/43/51/77/358435177.db2.gz	XEGKBUHYKBCCLX-LBPRGKRZSA-N	1	1	324.406	1.763	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C[C@@H]1CC[N@@H+](C)C1	ZINC000602152955	358851190	/nfs/dbraw/zinc/85/11/90/358851190.db2.gz	ZPDFVMAATNBVIR-AWEZNQCLSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)CN1CCN(C)CC1	ZINC000602541899	359035821	/nfs/dbraw/zinc/03/58/21/359035821.db2.gz	SBSBZPXZGAVSIR-OAHLLOKOSA-N	1	1	320.437	1.610	20	5		DDBDMO
Cc1c(C[N@H+]2C[C@]3(C)C(=O)NC(=O)[C@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000602726441	359153186	/nfs/dbraw/zinc/15/31/86/359153186.db2.gz	WQMCXADCVWAZBL-IYBDPMFKSA-N	1	1	317.345	1.388	20	5		DDBDMO
Cn1cc(C[NH2+][C@@]2(CO)CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602799410	359199820	/nfs/dbraw/zinc/19/98/20/359199820.db2.gz	SMCCGSGGKYUOCZ-OAHLLOKOSA-N	1	1	302.334	1.252	20	5		DDBDMO
CC[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1c(C)nn(C)c1C	ZINC000602807555	359204348	/nfs/dbraw/zinc/20/43/48/359204348.db2.gz	BFUYQXNDTZXPIJ-GFCCVEGCSA-N	1	1	306.370	1.920	20	5		DDBDMO
CCOC1CC2(C1)CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C2	ZINC000602830027	359222384	/nfs/dbraw/zinc/22/23/84/359222384.db2.gz	ULQAJDGQRNIKAY-UHFFFAOYSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000602915118	359291755	/nfs/dbraw/zinc/29/17/55/359291755.db2.gz	JKZIHDPSPHUFJT-IDFMNXDXSA-N	1	1	312.395	1.085	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@@H+](C)[C@H](C(C)C)C1	ZINC000602950424	359316136	/nfs/dbraw/zinc/31/61/36/359316136.db2.gz	DXFMVGFDQALZSK-ZDUSSCGKSA-N	1	1	321.381	1.524	20	5		DDBDMO
O=[N+]([O-])c1ccccc1Cn1cc(C[N@H+]2CCC[C@@H]2CO)nn1	ZINC000603187274	359466409	/nfs/dbraw/zinc/46/64/09/359466409.db2.gz	PXAVPMNXWAZCEW-CQSZACIVSA-N	1	1	317.349	1.191	20	5		DDBDMO
O=[N+]([O-])c1ccccc1Cn1cc(C[N@@H+]2CCC[C@@H]2CO)nn1	ZINC000603187274	359466413	/nfs/dbraw/zinc/46/64/13/359466413.db2.gz	PXAVPMNXWAZCEW-CQSZACIVSA-N	1	1	317.349	1.191	20	5		DDBDMO
C[C@@H]1CC[C@](CO)([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000187963185	200184213	/nfs/dbraw/zinc/18/42/13/200184213.db2.gz	QOYFSAWGCNGBHS-DOMZBBRYSA-N	1	1	309.366	1.239	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000604278110	359732433	/nfs/dbraw/zinc/73/24/33/359732433.db2.gz	GMAQTXWHNLCGPJ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N[C@@H]1CCC[N@H+](C)C1	ZINC000604278110	359732436	/nfs/dbraw/zinc/73/24/36/359732436.db2.gz	GMAQTXWHNLCGPJ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1nn(CCC[NH+]2CCN(C(C)C)CC2)c(C)c1[N+](=O)[O-]	ZINC000188185146	200205607	/nfs/dbraw/zinc/20/56/07/200205607.db2.gz	JLISQZICEODZGS-UHFFFAOYSA-N	1	1	309.414	1.824	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609382543	360303132	/nfs/dbraw/zinc/30/31/32/360303132.db2.gz	BZOAUEGMORXJOI-CYBMUJFWSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000609546564	360322389	/nfs/dbraw/zinc/32/23/89/360322389.db2.gz	BAGDBMVBTDKVTH-CQSZACIVSA-N	1	1	306.366	1.607	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])C1	ZINC000610240011	360395741	/nfs/dbraw/zinc/39/57/41/360395741.db2.gz	VBYPZTSXGDZLIX-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@@H]2C[N@@H+]2CCC[C@H]2CO)s1	ZINC000374490958	307209113	/nfs/dbraw/zinc/20/91/13/307209113.db2.gz	XWLYQRBPCMUFOL-MNOVXSKESA-N	1	1	312.395	1.477	20	5		DDBDMO
CCO[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000612030394	360894373	/nfs/dbraw/zinc/89/43/73/360894373.db2.gz	UMSDEWJTKNQMKR-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC[NH+](CCCO)CC1)CCCC2	ZINC000565888746	304101391	/nfs/dbraw/zinc/10/13/91/304101391.db2.gz	AMYOFZSDOMUCOH-UHFFFAOYSA-N	1	1	320.393	1.373	20	5		DDBDMO
Cc1cn(C[C@H](O)C[N@H+](C)Cc2ccccc2)nc1[N+](=O)[O-]	ZINC000619525396	364048220	/nfs/dbraw/zinc/04/82/20/364048220.db2.gz	NSEGZLAVJQVBDZ-CQSZACIVSA-N	1	1	304.350	1.593	20	5		DDBDMO
COCCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293086505	223390223	/nfs/dbraw/zinc/39/02/23/223390223.db2.gz	KAMLJIMOBOHOFG-UHFFFAOYSA-N	1	1	307.350	1.389	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)CC[NH+]2CCOCC2)c1	ZINC000359279057	299392665	/nfs/dbraw/zinc/39/26/65/299392665.db2.gz	BRASWVPSMITRTK-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@H]1c1cccc(F)c1	ZINC000261924355	203154123	/nfs/dbraw/zinc/15/41/23/203154123.db2.gz	IWUQUCZDOQBZNV-ZDUSSCGKSA-N	1	1	318.308	1.849	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N(C)CC[N@@H+](C)C2CC2)c1	ZINC000351544861	284371002	/nfs/dbraw/zinc/37/10/02/284371002.db2.gz	NUDBAFOCUUUCLN-UHFFFAOYSA-N	1	1	307.350	1.912	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000334042161	249190180	/nfs/dbraw/zinc/19/01/80/249190180.db2.gz	GZFYJTBZHWJYGS-JQWIXIFHSA-N	1	1	307.350	1.816	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000274074020	211330997	/nfs/dbraw/zinc/33/09/97/211330997.db2.gz	VGCYSLPDSMHFMC-CYBMUJFWSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000274074020	211331002	/nfs/dbraw/zinc/33/10/02/211331002.db2.gz	VGCYSLPDSMHFMC-CYBMUJFWSA-N	1	1	304.350	1.631	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(CCOc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000284740401	218157250	/nfs/dbraw/zinc/15/72/50/218157250.db2.gz	DJIMXOKRVHQONB-HOTGVXAUSA-N	1	1	321.377	1.379	20	5		DDBDMO
CC(C)(C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000338670298	250084839	/nfs/dbraw/zinc/08/48/39/250084839.db2.gz	BQPFSPNPUCROKD-VXGBXAGGSA-N	1	1	321.381	1.269	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285007070	218253531	/nfs/dbraw/zinc/25/35/31/218253531.db2.gz	CUQFTWPTKMWMAR-JTQLQIEISA-N	1	1	309.370	1.558	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[NH+](CC(C)(C)O)CC2)c1[N+](=O)[O-]	ZINC000106399313	194207806	/nfs/dbraw/zinc/20/78/06/194207806.db2.gz	DQOZOPGAIQJQKN-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000110991877	194378392	/nfs/dbraw/zinc/37/83/92/194378392.db2.gz	MFJGGWJKWKODBV-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
C[N@H+](CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CC1	ZINC000058938180	184132297	/nfs/dbraw/zinc/13/22/97/184132297.db2.gz	WXHLXBQZIJVUEJ-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@@H+](CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CC1	ZINC000058938180	184132298	/nfs/dbraw/zinc/13/22/98/184132298.db2.gz	WXHLXBQZIJVUEJ-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])o1	ZINC000058969331	184132876	/nfs/dbraw/zinc/13/28/76/184132876.db2.gz	TYPJVMALEKWICN-UHFFFAOYSA-N	1	1	324.381	1.286	20	5		DDBDMO
CN(CCN(C)C1CC[NH+](C)CC1)C(=O)c1ccc([N+](=O)[O-])o1	ZINC000058969331	184132877	/nfs/dbraw/zinc/13/28/77/184132877.db2.gz	TYPJVMALEKWICN-UHFFFAOYSA-N	1	1	324.381	1.286	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000341042246	251350200	/nfs/dbraw/zinc/35/02/00/251350200.db2.gz	HEUQOASJMYLDNJ-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)C1	ZINC000491564788	532977031	/nfs/dbraw/zinc/97/70/31/532977031.db2.gz	ZAIKOVMKVHMVPY-GEXIGZQTSA-N	1	1	319.361	1.445	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000269524192	207620052	/nfs/dbraw/zinc/62/00/52/207620052.db2.gz	QXKWLIXDQHBRRO-ZDUSSCGKSA-N	1	1	307.350	1.124	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC3(C2)Oc2ccccc2O3)n1	ZINC000288756232	285167928	/nfs/dbraw/zinc/16/79/28/285167928.db2.gz	GVLVLQDUWYEXIM-UHFFFAOYSA-N	1	1	316.317	1.665	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC3(C2)Oc2ccccc2O3)n1	ZINC000288756232	285167930	/nfs/dbraw/zinc/16/79/30/285167930.db2.gz	GVLVLQDUWYEXIM-UHFFFAOYSA-N	1	1	316.317	1.665	20	5		DDBDMO
CCOCCO[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000157625795	197203135	/nfs/dbraw/zinc/20/31/35/197203135.db2.gz	FYOWEKCVPFTZSZ-JKSUJKDBSA-N	1	1	324.377	1.756	20	5		DDBDMO
C[N@@H+](CCOc1ccc(F)cc1)CCn1cc([N+](=O)[O-])cn1	ZINC000157472625	197190021	/nfs/dbraw/zinc/19/00/21/197190021.db2.gz	XBJGYUDKWWXDGJ-UHFFFAOYSA-N	1	1	308.313	1.941	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000157152882	197166904	/nfs/dbraw/zinc/16/69/04/197166904.db2.gz	SIUOQMCXZLWAGP-YPMHNXCESA-N	1	1	318.377	1.733	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+](CCO)Cc1cccnc1	ZINC000156770573	197139079	/nfs/dbraw/zinc/13/90/79/197139079.db2.gz	QTTFQJGOPFLOSB-UHFFFAOYSA-N	1	1	317.345	1.863	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000156328704	197104846	/nfs/dbraw/zinc/10/48/46/197104846.db2.gz	OXNUTDWMENWLEY-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000156328704	197104848	/nfs/dbraw/zinc/10/48/48/197104848.db2.gz	OXNUTDWMENWLEY-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000352798024	285307727	/nfs/dbraw/zinc/30/77/27/285307727.db2.gz	WYQUJYBNQKUMCP-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](O)C[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000414519801	224348773	/nfs/dbraw/zinc/34/87/73/224348773.db2.gz	BQXCRFBHWDGTSZ-CMPLNLGQSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](O)C[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000414519801	224348775	/nfs/dbraw/zinc/34/87/75/224348775.db2.gz	BQXCRFBHWDGTSZ-CMPLNLGQSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452071537	533327543	/nfs/dbraw/zinc/32/75/43/533327543.db2.gz	UMKDNEFYWOJEQQ-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452071537	533327548	/nfs/dbraw/zinc/32/75/48/533327548.db2.gz	UMKDNEFYWOJEQQ-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000283603090	296517163	/nfs/dbraw/zinc/51/71/63/296517163.db2.gz	TUUXIGVOZKDVGI-ZDUSSCGKSA-N	1	1	306.366	1.538	20	5		DDBDMO
C[C@H](CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[N@@H+](C)C1CC1	ZINC000068216797	406626568	/nfs/dbraw/zinc/62/65/68/406626568.db2.gz	XDEKJGZNXZTWIQ-SECBINFHSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@H+](C)C1CC1	ZINC000068216797	406626575	/nfs/dbraw/zinc/62/65/75/406626575.db2.gz	XDEKJGZNXZTWIQ-SECBINFHSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[N@@H+](C)C1CC1	ZINC000068216797	406626579	/nfs/dbraw/zinc/62/65/79/406626579.db2.gz	XDEKJGZNXZTWIQ-SECBINFHSA-N	1	1	317.349	1.684	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2CC[C@H](C1)[N@H+]2C	ZINC000073995425	406899940	/nfs/dbraw/zinc/89/99/40/406899940.db2.gz	ACIMKQBBZOCNOL-QWHCGFSZSA-N	1	1	321.381	1.185	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000054128496	407179544	/nfs/dbraw/zinc/17/95/44/407179544.db2.gz	PUEPXIGKWBVNLN-UHFFFAOYSA-N	1	1	315.395	1.750	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCCOC1	ZINC000107696853	407378305	/nfs/dbraw/zinc/37/83/05/407378305.db2.gz	MGEQTVWHGGWOIJ-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000127863095	407473234	/nfs/dbraw/zinc/47/32/34/407473234.db2.gz	GJQNSQADNRSFSJ-GHMZBOCLSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000127863095	407473242	/nfs/dbraw/zinc/47/32/42/407473242.db2.gz	GJQNSQADNRSFSJ-GHMZBOCLSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000127863095	407473247	/nfs/dbraw/zinc/47/32/47/407473247.db2.gz	GJQNSQADNRSFSJ-GHMZBOCLSA-N	1	1	323.397	1.825	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000112991252	407456088	/nfs/dbraw/zinc/45/60/88/407456088.db2.gz	RXRDTFGXKQPDQQ-HIFRSBDPSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000265795783	407459697	/nfs/dbraw/zinc/45/96/97/407459697.db2.gz	MKUSOXXRBLTAAT-GFCCVEGCSA-N	1	1	305.378	1.940	20	5		DDBDMO
CC[C@H]1CN(c2ncc(C)cc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000266225986	407533589	/nfs/dbraw/zinc/53/35/89/407533589.db2.gz	RODHGCRBOYKLJS-OLZOCXBDSA-N	1	1	308.382	1.580	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(C)(C)O	ZINC000266728936	407613505	/nfs/dbraw/zinc/61/35/05/407613505.db2.gz	JVKDEZLCCUKGBW-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[N@H+](CCc1cnccn1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000271347399	407646288	/nfs/dbraw/zinc/64/62/88/407646288.db2.gz	NXAGILZMHIGHHX-UHFFFAOYSA-N	1	1	315.333	1.158	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000271347399	407646292	/nfs/dbraw/zinc/64/62/92/407646292.db2.gz	NXAGILZMHIGHHX-UHFFFAOYSA-N	1	1	315.333	1.158	20	5		DDBDMO
C[NH+](C)[C@@H]1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1	ZINC000271374034	407658573	/nfs/dbraw/zinc/65/85/73/407658573.db2.gz	ZNGXKDNRJLKGBM-MRVPVSSYSA-N	1	1	319.408	1.200	20	5		DDBDMO
CCC(=O)N[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000130384450	407683214	/nfs/dbraw/zinc/68/32/14/407683214.db2.gz	KIRUGGZGXTZFRZ-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
Nc1ncc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1	ZINC000262005232	407707209	/nfs/dbraw/zinc/70/72/09/407707209.db2.gz	LRQDBSPICDPGNR-UHFFFAOYSA-N	1	1	319.390	1.956	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000186734106	407758832	/nfs/dbraw/zinc/75/88/32/407758832.db2.gz	AKOXCFSIXMDJPM-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@]2(CCOC2)C1	ZINC000153745702	407893616	/nfs/dbraw/zinc/89/36/16/407893616.db2.gz	YWBMAAQWCOMFIY-INIZCTEOSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@]2(CCOC2)C1	ZINC000153745702	407893623	/nfs/dbraw/zinc/89/36/23/407893623.db2.gz	YWBMAAQWCOMFIY-INIZCTEOSA-N	1	1	319.361	1.954	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCS[C@H]3COCC[C@@H]32)c1	ZINC000154472537	408040704	/nfs/dbraw/zinc/04/07/04/408040704.db2.gz	NVVMKYAMGGBPLV-KKUMJFAQSA-N	1	1	324.402	1.835	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000272672218	408008254	/nfs/dbraw/zinc/00/82/54/408008254.db2.gz	TYOQGPOYXPPVKK-MNOVXSKESA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000272672218	408008259	/nfs/dbraw/zinc/00/82/59/408008259.db2.gz	TYOQGPOYXPPVKK-MNOVXSKESA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000272672218	408008268	/nfs/dbraw/zinc/00/82/68/408008268.db2.gz	TYOQGPOYXPPVKK-MNOVXSKESA-N	1	1	321.381	1.608	20	5		DDBDMO
Cn1cnc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1	ZINC000090969441	161688434	/nfs/dbraw/zinc/68/84/34/161688434.db2.gz	KULSMNZTVQZSLG-CYBMUJFWSA-N	1	1	301.350	1.834	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCN1CCOCC1	ZINC000175173760	408068449	/nfs/dbraw/zinc/06/84/49/408068449.db2.gz	IMVRAWFIVVNYRE-UHFFFAOYSA-N	1	1	323.393	1.758	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCN1CCOCC1	ZINC000175173760	408068456	/nfs/dbraw/zinc/06/84/56/408068456.db2.gz	IMVRAWFIVVNYRE-UHFFFAOYSA-N	1	1	323.393	1.758	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000245854048	408079234	/nfs/dbraw/zinc/07/92/34/408079234.db2.gz	DHDIXYGCFMVVKX-QWRGUYRKSA-N	1	1	307.354	1.027	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCOCC12CCC2	ZINC000182229227	408099821	/nfs/dbraw/zinc/09/98/21/408099821.db2.gz	JTJDLOAHIWSSTK-ZDUSSCGKSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCOCC12CCC2	ZINC000182229227	408099825	/nfs/dbraw/zinc/09/98/25/408099825.db2.gz	JTJDLOAHIWSSTK-ZDUSSCGKSA-N	1	1	322.361	1.589	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@@H]1C	ZINC000155339321	408156518	/nfs/dbraw/zinc/15/65/18/408156518.db2.gz	XZVMHIZQSMTWGO-IINYFYTJSA-N	1	1	306.366	1.757	20	5		DDBDMO
CCN(CC)C(=O)[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000176243157	408322337	/nfs/dbraw/zinc/32/23/37/408322337.db2.gz	LEFSWTBBVJQSIH-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
C[C@H](CO)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000131949828	162026143	/nfs/dbraw/zinc/02/61/43/162026143.db2.gz	CCLDMWGZBGACCH-SNVBAGLBSA-N	1	1	309.322	1.205	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1(CO)CCOCC1	ZINC000190990138	408352802	/nfs/dbraw/zinc/35/28/02/408352802.db2.gz	OYAPTFYJXBUAJI-UHFFFAOYSA-N	1	1	323.349	1.007	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177052922	408509005	/nfs/dbraw/zinc/50/90/05/408509005.db2.gz	MAQJNIZZMIJFJP-WCQYABFASA-N	1	1	303.362	1.879	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000248457536	408570669	/nfs/dbraw/zinc/57/06/69/408570669.db2.gz	MKFVNZSTJWOKKL-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](c1cccnc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680740	408633447	/nfs/dbraw/zinc/63/34/47/408633447.db2.gz	UPNOSDPQCLECKZ-RISCZKNCSA-N	1	1	305.338	1.240	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270858191	408712196	/nfs/dbraw/zinc/71/21/96/408712196.db2.gz	HTSLTFKLXPPEAY-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270858191	408712197	/nfs/dbraw/zinc/71/21/97/408712197.db2.gz	HTSLTFKLXPPEAY-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
CN(C(=O)C[N@H+](CCO)C1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000275902707	408715624	/nfs/dbraw/zinc/71/56/24/408715624.db2.gz	VHSOUQZJEWMURV-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@@H+](CCO)C1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000275902707	408715627	/nfs/dbraw/zinc/71/56/27/408715627.db2.gz	VHSOUQZJEWMURV-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CCN1CC[NH+]([C@@H]2CCN(c3cc(N)ccc3[N+](=O)[O-])C2)CC1	ZINC000193419679	408718048	/nfs/dbraw/zinc/71/80/48/408718048.db2.gz	SLZHPZZPHFLCFV-CQSZACIVSA-N	1	1	319.409	1.393	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@H]1CO	ZINC000249515287	408737154	/nfs/dbraw/zinc/73/71/54/408737154.db2.gz	BZMPORYJMHIJSV-STQMWFEESA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000162188073	408677149	/nfs/dbraw/zinc/67/71/49/408677149.db2.gz	QGPXBEOJJMUXCH-GFCCVEGCSA-N	1	1	323.397	1.570	20	5		DDBDMO
CC(C)C[C@H](CO)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000185311934	408794376	/nfs/dbraw/zinc/79/43/76/408794376.db2.gz	RSTQQFAUUHFCAQ-OAHLLOKOSA-N	1	1	323.393	1.896	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000249764531	408764142	/nfs/dbraw/zinc/76/41/42/408764142.db2.gz	ZRXVHYRLFMPWOJ-NEPJUHHUSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@H+](C)C1CC1	ZINC000290796303	408834775	/nfs/dbraw/zinc/83/47/75/408834775.db2.gz	PBTRBERSGXKIDZ-ZDUSSCGKSA-N	1	1	308.334	1.631	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])c(=O)c3ccccc32)CCO1	ZINC000291703326	408910207	/nfs/dbraw/zinc/91/02/07/408910207.db2.gz	UQHUAOQHUAOBAX-GFCCVEGCSA-N	1	1	317.345	1.630	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])c(=O)c3ccccc32)CCO1	ZINC000291703326	408910210	/nfs/dbraw/zinc/91/02/10/408910210.db2.gz	UQHUAOQHUAOBAX-GFCCVEGCSA-N	1	1	317.345	1.630	20	5		DDBDMO
CN(C(=O)c1c(N)cccc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000286219292	408943916	/nfs/dbraw/zinc/94/39/16/408943916.db2.gz	NJSBWOPBXYSTMP-FOSCPWQOSA-N	1	1	318.377	1.874	20	5		DDBDMO
[NH3+]CC[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000281965691	408963044	/nfs/dbraw/zinc/96/30/44/408963044.db2.gz	NJPUZKLEHYBWQA-SNVBAGLBSA-N	1	1	317.349	1.672	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000277760508	409007153	/nfs/dbraw/zinc/00/71/53/409007153.db2.gz	RFRUZDDHZUDSJB-UHFFFAOYSA-N	1	1	308.338	1.252	20	5		DDBDMO
C[C@@H]1CN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293425314	409110444	/nfs/dbraw/zinc/11/04/44/409110444.db2.gz	NIWCFUDNCHPELC-MJBXVCDLSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000293425314	409110446	/nfs/dbraw/zinc/11/04/46/409110446.db2.gz	NIWCFUDNCHPELC-MJBXVCDLSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000293425314	409110448	/nfs/dbraw/zinc/11/04/48/409110448.db2.gz	NIWCFUDNCHPELC-MJBXVCDLSA-N	1	1	323.393	1.359	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283623734	409185869	/nfs/dbraw/zinc/18/58/69/409185869.db2.gz	AXWCDJBBTZFICT-SNVBAGLBSA-N	1	1	324.356	1.730	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cccc(Cl)c3[N+](=O)[O-])C[C@H]2C1	ZINC000279260547	409180253	/nfs/dbraw/zinc/18/02/53/409180253.db2.gz	WXUOKKBAPUNRPA-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000283804677	409220164	/nfs/dbraw/zinc/22/01/64/409220164.db2.gz	WFAGWXIRKLFVLS-UHFFFAOYSA-N	1	1	300.330	1.953	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000293993722	409222547	/nfs/dbraw/zinc/22/25/47/409222547.db2.gz	ODIUPYSXUPQMEF-BETUJISGSA-N	1	1	321.377	1.833	20	5		DDBDMO
COCCC[N@H+](C)CCN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284229748	409299985	/nfs/dbraw/zinc/29/99/85/409299985.db2.gz	UMSDPPXVCFYABN-LBPRGKRZSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCCC[N@@H+](C)CCN[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284229748	409299988	/nfs/dbraw/zinc/29/99/88/409299988.db2.gz	UMSDPPXVCFYABN-LBPRGKRZSA-N	1	1	310.398	1.796	20	5		DDBDMO
C[C@H]([N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C(C)(C)O	ZINC000295225034	409386098	/nfs/dbraw/zinc/38/60/98/409386098.db2.gz	WCUYLEZGANTFAM-NSHDSACASA-N	1	1	309.366	1.649	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1(C)C	ZINC000295978840	409390182	/nfs/dbraw/zinc/39/01/82/409390182.db2.gz	KWWSZAMVLJDHSQ-CQSZACIVSA-N	1	1	321.377	1.941	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000295154635	409348399	/nfs/dbraw/zinc/34/83/99/409348399.db2.gz	DBCHNWJTOAYGBP-AWEZNQCLSA-N	1	1	311.313	1.134	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000295387689	409461126	/nfs/dbraw/zinc/46/11/26/409461126.db2.gz	BCBKJRAIKRZMMJ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000295387689	409461134	/nfs/dbraw/zinc/46/11/34/409461134.db2.gz	BCBKJRAIKRZMMJ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1ccc2c(c1)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CCO2	ZINC000285458143	409451338	/nfs/dbraw/zinc/45/13/38/409451338.db2.gz	GTAQDEGGDUXBRK-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
Cc1ccc2c(c1)C[N@H+](CCn1ccc([N+](=O)[O-])n1)CCO2	ZINC000285458143	409451341	/nfs/dbraw/zinc/45/13/41/409451341.db2.gz	GTAQDEGGDUXBRK-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
CNc1c(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000318614214	164032196	/nfs/dbraw/zinc/03/21/96/164032196.db2.gz	JBPICLVSDFZJQV-JTQLQIEISA-N	1	1	306.366	1.849	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000342351351	409585726	/nfs/dbraw/zinc/58/57/26/409585726.db2.gz	WSQKKNIVLYZBIC-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000304305561	409601532	/nfs/dbraw/zinc/60/15/32/409601532.db2.gz	JRSVQZPDZCJNEG-FZMZJTMJSA-N	1	1	307.350	1.403	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@H]3CC[N@@H+](C)[C@@H](C)C3)n2)n1C	ZINC000331647008	409730114	/nfs/dbraw/zinc/73/01/14/409730114.db2.gz	YPKJTFXLNYEOTN-WPRPVWTQSA-N	1	1	320.353	1.884	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCOC[C@@H]2[C@H]2CCC[C@@H]2O)cc1	ZINC000332024449	409810530	/nfs/dbraw/zinc/81/05/30/409810530.db2.gz	ZYTCQYXWZHDMCZ-OAGGEKHMSA-N	1	1	306.362	1.957	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCOC[C@@H]2[C@H]2CCC[C@@H]2O)cc1	ZINC000332024449	409810537	/nfs/dbraw/zinc/81/05/37/409810537.db2.gz	ZYTCQYXWZHDMCZ-OAGGEKHMSA-N	1	1	306.362	1.957	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000342832072	409936024	/nfs/dbraw/zinc/93/60/24/409936024.db2.gz	RAKJHVBUHNXXMK-GFCCVEGCSA-N	1	1	309.351	1.078	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229641	409999454	/nfs/dbraw/zinc/99/94/54/409999454.db2.gz	PNOCBPXJUQZSFQ-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229641	409999461	/nfs/dbraw/zinc/99/94/61/409999461.db2.gz	PNOCBPXJUQZSFQ-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H]1CC(=O)N(C)C1=O	ZINC000338967545	410052522	/nfs/dbraw/zinc/05/25/22/410052522.db2.gz	GODFLCLBOXFASI-AWEZNQCLSA-N	1	1	319.361	1.873	20	5		DDBDMO
CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@H]1CC(=O)N(C)C1=O	ZINC000338967545	410052526	/nfs/dbraw/zinc/05/25/26/410052526.db2.gz	GODFLCLBOXFASI-AWEZNQCLSA-N	1	1	319.361	1.873	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000279677536	287101845	/nfs/dbraw/zinc/10/18/45/287101845.db2.gz	DZPJWMIDIFDAMA-RISCZKNCSA-N	1	1	321.377	1.819	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000339389468	410151083	/nfs/dbraw/zinc/15/10/83/410151083.db2.gz	CCSAYMMOILPBAN-HZPDHXFCSA-N	1	1	305.378	1.890	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000351826457	410268021	/nfs/dbraw/zinc/26/80/21/410268021.db2.gz	KBFVHADWRBKBPM-IINYFYTJSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000351773563	410223375	/nfs/dbraw/zinc/22/33/75/410223375.db2.gz	HFFCSLWHRYPXEV-SKDRFNHKSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000351773563	410223377	/nfs/dbraw/zinc/22/33/77/410223377.db2.gz	HFFCSLWHRYPXEV-SKDRFNHKSA-N	1	1	304.306	1.457	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](CC)CN1C(C)=O	ZINC000357907371	410321052	/nfs/dbraw/zinc/32/10/52/410321052.db2.gz	FEJWCSRNMBXCBN-UONOGXRCSA-N	1	1	323.397	1.513	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)N1C	ZINC000339618880	410332882	/nfs/dbraw/zinc/33/28/82/410332882.db2.gz	GNSGIIAPTLFDFG-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)N1C	ZINC000339621171	410338645	/nfs/dbraw/zinc/33/86/45/410338645.db2.gz	GERMDTZPVSWVJV-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[N@@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000343274611	410301029	/nfs/dbraw/zinc/30/10/29/410301029.db2.gz	RXHODGYHIYKQOH-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000343274611	410301033	/nfs/dbraw/zinc/30/10/33/410301033.db2.gz	RXHODGYHIYKQOH-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
C[C@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCC[C@H](C)C1	ZINC000298755318	410382010	/nfs/dbraw/zinc/38/20/10/410382010.db2.gz	YACISCNPJBTAGD-WDEREUQCSA-N	1	1	321.381	1.621	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@@H+]2CC=C(C)CC2)cc1[N+](=O)[O-]	ZINC000355333686	410448054	/nfs/dbraw/zinc/44/80/54/410448054.db2.gz	HJXGWKHVNNYGSB-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1	ZINC000301075484	410650392	/nfs/dbraw/zinc/65/03/92/410650392.db2.gz	BLLYGSMMXQVQSX-SNVBAGLBSA-N	1	1	320.349	1.679	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343851582	410746562	/nfs/dbraw/zinc/74/65/62/410746562.db2.gz	DMPRQEQLFFAHNJ-TZMCWYRMSA-N	1	1	320.393	1.919	20	5		DDBDMO
COc1c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000356003968	410770994	/nfs/dbraw/zinc/77/09/94/410770994.db2.gz	QXBJXKCUVIGDMM-GFCCVEGCSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000344044934	410918813	/nfs/dbraw/zinc/91/88/13/410918813.db2.gz	XVGBWYJJIGANLG-CQDKDKBSSA-N	1	1	319.361	1.626	20	5		DDBDMO
C[C@@H]1[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080044	410935852	/nfs/dbraw/zinc/93/58/52/410935852.db2.gz	XGQMVQPEAGSVAE-GXTWGEPZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080044	410935856	/nfs/dbraw/zinc/93/58/56/410935856.db2.gz	XGQMVQPEAGSVAE-GXTWGEPZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@@H]21	ZINC000129187114	196027307	/nfs/dbraw/zinc/02/73/07/196027307.db2.gz	ZXCFQFNQFWDPJU-OCCSQVGLSA-N	1	1	318.377	1.733	20	5		DDBDMO
Cc1cc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])no1	ZINC000580251532	422906618	/nfs/dbraw/zinc/90/66/18/422906618.db2.gz	JIMNEPNIYZGRLD-LBPRGKRZSA-N	1	1	307.306	1.421	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](CO)C(C)(C)C	ZINC000134430180	196390307	/nfs/dbraw/zinc/39/03/07/196390307.db2.gz	KCHITKAVBHBWOQ-CYBMUJFWSA-N	1	1	309.366	1.533	20	5		DDBDMO
O=C(N[C@H]1CC12CC[NH2+]CC2)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000366556507	418489284	/nfs/dbraw/zinc/48/92/84/418489284.db2.gz	PODIHHXYWOPHCI-LBPRGKRZSA-N	1	1	315.333	1.343	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000374836175	418568040	/nfs/dbraw/zinc/56/80/40/418568040.db2.gz	ZICQNKHAXYJCMX-UWVGGRQHSA-N	1	1	322.340	1.673	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c3nonc32)CC1	ZINC000375509499	418651374	/nfs/dbraw/zinc/65/13/74/418651374.db2.gz	WCAYVFXLMZRSIY-JTQLQIEISA-N	1	1	321.337	1.024	20	5		DDBDMO
CCOc1cc(C[N@@H+](CCO)[C@H]2CCO[C@H]2C)ccc1[N+](=O)[O-]	ZINC000361584683	418685967	/nfs/dbraw/zinc/68/59/67/418685967.db2.gz	FXXXBGZECLMMND-JSGCOSHPSA-N	1	1	324.377	1.965	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[N@H+]3CCC[C@H]3CO1)CCN2	ZINC000365542874	418872806	/nfs/dbraw/zinc/87/28/06/418872806.db2.gz	CBCZIJHOAXOHMA-RYUDHWBXSA-N	1	1	318.377	1.838	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@]23CCOC3)c1	ZINC000421041760	419466145	/nfs/dbraw/zinc/46/61/45/419466145.db2.gz	YPJDGCDNRPXWOY-DZGCQCFKSA-N	1	1	308.334	1.199	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@](C)(F)C1	ZINC000423691741	420129070	/nfs/dbraw/zinc/12/90/70/420129070.db2.gz	PXKVCSAARVWHJV-HNNXBMFYSA-N	1	1	309.341	1.985	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](N2CCCC2=O)C1	ZINC000430229498	420092102	/nfs/dbraw/zinc/09/21/02/420092102.db2.gz	VVZCUJJQRPHDSV-CQSZACIVSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](N2CCCC2=O)C1	ZINC000430229498	420092107	/nfs/dbraw/zinc/09/21/07/420092107.db2.gz	VVZCUJJQRPHDSV-CQSZACIVSA-N	1	1	319.361	1.800	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](CN)C1CC1	ZINC000420309767	420198117	/nfs/dbraw/zinc/19/81/17/420198117.db2.gz	FMYMJTMHFMNPHN-CQSZACIVSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](CN)C1CC1	ZINC000420309767	420198123	/nfs/dbraw/zinc/19/81/23/420198123.db2.gz	FMYMJTMHFMNPHN-CQSZACIVSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000430968964	420229087	/nfs/dbraw/zinc/22/90/87/420229087.db2.gz	ZVFKQJNQPJGQIG-ZDUSSCGKSA-N	1	1	320.393	1.773	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000457063517	420599997	/nfs/dbraw/zinc/59/99/97/420599997.db2.gz	VZEUAOGWBQCSQG-UHFFFAOYSA-N	1	1	307.354	1.176	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000442309772	420679178	/nfs/dbraw/zinc/67/91/78/420679178.db2.gz	UDOXXMQARJQSRQ-WDEREUQCSA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000442309772	420679184	/nfs/dbraw/zinc/67/91/84/420679184.db2.gz	UDOXXMQARJQSRQ-WDEREUQCSA-N	1	1	320.349	1.084	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000456066594	421094532	/nfs/dbraw/zinc/09/45/32/421094532.db2.gz	MMXGZNZUYJPBJU-LLVKDONJSA-N	1	1	321.381	1.634	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000449747227	421074054	/nfs/dbraw/zinc/07/40/54/421074054.db2.gz	WDVRPGBWWRPORV-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000449747227	421074057	/nfs/dbraw/zinc/07/40/57/421074057.db2.gz	WDVRPGBWWRPORV-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)NC	ZINC000449771357	421080134	/nfs/dbraw/zinc/08/01/34/421080134.db2.gz	GPCIVJQEVADDIB-SNVBAGLBSA-N	1	1	317.292	1.810	20	5		DDBDMO
CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(=O)NC	ZINC000449771356	421080442	/nfs/dbraw/zinc/08/04/42/421080442.db2.gz	GPCIVJQEVADDIB-JTQLQIEISA-N	1	1	317.292	1.810	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000456340493	421143685	/nfs/dbraw/zinc/14/36/85/421143685.db2.gz	DMAYOKSFELMQFK-NSHDSACASA-N	1	1	309.370	1.193	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000456340493	421143689	/nfs/dbraw/zinc/14/36/89/421143689.db2.gz	DMAYOKSFELMQFK-NSHDSACASA-N	1	1	309.370	1.193	20	5		DDBDMO
CNc1nc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1[N+](=O)[O-]	ZINC000456333749	421144296	/nfs/dbraw/zinc/14/42/96/421144296.db2.gz	UBDQCTCOIRJNDC-FGWVZKOKSA-N	1	1	319.365	1.387	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000456356787	421147441	/nfs/dbraw/zinc/14/74/41/421147441.db2.gz	RYUJHUOEQZMVDA-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000524783286	421273098	/nfs/dbraw/zinc/27/30/98/421273098.db2.gz	FTGMFNKPELCJOC-YPMHNXCESA-N	1	1	306.366	1.877	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CCC[C@@]2(C)CO)c([N+](=O)[O-])c1	ZINC000546103350	421284691	/nfs/dbraw/zinc/28/46/91/421284691.db2.gz	OIKBKMZESPWIAQ-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CCC[C@@]2(C)CO)c([N+](=O)[O-])c1	ZINC000546103350	421284696	/nfs/dbraw/zinc/28/46/96/421284696.db2.gz	OIKBKMZESPWIAQ-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000516225688	421535119	/nfs/dbraw/zinc/53/51/19/421535119.db2.gz	ATCQPMDXXIVKGQ-GXTWGEPZSA-N	1	1	321.377	1.535	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000518878252	421670942	/nfs/dbraw/zinc/67/09/42/421670942.db2.gz	ITSNTNQEORYLLY-LLVKDONJSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000521992784	421809464	/nfs/dbraw/zinc/80/94/64/421809464.db2.gz	QKCAJEPLJXAXJR-UHFFFAOYSA-N	1	1	321.333	1.491	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1	ZINC000542836922	421831230	/nfs/dbraw/zinc/83/12/30/421831230.db2.gz	AVBNXEWQFBJOPS-UHFFFAOYSA-N	1	1	321.381	1.750	20	5		DDBDMO
C[C@H]1C[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1C1CC1	ZINC000584383765	422299098	/nfs/dbraw/zinc/29/90/98/422299098.db2.gz	PEOQRFYKDGKYIK-UWVGGRQHSA-N	1	1	302.338	1.675	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594591226	422351586	/nfs/dbraw/zinc/35/15/86/422351586.db2.gz	IHRIXKCGSOYKKG-RWMBFGLXSA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594591226	422351591	/nfs/dbraw/zinc/35/15/91/422351591.db2.gz	IHRIXKCGSOYKKG-RWMBFGLXSA-N	1	1	308.382	2.208	20	5		DDBDMO
Nc1ncc2c(n1)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC2	ZINC000598950859	422400274	/nfs/dbraw/zinc/40/02/74/422400274.db2.gz	USVRXQKSAITSCM-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
Nc1ncc2c(n1)C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC2	ZINC000598950859	422400280	/nfs/dbraw/zinc/40/02/80/422400280.db2.gz	USVRXQKSAITSCM-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
CC1(C)COCC[N@@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000179299962	263357684	/nfs/dbraw/zinc/35/76/84/263357684.db2.gz	RCEMWLAYMJNFGV-UHFFFAOYSA-N	1	1	320.353	1.160	20	5		DDBDMO
CC1(C)COCC[N@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000179299962	263357685	/nfs/dbraw/zinc/35/76/85/263357685.db2.gz	RCEMWLAYMJNFGV-UHFFFAOYSA-N	1	1	320.353	1.160	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000342365438	271390701	/nfs/dbraw/zinc/39/07/01/271390701.db2.gz	VYYKYQXPAUYICL-QWRGUYRKSA-N	1	1	322.365	1.979	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000345449492	272254128	/nfs/dbraw/zinc/25/41/28/272254128.db2.gz	AUHRVGDZHWFGRF-LBPRGKRZSA-N	1	1	308.382	1.928	20	5		DDBDMO
CCOc1ccc(C(=O)NC[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000347745996	272749354	/nfs/dbraw/zinc/74/93/54/272749354.db2.gz	LFLAFXOOBXYZDV-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H](C)OC	ZINC000291143840	276082219	/nfs/dbraw/zinc/08/22/19/276082219.db2.gz	DBHUNVWLIGBSHD-GFCCVEGCSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H](C)OC	ZINC000291143840	276082220	/nfs/dbraw/zinc/08/22/20/276082220.db2.gz	DBHUNVWLIGBSHD-GFCCVEGCSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC[N@H+](CCCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000266865739	276123924	/nfs/dbraw/zinc/12/39/24/276123924.db2.gz	MLHXXBWSQYYIPH-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
CC[N@@H+](CCCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000266865739	276123926	/nfs/dbraw/zinc/12/39/26/276123926.db2.gz	MLHXXBWSQYYIPH-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000152354101	277204949	/nfs/dbraw/zinc/20/49/49/277204949.db2.gz	FJNHRGXRVABBLC-UHFFFAOYSA-N	1	1	324.381	1.091	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000334047271	277238826	/nfs/dbraw/zinc/23/88/26/277238826.db2.gz	BECTZVWVHOSCIZ-NEPJUHHUSA-N	1	1	306.366	1.968	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC[NH2+]1	ZINC000088059421	288240338	/nfs/dbraw/zinc/24/03/38/288240338.db2.gz	VKWCVDIGVLMFHX-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@](O)(C(N)=O)C1	ZINC000286103542	281021172	/nfs/dbraw/zinc/02/11/72/281021172.db2.gz	IMKWPJREWIEHLL-XHDPSFHLSA-N	1	1	307.350	1.276	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH2+]C[C@H]1C	ZINC000193354631	288575104	/nfs/dbraw/zinc/57/51/04/288575104.db2.gz	SIAOQXNWBVCDNF-SNVBAGLBSA-N	1	1	313.379	1.140	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NCc1c[nH+]c2n1CCCC2	ZINC000367647539	300867697	/nfs/dbraw/zinc/86/76/97/300867697.db2.gz	YERXPBZPPNPTSW-UHFFFAOYSA-N	1	1	315.333	1.640	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000369800030	301226611	/nfs/dbraw/zinc/22/66/11/301226611.db2.gz	QULYFLJBAYXYFX-LSDHHAIUSA-N	1	1	324.381	1.451	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000369800030	301226614	/nfs/dbraw/zinc/22/66/14/301226614.db2.gz	QULYFLJBAYXYFX-LSDHHAIUSA-N	1	1	324.381	1.451	20	5		DDBDMO
CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000369912999	301238872	/nfs/dbraw/zinc/23/88/72/301238872.db2.gz	MLUACXOGYBHBNP-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000369912999	301238874	/nfs/dbraw/zinc/23/88/74/301238874.db2.gz	MLUACXOGYBHBNP-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000369912999	301238876	/nfs/dbraw/zinc/23/88/76/301238876.db2.gz	MLUACXOGYBHBNP-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079655	302140399	/nfs/dbraw/zinc/14/03/99/302140399.db2.gz	CVGROMQSKOONJR-NGFQHRJXSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000377079655	302140402	/nfs/dbraw/zinc/14/04/02/302140402.db2.gz	CVGROMQSKOONJR-NGFQHRJXSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079655	302140405	/nfs/dbraw/zinc/14/04/05/302140405.db2.gz	CVGROMQSKOONJR-NGFQHRJXSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@@H]1C	ZINC000532134478	303276267	/nfs/dbraw/zinc/27/62/67/303276267.db2.gz	ZCMFMQXNBZBRBK-NWDGAFQWSA-N	1	1	306.366	1.983	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000532142870	303276822	/nfs/dbraw/zinc/27/68/22/303276822.db2.gz	FNNFUJCCBZUYPX-LBPRGKRZSA-N	1	1	306.366	1.794	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21	ZINC000535043460	303341787	/nfs/dbraw/zinc/34/17/87/303341787.db2.gz	YIWLGLPOPPXZOG-LBPRGKRZSA-N	1	1	315.333	1.245	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21	ZINC000535043460	303341788	/nfs/dbraw/zinc/34/17/88/303341788.db2.gz	YIWLGLPOPPXZOG-LBPRGKRZSA-N	1	1	315.333	1.245	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1CO	ZINC000362090447	307014090	/nfs/dbraw/zinc/01/40/90/307014090.db2.gz	NHQPITCKCCIFJK-WCQYABFASA-N	1	1	319.361	1.044	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2nc(C)ccc2[N+](=O)[O-])CC1	ZINC000363786592	307035915	/nfs/dbraw/zinc/03/59/15/307035915.db2.gz	VDXWLGKVBADXFF-UHFFFAOYSA-N	1	1	308.382	1.847	20	5		DDBDMO
CCn1nccc1CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000367254244	307089870	/nfs/dbraw/zinc/08/98/70/307089870.db2.gz	WALWFYGIZUNUBV-CQSZACIVSA-N	1	1	318.381	1.887	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](O)C2(CC2)C1	ZINC000368793734	307109823	/nfs/dbraw/zinc/10/98/23/307109823.db2.gz	ZJROLWVVGQXEAM-CQSZACIVSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1c([N+](=O)[O-])ncn1C	ZINC000369644806	307125714	/nfs/dbraw/zinc/12/57/14/307125714.db2.gz	AKOLYITZDHWXEC-LBPRGKRZSA-N	1	1	323.397	1.013	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC23CCCCC3)c1	ZINC000371164666	307143820	/nfs/dbraw/zinc/14/38/20/307143820.db2.gz	JPUHGQYMJSMEKA-AWEZNQCLSA-N	1	1	308.382	1.951	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)n1	ZINC000373164193	307180551	/nfs/dbraw/zinc/18/05/51/307180551.db2.gz	DBUGOYITADFACY-SNVBAGLBSA-N	1	1	307.354	1.075	20	5		DDBDMO
CCc1[nH+]ccn1C[C@H]1CCCN1c1ncc([N+](=O)[O-])cn1	ZINC000373393257	307187194	/nfs/dbraw/zinc/18/71/94/307187194.db2.gz	OLYFTETWVXAADH-LLVKDONJSA-N	1	1	302.338	1.813	20	5		DDBDMO
CC(C)O[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000570926352	308185825	/nfs/dbraw/zinc/18/58/25/308185825.db2.gz	WCOBEQBLAIYVCG-GDBMZVCRSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H](CCN(C)C)[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460686	308316053	/nfs/dbraw/zinc/31/60/53/308316053.db2.gz	XDXVCNRKCMJCMO-JSGCOSHPSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@@H](CC[NH+](C)C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460686	308316054	/nfs/dbraw/zinc/31/60/54/308316054.db2.gz	XDXVCNRKCMJCMO-JSGCOSHPSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000583892210	337384087	/nfs/dbraw/zinc/38/40/87/337384087.db2.gz	ZIFGKSKNRJFWGB-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000488728639	484215215	/nfs/dbraw/zinc/21/52/15/484215215.db2.gz	FLAAXYDCEIKKJP-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000331338433	533922893	/nfs/dbraw/zinc/92/28/93/533922893.db2.gz	JMEIXTJWSHQKBG-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1C	ZINC000331338433	533922897	/nfs/dbraw/zinc/92/28/97/533922897.db2.gz	JMEIXTJWSHQKBG-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1C	ZINC000331338433	533922903	/nfs/dbraw/zinc/92/29/03/533922903.db2.gz	JMEIXTJWSHQKBG-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330895787	534104317	/nfs/dbraw/zinc/10/43/17/534104317.db2.gz	GJWAYHMYYYVHRG-RYUDHWBXSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000154783452	525661710	/nfs/dbraw/zinc/66/17/10/525661710.db2.gz	ALQFSOYTBYEBRJ-ZANVPECISA-N	1	1	310.310	1.634	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000154783452	525661716	/nfs/dbraw/zinc/66/17/16/525661716.db2.gz	ALQFSOYTBYEBRJ-ZANVPECISA-N	1	1	310.310	1.634	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21	ZINC000157291375	527312498	/nfs/dbraw/zinc/31/24/98/527312498.db2.gz	RWEKLBAYMSAYKS-SWLSCSKDSA-N	1	1	318.377	1.855	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000451938520	527789690	/nfs/dbraw/zinc/78/96/90/527789690.db2.gz	OEUMTEMZJQTHOG-LERXQTSPSA-N	1	1	323.349	1.315	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000302485920	528311586	/nfs/dbraw/zinc/31/15/86/528311586.db2.gz	YKKMEMRJKHOSHX-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000797418619	700008562	/nfs/dbraw/zinc/00/85/62/700008562.db2.gz	ZNJLTDIICDCOIZ-OAHLLOKOSA-N	1	1	317.349	1.360	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000108459085	696634002	/nfs/dbraw/zinc/63/40/02/696634002.db2.gz	ARVIPMGGDRHOCR-LBPRGKRZSA-N	1	1	318.377	1.700	20	5		DDBDMO
C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)(C)S(C)(=O)=O	ZINC000124272333	696741076	/nfs/dbraw/zinc/74/10/76/696741076.db2.gz	GIXLBNUEVGSPIH-UHFFFAOYSA-N	1	1	314.407	1.892	20	5		DDBDMO
C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(C)(C)S(C)(=O)=O	ZINC000124272333	696741080	/nfs/dbraw/zinc/74/10/80/696741080.db2.gz	GIXLBNUEVGSPIH-UHFFFAOYSA-N	1	1	314.407	1.892	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000151638373	696888668	/nfs/dbraw/zinc/88/86/68/696888668.db2.gz	AUTOJLBROOHCNB-NSHDSACASA-N	1	1	318.333	1.787	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000151638373	696888669	/nfs/dbraw/zinc/88/86/69/696888669.db2.gz	AUTOJLBROOHCNB-NSHDSACASA-N	1	1	318.333	1.787	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582168	698121192	/nfs/dbraw/zinc/12/11/92/698121192.db2.gz	RVCURFPACBJKPP-KGLIPLIRSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@@H+]1CCO	ZINC000777831399	698225561	/nfs/dbraw/zinc/22/55/61/698225561.db2.gz	CVLQEYWPGCWLCU-JTQLQIEISA-N	1	1	322.390	1.707	20	5		DDBDMO
C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+]1CCO	ZINC000777831399	698225566	/nfs/dbraw/zinc/22/55/66/698225566.db2.gz	CVLQEYWPGCWLCU-JTQLQIEISA-N	1	1	322.390	1.707	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000778899585	698380747	/nfs/dbraw/zinc/38/07/47/698380747.db2.gz	NBOGYCUGRQIRBT-UHFFFAOYSA-N	1	1	319.273	1.685	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@](C)(C(N)=O)C2)c2ccc([N+](=O)[O-])cc12	ZINC000794704606	699825336	/nfs/dbraw/zinc/82/53/36/699825336.db2.gz	LIXCPBCAXGZWNK-OAHLLOKOSA-N	1	1	317.349	1.408	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000795752753	699889878	/nfs/dbraw/zinc/88/98/78/699889878.db2.gz	VRJQWMBOZHMWOI-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000795752753	699889881	/nfs/dbraw/zinc/88/98/81/699889881.db2.gz	VRJQWMBOZHMWOI-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC)C[C@H]1C	ZINC000754079786	700481382	/nfs/dbraw/zinc/48/13/82/700481382.db2.gz	LTTIGIGTZUNFBD-LLVKDONJSA-N	1	1	306.366	1.485	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)N2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761076318	700840033	/nfs/dbraw/zinc/84/00/33/700840033.db2.gz	NRRLOSOLCXRHFT-AAEUAGOBSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C	ZINC000767179302	701088602	/nfs/dbraw/zinc/08/86/02/701088602.db2.gz	SQBQNZUJHPPKOU-SNVBAGLBSA-N	1	1	311.769	1.953	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C	ZINC000767179302	701088603	/nfs/dbraw/zinc/08/86/03/701088603.db2.gz	SQBQNZUJHPPKOU-SNVBAGLBSA-N	1	1	311.769	1.953	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000804446419	701190814	/nfs/dbraw/zinc/19/08/14/701190814.db2.gz	GEJAKFYJBCIVHM-SNVBAGLBSA-N	1	1	309.326	1.161	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000804446419	701190817	/nfs/dbraw/zinc/19/08/17/701190817.db2.gz	GEJAKFYJBCIVHM-SNVBAGLBSA-N	1	1	309.326	1.161	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)CC[N@@H+](C)C1CC1	ZINC000770220320	701271918	/nfs/dbraw/zinc/27/19/18/701271918.db2.gz	DTXDEUCGWZOTMW-UHFFFAOYSA-N	1	1	306.366	1.485	20	5		DDBDMO
CCOc1cc(NCC(=O)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000771201346	701312991	/nfs/dbraw/zinc/31/29/91/701312991.db2.gz	GFXVVDDBHGGZRY-UHFFFAOYSA-N	1	1	322.365	1.179	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000879145356	706598596	/nfs/dbraw/zinc/59/85/96/706598596.db2.gz	TXQNPXWWKXTHHE-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
O=C1N[C@H]2C[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]2CO1	ZINC000830917410	706602483	/nfs/dbraw/zinc/60/24/83/706602483.db2.gz	XVJIOYUVBHCPAF-KWCYVHTRSA-N	1	1	321.333	1.059	20	5		DDBDMO
COC(=O)[C@@]1(C)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839668353	701773977	/nfs/dbraw/zinc/77/39/77/701773977.db2.gz	ZRGXFQMRYHLJCZ-HOCLYGCPSA-N	1	1	322.361	1.903	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867952751	701851197	/nfs/dbraw/zinc/85/11/97/701851197.db2.gz	FAIQSYZSPNXVIQ-MRXNPFEDSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc43)CC[C@H]21	ZINC000866207001	706648521	/nfs/dbraw/zinc/64/85/21/706648521.db2.gz	NUVVZLLYSJTWOX-NXEZZACHSA-N	1	1	303.322	1.661	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000866206768	706648672	/nfs/dbraw/zinc/64/86/72/706648672.db2.gz	NAYJROBUMLTZJL-RYUDHWBXSA-N	1	1	304.350	1.224	20	5		DDBDMO
COCCCC[N@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000841690787	702540086	/nfs/dbraw/zinc/54/00/86/702540086.db2.gz	IOCHZBJTSNXHSN-UHFFFAOYSA-N	1	1	321.175	1.870	20	5		DDBDMO
COCCCC[N@@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000841690787	702540088	/nfs/dbraw/zinc/54/00/88/702540088.db2.gz	IOCHZBJTSNXHSN-UHFFFAOYSA-N	1	1	321.175	1.870	20	5		DDBDMO
CON1CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000846975216	703359685	/nfs/dbraw/zinc/35/96/85/703359685.db2.gz	BWSQPKMHUUNESV-UHFFFAOYSA-N	1	1	322.365	1.411	20	5		DDBDMO
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C[NH+]1CCCC1	ZINC000818966594	704036845	/nfs/dbraw/zinc/03/68/45/704036845.db2.gz	LMSBEZJZEFIANQ-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCC2	ZINC000818971349	704038798	/nfs/dbraw/zinc/03/87/98/704038798.db2.gz	UPIJTTCFYZHHNQ-GWCFXTLKSA-N	1	1	317.349	1.517	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000852432207	704044749	/nfs/dbraw/zinc/04/47/49/704044749.db2.gz	JANRVEWSTGLAQR-AWEZNQCLSA-N	1	1	305.334	1.664	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000852432980	704045612	/nfs/dbraw/zinc/04/56/12/704045612.db2.gz	RLOCQGLIALVUOU-ZDUSSCGKSA-N	1	1	321.333	1.500	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000870874383	704153333	/nfs/dbraw/zinc/15/33/33/704153333.db2.gz	IVGVBGLNBOHXBP-ZBEGNZNMSA-N	1	1	321.377	1.795	20	5		DDBDMO
CCN(C[C@H]1CCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870875366	704153618	/nfs/dbraw/zinc/15/36/18/704153618.db2.gz	LUKUNUFUXKUTHQ-MLGOLLRUSA-N	1	1	321.377	1.654	20	5		DDBDMO
COCC1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000870884685	704157064	/nfs/dbraw/zinc/15/70/64/704157064.db2.gz	FVOJHWIFVZDHIA-MRXNPFEDSA-N	1	1	321.377	1.654	20	5		DDBDMO
CN(C[C@H]1CCCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870922636	704170086	/nfs/dbraw/zinc/17/00/86/704170086.db2.gz	KQJWVWKAPSWVJP-MLGOLLRUSA-N	1	1	321.377	1.654	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)n1	ZINC000871156772	704233843	/nfs/dbraw/zinc/23/38/43/704233843.db2.gz	MCNJSBOPFOFMGX-UHFFFAOYSA-N	1	1	309.370	1.368	20	5		DDBDMO
CCN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1	ZINC000855485764	704487321	/nfs/dbraw/zinc/48/73/21/704487321.db2.gz	HDAFOBVEPBZZAU-GJZGRUSLSA-N	1	1	321.377	1.571	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@H]2C[N@H+](C)C[C@H]21	ZINC000823100739	705139632	/nfs/dbraw/zinc/13/96/32/705139632.db2.gz	IHNCATLRNQNNMQ-TZMCWYRMSA-N	1	1	303.362	1.988	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000874822360	705181467	/nfs/dbraw/zinc/18/14/67/705181467.db2.gz	ARBBDDZLZGIVMT-KGLIPLIRSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000874827731	705186161	/nfs/dbraw/zinc/18/61/61/705186161.db2.gz	SWYYQWWTDQFOBI-ZNMIVQPWSA-N	1	1	319.361	1.323	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H](n3ccnn3)C2)c1	ZINC000823469099	705249931	/nfs/dbraw/zinc/24/99/31/705249931.db2.gz	OQPLJUWJXPHQFP-CABCVRRESA-N	1	1	317.349	1.557	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826646701	705833229	/nfs/dbraw/zinc/83/32/29/705833229.db2.gz	DRMGDQRVUIVVHS-IUODEOHRSA-N	1	1	321.377	1.428	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827264784	705963320	/nfs/dbraw/zinc/96/33/20/705963320.db2.gz	DOTUQMFNNVMITF-DGCLKSJQSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000864958759	706312082	/nfs/dbraw/zinc/31/20/82/706312082.db2.gz	UUUHPFKVXHBSQW-UHFFFAOYSA-N	1	1	320.324	1.988	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880528821	707005423	/nfs/dbraw/zinc/00/54/23/707005423.db2.gz	HBIPXIIVAMFXCW-AEGPPILISA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880528821	707005425	/nfs/dbraw/zinc/00/54/25/707005425.db2.gz	HBIPXIIVAMFXCW-AEGPPILISA-N	1	1	319.361	1.229	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+]2C[C@@H](O)CC3(CCOCC3)C2)c1	ZINC000880588939	707029601	/nfs/dbraw/zinc/02/96/01/707029601.db2.gz	IHZLLMMHDCDIJF-HNNXBMFYSA-N	1	1	306.362	1.958	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000837224554	707601711	/nfs/dbraw/zinc/60/17/11/707601711.db2.gz	DNHOLORPAXSLGM-OAHLLOKOSA-N	1	1	321.377	1.619	20	5		DDBDMO
CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccccc1	ZINC000839464098	708049510	/nfs/dbraw/zinc/04/95/10/708049510.db2.gz	VKQYYTSTCAEOPK-KFWWJZLASA-N	1	1	305.378	1.851	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c1	ZINC000897221628	708259160	/nfs/dbraw/zinc/25/91/60/708259160.db2.gz	NXPCAXCOMKJUPJ-KBPBESRZSA-N	1	1	305.378	1.939	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897221372	708259546	/nfs/dbraw/zinc/25/95/46/708259546.db2.gz	MBDSGDKSQTZXHM-STQMWFEESA-N	1	1	323.397	1.155	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000886596181	708788003	/nfs/dbraw/zinc/78/80/03/708788003.db2.gz	YLRWCHBVDUKHKX-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000886596181	708788004	/nfs/dbraw/zinc/78/80/04/708788004.db2.gz	YLRWCHBVDUKHKX-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
C[NH+](C)[C@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C12CCC2	ZINC000898835474	708884384	/nfs/dbraw/zinc/88/43/84/708884384.db2.gz	NPGAMDHQBBQGDL-KBPBESRZSA-N	1	1	319.361	1.903	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CC[C@H](O)C2)c1C	ZINC000899155274	709003151	/nfs/dbraw/zinc/00/31/51/709003151.db2.gz	YAEPAZOAZIBYOP-LBPRGKRZSA-N	1	1	307.350	1.008	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887930630	709168999	/nfs/dbraw/zinc/16/89/99/709168999.db2.gz	QDPPMNXPIXSZRF-BMIGLBTASA-N	1	1	307.325	1.758	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1	ZINC000887934191	709170557	/nfs/dbraw/zinc/17/05/57/709170557.db2.gz	CVSPPEZUOWZFFZ-WBMJQRKESA-N	1	1	303.362	1.927	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104022	713132292	/nfs/dbraw/zinc/13/22/92/713132292.db2.gz	STCAQWJFTNIOJO-UONOGXRCSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104022	713132293	/nfs/dbraw/zinc/13/22/93/713132293.db2.gz	STCAQWJFTNIOJO-UONOGXRCSA-N	1	1	321.402	1.904	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@@H+](CC(C)C)CCO1	ZINC000891572208	710238701	/nfs/dbraw/zinc/23/87/01/710238701.db2.gz	RLTGVEJXPWKFAX-CYBMUJFWSA-N	1	1	324.381	1.767	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000913286078	713191629	/nfs/dbraw/zinc/19/16/29/713191629.db2.gz	YRDFMULBILLXLT-IYBDPMFKSA-N	1	1	318.377	1.591	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928431520	713192702	/nfs/dbraw/zinc/19/27/02/713192702.db2.gz	FBEXYQXVJIIWOX-FZMZJTMJSA-N	1	1	319.361	1.767	20	5		DDBDMO
COc1c(O)ccc(CN2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000893669909	710770705	/nfs/dbraw/zinc/77/07/05/710770705.db2.gz	XCLBNAQVRRRBRM-WDEREUQCSA-N	1	1	309.366	1.833	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3ccc4nonc4c3[N+](=O)[O-])C2)C1	ZINC000893964399	710903331	/nfs/dbraw/zinc/90/33/31/710903331.db2.gz	QMBBZVWBTSATTP-AWEZNQCLSA-N	1	1	303.322	1.663	20	5		DDBDMO
COc1cc([C@@H](C)NC[C@H]2C[N@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091851	711030092	/nfs/dbraw/zinc/03/00/92/711030092.db2.gz	BMJJVKYGMXKSJU-DOMZBBRYSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([C@@H](C)NC[C@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091851	711030097	/nfs/dbraw/zinc/03/00/97/711030097.db2.gz	BMJJVKYGMXKSJU-DOMZBBRYSA-N	1	1	322.409	1.500	20	5		DDBDMO
C[C@@]1(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[NH+]2CCC1CC2	ZINC000912377504	711301055	/nfs/dbraw/zinc/30/10/55/711301055.db2.gz	ORUDJEATZDSUOM-OAHLLOKOSA-N	1	1	305.334	1.515	20	5		DDBDMO
Cc1nc(NC[C@@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-]	ZINC000896521179	711737421	/nfs/dbraw/zinc/73/74/21/711737421.db2.gz	HQQRYKYSNLDYGH-ZDUSSCGKSA-N	1	1	306.366	1.963	20	5		DDBDMO
Nc1c(F)c(NC[C@@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-]	ZINC000896521169	711737459	/nfs/dbraw/zinc/73/74/59/711737459.db2.gz	HKUQGGUCPYRLGD-NSHDSACASA-N	1	1	324.356	1.981	20	5		DDBDMO
O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(F)c(Cl)c1	ZINC000905202480	711966672	/nfs/dbraw/zinc/96/66/72/711966672.db2.gz	MNGPPPIBJBTEQJ-LLVKDONJSA-N	1	1	301.705	1.451	20	5		DDBDMO
C[C@@H](NC(=O)C1CN(C)CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000906318149	712296567	/nfs/dbraw/zinc/29/65/67/712296567.db2.gz	UVNWDEGJQSJJQY-GFCCVEGCSA-N	1	1	320.393	1.265	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@@H]1CC[N@H+]1C	ZINC000914291384	713371523	/nfs/dbraw/zinc/37/15/23/713371523.db2.gz	KLOWPDUCTVUHPU-LBPRGKRZSA-N	1	1	308.338	1.107	20	5		DDBDMO
CCOC(=O)c1ccc(N2CCC[N@H+](CC[N+](=O)[O-])CC2)nc1	ZINC000929926394	713719672	/nfs/dbraw/zinc/71/96/72/713719672.db2.gz	VSTIUDCXADUNGM-UHFFFAOYSA-N	1	1	322.365	1.047	20	5		DDBDMO
CCOC(=O)c1ccc(N2CCC[N@@H+](CC[N+](=O)[O-])CC2)nc1	ZINC000929926394	713719673	/nfs/dbraw/zinc/71/96/73/713719673.db2.gz	VSTIUDCXADUNGM-UHFFFAOYSA-N	1	1	322.365	1.047	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C1(O)CCCC1	ZINC000930354010	713812508	/nfs/dbraw/zinc/81/25/08/713812508.db2.gz	NGXQTUFBEMNYCH-OAHLLOKOSA-N	1	1	308.378	1.735	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000931205461	714035803	/nfs/dbraw/zinc/03/58/03/714035803.db2.gz	MXJYCEFGUGGZQG-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1	ZINC000931311823	714062750	/nfs/dbraw/zinc/06/27/50/714062750.db2.gz	PPYRQDFKJMZAMU-ZACQAIPSSA-N	1	1	319.405	1.902	20	5		DDBDMO
C[N@H+]1CC[C@@H]2C[NH+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931439821	714098494	/nfs/dbraw/zinc/09/84/94/714098494.db2.gz	ONZCVWNFGRTWCP-YCPHGPKFSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931439821	714098501	/nfs/dbraw/zinc/09/85/01/714098501.db2.gz	ONZCVWNFGRTWCP-YCPHGPKFSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931439821	714098504	/nfs/dbraw/zinc/09/85/04/714098504.db2.gz	ONZCVWNFGRTWCP-YCPHGPKFSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1C[C@@H](O)C[C@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000924989610	714717974	/nfs/dbraw/zinc/71/79/74/714717974.db2.gz	SSJCOIXUVJNSLS-IUCAKERBSA-N	1	1	313.741	1.043	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934252389	714774739	/nfs/dbraw/zinc/77/47/39/714774739.db2.gz	MOODQSACGBAKRJ-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H]2[C@H]1CCCN2CCO	ZINC000934252389	714774740	/nfs/dbraw/zinc/77/47/40/714774740.db2.gz	MOODQSACGBAKRJ-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H]2[C@H]1CCCN2CCO	ZINC000934252389	714774741	/nfs/dbraw/zinc/77/47/41/714774741.db2.gz	MOODQSACGBAKRJ-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)C[C@H]21	ZINC000611712217	719388927	/nfs/dbraw/zinc/38/89/27/719388927.db2.gz	XZWBNTJGLXWLND-KGLIPLIRSA-N	1	1	315.333	1.057	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@@H]2[C@@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923253	721849247	/nfs/dbraw/zinc/84/92/47/721849247.db2.gz	UNHOKRDCMBXEFW-UONOGXRCSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@@H]2[C@@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923253	721849248	/nfs/dbraw/zinc/84/92/48/721849248.db2.gz	UNHOKRDCMBXEFW-UONOGXRCSA-N	1	1	305.382	1.204	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC001025775280	736852628	/nfs/dbraw/zinc/85/26/28/736852628.db2.gz	KXRVMRSUSZRSJI-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
Cc1ccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001025775280	736852632	/nfs/dbraw/zinc/85/26/32/736852632.db2.gz	KXRVMRSUSZRSJI-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001025775280	736852634	/nfs/dbraw/zinc/85/26/34/736852634.db2.gz	KXRVMRSUSZRSJI-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc2c(c1)CCC2)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932158	742776653	/nfs/dbraw/zinc/77/66/53/742776653.db2.gz	JXTJWFPDRPFIGM-HUUCEWRRSA-N	1	1	303.362	1.046	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@@H]1[C@H]1CCCO1	ZINC001198685214	747576917	/nfs/dbraw/zinc/57/69/17/747576917.db2.gz	HZUCEWJFBCCKJK-HUUCEWRRSA-N	1	1	321.377	1.790	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001137250278	749700871	/nfs/dbraw/zinc/70/08/71/749700871.db2.gz	STDAGFNGQDTOLK-YPMHNXCESA-N	1	1	318.377	1.876	20	5		DDBDMO
C[N@@H+](C1CN(C(=O)OC(C)(C)C)C1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169038233	762192662	/nfs/dbraw/zinc/19/26/62/762192662.db2.gz	XGUXSHACXFZCFQ-NEPJUHHUSA-N	1	1	313.398	1.983	20	5		DDBDMO
Cc1cncnc1O[C@@H]1CC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169053207	762208199	/nfs/dbraw/zinc/20/81/99/762208199.db2.gz	IEJSUKLVBVTMAX-HZSPNIEDSA-N	1	1	306.366	1.684	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCC(F)(F)F)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000674993	753877199	/nfs/dbraw/zinc/87/71/99/753877199.db2.gz	PTVKBDWNKHPDMV-GHMZBOCLSA-N	1	1	321.299	1.352	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020138916	760612372	/nfs/dbraw/zinc/61/23/72/760612372.db2.gz	HYCAIANXMRTFIT-KBUPBQIOSA-N	1	1	303.362	1.131	20	5		DDBDMO
O=C(N[C@H]1CC[C@H](C[NH2+]Cc2ccon2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001050325369	763467131	/nfs/dbraw/zinc/46/71/31/763467131.db2.gz	AESJJTVQNVVQCU-HBJVGIJOSA-N	1	1	322.365	1.104	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](F)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170327848	766254106	/nfs/dbraw/zinc/25/41/06/766254106.db2.gz	IIKWAZPQSJXIMY-WDBKCZKBSA-N	1	1	312.341	1.939	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001093840338	775123724	/nfs/dbraw/zinc/12/37/24/775123724.db2.gz	IKEOWZZFFGIHHQ-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
CN(C)C(=O)C[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172915525	776929980	/nfs/dbraw/zinc/92/99/80/776929980.db2.gz	NXVUPSKIAFRQSE-CQSZACIVSA-N	1	1	305.378	1.862	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(C)[nH+]c(C)c1	ZINC001116405148	780506341	/nfs/dbraw/zinc/50/63/41/780506341.db2.gz	WIMVXTYBYVOGAT-UHFFFAOYSA-N	1	1	303.322	1.562	20	5		DDBDMO
CCn1cc([C@H](O)C[N@H+](CC[N+](=O)[O-])Cc2ccccc2)cn1	ZINC001119767204	781600284	/nfs/dbraw/zinc/60/02/84/781600284.db2.gz	QCIJWLLNMSEZPD-MRXNPFEDSA-N	1	1	318.377	1.715	20	5		DDBDMO
CCn1cc([C@H](O)C[N@@H+](CC[N+](=O)[O-])Cc2ccccc2)cn1	ZINC001119767204	781600287	/nfs/dbraw/zinc/60/02/87/781600287.db2.gz	QCIJWLLNMSEZPD-MRXNPFEDSA-N	1	1	318.377	1.715	20	5		DDBDMO
CC1(C(=O)NCC2C[NH+](Cc3cccc([N+](=O)[O-])c3)C2)CC1	ZINC001268828584	840875611	/nfs/dbraw/zinc/87/56/11/840875611.db2.gz	FTUNTMABRAQYKS-UHFFFAOYSA-N	1	1	303.362	1.943	20	5		DDBDMO
Cc1ccccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC1	ZINC001326823182	861633949	/nfs/dbraw/zinc/63/39/49/861633949.db2.gz	SPCYZHXUZLLKRZ-HUUCEWRRSA-N	1	1	317.389	1.789	20	5		DDBDMO
CCC(CC)C[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001072724813	857641955	/nfs/dbraw/zinc/64/19/55/857641955.db2.gz	FSIMYNAZFJWJRU-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCC(CC)C[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001072724813	857641960	/nfs/dbraw/zinc/64/19/60/857641960.db2.gz	FSIMYNAZFJWJRU-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCC(CC)C[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001072724813	857641964	/nfs/dbraw/zinc/64/19/64/857641964.db2.gz	FSIMYNAZFJWJRU-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CCc1ccc([N+](=O)[O-])cc1Cl	ZINC001121931505	858638143	/nfs/dbraw/zinc/63/81/43/858638143.db2.gz	BCSCTQXZDGUJOQ-UHFFFAOYSA-N	1	1	321.711	1.891	20	5		DDBDMO
C[C@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC001122253112	858725314	/nfs/dbraw/zinc/72/53/14/858725314.db2.gz	JPEWXZSXYKDPDM-XHDPSFHLSA-N	1	1	307.350	1.406	20	5		DDBDMO
COc1cc(C)nc(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001157266354	863694831	/nfs/dbraw/zinc/69/48/31/863694831.db2.gz	RBEHOKKRAQEZAW-NEPJUHHUSA-N	1	1	306.366	1.837	20	5		DDBDMO
Cc1ccc(NC(=O)C[C@@]2(O)CCC[N@H+](C)C2)c(N)c1[N+](=O)[O-]	ZINC001158231531	864503744	/nfs/dbraw/zinc/50/37/44/864503744.db2.gz	IKTDZMVLONNRGD-HNNXBMFYSA-N	1	1	322.365	1.271	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(N3CC[N@H+]4CC[C@H]4C3)nn2)cc1	ZINC001158434472	864651684	/nfs/dbraw/zinc/65/16/84/864651684.db2.gz	SEEWGLKXFFYOCB-AWEZNQCLSA-N	1	1	311.345	1.946	20	5		DDBDMO
CN1CCOC[C@@H]1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001158707136	864831877	/nfs/dbraw/zinc/83/18/77/864831877.db2.gz	IYLLHDKHYJBUSH-IHVVCDCBSA-N	1	1	321.381	1.265	20	5		DDBDMO
COC(=O)c1cnc(NCC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC001160965303	866224674	/nfs/dbraw/zinc/22/46/74/866224674.db2.gz	WCKUKFPTDFNXFD-LLVKDONJSA-N	1	1	308.338	1.673	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[N@H+](C)CCN2C)c1C	ZINC001334414893	867553236	/nfs/dbraw/zinc/55/32/36/867553236.db2.gz	HROWKMAQGYJQLQ-CYBMUJFWSA-N	1	1	320.393	1.187	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ncnc3cc(F)c([N+](=O)[O-])cc32)C1	ZINC001162683170	867728244	/nfs/dbraw/zinc/72/82/44/867728244.db2.gz	QOQXAKYRTFBMJP-VIFPVBQESA-N	1	1	321.312	1.420	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ncnc3cc(F)c([N+](=O)[O-])cc32)C1	ZINC001162683170	867728252	/nfs/dbraw/zinc/72/82/52/867728252.db2.gz	QOQXAKYRTFBMJP-VIFPVBQESA-N	1	1	321.312	1.420	20	5		DDBDMO
Cc1nc(NCC[C@@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-]	ZINC001162815866	867850258	/nfs/dbraw/zinc/85/02/58/867850258.db2.gz	ZVBRBJBCGNGIDZ-VIFPVBQESA-N	1	1	301.297	1.740	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1	ZINC001322752717	868362628	/nfs/dbraw/zinc/36/26/28/868362628.db2.gz	MPAZNEDSTWUGOB-LBPRGKRZSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1	ZINC001226068686	882189367	/nfs/dbraw/zinc/18/93/67/882189367.db2.gz	UXDXTKZDZXQXKU-UHFFFAOYSA-N	1	1	314.363	1.471	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC(N3CC(F)C3)C2)ncc1[N+](=O)[O-]	ZINC001163757861	868685999	/nfs/dbraw/zinc/68/59/99/868685999.db2.gz	CKCSMAMVEOZBGU-ONEGZZNKSA-N	1	1	321.356	1.364	20	5		DDBDMO
CCOc1nc(N2CCC(F)(F)[C@@H]([NH3+])C2)ccc1[N+](=O)[O-]	ZINC001164323940	869129582	/nfs/dbraw/zinc/12/95/82/869129582.db2.gz	PLGJCPYLYUSQDO-VIFPVBQESA-N	1	1	302.281	1.561	20	5		DDBDMO
CC1(C)CC(C[NH2+]CC2(CCNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC001164494361	869232004	/nfs/dbraw/zinc/23/20/04/869232004.db2.gz	GXCUXXAOJYNEJA-ZIAGYGMSSA-N	1	1	323.437	1.964	20	5		DDBDMO
COC(=O)c1cc(O[C@@H]2CCC[N@@H+](C)C2)c(OC)cc1[N+](=O)[O-]	ZINC001226441677	882433585	/nfs/dbraw/zinc/43/35/85/882433585.db2.gz	TZBHQXRBAFDRKI-SNVBAGLBSA-N	1	1	324.333	1.863	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001303985496	871171886	/nfs/dbraw/zinc/17/18/86/871171886.db2.gz	GWBLCGCKJWKYBM-CQSZACIVSA-N	1	1	321.377	1.820	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1(CO)CC1	ZINC001307698377	871451049	/nfs/dbraw/zinc/45/10/49/871451049.db2.gz	MYUCGZNBTHVMLE-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1(CO)CC1	ZINC001307698377	871451057	/nfs/dbraw/zinc/45/10/57/871451057.db2.gz	MYUCGZNBTHVMLE-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
COC(=O)/C(C)=C\C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001307999812	871462817	/nfs/dbraw/zinc/46/28/17/871462817.db2.gz	OTXNXEJAUUIDTA-OCOPJHETSA-N	1	1	308.334	1.511	20	5		DDBDMO
COC(=O)/C(C)=C\C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001307999813	871463114	/nfs/dbraw/zinc/46/31/14/871463114.db2.gz	OTXNXEJAUUIDTA-QARUFBMTSA-N	1	1	308.334	1.511	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H](CC(N)=O)C2)c1[N+](=O)[O-]	ZINC001308578351	871514305	/nfs/dbraw/zinc/51/43/05/871514305.db2.gz	NREQHTIYHPCCPM-JTQLQIEISA-N	1	1	323.349	1.396	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C2COC(C)(C)OC2)c1[N+](=O)[O-]	ZINC001308672795	871516675	/nfs/dbraw/zinc/51/66/75/871516675.db2.gz	OIBIZQWXFKONLM-UHFFFAOYSA-N	1	1	312.322	1.550	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)C1N=NC(=O)N1C	ZINC001308846945	871531494	/nfs/dbraw/zinc/53/14/94/871531494.db2.gz	XPBPMPUNZUUDLM-SNVBAGLBSA-N	1	1	305.338	1.897	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC001348223685	874436024	/nfs/dbraw/zinc/43/60/24/874436024.db2.gz	GCOXVLOSLVBQIX-QCZZGDTMSA-N	1	1	305.334	1.370	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC001348223685	874436025	/nfs/dbraw/zinc/43/60/25/874436025.db2.gz	GCOXVLOSLVBQIX-QCZZGDTMSA-N	1	1	305.334	1.370	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2nnc(CCC[N+](=O)[O-])n2C)[C@@H](C)C1	ZINC001355391970	878531724	/nfs/dbraw/zinc/53/17/24/878531724.db2.gz	NSEGMRIUYCCROB-QWHCGFSZSA-N	1	1	324.429	1.191	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228813268	883683520	/nfs/dbraw/zinc/68/35/20/883683520.db2.gz	AKEHBKLNUWUSJH-SNVBAGLBSA-N	1	1	324.333	1.950	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228813268	883683528	/nfs/dbraw/zinc/68/35/28/883683528.db2.gz	AKEHBKLNUWUSJH-SNVBAGLBSA-N	1	1	324.333	1.950	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H](C)C[N+](C)(C)C)cc1O	ZINC001228813391	883684543	/nfs/dbraw/zinc/68/45/43/883684543.db2.gz	BZIOBONGOVGEPR-VIFPVBQESA-O	1	1	313.330	1.561	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCNC2(CC[NH2+]CC2)C1	ZINC001246606863	892732253	/nfs/dbraw/zinc/73/22/53/892732253.db2.gz	SPUFAHPDORJYJH-AWEZNQCLSA-N	1	1	318.421	1.553	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])N1C[C@H]2COC[C@@H](C1)C2[NH3+]	ZINC001246857607	892947443	/nfs/dbraw/zinc/94/74/43/892947443.db2.gz	BNASOOILKPTTIG-CLJRNHLWSA-N	1	1	305.378	1.431	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@@H]2C[C@@H](CO)C[C@@H]21	ZINC001254553474	896499082	/nfs/dbraw/zinc/49/90/82/896499082.db2.gz	VQMKCQCKIIQZBL-OSRSDYAFSA-N	1	1	320.389	1.998	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@H]2C[C@@H](CO)C[C@@H]21	ZINC001254553474	896499090	/nfs/dbraw/zinc/49/90/90/896499090.db2.gz	VQMKCQCKIIQZBL-OSRSDYAFSA-N	1	1	320.389	1.998	20	5		DDBDMO
COC[C@]12COC[C@H]1C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254595549	896522883	/nfs/dbraw/zinc/52/28/83/896522883.db2.gz	LWNMOLNFIFCDHQ-DJIMGWMZSA-N	1	1	318.373	1.657	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC001261510244	899612166	/nfs/dbraw/zinc/61/21/66/899612166.db2.gz	SCMLMINJMVXOKP-CQSZACIVSA-N	1	1	321.352	1.973	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001262710402	900323002	/nfs/dbraw/zinc/32/30/02/900323002.db2.gz	OTGBYDXAIPQOOP-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
O=C(NC[C@H]1CC[C@H](C[NH2+]CCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001279252808	903202833	/nfs/dbraw/zinc/20/28/33/903202833.db2.gz	CDQYWUQZUISFHC-AAVRWANBSA-N	1	1	315.389	1.523	20	5		DDBDMO
C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@@H](C)C1	ZINC000248780739	282108309	/nfs/dbraw/zinc/10/83/09/282108309.db2.gz	WKGPRRHWSMEWIA-VXGBXAGGSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC[C@@]1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248951639	282120058	/nfs/dbraw/zinc/12/00/58/282120058.db2.gz	PQJGGUFQXFTFKV-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248951639	282120066	/nfs/dbraw/zinc/12/00/66/282120066.db2.gz	PQJGGUFQXFTFKV-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1ncn(C[C@@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1	ZINC000278579114	214251860	/nfs/dbraw/zinc/25/18/60/214251860.db2.gz	OMOXBIAOEHRDTD-AWEZNQCLSA-N	1	1	317.349	1.477	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[NH+]([C@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000296740497	529466304	/nfs/dbraw/zinc/46/63/04/529466304.db2.gz	AOLOHBZIJXTDIW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+]([C@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000296740497	529466308	/nfs/dbraw/zinc/46/63/08/529466308.db2.gz	AOLOHBZIJXTDIW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000457212058	529467110	/nfs/dbraw/zinc/46/71/10/529467110.db2.gz	WVSBJHSHGKGCNL-UHFFFAOYSA-N	1	1	309.370	1.485	20	5		DDBDMO
C[N@H+](CCOCC1CC1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000088599208	185259059	/nfs/dbraw/zinc/25/90/59/185259059.db2.gz	FJNBGHFSNPOMPW-UHFFFAOYSA-N	1	1	307.350	1.552	20	5		DDBDMO
C[N@@H+](CCOCC1CC1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000088599208	185259060	/nfs/dbraw/zinc/25/90/60/185259060.db2.gz	FJNBGHFSNPOMPW-UHFFFAOYSA-N	1	1	307.350	1.552	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000255640725	282271637	/nfs/dbraw/zinc/27/16/37/282271637.db2.gz	TYDHVVOLCGIPTR-IDTUSYRASA-N	1	1	301.346	1.915	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1	ZINC000097028015	185399034	/nfs/dbraw/zinc/39/90/34/185399034.db2.gz	NXAXBCIIFOQDMU-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000425050719	529822072	/nfs/dbraw/zinc/82/20/72/529822072.db2.gz	RTUJFLLGIORJIH-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000286722008	219129567	/nfs/dbraw/zinc/12/95/67/219129567.db2.gz	BDIBOCNDWIXKTF-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1	ZINC000272753446	210156557	/nfs/dbraw/zinc/15/65/57/210156557.db2.gz	FDDNCQXIZFDJQL-JTQLQIEISA-N	1	1	304.350	1.557	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000286737979	219137563	/nfs/dbraw/zinc/13/75/63/219137563.db2.gz	XZCYHPJLRHQGIV-TZMCWYRMSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000458219189	530060981	/nfs/dbraw/zinc/06/09/81/530060981.db2.gz	OTLWCQQERAHNFD-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CC[C@H](C)C2)cc([N+](=O)[O-])c1C	ZINC000616359384	362656837	/nfs/dbraw/zinc/65/68/37/362656837.db2.gz	OZAAEVTVFLLYAU-NSHDSACASA-N	1	1	321.377	1.983	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC000272616694	210017080	/nfs/dbraw/zinc/01/70/80/210017080.db2.gz	LHZIWVGJOXKKOY-GXFFZTMASA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H](C[NH+]1C[C@@H](C)C[C@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000138649502	186018361	/nfs/dbraw/zinc/01/83/61/186018361.db2.gz	ARJHYFJUWAIJNK-GARJFASQSA-N	1	1	309.370	1.414	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C(N)=O)C(C)(C)C	ZINC000173342871	186178410	/nfs/dbraw/zinc/17/84/10/186178410.db2.gz	GLKFXPQJPUGLLK-CYBMUJFWSA-N	1	1	322.365	1.331	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000265994987	186352457	/nfs/dbraw/zinc/35/24/57/186352457.db2.gz	JJCVHGREOGODLL-ZDUSSCGKSA-N	1	1	323.397	1.276	20	5		DDBDMO
CC(=O)N1CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000026160020	352206007	/nfs/dbraw/zinc/20/60/07/352206007.db2.gz	STOVBPACQQVARW-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](O)C3)o2)cc1	ZINC000048615476	352544295	/nfs/dbraw/zinc/54/42/95/352544295.db2.gz	GVBUPYXMTCTIEY-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](O)C3)o2)cc1	ZINC000048615476	352544298	/nfs/dbraw/zinc/54/42/98/352544298.db2.gz	GVBUPYXMTCTIEY-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])cc(C)c1C	ZINC000068960686	353139047	/nfs/dbraw/zinc/13/90/47/353139047.db2.gz	NLHVVSSXJWOYNM-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
CCC[N@H+](CCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000072953252	353227661	/nfs/dbraw/zinc/22/76/61/353227661.db2.gz	GKCGYGVHRZKHFI-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000072953252	353227663	/nfs/dbraw/zinc/22/76/63/353227663.db2.gz	GKCGYGVHRZKHFI-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
COc1ccccc1C[N@H+](CCO)CCn1cc([N+](=O)[O-])cn1	ZINC000174845303	198392727	/nfs/dbraw/zinc/39/27/27/198392727.db2.gz	GLAUPQAVPJIQJP-UHFFFAOYSA-N	1	1	320.349	1.294	20	5		DDBDMO
COc1ccccc1C[N@@H+](CCO)CCn1cc([N+](=O)[O-])cn1	ZINC000174845303	198392728	/nfs/dbraw/zinc/39/27/28/198392728.db2.gz	GLAUPQAVPJIQJP-UHFFFAOYSA-N	1	1	320.349	1.294	20	5		DDBDMO
Cc1ccnc(N2CCN(c3[nH+]ccn3C)CC2)c1[N+](=O)[O-]	ZINC000078293491	353509207	/nfs/dbraw/zinc/50/92/07/353509207.db2.gz	DSBQQRJHJWFNRQ-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
Cc1cnc(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c([N+](=O)[O-])c1	ZINC000078662683	353527655	/nfs/dbraw/zinc/52/76/55/353527655.db2.gz	ANHPLOGXNNBDNW-AWEZNQCLSA-N	1	1	320.393	1.847	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000108298464	353949056	/nfs/dbraw/zinc/94/90/56/353949056.db2.gz	MEFMCXJHEGMDSU-ZDUSSCGKSA-N	1	1	321.381	1.090	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000144000922	354152223	/nfs/dbraw/zinc/15/22/23/354152223.db2.gz	SIQUMQIABSPGHP-JTQLQIEISA-N	1	1	305.334	1.570	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000157689610	354225922	/nfs/dbraw/zinc/22/59/22/354225922.db2.gz	XJFLPXCFSXWLHF-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000157689610	354225924	/nfs/dbraw/zinc/22/59/24/354225924.db2.gz	XJFLPXCFSXWLHF-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ncnc2ccc([N+](=O)[O-])cc21	ZINC000321498353	354532690	/nfs/dbraw/zinc/53/26/90/354532690.db2.gz	SPSKAAKMGIOIEN-LBPRGKRZSA-N	1	1	316.365	1.196	20	5		DDBDMO
CN1CCN(C)[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000321498353	354532693	/nfs/dbraw/zinc/53/26/93/354532693.db2.gz	SPSKAAKMGIOIEN-LBPRGKRZSA-N	1	1	316.365	1.196	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000321498353	354532696	/nfs/dbraw/zinc/53/26/96/354532696.db2.gz	SPSKAAKMGIOIEN-LBPRGKRZSA-N	1	1	316.365	1.196	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000321498353	354532699	/nfs/dbraw/zinc/53/26/99/354532699.db2.gz	SPSKAAKMGIOIEN-LBPRGKRZSA-N	1	1	316.365	1.196	20	5		DDBDMO
CCOc1cc(NC[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000315929279	354498377	/nfs/dbraw/zinc/49/83/77/354498377.db2.gz	XBVVVJCUJJRXFL-CYBMUJFWSA-N	1	1	308.382	1.651	20	5		DDBDMO
CCOc1cc(N2CCO[C@@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000585783576	354841982	/nfs/dbraw/zinc/84/19/82/354841982.db2.gz	BDAHJNKVCRXLMR-HUUCEWRRSA-N	1	1	321.377	1.903	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2cc(N)c([N+](=O)[O-])c(CO)c2)C[C@H]1C	ZINC000588009275	354893532	/nfs/dbraw/zinc/89/35/32/354893532.db2.gz	DSMJUAXWGLCCQJ-GHMZBOCLSA-N	1	1	308.382	1.588	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601314550	358491969	/nfs/dbraw/zinc/49/19/69/358491969.db2.gz	JHSHKBHMVSUGHS-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601314550	358491970	/nfs/dbraw/zinc/49/19/70/358491970.db2.gz	JHSHKBHMVSUGHS-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@H]4[C@H](CO)[C@H]4C3)o2)cc1	ZINC000590005644	355039420	/nfs/dbraw/zinc/03/94/20/355039420.db2.gz	DFVGCCPZFULJEI-ITGUQSILSA-N	1	1	316.317	1.315	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@H]4[C@H](CO)[C@H]4C3)o2)cc1	ZINC000590005644	355039423	/nfs/dbraw/zinc/03/94/23/355039423.db2.gz	DFVGCCPZFULJEI-ITGUQSILSA-N	1	1	316.317	1.315	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[NH+](C[C@H](C)O)CC1	ZINC000346352274	283071918	/nfs/dbraw/zinc/07/19/18/283071918.db2.gz	PIRGBIOVEXPZQX-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@@H](O)[C@H](CO)C2)cc1	ZINC000591054808	355238710	/nfs/dbraw/zinc/23/87/10/355238710.db2.gz	DNSXFDCRCPXOCS-SWLSCSKDSA-N	1	1	310.350	1.039	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+]1C	ZINC000592794062	355693819	/nfs/dbraw/zinc/69/38/19/355693819.db2.gz	MIDYFXRDDAUKPO-MWLCHTKSSA-N	1	1	317.349	1.428	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCCN2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc1	ZINC000594026646	356093180	/nfs/dbraw/zinc/09/31/80/356093180.db2.gz	GJQHCXZZGDIRQL-LSDHHAIUSA-N	1	1	321.377	1.115	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](N3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000595473633	356507569	/nfs/dbraw/zinc/50/75/69/356507569.db2.gz	YMXSCOGSGWTFJE-ZDUSSCGKSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](N3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000595473633	356507574	/nfs/dbraw/zinc/50/75/74/356507574.db2.gz	YMXSCOGSGWTFJE-ZDUSSCGKSA-N	1	1	324.381	1.578	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000595524096	356533049	/nfs/dbraw/zinc/53/30/49/356533049.db2.gz	XMKQZMOYYHEVIY-AWEZNQCLSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595741355	356630227	/nfs/dbraw/zinc/63/02/27/356630227.db2.gz	MXSGOSBVTLBLFC-ZWNOBZJWSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595741355	356630228	/nfs/dbraw/zinc/63/02/28/356630228.db2.gz	MXSGOSBVTLBLFC-ZWNOBZJWSA-N	1	1	307.325	1.834	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595741685	356630276	/nfs/dbraw/zinc/63/02/76/356630276.db2.gz	DBUWNENQQZKHKS-IJLUTSLNSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@H]1COCCO1	ZINC000595738562	356629290	/nfs/dbraw/zinc/62/92/90/356629290.db2.gz	WFNGPFLJBBPIAX-CQSZACIVSA-N	1	1	323.349	1.271	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595836580	356671584	/nfs/dbraw/zinc/67/15/84/356671584.db2.gz	WTHODXSOAQQDCG-CHWSQXEVSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595836580	356671587	/nfs/dbraw/zinc/67/15/87/356671587.db2.gz	WTHODXSOAQQDCG-CHWSQXEVSA-N	1	1	319.361	1.810	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H]4COC[C@@H]4C3)nc2c1	ZINC000595827693	356666836	/nfs/dbraw/zinc/66/68/36/356666836.db2.gz	DADYNDDEXCZDIT-QWRGUYRKSA-N	1	1	302.334	1.939	20	5		DDBDMO
CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1	ZINC000596188322	356806134	/nfs/dbraw/zinc/80/61/34/356806134.db2.gz	WMQDJBMRRGODBO-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1nc(N2CCC[C@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000596246402	356831163	/nfs/dbraw/zinc/83/11/63/356831163.db2.gz	DLQQIBUETVJJCS-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
CC[N@H+]1CCCN(c2nccc(C(N)=O)c2[N+](=O)[O-])[C@H](C)C1	ZINC000596269595	356838842	/nfs/dbraw/zinc/83/88/42/356838842.db2.gz	UTFJBNONMWGNSU-SNVBAGLBSA-N	1	1	307.354	1.009	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000597574711	357233867	/nfs/dbraw/zinc/23/38/67/357233867.db2.gz	GYMOQASUKBQMRM-RYUDHWBXSA-N	1	1	310.329	1.192	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000597792848	357331430	/nfs/dbraw/zinc/33/14/30/357331430.db2.gz	BPAHLLCWJBFZRN-LLVKDONJSA-N	1	1	323.349	1.141	20	5		DDBDMO
COCCN1CCC[C@@H](NC(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000597792848	357331435	/nfs/dbraw/zinc/33/14/35/357331435.db2.gz	BPAHLLCWJBFZRN-LLVKDONJSA-N	1	1	323.349	1.141	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597857361	357360021	/nfs/dbraw/zinc/36/00/21/357360021.db2.gz	FIXJGGLNFKHZMK-SNVBAGLBSA-N	1	1	323.397	1.873	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597859172	357361231	/nfs/dbraw/zinc/36/12/31/357361231.db2.gz	ALARUWBUKGAQJY-SNVBAGLBSA-N	1	1	309.370	1.179	20	5		DDBDMO
CCN(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CC[N@@H+](C)C1	ZINC000597947573	357396288	/nfs/dbraw/zinc/39/62/88/357396288.db2.gz	ZBUFXGKJFLTBDE-CQSZACIVSA-N	1	1	305.378	1.998	20	5		DDBDMO
CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](CC)C1	ZINC000598039036	357436911	/nfs/dbraw/zinc/43/69/11/357436911.db2.gz	HRMPENRJISMQSI-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1	ZINC000598039036	357436917	/nfs/dbraw/zinc/43/69/17/357436917.db2.gz	HRMPENRJISMQSI-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598221929	357498291	/nfs/dbraw/zinc/49/82/91/357498291.db2.gz	YRASKIRXHNGQOM-SNVBAGLBSA-N	1	1	307.354	1.455	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@@H]1CCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000178780564	198929774	/nfs/dbraw/zinc/92/97/74/198929774.db2.gz	QDFURPBXJMESBZ-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
[NH3+][C@]12CCC[C@@H]1CN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2	ZINC000598668053	357678178	/nfs/dbraw/zinc/67/81/78/357678178.db2.gz	OOELQRKTFWLWFA-PSLIRLAXSA-N	1	1	315.333	1.425	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1(C)COC1	ZINC000600188293	358149904	/nfs/dbraw/zinc/14/99/04/358149904.db2.gz	BYOJVTJMCQFNMR-UHFFFAOYSA-N	1	1	308.334	1.834	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000600312437	358191727	/nfs/dbraw/zinc/19/17/27/358191727.db2.gz	SFCYNPRZEYVDNE-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](O)[C@H]3CCCO3)c2c1	ZINC000601201017	358444948	/nfs/dbraw/zinc/44/49/48/358444948.db2.gz	JVICIHBNMZFSBM-HUUCEWRRSA-N	1	1	303.318	1.517	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000601139966	358417998	/nfs/dbraw/zinc/41/79/98/358417998.db2.gz	OIKCWNKCRSOZNP-LSDHHAIUSA-N	1	1	321.377	1.820	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@@H]3COC[C@@H]3C1)OCCO2	ZINC000601977486	358762733	/nfs/dbraw/zinc/76/27/33/358762733.db2.gz	UTFBQGXNKGKYEM-TXEJJXNPSA-N	1	1	306.318	1.444	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCN2CC(F)(F)C[C@H]2C1	ZINC000602847912	359235246	/nfs/dbraw/zinc/23/52/46/359235246.db2.gz	LOEHTZZGNVOFRW-NSHDSACASA-N	1	1	315.324	1.125	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC2(C[C@H]1C)CCOCC2	ZINC000602850227	359237825	/nfs/dbraw/zinc/23/78/25/359237825.db2.gz	QAMGFEFHNMWXCZ-GFCCVEGCSA-N	1	1	308.382	1.991	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@]2(CCOC2)O1	ZINC000602823130	359216833	/nfs/dbraw/zinc/21/68/33/359216833.db2.gz	YUGJCAGSRPPTMG-HIFRSBDPSA-N	1	1	324.381	1.370	20	5		DDBDMO
C[C@@](CO)([NH2+]CC(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1	ZINC000602965941	359330452	/nfs/dbraw/zinc/33/04/52/359330452.db2.gz	RSSSZBXHLUIMNY-INIZCTEOSA-N	1	1	321.377	1.404	20	5		DDBDMO
Cc1[nH+]ccn1Cc1cn(Cc2csc([N+](=O)[O-])c2)nn1	ZINC000603206382	359480898	/nfs/dbraw/zinc/48/08/98/359480898.db2.gz	SDQACJCULLUFKH-UHFFFAOYSA-N	1	1	304.335	1.849	20	5		DDBDMO
Cc1nn(CC[NH+]2C[C@@H](C)O[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603322097	359568775	/nfs/dbraw/zinc/56/87/75/359568775.db2.gz	SVGDLFHDHVMAKA-GHMZBOCLSA-N	1	1	319.365	1.757	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(CO)CC1	ZINC000186801627	200013500	/nfs/dbraw/zinc/01/35/00/200013500.db2.gz	KKTZDIYOBREIIC-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(CO)CC1	ZINC000186801627	200013501	/nfs/dbraw/zinc/01/35/01/200013501.db2.gz	KKTZDIYOBREIIC-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000186857726	200022672	/nfs/dbraw/zinc/02/26/72/200022672.db2.gz	WMDLKJBGSYWEJM-GFCCVEGCSA-N	1	1	321.377	1.296	20	5		DDBDMO
O=C(NCC[N@@H+]1CCCOCC1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000189412978	200396473	/nfs/dbraw/zinc/39/64/73/200396473.db2.gz	VNHPUGNBSLZCKV-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000189412978	200396475	/nfs/dbraw/zinc/39/64/75/200396475.db2.gz	VNHPUGNBSLZCKV-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
COc1cc(CN[C@H]2CCC[N@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000608782074	360242210	/nfs/dbraw/zinc/24/22/10/360242210.db2.gz	SCKUNFSSKSTSMS-LBPRGKRZSA-N	1	1	309.366	1.796	20	5		DDBDMO
COc1cc(CN[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000608782074	360242213	/nfs/dbraw/zinc/24/22/13/360242213.db2.gz	SCKUNFSSKSTSMS-LBPRGKRZSA-N	1	1	309.366	1.796	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCc3ccc(O)cc3CC2)n1	ZINC000610485153	360447378	/nfs/dbraw/zinc/44/73/78/360447378.db2.gz	GMSBQKNDXLWBTP-UHFFFAOYSA-N	1	1	302.334	1.598	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](C)CCO1	ZINC000610899532	360567621	/nfs/dbraw/zinc/56/76/21/360567621.db2.gz	YYGOFWFMAJOMNP-BXUZGUMPSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCO1	ZINC000610899532	360567626	/nfs/dbraw/zinc/56/76/26/360567626.db2.gz	YYGOFWFMAJOMNP-BXUZGUMPSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])s2)CC1	ZINC000610808398	360542441	/nfs/dbraw/zinc/54/24/41/360542441.db2.gz	IJRXARYEYXTDMG-LLVKDONJSA-N	1	1	324.406	1.399	20	5		DDBDMO
CC1(C)C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C(C)(C)CO1	ZINC000611185227	360653249	/nfs/dbraw/zinc/65/32/49/360653249.db2.gz	SLXQLDZXPJEIEY-UHFFFAOYSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C(C)(C)CO1	ZINC000611185227	360653255	/nfs/dbraw/zinc/65/32/55/360653255.db2.gz	SLXQLDZXPJEIEY-UHFFFAOYSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092338	360621936	/nfs/dbraw/zinc/62/19/36/360621936.db2.gz	QKKQKMQZEULANC-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092338	360621942	/nfs/dbraw/zinc/62/19/42/360621942.db2.gz	QKKQKMQZEULANC-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092338	360621947	/nfs/dbraw/zinc/62/19/47/360621947.db2.gz	QKKQKMQZEULANC-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1CCOC1	ZINC000611275763	360687076	/nfs/dbraw/zinc/68/70/76/360687076.db2.gz	UGIJWDLWKVVTED-NSHDSACASA-N	1	1	308.334	1.834	20	5		DDBDMO
COc1ccc(C(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000271975043	209352587	/nfs/dbraw/zinc/35/25/87/209352587.db2.gz	NKTFNGHPQYPSFY-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@@H](CCO)C1	ZINC000612070175	360908960	/nfs/dbraw/zinc/90/89/60/360908960.db2.gz	DAYJUXDTKYMMGY-UONOGXRCSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H](C(F)F)C1	ZINC000612110345	360923415	/nfs/dbraw/zinc/92/34/15/360923415.db2.gz	DLVXILPDBGJFGS-QWRGUYRKSA-N	1	1	316.304	1.922	20	5		DDBDMO
Cc1cc([N+](=O)[O-])nn1C[C@H](O)C[N@H+](C)Cc1ccccc1	ZINC000612605181	361079229	/nfs/dbraw/zinc/07/92/29/361079229.db2.gz	IELZJPXQHKJIQA-CQSZACIVSA-N	1	1	304.350	1.593	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000271886631	209295254	/nfs/dbraw/zinc/29/52/54/209295254.db2.gz	CZUUCRAWKLDHCU-UHFFFAOYSA-N	1	1	315.333	1.463	20	5		DDBDMO
C[N@H+]1CC=C(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000271886631	209295259	/nfs/dbraw/zinc/29/52/59/209295259.db2.gz	CZUUCRAWKLDHCU-UHFFFAOYSA-N	1	1	315.333	1.463	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000271886631	209295261	/nfs/dbraw/zinc/29/52/61/209295261.db2.gz	CZUUCRAWKLDHCU-UHFFFAOYSA-N	1	1	315.333	1.463	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NC(C)(C)CCN1CC[NH+](C)CC1	ZINC000613705074	361526915	/nfs/dbraw/zinc/52/69/15/361526915.db2.gz	HNDOHZMSXFEUDR-UHFFFAOYSA-N	1	1	310.402	1.156	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000275181034	212178009	/nfs/dbraw/zinc/17/80/09/212178009.db2.gz	ARGFFRXZVYXYSP-TYNCELHUSA-N	1	1	320.345	1.530	20	5		DDBDMO
CCOCC[N@@H+](CC)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000264579252	204009040	/nfs/dbraw/zinc/00/90/40/204009040.db2.gz	JFEHPWVBFJPQJM-AWEZNQCLSA-N	1	1	312.366	1.693	20	5		DDBDMO
CNS(=O)(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000264655527	204056198	/nfs/dbraw/zinc/05/61/98/204056198.db2.gz	UALOHJGHRSDRQH-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@@H+](CCCN1CCOCC1)CCc1cccc([N+](=O)[O-])c1	ZINC000282562568	217091315	/nfs/dbraw/zinc/09/13/15/217091315.db2.gz	YPRONROKPNJDEY-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@@H]3OCCN(C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000284504872	218055110	/nfs/dbraw/zinc/05/51/10/218055110.db2.gz	XXKNHUTVJNGTLR-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cc([N+](=O)[O-])n[nH]1)Cc1ccccc1	ZINC000284822039	218193902	/nfs/dbraw/zinc/19/39/02/218193902.db2.gz	AKHNIBKSIWSJOE-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000105824043	194137357	/nfs/dbraw/zinc/13/73/57/194137357.db2.gz	VOFRVNBOCMZUAN-UONOGXRCSA-N	1	1	307.394	1.524	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000064570496	184300416	/nfs/dbraw/zinc/30/04/16/184300416.db2.gz	DKHSFKDLDYOSKG-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000064570496	184300419	/nfs/dbraw/zinc/30/04/19/184300419.db2.gz	DKHSFKDLDYOSKG-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000412310016	224008805	/nfs/dbraw/zinc/00/88/05/224008805.db2.gz	CXSVWXYNVNPLCD-UHFFFAOYSA-N	1	1	307.354	1.266	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000119824700	195043705	/nfs/dbraw/zinc/04/37/05/195043705.db2.gz	QZMTUWRTODWFRX-GFCCVEGCSA-N	1	1	323.397	1.344	20	5		DDBDMO
O=C1NCCCC[C@H]1[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000119973522	195072807	/nfs/dbraw/zinc/07/28/07/195072807.db2.gz	KIGOKQIOSAHHMD-WCQYABFASA-N	1	1	319.365	1.145	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](CCO)CC1CC1	ZINC000352479102	285080333	/nfs/dbraw/zinc/08/03/33/285080333.db2.gz	AOCOHFSSARFWJL-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N[C@@H]1CCCC[NH2+]C1	ZINC000261736388	285156503	/nfs/dbraw/zinc/15/65/03/285156503.db2.gz	RRVNTUIWIANPCV-SECBINFHSA-N	1	1	317.342	1.154	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)c1ncc([N+](=O)[O-])cc1F	ZINC000413303108	224172644	/nfs/dbraw/zinc/17/26/44/224172644.db2.gz	PZMCMCAOKRAJOB-UHFFFAOYSA-N	1	1	313.377	1.449	20	5		DDBDMO
CN(CCCN(C)c1ncc([N+](=O)[O-])cc1F)CC[NH+](C)C	ZINC000413303108	224172646	/nfs/dbraw/zinc/17/26/46/224172646.db2.gz	PZMCMCAOKRAJOB-UHFFFAOYSA-N	1	1	313.377	1.449	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000352802442	285311410	/nfs/dbraw/zinc/31/14/10/285311410.db2.gz	DVDCZMFZFCWYNN-ABAIWWIYSA-N	1	1	321.352	1.829	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])cn1)C(C)C	ZINC000294932028	224319929	/nfs/dbraw/zinc/31/99/29/224319929.db2.gz	KGTJPGRHMXCKKX-ZDUSSCGKSA-N	1	1	310.354	1.579	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](CC)CCO	ZINC000289864981	221278074	/nfs/dbraw/zinc/27/80/74/221278074.db2.gz	RGCYBEJJEHABRA-UHFFFAOYSA-N	1	1	324.381	1.593	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NCC(F)(F)C[NH3+]	ZINC000414655763	224368326	/nfs/dbraw/zinc/36/83/26/224368326.db2.gz	LYABKXLEKSDFTQ-UHFFFAOYSA-N	1	1	304.253	1.319	20	5		DDBDMO
COCC[N@H+](C)CCNCc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000084440021	407088895	/nfs/dbraw/zinc/08/88/95/407088895.db2.gz	XZPNIKMZQVUAJV-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
COCC[N@@H+](C)CCNCc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000084440021	407088898	/nfs/dbraw/zinc/08/88/98/407088898.db2.gz	XZPNIKMZQVUAJV-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000085862043	407106542	/nfs/dbraw/zinc/10/65/42/407106542.db2.gz	ZYCXXGOZBRNREY-UHFFFAOYSA-N	1	1	307.350	1.187	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCC[C@H](C)C1	ZINC000046879086	407064899	/nfs/dbraw/zinc/06/48/99/407064899.db2.gz	KVLUADCYLKNJKN-NSHDSACASA-N	1	1	306.366	1.760	20	5		DDBDMO
O=C(C[N@@H+]1CCCSCC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000089986238	407164382	/nfs/dbraw/zinc/16/43/82/407164382.db2.gz	GGRLICSMFVKPLH-UHFFFAOYSA-N	1	1	321.402	1.923	20	5		DDBDMO
O=C(C[N@H+]1CCCSCC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000089986238	407164386	/nfs/dbraw/zinc/16/43/86/407164386.db2.gz	GGRLICSMFVKPLH-UHFFFAOYSA-N	1	1	321.402	1.923	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000098104768	407305850	/nfs/dbraw/zinc/30/58/50/407305850.db2.gz	XPICEYVYJPLXJZ-JTQLQIEISA-N	1	1	309.370	1.098	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@](C)(O)C1	ZINC000124267957	407353269	/nfs/dbraw/zinc/35/32/69/407353269.db2.gz	RKADRDOBFKYLOU-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@](C)(O)C1	ZINC000124267957	407353270	/nfs/dbraw/zinc/35/32/70/407353270.db2.gz	RKADRDOBFKYLOU-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@](C)(O)C1	ZINC000124268155	407353474	/nfs/dbraw/zinc/35/34/74/407353474.db2.gz	RKADRDOBFKYLOU-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@](C)(O)C1	ZINC000124268155	407353476	/nfs/dbraw/zinc/35/34/76/407353476.db2.gz	RKADRDOBFKYLOU-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000103283663	407336064	/nfs/dbraw/zinc/33/60/64/407336064.db2.gz	ROGFRWFIJNZMQZ-OLZOCXBDSA-N	1	1	321.377	1.950	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000112364040	407427642	/nfs/dbraw/zinc/42/76/42/407427642.db2.gz	ZXXBAVYUQPRUJL-UHFFFAOYSA-N	1	1	315.395	1.605	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)c1	ZINC000127153268	407429215	/nfs/dbraw/zinc/42/92/15/407429215.db2.gz	SHAPRFFPQXLGMI-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000113198165	407474988	/nfs/dbraw/zinc/47/49/88/407474988.db2.gz	AZKZIYLUTIGOGI-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1	ZINC000173612033	407889608	/nfs/dbraw/zinc/88/96/08/407889608.db2.gz	CJXWMULNIDMJFY-CQSZACIVSA-N	1	1	307.350	1.871	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1	ZINC000173612033	407889614	/nfs/dbraw/zinc/88/96/14/407889614.db2.gz	CJXWMULNIDMJFY-CQSZACIVSA-N	1	1	307.350	1.871	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2nn(C)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000272467542	407934733	/nfs/dbraw/zinc/93/47/33/407934733.db2.gz	WIABJMJPDXLUSI-QWRGUYRKSA-N	1	1	309.370	1.131	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+]([C@@H]3CCCC[C@H]3O)C2)nc1	ZINC000245635271	408031562	/nfs/dbraw/zinc/03/15/62/408031562.db2.gz	RFPNOBNZBJHLPZ-MRVWCRGKSA-N	1	1	306.366	1.780	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000189553211	408049952	/nfs/dbraw/zinc/04/99/52/408049952.db2.gz	CFVYQIUFZHGWTD-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C1CCC(=O)N1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000135237604	407994853	/nfs/dbraw/zinc/99/48/53/407994853.db2.gz	FEMRKTMNZNUKLY-UHFFFAOYSA-N	1	1	317.345	1.708	20	5		DDBDMO
O=C1CCC(=O)N1CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000135237604	407994859	/nfs/dbraw/zinc/99/48/59/407994859.db2.gz	FEMRKTMNZNUKLY-UHFFFAOYSA-N	1	1	317.345	1.708	20	5		DDBDMO
CCOC(=O)C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000136805111	408127053	/nfs/dbraw/zinc/12/70/53/408127053.db2.gz	JPIAIMKVJQINBW-OAHLLOKOSA-N	1	1	322.361	1.903	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[N@H+]2CCCC[C@H]2C1	ZINC000151012993	408239534	/nfs/dbraw/zinc/23/95/34/408239534.db2.gz	OBHTUIMKLSEFMG-AWEZNQCLSA-N	1	1	321.352	1.973	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000155704572	408199224	/nfs/dbraw/zinc/19/92/24/408199224.db2.gz	MXHDUIRISZNAAB-DOMZBBRYSA-N	1	1	305.378	1.982	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@H]1COc2ccccc2O1	ZINC000176193541	408304142	/nfs/dbraw/zinc/30/41/42/408304142.db2.gz	ZDGOETREDMCHHZ-GFCCVEGCSA-N	1	1	318.333	1.563	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183184966	408347213	/nfs/dbraw/zinc/34/72/13/408347213.db2.gz	AGRFETPLPRKKJK-WCQYABFASA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183184966	408347218	/nfs/dbraw/zinc/34/72/18/408347218.db2.gz	AGRFETPLPRKKJK-WCQYABFASA-N	1	1	319.361	1.187	20	5		DDBDMO
C[NH+](C)[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000170867471	162197149	/nfs/dbraw/zinc/19/71/49/162197149.db2.gz	ICOINSSJNGBAEL-SNVBAGLBSA-N	1	1	303.322	1.247	20	5		DDBDMO
C[C@@H]1CC(O)C[C@@H](C)[NH+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000191258757	408395164	/nfs/dbraw/zinc/39/51/64/408395164.db2.gz	COLOPABOEDCHGX-VXGBXAGGSA-N	1	1	321.377	1.791	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C	ZINC000191482983	408432673	/nfs/dbraw/zinc/43/26/73/408432673.db2.gz	BEMCXCLUPRJUKH-GFCCVEGCSA-N	1	1	321.377	1.983	20	5		DDBDMO
CCc1[nH+]ccn1[C@H]1CCCN(c2c([N+](=O)[O-])ncn2C)C1	ZINC000264324797	408444561	/nfs/dbraw/zinc/44/45/61/408444561.db2.gz	LBRQOZUHYLVCCK-NSHDSACASA-N	1	1	304.354	1.929	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@H]1n1ccnc1	ZINC000247658917	408500725	/nfs/dbraw/zinc/50/07/25/408500725.db2.gz	XHRZIOTYENHYSJ-GXTWGEPZSA-N	1	1	304.354	1.571	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534274	408566211	/nfs/dbraw/zinc/56/62/11/408566211.db2.gz	WDMVXQYWFPEHNU-DOMZBBRYSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534274	408566215	/nfs/dbraw/zinc/56/62/15/408566215.db2.gz	WDMVXQYWFPEHNU-DOMZBBRYSA-N	1	1	321.377	1.793	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248450130	408568964	/nfs/dbraw/zinc/56/89/64/408568964.db2.gz	ILUOZQZLESQXEL-ZIAGYGMSSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@H]1CSCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248462588	408573777	/nfs/dbraw/zinc/57/37/77/408573777.db2.gz	PZPFXNFINAYNEN-NWDGAFQWSA-N	1	1	312.391	1.772	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000161317604	408586628	/nfs/dbraw/zinc/58/66/28/408586628.db2.gz	OFPVHTSTMMLHCK-LLVKDONJSA-N	1	1	308.386	1.747	20	5		DDBDMO
C[C@@H](c1ccccn1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680758	408634332	/nfs/dbraw/zinc/63/43/32/408634332.db2.gz	URCSPOHINMCOLU-AAEUAGOBSA-N	1	1	305.338	1.240	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270859337	408711384	/nfs/dbraw/zinc/71/13/84/408711384.db2.gz	ZOOOJOXTTRFXPD-LLVKDONJSA-N	1	1	309.370	1.323	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](CCO)CC1	ZINC000185006706	408735396	/nfs/dbraw/zinc/73/53/96/408735396.db2.gz	SQKNCBFWGJOCIU-OUKQBFOZSA-N	1	1	319.361	1.135	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H]1CO	ZINC000248997303	408675603	/nfs/dbraw/zinc/67/56/03/408675603.db2.gz	YCBSFIUNHOCDRG-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000249054416	408679143	/nfs/dbraw/zinc/67/91/43/408679143.db2.gz	LGBLTSUGWVIAHP-KGLIPLIRSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000249054416	408679147	/nfs/dbraw/zinc/67/91/47/408679147.db2.gz	LGBLTSUGWVIAHP-KGLIPLIRSA-N	1	1	310.350	1.445	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185227214	408782480	/nfs/dbraw/zinc/78/24/80/408782480.db2.gz	GQPWGAHSFFGNNV-UHFFFAOYSA-N	1	1	313.379	1.310	20	5		DDBDMO
CC[C@H]1CN(c2nc(C)ccc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000178213390	408788729	/nfs/dbraw/zinc/78/87/29/408788729.db2.gz	RFGNERWACTXVDD-ZDUSSCGKSA-N	1	1	308.382	1.845	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000265743478	408766716	/nfs/dbraw/zinc/76/67/16/408766716.db2.gz	VKEHSNBRJJWIMK-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[N@@H+](C3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000265743478	408766723	/nfs/dbraw/zinc/76/67/23/408766723.db2.gz	VKEHSNBRJJWIMK-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[N@H+](C3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000265743478	408766729	/nfs/dbraw/zinc/76/67/29/408766729.db2.gz	VKEHSNBRJJWIMK-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000194707721	163294289	/nfs/dbraw/zinc/29/42/89/163294289.db2.gz	SWJZDQUOEWHQFA-SNVBAGLBSA-N	1	1	303.322	1.295	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1(CO)CCC1	ZINC000292208721	409001591	/nfs/dbraw/zinc/00/15/91/409001591.db2.gz	TUHBQCPEPUJEFM-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H]1[C@@H]([NH+]2CCCC2)CCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000287306787	409016549	/nfs/dbraw/zinc/01/65/49/409016549.db2.gz	UNXZXRSNFZCFKW-NHYWBVRUSA-N	1	1	319.361	1.999	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@H](O)Cc1ccccc1	ZINC000293143686	409057632	/nfs/dbraw/zinc/05/76/32/409057632.db2.gz	BFNMQSCVKOOZNC-AWEZNQCLSA-N	1	1	304.350	1.327	20	5		DDBDMO
CC[N@@H+](CCNc1nc(C(=O)OC)ccc1[N+](=O)[O-])C1CC1	ZINC000287693595	409078011	/nfs/dbraw/zinc/07/80/11/409078011.db2.gz	DSSRWQHDYVXWAK-UHFFFAOYSA-N	1	1	308.338	1.673	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000293315077	409087512	/nfs/dbraw/zinc/08/75/12/409087512.db2.gz	FQJOTUBRKVGDKM-FRRDWIJNSA-N	1	1	320.393	1.946	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000279391112	409204882	/nfs/dbraw/zinc/20/48/82/409204882.db2.gz	UHCKQMIWIBKABR-XJKSGUPXSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]2OCC[N@@H+](C)[C@H]2C1	ZINC000408028976	164202588	/nfs/dbraw/zinc/20/25/88/164202588.db2.gz	VMODWNOVYOAALR-NWDGAFQWSA-N	1	1	309.370	1.029	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000356903498	409708421	/nfs/dbraw/zinc/70/84/21/409708421.db2.gz	PRLJFEMSRQTCBL-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000356835250	409645269	/nfs/dbraw/zinc/64/52/69/409645269.db2.gz	BLKAMKFRESEIQY-NEPJUHHUSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@@H](NC(=O)[C@H]1C[N@H+]2CCN1CCC2)c1ccccc1[N+](=O)[O-]	ZINC000342475248	409661722	/nfs/dbraw/zinc/66/17/22/409661722.db2.gz	RNUSOYXKEITLHJ-IUODEOHRSA-N	1	1	318.377	1.162	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@@H]2C1	ZINC000296854719	409669583	/nfs/dbraw/zinc/66/95/83/409669583.db2.gz	UMCMRHATTRNQIO-KGLIPLIRSA-N	1	1	317.349	1.380	20	5		DDBDMO
CC[C@H](C)[NH+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])CC1	ZINC000296879113	409683092	/nfs/dbraw/zinc/68/30/92/409683092.db2.gz	JCGWUGKOHMWXIK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H](C)[NH+]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000296879113	409683119	/nfs/dbraw/zinc/68/31/19/409683119.db2.gz	JCGWUGKOHMWXIK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000354406690	409831396	/nfs/dbraw/zinc/83/13/96/409831396.db2.gz	VZSMNDUYQDIFAZ-ONGXEEELSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000354406690	409831402	/nfs/dbraw/zinc/83/14/02/409831402.db2.gz	VZSMNDUYQDIFAZ-ONGXEEELSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000354406690	409831408	/nfs/dbraw/zinc/83/14/08/409831408.db2.gz	VZSMNDUYQDIFAZ-ONGXEEELSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000354419424	409839513	/nfs/dbraw/zinc/83/95/13/409839513.db2.gz	XEIXMPSMGDFOJP-ZDUSSCGKSA-N	1	1	323.397	1.562	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC000357029293	409806885	/nfs/dbraw/zinc/80/68/85/409806885.db2.gz	CSFDTOJKCUYDAP-STQMWFEESA-N	1	1	320.393	1.866	20	5		DDBDMO
O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[NH+](C2CC2)CC1	ZINC000342886104	409974872	/nfs/dbraw/zinc/97/48/72/409974872.db2.gz	FUDJWDZNHOVBBS-UHFFFAOYSA-N	1	1	314.345	1.996	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000332394031	410122125	/nfs/dbraw/zinc/12/21/25/410122125.db2.gz	WGXIXJWZDAEUKU-HZPDHXFCSA-N	1	1	305.378	1.542	20	5		DDBDMO
C[C@@H]1CC[C@H]([N@@H+](CCO)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000351635838	410125494	/nfs/dbraw/zinc/12/54/94/410125494.db2.gz	QKRIXZNWIIQUOB-OLZOCXBDSA-N	1	1	309.366	1.239	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000332671545	410203951	/nfs/dbraw/zinc/20/39/51/410203951.db2.gz	ZQYJLPVWNKONAF-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000298471481	410246714	/nfs/dbraw/zinc/24/67/14/410246714.db2.gz	QOAJQMFIRLYHBB-LBPRGKRZSA-N	1	1	303.362	1.738	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+](C)C2CC(O)C2)cc1[N+](=O)[O-]	ZINC000354980668	410221693	/nfs/dbraw/zinc/22/16/93/410221693.db2.gz	MNZCOAMXQSTKQH-UHFFFAOYSA-N	1	1	324.333	1.102	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351774206	410224968	/nfs/dbraw/zinc/22/49/68/410224968.db2.gz	KDJOFYZAYGPGDQ-OLUVUFQESA-N	1	1	307.350	1.543	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351774206	410224974	/nfs/dbraw/zinc/22/49/74/410224974.db2.gz	KDJOFYZAYGPGDQ-OLUVUFQESA-N	1	1	307.350	1.543	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)(CO)CO	ZINC000347354425	410493110	/nfs/dbraw/zinc/49/31/10/410493110.db2.gz	BEYOAFAPHLXPPP-NTUHNPAUSA-N	1	1	308.378	1.921	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343612228	410570160	/nfs/dbraw/zinc/57/01/60/410570160.db2.gz	VNXXGSLPKKRKBI-RISCZKNCSA-N	1	1	306.366	1.877	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H](C)O	ZINC000352195719	410538328	/nfs/dbraw/zinc/53/83/28/410538328.db2.gz	SVSSYRBWSVTPRG-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C[C@H](C)O	ZINC000352195719	410538334	/nfs/dbraw/zinc/53/83/34/410538334.db2.gz	SVSSYRBWSVTPRG-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)C[NH+]2CCOCC2)c1	ZINC000359392863	410635884	/nfs/dbraw/zinc/63/58/84/410635884.db2.gz	NWGUNFYVZGFWJQ-ZDUSSCGKSA-N	1	1	321.377	1.601	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[C@@H]1C[N@@H+]1CCC[C@H]1CO	ZINC000301530275	410737487	/nfs/dbraw/zinc/73/74/87/410737487.db2.gz	KWBFAPNDMVVBMY-OLZOCXBDSA-N	1	1	306.366	1.415	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(S(N)(=O)=O)CC1	ZINC000330528757	410751685	/nfs/dbraw/zinc/75/16/85/410751685.db2.gz	RSHBESMXNYXOIC-SNVBAGLBSA-N	1	1	313.379	1.409	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](C)[C@H]1CO	ZINC000330575468	410791823	/nfs/dbraw/zinc/79/18/23/410791823.db2.gz	OGHXAYDOJRRBKF-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](C)[C@H]1CO	ZINC000330575468	410791824	/nfs/dbraw/zinc/79/18/24/410791824.db2.gz	OGHXAYDOJRRBKF-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000301801013	410799947	/nfs/dbraw/zinc/79/99/47/410799947.db2.gz	CDCBZRKHKIKDNX-ZDUSSCGKSA-N	1	1	320.393	1.903	20	5		DDBDMO
Cc1nn(C)c(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301884954	410822888	/nfs/dbraw/zinc/82/28/88/410822888.db2.gz	ZEUDTZFHPMEKEJ-RYUDHWBXSA-N	1	1	309.370	1.302	20	5		DDBDMO
Cc1nn(C)c(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301884954	410822897	/nfs/dbraw/zinc/82/28/97/410822897.db2.gz	ZEUDTZFHPMEKEJ-RYUDHWBXSA-N	1	1	309.370	1.302	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](CCO)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000302542913	410847824	/nfs/dbraw/zinc/84/78/24/410847824.db2.gz	OEKQPLLZGNSEPM-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000330666679	410862624	/nfs/dbraw/zinc/86/26/24/410862624.db2.gz	WOZGRMFGWORLDC-BXUZGUMPSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344032849	410907933	/nfs/dbraw/zinc/90/79/33/410907933.db2.gz	DXYADTZBPRABOV-FDRIWYBQSA-N	1	1	319.361	1.625	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000344240688	411047701	/nfs/dbraw/zinc/04/77/01/411047701.db2.gz	QZQIAFGPNFSLST-GFCCVEGCSA-N	1	1	311.313	1.184	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000331430508	411087415	/nfs/dbraw/zinc/08/74/15/411087415.db2.gz	CDGQKCSYECETFG-ZWNOBZJWSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CCC[N@H+]1CCOC	ZINC000360965900	418555780	/nfs/dbraw/zinc/55/57/80/418555780.db2.gz	KJYPWFKBMXKMAR-LBPRGKRZSA-N	1	1	311.386	1.642	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](CCO)[C@@H](C)C1	ZINC000188303953	222010849	/nfs/dbraw/zinc/01/08/49/222010849.db2.gz	MWWAEHBMXCZTDL-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000188303953	222010852	/nfs/dbraw/zinc/01/08/52/222010852.db2.gz	MWWAEHBMXCZTDL-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1	ZINC000375011465	418587862	/nfs/dbraw/zinc/58/78/62/418587862.db2.gz	FZGIKRQOISLMBE-KBPBESRZSA-N	1	1	308.382	1.930	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000194599753	222179312	/nfs/dbraw/zinc/17/93/12/222179312.db2.gz	UUVIWUXSZDYOLS-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2C(=O)NC[C@H]2C1	ZINC000368231814	418707807	/nfs/dbraw/zinc/70/78/07/418707807.db2.gz	YVSRPARRAMNZRF-AAEUAGOBSA-N	1	1	305.334	1.171	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1cc([N+](=O)[O-])cnc1N)CC2	ZINC000368119469	418692463	/nfs/dbraw/zinc/69/24/63/418692463.db2.gz	LHFFMWSBMRYOFR-UHFFFAOYSA-N	1	1	319.365	1.272	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCOC[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000371099100	418761594	/nfs/dbraw/zinc/76/15/94/418761594.db2.gz	JQZHCGHNHAKMDL-LBPRGKRZSA-N	1	1	310.350	1.951	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@H](CO)C1	ZINC000371688060	418809267	/nfs/dbraw/zinc/80/92/67/418809267.db2.gz	CLWUJUQLBRZLQK-KBPBESRZSA-N	1	1	324.377	1.429	20	5		DDBDMO
CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC	ZINC000411227739	418881995	/nfs/dbraw/zinc/88/19/95/418881995.db2.gz	LCGFGDVPYOBAIG-UHFFFAOYSA-N	1	1	309.322	1.418	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC	ZINC000411227739	418881998	/nfs/dbraw/zinc/88/19/98/418881998.db2.gz	LCGFGDVPYOBAIG-UHFFFAOYSA-N	1	1	309.322	1.418	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](O)C[C@@H]1C	ZINC000411413826	418901584	/nfs/dbraw/zinc/90/15/84/418901584.db2.gz	AONLDTWRLPHYJY-JQWIXIFHSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000372973148	418918007	/nfs/dbraw/zinc/91/80/07/418918007.db2.gz	JCTIBSAUMWBMQP-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000411622365	419363960	/nfs/dbraw/zinc/36/39/60/419363960.db2.gz	SSPCSOVGJBWALQ-QLFBSQMISA-N	1	1	303.362	1.909	20	5		DDBDMO
CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCC[N@H+]1C	ZINC000421011086	419448007	/nfs/dbraw/zinc/44/80/07/419448007.db2.gz	RSQCCCUXZSVORW-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011086	419448014	/nfs/dbraw/zinc/44/80/14/419448014.db2.gz	RSQCCCUXZSVORW-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011086	419448018	/nfs/dbraw/zinc/44/80/18/419448018.db2.gz	RSQCCCUXZSVORW-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[N@H+](Cc1occc1C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000412024954	419569197	/nfs/dbraw/zinc/56/91/97/419569197.db2.gz	GUWXLXFFMFKWEU-CYBMUJFWSA-N	1	1	308.338	1.576	20	5		DDBDMO
COCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CCCSC1	ZINC000433187812	229169117	/nfs/dbraw/zinc/16/91/17/229169117.db2.gz	BKDXTMGVPQYCFE-LLVKDONJSA-N	1	1	314.411	1.672	20	5		DDBDMO
COCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@@H]1CCCSC1	ZINC000433187812	229169120	/nfs/dbraw/zinc/16/91/20/229169120.db2.gz	BKDXTMGVPQYCFE-LLVKDONJSA-N	1	1	314.411	1.672	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000430280256	420103298	/nfs/dbraw/zinc/10/32/98/420103298.db2.gz	VPRBDNVJBDZSLS-OAHLLOKOSA-N	1	1	307.350	1.561	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000423969127	420287735	/nfs/dbraw/zinc/28/77/35/420287735.db2.gz	LGHAPHDEXPXGER-LBPRGKRZSA-N	1	1	301.306	1.105	20	5		DDBDMO
CO[C@@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000425417024	420378308	/nfs/dbraw/zinc/37/83/08/420378308.db2.gz	MCMKCXUHJTZZNE-OCCSQVGLSA-N	1	1	306.366	1.901	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000453006097	420700380	/nfs/dbraw/zinc/70/03/80/420700380.db2.gz	KXDCVNZLQHSTJW-GXFFZTMASA-N	1	1	305.334	1.380	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444650327	420759324	/nfs/dbraw/zinc/75/93/24/420759324.db2.gz	MUZFMKZKHFNLKB-SECBINFHSA-N	1	1	305.338	1.285	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1F	ZINC000448795578	420898263	/nfs/dbraw/zinc/89/82/63/420898263.db2.gz	PVCOYSPNGMSOIS-SECBINFHSA-N	1	1	323.324	1.709	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000455040381	420961776	/nfs/dbraw/zinc/96/17/76/420961776.db2.gz	MHSXUUVWXCKUPX-LLVKDONJSA-N	1	1	307.354	1.360	20	5		DDBDMO
CC(C)[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+]1C	ZINC000487956634	421060234	/nfs/dbraw/zinc/06/02/34/421060234.db2.gz	VXQSIRKXGIBNQC-AWEZNQCLSA-N	1	1	308.382	1.029	20	5		DDBDMO
Cn1nnc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1	ZINC000494355681	421000553	/nfs/dbraw/zinc/00/05/53/421000553.db2.gz	HAPPXZWNNHTNFT-YPMHNXCESA-N	1	1	316.365	1.619	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455818372	421065243	/nfs/dbraw/zinc/06/52/43/421065243.db2.gz	AXVIVUMZLSOHMT-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)C[C@@H]1[NH+]1CCOCC1	ZINC000450397525	421192834	/nfs/dbraw/zinc/19/28/34/421192834.db2.gz	VWFKRBWZRARDEF-OCCSQVGLSA-N	1	1	306.366	1.537	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@@H]1CCC[N@@H+]1CCCO)CCN2	ZINC000450591778	421213954	/nfs/dbraw/zinc/21/39/54/421213954.db2.gz	GKZLZZNYXYFARS-LBPRGKRZSA-N	1	1	320.393	1.822	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000559840948	421226463	/nfs/dbraw/zinc/22/64/63/421226463.db2.gz	DENRHNOBDVWEPG-UHFFFAOYSA-N	1	1	306.366	1.842	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC(C[N@H+](C)C(C)C)CC2)c1[N+](=O)[O-]	ZINC000523352743	421234663	/nfs/dbraw/zinc/23/46/63/421234663.db2.gz	QOLCGOQIVFFVKW-UHFFFAOYSA-N	1	1	323.397	1.819	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(C[N@@H+](C)C(C)C)CC2)c1[N+](=O)[O-]	ZINC000523352743	421234664	/nfs/dbraw/zinc/23/46/64/421234664.db2.gz	QOLCGOQIVFFVKW-UHFFFAOYSA-N	1	1	323.397	1.819	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(C[N@H+](C)C(C)C)CC2)c1[N+](=O)[O-]	ZINC000523352743	421234668	/nfs/dbraw/zinc/23/46/68/421234668.db2.gz	QOLCGOQIVFFVKW-UHFFFAOYSA-N	1	1	323.397	1.819	20	5		DDBDMO
CC(C)[N@H+](Cc1ccccn1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000525782934	421301345	/nfs/dbraw/zinc/30/13/45/421301345.db2.gz	HBGSRULPXSNCLH-OAHLLOKOSA-N	1	1	319.365	1.458	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000524719958	421266171	/nfs/dbraw/zinc/26/61/71/421266171.db2.gz	RQFZKPPPLZPECW-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21	ZINC000547838439	421372233	/nfs/dbraw/zinc/37/22/33/421372233.db2.gz	OEKIVMKVDMUITO-GFCCVEGCSA-N	1	1	315.333	1.245	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21	ZINC000547838439	421372237	/nfs/dbraw/zinc/37/22/37/421372237.db2.gz	OEKIVMKVDMUITO-GFCCVEGCSA-N	1	1	315.333	1.245	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21	ZINC000547838440	421372517	/nfs/dbraw/zinc/37/25/17/421372517.db2.gz	OEKIVMKVDMUITO-LBPRGKRZSA-N	1	1	315.333	1.245	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21	ZINC000547838440	421372519	/nfs/dbraw/zinc/37/25/19/421372519.db2.gz	OEKIVMKVDMUITO-LBPRGKRZSA-N	1	1	315.333	1.245	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1	ZINC000548058505	421394659	/nfs/dbraw/zinc/39/46/59/421394659.db2.gz	RIADYHQBPWQEQU-MNOVXSKESA-N	1	1	321.381	1.422	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CC[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000562916497	421425726	/nfs/dbraw/zinc/42/57/26/421425726.db2.gz	IKTMQUINZQFZBY-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000549189193	421496662	/nfs/dbraw/zinc/49/66/62/421496662.db2.gz	BEUGNSLVFWJYBU-GHMZBOCLSA-N	1	1	321.381	1.701	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000553319371	421611248	/nfs/dbraw/zinc/61/12/48/421611248.db2.gz	HRIDKLDPXNBZDY-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000553319371	421611250	/nfs/dbraw/zinc/61/12/50/421611250.db2.gz	HRIDKLDPXNBZDY-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
C[C@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000554856889	421664262	/nfs/dbraw/zinc/66/42/62/421664262.db2.gz	DFJDJLAHFOSSTR-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000537814636	421736033	/nfs/dbraw/zinc/73/60/33/421736033.db2.gz	FXYBWTMIMGMJGL-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@@H+]1C	ZINC000537814636	421736035	/nfs/dbraw/zinc/73/60/35/421736035.db2.gz	FXYBWTMIMGMJGL-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000557572543	421777848	/nfs/dbraw/zinc/77/78/48/421777848.db2.gz	WHMFRNVJGNVYKA-NSHDSACASA-N	1	1	322.365	1.839	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000345328976	272220681	/nfs/dbraw/zinc/22/06/81/272220681.db2.gz	VEJKXJXFHXAEQJ-VXGBXAGGSA-N	1	1	306.366	1.606	20	5		DDBDMO
CC[N@@H+]1C[C@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000345901802	272362431	/nfs/dbraw/zinc/36/24/31/272362431.db2.gz	HYEOVJBUCXZQFD-UWVGGRQHSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000345901802	272362433	/nfs/dbraw/zinc/36/24/33/272362433.db2.gz	HYEOVJBUCXZQFD-UWVGGRQHSA-N	1	1	309.370	1.191	20	5		DDBDMO
C[C@@H](CNc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[NH+]1CCOCC1	ZINC000278408429	274226157	/nfs/dbraw/zinc/22/61/57/274226157.db2.gz	HIVUUXJNEWLTLW-NSHDSACASA-N	1	1	319.365	1.851	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H]1C	ZINC000275387156	274270574	/nfs/dbraw/zinc/27/05/74/274270574.db2.gz	PYSWOEPDMHWHBM-NWDGAFQWSA-N	1	1	320.393	1.454	20	5		DDBDMO
O=C1OCC[C@@H]1CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000177648984	275026844	/nfs/dbraw/zinc/02/68/44/275026844.db2.gz	LCEYIQPJKZTMJK-ZDUSSCGKSA-N	1	1	319.361	1.670	20	5		DDBDMO
CCC[C@H]1CN(c2ncccc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000271012837	276049707	/nfs/dbraw/zinc/04/97/07/276049707.db2.gz	YBJDBGUUMFVXLC-ZDUSSCGKSA-N	1	1	308.382	1.927	20	5		DDBDMO
CC[N@H+]1CCCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000276952237	276165314	/nfs/dbraw/zinc/16/53/14/276165314.db2.gz	VPWGNPHLIMSLBC-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2ccc(F)cc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000413492091	277134873	/nfs/dbraw/zinc/13/48/73/277134873.db2.gz	CBLBCJWBCQDFEQ-JTQLQIEISA-N	1	1	311.313	1.275	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c1	ZINC000420432279	280654719	/nfs/dbraw/zinc/65/47/19/280654719.db2.gz	XVCSQJZBZUFPIR-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933163	281029765	/nfs/dbraw/zinc/02/97/65/281029765.db2.gz	DLNGUECRMIZDCE-CHWSQXEVSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933163	281029768	/nfs/dbraw/zinc/02/97/68/281029768.db2.gz	DLNGUECRMIZDCE-CHWSQXEVSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C1	ZINC000369359357	301171628	/nfs/dbraw/zinc/17/16/28/301171628.db2.gz	QQASQGKDBBISRB-INIZCTEOSA-N	1	1	318.421	1.807	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3OCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000369677875	301211177	/nfs/dbraw/zinc/21/11/77/301211177.db2.gz	ZKUYRDAOHXXDFU-GXTWGEPZSA-N	1	1	305.334	1.305	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000369998244	301254898	/nfs/dbraw/zinc/25/48/98/301254898.db2.gz	QRCPFOHZFWNPPX-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000369998244	301254900	/nfs/dbraw/zinc/25/49/00/301254900.db2.gz	QRCPFOHZFWNPPX-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000369998244	301254901	/nfs/dbraw/zinc/25/49/01/301254901.db2.gz	QRCPFOHZFWNPPX-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3CC[NH2+][C@@H]3C2)c1[N+](=O)[O-]	ZINC000370166709	301286894	/nfs/dbraw/zinc/28/68/94/301286894.db2.gz	ZQLKEXBMJOHHLD-MWLCHTKSSA-N	1	1	307.354	1.094	20	5		DDBDMO
CN1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C[C@H]1c1ccccc1Cl	ZINC000377123227	302145924	/nfs/dbraw/zinc/14/59/24/302145924.db2.gz	OPKBEFNHOBRNLD-BNOWGMLFSA-N	1	1	323.780	1.820	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000377362859	302172595	/nfs/dbraw/zinc/17/25/95/302172595.db2.gz	QSSHTEFZDMSRPO-UWVGGRQHSA-N	1	1	305.338	1.127	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000532078038	303274782	/nfs/dbraw/zinc/27/47/82/303274782.db2.gz	IJQDDULYVBYBNF-YGRLFVJLSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532143600	303277329	/nfs/dbraw/zinc/27/73/29/303277329.db2.gz	OGTGLKPBWZWONW-GFCCVEGCSA-N	1	1	306.366	1.984	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000534338946	303332096	/nfs/dbraw/zinc/33/20/96/303332096.db2.gz	GVUNNXQILANMBS-VXGBXAGGSA-N	1	1	321.377	1.697	20	5		DDBDMO
Cc1nn(C)c(N2CC[NH+]([C@H]3CCSC3)CC2)c1[N+](=O)[O-]	ZINC000364008620	307039698	/nfs/dbraw/zinc/03/96/98/307039698.db2.gz	IBIXMTBRFYSZSB-NSHDSACASA-N	1	1	311.411	1.264	20	5		DDBDMO
CNC(=O)c1ccc(N2CCC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000371475743	307150956	/nfs/dbraw/zinc/15/09/56/307150956.db2.gz	NAKGMBWBSPQFIF-ZDUSSCGKSA-N	1	1	318.377	1.629	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@](O)(c3ccc(F)cc3)C2)n1	ZINC000375965524	307236491	/nfs/dbraw/zinc/23/64/91/307236491.db2.gz	YBOCJQKLDCDFIX-HNNXBMFYSA-N	1	1	320.324	1.524	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@@H]2CCCC[N@H+]2CCO)c1[N+](=O)[O-]	ZINC000452378487	534607152	/nfs/dbraw/zinc/60/71/52/534607152.db2.gz	WZIRVILBGOEHHK-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@H](O)C[C@@H]1[C@H]1CCCOC1	ZINC000451300863	534886803	/nfs/dbraw/zinc/88/68/03/534886803.db2.gz	MREMEGJMKQVKRJ-SQWLQELKSA-N	1	1	306.362	1.957	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000330990985	529096226	/nfs/dbraw/zinc/09/62/26/529096226.db2.gz	AUQMGFJLBIYUPT-LBPRGKRZSA-N	1	1	323.397	1.469	20	5		DDBDMO
CCN1CC[NH+](CCCNc2ncc([N+](=O)[O-])c(C)n2)CC1	ZINC000296651363	529145241	/nfs/dbraw/zinc/14/52/41/529145241.db2.gz	XKKMJGHPTBWHOX-UHFFFAOYSA-N	1	1	308.386	1.133	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCCC[NH+]1CCOCC1	ZINC000748495574	700121984	/nfs/dbraw/zinc/12/19/84/700121984.db2.gz	SXWCNHGSDDHKSX-QPJJXVBHSA-N	1	1	320.345	1.874	20	5		DDBDMO
Cc1cc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cs1	ZINC000981137827	697015744	/nfs/dbraw/zinc/01/57/44/697015744.db2.gz	GWFYQZZXAVJPPP-ZIAGYGMSSA-N	1	1	323.418	1.756	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]Cc2cccc(F)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983653187	697286576	/nfs/dbraw/zinc/28/65/76/697286576.db2.gz	HKBPJCYDFVOEKY-NMFUWQPSSA-N	1	1	321.352	1.475	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000178776411	697428775	/nfs/dbraw/zinc/42/87/75/697428775.db2.gz	FIHTXOUJZPHTFF-LBPRGKRZSA-N	1	1	318.333	1.930	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678497	700176264	/nfs/dbraw/zinc/17/62/64/700176264.db2.gz	SRUWIYVQWAKQAH-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678497	700176265	/nfs/dbraw/zinc/17/62/65/700176265.db2.gz	SRUWIYVQWAKQAH-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CC(O)(C(C)C)C1	ZINC000773891719	697819263	/nfs/dbraw/zinc/81/92/63/697819263.db2.gz	AEQSTORWLPKUEH-UHFFFAOYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594043	698125060	/nfs/dbraw/zinc/12/50/60/698125060.db2.gz	RZAKMXGHKGMOAD-CZUORRHYSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[N@@H+](CCCn1ccnc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776600683	698126018	/nfs/dbraw/zinc/12/60/18/698126018.db2.gz	DNVQNBLFLNBELW-OAHLLOKOSA-N	1	1	304.350	1.847	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000262073041	698453275	/nfs/dbraw/zinc/45/32/75/698453275.db2.gz	CVDHYRHUPSMAMV-LLCTXKFZSA-N	1	1	316.405	1.588	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2C[C@@]2(CO)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000782633747	698755450	/nfs/dbraw/zinc/75/54/50/698755450.db2.gz	QCPMKODWIWVCLM-ABAIWWIYSA-N	1	1	305.334	1.238	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000786846002	699172745	/nfs/dbraw/zinc/17/27/45/699172745.db2.gz	SIUALXVJNHTJGZ-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
Cc1[nH+]ccn1-c1ccc(CNc2ccncc2[N+](=O)[O-])cn1	ZINC000727430925	699411949	/nfs/dbraw/zinc/41/19/49/699411949.db2.gz	GXTMMJBNQCVNIH-UHFFFAOYSA-N	1	1	310.317	1.913	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nnnn1C1CC1	ZINC000790533074	699465630	/nfs/dbraw/zinc/46/56/30/699465630.db2.gz	JLZRTUIPDDUMDO-ZANVPECISA-N	1	1	318.337	1.300	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])c2nonc21	ZINC000734484599	699652799	/nfs/dbraw/zinc/65/27/99/699652799.db2.gz	ARAGIMNWYGUZJJ-SNVBAGLBSA-N	1	1	305.338	1.909	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000744798669	699961333	/nfs/dbraw/zinc/96/13/33/699961333.db2.gz	MRSVODITQNWBTA-JTQLQIEISA-N	1	1	322.321	1.575	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000751952091	700329791	/nfs/dbraw/zinc/32/97/91/700329791.db2.gz	VIDYXYAQIVPXOG-CYBMUJFWSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000751952091	700329795	/nfs/dbraw/zinc/32/97/95/700329795.db2.gz	VIDYXYAQIVPXOG-CYBMUJFWSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801886758	700350781	/nfs/dbraw/zinc/35/07/81/700350781.db2.gz	FMOWRJFEIVLXAY-SECBINFHSA-N	1	1	310.329	1.388	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H]2C[C@H](C)O)c2ncc([N+](=O)[O-])cc12	ZINC000752803519	700389041	/nfs/dbraw/zinc/38/90/41/700389041.db2.gz	JNMLIZQRTPCRKH-JQWIXIFHSA-N	1	1	319.365	1.841	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000763876568	700951619	/nfs/dbraw/zinc/95/16/19/700951619.db2.gz	UYGFDXFLXQIWBJ-CABCVRRESA-N	1	1	312.366	1.346	20	5		DDBDMO
O=C(NC1CCC([NH+]2CCCCC2)CC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000764533694	700975754	/nfs/dbraw/zinc/97/57/54/700975754.db2.gz	UZZABKRIASLZLI-UHFFFAOYSA-N	1	1	321.381	1.845	20	5		DDBDMO
CNc1c(C(=O)OCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000765517087	701017573	/nfs/dbraw/zinc/01/75/73/701017573.db2.gz	UWZAMJIWZUZGHJ-UHFFFAOYSA-N	1	1	323.349	1.516	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000771407593	701318969	/nfs/dbraw/zinc/31/89/69/701318969.db2.gz	RRVCBVIPLPVKEN-VXGBXAGGSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000771407593	701318971	/nfs/dbraw/zinc/31/89/71/701318971.db2.gz	RRVCBVIPLPVKEN-VXGBXAGGSA-N	1	1	320.393	1.825	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)C(C)(C)CC2)n1	ZINC000866112505	706621781	/nfs/dbraw/zinc/62/17/81/706621781.db2.gz	DFEMEJPFSACCPE-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000840094781	701966230	/nfs/dbraw/zinc/96/62/30/701966230.db2.gz	WZONBSPLDVPLMN-ZDUSSCGKSA-N	1	1	303.366	1.928	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812337763	702161655	/nfs/dbraw/zinc/16/16/55/702161655.db2.gz	HROWJSSSSTVGRM-WDEREUQCSA-N	1	1	321.381	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812337763	702161658	/nfs/dbraw/zinc/16/16/58/702161658.db2.gz	HROWJSSSSTVGRM-WDEREUQCSA-N	1	1	321.381	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812337763	702161661	/nfs/dbraw/zinc/16/16/61/702161661.db2.gz	HROWJSSSSTVGRM-WDEREUQCSA-N	1	1	321.381	1.465	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000879320874	706649102	/nfs/dbraw/zinc/64/91/02/706649102.db2.gz	JSHBEQYEORECAY-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000817151530	702290999	/nfs/dbraw/zinc/29/09/99/702290999.db2.gz	SVKOOZSOFVUZIF-SECBINFHSA-N	1	1	319.408	1.371	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](COC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000842829382	702780888	/nfs/dbraw/zinc/78/08/88/702780888.db2.gz	HNSAFYVJSPCOQQ-NSHDSACASA-N	1	1	310.354	1.606	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)C2(C)C)c1	ZINC000844334204	703016860	/nfs/dbraw/zinc/01/68/60/703016860.db2.gz	VHKHQAVCPNLAGO-CYBMUJFWSA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)C2(C)C)c1	ZINC000844334204	703016862	/nfs/dbraw/zinc/01/68/62/703016862.db2.gz	VHKHQAVCPNLAGO-CYBMUJFWSA-N	1	1	308.334	1.727	20	5		DDBDMO
C[C@@H]1C[C@@H]1C(N)=[NH+]O[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000848518513	703560317	/nfs/dbraw/zinc/56/03/17/703560317.db2.gz	KRVCARVVVUYWBQ-ICCXJUOJSA-N	1	1	318.333	1.855	20	5		DDBDMO
CCC[N@@H+]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979996	704041611	/nfs/dbraw/zinc/04/16/11/704041611.db2.gz	FNOSITSFMQDNHV-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979996	704041614	/nfs/dbraw/zinc/04/16/14/704041614.db2.gz	FNOSITSFMQDNHV-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
Cc1cc(C[C@@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000819176515	704081608	/nfs/dbraw/zinc/08/16/08/704081608.db2.gz	FCIVOQBBWVMQDM-BMIGLBTASA-N	1	1	304.350	1.881	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000819899971	704183989	/nfs/dbraw/zinc/18/39/89/704183989.db2.gz	XHNWPXRVCYZIKE-SNVBAGLBSA-N	1	1	308.338	1.084	20	5		DDBDMO
COc1cc(N2CC[NH+]([C@H]3CCOC3)CC2)c([N+](=O)[O-])cc1C	ZINC000853451250	704241383	/nfs/dbraw/zinc/24/13/83/704241383.db2.gz	DMFVDIKZEJMHAE-ZDUSSCGKSA-N	1	1	321.377	1.823	20	5		DDBDMO
CN1CC(C[N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1	ZINC000853552565	704266714	/nfs/dbraw/zinc/26/67/14/704266714.db2.gz	BATOKRXOBATNAK-UHFFFAOYSA-N	1	1	315.377	1.909	20	5		DDBDMO
CN1CC(C[N@@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1	ZINC000853552565	704266718	/nfs/dbraw/zinc/26/67/18/704266718.db2.gz	BATOKRXOBATNAK-UHFFFAOYSA-N	1	1	315.377	1.909	20	5		DDBDMO
O=[N+]([O-])c1cc(C(F)F)ccc1N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000853708150	704302708	/nfs/dbraw/zinc/30/27/08/704302708.db2.gz	GIBFDMPUOMKXEF-LLVKDONJSA-N	1	1	313.304	1.788	20	5		DDBDMO
O=[N+]([O-])c1cc(C(F)F)ccc1N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000853708150	704302711	/nfs/dbraw/zinc/30/27/11/704302711.db2.gz	GIBFDMPUOMKXEF-LLVKDONJSA-N	1	1	313.304	1.788	20	5		DDBDMO
C[C@@H](C[N@H+](C)CCCN(C)C)Nc1cc(N)ccc1[N+](=O)[O-]	ZINC000853774243	704314084	/nfs/dbraw/zinc/31/40/84/704314084.db2.gz	QHKRRLYCNRNNDD-LBPRGKRZSA-N	1	1	309.414	1.861	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1cc(N)ccc1[N+](=O)[O-]	ZINC000853774243	704314085	/nfs/dbraw/zinc/31/40/85/704314085.db2.gz	QHKRRLYCNRNNDD-LBPRGKRZSA-N	1	1	309.414	1.861	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3F)[C@@H]2C1	ZINC000854986831	704465219	/nfs/dbraw/zinc/46/52/19/704465219.db2.gz	CLDCPUFEOHOUFU-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000855284600	704477233	/nfs/dbraw/zinc/47/72/33/704477233.db2.gz	WDBKTWSLNQZIFM-JSGCOSHPSA-N	1	1	321.377	1.617	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[NH+](CCCF)CC1	ZINC000858599269	704732970	/nfs/dbraw/zinc/73/29/70/704732970.db2.gz	LSIBWBKLHMARCW-UHFFFAOYSA-N	1	1	312.301	1.985	20	5		DDBDMO
COc1cc(NCC[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000858811919	704760742	/nfs/dbraw/zinc/76/07/42/704760742.db2.gz	IQFKEUJNFMSMOL-SNVBAGLBSA-N	1	1	311.338	1.091	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000822568763	704976878	/nfs/dbraw/zinc/97/68/78/704976878.db2.gz	HZMHUUJOONQETQ-LLVKDONJSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860161402	705119773	/nfs/dbraw/zinc/11/97/73/705119773.db2.gz	XZMROFUHIQGYGJ-GIPNMCIBSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860161402	705119774	/nfs/dbraw/zinc/11/97/74/705119774.db2.gz	XZMROFUHIQGYGJ-GIPNMCIBSA-N	1	1	319.317	1.027	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000860176995	705124122	/nfs/dbraw/zinc/12/41/22/705124122.db2.gz	LFPMQRHCWIYUGN-JKSUJKDBSA-N	1	1	321.377	1.619	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874827844	705186013	/nfs/dbraw/zinc/18/60/13/705186013.db2.gz	DULZTCRMSKXMSF-CHWSQXEVSA-N	1	1	319.361	1.912	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874830011	705188461	/nfs/dbraw/zinc/18/84/61/705188461.db2.gz	PRIKSHOALVPETQ-NWDGAFQWSA-N	1	1	319.365	1.340	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874833540	705191355	/nfs/dbraw/zinc/19/13/55/705191355.db2.gz	LUCXSJHPRPNANT-QWHCGFSZSA-N	1	1	318.377	1.945	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874833536	705191486	/nfs/dbraw/zinc/19/14/86/705191486.db2.gz	LUCXSJHPRPNANT-CHWSQXEVSA-N	1	1	318.377	1.945	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825830352	705735477	/nfs/dbraw/zinc/73/54/77/705735477.db2.gz	KNQHOVDEIUKUMP-GJZGRUSLSA-N	1	1	321.377	1.619	20	5		DDBDMO
CCN1CCC[C@H](C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C1	ZINC000876989401	705950023	/nfs/dbraw/zinc/95/00/23/705950023.db2.gz	XZAWGYNAPMGDJC-IYXRBSQSSA-N	1	1	307.398	1.816	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC[C@@H]21	ZINC000827339436	705980105	/nfs/dbraw/zinc/98/01/05/705980105.db2.gz	TUPMZCUBSQPLLA-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000827626284	706039624	/nfs/dbraw/zinc/03/96/24/706039624.db2.gz	VHAHOYQPYMMQOU-KKUMJFAQSA-N	1	1	303.362	1.909	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000877835759	706227003	/nfs/dbraw/zinc/22/70/03/706227003.db2.gz	WTWVTRIQRFQZJO-LBPRGKRZSA-N	1	1	322.361	1.959	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@H](C(F)(F)F)O1	ZINC000880059587	706866569	/nfs/dbraw/zinc/86/65/69/706866569.db2.gz	JKGZKGXQDKMUFS-GXSJLCMTSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@H](C(F)(F)F)O1	ZINC000880059587	706866571	/nfs/dbraw/zinc/86/65/71/706866571.db2.gz	JKGZKGXQDKMUFS-GXSJLCMTSA-N	1	1	322.287	1.833	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000880313053	706938114	/nfs/dbraw/zinc/93/81/14/706938114.db2.gz	FGYWAJWAGAXSQH-GASCZTMLSA-N	1	1	303.362	1.813	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000880425590	706970491	/nfs/dbraw/zinc/97/04/91/706970491.db2.gz	GHGPZRGPWFLYBM-SWLSCSKDSA-N	1	1	310.350	1.709	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832955077	706998306	/nfs/dbraw/zinc/99/83/06/706998306.db2.gz	ZHVXLQBETNKYLX-IUODEOHRSA-N	1	1	323.393	1.865	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000834310209	707027710	/nfs/dbraw/zinc/02/77/10/707027710.db2.gz	GYFZQHORCKKGJX-MFKMUULPSA-N	1	1	304.350	1.262	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1)[N+](=O)[O-]	ZINC000834591781	707090601	/nfs/dbraw/zinc/09/06/01/707090601.db2.gz	DMTSSYMXDJAHGX-NWDGAFQWSA-N	1	1	301.362	1.467	20	5		DDBDMO
Nc1c(F)c(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221449	708259173	/nfs/dbraw/zinc/25/91/73/708259173.db2.gz	NBLFYSJHYRECOP-QWRGUYRKSA-N	1	1	324.356	1.352	20	5		DDBDMO
CC1([C@@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)OCCO1	ZINC000886125269	708702131	/nfs/dbraw/zinc/70/21/31/708702131.db2.gz	MUXMJKGTYSRWGA-CYBMUJFWSA-N	1	1	307.350	1.965	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000928448249	713201012	/nfs/dbraw/zinc/20/10/12/713201012.db2.gz	NDLDEHRKIAFMMD-CMPLNLGQSA-N	1	1	309.370	1.007	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928453565	713203975	/nfs/dbraw/zinc/20/39/75/713203975.db2.gz	OWSUDWXEZYAJAP-NWDGAFQWSA-N	1	1	306.366	1.606	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC000893941490	710893756	/nfs/dbraw/zinc/89/37/56/710893756.db2.gz	SDWBHYGDQJPRLP-RISCZKNCSA-N	1	1	304.350	1.095	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000928573537	713234482	/nfs/dbraw/zinc/23/44/82/713234482.db2.gz	QSXPSLVVJKOUQT-ZDUSSCGKSA-N	1	1	318.377	1.629	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000928573537	713234484	/nfs/dbraw/zinc/23/44/84/713234484.db2.gz	QSXPSLVVJKOUQT-ZDUSSCGKSA-N	1	1	318.377	1.629	20	5		DDBDMO
Cc1c(C[C@@H](C[NH3+])CNCc2ccccc2[N+](=O)[O-])cnn1C	ZINC000903923043	711333568	/nfs/dbraw/zinc/33/35/68/711333568.db2.gz	KEAUCNJMOZUWQC-ZDUSSCGKSA-N	1	1	317.393	1.544	20	5		DDBDMO
COc1c(O)ccc(C[N@H+](C)[C@H]2CCC(=O)N(C)C2)c1[N+](=O)[O-]	ZINC000895537972	711536921	/nfs/dbraw/zinc/53/69/21/711536921.db2.gz	XCQGAMHEUZYUSO-NSHDSACASA-N	1	1	323.349	1.362	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+](C)[C@H]2CCC(=O)N(C)C2)c1[N+](=O)[O-]	ZINC000895537972	711536922	/nfs/dbraw/zinc/53/69/22/711536922.db2.gz	XCQGAMHEUZYUSO-NSHDSACASA-N	1	1	323.349	1.362	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2C[C@H](O)CC(C)(C)C2)c1[N+](=O)[O-]	ZINC000895847775	711623865	/nfs/dbraw/zinc/62/38/65/711623865.db2.gz	FCPWEMFMAVFDNS-LLVKDONJSA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H](O)CC(C)(C)C2)c1[N+](=O)[O-]	ZINC000895847775	711623866	/nfs/dbraw/zinc/62/38/66/711623866.db2.gz	FCPWEMFMAVFDNS-LLVKDONJSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[C@@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCN1C	ZINC000896572425	711755690	/nfs/dbraw/zinc/75/56/90/711755690.db2.gz	VBLUSBVZIRDZTC-KOLCDFICSA-N	1	1	312.395	1.020	20	5		DDBDMO
O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(Cl)c(Cl)c1	ZINC000905203302	711967283	/nfs/dbraw/zinc/96/72/83/711967283.db2.gz	QXYJWRWPWNUMPF-LLVKDONJSA-N	1	1	318.160	1.965	20	5		DDBDMO
O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCCN1Cc1ccc(F)cc1F	ZINC000905229262	711974967	/nfs/dbraw/zinc/97/49/67/711974967.db2.gz	LTXNXPPUBDCHSR-ZDUSSCGKSA-N	1	1	313.304	1.322	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cn(CC[C@@H]2CCCC[N@H+]2C)c1=O	ZINC000915668714	713426947	/nfs/dbraw/zinc/42/69/47/713426947.db2.gz	NHFOPRSWHOJENO-NSHDSACASA-N	1	1	323.349	1.418	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCO[C@H]3CCOC3)C2)nc1	ZINC000929988910	713729930	/nfs/dbraw/zinc/72/99/30/713729930.db2.gz	OOYWMASFHLUNNZ-JSGCOSHPSA-N	1	1	322.365	1.282	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H]1CCC3(COC3)O1)C2	ZINC000930100058	713756107	/nfs/dbraw/zinc/75/61/07/713756107.db2.gz	QDKGLUFLPGOQJR-CYBMUJFWSA-N	1	1	304.346	1.901	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H]1CCC3(COC3)O1)C2	ZINC000930100058	713756110	/nfs/dbraw/zinc/75/61/10/713756110.db2.gz	QDKGLUFLPGOQJR-CYBMUJFWSA-N	1	1	304.346	1.901	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)C2(O)CCC2)C2CC2)cc1	ZINC000930140857	713765568	/nfs/dbraw/zinc/76/55/68/713765568.db2.gz	IQDJXXRJWNZPNY-HNNXBMFYSA-N	1	1	306.362	1.835	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1CCOC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000930234498	713783046	/nfs/dbraw/zinc/78/30/46/713783046.db2.gz	CGMSSZULCKLVAX-LBPRGKRZSA-N	1	1	321.377	1.883	20	5		DDBDMO
C/C(=C/C(=O)NC[C@@H]1C[C@H](O)C[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000924982050	714714671	/nfs/dbraw/zinc/71/46/71/714714671.db2.gz	OPLBNAWKSQZRGY-GYZFRLQBSA-N	1	1	319.361	1.179	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccoc2)C2CC2)c1	ZINC000934003572	714720425	/nfs/dbraw/zinc/72/04/25/714720425.db2.gz	ATOMTWBNGFQMHM-AWEZNQCLSA-N	1	1	306.322	1.410	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000935429752	715053244	/nfs/dbraw/zinc/05/32/44/715053244.db2.gz	FJEUQCISPZCDKZ-HUUCEWRRSA-N	1	1	321.377	1.129	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3nccc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC001164674827	719426718	/nfs/dbraw/zinc/42/67/18/719426718.db2.gz	XOBFLWRFKXMHKS-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(c4cc(N)c([N+](=O)[O-])cn4)C[C@]2(C1)CCCC3	ZINC001120900034	782220880	/nfs/dbraw/zinc/22/08/80/782220880.db2.gz	MBUXNNPHLYIBTR-IYBDPMFKSA-N	1	1	317.393	1.884	20	5		DDBDMO
Cc1[nH+]ccn1-c1ncccc1CNc1c([N+](=O)[O-])cnn1C	ZINC001185969842	744322542	/nfs/dbraw/zinc/32/25/42/744322542.db2.gz	RJQXYCIQVQXZCT-UHFFFAOYSA-N	1	1	313.321	1.830	20	5		DDBDMO
C[C@@H]1Cc2n[nH]cc2C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC001197787331	747264526	/nfs/dbraw/zinc/26/45/26/747264526.db2.gz	UDZCFTPCBUNPGE-LLVKDONJSA-N	1	1	317.349	1.174	20	5		DDBDMO
O=C(CCc1cnc[nH]1)NCC[NH2+]Cc1ccccc1[N+](=O)[O-]	ZINC001128992212	750750059	/nfs/dbraw/zinc/75/00/59/750750059.db2.gz	URGYFVLDTKCMOH-UHFFFAOYSA-N	1	1	317.349	1.157	20	5		DDBDMO
O=C(C1CCC1)N1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169028400	762185857	/nfs/dbraw/zinc/18/58/57/762185857.db2.gz	RXQPQMCMDXHHPY-UKRRQHHQSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCOC(=O)N1CCC([N@@H+](C)[C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169038630	762193515	/nfs/dbraw/zinc/19/35/15/762193515.db2.gz	JMBWXFDHYSRBNK-JSGCOSHPSA-N	1	1	313.398	1.985	20	5		DDBDMO
O=C(NC1CC1)[C@H]1C[C@H]2C[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]2C1	ZINC001169023551	762200590	/nfs/dbraw/zinc/20/05/90/762200590.db2.gz	OYWUCPYYTJYXPR-IPVBOJNNSA-N	1	1	321.421	1.668	20	5		DDBDMO
CCn1ncc2c1[C@H](COC)C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169025070	762202436	/nfs/dbraw/zinc/20/24/36/762202436.db2.gz	XNEIHPOAOMUOIM-QEJZJMRPSA-N	1	1	322.409	1.894	20	5		DDBDMO
COc1cnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054637	762209940	/nfs/dbraw/zinc/20/99/40/762209940.db2.gz	NBNGEQKJJFLVTF-RWMBFGLXSA-N	1	1	322.365	1.384	20	5		DDBDMO
Cc1cnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169057628	762211245	/nfs/dbraw/zinc/21/12/45/762211245.db2.gz	WKJXUXIZWWHSSM-MELADBBJSA-N	1	1	306.366	1.684	20	5		DDBDMO
Cc1cccc(C)c1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001020138853	760612448	/nfs/dbraw/zinc/61/24/48/760612448.db2.gz	DXWJECGVSSMYCO-IXYNUQLISA-N	1	1	317.389	1.705	20	5		DDBDMO
O=C(NC1(C2CC[NH+](CCCF)CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000153796	761545123	/nfs/dbraw/zinc/54/51/23/761545123.db2.gz	LLBBLCXLGGYOLN-CHWSQXEVSA-N	1	1	313.373	1.372	20	5		DDBDMO
CCc1ccoc1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001133401284	769778586	/nfs/dbraw/zinc/77/85/86/769778586.db2.gz	CQKIXCYPMOFUAO-UHFFFAOYSA-N	1	1	321.337	1.003	20	5		DDBDMO
Cc1cc(N[C@@H](N)CCC[NH3+])nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC001159788948	771928926	/nfs/dbraw/zinc/92/89/26/771928926.db2.gz	NTHAHZVOWMKITB-CYBMUJFWSA-N	1	1	316.365	1.218	20	5		DDBDMO
Cc1nc(NCCNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC001093674109	774989469	/nfs/dbraw/zinc/98/94/69/774989469.db2.gz	PCWPPTKOQOPXMJ-UHFFFAOYSA-N	1	1	309.370	1.167	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1cccc(F)c1[N+](=O)[O-]	ZINC001093840701	775125284	/nfs/dbraw/zinc/12/52/84/775125284.db2.gz	QQXAOYPOSVYUHX-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
COC(=O)c1c(C)c([N+](=O)[O-])ccc1Nc1nccnc1C[NH3+]	ZINC001171448645	776044880	/nfs/dbraw/zinc/04/48/80/776044880.db2.gz	KLMCBOPNXXLLOW-UHFFFAOYSA-N	1	1	317.305	1.682	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](O)[C@@](C)(CO)C1	ZINC001173222733	777055805	/nfs/dbraw/zinc/05/58/05/777055805.db2.gz	UZRGCJRGYOHNDL-UHOFOFEASA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(N2CCOCC2)C1	ZINC001173226010	777061093	/nfs/dbraw/zinc/06/10/93/777061093.db2.gz	HANDUNPKAHJSIX-ZDUSSCGKSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101657646	777352388	/nfs/dbraw/zinc/35/23/88/777352388.db2.gz	IXAAOXAVAAMJCZ-UHFFFAOYSA-N	1	1	309.370	1.200	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1nccc(C)c1[N+](=O)[O-]	ZINC001101705434	777415153	/nfs/dbraw/zinc/41/51/53/777415153.db2.gz	GNHJOBNPKHEVJU-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@]2(CCOC2=O)C1)Nc1ccccc1[N+](=O)[O-]	ZINC001177002705	778384641	/nfs/dbraw/zinc/38/46/41/778384641.db2.gz	NANAJQFFHDCPQP-OAHLLOKOSA-N	1	1	319.317	1.172	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@]2(CCOC2=O)C1)Nc1ccccc1[N+](=O)[O-]	ZINC001177002705	778384645	/nfs/dbraw/zinc/38/46/45/778384645.db2.gz	NANAJQFFHDCPQP-OAHLLOKOSA-N	1	1	319.317	1.172	20	5		DDBDMO
Cc1[nH+]ccn1CCCCn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC001116432679	780508619	/nfs/dbraw/zinc/50/86/19/780508619.db2.gz	INOTVVBFNNATNK-UHFFFAOYSA-N	1	1	321.293	1.650	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001116491569	780515084	/nfs/dbraw/zinc/51/50/84/780515084.db2.gz	UITGZBNXQJEUAI-FZMZJTMJSA-N	1	1	307.350	1.216	20	5		DDBDMO
C[N@H+]1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=O)CC1(C)C	ZINC001119330575	781406608	/nfs/dbraw/zinc/40/66/08/781406608.db2.gz	IEOBABOLHWDNPI-UHFFFAOYSA-N	1	1	320.349	1.486	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(CF)cc1	ZINC001267194394	837510180	/nfs/dbraw/zinc/51/01/80/837510180.db2.gz	OJSNNIBZAXCLSG-ZIAGYGMSSA-N	1	1	309.341	1.369	20	5		DDBDMO
C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(CF)cc1	ZINC001267194394	837510186	/nfs/dbraw/zinc/51/01/86/837510186.db2.gz	OJSNNIBZAXCLSG-ZIAGYGMSSA-N	1	1	309.341	1.369	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(CF)cc1	ZINC001267194394	837510192	/nfs/dbraw/zinc/51/01/92/837510192.db2.gz	OJSNNIBZAXCLSG-ZIAGYGMSSA-N	1	1	309.341	1.369	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCN([C@H]2CCC[N@H+](C)C2)CC1	ZINC001326394346	861329248	/nfs/dbraw/zinc/32/92/48/861329248.db2.gz	OBMWYYIXQOYYFC-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC001328498509	863008989	/nfs/dbraw/zinc/00/89/89/863008989.db2.gz	CFNDFCMMUODFCL-NSHDSACASA-N	1	1	306.366	1.700	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[N@@H+](C)C(C)(C)C1	ZINC001121758236	858587605	/nfs/dbraw/zinc/58/76/05/858587605.db2.gz	JORLVQZLRCMFNI-UHFFFAOYSA-N	1	1	310.402	1.038	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(C[N+](=O)[O-])n2CC)C1	ZINC001121792139	858598085	/nfs/dbraw/zinc/59/80/85/858598085.db2.gz	RJXUXUHEOBNEKH-LBPRGKRZSA-N	1	1	310.402	1.243	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CC1CCCC1	ZINC001122844504	858984432	/nfs/dbraw/zinc/98/44/32/858984432.db2.gz	BKGBGMLWSNHMAB-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[N@H+]2CCN1C[C@@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975901	859506485	/nfs/dbraw/zinc/50/64/85/859506485.db2.gz	GUSQVLAMRAVGBN-ZOWXZIJZSA-N	1	1	318.377	1.160	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001141649552	860901826	/nfs/dbraw/zinc/90/18/26/860901826.db2.gz	QGWCZLYURWZTLP-SNVBAGLBSA-N	1	1	309.370	1.422	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1cnc(Cl)s1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157760622	864110561	/nfs/dbraw/zinc/11/05/61/864110561.db2.gz	FUJPOEOLHUPZFL-RKDXNWHRSA-N	1	1	318.786	1.058	20	5		DDBDMO
CN(C)c1ccccc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761637	864111169	/nfs/dbraw/zinc/11/11/69/864111169.db2.gz	VOGXTVFTVZLIKU-UKRRQHHQSA-N	1	1	320.393	1.014	20	5		DDBDMO
Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@H+]3Cn2nccc2[N+](=O)[O-])cn1	ZINC001331057917	864810734	/nfs/dbraw/zinc/81/07/34/864810734.db2.gz	JQSYSCPCUCPTKZ-QXMXGUDHSA-N	1	1	316.365	1.893	20	5		DDBDMO
Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cn2nccc2[N+](=O)[O-])cn1	ZINC001331057917	864810752	/nfs/dbraw/zinc/81/07/52/864810752.db2.gz	JQSYSCPCUCPTKZ-QXMXGUDHSA-N	1	1	316.365	1.893	20	5		DDBDMO
COc1nc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)ncc1[N+](=O)[O-]	ZINC001160465491	865861110	/nfs/dbraw/zinc/86/11/10/865861110.db2.gz	IVXKYQFTBJCHLI-RTCCRHLQSA-N	1	1	307.354	1.821	20	5		DDBDMO
Nc1cc(N[C@@H]2CCC[C@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160724734	866073816	/nfs/dbraw/zinc/07/38/16/866073816.db2.gz	MPNNEKLYBHRDQP-VXGBXAGGSA-N	1	1	307.354	1.237	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC([NH2+]C2COC2)C1	ZINC001164220475	869031150	/nfs/dbraw/zinc/03/11/50/869031150.db2.gz	JDFANEYISXCXHK-UHFFFAOYSA-N	1	1	300.318	1.320	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NC(=O)c1ccn(-c2cc[nH+]cc2)n1	ZINC001339139905	870365311	/nfs/dbraw/zinc/36/53/11/870365311.db2.gz	NKNGTAOQMWJTEN-UHFFFAOYSA-N	1	1	313.277	1.161	20	5		DDBDMO
Cc1cnoc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001317467037	870888668	/nfs/dbraw/zinc/88/86/68/870888668.db2.gz	AUVSWIVGZWWPKF-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
Cc1cnoc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001317467037	870888679	/nfs/dbraw/zinc/88/86/79/870888679.db2.gz	AUVSWIVGZWWPKF-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@H]2CCCN(C)C2=O)c1[N+](=O)[O-]	ZINC001206691564	872512132	/nfs/dbraw/zinc/51/21/32/872512132.db2.gz	JXUNNBILMBMMMP-JTQLQIEISA-N	1	1	309.322	1.019	20	5		DDBDMO
COC(=O)[C@]1(F)CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596397	896522348	/nfs/dbraw/zinc/52/23/48/896522348.db2.gz	CXYQEQFQJWGSPV-ZFWWWQNUSA-N	1	1	308.309	1.649	20	5		DDBDMO
COC(=O)[C@]1(F)CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596397	896522359	/nfs/dbraw/zinc/52/23/59/896522359.db2.gz	CXYQEQFQJWGSPV-ZFWWWQNUSA-N	1	1	308.309	1.649	20	5		DDBDMO
COC1C[C@@H]2COC[C@H](C1)[N@@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254595841	896522508	/nfs/dbraw/zinc/52/25/08/896522508.db2.gz	NROYCEFNRULGKJ-PMRDEQMMSA-N	1	1	318.373	1.940	20	5		DDBDMO
COC1C[C@@H]2COC[C@H](C1)[N@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254595841	896522518	/nfs/dbraw/zinc/52/25/18/896522518.db2.gz	NROYCEFNRULGKJ-PMRDEQMMSA-N	1	1	318.373	1.940	20	5		DDBDMO
CN(C1COC1)C1C[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254604340	896528595	/nfs/dbraw/zinc/52/85/95/896528595.db2.gz	VTGNQXZKLXHVOE-CQSZACIVSA-N	1	1	303.362	1.077	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12	ZINC001263980014	900853576	/nfs/dbraw/zinc/85/35/76/900853576.db2.gz	LEJBWASZLQXSAR-BYCMXARLSA-N	1	1	303.362	1.973	20	5		DDBDMO
O=C(CCCF)N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC001265720857	902341332	/nfs/dbraw/zinc/34/13/32/902341332.db2.gz	VSXZXZTYCTUJMT-FOLVSLTJSA-N	1	1	321.352	1.891	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C[C@H]1C(C)(C)C	ZINC001307195213	915849814	/nfs/dbraw/zinc/84/98/14/915849814.db2.gz	BMSLHZSNVFMCMH-LBPRGKRZSA-N	1	1	321.381	1.255	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452064487	231286614	/nfs/dbraw/zinc/28/66/14/231286614.db2.gz	FLPOSEODXIRBNI-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452064487	231286619	/nfs/dbraw/zinc/28/66/19/231286619.db2.gz	FLPOSEODXIRBNI-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
Cc1nn(C)c(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000488736618	282270893	/nfs/dbraw/zinc/27/08/93/282270893.db2.gz	VIZKZPOXXSEUNP-DMDPSCGWSA-N	1	1	307.398	1.803	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000299295498	530057136	/nfs/dbraw/zinc/05/71/36/530057136.db2.gz	CREWJXFWCYRLIL-CQSZACIVSA-N	1	1	316.361	1.760	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000413435751	530061092	/nfs/dbraw/zinc/06/10/92/530061092.db2.gz	HUUDEMWASVCBMM-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
C[C@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C1=CC[N@@H+](C)CC1	ZINC000330762361	232050358	/nfs/dbraw/zinc/05/03/58/232050358.db2.gz	HTBRHCQMVTVMAN-NSHDSACASA-N	1	1	321.381	1.293	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCO)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000181979367	199370664	/nfs/dbraw/zinc/37/06/64/199370664.db2.gz	JWIUVPUNIDBEKR-UHFFFAOYSA-N	1	1	304.350	1.594	20	5		DDBDMO
C[C@H](O)C[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000279671849	215050564	/nfs/dbraw/zinc/05/05/64/215050564.db2.gz	DLYXIGJOPYGWIV-QWHCGFSZSA-N	1	1	309.366	1.382	20	5		DDBDMO
CC1(C)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCS1	ZINC000279679085	215056454	/nfs/dbraw/zinc/05/64/54/215056454.db2.gz	GIRHAZQZTXQCLO-UHFFFAOYSA-N	1	1	311.407	1.974	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279723187	215092185	/nfs/dbraw/zinc/09/21/85/215092185.db2.gz	IZHYQCNXYGYLIX-ZWNOBZJWSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279723187	215092187	/nfs/dbraw/zinc/09/21/87/215092187.db2.gz	IZHYQCNXYGYLIX-ZWNOBZJWSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-])C1CC1	ZINC000139425421	186022542	/nfs/dbraw/zinc/02/25/42/186022542.db2.gz	FTELZWTUGKKPBN-UHFFFAOYSA-N	1	1	317.342	1.106	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@H](C)O1	ZINC000042811739	352352741	/nfs/dbraw/zinc/35/27/41/352352741.db2.gz	FDKCRWQXRKBTMK-PHIMTYICSA-N	1	1	310.354	1.152	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000060410931	352871955	/nfs/dbraw/zinc/87/19/55/352871955.db2.gz	WAXTXPMVWMUMIV-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000064333969	352933555	/nfs/dbraw/zinc/93/35/55/352933555.db2.gz	LZKAHZGMXOUWRT-STQMWFEESA-N	1	1	319.361	1.496	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000067413202	353047839	/nfs/dbraw/zinc/04/78/39/353047839.db2.gz	GDYCPJAYVACURP-CQSZACIVSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[NH+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1	ZINC000068467751	353113412	/nfs/dbraw/zinc/11/34/12/353113412.db2.gz	KZHKJRVZTRDJMM-UHFFFAOYSA-N	1	1	302.334	1.324	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000174641527	198363384	/nfs/dbraw/zinc/36/33/84/198363384.db2.gz	WALCYYJUIWRPAJ-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000076800569	353439088	/nfs/dbraw/zinc/43/90/88/353439088.db2.gz	POHPUKSGYRAKNO-PHIMTYICSA-N	1	1	308.386	1.747	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000078404033	353515178	/nfs/dbraw/zinc/51/51/78/353515178.db2.gz	ZFHASLKTCWNFDD-ZDUSSCGKSA-N	1	1	306.366	1.457	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+][C@H]1C[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000601291478	358480561	/nfs/dbraw/zinc/48/05/61/358480561.db2.gz	KQRHMNTXMFXBEY-LNSITVRQSA-N	1	1	316.361	1.778	20	5		DDBDMO
C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000617751298	363287596	/nfs/dbraw/zinc/28/75/96/363287596.db2.gz	FHMPGKJKYBEFSW-HUBLWGQQSA-N	1	1	321.377	1.534	20	5		DDBDMO
C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000617751298	363287601	/nfs/dbraw/zinc/28/76/01/363287601.db2.gz	FHMPGKJKYBEFSW-HUBLWGQQSA-N	1	1	321.377	1.534	20	5		DDBDMO
CCOC(=O)CC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000161896808	354244142	/nfs/dbraw/zinc/24/41/42/354244142.db2.gz	OOZDCDBJHSJWGU-CYBMUJFWSA-N	1	1	324.381	1.847	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](CO)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000293110161	354453878	/nfs/dbraw/zinc/45/38/78/354453878.db2.gz	LPLSHKMSVGJUCD-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](CO)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000293110161	354453880	/nfs/dbraw/zinc/45/38/80/354453880.db2.gz	LPLSHKMSVGJUCD-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H](O)C1CC1	ZINC000305721028	354471294	/nfs/dbraw/zinc/47/12/94/354471294.db2.gz	IIVOKQRTTSZROA-HZMBPMFUSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)C1CC1	ZINC000305721028	354471296	/nfs/dbraw/zinc/47/12/96/354471296.db2.gz	IIVOKQRTTSZROA-HZMBPMFUSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)COc1ccc([N+](=O)[O-])c2ncccc12	ZINC000320555842	354528106	/nfs/dbraw/zinc/52/81/06/354528106.db2.gz	KMCGRARFCWNMID-NSHDSACASA-N	1	1	305.334	1.834	20	5		DDBDMO
CC[N@H+]1CCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000317558078	354511932	/nfs/dbraw/zinc/51/19/32/354511932.db2.gz	MZEAMPRZEAHDFK-LLVKDONJSA-N	1	1	307.350	1.912	20	5		DDBDMO
C[C@@H](NC(=O)NC[C@@]1(O)CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000358668486	299218396	/nfs/dbraw/zinc/21/83/96/299218396.db2.gz	XNRIFYZIDPGCGH-ABAIWWIYSA-N	1	1	322.365	1.022	20	5		DDBDMO
C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@@H]1C[N@H+](C)CCO1	ZINC000588002841	354891986	/nfs/dbraw/zinc/89/19/86/354891986.db2.gz	VKCVGKITFHZQIL-SCZZXKLOSA-N	1	1	323.378	1.731	20	5		DDBDMO
C[C@@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000588002841	354891989	/nfs/dbraw/zinc/89/19/89/354891989.db2.gz	VKCVGKITFHZQIL-SCZZXKLOSA-N	1	1	323.378	1.731	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc([N+](=O)[O-])c1C	ZINC000590047190	355044963	/nfs/dbraw/zinc/04/49/63/355044963.db2.gz	XDJJTURWRTUFNN-RISCZKNCSA-N	1	1	319.361	1.688	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000590446887	355099646	/nfs/dbraw/zinc/09/96/46/355099646.db2.gz	WVSFCDSZUZUFFU-JSGCOSHPSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000590655894	355138994	/nfs/dbraw/zinc/13/89/94/355138994.db2.gz	CRLUBNDLXSHCSK-JSGCOSHPSA-N	1	1	322.361	1.974	20	5		DDBDMO
CCn1cc(C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C(C)C)cn1	ZINC000593081615	355789293	/nfs/dbraw/zinc/78/92/93/355789293.db2.gz	UBBKTBXQXMTVFY-UHFFFAOYSA-N	1	1	306.370	1.918	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593502946	355905763	/nfs/dbraw/zinc/90/57/63/355905763.db2.gz	FYDOTWIWIYXROY-CYBMUJFWSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595469717	356505064	/nfs/dbraw/zinc/50/50/64/356505064.db2.gz	XDIWDQYGQCGJJG-LBPRGKRZSA-N	1	1	311.357	1.886	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595469717	356505068	/nfs/dbraw/zinc/50/50/68/356505068.db2.gz	XDIWDQYGQCGJJG-LBPRGKRZSA-N	1	1	311.357	1.886	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3onc(C)c3[N+](=O)[O-])[C@H]2C1	ZINC000595506116	356522533	/nfs/dbraw/zinc/52/25/33/356522533.db2.gz	ZQAQHOLAEDZVMF-NWDGAFQWSA-N	1	1	310.354	1.186	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000081556691	192290506	/nfs/dbraw/zinc/29/05/06/192290506.db2.gz	SXDVPVAYEIDZFY-QWRGUYRKSA-N	1	1	322.365	1.236	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(COC2)C1	ZINC000595832610	356669511	/nfs/dbraw/zinc/66/95/11/356669511.db2.gz	GGSSLMDAQCCUNH-LLVKDONJSA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(COC2)C1	ZINC000595832610	356669512	/nfs/dbraw/zinc/66/95/12/356669512.db2.gz	GGSSLMDAQCCUNH-LLVKDONJSA-N	1	1	305.334	1.644	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H]4COC[C@H]4C3)nc2c1	ZINC000595827695	356666710	/nfs/dbraw/zinc/66/67/10/356666710.db2.gz	DADYNDDEXCZDIT-WDEREUQCSA-N	1	1	302.334	1.939	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CCC([N@@H+]2CC[C@@H](O)C2)CC1	ZINC000595862393	356682364	/nfs/dbraw/zinc/68/23/64/356682364.db2.gz	BISFALALHOIQMB-OAHLLOKOSA-N	1	1	321.377	1.331	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000595862393	356682366	/nfs/dbraw/zinc/68/23/66/356682366.db2.gz	BISFALALHOIQMB-OAHLLOKOSA-N	1	1	321.377	1.331	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596111001	356776119	/nfs/dbraw/zinc/77/61/19/356776119.db2.gz	UBVUAQOWVRWUOR-LBPRGKRZSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@@H]21	ZINC000596170406	356801030	/nfs/dbraw/zinc/80/10/30/356801030.db2.gz	ZLDJJQKPHSKJST-FZMZJTMJSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	ZINC000597712902	357297751	/nfs/dbraw/zinc/29/77/51/357297751.db2.gz	AECWSVYPPWZXAF-INIZCTEOSA-N	1	1	319.361	1.858	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	ZINC000597712902	357297752	/nfs/dbraw/zinc/29/77/52/357297752.db2.gz	AECWSVYPPWZXAF-INIZCTEOSA-N	1	1	319.361	1.858	20	5		DDBDMO
CCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1	ZINC000598038277	357437559	/nfs/dbraw/zinc/43/75/59/357437559.db2.gz	BTUCKGFALKGHHX-NSHDSACASA-N	1	1	308.338	1.252	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000598343108	357545508	/nfs/dbraw/zinc/54/55/08/357545508.db2.gz	SJZPIJJXQCXPCL-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000598342781	357545815	/nfs/dbraw/zinc/54/58/15/357545815.db2.gz	QDEVTLBGHGNAMX-LLVKDONJSA-N	1	1	321.333	1.538	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000598454587	357589578	/nfs/dbraw/zinc/58/95/78/357589578.db2.gz	WZCONPTVWWWYCE-HNNXBMFYSA-N	1	1	319.361	1.266	20	5		DDBDMO
CC1(C)CC[C@H](CO)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000598648160	357669222	/nfs/dbraw/zinc/66/92/22/357669222.db2.gz	OETAJHAZPZCUBO-CYBMUJFWSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1CO	ZINC000598646912	357669315	/nfs/dbraw/zinc/66/93/15/357669315.db2.gz	AVPAXNZJYHFJBK-MFKMUULPSA-N	1	1	307.350	1.144	20	5		DDBDMO
C[NH+]1CCN(CC2CN(c3c(F)cccc3[N+](=O)[O-])C2)CC1	ZINC000599105971	357817546	/nfs/dbraw/zinc/81/75/46/357817546.db2.gz	IGRMNFZDURRQNA-UHFFFAOYSA-N	1	1	308.357	1.418	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2NCC[N@@H+]1CC[C@@H](O)C1	ZINC000599175509	357840153	/nfs/dbraw/zinc/84/01/53/357840153.db2.gz	DKHCPAFPIRQXNH-GFCCVEGCSA-N	1	1	302.334	1.622	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1NCC[N@@H+]1CC[C@H](O)C1)CCCC2	ZINC000599200085	357847281	/nfs/dbraw/zinc/84/72/81/357847281.db2.gz	WBICNJDUHNCKKS-LBPRGKRZSA-N	1	1	306.366	1.347	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(NCC[N@@H+]3CC[C@H](O)C3)ccnc21	ZINC000599198977	357847359	/nfs/dbraw/zinc/84/73/59/357847359.db2.gz	DJRZHSQNWOPLFW-NSHDSACASA-N	1	1	302.334	1.622	20	5		DDBDMO
Cc1cc(NCC[N@H+]2CC[C@H](O)C2)c2cccc([N+](=O)[O-])c2n1	ZINC000599198924	357848036	/nfs/dbraw/zinc/84/80/36/357848036.db2.gz	BFYMKNIGCUSCTC-LBPRGKRZSA-N	1	1	316.361	1.930	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000179396614	199028103	/nfs/dbraw/zinc/02/81/03/199028103.db2.gz	DRYJELRDPQEQBZ-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[NH+]1CCC(N2CCOCC2)CC1	ZINC000599471915	357948678	/nfs/dbraw/zinc/94/86/78/357948678.db2.gz	HAXJJHGLIICWBL-UHFFFAOYSA-N	1	1	305.378	1.891	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000599567295	357976868	/nfs/dbraw/zinc/97/68/68/357976868.db2.gz	WKZBSUZOZDLZBM-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000599567295	357976871	/nfs/dbraw/zinc/97/68/71/357976871.db2.gz	WKZBSUZOZDLZBM-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
CC(C)c1ccc(C(=O)NCC[N@H+]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000600808444	358320296	/nfs/dbraw/zinc/32/02/96/358320296.db2.gz	OOJZQKWVUDNHGG-ZDUSSCGKSA-N	1	1	321.377	1.515	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601136474	358416993	/nfs/dbraw/zinc/41/69/93/358416993.db2.gz	FLTNWQYPPPAFOG-YUMQZZPRSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601136474	358416996	/nfs/dbraw/zinc/41/69/96/358416996.db2.gz	FLTNWQYPPPAFOG-YUMQZZPRSA-N	1	1	321.303	1.876	20	5		DDBDMO
Cc1c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cnn1C	ZINC000601149864	358422163	/nfs/dbraw/zinc/42/21/63/358422163.db2.gz	QXMMEQHGGFJSNU-HNNXBMFYSA-N	1	1	304.350	1.634	20	5		DDBDMO
O=C1CCC[C@H](CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)N1	ZINC000601156468	358425667	/nfs/dbraw/zinc/42/56/67/358425667.db2.gz	RAAVIPZTHFCKEA-SNVBAGLBSA-N	1	1	300.318	1.646	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)C[C@H]1CC[N@@H+](C)C1	ZINC000602150412	358849022	/nfs/dbraw/zinc/84/90/22/358849022.db2.gz	JFACJAGRBHTOFW-CYBMUJFWSA-N	1	1	305.378	1.938	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602652026	359101272	/nfs/dbraw/zinc/10/12/72/359101272.db2.gz	CUWLSHKIJNDBQN-UHFFFAOYSA-N	1	1	321.381	1.875	20	5		DDBDMO
CCC(=O)N1CCC[N@H+](CCn2c(C)ncc2[N+](=O)[O-])CC1	ZINC000602768655	359176480	/nfs/dbraw/zinc/17/64/80/359176480.db2.gz	OUSVNHIBZHPMMP-UHFFFAOYSA-N	1	1	309.370	1.044	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])CC1	ZINC000602768655	359176485	/nfs/dbraw/zinc/17/64/85/359176485.db2.gz	OUSVNHIBZHPMMP-UHFFFAOYSA-N	1	1	309.370	1.044	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1	ZINC000602795317	359198188	/nfs/dbraw/zinc/19/81/88/359198188.db2.gz	HUHOLHMXOWNHJD-OCCSQVGLSA-N	1	1	318.381	1.879	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)C[C@](C)(O)C1CC1	ZINC000602831704	359223806	/nfs/dbraw/zinc/22/38/06/359223806.db2.gz	PWHXIDNHNMMMKF-RDJZCZTQSA-N	1	1	322.405	1.981	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000603142366	359430714	/nfs/dbraw/zinc/43/07/14/359430714.db2.gz	JWNOAYVBCHYCKF-TXEJJXNPSA-N	1	1	323.397	1.431	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000187580127	200130093	/nfs/dbraw/zinc/13/00/93/200130093.db2.gz	NDYDAEHMQLQPRU-OAHLLOKOSA-N	1	1	309.366	1.241	20	5		DDBDMO
C[C@@H]1CC[C@@](CO)([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000187982149	200185871	/nfs/dbraw/zinc/18/58/71/200185871.db2.gz	VYNUQHZYQBGADJ-BDJLRTHQSA-N	1	1	321.377	1.677	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609383578	360303343	/nfs/dbraw/zinc/30/33/43/360303343.db2.gz	VLZPNYQKZXMQQG-ZDUSSCGKSA-N	1	1	319.361	1.574	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000609283849	360287099	/nfs/dbraw/zinc/28/70/99/360287099.db2.gz	FREMKTLZMUTXFV-HIFRSBDPSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000609448293	360307807	/nfs/dbraw/zinc/30/78/07/360307807.db2.gz	HZTXZRVNUVZTTQ-ZDUSSCGKSA-N	1	1	307.325	1.948	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](C)CCO1	ZINC000610899534	360567201	/nfs/dbraw/zinc/56/72/01/360567201.db2.gz	YYGOFWFMAJOMNP-RISCZKNCSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCO1	ZINC000610899534	360567205	/nfs/dbraw/zinc/56/72/05/360567205.db2.gz	YYGOFWFMAJOMNP-RISCZKNCSA-N	1	1	322.365	1.113	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c1	ZINC000610912571	360570330	/nfs/dbraw/zinc/57/03/30/360570330.db2.gz	YMUVKGTWURJEJS-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c1	ZINC000610912571	360570334	/nfs/dbraw/zinc/57/03/34/360570334.db2.gz	YMUVKGTWURJEJS-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
COCC1([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1	ZINC000611179035	360651228	/nfs/dbraw/zinc/65/12/28/360651228.db2.gz	ZASZZOGIIFISDF-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
COCC1([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1	ZINC000611179035	360651233	/nfs/dbraw/zinc/65/12/33/360651233.db2.gz	ZASZZOGIIFISDF-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000611148672	360637856	/nfs/dbraw/zinc/63/78/56/360637856.db2.gz	RQSCMGDPGSUGAF-LBPRGKRZSA-N	1	1	316.361	1.829	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)N(C)C	ZINC000611204917	360658717	/nfs/dbraw/zinc/65/87/17/360658717.db2.gz	IGWNGUWIMGOEFD-UHFFFAOYSA-N	1	1	322.365	1.334	20	5		DDBDMO
COCC[NH+]1CCN(c2ncnc3ccc([N+](=O)[O-])cc32)CC1	ZINC000611699490	360796814	/nfs/dbraw/zinc/79/68/14/360796814.db2.gz	DGUPJJWBCQZDNR-UHFFFAOYSA-N	1	1	317.349	1.306	20	5		DDBDMO
C[N@H+](C[C@H](O)C1CC1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612086861	360913702	/nfs/dbraw/zinc/91/37/02/360913702.db2.gz	YZYIHLRJYCOCLA-JSGCOSHPSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1cc(N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000292713164	223213251	/nfs/dbraw/zinc/21/32/51/223213251.db2.gz	SVHQUAJLFACGAS-VXGBXAGGSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)c1[N+](=O)[O-]	ZINC000619874032	364170411	/nfs/dbraw/zinc/17/04/11/364170411.db2.gz	WWHKUUKURIORCJ-CYBMUJFWSA-N	1	1	318.377	1.023	20	5		DDBDMO
CO[C@@H](C)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293061611	223378122	/nfs/dbraw/zinc/37/81/22/223378122.db2.gz	IMYHSKDZNPZETD-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000275180368	212178134	/nfs/dbraw/zinc/17/81/34/212178134.db2.gz	CPVUMQFANYMTOR-UHFFFAOYSA-N	1	1	311.769	2.000	20	5		DDBDMO
C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1=CC[N@H+](C)CC1	ZINC000274925101	212037866	/nfs/dbraw/zinc/03/78/66/212037866.db2.gz	MBFDLYUVHBXNLI-JTQLQIEISA-N	1	1	305.334	1.681	20	5		DDBDMO
C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000274925101	212037868	/nfs/dbraw/zinc/03/78/68/212037868.db2.gz	MBFDLYUVHBXNLI-JTQLQIEISA-N	1	1	305.334	1.681	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000264641194	204046334	/nfs/dbraw/zinc/04/63/34/204046334.db2.gz	OEVBRJKQZKZTRV-ZDUSSCGKSA-N	1	1	303.362	1.738	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+](C)[C@H](C)CC)c1[N+](=O)[O-]	ZINC000264664660	204062218	/nfs/dbraw/zinc/06/22/18/204062218.db2.gz	JHHVSGGKUHSIKT-SNVBAGLBSA-N	1	1	311.386	1.731	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000265089104	204389457	/nfs/dbraw/zinc/38/94/57/204389457.db2.gz	ZGZCFFZVHUWSIS-UHFFFAOYSA-N	1	1	318.333	1.685	20	5		DDBDMO
C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1	ZINC000271731141	209164151	/nfs/dbraw/zinc/16/41/51/209164151.db2.gz	MZSCYGMMOWYSQD-AVGNSLFASA-N	1	1	321.377	1.929	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc32)C1	ZINC000266192881	205173368	/nfs/dbraw/zinc/17/33/68/205173368.db2.gz	GZAMJZPOFFJMAH-SNVBAGLBSA-N	1	1	305.338	1.909	20	5		DDBDMO
C[NH+](C)C[C@H]1CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000267443853	206071107	/nfs/dbraw/zinc/07/11/07/206071107.db2.gz	CPYFYMAOFCYYFJ-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000061380226	184170256	/nfs/dbraw/zinc/17/02/56/184170256.db2.gz	JJGAJLQOBTYQJC-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+](CCO)CC1CC1	ZINC000352479059	285080419	/nfs/dbraw/zinc/08/04/19/285080419.db2.gz	AFFUJSPQDKNMKU-CYBMUJFWSA-N	1	1	310.350	1.039	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+](CCO)CCOCC(F)(F)F)cc1	ZINC000078671289	285112013	/nfs/dbraw/zinc/11/20/13/285112013.db2.gz	KJFMKEGLYJGKDF-UHFFFAOYSA-N	1	1	322.283	1.968	20	5		DDBDMO
COc1cc(C[N@@H+]2CCSC[C@H]2CCO)ccc1[N+](=O)[O-]	ZINC000352546438	285130716	/nfs/dbraw/zinc/13/07/16/285130716.db2.gz	VFUPNSNYDDVRBJ-GFCCVEGCSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1cc(C[N@H+]2CCSC[C@H]2CCO)ccc1[N+](=O)[O-]	ZINC000352546438	285130718	/nfs/dbraw/zinc/13/07/18/285130718.db2.gz	VFUPNSNYDDVRBJ-GFCCVEGCSA-N	1	1	312.391	1.903	20	5		DDBDMO
CN(C)CC[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000413106626	224136308	/nfs/dbraw/zinc/13/63/08/224136308.db2.gz	YXZWRIFKKSMMBD-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@]2(C)CO)c([N+](=O)[O-])c1	ZINC000567971134	304256929	/nfs/dbraw/zinc/25/69/29/304256929.db2.gz	URLGPLUNBSFDTR-HNNXBMFYSA-N	1	1	310.350	1.829	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CO)C1	ZINC000121594323	195312163	/nfs/dbraw/zinc/31/21/63/195312163.db2.gz	XACGOWKGCQCUCE-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](CO)C1	ZINC000121594323	195312164	/nfs/dbraw/zinc/31/21/64/195312164.db2.gz	XACGOWKGCQCUCE-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC(=O)C1CC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000027344323	406908618	/nfs/dbraw/zinc/90/86/18/406908618.db2.gz	DCBFFLWGBPZHCE-UHFFFAOYSA-N	1	1	321.333	1.079	20	5		DDBDMO
C[N@H+](CCN1C(=O)NC(C)(C)C1=O)Cc1ccccc1[N+](=O)[O-]	ZINC000046599870	407061814	/nfs/dbraw/zinc/06/18/14/407061814.db2.gz	GEJVWFVHCKRGLM-UHFFFAOYSA-N	1	1	320.349	1.357	20	5		DDBDMO
C[N@@H+](CCN1C(=O)NC(C)(C)C1=O)Cc1ccccc1[N+](=O)[O-]	ZINC000046599870	407061817	/nfs/dbraw/zinc/06/18/17/407061817.db2.gz	GEJVWFVHCKRGLM-UHFFFAOYSA-N	1	1	320.349	1.357	20	5		DDBDMO
CCC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)NC	ZINC000056508282	407209988	/nfs/dbraw/zinc/20/99/88/407209988.db2.gz	LDYZXHHYGJOEAE-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1	ZINC000097617542	407300657	/nfs/dbraw/zinc/30/06/57/407300657.db2.gz	KRKGXHISKMZGEA-UHFFFAOYSA-N	1	1	318.377	1.947	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000124497547	407359912	/nfs/dbraw/zinc/35/99/12/407359912.db2.gz	ANOYWGXQRWWUGK-GXTWGEPZSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000124498006	407360171	/nfs/dbraw/zinc/36/01/71/407360171.db2.gz	ANOYWGXQRWWUGK-JSGCOSHPSA-N	1	1	321.377	1.915	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000271010969	407466980	/nfs/dbraw/zinc/46/69/80/407466980.db2.gz	ZSXFOQLZQMCTIK-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
COC[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000265762640	407442497	/nfs/dbraw/zinc/44/24/97/407442497.db2.gz	HISXIZFDRNSJKR-GXTWGEPZSA-N	1	1	310.350	1.303	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000270968065	407443392	/nfs/dbraw/zinc/44/33/92/407443392.db2.gz	VTOGBQOVBXQCDG-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+](Cc1ccncc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270998750	407460700	/nfs/dbraw/zinc/46/07/00/407460700.db2.gz	JWLTXNHXNIQTSG-CQSZACIVSA-N	1	1	305.338	1.069	20	5		DDBDMO
C[C@H](C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000266541459	407552786	/nfs/dbraw/zinc/55/27/86/407552786.db2.gz	QCHAPEJHYKOPMU-CZUORRHYSA-N	1	1	318.377	1.888	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCC[C@H]1C(N)=O	ZINC000271257747	407599543	/nfs/dbraw/zinc/59/95/43/407599543.db2.gz	ALBJXMNCIBUMIF-LBPRGKRZSA-N	1	1	307.354	1.050	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H](OCCO)C2)c1	ZINC000178862616	407629222	/nfs/dbraw/zinc/62/92/22/407629222.db2.gz	KQMCAXPNUNQWHU-LSDHHAIUSA-N	1	1	310.350	1.102	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178873013	407635470	/nfs/dbraw/zinc/63/54/70/407635470.db2.gz	ADSHRAPYWOAJGN-JSGCOSHPSA-N	1	1	308.334	1.656	20	5		DDBDMO
CC[C@@H]1CN(c2nccc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000115517102	407687602	/nfs/dbraw/zinc/68/76/02/407687602.db2.gz	PCIZZRZAIWXZTP-CYBMUJFWSA-N	1	1	308.382	1.845	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000186764279	407766448	/nfs/dbraw/zinc/76/64/48/407766448.db2.gz	HGOXBEFITKWLNQ-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000186764279	407766455	/nfs/dbraw/zinc/76/64/55/407766455.db2.gz	HGOXBEFITKWLNQ-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000186764279	407766460	/nfs/dbraw/zinc/76/64/60/407766460.db2.gz	HGOXBEFITKWLNQ-AWEZNQCLSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000181184812	407963245	/nfs/dbraw/zinc/96/32/45/407963245.db2.gz	NXDVFILTVWYRNR-PWSUYJOCSA-N	1	1	306.366	1.636	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000272428621	407915320	/nfs/dbraw/zinc/91/53/20/407915320.db2.gz	HJCOHNICAFFRFT-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
CCCCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(N)=O	ZINC000272555161	407982279	/nfs/dbraw/zinc/98/22/79/407982279.db2.gz	LDNRGZZSHRMJBB-UHFFFAOYSA-N	1	1	309.366	1.951	20	5		DDBDMO
CCOC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000154464308	408038244	/nfs/dbraw/zinc/03/82/44/408038244.db2.gz	UIODTKGWPISSPQ-UKRRQHHQSA-N	1	1	322.361	1.903	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000245715105	408049552	/nfs/dbraw/zinc/04/95/52/408049552.db2.gz	NXDVFILTVWYRNR-CMPLNLGQSA-N	1	1	306.366	1.636	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@@H]2CCC[C@@H]21	ZINC000273084932	408050189	/nfs/dbraw/zinc/05/01/89/408050189.db2.gz	YOOSLURCAYKTKK-VNHYZAJKSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@@H]2CCC[C@@H]21	ZINC000273084932	408050194	/nfs/dbraw/zinc/05/01/94/408050194.db2.gz	YOOSLURCAYKTKK-VNHYZAJKSA-N	1	1	322.361	1.588	20	5		DDBDMO
C[NH+]1CCC(C)(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000272585693	407994097	/nfs/dbraw/zinc/99/40/97/407994097.db2.gz	YZHRBPGVKYHEEB-UHFFFAOYSA-N	1	1	307.350	1.762	20	5		DDBDMO
O=C1NCCCC[C@@H]1[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245857470	408079342	/nfs/dbraw/zinc/07/93/42/408079342.db2.gz	KIGOKQIOSAHHMD-YPMHNXCESA-N	1	1	319.365	1.145	20	5		DDBDMO
C[C@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000245994035	408117090	/nfs/dbraw/zinc/11/70/90/408117090.db2.gz	AAQFGLLOMFVSML-WFASDCNBSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000245994035	408117098	/nfs/dbraw/zinc/11/70/98/408117098.db2.gz	AAQFGLLOMFVSML-WFASDCNBSA-N	1	1	319.361	1.811	20	5		DDBDMO
COc1ccc(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000155075769	408123263	/nfs/dbraw/zinc/12/32/63/408123263.db2.gz	QEYZWTYELLIKIS-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000155075769	408123268	/nfs/dbraw/zinc/12/32/68/408123268.db2.gz	QEYZWTYELLIKIS-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000246315656	408215515	/nfs/dbraw/zinc/21/55/15/408215515.db2.gz	KBGUGJKJJZPNRT-WFASDCNBSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@@H]1CO	ZINC000190348788	408226386	/nfs/dbraw/zinc/22/63/86/408226386.db2.gz	KMNGYYFUMPTGDA-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
CCCCC[N@@H+](CC(N)=O)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000183053869	408314534	/nfs/dbraw/zinc/31/45/34/408314534.db2.gz	YHZURUDATMZBTK-AWEZNQCLSA-N	1	1	309.366	1.606	20	5		DDBDMO
CCCCC[N@H+](CC(N)=O)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000183053869	408314538	/nfs/dbraw/zinc/31/45/38/408314538.db2.gz	YHZURUDATMZBTK-AWEZNQCLSA-N	1	1	309.366	1.606	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000190909434	408340507	/nfs/dbraw/zinc/34/05/07/408340507.db2.gz	SJWHAPYXTZMOCF-NEPJUHHUSA-N	1	1	307.350	1.484	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1C[C@H](C)O	ZINC000246785044	408338133	/nfs/dbraw/zinc/33/81/33/408338133.db2.gz	JAQKOEHUGGLUBW-QWRGUYRKSA-N	1	1	311.338	1.105	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1C[C@H](C)O	ZINC000246785044	408338138	/nfs/dbraw/zinc/33/81/38/408338138.db2.gz	JAQKOEHUGGLUBW-QWRGUYRKSA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183184997	408348469	/nfs/dbraw/zinc/34/84/69/408348469.db2.gz	AGRFETPLPRKKJK-AAEUAGOBSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183184997	408348472	/nfs/dbraw/zinc/34/84/72/408348472.db2.gz	AGRFETPLPRKKJK-AAEUAGOBSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000274543568	408444868	/nfs/dbraw/zinc/44/48/68/408444868.db2.gz	UUUKGIOXRAHXEU-YGRLFVJLSA-N	1	1	306.366	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H](O)C(F)(F)F)C2)nc1	ZINC000248388057	408555590	/nfs/dbraw/zinc/55/55/90/408555590.db2.gz	CUHSTHUGSJZPTG-PSASIEDQSA-N	1	1	320.271	1.399	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@@H](O)C(F)(F)F)C2)nc1	ZINC000248388057	408555592	/nfs/dbraw/zinc/55/55/92/408555592.db2.gz	CUHSTHUGSJZPTG-PSASIEDQSA-N	1	1	320.271	1.399	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248441390	408566190	/nfs/dbraw/zinc/56/61/90/408566190.db2.gz	DQGXXAUHODJIDV-MGPQQGTHSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534276	408566457	/nfs/dbraw/zinc/56/64/57/408566457.db2.gz	WDMVXQYWFPEHNU-IUODEOHRSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534276	408566459	/nfs/dbraw/zinc/56/64/59/408566459.db2.gz	WDMVXQYWFPEHNU-IUODEOHRSA-N	1	1	321.377	1.793	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248459348	408570606	/nfs/dbraw/zinc/57/06/06/408570606.db2.gz	NNXLKUZEMWOHGU-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[NH2+]CCN1S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000193358651	408713454	/nfs/dbraw/zinc/71/34/54/408713454.db2.gz	KPKGZHOLZYWACJ-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000162617620	408719563	/nfs/dbraw/zinc/71/95/63/408719563.db2.gz	LTDVUIOSHQJNKN-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1O	ZINC000249550064	408740756	/nfs/dbraw/zinc/74/07/56/408740756.db2.gz	HPDTXANIZJCYTP-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000251696821	408785598	/nfs/dbraw/zinc/78/55/98/408785598.db2.gz	IRBPJCRBIVCFJP-RYUDHWBXSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000251696821	408785601	/nfs/dbraw/zinc/78/56/01/408785601.db2.gz	IRBPJCRBIVCFJP-RYUDHWBXSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000251903102	408788694	/nfs/dbraw/zinc/78/86/94/408788694.db2.gz	SOJYVZOMZFLQHB-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000251903102	408788697	/nfs/dbraw/zinc/78/86/97/408788697.db2.gz	SOJYVZOMZFLQHB-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000252441772	408794211	/nfs/dbraw/zinc/79/42/11/408794211.db2.gz	RXRDTFGXKQPDQQ-UKRRQHHQSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000270942882	408752056	/nfs/dbraw/zinc/75/20/56/408752056.db2.gz	RSFKXYPVNIOLCV-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000270942882	408752062	/nfs/dbraw/zinc/75/20/62/408752062.db2.gz	RSFKXYPVNIOLCV-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@@H]21	ZINC000178004438	408754992	/nfs/dbraw/zinc/75/49/92/408754992.db2.gz	TZQOQAHNUPGAFP-NHYWBVRUSA-N	1	1	318.377	1.733	20	5		DDBDMO
COC[C@H](Cc1ccccc1)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000191482894	163188862	/nfs/dbraw/zinc/18/88/62/163188862.db2.gz	SSDLEKAQTBOUDK-HNNXBMFYSA-N	1	1	318.377	1.981	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N(C)CCC[NH+]1CCN(C)CC1	ZINC000192585332	163227765	/nfs/dbraw/zinc/22/77/65/163227765.db2.gz	IUDGCQAGGJRDGY-UHFFFAOYSA-N	1	1	324.429	1.193	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000286166587	408935347	/nfs/dbraw/zinc/93/53/47/408935347.db2.gz	WOIPALXJXAUSHJ-ZIAGYGMSSA-N	1	1	323.393	1.772	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000277432161	408939352	/nfs/dbraw/zinc/93/93/52/408939352.db2.gz	DTCZJRYFDUIFPJ-CYBMUJFWSA-N	1	1	321.381	1.315	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000282209803	409011252	/nfs/dbraw/zinc/01/12/52/409011252.db2.gz	XWAPLHJJVKLTEZ-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
O=c1cc(C[N@H+]2C[C@@H](O)[C@@H](O)C2)c2c(ccc3ccccc32)o1	ZINC000278954119	409120831	/nfs/dbraw/zinc/12/08/31/409120831.db2.gz	ZAOXYUDFPXFJJS-GASCZTMLSA-N	1	1	311.337	1.484	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000283556770	409175664	/nfs/dbraw/zinc/17/56/64/409175664.db2.gz	UJRWLWHIQMPZKZ-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
O=c1nc([C@H]2CCCCN2Cc2cccc([N+](=O)[O-])c2)[nH][n-]1	ZINC000289047478	409211522	/nfs/dbraw/zinc/21/15/22/409211522.db2.gz	BWJRJJLBFAOHQQ-GFCCVEGCSA-N	1	1	303.322	1.733	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000294020359	409226222	/nfs/dbraw/zinc/22/62/22/409226222.db2.gz	QMCDDWIEAMXXSD-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000294020359	409226225	/nfs/dbraw/zinc/22/62/25/409226225.db2.gz	QMCDDWIEAMXXSD-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(=O)c1cc(N2CCC[N@@H+](CCO)CC2)ccc1[N+](=O)[O-]	ZINC000283848884	409227217	/nfs/dbraw/zinc/22/72/17/409227217.db2.gz	TZEIAKMPUQHQHW-UHFFFAOYSA-N	1	1	307.350	1.302	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000279384985	409203845	/nfs/dbraw/zinc/20/38/45/409203845.db2.gz	IFOOUWFPUJDSPL-SNVBAGLBSA-N	1	1	324.356	1.730	20	5		DDBDMO
C[C@H](NC(=O)[C@H](C)N1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000295260793	409402124	/nfs/dbraw/zinc/40/21/24/409402124.db2.gz	GCJFLDMBADPCOF-STQMWFEESA-N	1	1	320.393	1.408	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1	ZINC000285390764	409423223	/nfs/dbraw/zinc/42/32/23/409423223.db2.gz	NXXJLDZYXQMSML-TZMCWYRMSA-N	1	1	320.353	1.103	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1	ZINC000285390764	409423224	/nfs/dbraw/zinc/42/32/24/409423224.db2.gz	NXXJLDZYXQMSML-TZMCWYRMSA-N	1	1	320.353	1.103	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000295425730	409476626	/nfs/dbraw/zinc/47/66/26/409476626.db2.gz	UHMSWWOSXKUJCI-SNVBAGLBSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000295425730	409476629	/nfs/dbraw/zinc/47/66/29/409476629.db2.gz	UHMSWWOSXKUJCI-SNVBAGLBSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000295425730	409476632	/nfs/dbraw/zinc/47/66/32/409476632.db2.gz	UHMSWWOSXKUJCI-SNVBAGLBSA-N	1	1	321.381	1.437	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)C[C@H]2C1	ZINC000408278029	164283848	/nfs/dbraw/zinc/28/38/48/164283848.db2.gz	COXGVHDCIIOSRJ-TXEJJXNPSA-N	1	1	314.345	1.710	20	5		DDBDMO
C[N@@H+](CCNc1nccc(C(N)=O)c1[N+](=O)[O-])C1CCCC1	ZINC000290694411	409491013	/nfs/dbraw/zinc/49/10/13/409491013.db2.gz	UYSAIVHHUSFZNK-UHFFFAOYSA-N	1	1	307.354	1.375	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356793983	409613263	/nfs/dbraw/zinc/61/32/63/409613263.db2.gz	LWBVGLBWLPTQQB-GHMZBOCLSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356793983	409613272	/nfs/dbraw/zinc/61/32/72/409613272.db2.gz	LWBVGLBWLPTQQB-GHMZBOCLSA-N	1	1	322.365	1.695	20	5		DDBDMO
CC[N@H+](Cc1ccccn1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000305034147	409657299	/nfs/dbraw/zinc/65/72/99/409657299.db2.gz	IDKUGBVTDUZGSF-CQSZACIVSA-N	1	1	305.338	1.069	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881926	409689185	/nfs/dbraw/zinc/68/91/85/409689185.db2.gz	PEFAAVVSPYXNIO-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881926	409689192	/nfs/dbraw/zinc/68/91/92/409689192.db2.gz	PEFAAVVSPYXNIO-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881926	409689202	/nfs/dbraw/zinc/68/92/02/409689202.db2.gz	PEFAAVVSPYXNIO-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881926	409689210	/nfs/dbraw/zinc/68/92/10/409689210.db2.gz	PEFAAVVSPYXNIO-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H]1C	ZINC000354439059	409854879	/nfs/dbraw/zinc/85/48/79/409854879.db2.gz	UXKSYRABUQQWQD-NWDGAFQWSA-N	1	1	308.382	1.878	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc(F)cc1[N+](=O)[O-]	ZINC000299002317	410479238	/nfs/dbraw/zinc/47/92/38/410479238.db2.gz	JWXRWTRYIVHTFN-VXGBXAGGSA-N	1	1	322.340	1.673	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(C[NH+](C)C)on1	ZINC000359175087	410563920	/nfs/dbraw/zinc/56/39/20/410563920.db2.gz	RCUDFJOLJCFPLC-UHFFFAOYSA-N	1	1	318.333	1.917	20	5		DDBDMO
CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355541670	410571020	/nfs/dbraw/zinc/57/10/20/410571020.db2.gz	JAMFXCLPBYPRFD-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355541670	410571027	/nfs/dbraw/zinc/57/10/27/410571027.db2.gz	JAMFXCLPBYPRFD-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H](C)O	ZINC000352228777	410562117	/nfs/dbraw/zinc/56/21/17/410562117.db2.gz	AMZOYGGQZDGMSG-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H](C)O	ZINC000352228777	410562120	/nfs/dbraw/zinc/56/21/20/410562120.db2.gz	AMZOYGGQZDGMSG-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000301197144	410674970	/nfs/dbraw/zinc/67/49/70/410674970.db2.gz	UQYJELUQTGODTP-LLVKDONJSA-N	1	1	324.356	1.733	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@@H+](C3CC3)CCO2)ccc1[N+](=O)[O-]	ZINC000301406052	410714929	/nfs/dbraw/zinc/71/49/29/410714929.db2.gz	UQAVZHSXEQHLTD-CYBMUJFWSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@H+](C3CC3)CCO2)ccc1[N+](=O)[O-]	ZINC000301406052	410714940	/nfs/dbraw/zinc/71/49/40/410714940.db2.gz	UQAVZHSXEQHLTD-CYBMUJFWSA-N	1	1	307.350	1.879	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCNC1=O	ZINC000340217360	410760753	/nfs/dbraw/zinc/76/07/53/410760753.db2.gz	BGJAXGRVDNRRMK-ZDUSSCGKSA-N	1	1	320.349	1.052	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600204	410813744	/nfs/dbraw/zinc/81/37/44/410813744.db2.gz	FQIZJXFWBXMKHV-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600204	410813749	/nfs/dbraw/zinc/81/37/49/410813749.db2.gz	FQIZJXFWBXMKHV-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600204	410813751	/nfs/dbraw/zinc/81/37/51/410813751.db2.gz	FQIZJXFWBXMKHV-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600204	410813755	/nfs/dbraw/zinc/81/37/55/410813755.db2.gz	FQIZJXFWBXMKHV-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[N@H+](C)CC1	ZINC000340310434	410845332	/nfs/dbraw/zinc/84/53/32/410845332.db2.gz	YEYVDOGBYVNULQ-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000302659361	410846009	/nfs/dbraw/zinc/84/60/09/410846009.db2.gz	AQUVLRGMHFMWFD-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
COc1cc(C(=O)NCC[NH+]2CCC2)c([N+](=O)[O-])cc1OC	ZINC000337617167	410900402	/nfs/dbraw/zinc/90/04/02/410900402.db2.gz	MFAQTCYEPCHJBU-UHFFFAOYSA-N	1	1	309.322	1.048	20	5		DDBDMO
CC(C)N(C)C(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000331278105	411054473	/nfs/dbraw/zinc/05/44/73/411054473.db2.gz	DFLFHTUVEXGLMZ-GFCCVEGCSA-N	1	1	321.381	1.343	20	5		DDBDMO
CC(C)N(C)C(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000331278105	411054478	/nfs/dbraw/zinc/05/44/78/411054478.db2.gz	DFLFHTUVEXGLMZ-GFCCVEGCSA-N	1	1	321.381	1.343	20	5		DDBDMO
C[N@H+](CCc1ccccc1O)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000344230874	411042792	/nfs/dbraw/zinc/04/27/92/411042792.db2.gz	YKECYCYPNWIKKT-UHFFFAOYSA-N	1	1	317.345	1.637	20	5		DDBDMO
CC[C@H](CO)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000353671089	411105383	/nfs/dbraw/zinc/10/53/83/411105383.db2.gz	JMKGGUFHADQMEI-OCCSQVGLSA-N	1	1	304.350	1.778	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCN1C[C@H]2CC[C@@H](C1)O2	ZINC000374501916	418535888	/nfs/dbraw/zinc/53/58/88/418535888.db2.gz	GEKPQURIPNJXPQ-CALCHBBNSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000366956236	418542915	/nfs/dbraw/zinc/54/29/15/418542915.db2.gz	XRWRMOBWUIEBMS-CYBMUJFWSA-N	1	1	315.333	1.094	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000366956236	418542919	/nfs/dbraw/zinc/54/29/19/418542919.db2.gz	XRWRMOBWUIEBMS-CYBMUJFWSA-N	1	1	315.333	1.094	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+]([C@H]3CCSC3)CC2)s1	ZINC000367148503	418564446	/nfs/dbraw/zinc/56/44/46/418564446.db2.gz	XZQUJORMPMRLML-VIFPVBQESA-N	1	1	300.409	1.679	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C2)C1	ZINC000293617673	418580275	/nfs/dbraw/zinc/58/02/75/418580275.db2.gz	DGTYAOBFRUIMHQ-OAHLLOKOSA-N	1	1	322.340	1.484	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000365055772	418834567	/nfs/dbraw/zinc/83/45/67/418834567.db2.gz	WJBLFOZWVNJZTE-NEPJUHHUSA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1ccnc(N2CCC[N@@H+](CC(C)(C)O)CC2)c1[N+](=O)[O-]	ZINC000372593477	418886249	/nfs/dbraw/zinc/88/62/49/418886249.db2.gz	MBSFLHUGWVRQBJ-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
COC(=O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2C)CC[N@@H+](C)C1	ZINC000411915461	419481024	/nfs/dbraw/zinc/48/10/24/419481024.db2.gz	ZHDQRJLCOIWNPI-AWEZNQCLSA-N	1	1	321.377	1.440	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C1(C(=O)N(C)C)CC1	ZINC000411916176	419481445	/nfs/dbraw/zinc/48/14/45/419481445.db2.gz	USJQHMNXDZNQDT-UHFFFAOYSA-N	1	1	320.349	1.052	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C[C@H]1CCC[N@H+]1C	ZINC000421000788	419431531	/nfs/dbraw/zinc/43/15/31/419431531.db2.gz	KNIQYJOOQUCFOE-CQSZACIVSA-N	1	1	320.393	1.868	20	5		DDBDMO
CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCC[N@H+]1C	ZINC000420996870	419435350	/nfs/dbraw/zinc/43/53/50/419435350.db2.gz	GHYQFRNBLAXINB-CYBMUJFWSA-N	1	1	306.366	1.220	20	5		DDBDMO
COC(=O)[C@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000411902311	419457200	/nfs/dbraw/zinc/45/72/00/419457200.db2.gz	HWZDNIBMBYZMPH-CYBMUJFWSA-N	1	1	307.350	1.131	20	5		DDBDMO
CC(C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC(=O)N1	ZINC000412092233	419646582	/nfs/dbraw/zinc/64/65/82/419646582.db2.gz	VQULFMLJZZQHSR-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCC(F)(F)C[NH3+]	ZINC000418529905	419861088	/nfs/dbraw/zinc/86/10/88/419861088.db2.gz	YJUSDXLMTLYPRU-UHFFFAOYSA-N	1	1	316.308	1.373	20	5		DDBDMO
C[C@H]1CN(CCn2cc([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC000429385351	420010717	/nfs/dbraw/zinc/01/07/17/420010717.db2.gz	VKKVSZITFJTDHW-ZDUSSCGKSA-N	1	1	307.398	1.598	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430237706	420094958	/nfs/dbraw/zinc/09/49/58/420094958.db2.gz	PKCYTMKOQBPCKU-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420585841	420323541	/nfs/dbraw/zinc/32/35/41/420323541.db2.gz	NFSGGRGPYRQTGY-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3c(C(N)=O)cccc3[N+](=O)[O-])C2)C1	ZINC000420644194	420340271	/nfs/dbraw/zinc/34/02/71/420340271.db2.gz	WPTKCXMHFVYUJP-OAHLLOKOSA-N	1	1	304.350	1.226	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000420740720	420374660	/nfs/dbraw/zinc/37/46/60/420374660.db2.gz	RVLJXDFMYDXACA-LBPRGKRZSA-N	1	1	313.379	1.310	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000425504906	420403453	/nfs/dbraw/zinc/40/34/53/420403453.db2.gz	XOBLWHNGIPACMW-CQSZACIVSA-N	1	1	317.349	1.902	20	5		DDBDMO
CN(C)C[C@H](O)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000417317126	420448861	/nfs/dbraw/zinc/44/88/61/420448861.db2.gz	VRMGPQYHQCLVCJ-GDBMZVCRSA-N	1	1	307.394	1.874	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000492360628	420534261	/nfs/dbraw/zinc/53/42/61/420534261.db2.gz	ACFCCODOJHHAJV-HJWRWDBZSA-N	1	1	301.346	1.986	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1	ZINC000457105359	420614648	/nfs/dbraw/zinc/61/46/48/420614648.db2.gz	CDMQILOOSYOQDT-LBPRGKRZSA-N	1	1	309.370	1.041	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000492988042	420728526	/nfs/dbraw/zinc/72/85/26/420728526.db2.gz	NPYRFTZVECOGRS-FWWRYZNZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000492988042	420728529	/nfs/dbraw/zinc/72/85/29/420728529.db2.gz	NPYRFTZVECOGRS-FWWRYZNZSA-N	1	1	319.361	1.133	20	5		DDBDMO
CC1=CC[N@@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)CC1	ZINC000447682815	420793836	/nfs/dbraw/zinc/79/38/36/420793836.db2.gz	KFTUJRGQDHTKTG-UHFFFAOYSA-N	1	1	301.350	1.957	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455095374	420968337	/nfs/dbraw/zinc/96/83/37/420968337.db2.gz	TWHJABRFRGVTEQ-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455095374	420968339	/nfs/dbraw/zinc/96/83/39/420968339.db2.gz	TWHJABRFRGVTEQ-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
CNc1nc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000454921238	420943085	/nfs/dbraw/zinc/94/30/85/420943085.db2.gz	IIBVGGFIJGPVST-JTQLQIEISA-N	1	1	319.365	1.246	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c1	ZINC000449433159	421010576	/nfs/dbraw/zinc/01/05/76/421010576.db2.gz	LASCQXKMVCSYIC-FVQBIDKESA-N	1	1	306.362	1.957	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000487494261	421030760	/nfs/dbraw/zinc/03/07/60/421030760.db2.gz	DDJFZZMCEULKSW-ONGXEEELSA-N	1	1	317.349	1.285	20	5		DDBDMO
[NH3+][C@H]1CCC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449635816	421041466	/nfs/dbraw/zinc/04/14/66/421041466.db2.gz	CHSPHBDNIFPSKI-ZJUUUORDSA-N	1	1	317.349	1.718	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000456362495	421149913	/nfs/dbraw/zinc/14/99/13/421149913.db2.gz	WPZUVFKJQZKYPL-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCC[N@H+]1CCCO	ZINC000450588459	421212926	/nfs/dbraw/zinc/21/29/26/421212926.db2.gz	BIMRBXQMUFZSPM-GFCCVEGCSA-N	1	1	311.386	1.378	20	5		DDBDMO
C[C@H]1COCCN1CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000525802642	421302969	/nfs/dbraw/zinc/30/29/69/421302969.db2.gz	YTPFSXFTEOFNOK-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H]1COCCN1CC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000525802642	421302972	/nfs/dbraw/zinc/30/29/72/421302972.db2.gz	YTPFSXFTEOFNOK-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@]1(CO)CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000545398076	421257650	/nfs/dbraw/zinc/25/76/50/421257650.db2.gz	VVKUQCMDSUHHOO-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000545398076	421257651	/nfs/dbraw/zinc/25/76/51/421257651.db2.gz	VVKUQCMDSUHHOO-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000564362042	421583830	/nfs/dbraw/zinc/58/38/30/421583830.db2.gz	GGUUZJVXJNHHOG-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000564362042	421583833	/nfs/dbraw/zinc/58/38/33/421583833.db2.gz	GGUUZJVXJNHHOG-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000518026771	421637063	/nfs/dbraw/zinc/63/70/63/421637063.db2.gz	FJNRDLUWOGRPPM-JTQLQIEISA-N	1	1	309.370	1.340	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000520065303	421738798	/nfs/dbraw/zinc/73/87/98/421738798.db2.gz	RKEMPGWJNQTONA-JTQLQIEISA-N	1	1	307.354	1.231	20	5		DDBDMO
Nc1ccc(N[C@H]2CC[N@H+](C3CCCCC3)C2)nc1[N+](=O)[O-]	ZINC000596481103	422377353	/nfs/dbraw/zinc/37/73/53/422377353.db2.gz	XIMMDSJEFSDMQS-NSHDSACASA-N	1	1	305.382	2.391	20	5		DDBDMO
Cc1ccnc(NCCCCN2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000609669393	422463596	/nfs/dbraw/zinc/46/35/96/422463596.db2.gz	YXAXNTMDDMGLKT-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]2COCC[C@H]21	ZINC000341583120	271127160	/nfs/dbraw/zinc/12/71/60/271127160.db2.gz	UISULLXAWUIHOU-GXTWGEPZSA-N	1	1	307.350	1.257	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000341786137	271213000	/nfs/dbraw/zinc/21/30/00/271213000.db2.gz	BFBIXHMGELJBRO-LLVKDONJSA-N	1	1	309.370	1.079	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000341786137	271213002	/nfs/dbraw/zinc/21/30/02/271213002.db2.gz	BFBIXHMGELJBRO-LLVKDONJSA-N	1	1	309.370	1.079	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000343440388	271772808	/nfs/dbraw/zinc/77/28/08/271772808.db2.gz	NWTSFKVDJLDUCF-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000343440388	271772811	/nfs/dbraw/zinc/77/28/11/271772811.db2.gz	NWTSFKVDJLDUCF-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000427968820	274338259	/nfs/dbraw/zinc/33/82/59/274338259.db2.gz	VHDAEBSRGVCDHV-BXUZGUMPSA-N	1	1	319.361	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)c2nonc21	ZINC000291000356	275036415	/nfs/dbraw/zinc/03/64/15/275036415.db2.gz	UZSIWFMZQYFKHA-UHFFFAOYSA-N	1	1	315.293	1.181	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000331225060	276178597	/nfs/dbraw/zinc/17/85/97/276178597.db2.gz	XLPFUVDJYLDVTB-JTQLQIEISA-N	1	1	309.370	1.655	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@H]3OCC[N@@H+](C)[C@H]3C2)c1	ZINC000284896891	295254494	/nfs/dbraw/zinc/25/44/94/295254494.db2.gz	HHRAINCVHLNRLZ-LSDHHAIUSA-N	1	1	307.350	1.513	20	5		DDBDMO
C[C@H]1C[C@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000354205239	298363271	/nfs/dbraw/zinc/36/32/71/298363271.db2.gz	QVVHZJYVJUNCGR-UWVGGRQHSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@H]1C[C@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000354205239	298363273	/nfs/dbraw/zinc/36/32/73/298363273.db2.gz	QVVHZJYVJUNCGR-UWVGGRQHSA-N	1	1	321.333	1.992	20	5		DDBDMO
COCCCOC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000355329945	298715781	/nfs/dbraw/zinc/71/57/81/298715781.db2.gz	BKALJIFYVFHIOA-UHFFFAOYSA-N	1	1	312.370	1.346	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000357312604	299005988	/nfs/dbraw/zinc/00/59/88/299005988.db2.gz	JNAMULTUGNQHIS-VHSXEESVSA-N	1	1	305.338	1.127	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000363265560	300241787	/nfs/dbraw/zinc/24/17/87/300241787.db2.gz	FYFAKBOAEKPFSW-LSDHHAIUSA-N	1	1	319.361	1.117	20	5		DDBDMO
COc1ccc(C[NH2+][C@H]2CCc3[nH]cnc3C2)cc1[N+](=O)[O-]	ZINC000368688240	301075565	/nfs/dbraw/zinc/07/55/65/301075565.db2.gz	NQIQNYIGILDBSQ-NSHDSACASA-N	1	1	302.334	1.974	20	5		DDBDMO
CC(C)OC[C@@H](O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012207	301119213	/nfs/dbraw/zinc/11/92/13/301119213.db2.gz	UMXJYJZBBXLXBR-OCCSQVGLSA-N	1	1	312.370	1.214	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000377495281	302185844	/nfs/dbraw/zinc/18/58/44/302185844.db2.gz	XOEWUGZNLFBFSR-LLVKDONJSA-N	1	1	320.349	1.121	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)n1	ZINC000377791133	302233851	/nfs/dbraw/zinc/23/38/51/302233851.db2.gz	ZDLPFZIAUNBWFZ-TZMCWYRMSA-N	1	1	306.366	1.825	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000532078037	303274918	/nfs/dbraw/zinc/27/49/18/303274918.db2.gz	IJQDDULYVBYBNF-QMTHXVAHSA-N	1	1	318.377	1.849	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]1COCC2	ZINC000369541924	307122999	/nfs/dbraw/zinc/12/29/99/307122999.db2.gz	QYFXWDORHVYPQE-XJKSGUPXSA-N	1	1	320.345	1.606	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000372658340	307172722	/nfs/dbraw/zinc/17/27/22/307172722.db2.gz	YAFABQJYWLYJIZ-ZNMIVQPWSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000372658340	307172723	/nfs/dbraw/zinc/17/27/23/307172723.db2.gz	YAFABQJYWLYJIZ-ZNMIVQPWSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000372658340	307172724	/nfs/dbraw/zinc/17/27/24/307172724.db2.gz	YAFABQJYWLYJIZ-ZNMIVQPWSA-N	1	1	303.362	1.432	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CN[C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000565169269	308022861	/nfs/dbraw/zinc/02/28/61/308022861.db2.gz	GBXMZLOQTJFXNC-SWLSCSKDSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@H](O)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000565169269	308022862	/nfs/dbraw/zinc/02/28/62/308022862.db2.gz	GBXMZLOQTJFXNC-SWLSCSKDSA-N	1	1	311.382	1.185	20	5		DDBDMO
C[C@H]1C[C@@H]([NH3+])CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000571773014	308201796	/nfs/dbraw/zinc/20/17/96/308201796.db2.gz	VNCBMWOVCGFFFK-RYUDHWBXSA-N	1	1	306.366	1.735	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@H]1C1(O)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000573452006	308241019	/nfs/dbraw/zinc/24/10/19/308241019.db2.gz	ZUPJPSZVPFHQSS-AWEZNQCLSA-N	1	1	319.361	1.913	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@H]1C1(O)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000573452006	308241021	/nfs/dbraw/zinc/24/10/21/308241021.db2.gz	ZUPJPSZVPFHQSS-AWEZNQCLSA-N	1	1	319.361	1.913	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000361591240	484521398	/nfs/dbraw/zinc/52/13/98/484521398.db2.gz	YPNRDUHHDYWNKI-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000248541849	500915906	/nfs/dbraw/zinc/91/59/06/500915906.db2.gz	IIRBZIFUPCGPBY-GRYCIOLGSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000248541849	500915908	/nfs/dbraw/zinc/91/59/08/500915908.db2.gz	IIRBZIFUPCGPBY-GRYCIOLGSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](CCCO)C1	ZINC000295590746	534336166	/nfs/dbraw/zinc/33/61/66/534336166.db2.gz	WMLXICCTHVVEFC-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1cn2c([nH+]1)CC[C@@H](Nc1ccc3ncc([N+](=O)[O-])n3n1)C2	ZINC000302608003	534506780	/nfs/dbraw/zinc/50/67/80/534506780.db2.gz	BBWPRLXXJQINGK-SNVBAGLBSA-N	1	1	313.321	1.569	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000423970378	534773460	/nfs/dbraw/zinc/77/34/60/534773460.db2.gz	MPODFTZMXSAGAE-LBPRGKRZSA-N	1	1	318.358	1.838	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[N@@H+](C3CC3)CCO1)CCN2	ZINC000302483513	534884131	/nfs/dbraw/zinc/88/41/31/534884131.db2.gz	XAXPIRQEDRDPAR-LBPRGKRZSA-N	1	1	318.377	1.838	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@H]1C[N@H+](C3CC3)CCO1)CCN2	ZINC000302483513	534884134	/nfs/dbraw/zinc/88/41/34/534884134.db2.gz	XAXPIRQEDRDPAR-LBPRGKRZSA-N	1	1	318.377	1.838	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000451947751	527787071	/nfs/dbraw/zinc/78/70/71/527787071.db2.gz	QGWASUNRLGRKAN-BXUZGUMPSA-N	1	1	314.313	1.636	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1	ZINC000299299584	527795343	/nfs/dbraw/zinc/79/53/43/527795343.db2.gz	ZGWUAKPOBWVKBG-UHFFFAOYSA-N	1	1	310.354	1.354	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000293249157	527903047	/nfs/dbraw/zinc/90/30/47/527903047.db2.gz	LYMRGMPUKVYWSK-JKSUJKDBSA-N	1	1	305.378	1.890	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000444616868	528934353	/nfs/dbraw/zinc/93/43/53/528934353.db2.gz	DXKLEKWLYKBHCL-UHFFFAOYSA-N	1	1	323.397	1.420	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)CC1	ZINC000298141187	529134186	/nfs/dbraw/zinc/13/41/86/529134186.db2.gz	MNQMKMCIQFRFQN-UHFFFAOYSA-N	1	1	322.321	1.589	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000821266279	599146666	/nfs/dbraw/zinc/14/66/66/599146666.db2.gz	AHBYSYNQZJGTGY-SECBINFHSA-N	1	1	318.341	1.066	20	5		DDBDMO
C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820664758	599590371	/nfs/dbraw/zinc/59/03/71/599590371.db2.gz	BQDHMOSQSCXTNL-VHSXEESVSA-N	1	1	317.353	1.670	20	5		DDBDMO
COCC[NH+](CCOC)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000083104704	696550753	/nfs/dbraw/zinc/55/07/53/696550753.db2.gz	VIRGCUAECNYSFP-UHFFFAOYSA-N	1	1	308.338	1.497	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000748350072	700112562	/nfs/dbraw/zinc/11/25/62/700112562.db2.gz	NJFYHHMKNLRXBR-NSHDSACASA-N	1	1	317.349	1.107	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000748350072	700112563	/nfs/dbraw/zinc/11/25/63/700112563.db2.gz	NJFYHHMKNLRXBR-NSHDSACASA-N	1	1	317.349	1.107	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000170686140	697348652	/nfs/dbraw/zinc/34/86/52/697348652.db2.gz	KIFQKSHIBIVVQP-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
C[C@H]1C[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCCO1	ZINC000172494547	697368368	/nfs/dbraw/zinc/36/83/68/697368368.db2.gz	DBSJCIXCPMOKBA-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@H]1C[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCCO1	ZINC000172494547	697368370	/nfs/dbraw/zinc/36/83/70/697368370.db2.gz	DBSJCIXCPMOKBA-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1c[nH+]ccc1OC1CCN(Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000773342963	697747391	/nfs/dbraw/zinc/74/73/91/697747391.db2.gz	XVJSNMWEWAOWBQ-UHFFFAOYSA-N	1	1	317.349	1.996	20	5		DDBDMO
COCC[NH+](CCOC)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000749937290	700192810	/nfs/dbraw/zinc/19/28/10/700192810.db2.gz	LXBLEWNHAVZRLR-UHFFFAOYSA-N	1	1	323.353	1.200	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594041	698124709	/nfs/dbraw/zinc/12/47/09/698124709.db2.gz	RZAKMXGHKGMOAD-BBRMVZONSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000262534280	698473548	/nfs/dbraw/zinc/47/35/48/698473548.db2.gz	QAUGDRVPDOWLRX-KGLIPLIRSA-N	1	1	304.394	1.635	20	5		DDBDMO
COC[C@@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000739872356	699781514	/nfs/dbraw/zinc/78/15/14/699781514.db2.gz	PKUUYEBUYOYMSI-SNVBAGLBSA-N	1	1	307.306	1.429	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000739872356	699781515	/nfs/dbraw/zinc/78/15/15/699781515.db2.gz	PKUUYEBUYOYMSI-SNVBAGLBSA-N	1	1	307.306	1.429	20	5		DDBDMO
CC[N@@H+](CCc1ccccn1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000744389771	699947310	/nfs/dbraw/zinc/94/73/10/699947310.db2.gz	JYSBOQMZANVFFS-OAHLLOKOSA-N	1	1	319.365	1.112	20	5		DDBDMO
Cc1nn(C[N@H+](C)CCOCC2CC2)c2ncc([N+](=O)[O-])cc12	ZINC000755946718	700594794	/nfs/dbraw/zinc/59/47/94/700594794.db2.gz	PZSWTTMTKRNOTL-UHFFFAOYSA-N	1	1	319.365	1.964	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CCOCC2CC2)c2ncc([N+](=O)[O-])cc12	ZINC000755946718	700594795	/nfs/dbraw/zinc/59/47/95/700594795.db2.gz	PZSWTTMTKRNOTL-UHFFFAOYSA-N	1	1	319.365	1.964	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)[nH]1	ZINC000839660904	701770760	/nfs/dbraw/zinc/77/07/60/701770760.db2.gz	ZLENMCAUWWDJEH-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660904	701770763	/nfs/dbraw/zinc/77/07/63/701770763.db2.gz	ZLENMCAUWWDJEH-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660904	701770769	/nfs/dbraw/zinc/77/07/69/701770769.db2.gz	ZLENMCAUWWDJEH-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660904	701770775	/nfs/dbraw/zinc/77/07/75/701770775.db2.gz	ZLENMCAUWWDJEH-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660904	701770781	/nfs/dbraw/zinc/77/07/81/701770781.db2.gz	ZLENMCAUWWDJEH-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@H]3CCC[NH2+]C3)CC2)cc1	ZINC000841041627	702320008	/nfs/dbraw/zinc/32/00/08/702320008.db2.gz	BRYSXVCUNJOPQD-AWEZNQCLSA-N	1	1	304.394	1.905	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879361315	706660966	/nfs/dbraw/zinc/66/09/66/706660966.db2.gz	CLDOSCIURGSEBE-GXTWGEPZSA-N	1	1	310.350	1.039	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000848785890	703588932	/nfs/dbraw/zinc/58/89/32/703588932.db2.gz	AUTOQSRLJMAAJS-UHFFFAOYSA-N	1	1	305.294	1.324	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000852432694	704045449	/nfs/dbraw/zinc/04/54/49/704045449.db2.gz	NXNFLGZXRVLXBC-LBPRGKRZSA-N	1	1	321.333	1.500	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2nnc(C3CC3)[nH]2)c1	ZINC000819341953	704110624	/nfs/dbraw/zinc/11/06/24/704110624.db2.gz	VBGSQTHXUGGRMG-LBPRGKRZSA-N	1	1	303.322	1.414	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000870885055	704157110	/nfs/dbraw/zinc/15/71/10/704157110.db2.gz	AGLRRNHDFYEVGA-PEYYIBSZSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)C2	ZINC000854736991	704446202	/nfs/dbraw/zinc/44/62/02/704446202.db2.gz	LYOMOEWBTJYUQY-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]2COC[C@@H]21	ZINC000832774716	706981271	/nfs/dbraw/zinc/98/12/71/706981271.db2.gz	AFIBRHMTFNNLPY-ZNMIVQPWSA-N	1	1	306.362	1.985	20	5		DDBDMO
COc1cc(COC(=O)Cn2c[nH+]cc2C)c([N+](=O)[O-])cc1F	ZINC000859947525	705050139	/nfs/dbraw/zinc/05/01/39/705050139.db2.gz	IGQOWTMEIQRQTL-UHFFFAOYSA-N	1	1	323.280	1.991	20	5		DDBDMO
C[C@H]([C@H](C)NC(=O)CCC(C)(C)[N+](=O)[O-])[NH+]1CCOCC1	ZINC000823130186	705148198	/nfs/dbraw/zinc/14/81/98/705148198.db2.gz	VRWYNQLYUVLKFJ-NWDGAFQWSA-N	1	1	301.387	1.047	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000874851037	705204064	/nfs/dbraw/zinc/20/40/64/705204064.db2.gz	ZCGGRJPAIMYLEC-STQMWFEESA-N	1	1	319.361	1.669	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]C3CCN(CC4CC4)CC3)C2)c1	ZINC000876946726	705933971	/nfs/dbraw/zinc/93/39/71/705933971.db2.gz	PUICRFBXMJIPAQ-UHFFFAOYSA-N	1	1	319.409	1.959	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@H]21	ZINC000827313251	705973042	/nfs/dbraw/zinc/97/30/42/705973042.db2.gz	YVPSQBRDAZHKJP-CMPLNLGQSA-N	1	1	304.350	1.343	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1	ZINC000827330865	705977540	/nfs/dbraw/zinc/97/75/40/705977540.db2.gz	SKINIXDAJLKNPX-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000877608179	706158072	/nfs/dbraw/zinc/15/80/72/706158072.db2.gz	ODRSQNPIKDUHAW-OLZOCXBDSA-N	1	1	322.361	1.567	20	5		DDBDMO
COC(=O)C1=NO[C@]2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)C1	ZINC000877713923	706185995	/nfs/dbraw/zinc/18/59/95/706185995.db2.gz	IUTWEJJGPKWZGY-OAHLLOKOSA-N	1	1	319.317	1.489	20	5		DDBDMO
COC(=O)C1=NO[C@]2(CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)C1	ZINC000877713923	706185996	/nfs/dbraw/zinc/18/59/96/706185996.db2.gz	IUTWEJJGPKWZGY-OAHLLOKOSA-N	1	1	319.317	1.489	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)cc1	ZINC000877789311	706213799	/nfs/dbraw/zinc/21/37/99/706213799.db2.gz	IENXCGBOHLGGCA-KGLIPLIRSA-N	1	1	324.402	1.504	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H]3CS(=O)(=O)C[C@@H]3C2)cc1	ZINC000877789311	706213801	/nfs/dbraw/zinc/21/38/01/706213801.db2.gz	IENXCGBOHLGGCA-KGLIPLIRSA-N	1	1	324.402	1.504	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@@H](C(F)(F)F)O1	ZINC000880059590	706866553	/nfs/dbraw/zinc/86/65/53/706866553.db2.gz	JKGZKGXQDKMUFS-ONGXEEELSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@@H](C(F)(F)F)O1	ZINC000880059590	706866556	/nfs/dbraw/zinc/86/65/56/706866556.db2.gz	JKGZKGXQDKMUFS-ONGXEEELSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1C[C@H](C)O[C@@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000880092290	706876641	/nfs/dbraw/zinc/87/66/41/706876641.db2.gz	KUGFSCXXOAFTID-AVGNSLFASA-N	1	1	321.377	1.881	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137801	706887775	/nfs/dbraw/zinc/88/77/75/706887775.db2.gz	KVMDWBWLQJUECK-XHSDSOJGSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137801	706887779	/nfs/dbraw/zinc/88/77/79/706887779.db2.gz	KVMDWBWLQJUECK-XHSDSOJGSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137801	706887781	/nfs/dbraw/zinc/88/77/81/706887781.db2.gz	KVMDWBWLQJUECK-XHSDSOJGSA-N	1	1	305.378	1.797	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)[N+](=O)[O-]	ZINC000834591780	707090671	/nfs/dbraw/zinc/09/06/71/707090671.db2.gz	DMTSSYMXDJAHGX-NEPJUHHUSA-N	1	1	301.362	1.467	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1nc2ccccn2c1[N+](=O)[O-]	ZINC000872781392	707597463	/nfs/dbraw/zinc/59/74/63/707597463.db2.gz	SNOOOTIVEXZASB-NWDGAFQWSA-N	1	1	301.350	1.915	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3C[C@@H]4COC[C@@H]4C3)n2)c1	ZINC000872784935	707600185	/nfs/dbraw/zinc/60/01/85/707600185.db2.gz	IFWFBJHZGLRACD-BETUJISGSA-N	1	1	315.333	1.389	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000882958643	707871913	/nfs/dbraw/zinc/87/19/13/707871913.db2.gz	GSTDBKOBVRMNFN-SSDOTTSWSA-N	1	1	307.276	1.853	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3nc4ccccn4c3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896915514	708181500	/nfs/dbraw/zinc/18/15/00/708181500.db2.gz	YXPJRWIENVUYHH-ABAIWWIYSA-N	1	1	301.350	1.630	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000897222716	708260422	/nfs/dbraw/zinc/26/04/22/708260422.db2.gz	XANUFHXQVMLLHZ-OLZOCXBDSA-N	1	1	309.341	1.769	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc([N+](=O)[O-])cc1Br	ZINC000884824037	708387598	/nfs/dbraw/zinc/38/75/98/708387598.db2.gz	ONQSXCRRNDEVSB-UHFFFAOYSA-N	1	1	318.171	1.693	20	5		DDBDMO
O=C([C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)N1CCCC1	ZINC000886006209	708680378	/nfs/dbraw/zinc/68/03/78/708680378.db2.gz	OPRCKTIAHXVMCG-AWEZNQCLSA-N	1	1	318.377	1.824	20	5		DDBDMO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886019401	708682375	/nfs/dbraw/zinc/68/23/75/708682375.db2.gz	SQJZJIXTLDFVHI-ZIAGYGMSSA-N	1	1	321.377	1.742	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886080684	708694538	/nfs/dbraw/zinc/69/45/38/708694538.db2.gz	FRGSVHKJLUURLP-UHFFFAOYSA-N	1	1	302.338	1.046	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886193737	708712558	/nfs/dbraw/zinc/71/25/58/708712558.db2.gz	BEAYUAXAQMBYDC-ZDUSSCGKSA-N	1	1	306.366	1.871	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3cccnc3[N+](=O)[O-])[C@H]2C1	ZINC000886218089	708717314	/nfs/dbraw/zinc/71/73/14/708717314.db2.gz	NLPLQUYCZQQLDN-UONOGXRCSA-N	1	1	306.366	1.285	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@H+](Cc2cccnc2[N+](=O)[O-])CC12COC2	ZINC000886220886	708718114	/nfs/dbraw/zinc/71/81/14/708718114.db2.gz	OVFXXJIQSVDNEI-LBPRGKRZSA-N	1	1	321.333	1.001	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC12COC2	ZINC000886220886	708718115	/nfs/dbraw/zinc/71/81/15/708718115.db2.gz	OVFXXJIQSVDNEI-LBPRGKRZSA-N	1	1	321.333	1.001	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N(C)CC[N@@H+](C)CCO	ZINC000912612771	713050928	/nfs/dbraw/zinc/05/09/28/713050928.db2.gz	QTZJTPJABAFVFX-UHFFFAOYSA-N	1	1	309.366	1.208	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000886285640	708735729	/nfs/dbraw/zinc/73/57/29/708735729.db2.gz	OQXSUKGFQBRCLE-AWEZNQCLSA-N	1	1	306.366	1.021	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403310	709037662	/nfs/dbraw/zinc/03/76/62/709037662.db2.gz	SZEOWTDITPDZOM-WFASDCNBSA-N	1	1	321.377	1.535	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403310	709037666	/nfs/dbraw/zinc/03/76/66/709037666.db2.gz	SZEOWTDITPDZOM-WFASDCNBSA-N	1	1	321.377	1.535	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@H+]2CCC(C)(C)C2)c1[N+](=O)[O-]	ZINC000890078521	709738210	/nfs/dbraw/zinc/73/82/10/709738210.db2.gz	FYQRNQDSEQRBPR-UHFFFAOYSA-N	1	1	309.370	1.098	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OCC[C@@H]1CCCC[N@@H+]1C	ZINC000910203564	709812871	/nfs/dbraw/zinc/81/28/71/709812871.db2.gz	BGHHVUMTZIVGOT-LBPRGKRZSA-N	1	1	310.354	1.517	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000910296270	709873782	/nfs/dbraw/zinc/87/37/82/709873782.db2.gz	UIZVOGHYMIOHEM-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F	ZINC000911477203	710814214	/nfs/dbraw/zinc/81/42/14/710814214.db2.gz	UEYYNIMRRBDYFC-GFCCVEGCSA-N	1	1	313.304	1.974	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F	ZINC000911477203	710814218	/nfs/dbraw/zinc/81/42/18/710814218.db2.gz	UEYYNIMRRBDYFC-GFCCVEGCSA-N	1	1	313.304	1.974	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]CC2(N(C)C)CCC2)c1[N+](=O)[O-]	ZINC000893884186	710874015	/nfs/dbraw/zinc/87/40/15/710874015.db2.gz	CDGZFSDMGGMGLH-UHFFFAOYSA-N	1	1	309.366	1.883	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCF	ZINC000894256004	711039057	/nfs/dbraw/zinc/03/90/57/711039057.db2.gz	AUZAUZYLDNUXES-QMMMGPOBSA-N	1	1	303.721	1.812	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000928555322	713224458	/nfs/dbraw/zinc/22/44/58/713224458.db2.gz	OJIUNTCRXHZXRV-LBPRGKRZSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000928555322	713224460	/nfs/dbraw/zinc/22/44/60/713224460.db2.gz	OJIUNTCRXHZXRV-LBPRGKRZSA-N	1	1	315.333	1.214	20	5		DDBDMO
COC(=O)/C=C/c1ccc(NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895777739	711604192	/nfs/dbraw/zinc/60/41/92/711604192.db2.gz	WVGVSDPGOHAWBY-FUEXJSSKSA-N	1	1	305.334	1.897	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CC[N@H+]1C1CCOCC1	ZINC000896519869	711737265	/nfs/dbraw/zinc/73/72/65/711737265.db2.gz	YPRMXKXJGZEQAI-CYBMUJFWSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000913933880	713321906	/nfs/dbraw/zinc/32/19/06/713321906.db2.gz	USZZDXSDUPAFSR-NEPJUHHUSA-N	1	1	321.381	1.399	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC12CCCCC2	ZINC000908571233	712809843	/nfs/dbraw/zinc/80/98/43/712809843.db2.gz	SYPBPAHGVRENOV-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[NH+](CCc2ccncc2)CC1	ZINC000915218209	713413249	/nfs/dbraw/zinc/41/32/49/713413249.db2.gz	SMSXFTOIWWNABN-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CCn3cc[nH+]c32)c1	ZINC000931520502	714118402	/nfs/dbraw/zinc/11/84/02/714118402.db2.gz	WMBCQYSZCKUPHL-UHFFFAOYSA-N	1	1	302.290	1.598	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000923269980	714291695	/nfs/dbraw/zinc/29/16/95/714291695.db2.gz	ZRGHPXFMLZUMKE-VHSXEESVSA-N	1	1	322.340	1.625	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H]1CCC[N@@H+]1C(C)C	ZINC000923889613	714485046	/nfs/dbraw/zinc/48/50/46/714485046.db2.gz	AKGGMBOXANOCDW-GFCCVEGCSA-N	1	1	310.354	1.516	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H]2COCC[C@H]2OC)c1	ZINC000934035399	714727449	/nfs/dbraw/zinc/72/74/49/714727449.db2.gz	MGSOZBOTCAIYMR-TZMCWYRMSA-N	1	1	324.333	1.275	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)[C@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000935693902	715118428	/nfs/dbraw/zinc/11/84/28/715118428.db2.gz	DRRDRDRBMWDWKK-CLWVCHIJSA-N	1	1	315.373	1.718	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H](C)[N@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC001164643045	719178088	/nfs/dbraw/zinc/17/80/88/719178088.db2.gz	YWMJDCJFZDVXNV-VHSXEESVSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC001164643045	719178093	/nfs/dbraw/zinc/17/80/93/719178093.db2.gz	YWMJDCJFZDVXNV-VHSXEESVSA-N	1	1	308.338	1.305	20	5		DDBDMO
O=[N+]([O-])c1ccccc1NC[C@@]1(CO)COC[C@@H]2CCC[N@H+]21	ZINC001120922924	782237512	/nfs/dbraw/zinc/23/75/12/782237512.db2.gz	TWQQVZAEQJTRLP-SWLSCSKDSA-N	1	1	307.350	1.232	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nnc([C@@H](C)[N+](=O)[O-])n2C)[C@H](C)C1	ZINC001121389461	782487558	/nfs/dbraw/zinc/48/75/58/782487558.db2.gz	SBVMYGZGDPWITD-UTUOFQBUSA-N	1	1	310.402	1.319	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)C(F)F	ZINC001025643197	736807015	/nfs/dbraw/zinc/80/70/15/736807015.db2.gz	GSTWLQLQNDQJJZ-GDNZZTSVSA-N	1	1	311.288	1.406	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(F)cc1Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932390	742777039	/nfs/dbraw/zinc/77/70/39/742777039.db2.gz	VNUROQTXRKHPND-ZYHUDNBSSA-N	1	1	315.732	1.350	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](CO)CC(F)F)nc2c1	ZINC001180865676	742970905	/nfs/dbraw/zinc/97/09/05/742970905.db2.gz	QVDGKBNVEDPOBZ-ZETCQYMHSA-N	1	1	301.249	1.842	20	5		DDBDMO
O=C(Cc1cnc[nH]1)NCC1(Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC001110356643	744156883	/nfs/dbraw/zinc/15/68/83/744156883.db2.gz	HAOJRBZTKBJOIC-UHFFFAOYSA-N	1	1	315.333	1.621	20	5		DDBDMO
CCn1cc2c(n1)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2COC	ZINC001169019274	762199458	/nfs/dbraw/zinc/19/94/58/762199458.db2.gz	HCZSONFZAQHBIR-MELADBBJSA-N	1	1	322.409	1.894	20	5		DDBDMO
CCn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C[C@H]2COC	ZINC001169019274	762199461	/nfs/dbraw/zinc/19/94/61/762199461.db2.gz	HCZSONFZAQHBIR-MELADBBJSA-N	1	1	322.409	1.894	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169024541	762202278	/nfs/dbraw/zinc/20/22/78/762202278.db2.gz	WWLWBWAIEZAOJF-FRRDWIJNSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169024541	762202282	/nfs/dbraw/zinc/20/22/82/762202282.db2.gz	WWLWBWAIEZAOJF-FRRDWIJNSA-N	1	1	323.397	1.289	20	5		DDBDMO
COc1cccc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169053579	762208697	/nfs/dbraw/zinc/20/86/97/762208697.db2.gz	IZFUONYPSVFUIN-MELADBBJSA-N	1	1	321.377	1.989	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2C[C@@H](OC)[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC001170328656	766253785	/nfs/dbraw/zinc/25/37/85/766253785.db2.gz	LAVBFPYZKLLBAD-LYRGGWFBSA-N	1	1	324.377	1.880	20	5		DDBDMO
COc1ccc(C[C@@H](C)N2CC[N@H+]3CC[C@H]3C2)c([N+](=O)[O-])c1	ZINC001170355645	766261940	/nfs/dbraw/zinc/26/19/40/766261940.db2.gz	NNVKFSAQQBSHDU-OCCSQVGLSA-N	1	1	305.378	1.924	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1ccc(OC)c([N+](=O)[O-])n1	ZINC001170513021	767721206	/nfs/dbraw/zinc/72/12/06/767721206.db2.gz	DRFMGRDOXFGWPI-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
CCC(=O)NCCC[NH+]1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC001096244344	768743372	/nfs/dbraw/zinc/74/33/72/768743372.db2.gz	XPEKZYJZFOCUIH-UHFFFAOYSA-N	1	1	321.381	1.028	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001093953258	775262051	/nfs/dbraw/zinc/26/20/51/775262051.db2.gz	TUUUEYDUWXQNIN-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001094008182	775324454	/nfs/dbraw/zinc/32/44/54/775324454.db2.gz	GTNZKLYXEYQKJK-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
COC(=O)[C@H](CN)C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172901368	776916270	/nfs/dbraw/zinc/91/62/70/776916270.db2.gz	MLFIQNNPCBLZCV-ZIAGYGMSSA-N	1	1	321.377	1.180	20	5		DDBDMO
C[C@]1(O)COCC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1	ZINC001172906389	776916862	/nfs/dbraw/zinc/91/68/62/776916862.db2.gz	XPBWHHXHGSSTGE-DOTOQJQBSA-N	1	1	320.389	1.925	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2(CO)COC2)c1F	ZINC001173190420	777036600	/nfs/dbraw/zinc/03/66/00/777036600.db2.gz	XTNYQYWWNPQXFX-VIFPVBQESA-N	1	1	314.313	1.024	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001101705837	777416019	/nfs/dbraw/zinc/41/60/19/777416019.db2.gz	ZKFKBXVOURFXEI-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101875262	777633191	/nfs/dbraw/zinc/63/31/91/777633191.db2.gz	QSUGWABROSONLL-UHFFFAOYSA-N	1	1	318.337	1.065	20	5		DDBDMO
CN(CCNc1ncccc1[N+](=O)[O-])C(=O)C[N@@H+](C)C1CCC1	ZINC001102017452	777799825	/nfs/dbraw/zinc/79/98/25/777799825.db2.gz	ZJUMXHQSXWMAHF-UHFFFAOYSA-N	1	1	321.381	1.344	20	5		DDBDMO
Cc1nc(NC[C@@H]2CC[N@H+]2C2CCOCC2)ncc1[N+](=O)[O-]	ZINC001120064187	781745192	/nfs/dbraw/zinc/74/51/92/781745192.db2.gz	CQTAFMAIWZMSNU-LBPRGKRZSA-N	1	1	307.354	1.358	20	5		DDBDMO
Cc1ncc(C(=O)N(C)CC[NH2+]Cc2ccccc2[N+](=O)[O-])[nH]1	ZINC001266660417	836609394	/nfs/dbraw/zinc/60/93/94/836609394.db2.gz	NPGIRKFXXSGIHV-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
CN(CC[NH2+]CCCCC(F)(F)F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001266696607	836684946	/nfs/dbraw/zinc/68/49/46/836684946.db2.gz	NHSXKLLTACZBJS-NXEZZACHSA-N	1	1	311.304	1.432	20	5		DDBDMO
Cc1cc(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cs1	ZINC001268790466	840816423	/nfs/dbraw/zinc/81/64/23/840816423.db2.gz	FZZYBBVYUWLPLW-CHWSQXEVSA-N	1	1	311.407	1.660	20	5		DDBDMO
CN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC001326489243	861402997	/nfs/dbraw/zinc/40/29/97/861402997.db2.gz	PLPNIQUVRHFISD-ZIAGYGMSSA-N	1	1	307.350	1.181	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(NCC[C@H]2CCC[N@@H+](C)C2)n1	ZINC001156379242	862988269	/nfs/dbraw/zinc/98/82/69/862988269.db2.gz	RJLOIPHKNPNBSP-LLVKDONJSA-N	1	1	309.370	1.846	20	5		DDBDMO
C[N@H+]1CCC[C@H](OCC(=O)OCc2ccc([N+](=O)[O-])cc2)C1	ZINC001224986808	881624858	/nfs/dbraw/zinc/62/48/58/881624858.db2.gz	KKFKGSNVSNHFBG-AWEZNQCLSA-N	1	1	308.334	1.749	20	5		DDBDMO
CC(C)[NH+]1CC(OCC(=O)OCc2ccc([N+](=O)[O-])cc2)C1	ZINC001224987416	881625747	/nfs/dbraw/zinc/62/57/47/881625747.db2.gz	QWGPMKPCXVSSGY-UHFFFAOYSA-N	1	1	308.334	1.747	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)n1	ZINC001157282398	863709714	/nfs/dbraw/zinc/70/97/14/863709714.db2.gz	NBWPIYZLELCEHC-MFKMUULPSA-N	1	1	320.349	1.307	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1cccc(F)c1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767206	864118007	/nfs/dbraw/zinc/11/80/07/864118007.db2.gz	JNFFAQPJNOCHPL-ZYHUDNBSSA-N	1	1	313.304	1.226	20	5		DDBDMO
Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@H+]3Cn2cc([N+](=O)[O-])cn2)cn1	ZINC001331509147	865124880	/nfs/dbraw/zinc/12/48/80/865124880.db2.gz	RAHXBKNDRZTJDA-QXMXGUDHSA-N	1	1	316.365	1.893	20	5		DDBDMO
Cn1cc(C2C[C@H]3CC[C@@H](C2)[N@@H+]3Cn2cc([N+](=O)[O-])cn2)cn1	ZINC001331509147	865124881	/nfs/dbraw/zinc/12/48/81/865124881.db2.gz	RAHXBKNDRZTJDA-QXMXGUDHSA-N	1	1	316.365	1.893	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC001159884670	865580924	/nfs/dbraw/zinc/58/09/24/865580924.db2.gz	JVHDOLJHPXIQHN-GMXVVIOVSA-N	1	1	304.350	1.247	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC001160160330	865703999	/nfs/dbraw/zinc/70/39/99/865703999.db2.gz	JELZJLSSINRPRG-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1NCC[NH+]1CCC(F)(F)CC1	ZINC001160752321	866099507	/nfs/dbraw/zinc/09/95/07/866099507.db2.gz	NIFKLSMBQYWEQD-UHFFFAOYSA-N	1	1	316.308	1.680	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2ccn(-c3cccc([N+](=O)[O-])c3)n2)o1	ZINC001322583453	868262897	/nfs/dbraw/zinc/26/28/97/868262897.db2.gz	PTJAXODYVGIGRO-UHFFFAOYSA-N	1	1	314.305	1.892	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(c4ccc(N)c([N+](=O)[O-])n4)C[C@]2(C1)CCCC3	ZINC001337352403	869447485	/nfs/dbraw/zinc/44/74/85/869447485.db2.gz	CKFLVEQEGGQSAQ-IYBDPMFKSA-N	1	1	317.393	1.884	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC001337837203	869651278	/nfs/dbraw/zinc/65/12/78/869651278.db2.gz	YYQGGKGDUZPYOX-LEWSCRJBSA-N	1	1	304.350	1.368	20	5		DDBDMO
COc1cc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001339815420	870712100	/nfs/dbraw/zinc/71/21/00/870712100.db2.gz	MPDPUAWHOPFNBN-BXUZGUMPSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@H](C)[C@H]2CN(C)CC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815420	870712112	/nfs/dbraw/zinc/71/21/12/870712112.db2.gz	MPDPUAWHOPFNBN-BXUZGUMPSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@H](C)[C@H]2CN(C)CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815420	870712127	/nfs/dbraw/zinc/71/21/27/870712127.db2.gz	MPDPUAWHOPFNBN-BXUZGUMPSA-N	1	1	308.382	1.650	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[N@@H+](CC)[C@@H](C)C1	ZINC001340011948	870838069	/nfs/dbraw/zinc/83/80/69/870838069.db2.gz	MQNPHMVJOQLWAR-LBPRGKRZSA-N	1	1	310.402	1.038	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCC2	ZINC001303551765	871135781	/nfs/dbraw/zinc/13/57/81/871135781.db2.gz	ZTMOBTLPTPGPAG-UHFFFAOYSA-N	1	1	319.296	1.389	20	5		DDBDMO
Cc1ccc(F)cc1C[NH2+]CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317584794	871142347	/nfs/dbraw/zinc/14/23/47/871142347.db2.gz	IVZRMBYOCOHKII-ZIAGYGMSSA-N	1	1	309.341	1.347	20	5		DDBDMO
Cc1noc(C[C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC001308111908	871471815	/nfs/dbraw/zinc/47/18/15/871471815.db2.gz	BFGTYOUARRSNCL-LBPRGKRZSA-N	1	1	320.353	1.437	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[NH+](C[C@H](C)O)CC2)cc([N+](=O)[O-])c1	ZINC001350262984	875601771	/nfs/dbraw/zinc/60/17/71/875601771.db2.gz	UEOJFYLBPGYHGB-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
COc1cc(CO[C@H](C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC001223397124	880946514	/nfs/dbraw/zinc/94/65/14/880946514.db2.gz	VMDRJYIHAZEIFR-GFCCVEGCSA-N	1	1	310.350	1.841	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])nc2Cl)C1	ZINC001229919006	884231428	/nfs/dbraw/zinc/23/14/28/884231428.db2.gz	IKBFPFMUHJYIPY-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])nc2Cl)C1	ZINC001229919006	884231445	/nfs/dbraw/zinc/23/14/45/884231445.db2.gz	IKBFPFMUHJYIPY-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
[NH3+]Cc1nc(=O)[nH]n1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254467018	896453617	/nfs/dbraw/zinc/45/36/17/896453617.db2.gz	RXEFYVJNXAFNDX-UHFFFAOYSA-N	1	1	318.337	1.192	20	5		DDBDMO
C[C@]1(CO)C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[C@H]1O	ZINC001254593351	896521472	/nfs/dbraw/zinc/52/14/72/896521472.db2.gz	LILUJHRMWPUFED-ARFHVFGLSA-N	1	1	306.362	1.127	20	5		DDBDMO
Cc1cc(N(C(N)=[NH2+])[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[nH]n1	ZINC001254601093	896523784	/nfs/dbraw/zinc/52/37/84/896523784.db2.gz	ZEHYKWMLENUYIY-GFCCVEGCSA-N	1	1	300.322	1.494	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254597366	896523961	/nfs/dbraw/zinc/52/39/61/896523961.db2.gz	CTQRIKUNHMFCLN-BBRMVZONSA-N	1	1	317.389	1.862	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254599697	896524345	/nfs/dbraw/zinc/52/43/45/896524345.db2.gz	PAFWHLFEUPVTHR-SWLSCSKDSA-N	1	1	304.346	1.947	20	5		DDBDMO
CC(=O)N1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1C	ZINC001254606853	896527093	/nfs/dbraw/zinc/52/70/93/896527093.db2.gz	IQWMVIYCBAQFNT-MEDUHNTESA-N	1	1	303.362	1.615	20	5		DDBDMO
CC(=O)N1CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1C	ZINC001254606853	896527106	/nfs/dbraw/zinc/52/71/06/896527106.db2.gz	IQWMVIYCBAQFNT-MEDUHNTESA-N	1	1	303.362	1.615	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1C	ZINC001254605777	896528541	/nfs/dbraw/zinc/52/85/41/896528541.db2.gz	DLEDTOAFXWNDPE-LKTVYLICSA-N	1	1	304.346	1.803	20	5		DDBDMO
CCOC(=O)c1cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])[nH]n1	ZINC001261493969	899605956	/nfs/dbraw/zinc/60/59/56/899605956.db2.gz	ZQNQDQGYLPWBED-UHFFFAOYSA-N	1	1	304.306	1.784	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@@H+]1CCCOCC1	ZINC000286536019	219041380	/nfs/dbraw/zinc/04/13/80/219041380.db2.gz	COPCJJZCPLXHPZ-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@H+]1CCCOCC1	ZINC000286536019	219041381	/nfs/dbraw/zinc/04/13/81/219041381.db2.gz	COPCJJZCPLXHPZ-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000305756636	231041052	/nfs/dbraw/zinc/04/10/52/231041052.db2.gz	CTVDNZOZQZCBST-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000305756636	231041054	/nfs/dbraw/zinc/04/10/54/231041054.db2.gz	CTVDNZOZQZCBST-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CC(C)(C)CO	ZINC000451243687	231044283	/nfs/dbraw/zinc/04/42/83/231044283.db2.gz	CJQPZVHGMHOJJH-UHFFFAOYSA-N	1	1	309.366	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CC(C)(C)CO	ZINC000451243687	231044286	/nfs/dbraw/zinc/04/42/86/231044286.db2.gz	CJQPZVHGMHOJJH-UHFFFAOYSA-N	1	1	309.366	1.792	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@]2(CNC(=O)C2)C1	ZINC000278783614	214399607	/nfs/dbraw/zinc/39/96/07/214399607.db2.gz	DIJKDUIMRPFARB-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000495196475	529572570	/nfs/dbraw/zinc/57/25/70/529572570.db2.gz	UQCXNGAEEFFTEL-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000495196475	529572576	/nfs/dbraw/zinc/57/25/76/529572576.db2.gz	UQCXNGAEEFFTEL-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000421701039	529949504	/nfs/dbraw/zinc/94/95/04/529949504.db2.gz	GRSJOKXTLBVZDW-NSHDSACASA-N	1	1	309.370	1.079	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286724899	219131030	/nfs/dbraw/zinc/13/10/30/219131030.db2.gz	XKNFWFYTUWKRAW-NSHDSACASA-N	1	1	306.366	1.220	20	5		DDBDMO
COc1c(C(=O)N2CC[NH+](C(C)C)CC2)cccc1[N+](=O)[O-]	ZINC000331025178	232364363	/nfs/dbraw/zinc/36/43/63/232364363.db2.gz	AOHBQMMRHCTZKU-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459514629	233267329	/nfs/dbraw/zinc/26/73/29/233267329.db2.gz	ARZHDNHVLVMICZ-JKOKRWQUSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459514629	233267336	/nfs/dbraw/zinc/26/73/36/233267336.db2.gz	ARZHDNHVLVMICZ-JKOKRWQUSA-N	1	1	305.334	1.245	20	5		DDBDMO
Cc1cc(N2CCC([N@@H+](C)CCCO)CC2)ncc1[N+](=O)[O-]	ZINC000266846704	186357078	/nfs/dbraw/zinc/35/70/78/186357078.db2.gz	PFEBRXBHBDCPCQ-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000488753103	233899062	/nfs/dbraw/zinc/89/90/62/233899062.db2.gz	QHDPAOIMYJIDDM-NWDGAFQWSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@H]1C	ZINC000043085832	352360320	/nfs/dbraw/zinc/36/03/20/352360320.db2.gz	FKWORRPFEYYIDH-NEPJUHHUSA-N	1	1	309.370	1.170	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000054644034	352699796	/nfs/dbraw/zinc/69/97/96/352699796.db2.gz	BQCROYWIYJURPA-CYBMUJFWSA-N	1	1	306.366	1.531	20	5		DDBDMO
CCC[N@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000072953268	191256835	/nfs/dbraw/zinc/25/68/35/191256835.db2.gz	PCMMTXLABUCSNM-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000072953268	191256838	/nfs/dbraw/zinc/25/68/38/191256838.db2.gz	PCMMTXLABUCSNM-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CN([C@@H]1CCC[N@H+](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000173405647	198211418	/nfs/dbraw/zinc/21/14/18/198211418.db2.gz	LZAICLWYEAUXEV-GFCCVEGCSA-N	1	1	313.379	1.310	20	5		DDBDMO
CN([C@@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000173405647	198211420	/nfs/dbraw/zinc/21/14/20/198211420.db2.gz	LZAICLWYEAUXEV-GFCCVEGCSA-N	1	1	313.379	1.310	20	5		DDBDMO
O=[N+]([O-])c1cnccc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000069797653	353173663	/nfs/dbraw/zinc/17/36/63/353173663.db2.gz	NRBWGYTYOLLMML-CYBMUJFWSA-N	1	1	306.366	1.538	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C[C@H](C)O)C(C)C	ZINC000072610944	353204609	/nfs/dbraw/zinc/20/46/09/353204609.db2.gz	OSVRGCPACXAOKS-LBPRGKRZSA-N	1	1	309.366	1.933	20	5		DDBDMO
O=C(C[NH+]1CCC(CO)CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000076991847	353447153	/nfs/dbraw/zinc/44/71/53/353447153.db2.gz	XQBSAEFIYIEJKK-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000587974346	354888102	/nfs/dbraw/zinc/88/81/02/354888102.db2.gz	XQNLRKCFLKJRFU-JTQLQIEISA-N	1	1	308.338	1.225	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000587974346	354888104	/nfs/dbraw/zinc/88/81/04/354888104.db2.gz	XQNLRKCFLKJRFU-JTQLQIEISA-N	1	1	308.338	1.225	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590044221	355042553	/nfs/dbraw/zinc/04/25/53/355042553.db2.gz	ISKOCPSNGZIHLT-JSGCOSHPSA-N	1	1	319.361	1.308	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1F	ZINC000590045679	355043681	/nfs/dbraw/zinc/04/36/81/355043681.db2.gz	SVRKMGJNYXVODN-FIXISWKDSA-N	1	1	321.352	2.000	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc([N+](=O)[O-])c1C	ZINC000590047188	355044312	/nfs/dbraw/zinc/04/43/12/355044312.db2.gz	XDJJTURWRTUFNN-BXUZGUMPSA-N	1	1	319.361	1.688	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC000590446498	355099853	/nfs/dbraw/zinc/09/98/53/355099853.db2.gz	VZFCVKRQXNRXCN-GWCFXTLKSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](O)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000590762310	355170173	/nfs/dbraw/zinc/17/01/73/355170173.db2.gz	QLELKNXPOWQLDU-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
CN(Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCC[N@H+]1C	ZINC000591505418	355322048	/nfs/dbraw/zinc/32/20/48/355322048.db2.gz	JOFGMUYSXOJDRH-CYBMUJFWSA-N	1	1	321.377	1.892	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)[C@H](C)[C@H]2C)c1	ZINC000593019059	355771051	/nfs/dbraw/zinc/77/10/51/355771051.db2.gz	DGQLKQOJIFOPFB-VXGBXAGGSA-N	1	1	321.377	1.906	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000593187839	355820869	/nfs/dbraw/zinc/82/08/69/355820869.db2.gz	USWHIQWUFBGJCU-UTUOFQBUSA-N	1	1	309.370	1.121	20	5		DDBDMO
[NH3+]CCC1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000593322963	355853759	/nfs/dbraw/zinc/85/37/59/355853759.db2.gz	QPWZONRPTYAYNJ-UHFFFAOYSA-N	1	1	321.377	1.927	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC000593588731	355935036	/nfs/dbraw/zinc/93/50/36/355935036.db2.gz	LXBKQCNUTCIOFL-NHYWBVRUSA-N	1	1	321.352	1.829	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594417365	356203266	/nfs/dbraw/zinc/20/32/66/356203266.db2.gz	BZDBOQOBFZCBPD-QWRGUYRKSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1	ZINC000594571558	356252624	/nfs/dbraw/zinc/25/26/24/356252624.db2.gz	QREGUCLXLOXUEE-ZDUSSCGKSA-N	1	1	304.350	1.771	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1(CO)CCC1	ZINC000292270389	222953484	/nfs/dbraw/zinc/95/34/84/222953484.db2.gz	ZKZDRYWSRJNYEF-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COC[C@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)OC	ZINC000595370251	356468112	/nfs/dbraw/zinc/46/81/12/356468112.db2.gz	FYIHJIZBXWPYNJ-YPMHNXCESA-N	1	1	310.354	1.137	20	5		DDBDMO
COC(=O)CC1([NH2+]Cc2onc(C)c2[N+](=O)[O-])CCOCC1	ZINC000595385591	356473741	/nfs/dbraw/zinc/47/37/41/356473741.db2.gz	YBYBBISYTZSCGC-UHFFFAOYSA-N	1	1	313.310	1.093	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000595575691	356558968	/nfs/dbraw/zinc/55/89/68/356558968.db2.gz	WHEGWVPPAIVPTF-AWEZNQCLSA-N	1	1	320.393	1.921	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000618210178	363512820	/nfs/dbraw/zinc/51/28/20/363512820.db2.gz	SGKBATBAXXJYOA-LBPRGKRZSA-N	1	1	319.361	1.818	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000595745626	356633722	/nfs/dbraw/zinc/63/37/22/356633722.db2.gz	YSSWJUZDQKGQDK-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1[C@H]([N@H+]2CC[C@@]3(O)C[C@H]3C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595757476	356640213	/nfs/dbraw/zinc/64/02/13/356640213.db2.gz	MCSPSAMWCKWMRP-SGIREYDYSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CC[C@@]3(O)C[C@H]3C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595757476	356640216	/nfs/dbraw/zinc/64/02/16/356640216.db2.gz	MCSPSAMWCKWMRP-SGIREYDYSA-N	1	1	317.345	1.157	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000595851030	356677115	/nfs/dbraw/zinc/67/71/15/356677115.db2.gz	SLRJZDKSBSFALR-PHIMTYICSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000595851030	356677119	/nfs/dbraw/zinc/67/71/19/356677119.db2.gz	SLRJZDKSBSFALR-PHIMTYICSA-N	1	1	321.333	1.417	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000595825776	356665850	/nfs/dbraw/zinc/66/58/50/356665850.db2.gz	GQZUHXAHXUPUOK-AWEZNQCLSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000595825776	356665851	/nfs/dbraw/zinc/66/58/51/356665851.db2.gz	GQZUHXAHXUPUOK-AWEZNQCLSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H]2COC[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000595829514	356666735	/nfs/dbraw/zinc/66/67/35/356666735.db2.gz	IGDDJANBBURVBU-QWHCGFSZSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H]2COC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595828149	356666851	/nfs/dbraw/zinc/66/68/51/356666851.db2.gz	UVRPHTWSXSOHRE-CHWSQXEVSA-N	1	1	319.361	1.892	20	5		DDBDMO
CCN1CC[NH+](CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596073008	356762877	/nfs/dbraw/zinc/76/28/77/356762877.db2.gz	CVSWIYDAXLFYNS-UHFFFAOYSA-N	1	1	309.370	1.135	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596163182	356797696	/nfs/dbraw/zinc/79/76/96/356797696.db2.gz	QDQGZGPQBRBEEW-NOZJJQNGSA-N	1	1	304.350	1.588	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@@H]2C1	ZINC000596189724	356806991	/nfs/dbraw/zinc/80/69/91/356806991.db2.gz	QGHLRECYVULPHF-IINYFYTJSA-N	1	1	304.350	1.224	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3cc[nH]c(=O)c3[N+](=O)[O-])C2)CC1	ZINC000596123075	356781784	/nfs/dbraw/zinc/78/17/84/356781784.db2.gz	MJUZAAZTHXYMEL-NSHDSACASA-N	1	1	321.381	1.276	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@H](Nc3cc[nH]c(=O)c3[N+](=O)[O-])C2)CC1	ZINC000596123075	356781787	/nfs/dbraw/zinc/78/17/87/356781787.db2.gz	MJUZAAZTHXYMEL-NSHDSACASA-N	1	1	321.381	1.276	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)CO1	ZINC000596432130	356877974	/nfs/dbraw/zinc/87/79/74/356877974.db2.gz	QMHVUIHBEFDTJX-QWRGUYRKSA-N	1	1	322.365	1.215	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)CO1	ZINC000596432130	356877976	/nfs/dbraw/zinc/87/79/76/356877976.db2.gz	QMHVUIHBEFDTJX-QWRGUYRKSA-N	1	1	322.365	1.215	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000596268625	356838971	/nfs/dbraw/zinc/83/89/71/356838971.db2.gz	KTTHQRJSXAMVEM-GFCCVEGCSA-N	1	1	320.393	1.875	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]3COC[C@@H]3C1)OCCO2	ZINC000597231771	357103171	/nfs/dbraw/zinc/10/31/71/357103171.db2.gz	QPCOVUIOGUDPJM-YPMHNXCESA-N	1	1	320.345	1.834	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(CC)[C@H]2CC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000598043928	357440844	/nfs/dbraw/zinc/44/08/44/357440844.db2.gz	XMIBSJMATBSRNC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC)[C@H]2CC[N@H+](CC)C2)c1[N+](=O)[O-]	ZINC000598043928	357440847	/nfs/dbraw/zinc/44/08/47/357440847.db2.gz	XMIBSJMATBSRNC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC)[C@H]2CC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000598043928	357440851	/nfs/dbraw/zinc/44/08/51/357440851.db2.gz	XMIBSJMATBSRNC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
Cc1noc([C@@H]2OCC[C@@H]2[NH2+]Cc2csc([N+](=O)[O-])c2)n1	ZINC000599021213	357796542	/nfs/dbraw/zinc/79/65/42/357796542.db2.gz	UPTYAYDPIQLTJI-GXSJLCMTSA-N	1	1	310.335	1.968	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CCCC[N@H+](C)C1	ZINC000600315554	358193771	/nfs/dbraw/zinc/19/37/71/358193771.db2.gz	UVTQJTUPOHPTQF-ZDUSSCGKSA-N	1	1	323.397	1.338	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600474008	358234719	/nfs/dbraw/zinc/23/47/19/358234719.db2.gz	WAYNTESQMBPCSP-NSHDSACASA-N	1	1	307.354	1.373	20	5		DDBDMO
C[C@@](CO)([NH2+]Cc1cnc2n1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000601148427	358422408	/nfs/dbraw/zinc/42/24/08/358422408.db2.gz	BOUVTFJBKLWGFB-INIZCTEOSA-N	1	1	316.361	1.735	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@H+](C)C(C)(C)C1	ZINC000601186053	358438594	/nfs/dbraw/zinc/43/85/94/358438594.db2.gz	DBGZZQQXHYTDIC-UHFFFAOYSA-N	1	1	321.303	1.878	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@@H+](C)C(C)(C)C1	ZINC000601186053	358438597	/nfs/dbraw/zinc/43/85/97/358438597.db2.gz	DBGZZQQXHYTDIC-UHFFFAOYSA-N	1	1	321.303	1.878	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)CC1(O)CCOCC1	ZINC000601956633	358752804	/nfs/dbraw/zinc/75/28/04/358752804.db2.gz	SEOCRJFQGQWAJY-CQSZACIVSA-N	1	1	324.377	1.319	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)CC1(O)CCOCC1	ZINC000601956633	358752805	/nfs/dbraw/zinc/75/28/05/358752805.db2.gz	SEOCRJFQGQWAJY-CQSZACIVSA-N	1	1	324.377	1.319	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1=O	ZINC000601970239	358758545	/nfs/dbraw/zinc/75/85/45/358758545.db2.gz	NFMIIZAHHPQZOI-AWEZNQCLSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C[C@H]1CC[N@@H+](C)C1	ZINC000602152956	358851061	/nfs/dbraw/zinc/85/10/61/358851061.db2.gz	ZPDFVMAATNBVIR-CQSZACIVSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([NH2+]CC(F)(F)CO)CC2)cn1	ZINC000602613364	359073853	/nfs/dbraw/zinc/07/38/53/359073853.db2.gz	YMNVAYSHBAECQW-UHFFFAOYSA-N	1	1	316.308	1.176	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC2(CCOCC2)CC1	ZINC000602812846	359209791	/nfs/dbraw/zinc/20/97/91/359209791.db2.gz	RXGYHTCBJMMWCV-UHFFFAOYSA-N	1	1	324.381	1.371	20	5		DDBDMO
Cn1cc(CN[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822939	359217557	/nfs/dbraw/zinc/21/75/57/359217557.db2.gz	HJXFEDOHUVNYHR-HUUCEWRRSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cc(CN[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822939	359217560	/nfs/dbraw/zinc/21/75/60/359217560.db2.gz	HJXFEDOHUVNYHR-HUUCEWRRSA-N	1	1	315.377	1.863	20	5		DDBDMO
COC[C@](C)(CO)[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000602933677	359303051	/nfs/dbraw/zinc/30/30/51/359303051.db2.gz	WIYXWXQSVCACJX-ZDUSSCGKSA-N	1	1	302.302	1.230	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1cn[nH]c1	ZINC000602882263	359265390	/nfs/dbraw/zinc/26/53/90/359265390.db2.gz	UEYJOOPZFWDOIO-ZDUSSCGKSA-N	1	1	303.322	1.317	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[NH+](C2CC2)CC1	ZINC000602957659	359321864	/nfs/dbraw/zinc/32/18/64/359321864.db2.gz	NTRAIINGDPNDHI-UHFFFAOYSA-N	1	1	305.338	1.032	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1(CO)CC1	ZINC000186817709	200016305	/nfs/dbraw/zinc/01/63/05/200016305.db2.gz	KEKVFJKXPPBGIK-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1(CO)CC1	ZINC000186817709	200016307	/nfs/dbraw/zinc/01/63/07/200016307.db2.gz	KEKVFJKXPPBGIK-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@@H]1O	ZINC000186830762	200018201	/nfs/dbraw/zinc/01/82/01/200018201.db2.gz	NOXJMGAIKGNBIV-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@@H]1O	ZINC000186830762	200018203	/nfs/dbraw/zinc/01/82/03/200018203.db2.gz	NOXJMGAIKGNBIV-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000186932165	200033057	/nfs/dbraw/zinc/03/30/57/200033057.db2.gz	SOJYVZOMZFLQHB-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000186932165	200033058	/nfs/dbraw/zinc/03/30/58/200033058.db2.gz	SOJYVZOMZFLQHB-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1ccc(OCCN[C@@H]2C[C@@H]([NH3+])C2(C)C)c([N+](=O)[O-])c1	ZINC000603430963	359635858	/nfs/dbraw/zinc/63/58/58/359635858.db2.gz	DDEHABNBOZKNCT-ZIAGYGMSSA-N	1	1	309.366	1.698	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000604199914	359725776	/nfs/dbraw/zinc/72/57/76/359725776.db2.gz	XEGDMRAUXPPWLA-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000189417837	200397787	/nfs/dbraw/zinc/39/77/87/200397787.db2.gz	CEFCRWMDBWICIO-NSHDSACASA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccccc1[N+](=O)[O-]	ZINC000189428697	200399639	/nfs/dbraw/zinc/39/96/39/200399639.db2.gz	UJGNDYMAHXQACJ-CYBMUJFWSA-N	1	1	307.394	1.872	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609570172	360326294	/nfs/dbraw/zinc/32/62/94/360326294.db2.gz	TZTKMFAAMMYGMR-UHFFFAOYSA-N	1	1	323.349	1.785	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846479	360355317	/nfs/dbraw/zinc/35/53/17/360355317.db2.gz	RTHJJMLEUZXLAE-JQWIXIFHSA-N	1	1	319.365	1.143	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846479	360355321	/nfs/dbraw/zinc/35/53/21/360355321.db2.gz	RTHJJMLEUZXLAE-JQWIXIFHSA-N	1	1	319.365	1.143	20	5		DDBDMO
Cc1cnc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC000610489136	360450356	/nfs/dbraw/zinc/45/03/56/360450356.db2.gz	FTQYOOWDKKMGBF-CQSZACIVSA-N	1	1	320.393	1.989	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000610615773	360482010	/nfs/dbraw/zinc/48/20/10/360482010.db2.gz	SMWAFXXQKFSVOB-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000610615773	360482013	/nfs/dbraw/zinc/48/20/13/360482013.db2.gz	SMWAFXXQKFSVOB-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1c([N+](=O)[O-])ncn1C	ZINC000611031275	360606917	/nfs/dbraw/zinc/60/69/17/360606917.db2.gz	MBZGXSAYWRRVAW-UHFFFAOYSA-N	1	1	311.386	1.123	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611088144	360619878	/nfs/dbraw/zinc/61/98/78/360619878.db2.gz	FKWWNQUYKBKUQE-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611088221	360620054	/nfs/dbraw/zinc/62/00/54/360620054.db2.gz	KECHXNDXINQTIZ-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCOC(=O)C[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000611237515	360674403	/nfs/dbraw/zinc/67/44/03/360674403.db2.gz	NACYIRJNBLEFRN-HNNXBMFYSA-N	1	1	322.361	1.873	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCOCC2(CC2)C1	ZINC000612120814	360924880	/nfs/dbraw/zinc/92/48/80/360924880.db2.gz	XAOOTEIONWKJKW-ZDUSSCGKSA-N	1	1	322.361	1.447	20	5		DDBDMO
C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@]1(CO)CCOC1	ZINC000613130292	361283335	/nfs/dbraw/zinc/28/33/35/361283335.db2.gz	SLQCGEGOWHJRMQ-CQSZACIVSA-N	1	1	307.306	1.319	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@]1(CO)CCOC1	ZINC000613130292	361283338	/nfs/dbraw/zinc/28/33/38/361283338.db2.gz	SLQCGEGOWHJRMQ-CQSZACIVSA-N	1	1	307.306	1.319	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)CN1	ZINC000619077474	363888014	/nfs/dbraw/zinc/88/80/14/363888014.db2.gz	HKOHEUFVBHZWMF-IMMZDGJCSA-N	1	1	301.346	1.820	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@H](C)c2nncn2C)c([N+](=O)[O-])c1	ZINC000275164366	212164041	/nfs/dbraw/zinc/16/40/41/212164041.db2.gz	JPEGAWIMGKVZPD-SNVBAGLBSA-N	1	1	321.337	1.462	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[NH2+]3)c1[N+](=O)[O-]	ZINC000262612957	203350526	/nfs/dbraw/zinc/35/05/26/203350526.db2.gz	WSQFEDKQRBNNHJ-ZJUUUORDSA-N	1	1	307.354	1.237	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000264580224	204008345	/nfs/dbraw/zinc/00/83/45/204008345.db2.gz	CHNPREUXKLHVAF-NSHDSACASA-N	1	1	321.381	1.581	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1	ZINC000264653334	204054205	/nfs/dbraw/zinc/05/42/05/204054205.db2.gz	HEXIWQKRJFSOPJ-JTQLQIEISA-N	1	1	302.334	1.758	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000264659586	204061537	/nfs/dbraw/zinc/06/15/37/204061537.db2.gz	HLHFJNMWUKSGQV-CQSZACIVSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1cc(C(=O)NCC[NH+]2CCSCC2)cc([N+](=O)[O-])c1	ZINC000264756855	204130965	/nfs/dbraw/zinc/13/09/65/204130965.db2.gz	BZXLBGTXCUCJLJ-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000288470090	220162619	/nfs/dbraw/zinc/16/26/19/220162619.db2.gz	ORTNRKABGKNQEZ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000288470090	220162623	/nfs/dbraw/zinc/16/26/23/220162623.db2.gz	ORTNRKABGKNQEZ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c(N)c([N+](=O)[O-])c1	ZINC000267365960	206014455	/nfs/dbraw/zinc/01/44/55/206014455.db2.gz	XHZBLBNREQWVGU-STQMWFEESA-N	1	1	318.377	1.842	20	5		DDBDMO
C[C@H](CCN1CCN(C)CC1)[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC000185881753	248543977	/nfs/dbraw/zinc/54/39/77/248543977.db2.gz	AOZMVZGJULSKNE-CQSZACIVSA-N	1	1	306.410	1.710	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000284795943	218180970	/nfs/dbraw/zinc/18/09/70/218180970.db2.gz	OGZBJKJROSBOJF-ZFWWWQNUSA-N	1	1	319.361	1.837	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](CCn3cc([N+](=O)[O-])cn3)C[C@H]1CCCC2	ZINC000284910328	218232100	/nfs/dbraw/zinc/23/21/00/218232100.db2.gz	VFFCMHPWHLJAEK-IUODEOHRSA-N	1	1	322.365	1.457	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)NC3CC3)C2)cc1[N+](=O)[O-]	ZINC000273776319	211050868	/nfs/dbraw/zinc/05/08/68/211050868.db2.gz	RYEJNGPNGQYXTG-AWEZNQCLSA-N	1	1	318.377	1.939	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H](NC(=O)NC3CC3)C2)cc1[N+](=O)[O-]	ZINC000273776319	211050871	/nfs/dbraw/zinc/05/08/71/211050871.db2.gz	RYEJNGPNGQYXTG-AWEZNQCLSA-N	1	1	318.377	1.939	20	5		DDBDMO
CC[N@H+]1CCCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000272964682	210349768	/nfs/dbraw/zinc/34/97/68/210349768.db2.gz	UBHVTBYMRUXXHE-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@@H]1CCN(C2CC2)C1=O	ZINC000352551221	285134148	/nfs/dbraw/zinc/13/41/48/285134148.db2.gz	WQEFYBODKWBOCY-OAHLLOKOSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CN1CCOc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000352708228	285244462	/nfs/dbraw/zinc/24/44/62/285244462.db2.gz	FOKFKODTDXQGEJ-OAHLLOKOSA-N	1	1	321.377	1.244	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@H]3CC[NH2+]C3)CC2)c1[N+](=O)[O-]	ZINC000289855702	221271411	/nfs/dbraw/zinc/27/14/11/221271411.db2.gz	CKBJNBZRDIELAQ-NSHDSACASA-N	1	1	307.354	1.088	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](CO)C1	ZINC000122202688	195417193	/nfs/dbraw/zinc/41/71/93/195417193.db2.gz	MBYFPFNQUPBATB-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000072044680	406872687	/nfs/dbraw/zinc/87/26/87/406872687.db2.gz	HRRSCRZAABYUGE-ZDUSSCGKSA-N	1	1	307.350	1.431	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCS(=O)(=O)C1	ZINC000084439778	407089187	/nfs/dbraw/zinc/08/91/87/407089187.db2.gz	FLRAFWKUDPVDSS-JTQLQIEISA-N	1	1	304.755	1.525	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCC[C@@H]1C	ZINC000046859977	407064721	/nfs/dbraw/zinc/06/47/21/407064721.db2.gz	LXXZMRROCPLQCD-NSHDSACASA-N	1	1	306.366	1.902	20	5		DDBDMO
CCOC(=O)CC[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000055058865	407193506	/nfs/dbraw/zinc/19/35/06/407193506.db2.gz	DEWGJLFXBUPLEJ-UHFFFAOYSA-N	1	1	307.350	1.670	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000055389448	407202163	/nfs/dbraw/zinc/20/21/63/407202163.db2.gz	WMMAKOZLIJRFSL-BETUJISGSA-N	1	1	323.397	1.276	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000067706305	407280693	/nfs/dbraw/zinc/28/06/93/407280693.db2.gz	RWKHBHNAMKGTMN-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000103284076	407336217	/nfs/dbraw/zinc/33/62/17/407336217.db2.gz	ILKCSPUSYCBXHT-NWDGAFQWSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000127498289	407438486	/nfs/dbraw/zinc/43/84/86/407438486.db2.gz	HVPMAKGSLRFCGD-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000127498092	407438720	/nfs/dbraw/zinc/43/87/20/407438720.db2.gz	HVPMAKGSLRFCGD-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCOC1	ZINC000178781996	407601365	/nfs/dbraw/zinc/60/13/65/407601365.db2.gz	ZHZVPFKRNLABBK-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000266868717	407656864	/nfs/dbraw/zinc/65/68/64/407656864.db2.gz	OLRVKAYUNWMPHM-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000266868717	407656868	/nfs/dbraw/zinc/65/68/68/407656868.db2.gz	OLRVKAYUNWMPHM-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H](NS(C)(=O)=O)C2)cccc1[N+](=O)[O-]	ZINC000116891458	407791446	/nfs/dbraw/zinc/79/14/46/407791446.db2.gz	DPPVLABMJLJKLL-LBPRGKRZSA-N	1	1	313.379	1.027	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H](NS(C)(=O)=O)C2)cccc1[N+](=O)[O-]	ZINC000116891458	407791453	/nfs/dbraw/zinc/79/14/53/407791453.db2.gz	DPPVLABMJLJKLL-LBPRGKRZSA-N	1	1	313.379	1.027	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC[C@@H]1CCC[N@@H+]1C	ZINC000118107030	407891052	/nfs/dbraw/zinc/89/10/52/407891052.db2.gz	KIBXOIJXNGMCCE-LBPRGKRZSA-N	1	1	320.349	1.052	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000154063236	407964013	/nfs/dbraw/zinc/96/40/13/407964013.db2.gz	RKRPNULOVPSKQG-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000154063236	407964020	/nfs/dbraw/zinc/96/40/20/407964020.db2.gz	RKRPNULOVPSKQG-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272532693	407969362	/nfs/dbraw/zinc/96/93/62/407969362.db2.gz	ISKRCRQNZQATHP-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272532693	407969368	/nfs/dbraw/zinc/96/93/68/407969368.db2.gz	ISKRCRQNZQATHP-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CCC[N@@H+](C)C1	ZINC000153847617	407918118	/nfs/dbraw/zinc/91/81/18/407918118.db2.gz	XWPOYHIRXDBXNN-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000272441349	407922828	/nfs/dbraw/zinc/92/28/28/407922828.db2.gz	INGPOMKBVCEFHH-IUODEOHRSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[C@H]1CN(CCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CC(C)(C)O	ZINC000189899960	408133116	/nfs/dbraw/zinc/13/31/16/408133116.db2.gz	WGMFJVXYLFZBGQ-AWEZNQCLSA-N	1	1	321.421	1.914	20	5		DDBDMO
Cn1cccc1[C@H]1CCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000175492957	408145217	/nfs/dbraw/zinc/14/52/17/408145217.db2.gz	AKJYTKNBPAHZKU-DZGCQCFKSA-N	1	1	319.365	1.328	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000246206941	408176872	/nfs/dbraw/zinc/17/68/72/408176872.db2.gz	AARMECHHBSQGDS-WFASDCNBSA-N	1	1	318.377	1.702	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H](C[NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000269330260	408270726	/nfs/dbraw/zinc/27/07/26/408270726.db2.gz	FDVMAKAWNRDTRE-JTQLQIEISA-N	1	1	309.370	1.465	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000269377380	408289263	/nfs/dbraw/zinc/28/92/63/408289263.db2.gz	IKPVRSMUPILYLO-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[N@@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000269377380	408289267	/nfs/dbraw/zinc/28/92/67/408289267.db2.gz	IKPVRSMUPILYLO-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000269377380	408289273	/nfs/dbraw/zinc/28/92/73/408289273.db2.gz	IKPVRSMUPILYLO-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H]1CN(c2nc(C)ccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000246853633	408352888	/nfs/dbraw/zinc/35/28/88/408352888.db2.gz	BQBKKBGKQQEUEE-STQMWFEESA-N	1	1	308.382	1.580	20	5		DDBDMO
COc1cc(C[N@H+](C[C@H](C)O)[C@@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000190936071	408343317	/nfs/dbraw/zinc/34/33/17/408343317.db2.gz	HUHFHAIQEAUHPR-UWVGGRQHSA-N	1	1	316.329	1.306	20	5		DDBDMO
COc1cc(C[N@@H+](C[C@H](C)O)[C@@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000190936071	408343319	/nfs/dbraw/zinc/34/33/19/408343319.db2.gz	HUHFHAIQEAUHPR-UWVGGRQHSA-N	1	1	316.329	1.306	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000176989627	408491031	/nfs/dbraw/zinc/49/10/31/408491031.db2.gz	QMPVBLWYBQFYSK-ZYHUDNBSSA-N	1	1	304.350	1.486	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000177007219	408495216	/nfs/dbraw/zinc/49/52/16/408495216.db2.gz	KDVJCBOFNGHVND-NEPJUHHUSA-N	1	1	318.377	1.794	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCC[N@H+]2C)cc([N+](=O)[O-])c1C	ZINC000191714652	408475032	/nfs/dbraw/zinc/47/50/32/408475032.db2.gz	AKFODJPOTGAIND-LBPRGKRZSA-N	1	1	307.350	1.736	20	5		DDBDMO
CC[C@@H]1CN(c2nccc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000265193137	408576361	/nfs/dbraw/zinc/57/63/61/408576361.db2.gz	LHWXDKDBNPZDAD-QWHCGFSZSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cc1ccc(NC(=O)C(=O)NCC[N@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000265363254	408624588	/nfs/dbraw/zinc/62/45/88/408624588.db2.gz	FWQNUANYAIAJNI-UHFFFAOYSA-N	1	1	320.349	1.052	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000192792459	408650648	/nfs/dbraw/zinc/65/06/48/408650648.db2.gz	YKVWBMOXBAESOJ-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000192792459	408650653	/nfs/dbraw/zinc/65/06/53/408650653.db2.gz	YKVWBMOXBAESOJ-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000192792459	408650656	/nfs/dbraw/zinc/65/06/56/408650656.db2.gz	YKVWBMOXBAESOJ-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421815	408699567	/nfs/dbraw/zinc/69/95/67/408699567.db2.gz	HBCPHFKSCWTAIW-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421815	408699571	/nfs/dbraw/zinc/69/95/71/408699571.db2.gz	HBCPHFKSCWTAIW-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)C[N@@H+](C)C(C)C)n1	ZINC000290807509	408836694	/nfs/dbraw/zinc/83/66/94/408836694.db2.gz	ZGKWMCHXTPVKBW-SNVBAGLBSA-N	1	1	310.354	1.917	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2cc(Br)cc([N+](=O)[O-])c2=O)C1	ZINC000191193520	163176145	/nfs/dbraw/zinc/17/61/45/163176145.db2.gz	PKSCBKDNUOYIBF-MRVPVSSYSA-N	1	1	316.155	1.471	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000291983553	408956616	/nfs/dbraw/zinc/95/66/16/408956616.db2.gz	TZXKCFJVOHCXCO-SECBINFHSA-N	1	1	312.345	1.775	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286319419	408963028	/nfs/dbraw/zinc/96/30/28/408963028.db2.gz	KVCZYQYXKRHEBW-NSHDSACASA-N	1	1	306.366	1.485	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@H]1O	ZINC000286338824	408966691	/nfs/dbraw/zinc/96/66/91/408966691.db2.gz	FAMUJIGAQJNBMP-OUCADQQQSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292078769	408975894	/nfs/dbraw/zinc/97/58/94/408975894.db2.gz	FLJCKMZLTQYALI-CVEARBPZSA-N	1	1	305.378	1.656	20	5		DDBDMO
COC(=O)C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C	ZINC000283322316	409137071	/nfs/dbraw/zinc/13/70/71/409137071.db2.gz	OTIZWCWPMYEAKL-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
COC(=O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C	ZINC000283322316	409137072	/nfs/dbraw/zinc/13/70/72/409137072.db2.gz	OTIZWCWPMYEAKL-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
Nc1c(C(=O)NCC[N@@H+]2CC=CCC2)cc(F)cc1[N+](=O)[O-]	ZINC000280284461	409285057	/nfs/dbraw/zinc/28/50/57/409285057.db2.gz	QPSMPYUETTWAFS-UHFFFAOYSA-N	1	1	308.313	1.308	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337175	409294807	/nfs/dbraw/zinc/29/48/07/409294807.db2.gz	HNWBZZUDHJAJQV-MAZHCROVSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337175	409294810	/nfs/dbraw/zinc/29/48/10/409294810.db2.gz	HNWBZZUDHJAJQV-MAZHCROVSA-N	1	1	322.361	1.508	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CCC[N@@H+](CCCO)C2)cc([N+](=O)[O-])c1	ZINC000295513627	409324431	/nfs/dbraw/zinc/32/44/31/409324431.db2.gz	QBCJWILVTCOWCH-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000290448217	409406249	/nfs/dbraw/zinc/40/62/49/409406249.db2.gz	CWCJKQDCJIMTLG-QWRGUYRKSA-N	1	1	305.338	1.127	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@](C)(C(N)=O)C2)c([N+](=O)[O-])cc1F	ZINC000280742451	409434678	/nfs/dbraw/zinc/43/46/78/409434678.db2.gz	MNIBEGQIPAMNMA-AWEZNQCLSA-N	1	1	311.313	1.440	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CC(C)(C)CO	ZINC000295362280	409451022	/nfs/dbraw/zinc/45/10/22/409451022.db2.gz	ZGJZPXIDPGWCJG-LLVKDONJSA-N	1	1	309.366	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC(C)(C)CO	ZINC000295362280	409451026	/nfs/dbraw/zinc/45/10/26/409451026.db2.gz	ZGJZPXIDPGWCJG-LLVKDONJSA-N	1	1	309.366	1.872	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)cc1[N+](=O)[O-]	ZINC000295405316	409467629	/nfs/dbraw/zinc/46/76/29/409467629.db2.gz	IXZOTRPIHRPHHK-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C(C)C)C1	ZINC000408356037	164305944	/nfs/dbraw/zinc/30/59/44/164305944.db2.gz	CILDJYWDWGQISW-AWEZNQCLSA-N	1	1	306.366	1.710	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000304323874	409605448	/nfs/dbraw/zinc/60/54/48/409605448.db2.gz	MRDVLYVDTHDXKE-CQSZACIVSA-N	1	1	320.349	1.293	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000338795230	410037494	/nfs/dbraw/zinc/03/74/94/410037494.db2.gz	OMAQOXAJINQAAC-PHIMTYICSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000338795230	410037500	/nfs/dbraw/zinc/03/75/00/410037500.db2.gz	OMAQOXAJINQAAC-PHIMTYICSA-N	1	1	322.365	1.614	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000298476007	410246387	/nfs/dbraw/zinc/24/63/87/410246387.db2.gz	DHVZYKURDPKTGB-OLZOCXBDSA-N	1	1	319.361	1.717	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H](C)CO	ZINC000339634915	410348278	/nfs/dbraw/zinc/34/82/78/410348278.db2.gz	KMURYAOGYULMAF-LLVKDONJSA-N	1	1	309.366	1.935	20	5		DDBDMO
CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347004970	410306496	/nfs/dbraw/zinc/30/64/96/410306496.db2.gz	KQGMVLTXUCCYCW-CQSZACIVSA-N	1	1	319.361	1.669	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@](O)(C(F)(F)F)C2)n1	ZINC000357899986	410318931	/nfs/dbraw/zinc/31/89/31/410318931.db2.gz	AGSKNLXETVWYNQ-JTQLQIEISA-N	1	1	308.260	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@](O)(C(F)(F)F)C2)n1	ZINC000357899986	410318938	/nfs/dbraw/zinc/31/89/38/410318938.db2.gz	AGSKNLXETVWYNQ-JTQLQIEISA-N	1	1	308.260	1.181	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000194487567	306728866	/nfs/dbraw/zinc/72/88/66/306728866.db2.gz	OITQCLOJNUXIKS-UHFFFAOYSA-N	1	1	322.365	1.068	20	5		DDBDMO
CC(C)(CS(C)(=O)=O)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000358295152	410440808	/nfs/dbraw/zinc/44/08/08/410440808.db2.gz	IBBKCGAXNUTTBL-UHFFFAOYSA-N	1	1	304.343	1.647	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337310864	410707936	/nfs/dbraw/zinc/70/79/36/410707936.db2.gz	BOQVATCONKFUIF-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000337310864	410707946	/nfs/dbraw/zinc/70/79/46/410707946.db2.gz	BOQVATCONKFUIF-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000337310864	410707952	/nfs/dbraw/zinc/70/79/52/410707952.db2.gz	BOQVATCONKFUIF-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000337310869	410709278	/nfs/dbraw/zinc/70/92/78/410709278.db2.gz	BOZAOEYZSONRPI-ZOWXZIJZSA-N	1	1	319.361	1.626	20	5		DDBDMO
CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000355875729	410712752	/nfs/dbraw/zinc/71/27/52/410712752.db2.gz	CVXUDNPZHOULKZ-LLVKDONJSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)C1(S(C)(=O)=O)CC1	ZINC000353041030	410751921	/nfs/dbraw/zinc/75/19/21/410751921.db2.gz	XCTKAFPBROQOCD-SECBINFHSA-N	1	1	316.354	1.789	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1(CCO)CCOCC1	ZINC000353052001	410759977	/nfs/dbraw/zinc/75/99/77/410759977.db2.gz	XLSODSACPPDQGE-UHFFFAOYSA-N	1	1	324.377	1.837	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c4cnccc43)C[C@H]21	ZINC000301682873	410769304	/nfs/dbraw/zinc/76/93/04/410769304.db2.gz	VUKRLOGMFPPUQF-HZPDHXFCSA-N	1	1	314.345	1.662	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000343888470	410782405	/nfs/dbraw/zinc/78/24/05/410782405.db2.gz	XHMUSFURKHDQQD-OAHLLOKOSA-N	1	1	308.334	1.483	20	5		DDBDMO
CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1C[NH+]2CCC1CC2	ZINC000356103781	410835885	/nfs/dbraw/zinc/83/58/85/410835885.db2.gz	VKLUAJXMHOFYOI-AWEZNQCLSA-N	1	1	305.334	1.467	20	5		DDBDMO
CCOC(=O)c1cc(C(=O)NCC[NH+]2CCC2)cc([N+](=O)[O-])c1	ZINC000337580363	410874699	/nfs/dbraw/zinc/87/46/99/410874699.db2.gz	IKFPQJVUODOKLY-UHFFFAOYSA-N	1	1	321.333	1.207	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000341149663	410898107	/nfs/dbraw/zinc/89/81/07/410898107.db2.gz	UIZGBRUZJXSNFZ-NSHDSACASA-N	1	1	306.370	2.170	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cnc3N)C2)C1	ZINC000356279247	410941383	/nfs/dbraw/zinc/94/13/83/410941383.db2.gz	LJWPDHMAVAXMJQ-HNNXBMFYSA-N	1	1	319.365	1.130	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000341841961	411070616	/nfs/dbraw/zinc/07/06/16/411070616.db2.gz	KOBXYTPCJJNQJE-SNVBAGLBSA-N	1	1	308.338	1.591	20	5		DDBDMO
C[C@H](CCO)[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353517113	411041914	/nfs/dbraw/zinc/04/19/14/411041914.db2.gz	HWKBFRDCOHXWKP-RISCZKNCSA-N	1	1	304.350	1.778	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000419350877	226127504	/nfs/dbraw/zinc/12/75/04/226127504.db2.gz	ZYWFAGMMRKAWIR-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296695821	226133289	/nfs/dbraw/zinc/13/32/89/226133289.db2.gz	METGVWBEINTYQI-CZUORRHYSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000366737329	418510922	/nfs/dbraw/zinc/51/09/22/418510922.db2.gz	GRXHWOBFYZVVGM-ZDUSSCGKSA-N	1	1	309.322	1.348	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COC[C@@H]1CCCO1	ZINC000192707556	418526433	/nfs/dbraw/zinc/52/64/33/418526433.db2.gz	XLFIXPBKJDHMEO-GJZGRUSLSA-N	1	1	324.377	1.583	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC[NH+]1CCCC1	ZINC000193203246	418529833	/nfs/dbraw/zinc/52/98/33/418529833.db2.gz	TYSBTDHRYCDBFN-UHFFFAOYSA-N	1	1	313.379	1.277	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)n1	ZINC000191840280	222110380	/nfs/dbraw/zinc/11/03/80/222110380.db2.gz	YTMOVQFBUWUNFR-VHSXEESVSA-N	1	1	307.354	1.166	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)C[C@H]21	ZINC000375050719	418596063	/nfs/dbraw/zinc/59/60/63/418596063.db2.gz	SFDVBJDHPQAUOU-BXKDBHETSA-N	1	1	303.322	1.661	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000375053876	418596439	/nfs/dbraw/zinc/59/64/39/418596439.db2.gz	IJANSJJBAVLURK-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000361421329	418649847	/nfs/dbraw/zinc/64/98/47/418649847.db2.gz	SUFWQXWIYCYCME-AWEZNQCLSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000361421329	418649848	/nfs/dbraw/zinc/64/98/48/418649848.db2.gz	SUFWQXWIYCYCME-AWEZNQCLSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)C1	ZINC000367774499	418632027	/nfs/dbraw/zinc/63/20/27/418632027.db2.gz	WMDLOSUEGQLINP-OAHLLOKOSA-N	1	1	319.361	1.513	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)C1	ZINC000367774499	418632031	/nfs/dbraw/zinc/63/20/31/418632031.db2.gz	WMDLOSUEGQLINP-OAHLLOKOSA-N	1	1	319.361	1.513	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2C(=O)NC[C@@H]2C1	ZINC000368232015	418707438	/nfs/dbraw/zinc/70/74/38/418707438.db2.gz	YVSRPARRAMNZRF-DGCLKSJQSA-N	1	1	305.334	1.171	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](CC(N)=O)C2)c([N+](=O)[O-])cc1F	ZINC000367988160	418670118	/nfs/dbraw/zinc/67/01/18/418670118.db2.gz	JAJTUWBXYRKKAY-SECBINFHSA-N	1	1	311.313	1.440	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCOC1	ZINC000361593778	418688735	/nfs/dbraw/zinc/68/87/35/418688735.db2.gz	HMPDOPPHTOYDCD-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCOC1	ZINC000361593778	418688739	/nfs/dbraw/zinc/68/87/39/418688739.db2.gz	HMPDOPPHTOYDCD-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000411607713	419360911	/nfs/dbraw/zinc/36/09/11/419360911.db2.gz	DFUYVQOBKFOFGS-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1c(CC(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000425060763	228358161	/nfs/dbraw/zinc/35/81/61/228358161.db2.gz	WYZMMWLINSZZMZ-GOEBONIOSA-N	1	1	317.389	1.998	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000425919072	419367317	/nfs/dbraw/zinc/36/73/17/419367317.db2.gz	ATZCXMNOHBSQQA-HNNXBMFYSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421002734	419439758	/nfs/dbraw/zinc/43/97/58/419439758.db2.gz	MOXRGLXWLLBSRP-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079253	419627524	/nfs/dbraw/zinc/62/75/24/419627524.db2.gz	LCOYBTLIODQPGN-CHWSQXEVSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079253	419627527	/nfs/dbraw/zinc/62/75/27/419627527.db2.gz	LCOYBTLIODQPGN-CHWSQXEVSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC(C)[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC(=O)N1	ZINC000412092235	419649290	/nfs/dbraw/zinc/64/92/90/419649290.db2.gz	VQULFMLJZZQHSR-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000299624862	229275442	/nfs/dbraw/zinc/27/54/42/229275442.db2.gz	KTIPTRZZRFAWCR-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
CC(C)[C@@H]([NH3+])CN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268592	419999299	/nfs/dbraw/zinc/99/92/99/419999299.db2.gz	GPSPLAYWGIKICB-RISCZKNCSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@@H](N)C[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268592	419999302	/nfs/dbraw/zinc/99/93/02/419999302.db2.gz	GPSPLAYWGIKICB-RISCZKNCSA-N	1	1	308.382	1.885	20	5		DDBDMO
C[C@@H]1CCN[C@@H](C)[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420378155	420249480	/nfs/dbraw/zinc/24/94/80/420249480.db2.gz	WXEKLIDPMMSVTP-WQGACYEGSA-N	1	1	320.393	1.900	20	5		DDBDMO
CNC(=O)c1ccc(N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000425277976	420337447	/nfs/dbraw/zinc/33/74/47/420337447.db2.gz	DDFLUPFOSPZXNS-SWLSCSKDSA-N	1	1	318.377	1.485	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Nc2sccc2[N+](=O)[O-])CC1	ZINC000302050141	230064568	/nfs/dbraw/zinc/06/45/68/230064568.db2.gz	ZWXHNDLYTQGMLF-UHFFFAOYSA-N	1	1	312.395	1.621	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CCC[N@@H+](CCCO)C2)n1	ZINC000450614361	420499601	/nfs/dbraw/zinc/49/96/01/420499601.db2.gz	MZHZANWMBJKGJT-ZDUSSCGKSA-N	1	1	308.382	1.865	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](CC[NH3+])C1	ZINC000443065899	420741616	/nfs/dbraw/zinc/74/16/16/420741616.db2.gz	CRPMLZFNSRDGPR-STQMWFEESA-N	1	1	320.393	1.983	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](CO)[C@@H]3CCCO3)nc2c1	ZINC000447902562	420813080	/nfs/dbraw/zinc/81/30/80/420813080.db2.gz	FKGKRJNAFDZGLW-NEPJUHHUSA-N	1	1	307.306	1.366	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455657475	421050481	/nfs/dbraw/zinc/05/04/81/421050481.db2.gz	MFEZJUZEXLUVAZ-WDEREUQCSA-N	1	1	319.365	1.340	20	5		DDBDMO
O=C1OCC[C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000494132453	420996997	/nfs/dbraw/zinc/99/69/97/420996997.db2.gz	JAWKBAMGGVDGOQ-CQSZACIVSA-N	1	1	305.334	1.664	20	5		DDBDMO
O=C1OCC[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000494132453	420996998	/nfs/dbraw/zinc/99/69/98/420996998.db2.gz	JAWKBAMGGVDGOQ-CQSZACIVSA-N	1	1	305.334	1.664	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000488357852	421084778	/nfs/dbraw/zinc/08/47/78/421084778.db2.gz	QFCSTNSJFLIXKU-SWLSCSKDSA-N	1	1	305.378	1.793	20	5		DDBDMO
C[C@H](O)CC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450574386	421211669	/nfs/dbraw/zinc/21/16/69/421211669.db2.gz	ZUAGWTORMXWLOG-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000525620061	421293285	/nfs/dbraw/zinc/29/32/85/421293285.db2.gz	ZESTYBXVEDMQJH-UWVGGRQHSA-N	1	1	321.333	1.536	20	5		DDBDMO
COc1c(C(=O)NC[C@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000527245580	421370322	/nfs/dbraw/zinc/37/03/22/421370322.db2.gz	VHMZTUXBQIELQR-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000562927003	421426381	/nfs/dbraw/zinc/42/63/81/421426381.db2.gz	ZRVNHMVCPJJIDQ-NSHDSACASA-N	1	1	306.366	1.836	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2ccc([N+](=O)[O-])cn2)[nH+]c1	ZINC000531887323	421646173	/nfs/dbraw/zinc/64/61/73/421646173.db2.gz	GQQAQNVBRZEUIT-UHFFFAOYSA-N	1	1	315.333	1.925	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000543767968	421841325	/nfs/dbraw/zinc/84/13/25/421841325.db2.gz	ZGTHCZNQFDSXHT-LLVKDONJSA-N	1	1	307.354	1.264	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000573742131	422009507	/nfs/dbraw/zinc/00/95/07/422009507.db2.gz	UWVLAKBGDLPPAD-LBPRGKRZSA-N	1	1	319.361	1.658	20	5		DDBDMO
Nc1nccc(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000594345124	422346563	/nfs/dbraw/zinc/34/65/63/422346563.db2.gz	UEENKVZFCYAHFT-NSHDSACASA-N	1	1	319.365	1.319	20	5		DDBDMO
Nc1nc(NC[C@@H]2CC[N@H+]2C2CCCCC2)ncc1[N+](=O)[O-]	ZINC000599125864	422402829	/nfs/dbraw/zinc/40/28/29/422402829.db2.gz	DTECERYJSHIECY-NSHDSACASA-N	1	1	306.370	1.208	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)NCc1cccnc1)c1ccccc1[N+](=O)[O-]	ZINC000342295899	271369465	/nfs/dbraw/zinc/36/94/65/271369465.db2.gz	PXXWSAIEGOYTDS-LBPRGKRZSA-N	1	1	314.345	1.957	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)NCc1cccnc1)c1ccccc1[N+](=O)[O-]	ZINC000342295897	271369519	/nfs/dbraw/zinc/36/95/19/271369519.db2.gz	PXXWSAIEGOYTDS-GFCCVEGCSA-N	1	1	314.345	1.957	20	5		DDBDMO
CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000343807243	271876581	/nfs/dbraw/zinc/87/65/81/271876581.db2.gz	TURNZJDZRXJHQL-RYUDHWBXSA-N	1	1	323.397	1.948	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2C[NH+]2CCOCC2)cn1	ZINC000344436219	272026558	/nfs/dbraw/zinc/02/65/58/272026558.db2.gz	PVGUOFNMVRWIPJ-CQSZACIVSA-N	1	1	306.366	1.681	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000344645343	272078778	/nfs/dbraw/zinc/07/87/78/272078778.db2.gz	PDSUXDYYEZGEBC-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CC[N@@H+]4CCOC[C@@H]4C3)ccnc21	ZINC000432178214	275039569	/nfs/dbraw/zinc/03/95/69/275039569.db2.gz	SSEJJHRUJLPYCK-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CC[N@H+]4CCOC[C@@H]4C3)ccnc21	ZINC000432178214	275039570	/nfs/dbraw/zinc/03/95/70/275039570.db2.gz	SSEJJHRUJLPYCK-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@@H](C[NH+]3CCOCC3)C2)c(F)c1	ZINC000413278660	275040930	/nfs/dbraw/zinc/04/09/30/275040930.db2.gz	FLQSYRSKHYEFIQ-LBPRGKRZSA-N	1	1	324.356	1.678	20	5		DDBDMO
C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1	ZINC000119558354	281102689	/nfs/dbraw/zinc/10/26/89/281102689.db2.gz	UUMRCYXIVLQSPA-UHFFFAOYSA-N	1	1	300.318	1.531	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000358061664	299061581	/nfs/dbraw/zinc/06/15/81/299061581.db2.gz	HAKURBFZOLYZTI-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C[C@@H]21	ZINC000362290457	300044981	/nfs/dbraw/zinc/04/49/81/300044981.db2.gz	RVCCBSIBDURWLK-GWCFXTLKSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)C[C@H]2C1	ZINC000362663732	300113103	/nfs/dbraw/zinc/11/31/03/300113103.db2.gz	LTNMMIIVEMAHKZ-TXEJJXNPSA-N	1	1	315.333	1.643	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000362910235	300176353	/nfs/dbraw/zinc/17/63/53/300176353.db2.gz	HDKMYYSTTYICNP-ZDUSSCGKSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)C1	ZINC000362940574	300183483	/nfs/dbraw/zinc/18/34/83/300183483.db2.gz	GMQFHPVMTOFILI-KRWDZBQOSA-N	1	1	318.421	1.807	20	5		DDBDMO
Cn1cc(C[C@@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000363352643	300256064	/nfs/dbraw/zinc/25/60/64/300256064.db2.gz	NHXLFWGFSAYPRF-LBPRGKRZSA-N	1	1	304.354	1.089	20	5		DDBDMO
COC(=O)CN1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000363892115	300321775	/nfs/dbraw/zinc/32/17/75/300321775.db2.gz	WJOKHMGMGCLJEA-UHFFFAOYSA-N	1	1	321.377	1.584	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367994109	300928789	/nfs/dbraw/zinc/92/87/89/300928789.db2.gz	POBLPBXNZIBATG-ZYOFXKKJSA-N	1	1	311.288	1.674	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412264	301022191	/nfs/dbraw/zinc/02/21/91/301022191.db2.gz	RMJWPXATFKIWBM-RISCZKNCSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412264	301022192	/nfs/dbraw/zinc/02/21/92/301022192.db2.gz	RMJWPXATFKIWBM-RISCZKNCSA-N	1	1	319.361	1.687	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C[C@H]21	ZINC000368596590	301061355	/nfs/dbraw/zinc/06/13/55/301061355.db2.gz	VMBVMCJIFIDKHT-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CC[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369685059	301212569	/nfs/dbraw/zinc/21/25/69/301212569.db2.gz	ZJRIUZJZJFHHPP-CYBMUJFWSA-N	1	1	307.398	1.913	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369685059	301212571	/nfs/dbraw/zinc/21/25/71/301212571.db2.gz	ZJRIUZJZJFHHPP-CYBMUJFWSA-N	1	1	307.398	1.913	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369685059	301212573	/nfs/dbraw/zinc/21/25/73/301212573.db2.gz	ZJRIUZJZJFHHPP-CYBMUJFWSA-N	1	1	307.398	1.913	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[N@@H+](C)[C@H]2C1	ZINC000370445625	301340698	/nfs/dbraw/zinc/34/06/98/301340698.db2.gz	WHMUTWSFPFXMPS-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@H+](C)CC2(C)C)cc1[N+](=O)[O-]	ZINC000534306901	303330804	/nfs/dbraw/zinc/33/08/04/303330804.db2.gz	JFLGHJCHMBJNNQ-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)CC2(C)C)cc1[N+](=O)[O-]	ZINC000534306901	303330805	/nfs/dbraw/zinc/33/08/05/303330805.db2.gz	JFLGHJCHMBJNNQ-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CN1CCC[C@@H]([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000538712080	303389899	/nfs/dbraw/zinc/38/98/99/303389899.db2.gz	PLRAFLFAFQYICM-WCQYABFASA-N	1	1	319.365	1.097	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000366325106	307070937	/nfs/dbraw/zinc/07/09/37/307070937.db2.gz	JEPKZPDASJPCHW-GHMZBOCLSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000366325106	307070938	/nfs/dbraw/zinc/07/09/38/307070938.db2.gz	JEPKZPDASJPCHW-GHMZBOCLSA-N	1	1	323.736	1.343	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@@H]2C1	ZINC000367253620	307089748	/nfs/dbraw/zinc/08/97/48/307089748.db2.gz	SQYSIDXJDYWSPB-LKFCYVNXSA-N	1	1	322.340	1.482	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](O)C2(CC2)C1	ZINC000368793733	307109838	/nfs/dbraw/zinc/10/98/38/307109838.db2.gz	ZJROLWVVGQXEAM-AWEZNQCLSA-N	1	1	319.361	1.689	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1	ZINC000370997933	307140173	/nfs/dbraw/zinc/14/01/73/307140173.db2.gz	KLUGQRORYKFZAE-XFDYKOMQSA-N	1	1	306.362	1.721	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373938066	307198238	/nfs/dbraw/zinc/19/82/38/307198238.db2.gz	MJVAOBUTAYURIQ-VXGBXAGGSA-N	1	1	304.350	1.655	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279337	307204987	/nfs/dbraw/zinc/20/49/87/307204987.db2.gz	VGJHKYJTWGZXBS-YQQAZPJKSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000374279337	307204988	/nfs/dbraw/zinc/20/49/88/307204988.db2.gz	VGJHKYJTWGZXBS-YQQAZPJKSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279337	307204989	/nfs/dbraw/zinc/20/49/89/307204989.db2.gz	VGJHKYJTWGZXBS-YQQAZPJKSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CC[C@@H](F)C1	ZINC000451197873	534325684	/nfs/dbraw/zinc/32/56/84/534325684.db2.gz	ONRDZYRVKPIYJQ-SNVBAGLBSA-N	1	1	309.297	1.937	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](F)C1	ZINC000451197873	534325687	/nfs/dbraw/zinc/32/56/87/534325687.db2.gz	ONRDZYRVKPIYJQ-SNVBAGLBSA-N	1	1	309.297	1.937	20	5		DDBDMO
CCO[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C	ZINC000451522230	527763198	/nfs/dbraw/zinc/76/31/98/527763198.db2.gz	AWNKHJSKUMDDHU-TZMCWYRMSA-N	1	1	309.366	1.503	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000123295192	696730557	/nfs/dbraw/zinc/73/05/57/696730557.db2.gz	FGBNBTDOZCQMPJ-UHFFFAOYSA-N	1	1	315.377	1.957	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000108298495	696633473	/nfs/dbraw/zinc/63/34/73/696633473.db2.gz	NDQRTCFYLXDGDM-LBPRGKRZSA-N	1	1	307.325	1.948	20	5		DDBDMO
COCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000980573656	696802999	/nfs/dbraw/zinc/80/29/99/696802999.db2.gz	KAFMDEOADDKVCT-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000980573656	696803000	/nfs/dbraw/zinc/80/30/00/696803000.db2.gz	KAFMDEOADDKVCT-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000195157982	697732580	/nfs/dbraw/zinc/73/25/80/697732580.db2.gz	CDONLMAPKWWTGA-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
Cc1[nH+]ccn1-c1ncccc1CNc1c([N+](=O)[O-])ncn1C	ZINC000774535603	697891321	/nfs/dbraw/zinc/89/13/21/697891321.db2.gz	ARIAEZCBZJHOID-UHFFFAOYSA-N	1	1	313.321	1.830	20	5		DDBDMO
C[N@@H+](CCCn1ccnc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776600682	698126037	/nfs/dbraw/zinc/12/60/37/698126037.db2.gz	DNVQNBLFLNBELW-HNNXBMFYSA-N	1	1	304.350	1.847	20	5		DDBDMO
Cc1nn(CN2CC[NH+](Cc3ccsc3)CC2)cc1[N+](=O)[O-]	ZINC000779858759	698476542	/nfs/dbraw/zinc/47/65/42/698476542.db2.gz	AGMQFRAGBXWFIF-UHFFFAOYSA-N	1	1	321.406	1.937	20	5		DDBDMO
O=C1NCC2(CC[NH+](Cc3c(F)cccc3[N+](=O)[O-])CC2)O1	ZINC000782004910	698672426	/nfs/dbraw/zinc/67/24/26/698672426.db2.gz	SJDPLJMVXIPFMU-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCNC(=O)C1	ZINC000726792078	699380675	/nfs/dbraw/zinc/38/06/75/699380675.db2.gz	KDRGINFYTVIMEE-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCNC(=O)C1	ZINC000726792078	699380677	/nfs/dbraw/zinc/38/06/77/699380677.db2.gz	KDRGINFYTVIMEE-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)C1	ZINC000729529338	699481841	/nfs/dbraw/zinc/48/18/41/699481841.db2.gz	RNYHHSVENKTLKV-NSHDSACASA-N	1	1	315.333	1.875	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000796081341	699911131	/nfs/dbraw/zinc/91/11/31/699911131.db2.gz	TUNPYINNYUAFOV-CVEARBPZSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@]3(CCCOC3)C2)cc1	ZINC000796081341	699911132	/nfs/dbraw/zinc/91/11/32/699911132.db2.gz	TUNPYINNYUAFOV-CVEARBPZSA-N	1	1	322.361	1.510	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@@H+]1C	ZINC000763222886	700929583	/nfs/dbraw/zinc/92/95/83/700929583.db2.gz	DKLMVWOVASLBQK-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C	ZINC000763222886	700929584	/nfs/dbraw/zinc/92/95/84/700929584.db2.gz	DKLMVWOVASLBQK-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000763876570	700951603	/nfs/dbraw/zinc/95/16/03/700951603.db2.gz	UYGFDXFLXQIWBJ-HUUCEWRRSA-N	1	1	312.366	1.346	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000808228582	701509509	/nfs/dbraw/zinc/50/95/09/701509509.db2.gz	VAHXTMRUEOABJW-JTQLQIEISA-N	1	1	303.322	1.099	20	5		DDBDMO
CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839729426	701800866	/nfs/dbraw/zinc/80/08/66/701800866.db2.gz	XWHYBZIWTHZGEZ-OWCLPIDISA-N	1	1	319.405	1.924	20	5		DDBDMO
CC(C)[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839729426	701800871	/nfs/dbraw/zinc/80/08/71/701800871.db2.gz	XWHYBZIWTHZGEZ-OWCLPIDISA-N	1	1	319.405	1.924	20	5		DDBDMO
CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839729426	701800877	/nfs/dbraw/zinc/80/08/77/701800877.db2.gz	XWHYBZIWTHZGEZ-OWCLPIDISA-N	1	1	319.405	1.924	20	5		DDBDMO
COCCN(CCF)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867984819	701874308	/nfs/dbraw/zinc/87/43/08/701874308.db2.gz	PFZPUQNYNCISPF-AWEZNQCLSA-N	1	1	313.329	1.213	20	5		DDBDMO
C[C@H]1CCC[N@@H+]1CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014218	701912400	/nfs/dbraw/zinc/91/24/00/701912400.db2.gz	IQELVJPGDKOIAB-NHYWBVRUSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014218	701912401	/nfs/dbraw/zinc/91/24/01/701912401.db2.gz	IQELVJPGDKOIAB-NHYWBVRUSA-N	1	1	305.334	1.974	20	5		DDBDMO
CCOCC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000813172515	702308403	/nfs/dbraw/zinc/30/84/03/702308403.db2.gz	JDFQXEQWAKVLII-AWEZNQCLSA-N	1	1	308.334	1.749	20	5		DDBDMO
CCOCC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000813172515	702308409	/nfs/dbraw/zinc/30/84/09/702308409.db2.gz	JDFQXEQWAKVLII-AWEZNQCLSA-N	1	1	308.334	1.749	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1	ZINC000818986351	704043882	/nfs/dbraw/zinc/04/38/82/704043882.db2.gz	MDRQUWGJTPBOFQ-BZUAXINKSA-N	1	1	321.377	1.081	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000818986351	704043885	/nfs/dbraw/zinc/04/38/85/704043885.db2.gz	MDRQUWGJTPBOFQ-BZUAXINKSA-N	1	1	321.377	1.081	20	5		DDBDMO
CCN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000855360254	704480615	/nfs/dbraw/zinc/48/06/15/704480615.db2.gz	DFCZGCNYHHGSFU-ZIAGYGMSSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000824714705	705513117	/nfs/dbraw/zinc/51/31/17/705513117.db2.gz	FCZBSDQLHNOESJ-CQSZACIVSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1ccc(CNC(=O)[C@@H](C)[NH+]2CCSCC2)cc1[N+](=O)[O-]	ZINC000825648113	705708486	/nfs/dbraw/zinc/70/84/86/705708486.db2.gz	LRODMCOXLBGCFL-GFCCVEGCSA-N	1	1	323.418	1.957	20	5		DDBDMO
Cc1ccc(CNC(=O)CC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000825655937	705709437	/nfs/dbraw/zinc/70/94/37/705709437.db2.gz	YFKOTPNHNJRXMD-UHFFFAOYSA-N	1	1	307.350	1.242	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC[C@@H]21	ZINC000827234540	705957339	/nfs/dbraw/zinc/95/73/39/705957339.db2.gz	YIUJSOWODZCCQP-JSGCOSHPSA-N	1	1	321.352	1.829	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000877786303	706211531	/nfs/dbraw/zinc/21/15/31/706211531.db2.gz	DLJLQSPMJUJCBN-UHFFFAOYSA-N	1	1	323.349	1.493	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(N[C@@H]2CCc3c[nH+]cn3C2)cc1F	ZINC000865793944	706528471	/nfs/dbraw/zinc/52/84/71/706528471.db2.gz	GAGJDHMINCSBEX-SNVBAGLBSA-N	1	1	306.297	1.850	20	5		DDBDMO
NC(=O)[C@H](F)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000879040181	706569795	/nfs/dbraw/zinc/56/97/95/706569795.db2.gz	AXQBILLXDBJNAM-CYBMUJFWSA-N	1	1	313.304	1.769	20	5		DDBDMO
COC(=O)N(C)CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865944651	706572876	/nfs/dbraw/zinc/57/28/76/706572876.db2.gz	FHDREFHKZTWGKU-UHFFFAOYSA-N	1	1	304.306	1.675	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCN2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)cc1	ZINC000880069691	706869769	/nfs/dbraw/zinc/86/97/69/706869769.db2.gz	UJPUGFWKCZMJDK-LSDHHAIUSA-N	1	1	321.377	1.115	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000880146547	706892227	/nfs/dbraw/zinc/89/22/27/706892227.db2.gz	UOIKTJDBTOGWEX-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000880146547	706892229	/nfs/dbraw/zinc/89/22/29/706892229.db2.gz	UOIKTJDBTOGWEX-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCN1c1cc[nH+]cc1	ZINC000880263335	706925275	/nfs/dbraw/zinc/92/52/75/706925275.db2.gz	WUZOKPGCOBETAL-ZDUSSCGKSA-N	1	1	316.365	1.397	20	5		DDBDMO
C[C@@H]1c2sccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000880377834	706956460	/nfs/dbraw/zinc/95/64/60/706956460.db2.gz	GMMNFRWPBVZAQK-ZWNOBZJWSA-N	1	1	322.390	1.833	20	5		DDBDMO
C[C@@H](NC[C@H]1CCC[N@@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851561	707138718	/nfs/dbraw/zinc/13/87/18/707138718.db2.gz	ZNSKQJCHWGVXDI-TZMCWYRMSA-N	1	1	322.409	1.674	20	5		DDBDMO
C[C@@H](NC[C@H]1CCC[N@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851561	707138720	/nfs/dbraw/zinc/13/87/20/707138720.db2.gz	ZNSKQJCHWGVXDI-TZMCWYRMSA-N	1	1	322.409	1.674	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)Cn2cc(C[NH+]3CCCC3)nn2)c1	ZINC000881410574	707243751	/nfs/dbraw/zinc/24/37/51/707243751.db2.gz	GCLWGUPWKAEXHO-HNNXBMFYSA-N	1	1	317.349	1.516	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000837414257	707640881	/nfs/dbraw/zinc/64/08/81/707640881.db2.gz	RYZCAMDXZOZNTQ-LBPRGKRZSA-N	1	1	310.354	1.597	20	5		DDBDMO
Cc1c(C[NH2+]CCCN2CCC(O)CC2)cccc1[N+](=O)[O-]	ZINC000873022740	707697775	/nfs/dbraw/zinc/69/77/75/707697775.db2.gz	XZRJNJGDRHNTLB-UHFFFAOYSA-N	1	1	307.394	1.840	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000896912163	708180487	/nfs/dbraw/zinc/18/04/87/708180487.db2.gz	QCLZIVWBWRPYOS-YGRLFVJLSA-N	1	1	306.322	1.891	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897222771	708260400	/nfs/dbraw/zinc/26/04/00/708260400.db2.gz	XMKVGCYVANMTET-UONOGXRCSA-N	1	1	305.378	1.939	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885972820	708673884	/nfs/dbraw/zinc/67/38/84/708673884.db2.gz	LDRULJXSVLYEKJ-ZDUSSCGKSA-N	1	1	306.366	1.728	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885972820	708673887	/nfs/dbraw/zinc/67/38/87/708673887.db2.gz	LDRULJXSVLYEKJ-ZDUSSCGKSA-N	1	1	306.366	1.728	20	5		DDBDMO
CC(C)(O)C[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCOCC1	ZINC000886036048	708686495	/nfs/dbraw/zinc/68/64/95/708686495.db2.gz	SOWNNFZUDXTQRI-UHFFFAOYSA-N	1	1	309.366	1.742	20	5		DDBDMO
CC1(C)C(=O)N[C@@H]1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886217514	708716975	/nfs/dbraw/zinc/71/69/75/708716975.db2.gz	BCRNCAHOZLJBMU-CYBMUJFWSA-N	1	1	318.377	1.726	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000886589523	708783793	/nfs/dbraw/zinc/78/37/93/708783793.db2.gz	YDTJMYKULRGNMB-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000886589523	708783795	/nfs/dbraw/zinc/78/37/95/708783795.db2.gz	YDTJMYKULRGNMB-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCC3)C2)c1[N+](=O)[O-]	ZINC000912912660	713122176	/nfs/dbraw/zinc/12/21/76/713122176.db2.gz	CNXAHJUEVUKDBU-SNVBAGLBSA-N	1	1	307.354	1.362	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639648	710834252	/nfs/dbraw/zinc/83/42/52/710834252.db2.gz	QQBZDNZCGVXUPG-UONOGXRCSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639648	710834254	/nfs/dbraw/zinc/83/42/54/710834254.db2.gz	QQBZDNZCGVXUPG-UONOGXRCSA-N	1	1	317.349	1.920	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+][C@@H](C)c1cc(OC)cc([N+](=O)[O-])c1	ZINC000903086831	711028157	/nfs/dbraw/zinc/02/81/57/711028157.db2.gz	ANFBQHFTGIIINN-JTQLQIEISA-N	1	1	316.379	1.689	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000928569206	713232299	/nfs/dbraw/zinc/23/22/99/713232299.db2.gz	LGPGDUFKVBASMC-AWEZNQCLSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000928569206	713232301	/nfs/dbraw/zinc/23/23/01/713232301.db2.gz	LGPGDUFKVBASMC-AWEZNQCLSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000913534807	713248318	/nfs/dbraw/zinc/24/83/18/713248318.db2.gz	LGNXYQKJJSJYJF-DTORHVGOSA-N	1	1	308.313	1.235	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000913534807	713248319	/nfs/dbraw/zinc/24/83/19/713248319.db2.gz	LGNXYQKJJSJYJF-DTORHVGOSA-N	1	1	308.313	1.235	20	5		DDBDMO
COc1ccc2ncc([N+](=O)[O-])c(NC[C@@H]3CC[N@H+]3C)c2c1	ZINC000895768125	711600672	/nfs/dbraw/zinc/60/06/72/711600672.db2.gz	WUCDQCWBOVWUCZ-JTQLQIEISA-N	1	1	302.334	1.690	20	5		DDBDMO
O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(C(F)(F)F)cc1	ZINC000905116647	711941402	/nfs/dbraw/zinc/94/14/02/711941402.db2.gz	HYBKRFFXXAYYLM-NSHDSACASA-N	1	1	317.267	1.677	20	5		DDBDMO
O=[N+]([O-])CC[NH2+]Cc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000905286201	711992786	/nfs/dbraw/zinc/99/27/86/711992786.db2.gz	YAJPZEIGVXEBJW-UHFFFAOYSA-N	1	1	301.293	1.168	20	5		DDBDMO
C[C@H](NC(=O)C[C@@]1(O)CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000908512399	712793481	/nfs/dbraw/zinc/79/34/81/712793481.db2.gz	LCRNYMGACGYMND-LRDDRELGSA-N	1	1	321.377	1.619	20	5		DDBDMO
COCCOCCOCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000930099748	713756001	/nfs/dbraw/zinc/75/60/01/713756001.db2.gz	NQDSZMNTGDLRQV-UHFFFAOYSA-N	1	1	324.377	1.633	20	5		DDBDMO
COCCOCCOCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000930099748	713756004	/nfs/dbraw/zinc/75/60/04/713756004.db2.gz	NQDSZMNTGDLRQV-UHFFFAOYSA-N	1	1	324.377	1.633	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000930361980	713813994	/nfs/dbraw/zinc/81/39/94/713813994.db2.gz	AWGXOEAAVUAMEK-UGFHNGPFSA-N	1	1	303.362	1.766	20	5		DDBDMO
COC1(OC)CCOC[C@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1C	ZINC000931669028	714156345	/nfs/dbraw/zinc/15/63/45/714156345.db2.gz	WRJZLLXOZRMCET-CQSZACIVSA-N	1	1	310.350	1.771	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000932072782	714252604	/nfs/dbraw/zinc/25/26/04/714252604.db2.gz	ZJUJYOCVVYEWFS-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
[NH3+]CC[C@@H]1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000923481779	714370149	/nfs/dbraw/zinc/37/01/49/714370149.db2.gz	LOPMASGGSAWMTA-DOMZBBRYSA-N	1	1	318.377	1.371	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000933440021	714589612	/nfs/dbraw/zinc/58/96/12/714589612.db2.gz	XDMBIQLHULEGAH-WCQYABFASA-N	1	1	323.397	1.288	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C2	ZINC000933760088	714666007	/nfs/dbraw/zinc/66/60/07/714666007.db2.gz	OIKGAUTZLHWKBD-NHYWBVRUSA-N	1	1	307.325	1.821	20	5		DDBDMO
CCOc1cc(C[N@@H+](CC)CCC(=O)NC)ccc1[N+](=O)[O-]	ZINC000933863441	714686140	/nfs/dbraw/zinc/68/61/40/714686140.db2.gz	YYONNMFPWIKWHV-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCSC[C@H]1C1CC1	ZINC000933913349	714700670	/nfs/dbraw/zinc/70/06/70/714700670.db2.gz	BJAZEUOXMAKSPM-AWEZNQCLSA-N	1	1	323.418	1.974	20	5		DDBDMO
Cc1ccc(CN2CCN(C)CC[N@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000933993911	714717724	/nfs/dbraw/zinc/71/77/24/714717724.db2.gz	RRQKCMNAAWPFBK-UHFFFAOYSA-N	1	1	306.410	1.582	20	5		DDBDMO
O=C1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCCCCN1	ZINC000934160818	714757568	/nfs/dbraw/zinc/75/75/68/714757568.db2.gz	CHLMFGJDDBXMPT-UHFFFAOYSA-N	1	1	321.377	1.966	20	5		DDBDMO
Cc1c(CN2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)cccc1[N+](=O)[O-]	ZINC000934257978	714777500	/nfs/dbraw/zinc/77/75/00/714777500.db2.gz	KSAIBTGNYBTRMG-DLBZAZTESA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@@H]3[C@@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257978	714777504	/nfs/dbraw/zinc/77/75/04/714777504.db2.gz	KSAIBTGNYBTRMG-DLBZAZTESA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H]3[C@@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257978	714777506	/nfs/dbraw/zinc/77/75/06/714777506.db2.gz	KSAIBTGNYBTRMG-DLBZAZTESA-N	1	1	319.405	1.934	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932526	721853728	/nfs/dbraw/zinc/85/37/28/721853728.db2.gz	YQVAGGKZVBCUMK-CHWSQXEVSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932526	721853729	/nfs/dbraw/zinc/85/37/29/721853729.db2.gz	YQVAGGKZVBCUMK-CHWSQXEVSA-N	1	1	305.382	1.204	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC001167358300	733288706	/nfs/dbraw/zinc/28/87/06/733288706.db2.gz	OAJHRPKEJVTIMC-UHFFFAOYSA-N	1	1	313.239	1.737	20	5		DDBDMO
CC(C)CC[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001121087803	782350972	/nfs/dbraw/zinc/35/09/72/782350972.db2.gz	UVJAINXEUSFUFD-QAALLOGESA-N	1	1	309.410	1.715	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nnc([C@@H](C)[N+](=O)[O-])n2C)[C@@H](C)C1	ZINC001121389460	782487478	/nfs/dbraw/zinc/48/74/78/782487478.db2.gz	SBVMYGZGDPWITD-TUAOUCFPSA-N	1	1	310.402	1.319	20	5		DDBDMO
C[C@@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])S(C)(=O)=O	ZINC000697579786	742099108	/nfs/dbraw/zinc/09/91/08/742099108.db2.gz	NHDGRMSDNGPUQV-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
Cc1cc(C)c(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)c1	ZINC001126932085	742775940	/nfs/dbraw/zinc/77/59/40/742775940.db2.gz	HPNXDAXXAYPIRB-UKRRQHHQSA-N	1	1	305.378	1.483	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(C(=O)c4cc([N+](=O)[O-])c[nH]4)C[C@]2(C1)CCCC3	ZINC001181505456	743215408	/nfs/dbraw/zinc/21/54/08/743215408.db2.gz	ILRHDIZMAWAXRE-IYBDPMFKSA-N	1	1	318.377	1.871	20	5		DDBDMO
CC1(C)CC(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC001002789616	743419793	/nfs/dbraw/zinc/41/97/93/743419793.db2.gz	WBWWFBPNMLWRES-ZIAGYGMSSA-N	1	1	309.410	1.668	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)Nc1cccnn1)c1ccccc1[N+](=O)[O-]	ZINC001197513777	747183157	/nfs/dbraw/zinc/18/31/57/747183157.db2.gz	DGSPKDFILVQTPR-SNVBAGLBSA-N	1	1	301.306	1.674	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169052081	762207191	/nfs/dbraw/zinc/20/71/91/762207191.db2.gz	FXEDJRAZTCIFLJ-ZNMIVQPWSA-N	1	1	324.425	1.702	20	5		DDBDMO
CN1CCOC[C@@H]1CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001169659971	762582803	/nfs/dbraw/zinc/58/28/03/762582803.db2.gz	KVXTXBFHDJJEBC-LBPRGKRZSA-N	1	1	320.393	1.325	20	5		DDBDMO
CN1CCOC[C@@H]1CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001169659971	762582808	/nfs/dbraw/zinc/58/28/08/762582808.db2.gz	KVXTXBFHDJJEBC-LBPRGKRZSA-N	1	1	320.393	1.325	20	5		DDBDMO
CC1(C)CC(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001086363239	761492757	/nfs/dbraw/zinc/49/27/57/761492757.db2.gz	JEBHUHAPTRBUGP-FMKGYKFTSA-N	1	1	309.410	1.572	20	5		DDBDMO
COc1ccc(C[C@@H](C)[NH+]2CC3(CN(C)C3)C2)c([N+](=O)[O-])c1	ZINC001170355465	766261246	/nfs/dbraw/zinc/26/12/46/766261246.db2.gz	GCODTQYAKYWDJP-GFCCVEGCSA-N	1	1	305.378	1.782	20	5		DDBDMO
CC/C=C/CC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001147506995	773155257	/nfs/dbraw/zinc/15/52/57/773155257.db2.gz	JMZLMYJCHMZFPJ-LSMGEYOZSA-N	1	1	307.394	1.542	20	5		DDBDMO
CC/C=C/CC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147506995	773155259	/nfs/dbraw/zinc/15/52/59/773155259.db2.gz	JMZLMYJCHMZFPJ-LSMGEYOZSA-N	1	1	307.394	1.542	20	5		DDBDMO
CC/C=C/CC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147506995	773155261	/nfs/dbraw/zinc/15/52/61/773155261.db2.gz	JMZLMYJCHMZFPJ-LSMGEYOZSA-N	1	1	307.394	1.542	20	5		DDBDMO
CCC[N@H+](C)CC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001148638715	773561559	/nfs/dbraw/zinc/56/15/59/773561559.db2.gz	OLAOURMPFHSYGM-UHFFFAOYSA-N	1	1	314.411	1.204	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001148638715	773561563	/nfs/dbraw/zinc/56/15/63/773561563.db2.gz	OLAOURMPFHSYGM-UHFFFAOYSA-N	1	1	314.411	1.204	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C[N@H+](C)C2CCC2)c1	ZINC001094221680	775544182	/nfs/dbraw/zinc/54/41/82/775544182.db2.gz	MMYYQGNUHRFQHD-UHFFFAOYSA-N	1	1	320.393	1.916	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@H](CO)C2)c1F	ZINC001173188885	777036481	/nfs/dbraw/zinc/03/64/81/777036481.db2.gz	HPOYHAGYPWJTRD-QWRGUYRKSA-N	1	1	312.341	1.988	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(N(C)C2COC2)C1	ZINC001173234974	777065109	/nfs/dbraw/zinc/06/51/09/777065109.db2.gz	VJYMVLKJIJHICO-LBPRGKRZSA-N	1	1	305.378	1.541	20	5		DDBDMO
CC(=O)N(C)CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001102409815	778122153	/nfs/dbraw/zinc/12/21/53/778122153.db2.gz	WZZNSUIQAHSKDL-UHFFFAOYSA-N	1	1	306.366	1.195	20	5		DDBDMO
CCN(CC[NH2+]Cc1cccc(C)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268450022	840210503	/nfs/dbraw/zinc/21/05/03/840210503.db2.gz	MYLBGDVEYCYRMV-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(C)n2)C1	ZINC001148553842	850804567	/nfs/dbraw/zinc/80/45/67/850804567.db2.gz	VYISZYGHLVRCAU-LBPRGKRZSA-N	1	1	306.366	1.712	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001154022540	864332627	/nfs/dbraw/zinc/33/26/27/864332627.db2.gz	LBJNKABUFLTMNJ-SFYZADRCSA-N	1	1	313.745	1.280	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC001160152394	865702489	/nfs/dbraw/zinc/70/24/89/865702489.db2.gz	ASIIMWCMJMYALW-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@H+](C)[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC001160152394	865702494	/nfs/dbraw/zinc/70/24/94/865702494.db2.gz	ASIIMWCMJMYALW-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC001160152394	865702498	/nfs/dbraw/zinc/70/24/98/865702498.db2.gz	ASIIMWCMJMYALW-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])cn3)C[C@H]1[N@H+]2C	ZINC001225634006	881951465	/nfs/dbraw/zinc/95/14/65/881951465.db2.gz	COYOZRZQNGJDMB-FQUUOJAGSA-N	1	1	321.333	1.535	20	5		DDBDMO
COc1ccc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)c([N+](=O)[O-])c1	ZINC001225769323	882020015	/nfs/dbraw/zinc/02/00/15/882020015.db2.gz	JPDPSBNYCIKCPS-UAKXVISKSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1ccc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c([N+](=O)[O-])c1	ZINC001225769323	882020033	/nfs/dbraw/zinc/02/00/33/882020033.db2.gz	JPDPSBNYCIKCPS-UAKXVISKSA-N	1	1	306.318	1.786	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC001336523190	868991933	/nfs/dbraw/zinc/99/19/33/868991933.db2.gz	ZCZYNZZXEVCGGS-LBPRGKRZSA-N	1	1	315.333	1.115	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(F)cc2c1N1CC([NH2+]C2COC2)C1	ZINC001164221164	869030187	/nfs/dbraw/zinc/03/01/87/869030187.db2.gz	VKOQUKRCVCYYEB-UHFFFAOYSA-N	1	1	318.308	1.459	20	5		DDBDMO
O=C(NCCC1(C[NH2+]C/C=C/Cl)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494415	869232208	/nfs/dbraw/zinc/23/22/08/869232208.db2.gz	IZDSWOIGSJHMTO-WXQKJEBPSA-N	1	1	301.774	1.280	20	5		DDBDMO
CC(=O)N(C)C1CN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001166729031	870198931	/nfs/dbraw/zinc/19/89/31/870198931.db2.gz	BSBNMQSJKLWKNO-AATRIKPKSA-N	1	1	319.365	1.189	20	5		DDBDMO
COC(=O)C1([NH3+])CCN(c2ncc([N+](=O)[O-])c(C)c2C)CC1	ZINC001166797279	870261131	/nfs/dbraw/zinc/26/11/31/870261131.db2.gz	KTDZYQOCKQHYCF-UHFFFAOYSA-N	1	1	308.338	1.077	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC001339316052	870442833	/nfs/dbraw/zinc/44/28/33/870442833.db2.gz	GECHUHDHBHXLHO-ZLKJLUDKSA-N	1	1	319.361	1.673	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@H]1C	ZINC001339340144	870452411	/nfs/dbraw/zinc/45/24/11/870452411.db2.gz	MOXKTVBMGJSKGB-AGIUHOORSA-N	1	1	324.429	1.802	20	5		DDBDMO
Cc1cnoc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001317467653	871367479	/nfs/dbraw/zinc/36/74/79/871367479.db2.gz	JDNYLBRODVRFGZ-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
Cc1cnoc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001317467653	871367499	/nfs/dbraw/zinc/36/74/99/871367499.db2.gz	JDNYLBRODVRFGZ-UHFFFAOYSA-N	1	1	318.333	1.753	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](CCO)[C@H](CO)C2)cc1Cl	ZINC001308983842	871544788	/nfs/dbraw/zinc/54/47/88/871544788.db2.gz	UYLYCMNRPSDHLG-RYUDHWBXSA-N	1	1	314.769	1.671	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC2CC2)C[C@H]1C	ZINC001348145016	874378726	/nfs/dbraw/zinc/37/87/26/874378726.db2.gz	JLMLDVBFJILHMN-NEPJUHHUSA-N	1	1	322.413	1.556	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc3c(cccc3[N+](=O)[O-])o2)C1	ZINC001227236383	882924595	/nfs/dbraw/zinc/92/45/95/882924595.db2.gz	SILWLVHBSDGJPQ-SNVBAGLBSA-N	1	1	307.306	1.836	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@@H]2CSC[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC001349907361	875447575	/nfs/dbraw/zinc/44/75/75/875447575.db2.gz	DQDSGWZUOLJCSJ-JRPNMDOOSA-N	1	1	321.402	1.590	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC[N@H+]1C1CCCC1	ZINC001350602887	875782224	/nfs/dbraw/zinc/78/22/24/875782224.db2.gz	KMWUVPJAOGBRKF-LLVKDONJSA-N	1	1	321.381	1.417	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228603021	883567740	/nfs/dbraw/zinc/56/77/40/883567740.db2.gz	HZCHEYXKMIEQDA-SNVBAGLBSA-N	1	1	308.338	1.829	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228603021	883567753	/nfs/dbraw/zinc/56/77/53/883567753.db2.gz	HZCHEYXKMIEQDA-SNVBAGLBSA-N	1	1	308.338	1.829	20	5		DDBDMO
CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccnc([N+](=O)[O-])c3)C[C@H]1[N@H+]2C	ZINC001233858968	887398065	/nfs/dbraw/zinc/39/80/65/887398065.db2.gz	IZUYNXQVGDWGNJ-SCUASFONSA-N	1	1	321.333	1.535	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O[C@H]2CCC[N@H+](C)C2)n1	ZINC001234908507	888246518	/nfs/dbraw/zinc/24/65/18/888246518.db2.gz	GEAFQBYWTHKUSU-JTQLQIEISA-N	1	1	309.326	1.125	20	5		DDBDMO
C[C@H](CNC(=O)c1cnc(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1	ZINC001290900463	913537562	/nfs/dbraw/zinc/53/75/62/913537562.db2.gz	UYGRNIOCIRWHMR-WDEREUQCSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[N@H+]1CCC[C@@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)C1	ZINC001248066385	893526978	/nfs/dbraw/zinc/52/69/78/893526978.db2.gz	PTLQFGAGJMKHNN-MRVPVSSYSA-N	1	1	307.285	1.988	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN(CCCO)CC1)C2	ZINC001254592641	896522762	/nfs/dbraw/zinc/52/27/62/896522762.db2.gz	DTSODPHWVMJUQW-MRXNPFEDSA-N	1	1	305.378	1.062	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000278571652	214245557	/nfs/dbraw/zinc/24/55/57/214245557.db2.gz	KNSRYTXLAWUNOK-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000278571652	214245561	/nfs/dbraw/zinc/24/55/61/214245561.db2.gz	KNSRYTXLAWUNOK-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000278571652	214245564	/nfs/dbraw/zinc/24/55/64/214245564.db2.gz	KNSRYTXLAWUNOK-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
Cc1nc(N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000278648423	214300983	/nfs/dbraw/zinc/30/09/83/214300983.db2.gz	DKSIJIXMLYTYAB-LBPRGKRZSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000305759650	231043132	/nfs/dbraw/zinc/04/31/32/231043132.db2.gz	ILPWCNORGBGEOA-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000305759650	231043136	/nfs/dbraw/zinc/04/31/36/231043136.db2.gz	ILPWCNORGBGEOA-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305762030	231044208	/nfs/dbraw/zinc/04/42/08/231044208.db2.gz	MLEXKCSERCMKIA-GMXABZIVSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305762030	231044211	/nfs/dbraw/zinc/04/42/11/231044211.db2.gz	MLEXKCSERCMKIA-GMXABZIVSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000451629620	231144257	/nfs/dbraw/zinc/14/42/57/231144257.db2.gz	KJAULPFUSAKPPH-TYNCELHUSA-N	1	1	318.377	1.558	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000452067094	231289016	/nfs/dbraw/zinc/28/90/16/231289016.db2.gz	LWLHJQPXAYUXRN-FZMZJTMJSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000452067094	231289021	/nfs/dbraw/zinc/28/90/21/231289021.db2.gz	LWLHJQPXAYUXRN-FZMZJTMJSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000451248528	529485533	/nfs/dbraw/zinc/48/55/33/529485533.db2.gz	DEGIQWNYCRFFRP-DUVNUKRYSA-N	1	1	324.377	1.427	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCC[N@@H+]1CCCO	ZINC000452366034	231362770	/nfs/dbraw/zinc/36/27/70/231362770.db2.gz	OGUDFUXMQMJROY-HNNXBMFYSA-N	1	1	321.377	1.100	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000254977555	282222206	/nfs/dbraw/zinc/22/22/06/282222206.db2.gz	OJGMQQHPLDMZLT-YVMONPNESA-N	1	1	301.346	1.915	20	5		DDBDMO
CC1(C)CN(Cc2c(F)cccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000614923651	362081214	/nfs/dbraw/zinc/08/12/14/362081214.db2.gz	PMNIJPGDVXCDDB-UHFFFAOYSA-N	1	1	311.357	1.622	20	5		DDBDMO
CCO[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090550318	185302245	/nfs/dbraw/zinc/30/22/45/185302245.db2.gz	SVLIWMZTHGHALV-ZIAGYGMSSA-N	1	1	323.393	1.892	20	5		DDBDMO
CC1(C)[C@@H](O)C[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000563821271	303975954	/nfs/dbraw/zinc/97/59/54/303975954.db2.gz	QBJIKQSUAFPMTP-RYUDHWBXSA-N	1	1	318.333	1.894	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000266191721	282300864	/nfs/dbraw/zinc/30/08/64/282300864.db2.gz	MMRWKOBSPZODQD-CQSZACIVSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-]	ZINC000491889105	530057139	/nfs/dbraw/zinc/05/71/39/530057139.db2.gz	UURSUSVHMRGDDF-SCXUMTSISA-N	1	1	307.325	1.958	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-]	ZINC000491889104	530063010	/nfs/dbraw/zinc/06/30/10/530063010.db2.gz	UURSUSVHMRGDDF-IYNGYCSASA-N	1	1	307.325	1.958	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000181943819	199366771	/nfs/dbraw/zinc/36/67/71/199366771.db2.gz	ILUOZQZLESQXEL-KGLIPLIRSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C	ZINC000358391866	299140437	/nfs/dbraw/zinc/14/04/37/299140437.db2.gz	ITIQALUXLALPCD-ZYHUDNBSSA-N	1	1	309.341	1.875	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N(C)CC[N@@H+](C)C2CC2)n1	ZINC000286995002	219259667	/nfs/dbraw/zinc/25/96/67/219259667.db2.gz	UHDYWBPAFCSRAY-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
Cc1c(NC(=O)NC[C@@]2(O)CC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000358444987	299153675	/nfs/dbraw/zinc/15/36/75/299153675.db2.gz	WSFLGYIXUXMIBL-AWEZNQCLSA-N	1	1	308.338	1.091	20	5		DDBDMO
C[N@H+]1CCCN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1	ZINC000279956608	215268212	/nfs/dbraw/zinc/26/82/12/215268212.db2.gz	ZQRSQRVPTYRVPQ-UHFFFAOYSA-N	1	1	318.377	1.121	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000152411959	186069971	/nfs/dbraw/zinc/06/99/71/186069971.db2.gz	WXOOBVFQPQUXEZ-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
COc1cc(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000155790711	186113078	/nfs/dbraw/zinc/11/30/78/186113078.db2.gz	YPHSYEARDHOPMK-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1	ZINC000272441891	209845577	/nfs/dbraw/zinc/84/55/77/209845577.db2.gz	MOIAQYDCXSMDHP-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000181883873	186214788	/nfs/dbraw/zinc/21/47/88/186214788.db2.gz	HQTWBPQFXXAAQZ-SNVBAGLBSA-N	1	1	307.306	1.148	20	5		DDBDMO
CC(C)[C@@H](CNc1c([N+](=O)[O-])ncn1C)N1CC[NH+](C)CC1	ZINC000046551957	352455985	/nfs/dbraw/zinc/45/59/85/352455985.db2.gz	SODDSCDXGBUEKV-GFCCVEGCSA-N	1	1	310.402	1.012	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000060670051	352878667	/nfs/dbraw/zinc/87/86/67/352878667.db2.gz	KLTUWDHVYUVGKW-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000331908263	234262138	/nfs/dbraw/zinc/26/21/38/234262138.db2.gz	ALQZSRQGYVHPQL-NXEZZACHSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000331908263	234262143	/nfs/dbraw/zinc/26/21/43/234262143.db2.gz	ALQZSRQGYVHPQL-NXEZZACHSA-N	1	1	317.349	1.636	20	5		DDBDMO
CNC(=O)c1ccc(NC[C@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000068913119	353135826	/nfs/dbraw/zinc/13/58/26/353135826.db2.gz	SLBSGDPENHYJTQ-JTQLQIEISA-N	1	1	306.366	1.849	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])C1	ZINC000072811020	353216603	/nfs/dbraw/zinc/21/66/03/353216603.db2.gz	ANUWQWHOPWDAFT-BARDWOONSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000072811020	353216604	/nfs/dbraw/zinc/21/66/04/353216604.db2.gz	ANUWQWHOPWDAFT-BARDWOONSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000072811020	353216605	/nfs/dbraw/zinc/21/66/05/353216605.db2.gz	ANUWQWHOPWDAFT-BARDWOONSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000074105052	353292684	/nfs/dbraw/zinc/29/26/84/353292684.db2.gz	LGOXGBKTHOBZIN-GFCCVEGCSA-N	1	1	307.350	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000174539713	198350164	/nfs/dbraw/zinc/35/01/64/198350164.db2.gz	MUEPRFVLRLVHMT-FGWVZKOKSA-N	1	1	321.381	1.625	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1C[C@@H](C)O	ZINC000174618386	198361003	/nfs/dbraw/zinc/36/10/03/198361003.db2.gz	JAQKOEHUGGLUBW-MNOVXSKESA-N	1	1	311.338	1.105	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1C[C@@H](C)O	ZINC000174618386	198361004	/nfs/dbraw/zinc/36/10/04/198361004.db2.gz	JAQKOEHUGGLUBW-MNOVXSKESA-N	1	1	311.338	1.105	20	5		DDBDMO
CCOC(=O)c1ccnc(N[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000077934081	353497473	/nfs/dbraw/zinc/49/74/73/353497473.db2.gz	VPAONYNDLPJASJ-SNVBAGLBSA-N	1	1	320.349	1.815	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000079604003	353569665	/nfs/dbraw/zinc/56/96/65/353569665.db2.gz	BQENGVXURUUPII-XHSDSOJGSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000079604003	353569666	/nfs/dbraw/zinc/56/96/66/353569666.db2.gz	BQENGVXURUUPII-XHSDSOJGSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000079604003	353569669	/nfs/dbraw/zinc/56/96/69/353569669.db2.gz	BQENGVXURUUPII-XHSDSOJGSA-N	1	1	317.389	1.475	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)c1[N+](=O)[O-]	ZINC000081290876	353660778	/nfs/dbraw/zinc/66/07/78/353660778.db2.gz	XVCXXIHSRXECRV-LBPRGKRZSA-N	1	1	321.381	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H](O)Cn1cccn1)CC2	ZINC000088606094	353756694	/nfs/dbraw/zinc/75/66/94/353756694.db2.gz	BMIKLALAVOVTCW-HNNXBMFYSA-N	1	1	302.334	1.211	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)Cn1cccn1)CC2	ZINC000088606094	353756696	/nfs/dbraw/zinc/75/66/96/353756696.db2.gz	BMIKLALAVOVTCW-HNNXBMFYSA-N	1	1	302.334	1.211	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCCC1	ZINC000090526533	353794745	/nfs/dbraw/zinc/79/47/45/353794745.db2.gz	VSPWEGBYSJDDKX-ZDUSSCGKSA-N	1	1	323.393	1.772	20	5		DDBDMO
[NH3+][C@H]1CCC[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000124876406	354042572	/nfs/dbraw/zinc/04/25/72/354042572.db2.gz	FFKVGDUWMIBWBY-IUCAKERBSA-N	1	1	317.342	1.282	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](CO)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000293110151	354453862	/nfs/dbraw/zinc/45/38/62/354453862.db2.gz	LPLSHKMSVGJUCD-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](CO)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000293110151	354453866	/nfs/dbraw/zinc/45/38/66/354453866.db2.gz	LPLSHKMSVGJUCD-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000405314984	354678291	/nfs/dbraw/zinc/67/82/91/354678291.db2.gz	QWCWAVNIMZNHNS-QWHCGFSZSA-N	1	1	305.334	1.053	20	5		DDBDMO
C[NH+](C)C1(CS(=O)(=O)NCc2ccccc2[N+](=O)[O-])CC1	ZINC000601308745	358489704	/nfs/dbraw/zinc/48/97/04/358489704.db2.gz	CTGJSSKEPODRNP-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CCC([N@@H+](C)CCCO)CC1	ZINC000590584457	355121023	/nfs/dbraw/zinc/12/10/23/355121023.db2.gz	ITQRAQVGOFOXSE-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
C[NH+](C)C1(CS(=O)(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000601321437	358494863	/nfs/dbraw/zinc/49/48/63/358494863.db2.gz	NBKDFXWSHRJFEE-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cccc(OC)c1[N+](=O)[O-]	ZINC000591004640	355231199	/nfs/dbraw/zinc/23/11/99/355231199.db2.gz	BULOZFALJYNHAU-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cccc(OC)c1[N+](=O)[O-]	ZINC000591004640	355231200	/nfs/dbraw/zinc/23/12/00/355231200.db2.gz	BULOZFALJYNHAU-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)c1[N+](=O)[O-]	ZINC000591893459	355414505	/nfs/dbraw/zinc/41/45/05/355414505.db2.gz	YKEJWFKTCDVTSV-GHMZBOCLSA-N	1	1	307.354	1.231	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000593033286	355775056	/nfs/dbraw/zinc/77/50/56/355775056.db2.gz	LVDWBFPDESQXIN-CYBMUJFWSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2(CCC2)CO1	ZINC000593090662	355791853	/nfs/dbraw/zinc/79/18/53/355791853.db2.gz	BZBKXEMKJBPNHQ-GFCCVEGCSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2(CCC2)CO1	ZINC000593090662	355791860	/nfs/dbraw/zinc/79/18/60/355791860.db2.gz	BZBKXEMKJBPNHQ-GFCCVEGCSA-N	1	1	307.350	1.400	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000593188343	355820956	/nfs/dbraw/zinc/82/09/56/355820956.db2.gz	DHWAWRGMLVUYSP-UTUOFQBUSA-N	1	1	323.397	1.429	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccnc2cc([N+](=O)[O-])ccc21	ZINC000593483544	355899714	/nfs/dbraw/zinc/89/97/14/355899714.db2.gz	ZWHRDRQQQKASHO-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc1[N+](=O)[O-]	ZINC000594392611	356195089	/nfs/dbraw/zinc/19/50/89/356195089.db2.gz	IOUFXZSQMSRJAR-UONOGXRCSA-N	1	1	319.361	1.048	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594418450	356203940	/nfs/dbraw/zinc/20/39/40/356203940.db2.gz	JBAFFCZSRDJNJH-QWRGUYRKSA-N	1	1	307.354	1.373	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000594539415	356245608	/nfs/dbraw/zinc/24/56/08/356245608.db2.gz	MXCVXNNDJLTUGC-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019554	356373096	/nfs/dbraw/zinc/37/30/96/356373096.db2.gz	QXZWBVXBCNAQGA-CHWSQXEVSA-N	1	1	323.393	1.975	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019554	356373099	/nfs/dbraw/zinc/37/30/99/356373099.db2.gz	QXZWBVXBCNAQGA-CHWSQXEVSA-N	1	1	323.393	1.975	20	5		DDBDMO
CCCNC(=O)C1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1	ZINC000595291474	356436334	/nfs/dbraw/zinc/43/63/34/356436334.db2.gz	YXBWXIABMHFXRR-UHFFFAOYSA-N	1	1	310.354	1.629	20	5		DDBDMO
CO[C@@H](C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@@H]1CCOC1	ZINC000595423133	356486442	/nfs/dbraw/zinc/48/64/42/356486442.db2.gz	JNELLYZVTAEFPK-ABAIWWIYSA-N	1	1	307.350	1.399	20	5		DDBDMO
CO[C@@H](C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@@H]1CCOC1	ZINC000595423133	356486446	/nfs/dbraw/zinc/48/64/46/356486446.db2.gz	JNELLYZVTAEFPK-ABAIWWIYSA-N	1	1	307.350	1.399	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](N3CCCC3=O)CC2)c1[N+](=O)[O-]	ZINC000595546731	356543713	/nfs/dbraw/zinc/54/37/13/356543713.db2.gz	QNADSUNLATZVHI-LBPRGKRZSA-N	1	1	322.365	1.868	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](N3CCCC3=O)CC2)c1[N+](=O)[O-]	ZINC000595546731	356543716	/nfs/dbraw/zinc/54/37/16/356543716.db2.gz	QNADSUNLATZVHI-LBPRGKRZSA-N	1	1	322.365	1.868	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@](CO)(OC)C2)ccc1[N+](=O)[O-]	ZINC000595660251	356596555	/nfs/dbraw/zinc/59/65/55/356596555.db2.gz	TVJYGDFAFWBDRL-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1COCCO1	ZINC000595734851	356627499	/nfs/dbraw/zinc/62/74/99/356627499.db2.gz	CCNCDPOVGGYQCJ-GFCCVEGCSA-N	1	1	323.349	1.271	20	5		DDBDMO
COc1cc(N[C@H](C)C[NH+]2CCN(C)CC2)c([N+](=O)[O-])cc1C	ZINC000596123177	356781918	/nfs/dbraw/zinc/78/19/18/356781918.db2.gz	LFJNYJXJESWWKG-CYBMUJFWSA-N	1	1	322.409	1.960	20	5		DDBDMO
C[N@@H+](CCCCNc1ccc([N+](=O)[O-])c(C(N)=O)c1)C1CC1	ZINC000596260841	356835598	/nfs/dbraw/zinc/83/55/98/356835598.db2.gz	LJZKCLQPRGESPS-UHFFFAOYSA-N	1	1	306.366	1.980	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596265211	356838011	/nfs/dbraw/zinc/83/80/11/356838011.db2.gz	HAXWOIOMUGUTNG-UHFFFAOYSA-N	1	1	306.366	1.980	20	5		DDBDMO
Cc1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-]	ZINC000597202441	357090937	/nfs/dbraw/zinc/09/09/37/357090937.db2.gz	AYSPWFSNOOONHB-OAHLLOKOSA-N	1	1	305.378	1.810	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000597859616	357361052	/nfs/dbraw/zinc/36/10/52/357361052.db2.gz	WITWWHKSYVYJDB-JTQLQIEISA-N	1	1	306.366	1.780	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000597859538	357361241	/nfs/dbraw/zinc/36/12/41/357361241.db2.gz	FFAVXBWBFWLNAE-NSHDSACASA-N	1	1	306.366	1.840	20	5		DDBDMO
CCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000598042565	357439081	/nfs/dbraw/zinc/43/90/81/357439081.db2.gz	PSFJWMCSRNONPV-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598218997	357497360	/nfs/dbraw/zinc/49/73/60/357497360.db2.gz	KKOYTSMLHQAABP-JTQLQIEISA-N	1	1	307.354	1.455	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000598714061	357700838	/nfs/dbraw/zinc/70/08/38/357700838.db2.gz	FIOWTXGWDFOTGB-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1NCC[N@@H+]1CC[C@H](O)C1	ZINC000599199468	357848005	/nfs/dbraw/zinc/84/80/05/357848005.db2.gz	LPSGVMSQCJCSPY-NSHDSACASA-N	1	1	302.334	1.043	20	5		DDBDMO
Cc1nc2n(n1)C[C@H](Nc1cc[nH+]c3ccc([N+](=O)[O-])cc13)CC2	ZINC000601110252	358405313	/nfs/dbraw/zinc/40/53/13/358405313.db2.gz	AXWDVMMAEJGCLJ-LLVKDONJSA-N	1	1	324.344	1.892	20	5		DDBDMO
COc1ccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC000601150536	358422392	/nfs/dbraw/zinc/42/23/92/358422392.db2.gz	YZWPOZXWYRKVLR-MRXNPFEDSA-N	1	1	317.345	1.996	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601775615	358689708	/nfs/dbraw/zinc/68/97/08/358689708.db2.gz	GMVPMGCBAMOCIP-HNNXBMFYSA-N	1	1	309.366	1.260	20	5		DDBDMO
O=[N+]([O-])c1nccn1C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1	ZINC000601965308	358755977	/nfs/dbraw/zinc/75/59/77/358755977.db2.gz	UAPAUJNZAZIPRZ-OAHLLOKOSA-N	1	1	302.334	1.428	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602456377	358989783	/nfs/dbraw/zinc/98/97/83/358989783.db2.gz	YLLWANNVJFAMGO-LBPRGKRZSA-N	1	1	323.397	1.313	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602456377	358989785	/nfs/dbraw/zinc/98/97/85/358989785.db2.gz	YLLWANNVJFAMGO-LBPRGKRZSA-N	1	1	323.397	1.313	20	5		DDBDMO
CCOC(=O)[C@]1(C(C)C)CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602635833	359089559	/nfs/dbraw/zinc/08/95/59/359089559.db2.gz	CCEKWIIVBNMOKE-OAHLLOKOSA-N	1	1	324.381	1.740	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000602775857	359182703	/nfs/dbraw/zinc/18/27/03/359182703.db2.gz	CIDNRSDEAMTOPM-TZMCWYRMSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000602775857	359182727	/nfs/dbraw/zinc/18/27/27/359182727.db2.gz	CIDNRSDEAMTOPM-TZMCWYRMSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000602775857	359182731	/nfs/dbraw/zinc/18/27/31/359182731.db2.gz	CIDNRSDEAMTOPM-TZMCWYRMSA-N	1	1	309.414	1.904	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CCC[C@]2(CC[N@H+](C)C2)C1	ZINC000602834801	359226810	/nfs/dbraw/zinc/22/68/10/359226810.db2.gz	DBHAWFYFOGUPOM-OAHLLOKOSA-N	1	1	307.398	1.517	20	5		DDBDMO
CS[C@@H]1C[N@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000602797269	359198934	/nfs/dbraw/zinc/19/89/34/359198934.db2.gz	IBPQQAYJLGVXTI-NWDGAFQWSA-N	1	1	313.427	1.077	20	5		DDBDMO
CS[C@@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000602797269	359198940	/nfs/dbraw/zinc/19/89/40/359198940.db2.gz	IBPQQAYJLGVXTI-NWDGAFQWSA-N	1	1	313.427	1.077	20	5		DDBDMO
CC(C)[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])C(=O)N1CCCC1	ZINC000602808366	359205297	/nfs/dbraw/zinc/20/52/97/359205297.db2.gz	YJBRVSKIXCSVGF-LBPRGKRZSA-N	1	1	309.370	1.065	20	5		DDBDMO
Cn1cc(CN[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822940	359217234	/nfs/dbraw/zinc/21/72/34/359217234.db2.gz	HJXFEDOHUVNYHR-LSDHHAIUSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cc(CN[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822940	359217238	/nfs/dbraw/zinc/21/72/38/359217238.db2.gz	HJXFEDOHUVNYHR-LSDHHAIUSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)C(C)(C)C1	ZINC000602949334	359315033	/nfs/dbraw/zinc/31/50/33/359315033.db2.gz	YKBDPJGSDPBLLM-UHFFFAOYSA-N	1	1	307.354	1.278	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141256	359430032	/nfs/dbraw/zinc/43/00/32/359430032.db2.gz	FCMBGUPMOWGMEX-LLVKDONJSA-N	1	1	323.397	1.439	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141256	359430036	/nfs/dbraw/zinc/43/00/36/359430036.db2.gz	FCMBGUPMOWGMEX-LLVKDONJSA-N	1	1	323.397	1.439	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC1(CO)CC1	ZINC000186813288	200014928	/nfs/dbraw/zinc/01/49/28/200014928.db2.gz	BKKWDKCNUVSCTD-UHFFFAOYSA-N	1	1	307.350	1.628	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@@H+]2CCOC[C@H]2C)CC1	ZINC000603402027	359617412	/nfs/dbraw/zinc/61/74/12/359617412.db2.gz	LNTLALXWOAPWBU-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000186954876	200037872	/nfs/dbraw/zinc/03/78/72/200037872.db2.gz	QPAILHDQOPQQMG-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000186954876	200037873	/nfs/dbraw/zinc/03/78/73/200037873.db2.gz	QPAILHDQOPQQMG-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@]1(CO)CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000187592608	200132171	/nfs/dbraw/zinc/13/21/71/200132171.db2.gz	FZHXHBZMTOXQAF-INIZCTEOSA-N	1	1	321.377	1.678	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000604278113	359732443	/nfs/dbraw/zinc/73/24/43/359732443.db2.gz	HQHKMXZLOPSYGZ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@H]1CCC[N@H+](C)C1	ZINC000604278113	359732447	/nfs/dbraw/zinc/73/24/47/359732447.db2.gz	HQHKMXZLOPSYGZ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)C1	ZINC000609269645	360285615	/nfs/dbraw/zinc/28/56/15/360285615.db2.gz	UHUZLFGDZFDJOD-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000281208481	216153587	/nfs/dbraw/zinc/15/35/87/216153587.db2.gz	SHYKSTFTRNIZQO-OAHLLOKOSA-N	1	1	307.350	1.432	20	5		DDBDMO
CN(CC(=O)N[C@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000610292836	360410993	/nfs/dbraw/zinc/41/09/93/360410993.db2.gz	QJOJKEIKAZPASC-LBPRGKRZSA-N	1	1	306.366	1.241	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O	ZINC000611287539	360689896	/nfs/dbraw/zinc/68/98/96/360689896.db2.gz	HFCOGYMXJSLJBM-GXFFZTMASA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CC(=O)N1CC[NH+](C)CC1	ZINC000611680915	360790815	/nfs/dbraw/zinc/79/08/15/360790815.db2.gz	JKNLWEVGYNAYQO-ZDUSSCGKSA-N	1	1	320.393	1.362	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)nc1	ZINC000612778501	361142548	/nfs/dbraw/zinc/14/25/48/361142548.db2.gz	LVZLZLUYQLTMEU-ZDUSSCGKSA-N	1	1	307.354	1.076	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(NC(C)=O)CC1	ZINC000619531330	364049799	/nfs/dbraw/zinc/04/97/99/364049799.db2.gz	LGDVDOPNFIMCSO-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000350764128	284257000	/nfs/dbraw/zinc/25/70/00/284257000.db2.gz	OCZHPQOVCHXRQF-AWEZNQCLSA-N	1	1	307.398	1.455	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000266111912	205107711	/nfs/dbraw/zinc/10/77/11/205107711.db2.gz	VGVKNXXJQLGLJW-ONGXEEELSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000266111912	205107713	/nfs/dbraw/zinc/10/77/13/205107713.db2.gz	VGVKNXXJQLGLJW-ONGXEEELSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000266111912	205107718	/nfs/dbraw/zinc/10/77/18/205107718.db2.gz	VGVKNXXJQLGLJW-ONGXEEELSA-N	1	1	309.370	1.429	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)NCCc2ccccc2[N+](=O)[O-])CC1	ZINC000271865282	209278395	/nfs/dbraw/zinc/27/83/95/209278395.db2.gz	JCTHCFDCNNYAMF-UHFFFAOYSA-N	1	1	318.377	1.698	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000274074022	211331955	/nfs/dbraw/zinc/33/19/55/211331955.db2.gz	VGCYSLPDSMHFMC-ZDUSSCGKSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000274074022	211331958	/nfs/dbraw/zinc/33/19/58/211331958.db2.gz	VGCYSLPDSMHFMC-ZDUSSCGKSA-N	1	1	304.350	1.631	20	5		DDBDMO
Cc1ccc([C@@H](C)NC[C@H]2C[N@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847713	207014297	/nfs/dbraw/zinc/01/42/97/207014297.db2.gz	BQBWEFGGCYOTGC-HIFRSBDPSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1ccc([C@@H](C)NC[C@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847713	207014303	/nfs/dbraw/zinc/01/43/03/207014303.db2.gz	BQBWEFGGCYOTGC-HIFRSBDPSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@@H](O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000340982359	251317835	/nfs/dbraw/zinc/31/78/35/251317835.db2.gz	YTDXEHQHVMOBQV-JQWIXIFHSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+](CCO)CC1CC1	ZINC000352479060	285080471	/nfs/dbraw/zinc/08/04/71/285080471.db2.gz	AFFUJSPQDKNMKU-ZDUSSCGKSA-N	1	1	310.350	1.039	20	5		DDBDMO
CNc1nc(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000458216831	533076816	/nfs/dbraw/zinc/07/68/16/533076816.db2.gz	VPLPULVINRFJCW-LLVKDONJSA-N	1	1	321.381	1.493	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CO)C[C@@H]1C	ZINC000288731357	220377528	/nfs/dbraw/zinc/37/75/28/220377528.db2.gz	DZRQLJBNZDCQAO-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CO)C[C@@H]1C	ZINC000288731357	220377532	/nfs/dbraw/zinc/37/75/32/220377532.db2.gz	DZRQLJBNZDCQAO-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000352662261	285206310	/nfs/dbraw/zinc/20/63/10/285206310.db2.gz	XZCYHPJLRHQGIV-JSGCOSHPSA-N	1	1	323.349	1.387	20	5		DDBDMO
O=C(NCCCCC[NH+]1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000155036845	197016235	/nfs/dbraw/zinc/01/62/35/197016235.db2.gz	ORVORNSYMBKEJU-UHFFFAOYSA-N	1	1	309.370	1.704	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000352798025	285307768	/nfs/dbraw/zinc/30/77/68/285307768.db2.gz	WYQUJYBNQKUMCP-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)C1	ZINC000352914892	285384341	/nfs/dbraw/zinc/38/43/41/285384341.db2.gz	MSIUHKSGNYGFSV-JTQLQIEISA-N	1	1	304.306	1.363	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000102332302	407321567	/nfs/dbraw/zinc/32/15/67/407321567.db2.gz	VKHAWOBRMHBUEZ-LBPRGKRZSA-N	1	1	323.397	1.375	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@@H+](C)CC2)c([N+](=O)[O-])cc1OC	ZINC000097617059	407300470	/nfs/dbraw/zinc/30/04/70/407300470.db2.gz	BDGMUYANRVYNAE-UHFFFAOYSA-N	1	1	323.349	1.390	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1	ZINC000101631741	407312937	/nfs/dbraw/zinc/31/29/37/407312937.db2.gz	HYXZZGUQFIYTNJ-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@H](C(N)=O)CC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000103284357	407336304	/nfs/dbraw/zinc/33/63/04/407336304.db2.gz	CYMNYYJODXLQQZ-CMPLNLGQSA-N	1	1	307.350	1.689	20	5		DDBDMO
O=C(NCCC[NH+]1CCOCC1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000111917755	407419798	/nfs/dbraw/zinc/41/97/98/407419798.db2.gz	KOQSGIJDWIVROH-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
C[NH+]1CCC(O)(CNCc2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000265897552	407502975	/nfs/dbraw/zinc/50/29/75/407502975.db2.gz	UAPXEYWABHAKSH-UHFFFAOYSA-N	1	1	313.785	1.795	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000270968057	407442695	/nfs/dbraw/zinc/44/26/95/407442695.db2.gz	VTLDDFAQAVVHFE-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@@H+](CCNC(=O)NCCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000266791222	407634903	/nfs/dbraw/zinc/63/49/03/407634903.db2.gz	SOYQKJIRAYWMDA-UHFFFAOYSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N[C@H]1CCCC[NH2+]C1	ZINC000261736389	407596062	/nfs/dbraw/zinc/59/60/62/407596062.db2.gz	RRVNTUIWIANPCV-VIFPVBQESA-N	1	1	317.342	1.154	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000115548919	407687796	/nfs/dbraw/zinc/68/77/96/407687796.db2.gz	RGLHVUJRRSZPIQ-UHFFFAOYSA-N	1	1	321.421	1.916	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CCCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000266980386	407703295	/nfs/dbraw/zinc/70/32/95/407703295.db2.gz	PVYMDSKWGZHGSN-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
CCNC(=O)C[N@H+]1CCCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000266980386	407703296	/nfs/dbraw/zinc/70/32/96/407703296.db2.gz	PVYMDSKWGZHGSN-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000262034281	407719150	/nfs/dbraw/zinc/71/91/50/407719150.db2.gz	SRTSVAJICJNNOC-ZDUSSCGKSA-N	1	1	301.306	1.105	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)CCNc2ccccc2[N+](=O)[O-])CC1	ZINC000272049784	407756134	/nfs/dbraw/zinc/75/61/34/407756134.db2.gz	ZCOMKRRTESDFEO-UHFFFAOYSA-N	1	1	318.377	1.775	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000267343405	407840987	/nfs/dbraw/zinc/84/09/87/407840987.db2.gz	CYSLXTMDQQTEGE-LBPRGKRZSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000267343405	407840994	/nfs/dbraw/zinc/84/09/94/407840994.db2.gz	CYSLXTMDQQTEGE-LBPRGKRZSA-N	1	1	320.267	1.973	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)C[N@H+]1C1CC1	ZINC000133535421	407855562	/nfs/dbraw/zinc/85/55/62/407855562.db2.gz	DVHHENDGNCALHP-BDAKNGLRSA-N	1	1	305.338	1.126	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CCO)[C@H](C)C1	ZINC000187689248	407881241	/nfs/dbraw/zinc/88/12/41/407881241.db2.gz	OJOBZOQDJNVMET-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000134055006	407884892	/nfs/dbraw/zinc/88/48/92/407884892.db2.gz	RTOORFLEXWVDHX-BXUZGUMPSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000134055006	407884899	/nfs/dbraw/zinc/88/48/99/407884899.db2.gz	RTOORFLEXWVDHX-BXUZGUMPSA-N	1	1	322.365	1.113	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000154063442	407966009	/nfs/dbraw/zinc/96/60/09/407966009.db2.gz	RKRPNULOVPSKQG-MGPQQGTHSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000154089205	407968659	/nfs/dbraw/zinc/96/86/59/407968659.db2.gz	PMDWWHDUJLPHIJ-HNNXBMFYSA-N	1	1	321.377	1.772	20	5		DDBDMO
CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272542554	407973187	/nfs/dbraw/zinc/97/31/87/407973187.db2.gz	OBFZMDZAHAUTDN-GFCCVEGCSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272542554	407973189	/nfs/dbraw/zinc/97/31/89/407973189.db2.gz	OBFZMDZAHAUTDN-GFCCVEGCSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC(C)[NH+]1CCC(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000272549128	407979573	/nfs/dbraw/zinc/97/95/73/407979573.db2.gz	GTLQTPZMCNGWRC-UHFFFAOYSA-N	1	1	307.350	1.903	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c1	ZINC000153938099	407936836	/nfs/dbraw/zinc/93/68/36/407936836.db2.gz	DQMUTQAIIJRNGG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(NC1CC[NH+](CC2CC2)CC1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272585474	407994814	/nfs/dbraw/zinc/99/48/14/407994814.db2.gz	OQTNCUVLCYPROO-UHFFFAOYSA-N	1	1	319.361	1.905	20	5		DDBDMO
COC(=O)CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000154273032	408009478	/nfs/dbraw/zinc/00/94/78/408009478.db2.gz	XXGDULIAXUFTMA-AWEZNQCLSA-N	1	1	310.350	1.902	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000155614126	408187086	/nfs/dbraw/zinc/18/70/86/408187086.db2.gz	UOWUQDNKHNMXDO-UHFFFAOYSA-N	1	1	307.397	1.275	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000246306145	408213692	/nfs/dbraw/zinc/21/36/92/408213692.db2.gz	FRXWNAIAJNWQQY-GHMZBOCLSA-N	1	1	323.349	1.663	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1CO	ZINC000190371927	408232249	/nfs/dbraw/zinc/23/22/49/408232249.db2.gz	JUXRGGWZYHVNBA-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)c1cccc([N+](=O)[O-])c1	ZINC000269479664	408324574	/nfs/dbraw/zinc/32/45/74/408324574.db2.gz	XXHRWAJPQIWJQR-OAHLLOKOSA-N	1	1	321.377	1.562	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@H]2C[NH+]3CCN2CC3)c2ccncc21	ZINC000269490235	408328111	/nfs/dbraw/zinc/32/81/11/408328111.db2.gz	NUGAHSWVGPXQRR-LBPRGKRZSA-N	1	1	313.361	1.555	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000269333247	408271782	/nfs/dbraw/zinc/27/17/82/408271782.db2.gz	ATGZKHRKRVHBSG-MNOVXSKESA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000269333247	408271788	/nfs/dbraw/zinc/27/17/88/408271788.db2.gz	ATGZKHRKRVHBSG-MNOVXSKESA-N	1	1	323.397	1.996	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc2c(c1)OCO2	ZINC000176196527	408306009	/nfs/dbraw/zinc/30/60/09/408306009.db2.gz	YPKGCWCSFCYKMG-UHFFFAOYSA-N	1	1	304.306	1.652	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183197054	408350749	/nfs/dbraw/zinc/35/07/49/408350749.db2.gz	MVDYXJUNXOXCFN-NWDGAFQWSA-N	1	1	310.350	1.685	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@H+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000171806423	162242669	/nfs/dbraw/zinc/24/26/69/162242669.db2.gz	HDJUYRVMSFEWGU-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000171806423	162242672	/nfs/dbraw/zinc/24/26/72/162242672.db2.gz	HDJUYRVMSFEWGU-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000171806423	162242673	/nfs/dbraw/zinc/24/26/73/162242673.db2.gz	HDJUYRVMSFEWGU-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177081898	408513674	/nfs/dbraw/zinc/51/36/74/408513674.db2.gz	XZISOKHRSOTQCL-WPRPVWTQSA-N	1	1	322.340	1.671	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000183961673	408518204	/nfs/dbraw/zinc/51/82/04/408518204.db2.gz	QDIIVWSBWNFPHS-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]1C	ZINC000248344539	408551517	/nfs/dbraw/zinc/55/15/17/408551517.db2.gz	LSQFRHMNRDIBEM-UWVGGRQHSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]1C	ZINC000248344539	408551520	/nfs/dbraw/zinc/55/15/20/408551520.db2.gz	LSQFRHMNRDIBEM-UWVGGRQHSA-N	1	1	321.333	1.992	20	5		DDBDMO
COc1cc(C[NH2+]C[C@@](C)(O)C(F)(F)F)c([N+](=O)[O-])cc1O	ZINC000270566142	408581709	/nfs/dbraw/zinc/58/17/09/408581709.db2.gz	RSPHULVCQSUPCH-LLVKDONJSA-N	1	1	324.255	1.712	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1CCOC	ZINC000265319936	408614091	/nfs/dbraw/zinc/61/40/91/408614091.db2.gz	KNMQHKBVAIBYQP-LLVKDONJSA-N	1	1	311.338	1.371	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1CCOC	ZINC000265319936	408614095	/nfs/dbraw/zinc/61/40/95/408614095.db2.gz	KNMQHKBVAIBYQP-LLVKDONJSA-N	1	1	311.338	1.371	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2CO)cccc1[N+](=O)[O-]	ZINC000265465409	408661421	/nfs/dbraw/zinc/66/14/21/408661421.db2.gz	HTEGEGKBIVJAOW-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000248943493	408664158	/nfs/dbraw/zinc/66/41/58/408664158.db2.gz	CZQCZPOLZLBHOQ-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000248943493	408664161	/nfs/dbraw/zinc/66/41/61/408664161.db2.gz	CZQCZPOLZLBHOQ-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000270898544	408732044	/nfs/dbraw/zinc/73/20/44/408732044.db2.gz	FAHJOKXYWHDTHV-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CCO)C3CCC3)n2)cc1	ZINC000275793363	408680290	/nfs/dbraw/zinc/68/02/90/408680290.db2.gz	FFZCWRMPSFJLKA-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+](CCO)C3CCC3)n2)cc1	ZINC000275793363	408680298	/nfs/dbraw/zinc/68/02/98/408680298.db2.gz	FFZCWRMPSFJLKA-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000185338475	408797503	/nfs/dbraw/zinc/79/75/03/408797503.db2.gz	KKZIFZPUZSYYOF-UHFFFAOYSA-N	1	1	310.354	1.339	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000177980415	408750139	/nfs/dbraw/zinc/75/01/39/408750139.db2.gz	GWYZBSVMSUTXLU-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
CCC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CC)C(=O)OCC	ZINC000276805859	408901111	/nfs/dbraw/zinc/90/11/11/408901111.db2.gz	MPDWFXUHUJMPKI-GFCCVEGCSA-N	1	1	312.370	1.845	20	5		DDBDMO
CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CC)C(=O)OCC	ZINC000276805859	408901114	/nfs/dbraw/zinc/90/11/14/408901114.db2.gz	MPDWFXUHUJMPKI-GFCCVEGCSA-N	1	1	312.370	1.845	20	5		DDBDMO
Cc1cc(OCC(=O)N(C)[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000281799354	408931643	/nfs/dbraw/zinc/93/16/43/408931643.db2.gz	VGWZIRIIGSBSIT-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000291992231	408957649	/nfs/dbraw/zinc/95/76/49/408957649.db2.gz	WXKLQIDYYJDNME-KGLIPLIRSA-N	1	1	324.377	1.834	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](C2CCC2)CC1	ZINC000277556357	408965700	/nfs/dbraw/zinc/96/57/00/408965700.db2.gz	JJNCMZWRRBFVCG-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@H]1O	ZINC000286338829	408967057	/nfs/dbraw/zinc/96/70/57/408967057.db2.gz	FAMUJIGAQJNBMP-YRGRVCCFSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1[C@@H](CO)CC[C@@H]1CO	ZINC000287356921	409024635	/nfs/dbraw/zinc/02/46/35/409024635.db2.gz	LPQWHCXYRIHHQV-HUUCEWRRSA-N	1	1	324.377	1.700	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCCCCO	ZINC000278956881	409120720	/nfs/dbraw/zinc/12/07/20/409120720.db2.gz	WKKJYSYPFFQLAD-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](C)N1CC[NH+](C)CC1	ZINC000287975364	409124401	/nfs/dbraw/zinc/12/44/01/409124401.db2.gz	RBQGCZDGMXWOIK-LBPRGKRZSA-N	1	1	320.393	1.845	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283448848	409159299	/nfs/dbraw/zinc/15/92/99/409159299.db2.gz	KOVZDQBVXCYFSA-UHFFFAOYSA-N	1	1	312.345	1.776	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C1CCCC1	ZINC000279501110	409226139	/nfs/dbraw/zinc/22/61/39/409226139.db2.gz	SOSHWONXVLVJTD-UHFFFAOYSA-N	1	1	324.356	1.920	20	5		DDBDMO
Cc1cccc(C(=O)NCCC[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000294312440	409275931	/nfs/dbraw/zinc/27/59/31/409275931.db2.gz	XUGXDKMRDNWTGM-UHFFFAOYSA-N	1	1	320.393	1.271	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CC(N)=O)c1ccccc1	ZINC000280291605	409286724	/nfs/dbraw/zinc/28/67/24/409286724.db2.gz	FFEQEONMFCTILK-AWEZNQCLSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(C)(C)CO	ZINC000295189550	409364846	/nfs/dbraw/zinc/36/48/46/409364846.db2.gz	JHQJMVCEXRGKPQ-UHFFFAOYSA-N	1	1	309.366	1.874	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000285326944	409408734	/nfs/dbraw/zinc/40/87/34/409408734.db2.gz	RWOZACUMANJVNN-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(NCC[NH+]2CCC(O)CC2)c(F)c1	ZINC000296174059	409453038	/nfs/dbraw/zinc/45/30/38/409453038.db2.gz	ZPYSGEISZVZEAU-UHFFFAOYSA-N	1	1	301.293	1.742	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290624888	409466717	/nfs/dbraw/zinc/46/67/17/409466717.db2.gz	LVNWSEMRXUOHKJ-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000317286341	164027237	/nfs/dbraw/zinc/02/72/37/164027237.db2.gz	KMXJZRUAOOBCEG-MNOVXSKESA-N	1	1	306.366	1.849	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000296253427	409479106	/nfs/dbraw/zinc/47/91/06/409479106.db2.gz	FVBQVIYBIXTDTR-PHIMTYICSA-N	1	1	309.370	1.604	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000408134003	164238032	/nfs/dbraw/zinc/23/80/32/164238032.db2.gz	QLMRGRZZNWPFAP-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000408134003	164238034	/nfs/dbraw/zinc/23/80/34/164238034.db2.gz	QLMRGRZZNWPFAP-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000408134003	164238036	/nfs/dbraw/zinc/23/80/36/164238036.db2.gz	QLMRGRZZNWPFAP-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
CC(C)CN(CC[NH+](C)C)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356780517	409600027	/nfs/dbraw/zinc/60/00/27/409600027.db2.gz	RMFWDDQNRFNOHD-UHFFFAOYSA-N	1	1	309.366	1.960	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c1	ZINC000356834954	409646180	/nfs/dbraw/zinc/64/61/80/409646180.db2.gz	BYWYKLKPYZOIHW-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1	ZINC000356834954	409646186	/nfs/dbraw/zinc/64/61/86/409646186.db2.gz	BYWYKLKPYZOIHW-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000331596393	409674374	/nfs/dbraw/zinc/67/43/74/409674374.db2.gz	UCNSFDSJZCGBFG-UONOGXRCSA-N	1	1	312.370	1.043	20	5		DDBDMO
C[N@@H+](CCNc1ccc2ncc([N+](=O)[O-])n2n1)C1CCCCC1	ZINC000357180643	409924411	/nfs/dbraw/zinc/92/44/11/409924411.db2.gz	GSVLGISCUAHOJO-UHFFFAOYSA-N	1	1	318.381	2.314	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CC[N@@H+](C3CC3)C2)c1	ZINC000354623293	409975106	/nfs/dbraw/zinc/97/51/06/409975106.db2.gz	MBAQRRFIYKJIDQ-JTQLQIEISA-N	1	1	311.363	1.110	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000354623293	409975113	/nfs/dbraw/zinc/97/51/13/409975113.db2.gz	MBAQRRFIYKJIDQ-JTQLQIEISA-N	1	1	311.363	1.110	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC(=O)NC1CC1	ZINC000338354325	409935331	/nfs/dbraw/zinc/93/53/31/409935331.db2.gz	KATQECZMFSUYRB-UHFFFAOYSA-N	1	1	320.349	1.057	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC(=O)NC1CC1	ZINC000338354325	409935336	/nfs/dbraw/zinc/93/53/36/409935336.db2.gz	KATQECZMFSUYRB-UHFFFAOYSA-N	1	1	320.349	1.057	20	5		DDBDMO
C[C@H]1CN(c2ncnc3sc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000343024202	410081774	/nfs/dbraw/zinc/08/17/74/410081774.db2.gz	DDGHKDFASFCQEC-VIFPVBQESA-N	1	1	323.378	1.102	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000357701773	410196602	/nfs/dbraw/zinc/19/66/02/410196602.db2.gz	XSIILHYNWIWGGS-GXSJLCMTSA-N	1	1	308.338	1.671	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000339620086	410334992	/nfs/dbraw/zinc/33/49/92/410334992.db2.gz	TZQQXFLKQKIVPJ-BETUJISGSA-N	1	1	320.393	1.866	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000351963927	410375618	/nfs/dbraw/zinc/37/56/18/410375618.db2.gz	IIOHUWIVMVKKQP-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000355351922	410462734	/nfs/dbraw/zinc/46/27/34/410462734.db2.gz	UYRLUIOKSDHMQK-GJZGRUSLSA-N	1	1	319.361	1.530	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000343525036	410508342	/nfs/dbraw/zinc/50/83/42/410508342.db2.gz	LSZZEVSEIMJNMJ-ZYHUDNBSSA-N	1	1	307.350	1.816	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000343612963	410571949	/nfs/dbraw/zinc/57/19/49/410571949.db2.gz	QCVLGYBJAQXARA-CQSZACIVSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cn3)CC2)CCO1	ZINC000301095792	410656024	/nfs/dbraw/zinc/65/60/24/410656024.db2.gz	NKNCEVFAGDVEPZ-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000353010703	410733801	/nfs/dbraw/zinc/73/38/01/410733801.db2.gz	WRVJOVSIUGQWEZ-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000353010703	410733813	/nfs/dbraw/zinc/73/38/13/410733813.db2.gz	WRVJOVSIUGQWEZ-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000353205190	410851115	/nfs/dbraw/zinc/85/11/15/410851115.db2.gz	OVFIVLSTNXZBLK-LLVKDONJSA-N	1	1	323.349	1.860	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000366126626	418430685	/nfs/dbraw/zinc/43/06/85/418430685.db2.gz	NURIXZWEIIGTIJ-YPMHNXCESA-N	1	1	304.350	1.689	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(c2c([N+](=O)[O-])c(C)nn2CC)CC1	ZINC000192604596	418524967	/nfs/dbraw/zinc/52/49/67/418524967.db2.gz	JMSIIPJKZAJAIE-LBPRGKRZSA-N	1	1	311.386	1.013	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000192626500	418525428	/nfs/dbraw/zinc/52/54/28/418525428.db2.gz	UUWFMFUBUSCJAE-CYBMUJFWSA-N	1	1	323.397	1.278	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]21	ZINC000375015955	418589491	/nfs/dbraw/zinc/58/94/91/418589491.db2.gz	DHABDNAWXQEBJG-NHYWBVRUSA-N	1	1	318.377	1.220	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]21	ZINC000375052763	418596342	/nfs/dbraw/zinc/59/63/42/418596342.db2.gz	ZLZVUUFUZYGOEC-YGRLFVJLSA-N	1	1	304.350	1.224	20	5		DDBDMO
COCC[C@@H]1COCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000291327647	222315867	/nfs/dbraw/zinc/31/58/67/222315867.db2.gz	VIGCKJXSPMOLMP-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
COCC[C@@H]1COCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000291327647	222315868	/nfs/dbraw/zinc/31/58/68/222315868.db2.gz	VIGCKJXSPMOLMP-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000367836210	418643389	/nfs/dbraw/zinc/64/33/89/418643389.db2.gz	RTQOLCUZXMFHDJ-JIMOISOXSA-N	1	1	303.318	1.250	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N2CC[N@@H+]3CCOC[C@H]3C2)s1	ZINC000367799440	418637233	/nfs/dbraw/zinc/63/72/33/418637233.db2.gz	BFXKEVPRTWMVAM-SECBINFHSA-N	1	1	321.362	1.120	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N2CC[N@H+]3CCOC[C@H]3C2)s1	ZINC000367799440	418637236	/nfs/dbraw/zinc/63/72/36/418637236.db2.gz	BFXKEVPRTWMVAM-SECBINFHSA-N	1	1	321.362	1.120	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(NCCC[NH+]3CCOCC3)c21	ZINC000347398279	418638740	/nfs/dbraw/zinc/63/87/40/418638740.db2.gz	IHKPXWGEZTYGIM-UHFFFAOYSA-N	1	1	317.349	1.672	20	5		DDBDMO
C[C@H]1COCCN1CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375610813	418661633	/nfs/dbraw/zinc/66/16/33/418661633.db2.gz	HDTQXXZUGZGHKB-UONOGXRCSA-N	1	1	323.397	1.149	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000385849878	418737977	/nfs/dbraw/zinc/73/79/77/418737977.db2.gz	XKTKIJCYDLWFLX-OLZOCXBDSA-N	1	1	307.350	1.287	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000372470061	418873844	/nfs/dbraw/zinc/87/38/44/418873844.db2.gz	CZNCTTYBUZLTBH-MNOVXSKESA-N	1	1	305.334	1.657	20	5		DDBDMO
COc1c(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000425057728	228357200	/nfs/dbraw/zinc/35/72/00/228357200.db2.gz	BLXZZEPFJKCQNB-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@@H]2CCO)c1	ZINC000426254577	419420305	/nfs/dbraw/zinc/42/03/05/419420305.db2.gz	DZLRASKILOYYJZ-OCCSQVGLSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)C[C@H]1CCC[N@H+]1C	ZINC000421009412	419446911	/nfs/dbraw/zinc/44/69/11/419446911.db2.gz	QAXQJPDJGVWYRK-SWLSCSKDSA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1cc(CNCC(F)(F)C[NH3+])c([N+](=O)[O-])cc1OC	ZINC000414928216	419879253	/nfs/dbraw/zinc/87/92/53/419879253.db2.gz	LZHBZRSCPNZQQC-UHFFFAOYSA-N	1	1	305.281	1.296	20	5		DDBDMO
COc1ccc(NC(=O)[C@H]2CC[NH2+]CC2(F)F)cc1[N+](=O)[O-]	ZINC000423726847	420144487	/nfs/dbraw/zinc/14/44/87/420144487.db2.gz	QBLGPUKTIDUCLU-SECBINFHSA-N	1	1	315.276	1.787	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420381744	420251014	/nfs/dbraw/zinc/25/10/14/420251014.db2.gz	ZJHWHSGTCDHDCS-HSMVNMDESA-N	1	1	320.393	1.900	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000416287330	420306926	/nfs/dbraw/zinc/30/69/26/420306926.db2.gz	BWMOFCMSGNHBCZ-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000416287330	420306927	/nfs/dbraw/zinc/30/69/27/420306927.db2.gz	BWMOFCMSGNHBCZ-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000420802937	420396307	/nfs/dbraw/zinc/39/63/07/420396307.db2.gz	SMTSJETYNHFPAC-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccc([N+](=O)[O-])c(N)c1F	ZINC000443415748	230009430	/nfs/dbraw/zinc/00/94/30/230009430.db2.gz	GQWBXBYQPLANDO-UHFFFAOYSA-N	1	1	300.334	1.696	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439174040	420499730	/nfs/dbraw/zinc/49/97/30/420499730.db2.gz	YEJPJNVEZHADIP-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
CC(C)(C(=O)NCC[N@H+]1CCCC1(C)C)n1cc([N+](=O)[O-])cn1	ZINC000457071755	420602890	/nfs/dbraw/zinc/60/28/90/420602890.db2.gz	IHDMBFBQZURILT-UHFFFAOYSA-N	1	1	323.397	1.517	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCN1CC[N@@H+](C)C(C)(C)C1	ZINC000440652386	420593838	/nfs/dbraw/zinc/59/38/38/420593838.db2.gz	MSSGTUOTSRAESZ-UHFFFAOYSA-N	1	1	324.429	1.558	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000452068431	420620365	/nfs/dbraw/zinc/62/03/65/420620365.db2.gz	NYJKOKVLTPWQKH-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](CO)[C@H]3CCCO3)nc2c1	ZINC000447902565	420813280	/nfs/dbraw/zinc/81/32/80/420813280.db2.gz	FKGKRJNAFDZGLW-VXGBXAGGSA-N	1	1	307.306	1.366	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000448946431	420919960	/nfs/dbraw/zinc/91/99/60/420919960.db2.gz	NQGFJHSGKAWBDT-SECBINFHSA-N	1	1	311.313	1.519	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000448946431	420919962	/nfs/dbraw/zinc/91/99/62/420919962.db2.gz	NQGFJHSGKAWBDT-SECBINFHSA-N	1	1	311.313	1.519	20	5		DDBDMO
Cc1c(CNC(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000454849591	420933214	/nfs/dbraw/zinc/93/32/14/420933214.db2.gz	FPHZWXRTWUEYDD-HIFRSBDPSA-N	1	1	318.377	1.749	20	5		DDBDMO
CNc1nc(C(=O)N(C)CC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000456071494	421095885	/nfs/dbraw/zinc/09/58/85/421095885.db2.gz	RZYVEFVZDJANDL-UHFFFAOYSA-N	1	1	307.354	1.198	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000455810273	421065007	/nfs/dbraw/zinc/06/50/07/421065007.db2.gz	KREITOCPLSASEX-MNOVXSKESA-N	1	1	319.365	1.340	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000449746132	421073140	/nfs/dbraw/zinc/07/31/40/421073140.db2.gz	QGTDGNSTARXLME-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000449746132	421073143	/nfs/dbraw/zinc/07/31/43/421073143.db2.gz	QGTDGNSTARXLME-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455906631	421075408	/nfs/dbraw/zinc/07/54/08/421075408.db2.gz	GLAYHKVWDQNKHC-PWSUYJOCSA-N	1	1	321.381	1.490	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC000523685365	421246343	/nfs/dbraw/zinc/24/63/43/421246343.db2.gz	UGSGVNSUUSFOLY-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
CC(C)Oc1nc(N[C@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565850	422350744	/nfs/dbraw/zinc/35/07/44/422350744.db2.gz	ISIVTQRRTQGGBC-DGCLKSJQSA-N	1	1	324.381	1.908	20	5		DDBDMO
CC(C)Oc1nc(N[C@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565850	422350747	/nfs/dbraw/zinc/35/07/47/422350747.db2.gz	ISIVTQRRTQGGBC-DGCLKSJQSA-N	1	1	324.381	1.908	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000598465465	422395880	/nfs/dbraw/zinc/39/58/80/422395880.db2.gz	NNMGZXBCBSZONS-UHFFFAOYSA-N	1	1	323.397	1.882	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1ccncc1)c1ccccc1[N+](=O)[O-]	ZINC000342287102	271366719	/nfs/dbraw/zinc/36/67/19/271366719.db2.gz	WWVNKYRRXKULEH-NSHDSACASA-N	1	1	300.318	1.701	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000344910192	272139155	/nfs/dbraw/zinc/13/91/55/272139155.db2.gz	KDPIFTVKMYOAHF-LLVKDONJSA-N	1	1	322.365	1.018	20	5		DDBDMO
C[C@@H]1CCNC(=O)[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332215414	274305304	/nfs/dbraw/zinc/30/53/04/274305304.db2.gz	WPRQSTJYAHDYLW-OQPBUACISA-N	1	1	303.322	1.085	20	5		DDBDMO
C[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302389625	274364881	/nfs/dbraw/zinc/36/48/81/274364881.db2.gz	IAQXHKNQJDIXJH-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CCC[N@H+](CCO)CC1	ZINC000450313217	275039614	/nfs/dbraw/zinc/03/96/14/275039614.db2.gz	KNRLWLCGETYOEX-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
C[N@@H+]1CCCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1	ZINC000157108711	277052071	/nfs/dbraw/zinc/05/20/71/277052071.db2.gz	NGZWNDRFCXUQLV-UHFFFAOYSA-N	1	1	317.342	1.060	20	5		DDBDMO
C[N@H+]1CCCN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC1	ZINC000157108711	277052073	/nfs/dbraw/zinc/05/20/73/277052073.db2.gz	NGZWNDRFCXUQLV-UHFFFAOYSA-N	1	1	317.342	1.060	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCN1CCCC1	ZINC000089898169	281027198	/nfs/dbraw/zinc/02/71/98/281027198.db2.gz	PIIJHOKKEGLXMA-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCN1CCCC1	ZINC000089898169	281027200	/nfs/dbraw/zinc/02/72/00/281027200.db2.gz	PIIJHOKKEGLXMA-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O	ZINC000324328975	298262972	/nfs/dbraw/zinc/26/29/72/298262972.db2.gz	ZUPOSDWQEPGQOV-LBPRGKRZSA-N	1	1	320.349	1.006	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000354022928	298342277	/nfs/dbraw/zinc/34/22/77/298342277.db2.gz	VBPRSKXRRZPYJB-UHFFFAOYSA-N	1	1	317.349	1.462	20	5		DDBDMO
CC[NH+]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000362831308	300153859	/nfs/dbraw/zinc/15/38/59/300153859.db2.gz	PGRFXDYQZSIJMX-UHFFFAOYSA-N	1	1	303.322	1.787	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000364020015	300335518	/nfs/dbraw/zinc/33/55/18/300335518.db2.gz	XKXIWJXPHMZODY-NWDGAFQWSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000368804893	301090270	/nfs/dbraw/zinc/09/02/70/301090270.db2.gz	JTJXZFHMJMFIFD-OLZOCXBDSA-N	1	1	309.391	1.494	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)CC12CC2	ZINC000369007170	301118291	/nfs/dbraw/zinc/11/82/91/301118291.db2.gz	GRHCOKNDLRSWQB-DGCLKSJQSA-N	1	1	320.349	1.524	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000369800029	301226509	/nfs/dbraw/zinc/22/65/09/301226509.db2.gz	QULYFLJBAYXYFX-HUUCEWRRSA-N	1	1	324.381	1.451	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000369800029	301226512	/nfs/dbraw/zinc/22/65/12/301226512.db2.gz	QULYFLJBAYXYFX-HUUCEWRRSA-N	1	1	324.381	1.451	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](CC(N)=O)C1	ZINC000377604872	302196916	/nfs/dbraw/zinc/19/69/16/302196916.db2.gz	JTLIBOBPEWBVQI-WDEREUQCSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000377604872	302196919	/nfs/dbraw/zinc/19/69/19/302196919.db2.gz	JTLIBOBPEWBVQI-WDEREUQCSA-N	1	1	320.349	1.119	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000377647964	302203041	/nfs/dbraw/zinc/20/30/41/302203041.db2.gz	WDRJPONZGXIKBW-AWEZNQCLSA-N	1	1	307.350	1.320	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CCOCC1	ZINC000532988800	303303735	/nfs/dbraw/zinc/30/37/35/303303735.db2.gz	HAZOSWWXWGVMSN-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](c2ccncn2)C1	ZINC000363496452	307029674	/nfs/dbraw/zinc/02/96/74/307029674.db2.gz	PZCDQEPXOXMIQY-NSHDSACASA-N	1	1	302.338	1.498	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](c2ccncn2)C1	ZINC000363496452	307029675	/nfs/dbraw/zinc/02/96/75/307029675.db2.gz	PZCDQEPXOXMIQY-NSHDSACASA-N	1	1	302.338	1.498	20	5		DDBDMO
Cc1nn(C)c(N2CC[NH+]([C@@H]3CCSC3)CC2)c1[N+](=O)[O-]	ZINC000364008619	307039732	/nfs/dbraw/zinc/03/97/32/307039732.db2.gz	IBIXMTBRFYSZSB-LLVKDONJSA-N	1	1	311.411	1.264	20	5		DDBDMO
Cn1nccc1CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000367251988	307089828	/nfs/dbraw/zinc/08/98/28/307089828.db2.gz	KGQMPTCMFRULJQ-CYBMUJFWSA-N	1	1	304.354	1.404	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN2CC[NH+]([C@H]3CCOC3)CC2)c1	ZINC000367413796	307092646	/nfs/dbraw/zinc/09/26/46/307092646.db2.gz	WHPMIYMUABUIBG-JKSUJKDBSA-N	1	1	321.377	1.035	20	5		DDBDMO
CC[N@H+]1CCCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC1	ZINC000367442730	307093630	/nfs/dbraw/zinc/09/36/30/307093630.db2.gz	KGZHLONKWASHDB-UHFFFAOYSA-N	1	1	317.349	1.776	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000378496202	307289840	/nfs/dbraw/zinc/28/98/40/307289840.db2.gz	MSWJLAFXDJTAKL-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000571870728	308205078	/nfs/dbraw/zinc/20/50/78/308205078.db2.gz	QATPCYWYRRBUBY-JTQLQIEISA-N	1	1	304.350	1.590	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000154398385	527313745	/nfs/dbraw/zinc/31/37/45/527313745.db2.gz	DWVCBCMWPDXPEA-SWLSCSKDSA-N	1	1	318.377	1.855	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000157918744	527414216	/nfs/dbraw/zinc/41/42/16/527414216.db2.gz	WUFWFEURDZEYAX-CQSZACIVSA-N	1	1	301.350	1.978	20	5		DDBDMO
CCOc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000419007322	528313264	/nfs/dbraw/zinc/31/32/64/528313264.db2.gz	RKITYCALSFULKG-OLZOCXBDSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H](C)CO	ZINC000292859286	528401115	/nfs/dbraw/zinc/40/11/15/528401115.db2.gz	ACLJBZCRDILFNY-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
CCOCC[C@@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000444657234	528863736	/nfs/dbraw/zinc/86/37/36/528863736.db2.gz	KBVXXSFWOBKWDQ-TZMCWYRMSA-N	1	1	324.381	1.264	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000820715715	599084451	/nfs/dbraw/zinc/08/44/51/599084451.db2.gz	DNGHYCJVMXTLAG-SNVBAGLBSA-N	1	1	317.353	1.671	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](CCC(N)=O)C2)c(C)c1[N+](=O)[O-]	ZINC000066080631	696349564	/nfs/dbraw/zinc/34/95/64/696349564.db2.gz	UZSLIOHCCPPFSB-GFCCVEGCSA-N	1	1	309.370	1.343	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](CCC(N)=O)C2)c(C)c1[N+](=O)[O-]	ZINC000066080631	696349567	/nfs/dbraw/zinc/34/95/67/696349567.db2.gz	UZSLIOHCCPPFSB-GFCCVEGCSA-N	1	1	309.370	1.343	20	5		DDBDMO
CC1(C)C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000066528461	696353304	/nfs/dbraw/zinc/35/33/04/696353304.db2.gz	AUOXVVVXZYRRER-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC1(C)C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000066528461	696353305	/nfs/dbraw/zinc/35/33/05/696353305.db2.gz	AUOXVVVXZYRRER-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](C)C1	ZINC000108327195	696633467	/nfs/dbraw/zinc/63/34/67/696633467.db2.gz	FVNOKZRDCBOYIB-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
CCC(CC)(C[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000124068646	696738623	/nfs/dbraw/zinc/73/86/23/696738623.db2.gz	UHBZTNXTIVIUBP-UHFFFAOYSA-N	1	1	319.358	1.530	20	5		DDBDMO
CC(=O)N1C[C@]2(C)C[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C[C@]2(C)C1	ZINC000982177094	697049520	/nfs/dbraw/zinc/04/95/20/697049520.db2.gz	DBUJYPIHYFWUQD-GASCZTMLSA-N	1	1	321.381	1.019	20	5		DDBDMO
CC(=O)N1C[C@]2(C)C[N@H+](Cc3c([N+](=O)[O-])ncn3C)C[C@]2(C)C1	ZINC000982177094	697049523	/nfs/dbraw/zinc/04/95/23/697049523.db2.gz	DBUJYPIHYFWUQD-GASCZTMLSA-N	1	1	321.381	1.019	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCS[C@H]3COCC[C@H]32)cc1	ZINC000776587133	698122517	/nfs/dbraw/zinc/12/25/17/698122517.db2.gz	ULYPECVAELXWFB-KFWWJZLASA-N	1	1	324.402	1.835	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCC[C@H]2C2OCCO2)c1	ZINC000750055116	700201583	/nfs/dbraw/zinc/20/15/83/700201583.db2.gz	ZBWKEYCIZCSWMO-GJZGRUSLSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC[C@H]2C2OCCO2)c1	ZINC000750055116	700201586	/nfs/dbraw/zinc/20/15/86/700201586.db2.gz	ZBWKEYCIZCSWMO-GJZGRUSLSA-N	1	1	322.361	1.856	20	5		DDBDMO
CO[C@@H]1C[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@H]1C	ZINC000783969074	698896392	/nfs/dbraw/zinc/89/63/92/698896392.db2.gz	RYPGQAHNVPSBMJ-QMTHXVAHSA-N	1	1	319.365	1.962	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@H]1C	ZINC000783969074	698896397	/nfs/dbraw/zinc/89/63/97/698896397.db2.gz	RYPGQAHNVPSBMJ-QMTHXVAHSA-N	1	1	319.365	1.962	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNc2ccc(N)cc2[N+](=O)[O-])C1	ZINC000786574200	699155354	/nfs/dbraw/zinc/15/53/54/699155354.db2.gz	LOQKEAGAEWTPPH-CYBMUJFWSA-N	1	1	308.382	1.946	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H](C)[NH+]1CCOCC1	ZINC000729469404	699479540	/nfs/dbraw/zinc/47/95/40/699479540.db2.gz	GINYIKKKAWDNCV-VXGBXAGGSA-N	1	1	319.365	1.764	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000801552131	700319712	/nfs/dbraw/zinc/31/97/12/700319712.db2.gz	ZJUTUNPUVVKBJF-LBPRGKRZSA-N	1	1	300.330	1.952	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000801552131	700319715	/nfs/dbraw/zinc/31/97/15/700319715.db2.gz	ZJUTUNPUVVKBJF-LBPRGKRZSA-N	1	1	300.330	1.952	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@@H+](C)[C@H](C)C1	ZINC000761076616	700840120	/nfs/dbraw/zinc/84/01/20/700840120.db2.gz	HXNGGVZQCFUJEI-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C)C1	ZINC000761076616	700840122	/nfs/dbraw/zinc/84/01/22/700840122.db2.gz	HXNGGVZQCFUJEI-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C)[C@H](C)C1	ZINC000761076616	700840124	/nfs/dbraw/zinc/84/01/24/700840124.db2.gz	HXNGGVZQCFUJEI-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1cnn(C)n1	ZINC000806167202	701428483	/nfs/dbraw/zinc/42/84/83/701428483.db2.gz	OHEVXYFZAVVCRO-JTQLQIEISA-N	1	1	318.337	1.230	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839636466	701761880	/nfs/dbraw/zinc/76/18/80/701761880.db2.gz	SPONLTJVRYZFJT-GXTWGEPZSA-N	1	1	307.350	1.038	20	5		DDBDMO
COC(=O)[C@]1(C)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839668351	701773627	/nfs/dbraw/zinc/77/36/27/701773627.db2.gz	ZRGXFQMRYHLJCZ-GDBMZVCRSA-N	1	1	322.361	1.903	20	5		DDBDMO
CSc1ccc([C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+](C)C)cc1	ZINC000839780911	701824316	/nfs/dbraw/zinc/82/43/16/701824316.db2.gz	YOHPHKROOHPNDY-MCIONIFRSA-N	1	1	323.418	1.793	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](CCC(F)(F)F)CC1	ZINC000840474764	702124307	/nfs/dbraw/zinc/12/43/07/702124307.db2.gz	MOYOBGRHAWYDPT-GHMZBOCLSA-N	1	1	323.315	1.527	20	5		DDBDMO
CC[N@@H+](Cn1nc(C)c2cc([N+](=O)[O-])cnc21)[C@@H]1CCOC1	ZINC000812297267	702141069	/nfs/dbraw/zinc/14/10/69/702141069.db2.gz	WQXTXTHDIPRSAG-LLVKDONJSA-N	1	1	305.338	1.716	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000816952049	702235033	/nfs/dbraw/zinc/23/50/33/702235033.db2.gz	BEMWUXMHGRUYJB-SDBXPKJASA-N	1	1	308.313	1.092	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000879533662	706710819	/nfs/dbraw/zinc/71/08/19/706710819.db2.gz	IOJLESWFFJSPPJ-JLLWLGSASA-N	1	1	303.318	1.202	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000879576441	706724635	/nfs/dbraw/zinc/72/46/35/706724635.db2.gz	SCGJMWIDCQPDKF-TZMCWYRMSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000848766666	703586156	/nfs/dbraw/zinc/58/61/56/703586156.db2.gz	UBGWMTJYEGXZIM-NWDGAFQWSA-N	1	1	311.769	1.812	20	5		DDBDMO
COC(=O)N1CC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000850446280	703731665	/nfs/dbraw/zinc/73/16/65/703731665.db2.gz	RGBMBQRYFASPMT-VIFPVBQESA-N	1	1	309.322	1.705	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)N1	ZINC000852298426	704001225	/nfs/dbraw/zinc/00/12/25/704001225.db2.gz	ZTBKXOMUWWTWNK-HNNXBMFYSA-N	1	1	317.345	1.498	20	5		DDBDMO
CN(C)c1cc[nH+]cc1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000819905310	704184322	/nfs/dbraw/zinc/18/43/22/704184322.db2.gz	MHMQTELCDFGNDM-UHFFFAOYSA-N	1	1	301.306	1.890	20	5		DDBDMO
O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@@H+]1CC[C@H]2C[C@H]2C1	ZINC000853579788	704274773	/nfs/dbraw/zinc/27/47/73/704274773.db2.gz	ZVPNYMCJAFZBGF-RYUDHWBXSA-N	1	1	316.317	1.711	20	5		DDBDMO
O=c1oc(-c2ccc([N+](=O)[O-])cc2)nn1C[N@H+]1CC[C@H]2C[C@H]2C1	ZINC000853579788	704274775	/nfs/dbraw/zinc/27/47/75/704274775.db2.gz	ZVPNYMCJAFZBGF-RYUDHWBXSA-N	1	1	316.317	1.711	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC000823100737	705139640	/nfs/dbraw/zinc/13/96/40/705139640.db2.gz	IHNCATLRNQNNMQ-JSGCOSHPSA-N	1	1	303.362	1.988	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000861718168	705549613	/nfs/dbraw/zinc/54/96/13/705549613.db2.gz	WMWSWAOTWQTABW-NWDGAFQWSA-N	1	1	323.324	1.015	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](N2CCOC2=O)C1	ZINC000827000805	705910490	/nfs/dbraw/zinc/91/04/90/705910490.db2.gz	OXOIFLVBRBOJBG-CQSZACIVSA-N	1	1	305.334	1.930	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@](C)(C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000877578329	706147663	/nfs/dbraw/zinc/14/76/63/706147663.db2.gz	BCMXQGHJJDMNPM-HNNXBMFYSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@](C)(C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000877578329	706147666	/nfs/dbraw/zinc/14/76/66/706147666.db2.gz	BCMXQGHJJDMNPM-HNNXBMFYSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](c2ccccn2)C1	ZINC000878553787	706425886	/nfs/dbraw/zinc/42/58/86/706425886.db2.gz	RUNVCLBSDZQOJO-CYBMUJFWSA-N	1	1	301.350	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](O)C(F)(F)F)c2c1	ZINC000865474553	706440753	/nfs/dbraw/zinc/44/07/53/706440753.db2.gz	JXGIJEBOOQDAFG-NSHDSACASA-N	1	1	301.224	1.900	20	5		DDBDMO
Cc1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000865705725	706500916	/nfs/dbraw/zinc/50/09/16/706500916.db2.gz	YNFGCBUMJWUILA-OAHLLOKOSA-N	1	1	304.350	1.634	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCCN2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)c1	ZINC000880070959	706870488	/nfs/dbraw/zinc/87/04/88/706870488.db2.gz	PCQZZXUEPJCSCS-LSDHHAIUSA-N	1	1	321.377	1.115	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000832359080	706897044	/nfs/dbraw/zinc/89/70/44/706897044.db2.gz	BTCDHDOMXOUJHS-RISCZKNCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000832359080	706897046	/nfs/dbraw/zinc/89/70/46/706897046.db2.gz	BTCDHDOMXOUJHS-RISCZKNCSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000882021657	707469514	/nfs/dbraw/zinc/46/95/14/707469514.db2.gz	FKIJGZALXFFXHH-LLVKDONJSA-N	1	1	310.329	1.287	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2cnn(C[N@H+]3C[C@@H]4COC[C@@H]4C3)c2)c1	ZINC000872785478	707601293	/nfs/dbraw/zinc/60/12/93/707601293.db2.gz	CWOYCBOQCUYZOP-GASCZTMLSA-N	1	1	314.345	1.994	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000837546723	707678076	/nfs/dbraw/zinc/67/80/76/707678076.db2.gz	MKKLHSKAAZFPTQ-UHFFFAOYSA-N	1	1	317.349	1.153	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000838144214	707853602	/nfs/dbraw/zinc/85/36/02/707853602.db2.gz	LGJXOXWFPNVIKJ-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000896650209	708108280	/nfs/dbraw/zinc/10/82/80/708108280.db2.gz	CXLCCTQLXNOYHE-ZDUSSCGKSA-N	1	1	320.393	1.860	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897219633	708257226	/nfs/dbraw/zinc/25/72/26/708257226.db2.gz	MEXGMYHIKGALJH-STQMWFEESA-N	1	1	322.365	1.034	20	5		DDBDMO
Cc1cc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)ncc1[N+](=O)[O-]	ZINC000897220418	708258581	/nfs/dbraw/zinc/25/85/81/708258581.db2.gz	AYBTWJRBMLILOM-STQMWFEESA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1cc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897222105	708260066	/nfs/dbraw/zinc/26/00/66/708260066.db2.gz	RPKBHMHOVNLVHC-JKSUJKDBSA-N	1	1	305.378	1.939	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000897222718	708260431	/nfs/dbraw/zinc/26/04/31/708260431.db2.gz	XANUFHXQVMLLHZ-QWHCGFSZSA-N	1	1	309.341	1.769	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3C[C@]34CCOC4)C2)nc1	ZINC000886067096	708691516	/nfs/dbraw/zinc/69/15/16/708691516.db2.gz	HFLYJRLAWYNQBR-IOASZLSFSA-N	1	1	318.377	1.903	20	5		DDBDMO
CN(CCCN1CC[NH+](C)CC1)Cc1cccnc1[N+](=O)[O-]	ZINC000886091627	708696670	/nfs/dbraw/zinc/69/66/70/708696670.db2.gz	FEQWTROOAGTZOE-UHFFFAOYSA-N	1	1	307.398	1.059	20	5		DDBDMO
C[C@@H]1CN(Cc2cccnc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000886160426	708708043	/nfs/dbraw/zinc/70/80/43/708708043.db2.gz	SVLJNRVOFCZLAZ-GFCCVEGCSA-N	1	1	308.382	1.267	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(Cc2cccnc2[N+](=O)[O-])C[C@@H]1C	ZINC000886265729	708732481	/nfs/dbraw/zinc/73/24/81/708732481.db2.gz	PYERCQJQTKIUPW-BETUJISGSA-N	1	1	308.382	1.531	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]([C@@H]2CCCO2)C1	ZINC000886823105	708854316	/nfs/dbraw/zinc/85/43/16/708854316.db2.gz	ZAIWXAMQLVNYLE-JSGCOSHPSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=C(N1CCc2ccc([N+](=O)[O-])cc21)[C@@]12CC[N@@H+](C1)CCC2	ZINC000900099279	709288553	/nfs/dbraw/zinc/28/85/53/709288553.db2.gz	OQCWYZXBUQQPBC-INIZCTEOSA-N	1	1	301.346	1.970	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC[C@@H]2[C@@H](C)C[NH+](C)C)c1[N+](=O)[O-]	ZINC000912811833	713098559	/nfs/dbraw/zinc/09/85/59/713098559.db2.gz	ORXQGARZATYAPZ-CMPLNLGQSA-N	1	1	323.397	1.819	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccnc(NC)c2[N+](=O)[O-])[C@H](C)C1	ZINC000910273648	709857350	/nfs/dbraw/zinc/85/73/50/709857350.db2.gz	KBFMWMNHJHPGRK-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000892678984	710480477	/nfs/dbraw/zinc/48/04/77/710480477.db2.gz	AQCNVRMTYARDIT-GFCCVEGCSA-N	1	1	322.365	1.157	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000928445235	713199260	/nfs/dbraw/zinc/19/92/60/713199260.db2.gz	PQLCXAPPUCZAIA-BXUZGUMPSA-N	1	1	316.361	1.758	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2	ZINC000928574399	713234630	/nfs/dbraw/zinc/23/46/30/713234630.db2.gz	VDYNTXUSBPYCPZ-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2	ZINC000928574399	713234631	/nfs/dbraw/zinc/23/46/31/713234631.db2.gz	VDYNTXUSBPYCPZ-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC000894686699	711238505	/nfs/dbraw/zinc/23/85/05/711238505.db2.gz	ARUBDDFGDXGKMP-NEPJUHHUSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1CO	ZINC000894884924	711307853	/nfs/dbraw/zinc/30/78/53/711307853.db2.gz	LYMBOQPYBFKPHG-JTQLQIEISA-N	1	1	308.363	1.317	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1CO	ZINC000894884924	711307857	/nfs/dbraw/zinc/30/78/57/711307857.db2.gz	LYMBOQPYBFKPHG-JTQLQIEISA-N	1	1	308.363	1.317	20	5		DDBDMO
COc1cc(N[C@H]2Cc3c[nH+]cn3C2)c([N+](=O)[O-])cc1OC	ZINC000894995786	711356593	/nfs/dbraw/zinc/35/65/93/711356593.db2.gz	GCOLXIWLUNDUML-VIFPVBQESA-N	1	1	304.306	1.845	20	5		DDBDMO
C[C@@H](Nc1nc2sccn2c1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895247163	711464874	/nfs/dbraw/zinc/46/48/74/711464874.db2.gz	FEOHBFKRLSFPLT-ZJUUUORDSA-N	1	1	324.410	1.350	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NCc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC000895438343	711512649	/nfs/dbraw/zinc/51/26/49/711512649.db2.gz	PFGYUVDKWMOPPQ-LBPRGKRZSA-N	1	1	309.366	1.883	20	5		DDBDMO
CCCN1CC[C@H]([NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC000895438343	711512650	/nfs/dbraw/zinc/51/26/50/711512650.db2.gz	PFGYUVDKWMOPPQ-LBPRGKRZSA-N	1	1	309.366	1.883	20	5		DDBDMO
Nc1ccc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)nc1[N+](=O)[O-]	ZINC000895567626	711544692	/nfs/dbraw/zinc/54/46/92/711544692.db2.gz	GFEKGOCBMAVIJC-GHMZBOCLSA-N	1	1	309.395	1.564	20	5		DDBDMO
C[C@@H]1[C@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+]1C	ZINC000895735151	711590140	/nfs/dbraw/zinc/59/01/40/711590140.db2.gz	VFKUYKZQOAFIRI-QMTHXVAHSA-N	1	1	318.377	1.992	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000895734801	711590249	/nfs/dbraw/zinc/59/02/49/711590249.db2.gz	AUPOKUSTSAFVKI-KOLCDFICSA-N	1	1	308.338	1.589	20	5		DDBDMO
C[C@H](c1ccc(F)cc1)N1CCC[C@H]([NH2+]CC[N+](=O)[O-])C1=O	ZINC000905274224	711988959	/nfs/dbraw/zinc/98/89/59/711988959.db2.gz	NXQNLRKYQFBAJN-RISCZKNCSA-N	1	1	309.341	1.744	20	5		DDBDMO
O=C(NC1CC2(C1)CC([NH2+]CC1CCCC1)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC000963789777	717907361	/nfs/dbraw/zinc/90/73/61/717907361.db2.gz	ASGXHUYHJKZLAE-KDUKZITGSA-N	1	1	321.421	1.859	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000930093818	713754776	/nfs/dbraw/zinc/75/47/76/713754776.db2.gz	FSKIAVWRHXKTMN-RYUDHWBXSA-N	1	1	301.387	1.888	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2c(=O)[nH]n(C)c2C1	ZINC000931191018	714029928	/nfs/dbraw/zinc/02/99/28/714029928.db2.gz	PAHVCLWLEFBRES-UHFFFAOYSA-N	1	1	318.333	1.601	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2c(=O)[nH]n(C)c2C1	ZINC000931191018	714029930	/nfs/dbraw/zinc/02/99/30/714029930.db2.gz	PAHVCLWLEFBRES-UHFFFAOYSA-N	1	1	318.333	1.601	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000932069675	714251593	/nfs/dbraw/zinc/25/15/93/714251593.db2.gz	FLGPCAXAEUGFFU-AEGPPILISA-N	1	1	303.362	1.909	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000923263029	714288616	/nfs/dbraw/zinc/28/86/16/714288616.db2.gz	GGCYRSHYPLOLQO-UONOGXRCSA-N	1	1	321.352	1.972	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@@H]1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923368375	714330012	/nfs/dbraw/zinc/33/00/12/714330012.db2.gz	BHEBWAGJXUODRC-ZFWWWQNUSA-N	1	1	323.393	1.312	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000932757591	714406739	/nfs/dbraw/zinc/40/67/39/714406739.db2.gz	WWLQRKQZPKEUGI-ZDUSSCGKSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1ccc(CNC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000923910113	714488191	/nfs/dbraw/zinc/48/81/91/714488191.db2.gz	JLDIKBRDZCQZHY-AAEUAGOBSA-N	1	1	306.366	1.795	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1	ZINC000933741794	714660284	/nfs/dbraw/zinc/66/02/84/714660284.db2.gz	HYNAUHPOBDGTCC-CJNGLKHVSA-N	1	1	305.378	1.857	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000934832077	714912739	/nfs/dbraw/zinc/91/27/39/714912739.db2.gz	NIFDRDMJQCTBSO-STQMWFEESA-N	1	1	308.382	1.967	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4cccc([N+](=O)[O-])c4n3)C[C@H]21	ZINC001164664734	719389888	/nfs/dbraw/zinc/38/98/88/719389888.db2.gz	COEQLDSSFIOBFM-KGLIPLIRSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4cccc([N+](=O)[O-])c4n3)C[C@H]21	ZINC001164664736	719390051	/nfs/dbraw/zinc/39/00/51/719390051.db2.gz	COEQLDSSFIOBFM-ZIAGYGMSSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4c(cccc4[N+](=O)[O-])n3)C[C@@H]21	ZINC001164666135	719391085	/nfs/dbraw/zinc/39/10/85/719391085.db2.gz	JJVUPWXEAOJVJT-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001120959087	782257440	/nfs/dbraw/zinc/25/74/40/782257440.db2.gz	FLZNAZYKKRXQIA-WCQYABFASA-N	1	1	308.382	1.650	20	5		DDBDMO
Cc1ccc(CC[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001022063685	734368264	/nfs/dbraw/zinc/36/82/64/734368264.db2.gz	GVZGLOHUHLOBMP-QKPAOTATSA-N	1	1	317.389	1.440	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775895	736853283	/nfs/dbraw/zinc/85/32/83/736853283.db2.gz	PEWWXRGRSYTPRK-LJIZCISZSA-N	1	1	319.405	1.589	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CCC3=CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775895	736853285	/nfs/dbraw/zinc/85/32/85/736853285.db2.gz	PEWWXRGRSYTPRK-LJIZCISZSA-N	1	1	319.405	1.589	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3=CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775895	736853287	/nfs/dbraw/zinc/85/32/87/736853287.db2.gz	PEWWXRGRSYTPRK-LJIZCISZSA-N	1	1	319.405	1.589	20	5		DDBDMO
COC(=O)CC[N@H+](CCCN(C)C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169030386	762186621	/nfs/dbraw/zinc/18/66/21/762186621.db2.gz	ZDLKVPIZLJANCO-ZIAGYGMSSA-N	1	1	315.414	1.249	20	5		DDBDMO
COC(=O)CC[N@@H+](CCCN(C)C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169030386	762186626	/nfs/dbraw/zinc/18/66/26/762186626.db2.gz	ZDLKVPIZLJANCO-ZIAGYGMSSA-N	1	1	315.414	1.249	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)C1	ZINC001169018398	762199176	/nfs/dbraw/zinc/19/91/76/762199176.db2.gz	BDAIJUPTLOVRLH-APIJFGDWSA-N	1	1	317.393	1.290	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086082462	760941930	/nfs/dbraw/zinc/94/19/30/760941930.db2.gz	PGMUUQOWGHFJKP-CQROYNQRSA-N	1	1	321.352	1.475	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001100127243	763148236	/nfs/dbraw/zinc/14/82/36/763148236.db2.gz	CDPYZLGGIKQZIS-UHFFFAOYSA-N	1	1	317.349	1.352	20	5		DDBDMO
CC(C)[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1	ZINC001051291251	764719021	/nfs/dbraw/zinc/71/90/21/764719021.db2.gz	MLWGIYAOKKPXAJ-HZPDHXFCSA-N	1	1	317.389	1.735	20	5		DDBDMO
CC(C)[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1	ZINC001051291251	764719029	/nfs/dbraw/zinc/71/90/29/764719029.db2.gz	MLWGIYAOKKPXAJ-HZPDHXFCSA-N	1	1	317.389	1.735	20	5		DDBDMO
CC(C)[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1	ZINC001051291251	764719033	/nfs/dbraw/zinc/71/90/33/764719033.db2.gz	MLWGIYAOKKPXAJ-HZPDHXFCSA-N	1	1	317.389	1.735	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccnc2c1cccc2[N+](=O)[O-]	ZINC001170343611	766274826	/nfs/dbraw/zinc/27/48/26/766274826.db2.gz	VDYMDDBUVCOBLY-UHFFFAOYSA-N	1	1	313.317	1.844	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1(C)CCCC1	ZINC001132003946	768555694	/nfs/dbraw/zinc/55/56/94/768555694.db2.gz	HKHQSWUHGUTVIO-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
C[NH+](C)CCCC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001133040170	769424786	/nfs/dbraw/zinc/42/47/86/769424786.db2.gz	DODQSJPDQLXXSD-UHFFFAOYSA-N	1	1	314.411	1.204	20	5		DDBDMO
C[NH+]1CCC(C(=O)NCCNCc2ccccc2[N+](=O)[O-])CC1	ZINC001133286018	769665659	/nfs/dbraw/zinc/66/56/59/769665659.db2.gz	SOJYLKNLSQEDNE-UHFFFAOYSA-N	1	1	320.393	1.142	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001136452930	771971931	/nfs/dbraw/zinc/97/19/31/771971931.db2.gz	OAZRPFVUHBUKLF-LLVKDONJSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[N@@H+](CC(=O)NCCCNc1ccccc1[N+](=O)[O-])C1CCC1	ZINC001094853849	776507363	/nfs/dbraw/zinc/50/73/63/776507363.db2.gz	ZJSJWORONOVLBB-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCCO1	ZINC001173231938	777063814	/nfs/dbraw/zinc/06/38/14/777063814.db2.gz	PAVWENMSIMTQIQ-WFASDCNBSA-N	1	1	322.361	1.790	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC(=O)N2CCC[C@@H]2C1	ZINC001173235333	777065142	/nfs/dbraw/zinc/06/51/42/777065142.db2.gz	WEURANYEBVCLFG-SWLSCSKDSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC(=O)N2CCC[C@@H]2C1	ZINC001173235333	777065144	/nfs/dbraw/zinc/06/51/44/777065144.db2.gz	WEURANYEBVCLFG-SWLSCSKDSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cnon1)Cc1cccc([N+](=O)[O-])c1	ZINC001266425527	836235506	/nfs/dbraw/zinc/23/55/06/836235506.db2.gz	RSALXKZSJJBYGB-UHFFFAOYSA-N	1	1	319.321	1.230	20	5		DDBDMO
O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1cocn1	ZINC001268523190	840380548	/nfs/dbraw/zinc/38/05/48/840380548.db2.gz	PTUGCWPMPFSFQY-UPHRSURJSA-N	1	1	322.346	1.720	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001273508315	851042384	/nfs/dbraw/zinc/04/23/84/851042384.db2.gz	ZOCXPWPZYRTVQU-UKRRQHHQSA-N	1	1	323.368	1.771	20	5		DDBDMO
CN(CCC[N@H+](C)Cc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273508315	851042393	/nfs/dbraw/zinc/04/23/93/851042393.db2.gz	ZOCXPWPZYRTVQU-UKRRQHHQSA-N	1	1	323.368	1.771	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273508315	851042402	/nfs/dbraw/zinc/04/24/02/851042402.db2.gz	ZOCXPWPZYRTVQU-UKRRQHHQSA-N	1	1	323.368	1.771	20	5		DDBDMO
COc1nc(NCC2(N(C)C)CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC001156176058	862776674	/nfs/dbraw/zinc/77/66/74/862776674.db2.gz	JDCRNDMPQIGGFA-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Nc2c(C)cncc2[N+](=O)[O-])C1	ZINC001203061435	860685992	/nfs/dbraw/zinc/68/59/92/860685992.db2.gz	OAVJTOQLHCUIBC-LLVKDONJSA-N	1	1	307.354	1.183	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001332403322	865817125	/nfs/dbraw/zinc/81/71/25/865817125.db2.gz	PVVNHMYDBNDLAQ-QMTHXVAHSA-N	1	1	304.350	1.713	20	5		DDBDMO
COc1nc(-n2cc(CC[NH3+])c3cnccc32)ccc1[N+](=O)[O-]	ZINC001160945501	866203956	/nfs/dbraw/zinc/20/39/56/866203956.db2.gz	BXWLQACSUXAEMS-UHFFFAOYSA-N	1	1	313.317	1.839	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C2CCC1(CO)CC2	ZINC001333318372	866631217	/nfs/dbraw/zinc/63/12/17/866631217.db2.gz	ALXXUVNKBLVVBY-UHFFFAOYSA-N	1	1	319.361	1.831	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C2CCC1(CO)CC2	ZINC001333318372	866631223	/nfs/dbraw/zinc/63/12/23/866631223.db2.gz	ALXXUVNKBLVVBY-UHFFFAOYSA-N	1	1	319.361	1.831	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001333874572	867101406	/nfs/dbraw/zinc/10/14/06/867101406.db2.gz	BCYJXLWQOYJSRJ-LBPRGKRZSA-N	1	1	318.377	1.962	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C(C)C)[C@H](C)C2)n1	ZINC001165201865	869424865	/nfs/dbraw/zinc/42/48/65/869424865.db2.gz	QZWFQTZACODGBH-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC([N@H+](C)[C@@H]3CCOC3)C2)n1	ZINC001165205841	869431591	/nfs/dbraw/zinc/43/15/91/869431591.db2.gz	UJFJTIOBIQDIGN-GFCCVEGCSA-N	1	1	306.366	1.516	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC001337533174	869528056	/nfs/dbraw/zinc/52/80/56/869528056.db2.gz	AWCYICGDJKFHPU-LBPRGKRZSA-N	1	1	309.341	1.877	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC)C1	ZINC001339468484	870511331	/nfs/dbraw/zinc/51/13/31/870511331.db2.gz	VPCCTRLFFYPMPB-OLZOCXBDSA-N	1	1	324.429	1.804	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc([N+](=O)[O-])c4nonc43)[C@H]2C1	ZINC001339997593	870829190	/nfs/dbraw/zinc/82/91/90/870829190.db2.gz	DRMXPZKIRXRUST-LPEHRKFASA-N	1	1	303.322	1.883	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001302425864	871067678	/nfs/dbraw/zinc/06/76/78/871067678.db2.gz	SWOPVFVRPZXEAB-HNNXBMFYSA-N	1	1	318.333	1.124	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC001347539443	874179611	/nfs/dbraw/zinc/17/96/11/874179611.db2.gz	KYJTWLVQHSFMKV-ZWKOPEQDSA-N	1	1	307.325	1.804	20	5		DDBDMO
COc1cc2nc(=O)[nH]c(O[C@@H](C)C[N+](C)(C)C)c2cc1OC	ZINC001227283386	882953683	/nfs/dbraw/zinc/95/36/83/882953683.db2.gz	VHCFLZWRGOKRFY-JTQLQIEISA-O	1	1	322.385	1.826	20	5		DDBDMO
C[N@H+]1CCC[C@@H](Oc2[nH]c(=O)nc3cc([N+](=O)[O-])ccc32)C1	ZINC001228242707	883404133	/nfs/dbraw/zinc/40/41/33/883404133.db2.gz	RDCYPXLCQHTGFP-SNVBAGLBSA-N	1	1	304.306	1.717	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(F)c([N+](=O)[O-])c(F)c2)C1	ZINC001233754484	887280487	/nfs/dbraw/zinc/28/04/87/887280487.db2.gz	VDSCBRWLCWWTOF-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
C[N@@H+](CC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[C@@H]1CCSC1	ZINC001253838971	896134919	/nfs/dbraw/zinc/13/49/19/896134919.db2.gz	RIVOTMJYKWWPTQ-CQSZACIVSA-N	1	1	321.402	1.874	20	5		DDBDMO
C[C@H](CN1CC[NH+](C)CC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278590840	214259870	/nfs/dbraw/zinc/25/98/70/214259870.db2.gz	YWZGFEMHFIVVOZ-LLVKDONJSA-N	1	1	318.381	1.519	20	5		DDBDMO
C[C@@]12C[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000451378524	231082056	/nfs/dbraw/zinc/08/20/56/231082056.db2.gz	YCSRAVJDXLUOAI-IPQWEPCOSA-N	1	1	318.377	1.296	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1	ZINC000451306467	231063134	/nfs/dbraw/zinc/06/31/34/231063134.db2.gz	YHKCGJXGGUVPCI-OIISXLGYSA-N	1	1	320.389	1.999	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250334	529444607	/nfs/dbraw/zinc/44/46/07/529444607.db2.gz	IXQRRSOSLGFNBW-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250334	529444610	/nfs/dbraw/zinc/44/46/10/529444610.db2.gz	IXQRRSOSLGFNBW-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000452035170	231276925	/nfs/dbraw/zinc/27/69/25/231276925.db2.gz	GDRVOODIDLLGDF-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000255412258	282255415	/nfs/dbraw/zinc/25/54/15/282255415.db2.gz	OCYDVYZIILYKET-DAXSKMNVSA-N	1	1	319.361	1.399	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000294909810	530057405	/nfs/dbraw/zinc/05/74/05/530057405.db2.gz	ISZNDJHFPILPBG-CQSZACIVSA-N	1	1	319.361	1.768	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000330790439	232070574	/nfs/dbraw/zinc/07/05/74/232070574.db2.gz	SPHCKBAVWPRXFB-TXEJJXNPSA-N	1	1	305.378	1.997	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@@H](O)C(F)(F)F)OCCO2	ZINC000616487248	362721099	/nfs/dbraw/zinc/72/10/99/362721099.db2.gz	FZZHBQAXYHHPOJ-LLVKDONJSA-N	1	1	322.239	1.379	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182026180	199376269	/nfs/dbraw/zinc/37/62/69/199376269.db2.gz	MCVMPSLBXVRTED-AGIUHOORSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182026180	199376270	/nfs/dbraw/zinc/37/62/70/199376270.db2.gz	MCVMPSLBXVRTED-AGIUHOORSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[N@@H+](CCNC(=O)CSc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000067701673	353062447	/nfs/dbraw/zinc/06/24/47/353062447.db2.gz	JCJGPJFNHQVWBV-UHFFFAOYSA-N	1	1	309.391	1.897	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000067703542	353063732	/nfs/dbraw/zinc/06/37/32/353063732.db2.gz	NCFXVYKPHLZRAG-NSHDSACASA-N	1	1	305.334	1.570	20	5		DDBDMO
C[C@@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000077995644	353500741	/nfs/dbraw/zinc/50/07/41/353500741.db2.gz	QFAQRGOPRPFSCO-NSHDSACASA-N	1	1	322.365	1.074	20	5		DDBDMO
C[N@@H+](CCCNc1ncc([N+](=O)[O-])c(N)n1)Cc1ccccc1	ZINC000079832243	353578636	/nfs/dbraw/zinc/57/86/36/353578636.db2.gz	NWMRBOXWXNDVOC-UHFFFAOYSA-N	1	1	316.365	1.901	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(c2ncccc2[N+](=O)[O-])[C@H](C)C1	ZINC000089265719	353763839	/nfs/dbraw/zinc/76/38/39/353763839.db2.gz	NWVPUUXIYLWBML-LLVKDONJSA-N	1	1	308.338	1.063	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ncccc2[N+](=O)[O-])[C@H](C)C1	ZINC000089265719	353763841	/nfs/dbraw/zinc/76/38/41/353763841.db2.gz	NWVPUUXIYLWBML-LLVKDONJSA-N	1	1	308.338	1.063	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000089926539	353782727	/nfs/dbraw/zinc/78/27/27/353782727.db2.gz	WFTPXAHQTPQVHN-UHFFFAOYSA-N	1	1	319.340	1.790	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](c2ncc[nH]2)C1	ZINC000090554477	353795675	/nfs/dbraw/zinc/79/56/75/353795675.db2.gz	SLKLQGARMROKPU-LBPRGKRZSA-N	1	1	317.349	1.359	20	5		DDBDMO
CCc1nn(C)c(NC[C@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000094163899	353911753	/nfs/dbraw/zinc/91/17/53/353911753.db2.gz	HDEASBHKFWRLRH-NSHDSACASA-N	1	1	311.386	1.271	20	5		DDBDMO
NC(=O)N[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000270623441	354408174	/nfs/dbraw/zinc/40/81/74/354408174.db2.gz	KHPOTJDWTHBITP-LLVKDONJSA-N	1	1	308.338	1.106	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H](C)C1	ZINC000346231304	283035012	/nfs/dbraw/zinc/03/50/12/283035012.db2.gz	OBROETMBQSTOQC-SCRDCRAPSA-N	1	1	320.393	1.736	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@@H](C)C1	ZINC000346216129	283032865	/nfs/dbraw/zinc/03/28/65/283032865.db2.gz	IAARIYJUMISKAV-MISXGVKJSA-N	1	1	306.366	1.725	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2CCO)c1	ZINC000589515069	354998752	/nfs/dbraw/zinc/99/87/52/354998752.db2.gz	UVFMXQRKXNBBAP-CYBMUJFWSA-N	1	1	308.334	1.728	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1	ZINC000590446622	355099757	/nfs/dbraw/zinc/09/97/57/355099757.db2.gz	TYJAIVXHGVBAHF-QMTHXVAHSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[C@@H]1[C@H](O)CC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000590762213	355170189	/nfs/dbraw/zinc/17/01/89/355170189.db2.gz	BYWWODZEBPXHME-ZWNOBZJWSA-N	1	1	321.333	1.348	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000594204726	356139557	/nfs/dbraw/zinc/13/95/57/356139557.db2.gz	XSYHNFBNPQEGOI-NWDGAFQWSA-N	1	1	306.366	1.680	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000594539416	356245677	/nfs/dbraw/zinc/24/56/77/356245677.db2.gz	MXCVXNNDJLTUGC-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595551447	356546162	/nfs/dbraw/zinc/54/61/62/356546162.db2.gz	LZMGPXFKDXOHES-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000595536003	356537540	/nfs/dbraw/zinc/53/75/40/356537540.db2.gz	LTFACGYHCDUPFL-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1ccc2c(c1)C[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000595657528	356594813	/nfs/dbraw/zinc/59/48/13/356594813.db2.gz	MKNGNUAQGDWKRP-MRXNPFEDSA-N	1	1	316.361	1.519	20	5		DDBDMO
C[C@@H]1COC2(CCC2)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595683294	356609153	/nfs/dbraw/zinc/60/91/53/356609153.db2.gz	WKMXAJAEDLSMMM-GFCCVEGCSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@@H]1COC2(CCC2)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595683294	356609154	/nfs/dbraw/zinc/60/91/54/356609154.db2.gz	WKMXAJAEDLSMMM-GFCCVEGCSA-N	1	1	307.350	1.400	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000595744988	356632158	/nfs/dbraw/zinc/63/21/58/356632158.db2.gz	XPLWGVKCKBYEPX-HIFRSBDPSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1CCO	ZINC000595706885	356617160	/nfs/dbraw/zinc/61/71/60/356617160.db2.gz	YEYWJSSLLYJQPZ-GXTWGEPZSA-N	1	1	309.366	1.239	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2NC(=O)CC[C@@H]2C1	ZINC000595728986	356625444	/nfs/dbraw/zinc/62/54/44/356625444.db2.gz	PGGNRDWJKMDCQK-RISCZKNCSA-N	1	1	319.361	1.704	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](CCF)C2)c1	ZINC000595756853	356638418	/nfs/dbraw/zinc/63/84/18/356638418.db2.gz	XXSCJCMIZZNOBZ-YPMHNXCESA-N	1	1	300.334	1.224	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(=O)N(C)CC1	ZINC000595788824	356652969	/nfs/dbraw/zinc/65/29/69/356652969.db2.gz	YFNLMYSLODHZHI-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(=O)N(C)CC1	ZINC000595788824	356652972	/nfs/dbraw/zinc/65/29/72/356652972.db2.gz	YFNLMYSLODHZHI-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595833834	356670346	/nfs/dbraw/zinc/67/03/46/356670346.db2.gz	RZRUGRHRWBHWCM-FRRDWIJNSA-N	1	1	319.361	1.890	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H]2COC[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595826936	356665992	/nfs/dbraw/zinc/66/59/92/356665992.db2.gz	BESAWYNBWBZWAS-QWHCGFSZSA-N	1	1	319.361	1.892	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC3(COC3)C2)cccc1[N+](=O)[O-]	ZINC000595832157	356668664	/nfs/dbraw/zinc/66/86/64/356668664.db2.gz	CQCWUBPFLIZVJV-LBPRGKRZSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CCC3(COC3)C2)cccc1[N+](=O)[O-]	ZINC000595832157	356668665	/nfs/dbraw/zinc/66/86/65/356668665.db2.gz	CQCWUBPFLIZVJV-LBPRGKRZSA-N	1	1	319.361	1.953	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000595865087	356683838	/nfs/dbraw/zinc/68/38/38/356683838.db2.gz	ZAQMHISDEYMVAP-OAHLLOKOSA-N	1	1	323.368	1.765	20	5		DDBDMO
CC[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C	ZINC000618288412	363567080	/nfs/dbraw/zinc/56/70/80/363567080.db2.gz	GFIDKOXNXDTACC-LLVKDONJSA-N	1	1	303.366	1.997	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@H]21	ZINC000596170405	356800924	/nfs/dbraw/zinc/80/09/24/356800924.db2.gz	ZLDJJQKPHSKJST-BXUZGUMPSA-N	1	1	318.377	1.614	20	5		DDBDMO
Cc1nc(N2CCC[C@@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000596246401	356831267	/nfs/dbraw/zinc/83/12/67/356831267.db2.gz	DLQQIBUETVJJCS-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597715582	357299861	/nfs/dbraw/zinc/29/98/61/357299861.db2.gz	MWIAPFIQEOAUNU-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597715582	357299862	/nfs/dbraw/zinc/29/98/62/357299862.db2.gz	MWIAPFIQEOAUNU-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597715582	357299864	/nfs/dbraw/zinc/29/98/64/357299864.db2.gz	MWIAPFIQEOAUNU-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000598648864	357669976	/nfs/dbraw/zinc/66/99/76/357669976.db2.gz	IAHAZUMIZJXQCD-OLZOCXBDSA-N	1	1	321.377	1.874	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H]2C[C@@H](O)C2)c1	ZINC000599656489	358010527	/nfs/dbraw/zinc/01/05/27/358010527.db2.gz	VXYBAXLNXQEHGE-GSJFWJNXSA-N	1	1	308.334	1.584	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599674086	358019328	/nfs/dbraw/zinc/01/93/28/358019328.db2.gz	WPQTUXJOLOIUOA-KLPPZKSPSA-N	1	1	323.349	1.245	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601127586	358413468	/nfs/dbraw/zinc/41/34/68/358413468.db2.gz	KEZONFAMSSULCA-NSHDSACASA-N	1	1	307.325	1.948	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000601967817	358757628	/nfs/dbraw/zinc/75/76/28/358757628.db2.gz	CJFWRDNVWXVBGK-HNNXBMFYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602546371	359038574	/nfs/dbraw/zinc/03/85/74/359038574.db2.gz	QZWBHDOAZRWIMO-GFCCVEGCSA-N	1	1	319.365	1.071	20	5		DDBDMO
COCCC[N@@H+](C)CCNCc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602559409	359045177	/nfs/dbraw/zinc/04/51/77/359045177.db2.gz	IMBMGFXYOJYSIC-UHFFFAOYSA-N	1	1	322.365	1.794	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@H]1n1ccnc1	ZINC000602482359	359008626	/nfs/dbraw/zinc/00/86/26/359008626.db2.gz	FNZOCNGWIYKYMU-WCQYABFASA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@H]1n1ccnc1	ZINC000602482359	359008629	/nfs/dbraw/zinc/00/86/29/359008629.db2.gz	FNZOCNGWIYKYMU-WCQYABFASA-N	1	1	304.354	1.608	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602775855	359181976	/nfs/dbraw/zinc/18/19/76/359181976.db2.gz	CIDNRSDEAMTOPM-JSGCOSHPSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602775855	359181991	/nfs/dbraw/zinc/18/19/91/359181991.db2.gz	CIDNRSDEAMTOPM-JSGCOSHPSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602775855	359181993	/nfs/dbraw/zinc/18/19/93/359181993.db2.gz	CIDNRSDEAMTOPM-JSGCOSHPSA-N	1	1	309.414	1.904	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCc3cnccn3)C2)nc1	ZINC000602794274	359196131	/nfs/dbraw/zinc/19/61/31/359196131.db2.gz	NOTMQIUANWNQRI-ZDUSSCGKSA-N	1	1	314.349	1.509	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCS[C@H]2COCC[C@@H]21	ZINC000602784994	359189802	/nfs/dbraw/zinc/18/98/02/359189802.db2.gz	QVMXZSIOTLZBTR-RYUDHWBXSA-N	1	1	312.395	1.306	20	5		DDBDMO
Cn1cc(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c([N+](=O)[O-])n1	ZINC000602716363	359145667	/nfs/dbraw/zinc/14/56/67/359145667.db2.gz	UKNAZWYBWHWKPG-GASCZTMLSA-N	1	1	306.366	1.721	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000618467675	363642714	/nfs/dbraw/zinc/64/27/14/363642714.db2.gz	PFKXCJSWCJEBBJ-AAEUAGOBSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000618467675	363642716	/nfs/dbraw/zinc/64/27/16/363642716.db2.gz	PFKXCJSWCJEBBJ-AAEUAGOBSA-N	1	1	307.350	1.352	20	5		DDBDMO
CC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cnc2C)C[C@@H]1C	ZINC000603141019	359429838	/nfs/dbraw/zinc/42/98/38/359429838.db2.gz	AKQPKFCVGDTCQX-PHIMTYICSA-N	1	1	306.366	1.853	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cnc2C)C[C@@H]1C	ZINC000603141019	359429843	/nfs/dbraw/zinc/42/98/43/359429843.db2.gz	AKQPKFCVGDTCQX-PHIMTYICSA-N	1	1	306.366	1.853	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@@H]1O	ZINC000186820175	200017021	/nfs/dbraw/zinc/01/70/21/200017021.db2.gz	SRJKWAIKGGPKBG-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@@H]1O	ZINC000186820175	200017023	/nfs/dbraw/zinc/01/70/23/200017023.db2.gz	SRJKWAIKGGPKBG-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000186944709	200035350	/nfs/dbraw/zinc/03/53/50/200035350.db2.gz	OCWBEPSFWGQKRI-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1NC[C@@]1(CO)COCC[NH2+]1	ZINC000603418970	359628250	/nfs/dbraw/zinc/62/82/50/359628250.db2.gz	JXZUICYPISNVGP-GFCCVEGCSA-N	1	1	301.730	1.011	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@]2(CO)COCC[NH2+]2)c(Cl)c1	ZINC000603418187	359628545	/nfs/dbraw/zinc/62/85/45/359628545.db2.gz	CPKVHJSDKOMHFC-LBPRGKRZSA-N	1	1	301.730	1.011	20	5		DDBDMO
[NH3+]CC1(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCCC1	ZINC000237786125	202354423	/nfs/dbraw/zinc/35/44/23/202354423.db2.gz	UZDJXFBNFVWVRH-UHFFFAOYSA-N	1	1	303.322	1.472	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000609268777	360285325	/nfs/dbraw/zinc/28/53/25/360285325.db2.gz	BAGBGZMZWJSUGA-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=C([C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1)N1CCCC1	ZINC000610453354	360440542	/nfs/dbraw/zinc/44/05/42/360440542.db2.gz	XFYNYNWNQLZZJA-ZDUSSCGKSA-N	1	1	321.381	1.126	20	5		DDBDMO
CC[N@@H+](CCC(F)(F)F)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000610368177	360423027	/nfs/dbraw/zinc/42/30/27/360423027.db2.gz	VKZXESYZRYGLJS-JTQLQIEISA-N	1	1	310.276	1.427	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@H]2C[N@@H+]2CCC[C@H]2CO)s1	ZINC000374490961	307209180	/nfs/dbraw/zinc/20/91/80/307209180.db2.gz	XWLYQRBPCMUFOL-QWRGUYRKSA-N	1	1	312.395	1.477	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000610929130	360573777	/nfs/dbraw/zinc/57/37/77/360573777.db2.gz	KDHXVDGVCXJJIL-UHFFFAOYSA-N	1	1	314.773	1.536	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611261060	360682828	/nfs/dbraw/zinc/68/28/28/360682828.db2.gz	IESVIGLCZYKDKA-SNVBAGLBSA-N	1	1	324.333	1.607	20	5		DDBDMO
CC[C@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000611615844	360777401	/nfs/dbraw/zinc/77/74/01/360777401.db2.gz	CZVMGNLRQDKSFN-KGLIPLIRSA-N	1	1	322.409	1.888	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000619434452	364006583	/nfs/dbraw/zinc/00/65/83/364006583.db2.gz	OINCDVNJWHYZLW-OAHLLOKOSA-N	1	1	321.333	1.063	20	5		DDBDMO
COc1c(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440431	364009964	/nfs/dbraw/zinc/00/99/64/364009964.db2.gz	GRFLTXONQVHRKC-GXFFZTMASA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440431	364009971	/nfs/dbraw/zinc/00/99/71/364009971.db2.gz	GRFLTXONQVHRKC-GXFFZTMASA-N	1	1	323.349	1.052	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000359215273	299359390	/nfs/dbraw/zinc/35/93/90/299359390.db2.gz	AZKDMOSIKGGUHY-CYBMUJFWSA-N	1	1	318.377	1.973	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](O)CC1	ZINC000293061544	223377468	/nfs/dbraw/zinc/37/74/68/223377468.db2.gz	IMNDROKKUWQIEM-FZMZJTMJSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](O)CC1	ZINC000293061544	223377470	/nfs/dbraw/zinc/37/74/70/223377470.db2.gz	IMNDROKKUWQIEM-FZMZJTMJSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@H]2[NH2+]CCO[C@@H]2C)cc1[N+](=O)[O-]	ZINC000261926690	203153278	/nfs/dbraw/zinc/15/32/78/203153278.db2.gz	LDRIVWUNASBBSZ-WDMOLILDSA-N	1	1	307.350	1.457	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000264685205	204076859	/nfs/dbraw/zinc/07/68/59/204076859.db2.gz	QVVLADVPPRKYIQ-LLVKDONJSA-N	1	1	323.397	1.732	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CC=CCC2)c1	ZINC000282823064	217275828	/nfs/dbraw/zinc/27/58/28/217275828.db2.gz	QDHYIWJEUCJZIY-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CC=CCC2)c1	ZINC000282823064	217275830	/nfs/dbraw/zinc/27/58/30/217275830.db2.gz	QDHYIWJEUCJZIY-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000266344531	205281966	/nfs/dbraw/zinc/28/19/66/205281966.db2.gz	IROOQQWDJBTCCX-RYUDHWBXSA-N	1	1	309.366	1.495	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000288515051	220192325	/nfs/dbraw/zinc/19/23/25/220192325.db2.gz	QYKQTJQMWCNTJE-NSHDSACASA-N	1	1	306.366	1.652	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000288515051	220192326	/nfs/dbraw/zinc/19/23/26/220192326.db2.gz	QYKQTJQMWCNTJE-NSHDSACASA-N	1	1	306.366	1.652	20	5		DDBDMO
C[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000567031840	304193884	/nfs/dbraw/zinc/19/38/84/304193884.db2.gz	FOAJNCVIVVLTEB-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000104389057	194003861	/nfs/dbraw/zinc/00/38/61/194003861.db2.gz	SCFLAAQEPHPOSU-LBPRGKRZSA-N	1	1	308.382	1.853	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1	ZINC000106396254	194206317	/nfs/dbraw/zinc/20/63/17/194206317.db2.gz	XFQZXFYWQDMLGY-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[NH+](C[C@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000285232031	218343619	/nfs/dbraw/zinc/34/36/19/218343619.db2.gz	YEWBESGWALZYFC-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
COC(=O)c1cc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000109848046	194293210	/nfs/dbraw/zinc/29/32/10/194293210.db2.gz	ZKIMBADPOBIUTL-JTQLQIEISA-N	1	1	321.333	1.063	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2CC[N@H+](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000110651847	194347125	/nfs/dbraw/zinc/34/71/25/194347125.db2.gz	AXOBJQPQBUUAFI-SNVBAGLBSA-N	1	1	322.321	1.493	20	5		DDBDMO
Cc1c(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cnn1C	ZINC000268874837	207044337	/nfs/dbraw/zinc/04/43/37/207044337.db2.gz	JXWLNTVUOGDLBI-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000063512766	184284141	/nfs/dbraw/zinc/28/41/41/184284141.db2.gz	FKHMMIFIJYBMTO-SNVBAGLBSA-N	1	1	313.741	1.643	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000063512766	184284143	/nfs/dbraw/zinc/28/41/43/184284143.db2.gz	FKHMMIFIJYBMTO-SNVBAGLBSA-N	1	1	313.741	1.643	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](Oc3ccncc3)C2)c1	ZINC000120191256	195115512	/nfs/dbraw/zinc/11/55/12/195115512.db2.gz	NQOXFRWBZBJENN-CQSZACIVSA-N	1	1	303.322	1.340	20	5		DDBDMO
O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1CSC[NH2+]1	ZINC000159143008	197330444	/nfs/dbraw/zinc/33/04/44/197330444.db2.gz	MYRJNEJWYAIQFY-CYBMUJFWSA-N	1	1	309.391	1.696	20	5		DDBDMO
COCCOC[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000295890972	533104779	/nfs/dbraw/zinc/10/47/79/533104779.db2.gz	BNDKKXHNLZETSW-INIZCTEOSA-N	1	1	324.377	1.583	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000452093841	533676279	/nfs/dbraw/zinc/67/62/79/533676279.db2.gz	JHBLFBMSSKEWGM-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000452093841	533676268	/nfs/dbraw/zinc/67/62/68/533676268.db2.gz	JHBLFBMSSKEWGM-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cc1ccccc1[N+](=O)[O-])C2	ZINC000073989099	406898073	/nfs/dbraw/zinc/89/80/73/406898073.db2.gz	SFHNLXFUXYOXQA-UONOGXRCSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000032269063	406947352	/nfs/dbraw/zinc/94/73/52/406947352.db2.gz	KRDJEKXQZITRKK-ZDUSSCGKSA-N	1	1	324.381	1.020	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+](CCC(F)(F)F)C[C@H](O)CO)cc1	ZINC000084867114	407095453	/nfs/dbraw/zinc/09/54/53/407095453.db2.gz	KAOZOHGPMKJUMW-LBPRGKRZSA-N	1	1	322.283	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](CCC(F)(F)F)C[C@H](O)CO)cc1	ZINC000084867114	407095456	/nfs/dbraw/zinc/09/54/56/407095456.db2.gz	KAOZOHGPMKJUMW-LBPRGKRZSA-N	1	1	322.283	1.702	20	5		DDBDMO
C[N@H+](CCn1cccn1)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000111283242	407405579	/nfs/dbraw/zinc/40/55/79/407405579.db2.gz	AWAZZZVWJVVJMB-UHFFFAOYSA-N	1	1	318.333	1.790	20	5		DDBDMO
C[N@@H+](CCn1cccn1)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000111283242	407405581	/nfs/dbraw/zinc/40/55/81/407405581.db2.gz	AWAZZZVWJVVJMB-UHFFFAOYSA-N	1	1	318.333	1.790	20	5		DDBDMO
COCC1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000112355233	407427711	/nfs/dbraw/zinc/42/77/11/407427711.db2.gz	NKSKNVXPKVHTKG-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]([C@H](C)S(C)(=O)=O)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000113257612	407480205	/nfs/dbraw/zinc/48/02/05/407480205.db2.gz	KXEYFDPZQHLKTI-RYUDHWBXSA-N	1	1	314.407	1.891	20	5		DDBDMO
C[C@@H]([C@H](C)S(C)(=O)=O)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000113257612	407480207	/nfs/dbraw/zinc/48/02/07/407480207.db2.gz	KXEYFDPZQHLKTI-RYUDHWBXSA-N	1	1	314.407	1.891	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270980683	407449688	/nfs/dbraw/zinc/44/96/88/407449688.db2.gz	XDCLSMQQAWQUCD-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270980683	407449692	/nfs/dbraw/zinc/44/96/92/407449692.db2.gz	XDCLSMQQAWQUCD-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CC2(O)CCOCC2)cc1[N+](=O)[O-]	ZINC000178704072	407554999	/nfs/dbraw/zinc/55/49/99/407554999.db2.gz	SAHJUKVDNICACO-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@H]2CCC[N@@H+]2C)c(C)c1[N+](=O)[O-]	ZINC000171400811	407680802	/nfs/dbraw/zinc/68/08/02/407680802.db2.gz	HWXXAUTWDDQSKM-GFCCVEGCSA-N	1	1	309.370	1.009	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4cc([N+](=O)[O-])ccc4n3)C[C@@H]21	ZINC000153110657	407756681	/nfs/dbraw/zinc/75/66/81/407756681.db2.gz	LTIMTAYWLLBBPA-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc(OC)c1	ZINC000267061578	407731753	/nfs/dbraw/zinc/73/17/53/407731753.db2.gz	ISGTYFGJNJGQSO-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
CCC[NH+]1CCC(N(C)C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])CC1	ZINC000171665456	407735005	/nfs/dbraw/zinc/73/50/05/407735005.db2.gz	RLTSMQDMLOJCTL-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337966	407840395	/nfs/dbraw/zinc/84/03/95/407840395.db2.gz	KQNNCLBQOFLXCO-ABAIWWIYSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337966	407840397	/nfs/dbraw/zinc/84/03/97/407840397.db2.gz	KQNNCLBQOFLXCO-ABAIWWIYSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2[O-])C1	ZINC000134097250	407885788	/nfs/dbraw/zinc/88/57/88/407885788.db2.gz	JARBIUWBVWXROJ-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])NCC[N@H+]1CCCOCC1	ZINC000189464956	408025122	/nfs/dbraw/zinc/02/51/22/408025122.db2.gz	CPPROEFNQACUKN-VOTSOKGWSA-N	1	1	319.361	1.447	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591207	407997712	/nfs/dbraw/zinc/99/77/12/407997712.db2.gz	PMDGNDQFXFRXSX-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591207	407997716	/nfs/dbraw/zinc/99/77/16/407997716.db2.gz	PMDGNDQFXFRXSX-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591203	407997928	/nfs/dbraw/zinc/99/79/28/407997928.db2.gz	PMDGNDQFXFRXSX-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591203	407997934	/nfs/dbraw/zinc/99/79/34/407997934.db2.gz	PMDGNDQFXFRXSX-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC[C@@](C)(O)C[NH+]1CCOCC1	ZINC000135305454	408002252	/nfs/dbraw/zinc/00/22/52/408002252.db2.gz	GPCLNAOTAWZSJO-OAHLLOKOSA-N	1	1	309.366	1.398	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000136096463	408076764	/nfs/dbraw/zinc/07/67/64/408076764.db2.gz	FZTWZLTUVBSEPD-NSHDSACASA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136096463	408076770	/nfs/dbraw/zinc/07/67/70/408076770.db2.gz	FZTWZLTUVBSEPD-NSHDSACASA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136096463	408076779	/nfs/dbraw/zinc/07/67/79/408076779.db2.gz	FZTWZLTUVBSEPD-NSHDSACASA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182220821	408098385	/nfs/dbraw/zinc/09/83/85/408098385.db2.gz	DQGXXAUHODJIDV-IHRRRGAJSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1CCOCC1	ZINC000182327784	408127710	/nfs/dbraw/zinc/12/77/10/408127710.db2.gz	BRYXPVRCDXDQOW-CQSZACIVSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000269432246	408305285	/nfs/dbraw/zinc/30/52/85/408305285.db2.gz	BTHQFUYOZZLRGS-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269432750	408308067	/nfs/dbraw/zinc/30/80/67/408308067.db2.gz	CIWNUFWVEGQKAL-MWLCHTKSSA-N	1	1	321.381	1.654	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1CO	ZINC000190915572	408340863	/nfs/dbraw/zinc/34/08/63/408340863.db2.gz	VLDCSMQGTXSQKD-PWSUYJOCSA-N	1	1	318.333	1.705	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000183225411	408359641	/nfs/dbraw/zinc/35/96/41/408359641.db2.gz	QQHCYTHPSTUFMN-BZPMIXESSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC[C@@H]1CN(c2nc(C)ccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000246853614	408353795	/nfs/dbraw/zinc/35/37/95/408353795.db2.gz	BQBKKBGKQQEUEE-QWHCGFSZSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1(CO)CCOCC1	ZINC000191021058	408358219	/nfs/dbraw/zinc/35/82/19/408358219.db2.gz	JUKBUQQXBUZHMZ-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000183555139	408439805	/nfs/dbraw/zinc/43/98/05/408439805.db2.gz	LKYWIPUPRNYJEG-MNOVXSKESA-N	1	1	307.354	1.936	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000270343052	408495870	/nfs/dbraw/zinc/49/58/70/408495870.db2.gz	CSOLFVYWGJTFPR-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000177130334	408526955	/nfs/dbraw/zinc/52/69/55/408526955.db2.gz	DECHSJVQDGHIHW-CMPLNLGQSA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1cc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000176889797	408466959	/nfs/dbraw/zinc/46/69/59/408466959.db2.gz	AFVKODSKOHYMTD-LLVKDONJSA-N	1	1	306.366	1.652	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000177208309	408552048	/nfs/dbraw/zinc/55/20/48/408552048.db2.gz	XBIIPUCODXXVPU-SECBINFHSA-N	1	1	306.322	1.550	20	5		DDBDMO
C[C@@H]1CSCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248462590	408574153	/nfs/dbraw/zinc/57/41/53/408574153.db2.gz	PZPFXNFINAYNEN-VXGBXAGGSA-N	1	1	312.391	1.772	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1	ZINC000177159446	408538412	/nfs/dbraw/zinc/53/84/12/408538412.db2.gz	QULFGRXFEHRGLQ-MNOVXSKESA-N	1	1	319.361	1.958	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000192792441	408650709	/nfs/dbraw/zinc/65/07/09/408650709.db2.gz	YKVWBMOXBAESOJ-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000192792441	408650713	/nfs/dbraw/zinc/65/07/13/408650713.db2.gz	YKVWBMOXBAESOJ-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000192792441	408650718	/nfs/dbraw/zinc/65/07/18/408650718.db2.gz	YKVWBMOXBAESOJ-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000248880617	408653557	/nfs/dbraw/zinc/65/35/57/408653557.db2.gz	WVPGHUACUMNUMJ-GVXVVHGQSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000248880617	408653563	/nfs/dbraw/zinc/65/35/63/408653563.db2.gz	WVPGHUACUMNUMJ-GVXVVHGQSA-N	1	1	308.338	1.065	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1CO	ZINC000248900270	408658168	/nfs/dbraw/zinc/65/81/68/408658168.db2.gz	HEWIKXRIRHGSRD-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000249541358	408739437	/nfs/dbraw/zinc/73/94/37/408739437.db2.gz	DZQTUDSYOUPWEN-SWLSCSKDSA-N	1	1	321.377	1.950	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H](C)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000193144341	408699989	/nfs/dbraw/zinc/69/99/89/408699989.db2.gz	LKADIABDQJIAOG-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
C[C@H](CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1	ZINC000251690516	408783668	/nfs/dbraw/zinc/78/36/68/408783668.db2.gz	OYBWMSRIWBFEHZ-WDEREUQCSA-N	1	1	322.365	1.546	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000163751285	408788703	/nfs/dbraw/zinc/78/87/03/408788703.db2.gz	AWTGRDSSMQMUJK-GRYCIOLGSA-N	1	1	323.397	1.425	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000185105885	408758168	/nfs/dbraw/zinc/75/81/68/408758168.db2.gz	VCVIFEGTUZTYFE-BIBXISHDSA-N	1	1	300.380	1.672	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCn3cncc3C2)c1[N+](=O)[O-]	ZINC000290867099	408846097	/nfs/dbraw/zinc/84/60/97/408846097.db2.gz	ASVGTVRXASBGDZ-UHFFFAOYSA-N	1	1	304.310	1.123	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CC[N@H+](C)C2)c1	ZINC000280855696	408847247	/nfs/dbraw/zinc/84/72/47/408847247.db2.gz	ATSSVRGAFYYGMU-CYBMUJFWSA-N	1	1	321.377	1.740	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H](C)OC	ZINC000291143843	408860065	/nfs/dbraw/zinc/86/00/65/408860065.db2.gz	DBHUNVWLIGBSHD-LBPRGKRZSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H](C)OC	ZINC000291143843	408860068	/nfs/dbraw/zinc/86/00/68/408860068.db2.gz	DBHUNVWLIGBSHD-LBPRGKRZSA-N	1	1	321.377	1.841	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[NH+]3CCC2CC3)cc1	ZINC000191096323	163172242	/nfs/dbraw/zinc/17/22/42/163172242.db2.gz	MRKOANLZRHKVKH-UHFFFAOYSA-N	1	1	311.363	1.064	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000277404967	408934557	/nfs/dbraw/zinc/93/45/57/408934557.db2.gz	YRPYSVOXOZWZGE-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2NC[C@@H]2C[NH+]3CCN2CC3)s1	ZINC000286216568	408943548	/nfs/dbraw/zinc/94/35/48/408943548.db2.gz	NFPTWEJHKMKSQH-SECBINFHSA-N	1	1	320.378	1.011	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000292004270	408961297	/nfs/dbraw/zinc/96/12/97/408961297.db2.gz	VKLAKELKKOXWLV-GFCCVEGCSA-N	1	1	309.366	1.819	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+](C2CCC2)C1	ZINC000292256954	409010870	/nfs/dbraw/zinc/01/08/70/409010870.db2.gz	FDGCEOTWDHSOGU-LLVKDONJSA-N	1	1	306.366	1.869	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000287517764	409048356	/nfs/dbraw/zinc/04/83/56/409048356.db2.gz	UVCMBEFOZPZEBC-LBPRGKRZSA-N	1	1	321.377	1.577	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[NH2+]CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000293327982	409090087	/nfs/dbraw/zinc/09/00/87/409090087.db2.gz	IWNZLWPGLPHUML-ZJUUUORDSA-N	1	1	307.354	1.094	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000289140405	409224002	/nfs/dbraw/zinc/22/40/02/409224002.db2.gz	SEPJGWMHDGYBAX-JTQLQIEISA-N	1	1	309.370	1.621	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)CNc3ccccc3[N+](=O)[O-])C2)C1	ZINC000293919222	409206199	/nfs/dbraw/zinc/20/61/99/409206199.db2.gz	PFPIDGCDDYQZME-INIZCTEOSA-N	1	1	318.377	1.561	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573619	409363329	/nfs/dbraw/zinc/36/33/29/409363329.db2.gz	VRLHBEPQIHYMIO-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573619	409363336	/nfs/dbraw/zinc/36/33/36/409363336.db2.gz	VRLHBEPQIHYMIO-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]([N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)O	ZINC000295223019	409381928	/nfs/dbraw/zinc/38/19/28/409381928.db2.gz	VVKRZAWYDIXMDI-RYUDHWBXSA-N	1	1	312.366	1.426	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290674995	409485081	/nfs/dbraw/zinc/48/50/81/409485081.db2.gz	RPLPIDOWTDAVQR-LLVKDONJSA-N	1	1	321.381	1.765	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000331520075	409595814	/nfs/dbraw/zinc/59/58/14/409595814.db2.gz	NVPNIHAVQHHCIW-ZWNOBZJWSA-N	1	1	319.361	1.816	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000354147467	409692823	/nfs/dbraw/zinc/69/28/23/409692823.db2.gz	DECPUABOHKDPQQ-HNNXBMFYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000356853680	409664916	/nfs/dbraw/zinc/66/49/16/409664916.db2.gz	OCQLLPAPJFTRSG-VXGBXAGGSA-N	1	1	307.350	1.525	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000342558958	409723104	/nfs/dbraw/zinc/72/31/04/409723104.db2.gz	DSUYZFLCFPZAEQ-MFKMUULPSA-N	1	1	306.366	1.834	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC000357012403	409794274	/nfs/dbraw/zinc/79/42/74/409794274.db2.gz	YQJUYRQNWITJOT-OLZOCXBDSA-N	1	1	320.393	1.866	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000338422420	409975393	/nfs/dbraw/zinc/97/53/93/409975393.db2.gz	AANRHAQWOIAZEP-CYBMUJFWSA-N	1	1	323.397	1.562	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(Cc2noc([C@@H]3CC[N@@H+](C)C3)n2)c1	ZINC000350277004	409937008	/nfs/dbraw/zinc/93/70/08/409937008.db2.gz	QSJVBQPPPVXNMJ-SNVBAGLBSA-N	1	1	318.333	1.996	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000338794062	410037566	/nfs/dbraw/zinc/03/75/66/410037566.db2.gz	KLJIWFIEPCGNBQ-PHIMTYICSA-N	1	1	306.366	1.483	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1C	ZINC000357460896	410052472	/nfs/dbraw/zinc/05/24/72/410052472.db2.gz	RRFGCWKBNDADCO-NXEZZACHSA-N	1	1	307.354	1.008	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000332311531	410061388	/nfs/dbraw/zinc/06/13/88/410061388.db2.gz	MWRJETUMFGDJFB-LBPRGKRZSA-N	1	1	318.377	1.120	20	5		DDBDMO
CCNC(=O)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C	ZINC000339321226	410089985	/nfs/dbraw/zinc/08/99/85/410089985.db2.gz	QBOPUTONQMHXEX-CQSZACIVSA-N	1	1	319.365	1.721	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CCO1	ZINC000332604588	410191376	/nfs/dbraw/zinc/19/13/76/410191376.db2.gz	OEOALANOGJLCBK-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CCO1	ZINC000332604588	410191379	/nfs/dbraw/zinc/19/13/79/410191379.db2.gz	OEOALANOGJLCBK-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
Cc1[nH+]ccn1CCCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000298514544	410270253	/nfs/dbraw/zinc/27/02/53/410270253.db2.gz	PCVIAZZYGCPXTN-UHFFFAOYSA-N	1	1	314.301	1.786	20	5		DDBDMO
C[N@@H+](CC(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCSC1	ZINC000343315509	410347053	/nfs/dbraw/zinc/34/70/53/410347053.db2.gz	XVZUFLFTNLGGTJ-CYBMUJFWSA-N	1	1	323.418	1.691	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790190	410400683	/nfs/dbraw/zinc/40/06/83/410400683.db2.gz	JMXYLJIUKWVAQU-QWRGUYRKSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790190	410400692	/nfs/dbraw/zinc/40/06/92/410400692.db2.gz	JMXYLJIUKWVAQU-QWRGUYRKSA-N	1	1	321.333	1.417	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCOC[C@@H]2CC2CCC2)c1	ZINC000339781500	410453926	/nfs/dbraw/zinc/45/39/26/410453926.db2.gz	YDYPPRRCIMALAK-ZFWWWQNUSA-N	1	1	324.381	1.043	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@H](C)O	ZINC000352200654	410545910	/nfs/dbraw/zinc/54/59/10/410545910.db2.gz	BFSLONUDBSZQLE-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C[C@H](C)O	ZINC000352200654	410545916	/nfs/dbraw/zinc/54/59/16/410545916.db2.gz	BFSLONUDBSZQLE-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCSC[C@H]2CO)cc1	ZINC000343725317	410649239	/nfs/dbraw/zinc/64/92/39/410649239.db2.gz	NWWZVPQGYKALIR-CYBMUJFWSA-N	1	1	312.391	1.773	20	5		DDBDMO
COCC1(O)CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000330497461	410731866	/nfs/dbraw/zinc/73/18/66/410731866.db2.gz	ZIOJEIBSARPKQA-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
Cc1ccnc(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c1[N+](=O)[O-]	ZINC000301246525	410685203	/nfs/dbraw/zinc/68/52/03/410685203.db2.gz	ATDQRLAEXBCXIA-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
CCC[N@H+](CCn1cc([N+](=O)[O-])cn1)CCN1CCCCC1	ZINC000353165437	410822996	/nfs/dbraw/zinc/82/29/96/410822996.db2.gz	IJYNJSURIASQLT-UHFFFAOYSA-N	1	1	309.414	1.989	20	5		DDBDMO
CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)CCN1CCCCC1	ZINC000353165437	410823002	/nfs/dbraw/zinc/82/30/02/410823002.db2.gz	IJYNJSURIASQLT-UHFFFAOYSA-N	1	1	309.414	1.989	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000330602657	410817061	/nfs/dbraw/zinc/81/70/61/410817061.db2.gz	WUJUJFGIEFRVGN-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000330602657	410817066	/nfs/dbraw/zinc/81/70/66/410817066.db2.gz	WUJUJFGIEFRVGN-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080045	410935591	/nfs/dbraw/zinc/93/55/91/410935591.db2.gz	XGQMVQPEAGSVAE-JSGCOSHPSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080045	410935594	/nfs/dbraw/zinc/93/55/94/410935594.db2.gz	XGQMVQPEAGSVAE-JSGCOSHPSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc2c(c1)OCO2	ZINC000341292813	410987612	/nfs/dbraw/zinc/98/76/12/410987612.db2.gz	HPIPNKPNYCEVHP-SECBINFHSA-N	1	1	304.306	1.908	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000331184641	411003345	/nfs/dbraw/zinc/00/33/45/411003345.db2.gz	YIYASLLSUYDWMI-HNNXBMFYSA-N	1	1	321.377	1.772	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000353369160	410944164	/nfs/dbraw/zinc/94/41/64/410944164.db2.gz	KCBNOMCVBKELDE-LLVKDONJSA-N	1	1	307.354	1.312	20	5		DDBDMO
COc1ccc(OCCN2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000331279235	411053990	/nfs/dbraw/zinc/05/39/90/411053990.db2.gz	SRXRHTHBRZYIOX-LBPRGKRZSA-N	1	1	309.366	1.618	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000331294207	411061622	/nfs/dbraw/zinc/06/16/22/411061622.db2.gz	RHWFVLWIWJQEKD-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000331294207	411061626	/nfs/dbraw/zinc/06/16/26/411061626.db2.gz	RHWFVLWIWJQEKD-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000356606237	411104026	/nfs/dbraw/zinc/10/40/26/411104026.db2.gz	VSGVTOIFSSXCHE-NSHDSACASA-N	1	1	311.386	1.661	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000353710991	411116756	/nfs/dbraw/zinc/11/67/56/411116756.db2.gz	LWTWHXFLVUQLAV-LLVKDONJSA-N	1	1	307.354	1.122	20	5		DDBDMO
C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CCS(=O)(=O)C1	ZINC000353774882	411127379	/nfs/dbraw/zinc/12/73/79/411127379.db2.gz	JIAWSDCAUJVRPY-AGLBCWCQSA-N	1	1	324.402	1.975	20	5		DDBDMO
C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1CCS(=O)(=O)C1	ZINC000353774882	411127382	/nfs/dbraw/zinc/12/73/82/411127382.db2.gz	JIAWSDCAUJVRPY-AGLBCWCQSA-N	1	1	324.402	1.975	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](C)CO	ZINC000131842943	196203676	/nfs/dbraw/zinc/20/36/76/196203676.db2.gz	HYFSYQVTKTYMEF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000134035216	196356028	/nfs/dbraw/zinc/35/60/28/196356028.db2.gz	HKZCIOMABTUESF-LBPRGKRZSA-N	1	1	307.350	1.293	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc([N+](=O)[O-])o1	ZINC000134069113	196358575	/nfs/dbraw/zinc/35/85/75/196358575.db2.gz	QOCQLCURJKUPPO-LLVKDONJSA-N	1	1	311.338	1.155	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000296666009	226103389	/nfs/dbraw/zinc/10/33/89/226103389.db2.gz	KJOKVXOJRGIMRP-ZBFHGGJFSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1CCO	ZINC000419322454	226114484	/nfs/dbraw/zinc/11/44/84/226114484.db2.gz	HKDGQTWFYUWDMQ-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+](C2CC2)C1	ZINC000296803079	226229674	/nfs/dbraw/zinc/22/96/74/226229674.db2.gz	UJYZUUNVNROAIO-CYBMUJFWSA-N	1	1	320.393	1.173	20	5		DDBDMO
O=C(CCN1CC[C@@]2(CC[NH2+]C2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000360565417	418466459	/nfs/dbraw/zinc/46/64/59/418466459.db2.gz	UPUUXUSCHQASPG-MRXNPFEDSA-N	1	1	318.377	1.609	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+]([C@@H]3CCOC3)CC2)c2nonc21	ZINC000366859500	418527878	/nfs/dbraw/zinc/52/78/78/418527878.db2.gz	YNNPSNVPDBQULE-SNVBAGLBSA-N	1	1	319.321	1.042	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ccncc1[N+](=O)[O-]	ZINC000361041169	418572922	/nfs/dbraw/zinc/57/29/22/418572922.db2.gz	CPHPHPVVGXWTSG-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2CCC[N@H+]2CCOC)c1[N+](=O)[O-]	ZINC000360967102	418556203	/nfs/dbraw/zinc/55/62/03/418556203.db2.gz	WZIMKJVAABQKBE-LLVKDONJSA-N	1	1	311.386	1.413	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](C)C[NH+]1CCOCC1	ZINC000361002695	418563875	/nfs/dbraw/zinc/56/38/75/418563875.db2.gz	PABRKPVGZBXNCH-NSHDSACASA-N	1	1	311.386	1.500	20	5		DDBDMO
C=Cn1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000193983978	222168706	/nfs/dbraw/zinc/16/87/06/222168706.db2.gz	MFUWDVPSMQCTKO-CYBMUJFWSA-N	1	1	314.349	1.973	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1[C@@H]1CCCO1	ZINC000367724746	418627799	/nfs/dbraw/zinc/62/77/99/418627799.db2.gz	HFQBKASWMWDLAD-MELADBBJSA-N	1	1	324.381	1.042	20	5		DDBDMO
CCCCNC(=O)[C@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399829	418634426	/nfs/dbraw/zinc/63/44/26/418634426.db2.gz	AXNSRNNSIYELME-QWHCGFSZSA-N	1	1	323.397	1.733	20	5		DDBDMO
CCCCNC(=O)[C@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399829	418634427	/nfs/dbraw/zinc/63/44/27/418634427.db2.gz	AXNSRNNSIYELME-QWHCGFSZSA-N	1	1	323.397	1.733	20	5		DDBDMO
CO[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362573	418635775	/nfs/dbraw/zinc/63/57/75/418635775.db2.gz	TYPVGOVIHFKGSI-NWDGAFQWSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362573	418635778	/nfs/dbraw/zinc/63/57/78/418635778.db2.gz	TYPVGOVIHFKGSI-NWDGAFQWSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000368133898	418694434	/nfs/dbraw/zinc/69/44/34/418694434.db2.gz	IDLDZDDNNXPULU-REBRKWNGSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000368133898	418694437	/nfs/dbraw/zinc/69/44/37/418694437.db2.gz	IDLDZDDNNXPULU-REBRKWNGSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000368133898	418694439	/nfs/dbraw/zinc/69/44/39/418694439.db2.gz	IDLDZDDNNXPULU-REBRKWNGSA-N	1	1	303.362	1.288	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1	ZINC000371446961	418790946	/nfs/dbraw/zinc/79/09/46/418790946.db2.gz	IENKFCGEZMSPCE-STQMWFEESA-N	1	1	308.382	1.967	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cn2)[C@H]1c1cccs1	ZINC000364961216	418828454	/nfs/dbraw/zinc/82/84/54/418828454.db2.gz	YAOHNDLEYFUKHU-GWCFXTLKSA-N	1	1	319.390	2.551	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000365572347	418877801	/nfs/dbraw/zinc/87/78/01/418877801.db2.gz	LEFMFKBVTJFPDQ-HKUMRIAESA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000365572347	418877805	/nfs/dbraw/zinc/87/78/05/418877805.db2.gz	LEFMFKBVTJFPDQ-HKUMRIAESA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000365572347	418877807	/nfs/dbraw/zinc/87/78/07/418877807.db2.gz	LEFMFKBVTJFPDQ-HKUMRIAESA-N	1	1	323.418	1.912	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411186086	418877811	/nfs/dbraw/zinc/87/78/11/418877811.db2.gz	IRDVWCIBKFJUMQ-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N[C@H]3CC[N@H+]4CCC[C@@H]4C3)nn21	ZINC000372703428	418894120	/nfs/dbraw/zinc/89/41/20/418894120.db2.gz	IDOIEHMCTDHWSJ-WDEREUQCSA-N	1	1	302.338	1.676	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365839909	418914988	/nfs/dbraw/zinc/91/49/88/418914988.db2.gz	UBWWCQCCKPVOTO-BDJLRTHQSA-N	1	1	319.361	1.769	20	5		DDBDMO
Cc1ccnc(N[C@@H]2CC[N@@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000372957580	418916359	/nfs/dbraw/zinc/91/63/59/418916359.db2.gz	ZUEOVVYAFGBGQL-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1ccnc(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000372957580	418916361	/nfs/dbraw/zinc/91/63/61/418916361.db2.gz	ZUEOVVYAFGBGQL-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1	ZINC000420968472	419389369	/nfs/dbraw/zinc/38/93/69/419389369.db2.gz	BXCRZZIATVKKSJ-GFCCVEGCSA-N	1	1	321.377	1.950	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)C[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000420943302	419372482	/nfs/dbraw/zinc/37/24/82/419372482.db2.gz	POQPOECQNYKBRA-OLZOCXBDSA-N	1	1	324.377	1.933	20	5		DDBDMO
C[C@H](O)[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101486	419661641	/nfs/dbraw/zinc/66/16/41/419661641.db2.gz	WZXDFPRIFFUEST-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H](O)[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101486	419661656	/nfs/dbraw/zinc/66/16/56/419661656.db2.gz	WZXDFPRIFFUEST-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H]1CCCSC1	ZINC000433195554	229171209	/nfs/dbraw/zinc/17/12/09/229171209.db2.gz	WINCLHJXUMMCDX-GFCCVEGCSA-N	1	1	314.411	1.635	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C)C1	ZINC000429027297	419963415	/nfs/dbraw/zinc/96/34/15/419963415.db2.gz	DRMGBCUDPQHEQX-HZSPNIEDSA-N	1	1	307.398	1.453	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000430934694	420213645	/nfs/dbraw/zinc/21/36/45/420213645.db2.gz	QLSGWTAZUQJVGN-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000416287334	420308102	/nfs/dbraw/zinc/30/81/02/420308102.db2.gz	BWMOFCMSGNHBCZ-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000416287334	420308106	/nfs/dbraw/zinc/30/81/06/420308106.db2.gz	BWMOFCMSGNHBCZ-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
CNC(=O)c1ccc(N(C)C[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000420629996	420335123	/nfs/dbraw/zinc/33/51/23/420335123.db2.gz	DATJHWNBJKYMSK-LBPRGKRZSA-N	1	1	306.366	1.485	20	5		DDBDMO
COC[C@@H](C)OC[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315462	230363163	/nfs/dbraw/zinc/36/31/63/230363163.db2.gz	QPCFGKMJVSJFRL-MLGOLLRUSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@@H](C)OC[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315462	230363164	/nfs/dbraw/zinc/36/31/64/230363164.db2.gz	QPCFGKMJVSJFRL-MLGOLLRUSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000450780378	420528044	/nfs/dbraw/zinc/52/80/44/420528044.db2.gz	QDCTYUNKSBJJPW-XHDPSFHLSA-N	1	1	319.361	1.830	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000457079747	420605888	/nfs/dbraw/zinc/60/58/88/420605888.db2.gz	SMIUVLAZHQGMDE-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000442309767	420678469	/nfs/dbraw/zinc/67/84/69/420678469.db2.gz	UDOXXMQARJQSRQ-MNOVXSKESA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000442309767	420678472	/nfs/dbraw/zinc/67/84/72/420678472.db2.gz	UDOXXMQARJQSRQ-MNOVXSKESA-N	1	1	320.349	1.084	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H](CO)[C@H]1CCCO1	ZINC000447911290	420816377	/nfs/dbraw/zinc/81/63/77/420816377.db2.gz	ZMWAQJXWMDWBER-DGCLKSJQSA-N	1	1	300.742	1.878	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(N(C)C)no1	ZINC000449257990	420976517	/nfs/dbraw/zinc/97/65/17/420976517.db2.gz	NYQXMQCTRHNPIV-SNVBAGLBSA-N	1	1	305.338	1.765	20	5		DDBDMO
CNc1nc(C(=O)N2CC[NH+](C3CCC3)CC2)ccc1[N+](=O)[O-]	ZINC000455641903	421049096	/nfs/dbraw/zinc/04/90/96/421049096.db2.gz	AEVIGWSHVHNIKY-UHFFFAOYSA-N	1	1	319.365	1.342	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000456039688	421092652	/nfs/dbraw/zinc/09/26/52/421092652.db2.gz	MVBYDWHFLRVSQS-CYBMUJFWSA-N	1	1	321.381	1.444	20	5		DDBDMO
CNc1nc(C(=O)N[C@H](C)C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC000456065406	421094319	/nfs/dbraw/zinc/09/43/19/421094319.db2.gz	NAOZFZGZIOOYMD-SNVBAGLBSA-N	1	1	309.370	1.490	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)[N@H+]1CCO	ZINC000456226400	421127566	/nfs/dbraw/zinc/12/75/66/421127566.db2.gz	OFRZEJGHFHHLBW-BETUJISGSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000456226400	421127570	/nfs/dbraw/zinc/12/75/70/421127570.db2.gz	OFRZEJGHFHHLBW-BETUJISGSA-N	1	1	321.377	1.051	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000449764501	421077834	/nfs/dbraw/zinc/07/78/34/421077834.db2.gz	BQXCRFBHWDGTSZ-JQWIXIFHSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000449764501	421077835	/nfs/dbraw/zinc/07/78/35/421077835.db2.gz	BQXCRFBHWDGTSZ-JQWIXIFHSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000449785785	421082016	/nfs/dbraw/zinc/08/20/16/421082016.db2.gz	JCGBBDYBOBAFSA-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000449785786	421082754	/nfs/dbraw/zinc/08/27/54/421082754.db2.gz	JCGBBDYBOBAFSA-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000456335297	421143660	/nfs/dbraw/zinc/14/36/60/421143660.db2.gz	AJDZELPTNPCLNK-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Nc1ncccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450569994	421211422	/nfs/dbraw/zinc/21/14/22/421211422.db2.gz	OSNOIKFLBHOKLI-LBPRGKRZSA-N	1	1	314.349	1.653	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2	ZINC000560624416	421284508	/nfs/dbraw/zinc/28/45/08/421284508.db2.gz	MVWXQHPPUFWHJQ-WCQYABFASA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[NH+](CC(C)(C)O)CC1	ZINC000563548491	421520510	/nfs/dbraw/zinc/52/05/10/421520510.db2.gz	HDAUWAUQUKOPCX-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[N@@H+](C)C2(CCCCC2)C1	ZINC000516978464	421585980	/nfs/dbraw/zinc/58/59/80/421585980.db2.gz	GNMXVLRPUIWNDO-UHFFFAOYSA-N	1	1	307.398	1.779	20	5		DDBDMO
CN1C(=O)C[C@H]([N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010347	421587652	/nfs/dbraw/zinc/58/76/52/421587652.db2.gz	JOZYWROWBHFUFA-OCCSQVGLSA-N	1	1	317.345	1.532	20	5		DDBDMO
CN1C(=O)C[C@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010347	421587654	/nfs/dbraw/zinc/58/76/54/421587654.db2.gz	JOZYWROWBHFUFA-OCCSQVGLSA-N	1	1	317.345	1.532	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H](C)C1	ZINC000554128841	421633364	/nfs/dbraw/zinc/63/33/64/421633364.db2.gz	SWZXXCGQGZBWGH-SCRDCRAPSA-N	1	1	320.393	1.736	20	5		DDBDMO
COc1ccc(C[NH2+]C2(CCO)CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000519832520	421733715	/nfs/dbraw/zinc/73/37/15/421733715.db2.gz	IYOMXNOQMJULIC-UHFFFAOYSA-N	1	1	323.393	1.540	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000522306429	421823820	/nfs/dbraw/zinc/82/38/20/421823820.db2.gz	PDRSBBZZUDAVPY-LBPRGKRZSA-N	1	1	304.350	1.631	20	5		DDBDMO
C[C@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[NH+]1CC(C)C1	ZINC000580842306	421847318	/nfs/dbraw/zinc/84/73/18/421847318.db2.gz	CGFOGAMDHSJOPF-SNVBAGLBSA-N	1	1	317.349	1.428	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000580929553	421863501	/nfs/dbraw/zinc/86/35/01/421863501.db2.gz	AELAQLHYCOGKQJ-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CCO1	ZINC000581984176	422082498	/nfs/dbraw/zinc/08/24/98/422082498.db2.gz	QWQOJHMGCBRLSC-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2nccc3cc([N+](=O)[O-])ccc32)CCO1	ZINC000581984176	422082504	/nfs/dbraw/zinc/08/25/04/422082504.db2.gz	QWQOJHMGCBRLSC-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
CNc1nccc(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597861295	422392190	/nfs/dbraw/zinc/39/21/90/422392190.db2.gz	SKUFZEAFGXDXIM-SNVBAGLBSA-N	1	1	321.381	1.634	20	5		DDBDMO
Nc1ccc(NC[C@H]2CC[N@H+]2C2CCCCC2)nc1[N+](=O)[O-]	ZINC000599126990	422403068	/nfs/dbraw/zinc/40/30/68/422403068.db2.gz	KUXAFLKRKZNFMN-GFCCVEGCSA-N	1	1	305.382	2.391	20	5		DDBDMO
CC[NH+](CC)C[C@@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000341691093	271172485	/nfs/dbraw/zinc/17/24/85/271172485.db2.gz	BBXOTGUADMPNNG-SNVBAGLBSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1	ZINC000341782273	271211161	/nfs/dbraw/zinc/21/11/61/271211161.db2.gz	ZJDIWIRLMFCPFS-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)[C@@H](C)C1	ZINC000341782273	271211163	/nfs/dbraw/zinc/21/11/63/271211163.db2.gz	ZJDIWIRLMFCPFS-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCCC[C@H]2C[NH+]2CCOCC2)cn1	ZINC000344436218	272027058	/nfs/dbraw/zinc/02/70/58/272027058.db2.gz	PVGUOFNMVRWIPJ-AWEZNQCLSA-N	1	1	306.366	1.681	20	5		DDBDMO
C[C@@H](Cc1[nH]cc[nH+]1)OCC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344582145	272065144	/nfs/dbraw/zinc/06/51/44/272065144.db2.gz	OGKWMFGHDVXSRP-NSHDSACASA-N	1	1	318.333	1.929	20	5		DDBDMO
COc1cc(N2C[C@H]3OCC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000301646497	274096948	/nfs/dbraw/zinc/09/69/48/274096948.db2.gz	ICIFIEAJOIQGEX-TZMCWYRMSA-N	1	1	311.313	1.262	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000433847087	276041841	/nfs/dbraw/zinc/04/18/41/276041841.db2.gz	CMMMJRVOHNNBAT-QWRGUYRKSA-N	1	1	321.381	1.798	20	5		DDBDMO
CCNc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000411038867	276271512	/nfs/dbraw/zinc/27/15/12/276271512.db2.gz	CCFVPAJAZKLBGO-SWLSCSKDSA-N	1	1	318.377	1.803	20	5		DDBDMO
Cn1cc([C@@H]2C[NH2+]CCN2C(=O)c2ccc([N+](=O)[O-])cc2)cn1	ZINC000181357457	294282762	/nfs/dbraw/zinc/28/27/62/294282762.db2.gz	QZFHTEZWKOPOEZ-AWEZNQCLSA-N	1	1	315.333	1.115	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000165683056	298216047	/nfs/dbraw/zinc/21/60/47/298216047.db2.gz	LLLJFOBSZBXJRR-GFCCVEGCSA-N	1	1	323.397	1.713	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000362434293	300062034	/nfs/dbraw/zinc/06/20/34/300062034.db2.gz	RMBWJUHRUCVAFZ-LLVKDONJSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000362434293	300062035	/nfs/dbraw/zinc/06/20/35/300062035.db2.gz	RMBWJUHRUCVAFZ-LLVKDONJSA-N	1	1	301.306	1.234	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)[nH]n1	ZINC000363171562	300226024	/nfs/dbraw/zinc/22/60/24/300226024.db2.gz	ZSEVUGJGSZWQSE-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)n[nH]1	ZINC000363171562	300226028	/nfs/dbraw/zinc/22/60/28/300226028.db2.gz	ZSEVUGJGSZWQSE-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n[nH]1	ZINC000363171562	300226029	/nfs/dbraw/zinc/22/60/29/300226029.db2.gz	ZSEVUGJGSZWQSE-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412263	301022402	/nfs/dbraw/zinc/02/24/02/301022402.db2.gz	RMJWPXATFKIWBM-FZMZJTMJSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](O)C3(CC3)C2)cccc1[N+](=O)[O-]	ZINC000368412263	301022405	/nfs/dbraw/zinc/02/24/05/301022405.db2.gz	RMJWPXATFKIWBM-FZMZJTMJSA-N	1	1	319.361	1.687	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497261	301040970	/nfs/dbraw/zinc/04/09/70/301040970.db2.gz	XBSQUIIMJXFIBB-LVQVYYBASA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497261	301040972	/nfs/dbraw/zinc/04/09/72/301040972.db2.gz	XBSQUIIMJXFIBB-LVQVYYBASA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497261	301040973	/nfs/dbraw/zinc/04/09/73/301040973.db2.gz	XBSQUIIMJXFIBB-LVQVYYBASA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000368587933	301059104	/nfs/dbraw/zinc/05/91/04/301059104.db2.gz	BUQQVMYWXKYPHJ-TZMCWYRMSA-N	1	1	319.361	1.526	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000368964176	301111315	/nfs/dbraw/zinc/11/13/15/301111315.db2.gz	NDCQJJJAVVZLIA-XUJVJEKNSA-N	1	1	319.361	1.559	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@]3(CCCCO3)C2)c1	ZINC000370095054	301274919	/nfs/dbraw/zinc/27/49/19/301274919.db2.gz	RDARFGGVVWUZON-GJZGRUSLSA-N	1	1	324.381	1.187	20	5		DDBDMO
CCNC(=O)C[N@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000370872993	301398778	/nfs/dbraw/zinc/39/87/78/301398778.db2.gz	MZECMBHQNVLSEL-UHFFFAOYSA-N	1	1	318.377	1.711	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000370872993	301398780	/nfs/dbraw/zinc/39/87/80/301398780.db2.gz	MZECMBHQNVLSEL-UHFFFAOYSA-N	1	1	318.377	1.711	20	5		DDBDMO
COC[C@@H](O)C[N@@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000370873997	301399101	/nfs/dbraw/zinc/39/91/01/301399101.db2.gz	WRUUKVJQAGMCSL-AWEZNQCLSA-N	1	1	321.377	1.582	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000377058242	302138955	/nfs/dbraw/zinc/13/89/55/302138955.db2.gz	VKAYDHXURRATFT-MNOVXSKESA-N	1	1	306.322	1.052	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]12	ZINC000377715114	302217863	/nfs/dbraw/zinc/21/78/63/302217863.db2.gz	CTYOYUXHKQJIHC-KOLCDFICSA-N	1	1	316.317	1.304	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@H]12	ZINC000377715114	302217866	/nfs/dbraw/zinc/21/78/66/302217866.db2.gz	CTYOYUXHKQJIHC-KOLCDFICSA-N	1	1	316.317	1.304	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000378286045	302308392	/nfs/dbraw/zinc/30/83/92/302308392.db2.gz	JDUYRTKVUSPYRD-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCN2CC[NH+]([C@H]3CCOC3)CC2)cc1	ZINC000378398043	302321548	/nfs/dbraw/zinc/32/15/48/302321548.db2.gz	GSEGRGPORSGCQA-HNNXBMFYSA-N	1	1	321.377	1.380	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000530306825	303191969	/nfs/dbraw/zinc/19/19/69/303191969.db2.gz	MPOCPYRCXKZMPG-UHFFFAOYSA-N	1	1	319.361	1.524	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000362582532	307020931	/nfs/dbraw/zinc/02/09/31/307020931.db2.gz	ZMLNMHIDHROUOH-VIFPVBQESA-N	1	1	313.304	1.483	20	5		DDBDMO
Cc1cc(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)ncc1[N+](=O)[O-]	ZINC000364887498	307052485	/nfs/dbraw/zinc/05/24/85/307052485.db2.gz	JEHNEPJRDCNOHA-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1cc(N[C@H]2CCN(C3CC[NH+](C)CC3)C2)ncc1[N+](=O)[O-]	ZINC000364887498	307052486	/nfs/dbraw/zinc/05/24/86/307052486.db2.gz	JEHNEPJRDCNOHA-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000370813785	307136909	/nfs/dbraw/zinc/13/69/09/307136909.db2.gz	BQKSMWCVXNIIMP-UHFFFAOYSA-N	1	1	305.378	2.000	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330448	307168022	/nfs/dbraw/zinc/16/80/22/307168022.db2.gz	KZWUTCHFJKLOHJ-RWMBFGLXSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330448	307168023	/nfs/dbraw/zinc/16/80/23/307168023.db2.gz	KZWUTCHFJKLOHJ-RWMBFGLXSA-N	1	1	323.397	1.731	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c(C)cc1[N+](=O)[O-]	ZINC000517395356	307433525	/nfs/dbraw/zinc/43/35/25/307433525.db2.gz	HSMXCNYHNBIMEF-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
COC(=O)c1cnc(NC[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000564766621	308005092	/nfs/dbraw/zinc/00/50/92/308005092.db2.gz	GINVPWVZQHIYSU-NSHDSACASA-N	1	1	322.365	1.919	20	5		DDBDMO
Cn1cc([C@H]2C[N@@H+](CCn3ccc([N+](=O)[O-])n3)CC2(C)C)cn1	ZINC000573264017	308234845	/nfs/dbraw/zinc/23/48/45/308234845.db2.gz	QGWUQZYOUOGEFW-CYBMUJFWSA-N	1	1	318.381	1.650	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@](O)(C(F)F)C2)ccc1[N+](=O)[O-]	ZINC000451440160	533822184	/nfs/dbraw/zinc/82/21/84/533822184.db2.gz	WLUPKLVHTWRLJT-ZDUSSCGKSA-N	1	1	302.277	1.805	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@](O)(C(F)F)C2)ccc1[N+](=O)[O-]	ZINC000451440160	533822194	/nfs/dbraw/zinc/82/21/94/533822194.db2.gz	WLUPKLVHTWRLJT-ZDUSSCGKSA-N	1	1	302.277	1.805	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000445176534	533826498	/nfs/dbraw/zinc/82/64/98/533826498.db2.gz	DYUWAPWWXPPCLI-PHIMTYICSA-N	1	1	322.365	1.688	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000305427192	527363705	/nfs/dbraw/zinc/36/37/05/527363705.db2.gz	CAMRGBVYKMBFNW-CYBMUJFWSA-N	1	1	307.350	1.429	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1)C(C)C	ZINC000444177429	528512970	/nfs/dbraw/zinc/51/29/70/528512970.db2.gz	VWLPAHZIDGIKDS-UHFFFAOYSA-N	1	1	321.424	1.665	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCCCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000457199682	528546113	/nfs/dbraw/zinc/54/61/13/528546113.db2.gz	LDVDSDVDWHVJES-UHFFFAOYSA-N	1	1	323.397	1.875	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1	ZINC000412270878	528984213	/nfs/dbraw/zinc/98/42/13/528984213.db2.gz	PNZYZOJCPNCFNA-LSDHHAIUSA-N	1	1	303.362	1.907	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000451253361	529344102	/nfs/dbraw/zinc/34/41/02/529344102.db2.gz	JNZSTJUTPAXASJ-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000736848357	598243475	/nfs/dbraw/zinc/24/34/75/598243475.db2.gz	LWEXFPVSDIVDGU-SECBINFHSA-N	1	1	303.326	1.139	20	5		DDBDMO
CC[N@@H+](CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])C1CC1	ZINC000736537122	598298591	/nfs/dbraw/zinc/29/85/91/598298591.db2.gz	RGGFZWFISXQVLN-UHFFFAOYSA-N	1	1	317.353	1.671	20	5		DDBDMO
C[C@@H](CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000820281955	606706311	/nfs/dbraw/zinc/70/63/11/606706311.db2.gz	ZSYFWWKZHZLXJL-QMMMGPOBSA-N	1	1	318.341	1.065	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000821266423	607160664	/nfs/dbraw/zinc/16/06/64/607160664.db2.gz	CMFAQIRNQFHOPN-SECBINFHSA-N	1	1	318.341	1.066	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000101955517	696609548	/nfs/dbraw/zinc/60/95/48/696609548.db2.gz	YIHPPYYJRDKPOK-UHFFFAOYSA-N	1	1	310.310	1.573	20	5		DDBDMO
C[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCOC1	ZINC000106857507	696628270	/nfs/dbraw/zinc/62/82/70/696628270.db2.gz	AJDQAEOUNXVCRK-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
C[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCOC1	ZINC000106857507	696628271	/nfs/dbraw/zinc/62/82/71/696628271.db2.gz	AJDQAEOUNXVCRK-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000776582115	698121223	/nfs/dbraw/zinc/12/12/23/698121223.db2.gz	QNUIPDIIELLOCW-IAQYHMDHSA-N	1	1	322.361	1.902	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC3(C2)OCCO3)cc1	ZINC000776590557	698123549	/nfs/dbraw/zinc/12/35/49/698123549.db2.gz	HXRIEMHAGDTDMN-CQSZACIVSA-N	1	1	308.334	1.467	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC3(C2)OCCO3)cc1	ZINC000776590557	698123551	/nfs/dbraw/zinc/12/35/51/698123551.db2.gz	HXRIEMHAGDTDMN-CQSZACIVSA-N	1	1	308.334	1.467	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCSC[C@H]2CCO)c1	ZINC000750095182	700203483	/nfs/dbraw/zinc/20/34/83/700203483.db2.gz	WHGSUHRSMZVIKW-KGLIPLIRSA-N	1	1	312.391	1.428	20	5		DDBDMO
NC(=[NH+]OCCOc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000782333630	698710129	/nfs/dbraw/zinc/71/01/29/698710129.db2.gz	ZXOXSAKUKFIRIS-UHFFFAOYSA-N	1	1	309.322	1.899	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782525614	698734458	/nfs/dbraw/zinc/73/44/58/698734458.db2.gz	ZHZBTKDULMWVKI-ONGXEEELSA-N	1	1	311.313	1.518	20	5		DDBDMO
Cc1nn(CN2CC[N@@H+](C3CCOCC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000782899245	698782722	/nfs/dbraw/zinc/78/27/22/698782722.db2.gz	SNVONUHHIOPWHE-LBPRGKRZSA-N	1	1	323.397	1.242	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@H+]2CCC[C@H]2C)cc1[N+](=O)[O-]	ZINC000783922773	698892281	/nfs/dbraw/zinc/89/22/81/698892281.db2.gz	WCZYZGALKKWMBX-LLVKDONJSA-N	1	1	306.366	1.851	20	5		DDBDMO
CON(C)C(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000788020836	699268212	/nfs/dbraw/zinc/26/82/12/699268212.db2.gz	JAANOAQHOFDQNV-UHFFFAOYSA-N	1	1	307.350	1.969	20	5		DDBDMO
CS(=O)(=O)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000714244111	699269689	/nfs/dbraw/zinc/26/96/89/699269689.db2.gz	YQJNGKUXPAYPLS-XYPYZODXSA-N	1	1	318.782	1.913	20	5		DDBDMO
O=C(NC1CC1)c1ccc(C[N@@H+](CC[N+](=O)[O-])C2CC2)cc1	ZINC000791052768	699608857	/nfs/dbraw/zinc/60/88/57/699608857.db2.gz	CCLNRFJTVJBDDK-UHFFFAOYSA-N	1	1	303.362	1.820	20	5		DDBDMO
O=C(NC1CC1)c1ccc(C[N@H+](CC[N+](=O)[O-])C2CC2)cc1	ZINC000791052768	699608859	/nfs/dbraw/zinc/60/88/59/699608859.db2.gz	CCLNRFJTVJBDDK-UHFFFAOYSA-N	1	1	303.362	1.820	20	5		DDBDMO
O=C1O[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CCC2	ZINC000792282512	699689696	/nfs/dbraw/zinc/68/96/96/699689696.db2.gz	UHEZRKUITUWBGV-ZDUSSCGKSA-N	1	1	317.345	1.834	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CCC2	ZINC000792282512	699689697	/nfs/dbraw/zinc/68/96/97/699689697.db2.gz	UHEZRKUITUWBGV-ZDUSSCGKSA-N	1	1	317.345	1.834	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1	ZINC000793925198	699787337	/nfs/dbraw/zinc/78/73/37/699787337.db2.gz	NISYKTZSQTWTST-OLZOCXBDSA-N	1	1	303.362	1.927	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@](C)(O)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000794672392	699823391	/nfs/dbraw/zinc/82/33/91/699823391.db2.gz	LXIGLNDTQPJGFQ-OAHLLOKOSA-N	1	1	319.365	1.842	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](CCCCO)CC1	ZINC000795102605	699845855	/nfs/dbraw/zinc/84/58/55/699845855.db2.gz	YLCOVNQCXZMAHR-UHFFFAOYSA-N	1	1	311.386	1.014	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@H]1CCN(Cn2nccc2[N+](=O)[O-])C1	ZINC000743376180	699909959	/nfs/dbraw/zinc/90/99/59/699909959.db2.gz	JURUDDJACITOQS-HNNXBMFYSA-N	1	1	315.377	1.955	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)[C@@H](C)C1	ZINC000761077096	700840287	/nfs/dbraw/zinc/84/02/87/700840287.db2.gz	MWUKMYPUXFOCSA-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000762715299	700904128	/nfs/dbraw/zinc/90/41/28/700904128.db2.gz	BCVCMXSAFDSHKQ-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@]1(CO)CCOC1	ZINC000763888908	700952112	/nfs/dbraw/zinc/95/21/12/700952112.db2.gz	SXROIFLSPMYZPG-CYBMUJFWSA-N	1	1	300.742	1.831	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[NH+](C[C@H]3CCCO3)CC2)n1	ZINC000765454028	701013464	/nfs/dbraw/zinc/01/34/64/701013464.db2.gz	XFKZMNSPNLDPCM-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H](C)CO	ZINC000839603859	701751177	/nfs/dbraw/zinc/75/11/77/701751177.db2.gz	HXHURRNBYZBJFZ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H](C)CO	ZINC000839603859	701751181	/nfs/dbraw/zinc/75/11/81/701751181.db2.gz	HXHURRNBYZBJFZ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
Cn1ncc2c1CCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000839625065	701757690	/nfs/dbraw/zinc/75/76/90/701757690.db2.gz	MFZPWDKSWYOQHO-INIZCTEOSA-N	1	1	316.361	1.810	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)[nH]1	ZINC000839658330	701768821	/nfs/dbraw/zinc/76/88/21/701768821.db2.gz	FAMHGQDRLDNQOP-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658330	701768827	/nfs/dbraw/zinc/76/88/27/701768827.db2.gz	FAMHGQDRLDNQOP-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658330	701768833	/nfs/dbraw/zinc/76/88/33/701768833.db2.gz	FAMHGQDRLDNQOP-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658330	701768839	/nfs/dbraw/zinc/76/88/39/701768839.db2.gz	FAMHGQDRLDNQOP-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658330	701768844	/nfs/dbraw/zinc/76/88/44/701768844.db2.gz	FAMHGQDRLDNQOP-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839724442	701798180	/nfs/dbraw/zinc/79/81/80/701798180.db2.gz	IDLDZDDNNXPULU-ZGKBOVNRSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839724442	701798186	/nfs/dbraw/zinc/79/81/86/701798186.db2.gz	IDLDZDDNNXPULU-ZGKBOVNRSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839724442	701798190	/nfs/dbraw/zinc/79/81/90/701798190.db2.gz	IDLDZDDNNXPULU-ZGKBOVNRSA-N	1	1	303.362	1.288	20	5		DDBDMO
Cc1nn(CN2CC[C@]3(C2)CCC[N@H+](C)C3)c(C)c1[N+](=O)[O-]	ZINC000840085368	701959018	/nfs/dbraw/zinc/95/90/18/701959018.db2.gz	DATOHZGAJRIAAR-OAHLLOKOSA-N	1	1	307.398	1.783	20	5		DDBDMO
CC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@H]1CCOC1	ZINC000812298283	702141976	/nfs/dbraw/zinc/14/19/76/702141976.db2.gz	LAWJCPUSNHPYFG-ZDUSSCGKSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@H]1CCOC1	ZINC000812298283	702141977	/nfs/dbraw/zinc/14/19/77/702141977.db2.gz	LAWJCPUSNHPYFG-ZDUSSCGKSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000866206840	706648413	/nfs/dbraw/zinc/64/84/13/706648413.db2.gz	GDWRGYANPJTHCS-PWSUYJOCSA-N	1	1	304.350	1.224	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@@H]2C1	ZINC000816952047	702235564	/nfs/dbraw/zinc/23/55/64/702235564.db2.gz	BEMWUXMHGRUYJB-ISVAXAHUSA-N	1	1	308.313	1.092	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000816954086	702237808	/nfs/dbraw/zinc/23/78/08/702237808.db2.gz	STGALXSLNNAYNT-ZDSVCRJJSA-N	1	1	301.346	1.771	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](CO)[C@H]2CO)c(Cl)c1	ZINC000879364760	706662768	/nfs/dbraw/zinc/66/27/68/706662768.db2.gz	OUCQJFFJBRMKMI-SMDDNHRTSA-N	1	1	314.769	1.813	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](CO)[C@H]2CO)c(Cl)c1	ZINC000879364760	706662769	/nfs/dbraw/zinc/66/27/69/706662769.db2.gz	OUCQJFFJBRMKMI-SMDDNHRTSA-N	1	1	314.769	1.813	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000869284009	702552856	/nfs/dbraw/zinc/55/28/56/702552856.db2.gz	CCJDNDGOUJSJKJ-GFCCVEGCSA-N	1	1	309.341	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH2+]C[C@H]3CCCO3)n2)s1	ZINC000843218850	702844129	/nfs/dbraw/zinc/84/41/29/702844129.db2.gz	GROYKTKMHNUFRJ-MRVPVSSYSA-N	1	1	310.335	1.975	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1[NH3+]	ZINC000843353687	702865104	/nfs/dbraw/zinc/86/51/04/702865104.db2.gz	MXRDREDUEFAZAB-GWCFXTLKSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@H]1[NH3+]	ZINC000843353688	702865164	/nfs/dbraw/zinc/86/51/64/702865164.db2.gz	MXRDREDUEFAZAB-GXFFZTMASA-N	1	1	324.356	1.732	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000879561542	706718370	/nfs/dbraw/zinc/71/83/70/706718370.db2.gz	QFXBGHGIWHEHGK-QWHCGFSZSA-N	1	1	321.402	1.879	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000851820594	703864350	/nfs/dbraw/zinc/86/43/50/703864350.db2.gz	CLMZBFSKFFXULW-SECBINFHSA-N	1	1	319.408	1.419	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852437437	704048401	/nfs/dbraw/zinc/04/84/01/704048401.db2.gz	YCCMXDFGUWEPCD-ZIAGYGMSSA-N	1	1	321.333	1.155	20	5		DDBDMO
C[C@@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000870789977	704132997	/nfs/dbraw/zinc/13/29/97/704132997.db2.gz	LFZVPOHFWALDKJ-RYUDHWBXSA-N	1	1	310.354	1.597	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@@H](CN3CCCC3=O)C2)c(C)c1[N+](=O)[O-]	ZINC000853595342	704280232	/nfs/dbraw/zinc/28/02/32/704280232.db2.gz	ZPOBQHYDZPPQHQ-CYBMUJFWSA-N	1	1	321.381	1.310	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](CN3CCCC3=O)C2)c(C)c1[N+](=O)[O-]	ZINC000853595342	704280235	/nfs/dbraw/zinc/28/02/35/704280235.db2.gz	ZPOBQHYDZPPQHQ-CYBMUJFWSA-N	1	1	321.381	1.310	20	5		DDBDMO
O=C1CC[C@@H](C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)O1	ZINC000821354873	704395876	/nfs/dbraw/zinc/39/58/76/704395876.db2.gz	LACXBCMCUHWBCU-AWEZNQCLSA-N	1	1	305.334	1.422	20	5		DDBDMO
Nc1ccc(NC(=O)CCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000854494869	704407592	/nfs/dbraw/zinc/40/75/92/704407592.db2.gz	GWKWPFQOLCQFRS-UHFFFAOYSA-N	1	1	322.365	1.618	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000823113407	705143721	/nfs/dbraw/zinc/14/37/21/705143721.db2.gz	XIVHQOZSCMMKSN-GFCCVEGCSA-N	1	1	301.387	1.049	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(CCC(C)(C)[N+](=O)[O-])no1	ZINC000823234629	705178939	/nfs/dbraw/zinc/17/89/39/705178939.db2.gz	KLMKZSRVRAFIMC-QMMMGPOBSA-N	1	1	300.315	1.011	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000874823246	705182364	/nfs/dbraw/zinc/18/23/64/705182364.db2.gz	GVSKQFHBATWMDZ-UONOGXRCSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000874834282	705190932	/nfs/dbraw/zinc/19/09/32/705190932.db2.gz	QUSLQUKNTWVUOJ-GHMZBOCLSA-N	1	1	306.322	1.004	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848392	705202186	/nfs/dbraw/zinc/20/21/86/705202186.db2.gz	SGBVGBZXBBYDNV-KBPBESRZSA-N	1	1	318.377	1.945	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000861339487	705433461	/nfs/dbraw/zinc/43/34/61/705433461.db2.gz	CDWSWBMNCLSUOB-ABAIWWIYSA-N	1	1	308.334	1.861	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000827338671	705979709	/nfs/dbraw/zinc/97/97/09/705979709.db2.gz	PZSGNMIGLFJPAO-TZMCWYRMSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cn1cc(C[N@H+](C)C[C@]2(O)CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000877605290	706157071	/nfs/dbraw/zinc/15/70/71/706157071.db2.gz	YLBBDPWYPNTHRA-MRXNPFEDSA-N	1	1	316.361	1.594	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@]2(O)CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000877605290	706157073	/nfs/dbraw/zinc/15/70/73/706157073.db2.gz	YLBBDPWYPNTHRA-MRXNPFEDSA-N	1	1	316.361	1.594	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@]3(CCSC3)C2)cc1	ZINC000829261959	706310658	/nfs/dbraw/zinc/31/06/58/706310658.db2.gz	QRXDTIZWXNGNJY-LSDHHAIUSA-N	1	1	324.402	1.836	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@]3(CCSC3)C2)cc1	ZINC000829261959	706310660	/nfs/dbraw/zinc/31/06/60/706310660.db2.gz	QRXDTIZWXNGNJY-LSDHHAIUSA-N	1	1	324.402	1.836	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000830110206	706456446	/nfs/dbraw/zinc/45/64/46/706456446.db2.gz	BQSDJGYEUARYBU-JUDXGUMMSA-N	1	1	303.362	1.907	20	5		DDBDMO
C[C@@H]1CN(C)C(=O)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000865710760	706503040	/nfs/dbraw/zinc/50/30/40/706503040.db2.gz	CMVBIAYSOWPEDC-SNVBAGLBSA-N	1	1	300.318	1.810	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3cc(F)c([N+](=O)[O-])cc3CO)C2)C1	ZINC000865827387	706538310	/nfs/dbraw/zinc/53/83/10/706538310.db2.gz	JUVAAIWUGLIJHB-HNNXBMFYSA-N	1	1	309.341	1.758	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000880146273	706891877	/nfs/dbraw/zinc/89/18/77/706891877.db2.gz	STNSINISOXCPOA-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000880146273	706891881	/nfs/dbraw/zinc/89/18/81/706891881.db2.gz	STNSINISOXCPOA-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@H]2CCOC[C@H]2OC)cc1[N+](=O)[O-]	ZINC000880425586	706970647	/nfs/dbraw/zinc/97/06/47/706970647.db2.gz	GHAWSLYHBHVUPG-SWLSCSKDSA-N	1	1	310.350	1.839	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430912	706973368	/nfs/dbraw/zinc/97/33/68/706973368.db2.gz	XJLQPXNPKBBGEA-KGLIPLIRSA-N	1	1	323.349	1.269	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430912	706973371	/nfs/dbraw/zinc/97/33/71/706973371.db2.gz	XJLQPXNPKBBGEA-KGLIPLIRSA-N	1	1	323.349	1.269	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880433021	706974305	/nfs/dbraw/zinc/97/43/05/706974305.db2.gz	SSEABQYWVCCHAV-RBSFLKMASA-N	1	1	310.350	1.364	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@H]1C[N@@H+](C)CCN1C	ZINC000873051183	707709589	/nfs/dbraw/zinc/70/95/89/707709589.db2.gz	DELOHTIHAZAUEN-AWEZNQCLSA-N	1	1	306.410	1.547	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@H]1C[N@H+](C)CCN1C	ZINC000873051183	707709591	/nfs/dbraw/zinc/70/95/91/707709591.db2.gz	DELOHTIHAZAUEN-AWEZNQCLSA-N	1	1	306.410	1.547	20	5		DDBDMO
CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000882960760	707874700	/nfs/dbraw/zinc/87/47/00/707874700.db2.gz	UXXZTOMUQMLOHT-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
CC[NH+](CC)[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccccc1	ZINC000839464100	708049319	/nfs/dbraw/zinc/04/93/19/708049319.db2.gz	VKQYYTSTCAEOPK-RBSFLKMASA-N	1	1	305.378	1.851	20	5		DDBDMO
Cc1ccccc1[C@H](CO)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000886433766	708760395	/nfs/dbraw/zinc/76/03/95/708760395.db2.gz	UBURAXQXCCBFIJ-AWEZNQCLSA-N	1	1	304.350	1.765	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593161	708785485	/nfs/dbraw/zinc/78/54/85/708785485.db2.gz	JQEBWJCOABWWHQ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593161	708785489	/nfs/dbraw/zinc/78/54/89/708785489.db2.gz	JQEBWJCOABWWHQ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593161	708785492	/nfs/dbraw/zinc/78/54/92/708785492.db2.gz	JQEBWJCOABWWHQ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593161	708785494	/nfs/dbraw/zinc/78/54/94/708785494.db2.gz	JQEBWJCOABWWHQ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cc1[N+](=O)[O-]	ZINC000887939006	709173576	/nfs/dbraw/zinc/17/35/76/709173576.db2.gz	KATXQGULLMOUPH-CJNGLKHVSA-N	1	1	303.362	1.927	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c1C	ZINC000889636894	709568303	/nfs/dbraw/zinc/56/83/03/709568303.db2.gz	HOINAFBUONVIDC-OCCSQVGLSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c1C	ZINC000889636894	709568305	/nfs/dbraw/zinc/56/83/05/709568305.db2.gz	HOINAFBUONVIDC-OCCSQVGLSA-N	1	1	321.377	1.661	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000928448988	713201522	/nfs/dbraw/zinc/20/15/22/713201522.db2.gz	DGOWJJVFLKARCK-PSASIEDQSA-N	1	1	307.306	1.146	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928456456	713204992	/nfs/dbraw/zinc/20/49/92/713204992.db2.gz	RPLYOWIDVQDINW-ZWNOBZJWSA-N	1	1	318.377	1.992	20	5		DDBDMO
COc1c(O)ccc(CN2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000893669907	710770505	/nfs/dbraw/zinc/77/05/05/710770505.db2.gz	XCLBNAQVRRRBRM-MNOVXSKESA-N	1	1	309.366	1.833	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(c3ncnc4sc([N+](=O)[O-])cc43)[C@H]2C1	ZINC000893941963	710894570	/nfs/dbraw/zinc/89/45/70/710894570.db2.gz	XULUMRVBBJOEQD-SCZZXKLOSA-N	1	1	305.363	1.740	20	5		DDBDMO
COc1cc([C@H](C)[NH2+][C@@H](C)C(=O)N(C)OC)cc([N+](=O)[O-])c1	ZINC000903209002	711065948	/nfs/dbraw/zinc/06/59/48/711065948.db2.gz	DDHWHSWYRYJWII-UWVGGRQHSA-N	1	1	311.338	1.662	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H](CO)CC2)c1[N+](=O)[O-]	ZINC000894650559	711229128	/nfs/dbraw/zinc/22/91/28/711229128.db2.gz	XTBYKBLQKMQASZ-NSHDSACASA-N	1	1	310.350	1.903	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(F)cc2c1NCC[N@@H+]1CC[C@@H](O)C1	ZINC000894782674	711269874	/nfs/dbraw/zinc/26/98/74/711269874.db2.gz	XBPKKMKVJNQPOZ-LLVKDONJSA-N	1	1	320.324	1.183	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@@H]1CO	ZINC000894890914	711310923	/nfs/dbraw/zinc/31/09/23/711310923.db2.gz	WGCWYDAJMVJBKB-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@H]1Cc2c[nH+]cn2C1	ZINC000894996607	711356530	/nfs/dbraw/zinc/35/65/30/711356530.db2.gz	NLEWNSVRSLEUSB-JTQLQIEISA-N	1	1	316.317	1.923	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1	ZINC000913533660	713247893	/nfs/dbraw/zinc/24/78/93/713247893.db2.gz	ZQUGFNVDEVESJJ-AOOOYVTPSA-N	1	1	324.768	1.749	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1	ZINC000913533660	713247895	/nfs/dbraw/zinc/24/78/95/713247895.db2.gz	ZQUGFNVDEVESJJ-AOOOYVTPSA-N	1	1	324.768	1.749	20	5		DDBDMO
C[C@@H]1[C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000895738216	711591216	/nfs/dbraw/zinc/59/12/16/711591216.db2.gz	IATWKYPQOBCONY-MWLCHTKSSA-N	1	1	313.379	1.503	20	5		DDBDMO
C[C@@H]1[C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895738216	711591217	/nfs/dbraw/zinc/59/12/17/711591217.db2.gz	IATWKYPQOBCONY-MWLCHTKSSA-N	1	1	313.379	1.503	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000896564697	711753471	/nfs/dbraw/zinc/75/34/71/711753471.db2.gz	RMMPEWVQQXOFSJ-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
O=[N+]([O-])CC[NH2+]Cc1cc(Br)c2c(c1)OCCO2	ZINC000905067016	711926391	/nfs/dbraw/zinc/92/63/91/711926391.db2.gz	XNUKGEHNQZVRKH-UHFFFAOYSA-N	1	1	317.139	1.587	20	5		DDBDMO
O=[N+]([O-])CC[NH2+][C@@H](CO)c1ccc(Br)c(F)c1	ZINC000930557249	713865799	/nfs/dbraw/zinc/86/57/99/713865799.db2.gz	BPSHQKDAEFKXPC-JTQLQIEISA-N	1	1	307.119	1.488	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@@H](O)c1cccc(Br)c1	ZINC000930715231	713902260	/nfs/dbraw/zinc/90/22/60/713902260.db2.gz	GQFJIGADVMUDIX-LLVKDONJSA-N	1	1	303.156	1.691	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@@H](O)c1cccc(Br)c1	ZINC000930715231	713902261	/nfs/dbraw/zinc/90/22/61/713902261.db2.gz	GQFJIGADVMUDIX-LLVKDONJSA-N	1	1	303.156	1.691	20	5		DDBDMO
CN(C[C@@H]1CCCC[N@@H+]1CC[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000931979698	714224567	/nfs/dbraw/zinc/22/45/67/714224567.db2.gz	YVQYWGJEVUSWDA-LBPRGKRZSA-N	1	1	301.387	1.985	20	5		DDBDMO
CN(C[C@@H]1CCCC[N@H+]1CC[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000931979698	714224568	/nfs/dbraw/zinc/22/45/68/714224568.db2.gz	YVQYWGJEVUSWDA-LBPRGKRZSA-N	1	1	301.387	1.985	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1C(=O)NC(C)(C)C	ZINC000932436609	714330803	/nfs/dbraw/zinc/33/08/03/714330803.db2.gz	YYOVMGAAMPFFPC-GFCCVEGCSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C(=O)NC(C)(C)C	ZINC000932436609	714330804	/nfs/dbraw/zinc/33/08/04/714330804.db2.gz	YYOVMGAAMPFFPC-GFCCVEGCSA-N	1	1	323.397	1.479	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H]2C2OCCO2)cc1	ZINC000933902374	714696999	/nfs/dbraw/zinc/69/69/99/714696999.db2.gz	ZNTPYTDCSFMBHB-KGLIPLIRSA-N	1	1	308.334	1.466	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1C[C@H](O)C[N@@H+]1C	ZINC000924990253	714718276	/nfs/dbraw/zinc/71/82/76/714718276.db2.gz	UYVVSLXYMFQWSO-OLZOCXBDSA-N	1	1	321.377	1.315	20	5		DDBDMO
C/C(=C\C(=O)NCC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])cc1	ZINC000924997446	714721045	/nfs/dbraw/zinc/72/10/45/714721045.db2.gz	HNMSCKKMOPZTJK-VAWYXSNFSA-N	1	1	307.350	1.038	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000934121148	714747409	/nfs/dbraw/zinc/74/74/09/714747409.db2.gz	KOUPFODPQIFTKG-TZMCWYRMSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@@H]2CC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000934121148	714747410	/nfs/dbraw/zinc/74/74/10/714747410.db2.gz	KOUPFODPQIFTKG-TZMCWYRMSA-N	1	1	323.349	1.651	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H](O)[C@@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570365	714854120	/nfs/dbraw/zinc/85/41/20/714854120.db2.gz	DXABTQLKKXUEBN-GXFFZTMASA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H](O)[C@@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570365	714854121	/nfs/dbraw/zinc/85/41/21/714854121.db2.gz	DXABTQLKKXUEBN-GXFFZTMASA-N	1	1	311.313	1.328	20	5		DDBDMO
C[C@@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000928246696	740129884	/nfs/dbraw/zinc/12/98/84/740129884.db2.gz	LBZJLXMFZLQIGH-WDBKCZKBSA-N	1	1	307.350	1.227	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H](O)CC23CCC3)c([N+](=O)[O-])c1	ZINC001195305567	746572606	/nfs/dbraw/zinc/57/26/06/746572606.db2.gz	DGUPGQGKQVRKTK-CYBMUJFWSA-N	1	1	319.361	1.573	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1C[C@@H]2[C@H](O)CC[C@@H]2C1	ZINC001197739736	747255498	/nfs/dbraw/zinc/25/54/98/747255498.db2.gz	QIRRRIFZUGCELZ-GUIRCDHDSA-N	1	1	322.361	1.037	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](CO)[C@H](CCO)C2)ccc1[N+](=O)[O-]	ZINC001198755072	747600186	/nfs/dbraw/zinc/60/01/86/747600186.db2.gz	XGCAVCLQPDNHCO-ZIAGYGMSSA-N	1	1	324.377	1.416	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC001129080693	751247115	/nfs/dbraw/zinc/24/71/15/751247115.db2.gz	VGECPZAUWXQULS-BVUBDWEXSA-N	1	1	315.373	1.861	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169018751	762198816	/nfs/dbraw/zinc/19/88/16/762198816.db2.gz	DIQCMSLLZLLXRR-XBFCOCLRSA-N	1	1	308.382	1.411	20	5		DDBDMO
CCc1ncnc2c1CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169022086	762201035	/nfs/dbraw/zinc/20/10/35/762201035.db2.gz	MUIQWQQEPFJXOS-CHWSQXEVSA-N	1	1	304.394	1.885	20	5		DDBDMO
CN1CCN(C2CC[NH+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)CC1	ZINC001169026325	762203535	/nfs/dbraw/zinc/20/35/35/762203535.db2.gz	KVKJFFNMTGJGMT-HOCLYGCPSA-N	1	1	310.442	1.144	20	5		DDBDMO
Cc1ccccc1C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086083337	760943499	/nfs/dbraw/zinc/94/34/99/760943499.db2.gz	VRTBPFOWQGSUTP-SLBVQIDZSA-N	1	1	317.389	1.645	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CC2=CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086083309	760943686	/nfs/dbraw/zinc/94/36/86/760943686.db2.gz	URTPAOXKIXEMEF-LXTVHRRPSA-N	1	1	307.394	1.636	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1	ZINC001170344618	766275982	/nfs/dbraw/zinc/27/59/82/766275982.db2.gz	DIVCYWYZJWQDDV-GFCCVEGCSA-N	1	1	322.361	1.983	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1	ZINC001170344618	766275988	/nfs/dbraw/zinc/27/59/88/766275988.db2.gz	DIVCYWYZJWQDDV-GFCCVEGCSA-N	1	1	322.361	1.983	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1CC2(CCC2)C1	ZINC001132587457	769008117	/nfs/dbraw/zinc/00/81/17/769008117.db2.gz	GKWAWVRJXVZDGV-UHFFFAOYSA-N	1	1	321.381	1.114	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1	ZINC001134551206	771059363	/nfs/dbraw/zinc/05/93/63/771059363.db2.gz	YMFJLRZHJZVLTJ-BZNIZROVSA-N	1	1	319.361	1.627	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001136452931	771972085	/nfs/dbraw/zinc/97/20/85/771972085.db2.gz	OAZRPFVUHBUKLF-NSHDSACASA-N	1	1	321.381	1.422	20	5		DDBDMO
CCCCCC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001147505915	773155635	/nfs/dbraw/zinc/15/56/35/773155635.db2.gz	ANOBSUXMEZJRBT-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCCCCC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147505915	773155637	/nfs/dbraw/zinc/15/56/37/773155637.db2.gz	ANOBSUXMEZJRBT-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCCCCC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147505915	773155640	/nfs/dbraw/zinc/15/56/40/773155640.db2.gz	ANOBSUXMEZJRBT-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](O)[C@H](CO)C1)CC2	ZINC001172903303	776916173	/nfs/dbraw/zinc/91/61/73/776916173.db2.gz	GNVMATFAQXNDJV-ZMSDIMECSA-N	1	1	320.389	1.517	20	5		DDBDMO
C[C@H]1C(=O)NCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908135	776918445	/nfs/dbraw/zinc/91/84/45/776918445.db2.gz	BCKJZTCGPQFMBT-FZMZJTMJSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@H]1C(=O)NCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908135	776918452	/nfs/dbraw/zinc/91/84/52/776918452.db2.gz	BCKJZTCGPQFMBT-FZMZJTMJSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(=O)N1CCOCC1	ZINC001173228942	777062493	/nfs/dbraw/zinc/06/24/93/777062493.db2.gz	OEOMBOWKGFHWOD-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
O=[N+]([O-])c1cccc(Br)c1C[NH2+]C/C=C/CO	ZINC001179122374	779288713	/nfs/dbraw/zinc/28/87/13/779288713.db2.gz	AFHDZCXFBREBOH-OWOJBTEDSA-N	1	1	301.140	1.995	20	5		DDBDMO
COc1cc(CNC[C@H]2CCCC[N@@H+]2C)c([N+](=O)[O-])cc1O	ZINC001179730251	779470271	/nfs/dbraw/zinc/47/02/71/779470271.db2.gz	TXQPIQNZXBBAJY-GFCCVEGCSA-N	1	1	309.366	1.883	20	5		DDBDMO
COc1cc(CNC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1O	ZINC001179730251	779470273	/nfs/dbraw/zinc/47/02/73/779470273.db2.gz	TXQPIQNZXBBAJY-GFCCVEGCSA-N	1	1	309.366	1.883	20	5		DDBDMO
CC[N@H+](Cc1ccccc1F)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC001116150878	780479807	/nfs/dbraw/zinc/47/98/07/780479807.db2.gz	ZMAWRYCLOVVTJG-CQSZACIVSA-N	1	1	322.340	1.813	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@@H](C(C)C)N1CC[NH+](C)CC1	ZINC001117243984	780693420	/nfs/dbraw/zinc/69/34/20/780693420.db2.gz	NPOXBTOUWCEJDZ-AWEZNQCLSA-N	1	1	321.425	1.404	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](C(=O)NC2CC2)C1	ZINC001119305542	781399264	/nfs/dbraw/zinc/39/92/64/781399264.db2.gz	CHTNRNDKEGTXGM-LBPRGKRZSA-N	1	1	321.381	1.090	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2ccns2)CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001268036311	839510585	/nfs/dbraw/zinc/51/05/85/839510585.db2.gz	QHBCRDVINFQHRB-VXGBXAGGSA-N	1	1	324.406	1.327	20	5		DDBDMO
Nc1ccc[nH+]c1N1CCN(c2cccc([N+](=O)[O-])n2)CC1	ZINC001154782428	861448445	/nfs/dbraw/zinc/44/84/45/861448445.db2.gz	OHRCCVVSKPKVRJ-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
Cc1cc(C)cc(C[NH2+]C/C=C\CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001274014971	851849248	/nfs/dbraw/zinc/84/92/48/851849248.db2.gz	FOCXNZDKFLYEJC-JGPFYOFESA-N	1	1	317.389	1.731	20	5		DDBDMO
COC(=O)c1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc([N+](=O)[O-])c1	ZINC001155892648	862536123	/nfs/dbraw/zinc/53/61/23/862536123.db2.gz	KSKAISRNXXEDDA-TVQRCGJNSA-N	1	1	321.333	1.204	20	5		DDBDMO
COCCCC[NH2+]C1(C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001327982217	862610392	/nfs/dbraw/zinc/61/03/92/862610392.db2.gz	NSXHAXAWFGLJFI-CHWSQXEVSA-N	1	1	313.398	1.049	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1C[C@@H]2C)c1ccc([N+](=O)[O-])cc1	ZINC001124020489	859530113	/nfs/dbraw/zinc/53/01/13/859530113.db2.gz	OOAJUAZQBRSMDJ-SLEUVZQESA-N	1	1	318.377	1.160	20	5		DDBDMO
Cc1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1C	ZINC001157767449	864117871	/nfs/dbraw/zinc/11/78/71/864117871.db2.gz	NEVFFZFLULPZPX-HUUCEWRRSA-N	1	1	305.378	1.565	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC001225483848	881863002	/nfs/dbraw/zinc/86/30/02/881863002.db2.gz	KAXNZSKGNLBXLB-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
COc1ccc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)c([N+](=O)[O-])c1	ZINC001225769322	882020995	/nfs/dbraw/zinc/02/09/95/882020995.db2.gz	JPDPSBNYCIKCPS-TURKWSHLSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1ccc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c([N+](=O)[O-])c1	ZINC001225769322	882021017	/nfs/dbraw/zinc/02/10/17/882021017.db2.gz	JPDPSBNYCIKCPS-TURKWSHLSA-N	1	1	306.318	1.786	20	5		DDBDMO
CC(C)[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001162811088	867844912	/nfs/dbraw/zinc/84/49/12/867844912.db2.gz	ZELCFTRWQXUPDM-HZPDHXFCSA-N	1	1	319.405	1.721	20	5		DDBDMO
COc1nc(N[C@H]2CC[N@H+](C(C)C)C[C@H]2C)ncc1[N+](=O)[O-]	ZINC001163357054	868390537	/nfs/dbraw/zinc/39/05/37/868390537.db2.gz	ITRMAYHJJDYVSA-MNOVXSKESA-N	1	1	309.370	1.924	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ncc(Cl)cc2[N+](=O)[O-])C1	ZINC001226131089	882222073	/nfs/dbraw/zinc/22/20/73/882222073.db2.gz	ACABFYANHQLLGH-SNVBAGLBSA-N	1	1	301.730	1.743	20	5		DDBDMO
CN1CCC[C@H](C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001336763994	869130624	/nfs/dbraw/zinc/13/06/24/869130624.db2.gz	WRWDKIAJGLWVAZ-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
Nc1cc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ncc1[N+](=O)[O-]	ZINC001339824729	870717923	/nfs/dbraw/zinc/71/79/23/870717923.db2.gz	RKDIJPVPWZTSNG-ZYHUDNBSSA-N	1	1	309.395	1.564	20	5		DDBDMO
O=C(NCCCCC[NH+]1CCNCC1)c1ccccc1[N+](=O)[O-]	ZINC001341824327	871846076	/nfs/dbraw/zinc/84/60/76/871846076.db2.gz	SBSGQXAJXAAWAT-UHFFFAOYSA-N	1	1	320.393	1.400	20	5		DDBDMO
C[C@@H](C[N+](C)(C)C)Oc1ncnc2[nH]nc(Br)c21	ZINC001226667638	882575256	/nfs/dbraw/zinc/57/52/56/882575256.db2.gz	BHXWDWOPAALPSM-ZETCQYMHSA-N	1	1	315.195	1.589	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC2CC2)C[C@@H]1C	ZINC001348145017	874377724	/nfs/dbraw/zinc/37/77/24/874377724.db2.gz	JLMLDVBFJILHMN-NWDGAFQWSA-N	1	1	322.413	1.556	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC001349709043	875318103	/nfs/dbraw/zinc/31/81/03/875318103.db2.gz	FCPIGNUJJGWQTR-UHFFFAOYSA-N	1	1	311.313	1.624	20	5		DDBDMO
CN1C(=O)C[C@H]([NH2+]CC[N+](=O)[O-])[C@H]1c1ccc(Cl)c(F)c1	ZINC001351401421	876230855	/nfs/dbraw/zinc/23/08/55/876230855.db2.gz	VKFBOLUBSIDNLW-WCQYABFASA-N	1	1	315.732	1.617	20	5		DDBDMO
COCC[NH+](CCOC)C1CN(c2sccc2[N+](=O)[O-])C1	ZINC001354226708	877821365	/nfs/dbraw/zinc/82/13/65/877821365.db2.gz	QXWOHWWTWLHXTG-UHFFFAOYSA-N	1	1	315.395	1.440	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC001288259396	912803991	/nfs/dbraw/zinc/80/39/91/912803991.db2.gz	NKZNSRPBOVLQGQ-NSHDSACASA-N	1	1	322.321	1.635	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC001288259396	912804006	/nfs/dbraw/zinc/80/40/06/912804006.db2.gz	NKZNSRPBOVLQGQ-NSHDSACASA-N	1	1	322.321	1.635	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@@H]3C[C@@H](CO)C[C@@H]31)C2	ZINC001254594728	896521073	/nfs/dbraw/zinc/52/10/73/896521073.db2.gz	SPQVGZUGZHGYPP-RGXXSHLXSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@@H]3C[C@@H](CO)C[C@@H]31)C2	ZINC001254594728	896521080	/nfs/dbraw/zinc/52/10/80/896521080.db2.gz	SPQVGZUGZHGYPP-RGXXSHLXSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCC[C@@H](n3cncn3)C1)C2	ZINC001254604341	896528936	/nfs/dbraw/zinc/52/89/36/896528936.db2.gz	VUOYQSNAEDPGDC-CVEARBPZSA-N	1	1	313.361	1.991	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(NCCC[NH+]3CCOCC3)nc2c1	ZINC000278518092	214205977	/nfs/dbraw/zinc/20/59/77/214205977.db2.gz	SCCRHBMYXJITME-UHFFFAOYSA-N	1	1	305.338	1.605	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@H](C)C1	ZINC000286555157	219050961	/nfs/dbraw/zinc/05/09/61/219050961.db2.gz	AAIOGCAUKXOPLB-GFCCVEGCSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@H](C)C1	ZINC000286555157	219050962	/nfs/dbraw/zinc/05/09/62/219050962.db2.gz	AAIOGCAUKXOPLB-GFCCVEGCSA-N	1	1	320.393	1.827	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000249500632	282161402	/nfs/dbraw/zinc/16/14/02/282161402.db2.gz	XCYWJIKYBZVUOK-NEPJUHHUSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000249500632	282161404	/nfs/dbraw/zinc/16/14/04/282161404.db2.gz	XCYWJIKYBZVUOK-NEPJUHHUSA-N	1	1	323.349	1.005	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@H+]1CCCO	ZINC000452348654	231356129	/nfs/dbraw/zinc/35/61/29/231356129.db2.gz	LIZUDGYTNRJYCZ-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CCOCC1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000088600660	185259460	/nfs/dbraw/zinc/25/94/60/185259460.db2.gz	OMELCZZSLZWTHD-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CCOCC1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000088600660	185259461	/nfs/dbraw/zinc/25/94/61/185259461.db2.gz	OMELCZZSLZWTHD-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN1C(=O)CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1=O	ZINC000090027068	185278861	/nfs/dbraw/zinc/27/88/61/185278861.db2.gz	QOFXAVUUFUQTFK-NSHDSACASA-N	1	1	311.725	1.485	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000090554611	185303152	/nfs/dbraw/zinc/30/31/52/185303152.db2.gz	XKLIMMWUUVNKCH-HIFRSBDPSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000090554611	185303157	/nfs/dbraw/zinc/30/31/57/185303157.db2.gz	XKLIMMWUUVNKCH-HIFRSBDPSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000090554611	185303158	/nfs/dbraw/zinc/30/31/58/185303158.db2.gz	XKLIMMWUUVNKCH-HIFRSBDPSA-N	1	1	322.409	1.419	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000299458805	282255699	/nfs/dbraw/zinc/25/56/99/282255699.db2.gz	WVOJEZDZGMZSFE-VIFPVBQESA-N	1	1	320.353	1.208	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C1CCCCC1	ZINC000444853605	529916945	/nfs/dbraw/zinc/91/69/45/529916945.db2.gz	VABQDNMPWWBVTF-UHFFFAOYSA-N	1	1	322.365	1.690	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000294534640	529913014	/nfs/dbraw/zinc/91/30/14/529913014.db2.gz	MGMJRSINSRIXJD-UHFFFAOYSA-N	1	1	319.361	1.768	20	5		DDBDMO
CCOC(=O)c1cc(N2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000615494260	362306864	/nfs/dbraw/zinc/30/68/64/362306864.db2.gz	JNFKRGRGCGEVHU-NSHDSACASA-N	1	1	307.350	1.912	20	5		DDBDMO
Cn1cc[nH+]c1Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O	ZINC000158558471	290744504	/nfs/dbraw/zinc/74/45/04/290744504.db2.gz	ROOICEBXKLTWHF-UHFFFAOYSA-N	1	1	311.301	1.600	20	5		DDBDMO
CNC(=O)[C@H](CCSC)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000342301326	282545210	/nfs/dbraw/zinc/54/52/10/282545210.db2.gz	XWRPMPAFYVYFTC-LBPRGKRZSA-N	1	1	315.370	1.691	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000272609434	210008635	/nfs/dbraw/zinc/00/86/35/210008635.db2.gz	SDKVKSJVSJUMLD-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000272606289	210004361	/nfs/dbraw/zinc/00/43/61/210004361.db2.gz	JRFRMVBCCCPRSP-ZFWWWQNUSA-N	1	1	303.362	1.690	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)n1	ZINC000331210785	232795104	/nfs/dbraw/zinc/79/51/04/232795104.db2.gz	RGGGKRSARPCJRU-SNVBAGLBSA-N	1	1	307.354	1.191	20	5		DDBDMO
CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000279920725	215238674	/nfs/dbraw/zinc/23/86/74/215238674.db2.gz	WFHAJKWTPJWENC-ZDUSSCGKSA-N	1	1	307.350	1.626	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000287077953	219299667	/nfs/dbraw/zinc/29/96/67/219299667.db2.gz	YDXYWHSLAPZUBM-UHFFFAOYSA-N	1	1	317.349	1.774	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000149096191	186047860	/nfs/dbraw/zinc/04/78/60/186047860.db2.gz	IKSGSEVREVJKBC-UHFFFAOYSA-N	1	1	304.350	1.609	20	5		DDBDMO
C[C@H]1OCC[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000182026239	199376405	/nfs/dbraw/zinc/37/64/05/199376405.db2.gz	MCVMPSLBXVRTED-XQQFMLRXSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@H]1OCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1C	ZINC000182026239	199376407	/nfs/dbraw/zinc/37/64/07/199376407.db2.gz	MCVMPSLBXVRTED-XQQFMLRXSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000266863572	186363241	/nfs/dbraw/zinc/36/32/41/186363241.db2.gz	LEUAZICMFWRSTO-GFCCVEGCSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000266863572	186363242	/nfs/dbraw/zinc/36/32/42/186363242.db2.gz	LEUAZICMFWRSTO-GFCCVEGCSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1nccs1	ZINC000564845213	304019047	/nfs/dbraw/zinc/01/90/47/304019047.db2.gz	RYRXBHSDKKJLSJ-JTQLQIEISA-N	1	1	309.347	1.581	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000280057662	215343689	/nfs/dbraw/zinc/34/36/89/215343689.db2.gz	MLIVVGLHEIHZHX-HNNXBMFYSA-N	1	1	307.350	1.431	20	5		DDBDMO
CC(C)(CNc1ccc([N+](=O)[O-])c2nonc21)[NH+]1CCOCC1	ZINC000015171453	352153312	/nfs/dbraw/zinc/15/33/12/352153312.db2.gz	YMTOTPDDWAQCLM-UHFFFAOYSA-N	1	1	321.337	1.654	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC(=O)N(C)C	ZINC000041894458	352317074	/nfs/dbraw/zinc/31/70/74/352317074.db2.gz	KLGNBXYELUETCL-UHFFFAOYSA-N	1	1	322.365	1.252	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000063466938	352912664	/nfs/dbraw/zinc/91/26/64/352912664.db2.gz	MNOSXBWMRGYPDG-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000069529192	353165812	/nfs/dbraw/zinc/16/58/12/353165812.db2.gz	JPVJIFFOVWMPKC-LBPRGKRZSA-N	1	1	307.350	1.435	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)Cc2ccccc2[N+](=O)[O-])n1C	ZINC000074095401	353290330	/nfs/dbraw/zinc/29/03/30/353290330.db2.gz	JWPAVJWHOKJFAU-UHFFFAOYSA-N	1	1	317.349	1.253	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000174534623	198349141	/nfs/dbraw/zinc/34/91/41/198349141.db2.gz	MUWRMJKOXFZQHR-AWEZNQCLSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000174668172	198367495	/nfs/dbraw/zinc/36/74/95/198367495.db2.gz	LLLQXCLNPALXMR-UHFFFAOYSA-N	1	1	311.386	1.338	20	5		DDBDMO
Cc1cnc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)c([N+](=O)[O-])c1	ZINC000078664105	353527673	/nfs/dbraw/zinc/52/76/73/353527673.db2.gz	IWLFBPLTDKCJQD-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
COC(=O)C(C)(C)[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000093280904	353892204	/nfs/dbraw/zinc/89/22/04/353892204.db2.gz	OCSYQBJWULVUSF-LBPRGKRZSA-N	1	1	324.381	1.703	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038048	354223344	/nfs/dbraw/zinc/22/33/44/354223344.db2.gz	HONAWWFSCWSRTM-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038048	354223348	/nfs/dbraw/zinc/22/33/48/354223348.db2.gz	HONAWWFSCWSRTM-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
O=C1CC2(CN1)CC[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC2	ZINC000267721427	354405097	/nfs/dbraw/zinc/40/50/97/354405097.db2.gz	YSNJOWVQOKAHCR-UHFFFAOYSA-N	1	1	307.325	1.836	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000318130265	354514465	/nfs/dbraw/zinc/51/44/65/354514465.db2.gz	AKDHMNMJYHVUKR-PHIMTYICSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000318130265	354514467	/nfs/dbraw/zinc/51/44/67/354514467.db2.gz	AKDHMNMJYHVUKR-PHIMTYICSA-N	1	1	306.366	1.801	20	5		DDBDMO
Nc1cc(NC[C@H]2CC[N@H+](C3CC3)C2)cc(CO)c1[N+](=O)[O-]	ZINC000587178313	354881903	/nfs/dbraw/zinc/88/19/03/354881903.db2.gz	FEQANMCDGPPXJP-SNVBAGLBSA-N	1	1	306.366	1.566	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588862584	354944236	/nfs/dbraw/zinc/94/42/36/354944236.db2.gz	GNUWJJLRWMGECZ-ZIAGYGMSSA-N	1	1	319.361	1.184	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588861875	354944283	/nfs/dbraw/zinc/94/42/83/354944283.db2.gz	VTYRTBXSUPIVGC-VXGBXAGGSA-N	1	1	323.324	1.015	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000590537465	355109637	/nfs/dbraw/zinc/10/96/37/355109637.db2.gz	JMHBBNQJBQUVED-YPMHNXCESA-N	1	1	308.313	1.248	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590442833	355096814	/nfs/dbraw/zinc/09/68/14/355096814.db2.gz	HLYSCOOTNPVXSX-BXUZGUMPSA-N	1	1	304.350	1.169	20	5		DDBDMO
CCN1C[C@@H]([NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1=O	ZINC000590659566	355140145	/nfs/dbraw/zinc/14/01/45/355140145.db2.gz	YHWITHFJWXSZJQ-NSHDSACASA-N	1	1	321.333	1.076	20	5		DDBDMO
C[C@H](CC[NH+]1CCN(C)CC1)Nc1ncc([N+](=O)[O-])cc1F	ZINC000591155720	355256544	/nfs/dbraw/zinc/25/65/44/355256544.db2.gz	GDPCIDJXORKKPF-LLVKDONJSA-N	1	1	311.361	1.567	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CCNC1CC1	ZINC000591577324	355329763	/nfs/dbraw/zinc/32/97/63/355329763.db2.gz	PYJGXWIMAUFJFJ-LLVKDONJSA-N	1	1	306.366	1.654	20	5		DDBDMO
CCCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000592828097	355704895	/nfs/dbraw/zinc/70/48/95/355704895.db2.gz	BNJAXCRZURDKHR-NSHDSACASA-N	1	1	308.338	1.252	20	5		DDBDMO
CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C)C1	ZINC000592828684	355705299	/nfs/dbraw/zinc/70/52/99/355705299.db2.gz	HXVCOXXEHNZCCA-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000592828684	355705302	/nfs/dbraw/zinc/70/53/02/355705302.db2.gz	HXVCOXXEHNZCCA-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC[C@@H]2CO)c1	ZINC000592999032	355765645	/nfs/dbraw/zinc/76/56/45/355765645.db2.gz	JCBGQEODUPWHGJ-CYBMUJFWSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCC[C@@H]2CO)c1	ZINC000592999032	355765647	/nfs/dbraw/zinc/76/56/47/355765647.db2.gz	JCBGQEODUPWHGJ-CYBMUJFWSA-N	1	1	308.334	1.728	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000593186965	355820086	/nfs/dbraw/zinc/82/00/86/355820086.db2.gz	BMIJCOFGDXPBLU-JHJVBQTASA-N	1	1	321.377	1.913	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000081527107	192283396	/nfs/dbraw/zinc/28/33/96/192283396.db2.gz	GJYIRGOOYTWISN-LLVKDONJSA-N	1	1	322.365	1.156	20	5		DDBDMO
COc1ccc(C[N@@H+](CCOCCO)C2CCC2)cc1[N+](=O)[O-]	ZINC000595598488	356569442	/nfs/dbraw/zinc/56/94/42/356569442.db2.gz	FDCVESROWLGZDA-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@H]2COC[C@]2(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000595756460	356638348	/nfs/dbraw/zinc/63/83/48/356638348.db2.gz	GGPQELHCEMFEBK-LRDDRELGSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595835870	356671300	/nfs/dbraw/zinc/67/13/00/356671300.db2.gz	WKBHXUJLEKVTOH-AGIUHOORSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595835870	356671304	/nfs/dbraw/zinc/67/13/04/356671304.db2.gz	WKBHXUJLEKVTOH-AGIUHOORSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H](C)[NH+]1CCOCC1	ZINC000596113919	356777023	/nfs/dbraw/zinc/77/70/23/356777023.db2.gz	FBFHWMGQHMKLNZ-MNOVXSKESA-N	1	1	322.365	1.215	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1	ZINC000596512164	356902044	/nfs/dbraw/zinc/90/20/44/356902044.db2.gz	REJUUSVUHZHKCG-CYBMUJFWSA-N	1	1	314.345	1.927	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])c[nH]1	ZINC000596512164	356902047	/nfs/dbraw/zinc/90/20/47/356902047.db2.gz	REJUUSVUHZHKCG-CYBMUJFWSA-N	1	1	314.345	1.927	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@]3(O)C[C@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000597209391	357093570	/nfs/dbraw/zinc/09/35/70/357093570.db2.gz	AWPOZDSTLFTEQI-XHDPSFHLSA-N	1	1	308.334	1.569	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@]3(O)C[C@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000597209391	357093573	/nfs/dbraw/zinc/09/35/73/357093573.db2.gz	AWPOZDSTLFTEQI-XHDPSFHLSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cccc([N+](=O)[O-])c1N)C2	ZINC000597716645	357300077	/nfs/dbraw/zinc/30/00/77/357300077.db2.gz	RAJXVZFYIVNQSF-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597926258	357385473	/nfs/dbraw/zinc/38/54/73/357385473.db2.gz	WYGICCFJOROFKG-LLVKDONJSA-N	1	1	306.366	1.901	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)N[C@H]1CC[N@H+](C2CCCCC2)C1	ZINC000598218488	357497391	/nfs/dbraw/zinc/49/73/91/357497391.db2.gz	GFYIFECFMIPLJL-LBPRGKRZSA-N	1	1	321.381	1.315	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000598341645	357544758	/nfs/dbraw/zinc/54/47/58/357544758.db2.gz	FFOHHSVQAUMUMV-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@H](CO)C2)c1	ZINC000598649094	357670480	/nfs/dbraw/zinc/67/04/80/357670480.db2.gz	VLVYQGHSLOKOAF-FZMZJTMJSA-N	1	1	322.361	1.832	20	5		DDBDMO
CC[C@@H]1[NH2+]CC[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000599102251	357816039	/nfs/dbraw/zinc/81/60/39/357816039.db2.gz	QDNKQLDGJRHBKN-VHSXEESVSA-N	1	1	317.342	1.153	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599790197	358059445	/nfs/dbraw/zinc/05/94/45/358059445.db2.gz	BEESUKBQMODZKE-GFCCVEGCSA-N	1	1	322.365	1.400	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC1CC([NH+]2CCOCC2)C1	ZINC000600068378	358114104	/nfs/dbraw/zinc/11/41/04/358114104.db2.gz	AKIJPCHYPCAUDU-UHFFFAOYSA-N	1	1	319.361	1.117	20	5		DDBDMO
C[NH2+]C1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCC1	ZINC000600822829	358325258	/nfs/dbraw/zinc/32/52/58/358325258.db2.gz	BBWHVTYAGUATPM-UHFFFAOYSA-N	1	1	303.322	1.343	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000600963538	358360007	/nfs/dbraw/zinc/36/00/07/358360007.db2.gz	XDWYYSBFHYIRRN-UHFFFAOYSA-N	1	1	324.356	1.101	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000601120528	358410594	/nfs/dbraw/zinc/41/05/94/358410594.db2.gz	IAUVEFSGSBPSCE-NSHDSACASA-N	1	1	310.329	1.287	20	5		DDBDMO
C[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC(=O)N1C	ZINC000601162754	358428742	/nfs/dbraw/zinc/42/87/42/358428742.db2.gz	WMBJDGMKSDZAOJ-JTQLQIEISA-N	1	1	300.318	1.810	20	5		DDBDMO
CCN1C[C@@H](CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000601183488	358437717	/nfs/dbraw/zinc/43/77/17/358437717.db2.gz	CQCMWJGTLDTVQZ-LLVKDONJSA-N	1	1	314.345	1.845	20	5		DDBDMO
CCC1([NH+](C)C)CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC000601792284	358697316	/nfs/dbraw/zinc/69/73/16/358697316.db2.gz	UWYPVDSJNGDFLM-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
O=C1[C@H]([N@H+]2C[C@@H]3COC[C@@H]3C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000601975500	358761914	/nfs/dbraw/zinc/76/19/14/358761914.db2.gz	WJOAFGPUCVUYEV-TYNCELHUSA-N	1	1	317.345	1.278	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c1	ZINC000601976252	358762922	/nfs/dbraw/zinc/76/29/22/358762922.db2.gz	OZUNMULPHBJFPN-BETUJISGSA-N	1	1	306.318	1.460	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000602195462	358876468	/nfs/dbraw/zinc/87/64/68/358876468.db2.gz	LSUJJTKVKJUDQE-LRDDRELGSA-N	1	1	321.377	1.260	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@]2(CCCOC2)C1	ZINC000602786924	359191273	/nfs/dbraw/zinc/19/12/73/359191273.db2.gz	ZUUQCNJJDZKQCK-HNNXBMFYSA-N	1	1	308.382	1.992	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1	ZINC000602795312	359197921	/nfs/dbraw/zinc/19/79/21/359197921.db2.gz	HUHOLHMXOWNHJD-JSGCOSHPSA-N	1	1	318.381	1.879	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC000602798991	359200125	/nfs/dbraw/zinc/20/01/25/359200125.db2.gz	IGPDPLNUQWHZPD-SECBINFHSA-N	1	1	304.306	1.908	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817622	359212721	/nfs/dbraw/zinc/21/27/21/359212721.db2.gz	USJQETZMWDBZPX-OBJOEFQTSA-N	1	1	322.365	1.373	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817622	359212726	/nfs/dbraw/zinc/21/27/26/359212726.db2.gz	USJQETZMWDBZPX-OBJOEFQTSA-N	1	1	322.365	1.373	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])CC2(C)C)cn1	ZINC000602832560	359223962	/nfs/dbraw/zinc/22/39/62/359223962.db2.gz	PXPBLJQCIWLKAN-ZDUSSCGKSA-N	1	1	318.381	1.687	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](O)C[C@@]1(C)CO	ZINC000602910675	359289345	/nfs/dbraw/zinc/28/93/45/359289345.db2.gz	YSPOIBZRKHUVFW-HOCLYGCPSA-N	1	1	324.377	1.700	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](O)C[C@@]1(C)CO	ZINC000602910675	359289350	/nfs/dbraw/zinc/28/93/50/359289350.db2.gz	YSPOIBZRKHUVFW-HOCLYGCPSA-N	1	1	324.377	1.700	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602953163	359318324	/nfs/dbraw/zinc/31/83/24/359318324.db2.gz	PHZRKVNZCQLMME-NSHDSACASA-N	1	1	307.354	1.278	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC000602950564	359316567	/nfs/dbraw/zinc/31/65/67/359316567.db2.gz	FUZFZLMGKIXLHL-MNOVXSKESA-N	1	1	307.354	1.276	20	5		DDBDMO
CC1(C)[C@H]([NH+]2CCOCC2)C[C@@H]1Nc1ncc([N+](=O)[O-])cn1	ZINC000603400424	359616682	/nfs/dbraw/zinc/61/66/82/359616682.db2.gz	XBEXQESDPOCIIO-NWDGAFQWSA-N	1	1	307.354	1.296	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000189368714	200388546	/nfs/dbraw/zinc/38/85/46/200388546.db2.gz	HTDPDEGUVZAZMI-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000189368714	200388548	/nfs/dbraw/zinc/38/85/48/200388548.db2.gz	HTDPDEGUVZAZMI-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000609357430	360300559	/nfs/dbraw/zinc/30/05/59/360300559.db2.gz	INVWVGHFTKJLGN-JTQLQIEISA-N	1	1	321.333	1.395	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000609550422	360322640	/nfs/dbraw/zinc/32/26/40/360322640.db2.gz	WXZCQUDVIWTMOF-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846478	360354907	/nfs/dbraw/zinc/35/49/07/360354907.db2.gz	RTHJJMLEUZXLAE-CMPLNLGQSA-N	1	1	319.365	1.143	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846478	360354912	/nfs/dbraw/zinc/35/49/12/360354912.db2.gz	RTHJJMLEUZXLAE-CMPLNLGQSA-N	1	1	319.365	1.143	20	5		DDBDMO
C[C@H]1C[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000610271195	360405477	/nfs/dbraw/zinc/40/54/77/360405477.db2.gz	JWMXABVBMAZRSW-AAEUAGOBSA-N	1	1	321.377	1.938	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2CCCOC2)CC1	ZINC000610570057	360472514	/nfs/dbraw/zinc/47/25/14/360472514.db2.gz	SBAYFLBXGMFMGH-OAHLLOKOSA-N	1	1	319.361	1.532	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000611525671	360747073	/nfs/dbraw/zinc/74/70/73/360747073.db2.gz	DFPKHRLMPACTER-GFCCVEGCSA-N	1	1	322.409	1.837	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000611556115	360758808	/nfs/dbraw/zinc/75/88/08/360758808.db2.gz	IEUMILWRLSRWIU-GFCCVEGCSA-N	1	1	323.349	1.141	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000611556115	360758816	/nfs/dbraw/zinc/75/88/16/360758816.db2.gz	IEUMILWRLSRWIU-GFCCVEGCSA-N	1	1	323.349	1.141	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](C)C1	ZINC000281389934	216267555	/nfs/dbraw/zinc/26/75/55/216267555.db2.gz	GGBLTGDWLZNXDJ-GHMZBOCLSA-N	1	1	319.365	1.362	20	5		DDBDMO
CC(C)[C@H](CNc1cc(N)ccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000193381473	201043422	/nfs/dbraw/zinc/04/34/22/201043422.db2.gz	UBVAEJYFPLNVHO-INIZCTEOSA-N	1	1	321.425	1.861	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCc2[nH+]ccn2C1	ZINC000281457142	216313959	/nfs/dbraw/zinc/31/39/59/216313959.db2.gz	LJJRYQJYYGHFBW-LLVKDONJSA-N	1	1	304.354	1.991	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000619434451	364006961	/nfs/dbraw/zinc/00/69/61/364006961.db2.gz	OINCDVNJWHYZLW-HNNXBMFYSA-N	1	1	321.333	1.063	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)s1	ZINC000619694485	364117499	/nfs/dbraw/zinc/11/74/99/364117499.db2.gz	QIICHKIHGZRFAQ-NSHDSACASA-N	1	1	312.395	1.742	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)CCCOC	ZINC000275403633	212311614	/nfs/dbraw/zinc/31/16/14/212311614.db2.gz	FGMBLQBADZLCKL-UHFFFAOYSA-N	1	1	312.366	1.824	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000261718798	203101180	/nfs/dbraw/zinc/10/11/80/203101180.db2.gz	FARWWXJNYMPSKJ-LBPRGKRZSA-N	1	1	301.306	1.105	20	5		DDBDMO
NC(=O)C[N@@H+](CCC1CCCCC1)CCn1cc([N+](=O)[O-])cn1	ZINC000350090389	284146208	/nfs/dbraw/zinc/14/62/08/284146208.db2.gz	DIBBQHGSXCIAOG-UHFFFAOYSA-N	1	1	323.397	1.549	20	5		DDBDMO
CCOCC[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000093315162	193230788	/nfs/dbraw/zinc/23/07/88/193230788.db2.gz	XYTNYROZMBIXPI-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
CCOCC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000093315162	193230790	/nfs/dbraw/zinc/23/07/90/193230790.db2.gz	XYTNYROZMBIXPI-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
NC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000282802548	217260509	/nfs/dbraw/zinc/26/05/09/217260509.db2.gz	XGPLYJLMHXXMFM-ZDUSSCGKSA-N	1	1	320.349	1.263	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000266267806	205226472	/nfs/dbraw/zinc/22/64/72/205226472.db2.gz	GJCSENHHZWKVJR-UHFFFAOYSA-N	1	1	317.349	1.352	20	5		DDBDMO
CC(C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[NH+]1CCC(C)CC1	ZINC000160006213	197379695	/nfs/dbraw/zinc/37/96/95/197379695.db2.gz	XWVMXXSAOFAONE-LBPRGKRZSA-N	1	1	323.397	1.804	20	5		DDBDMO
COc1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)nn1	ZINC000338357557	249924412	/nfs/dbraw/zinc/92/44/12/249924412.db2.gz	MWCOWLOMGFTBSS-UHFFFAOYSA-N	1	1	318.337	1.427	20	5		DDBDMO
C[C@H](O)C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000159440807	197354468	/nfs/dbraw/zinc/35/44/68/197354468.db2.gz	LWQMDCPVJAABLM-IUCAKERBSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000159440807	197354470	/nfs/dbraw/zinc/35/44/70/197354470.db2.gz	LWQMDCPVJAABLM-IUCAKERBSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCCC[C@H]1C	ZINC000339003568	250242506	/nfs/dbraw/zinc/24/25/06/250242506.db2.gz	OCJKYRYAEGHHQS-GHMZBOCLSA-N	1	1	321.381	1.764	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269110136	207250174	/nfs/dbraw/zinc/25/01/74/207250174.db2.gz	IESJCWOIFWESRD-GHMZBOCLSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269110136	207250179	/nfs/dbraw/zinc/25/01/79/207250179.db2.gz	IESJCWOIFWESRD-GHMZBOCLSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269110136	207250182	/nfs/dbraw/zinc/25/01/82/207250182.db2.gz	IESJCWOIFWESRD-GHMZBOCLSA-N	1	1	307.354	1.183	20	5		DDBDMO
C[C@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000065424365	184342707	/nfs/dbraw/zinc/34/27/07/184342707.db2.gz	MTEDCFXTRIGYGB-JSGCOSHPSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000065424365	184342709	/nfs/dbraw/zinc/34/27/09/184342709.db2.gz	MTEDCFXTRIGYGB-JSGCOSHPSA-N	1	1	324.377	1.834	20	5		DDBDMO
COCC[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1C	ZINC000330703796	532967666	/nfs/dbraw/zinc/96/76/66/532967666.db2.gz	JLUGTVUMVWKBQW-GFCCVEGCSA-N	1	1	311.357	1.886	20	5		DDBDMO
C[N@@H+](CCC(=O)N1CCOCC1)CCc1ccccc1[N+](=O)[O-]	ZINC000352537796	285124342	/nfs/dbraw/zinc/12/43/42/285124342.db2.gz	AGOBUXCQHJLRSH-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000352661576	285205441	/nfs/dbraw/zinc/20/54/41/285205441.db2.gz	UHYODYGAFIUJQW-HONMWMINSA-N	1	1	307.350	1.767	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)C[C@H]1COCCN1	ZINC000422711130	533223145	/nfs/dbraw/zinc/22/31/45/533223145.db2.gz	GRAUZRNZMPFUIJ-AAEUAGOBSA-N	1	1	309.366	1.460	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000451539475	533415863	/nfs/dbraw/zinc/41/58/63/533415863.db2.gz	FISFUGJRPFNBHY-IVMMDQJWSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000452095064	533675216	/nfs/dbraw/zinc/67/52/16/533675216.db2.gz	KOTBOXWRTBVDEL-MRVWCRGKSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)CC[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC000114368936	407563647	/nfs/dbraw/zinc/56/36/47/407563647.db2.gz	VFUMZELNBUVUIK-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
COC(=O)CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072664936	406884364	/nfs/dbraw/zinc/88/43/64/406884364.db2.gz	POUOZFKHKUONEC-NSHDSACASA-N	1	1	308.338	1.429	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000045430537	407043841	/nfs/dbraw/zinc/04/38/41/407043841.db2.gz	ZPLKUHZRWPDPKY-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)NC(C)(C)C	ZINC000046056535	407052764	/nfs/dbraw/zinc/05/27/64/407052764.db2.gz	QJVUAQQLZSWFFI-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)NC(C)(C)C	ZINC000046056535	407052766	/nfs/dbraw/zinc/05/27/66/407052766.db2.gz	QJVUAQQLZSWFFI-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNS(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000108406007	407385767	/nfs/dbraw/zinc/38/57/67/407385767.db2.gz	VKVPKPDLTCPHOU-VIFPVBQESA-N	1	1	319.408	1.276	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000270983946	407451593	/nfs/dbraw/zinc/45/15/93/407451593.db2.gz	XOXCUFLCPGPQHA-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000270983946	407451596	/nfs/dbraw/zinc/45/15/96/407451596.db2.gz	XOXCUFLCPGPQHA-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000171062727	407585010	/nfs/dbraw/zinc/58/50/10/407585010.db2.gz	QZJOFKZFTHZQKH-LBPRGKRZSA-N	1	1	321.333	1.079	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000171062727	407585016	/nfs/dbraw/zinc/58/50/16/407585016.db2.gz	QZJOFKZFTHZQKH-LBPRGKRZSA-N	1	1	321.333	1.079	20	5		DDBDMO
CCCC[C@@H](C[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000261704222	407587303	/nfs/dbraw/zinc/58/73/03/407587303.db2.gz	OPAZUZZSJWZZHH-VIFPVBQESA-N	1	1	319.358	1.530	20	5		DDBDMO
CC[C@H]1CN(c2ncc(C)cc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000266225988	407534837	/nfs/dbraw/zinc/53/48/37/407534837.db2.gz	RODHGCRBOYKLJS-STQMWFEESA-N	1	1	308.382	1.580	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000171104466	407598809	/nfs/dbraw/zinc/59/88/09/407598809.db2.gz	CFRIQMDDWBTZLV-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H]1CCOC1	ZINC000178778194	407598911	/nfs/dbraw/zinc/59/89/11/407598911.db2.gz	CFNWXVIPWOQQDO-LBPRGKRZSA-N	1	1	319.361	1.452	20	5		DDBDMO
CNC(=O)[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(C)C	ZINC000178952374	407671902	/nfs/dbraw/zinc/67/19/02/407671902.db2.gz	AKZPZNLWFLYAIN-CYBMUJFWSA-N	1	1	323.349	1.322	20	5		DDBDMO
Cc1nccn1CCC[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000130491253	407693591	/nfs/dbraw/zinc/69/35/91/407693591.db2.gz	KFMWQFQMIZNZHO-UHFFFAOYSA-N	1	1	319.365	1.284	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@@H]1O	ZINC000186797471	407771724	/nfs/dbraw/zinc/77/17/24/407771724.db2.gz	VGJPRKOGAFGXNM-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@@H]1O	ZINC000186797471	407771731	/nfs/dbraw/zinc/77/17/31/407771731.db2.gz	VGJPRKOGAFGXNM-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000135532096	408028648	/nfs/dbraw/zinc/02/86/48/408028648.db2.gz	JASJCATXCOAPOF-GFCCVEGCSA-N	1	1	321.381	1.343	20	5		DDBDMO
CC[C@@]1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000135583242	408035133	/nfs/dbraw/zinc/03/51/33/408035133.db2.gz	PQJGGUFQXFTFKV-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000135583242	408035137	/nfs/dbraw/zinc/03/51/37/408035137.db2.gz	PQJGGUFQXFTFKV-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccn1	ZINC000181784949	408039692	/nfs/dbraw/zinc/03/96/92/408039692.db2.gz	WIOHNPUZSLYGIJ-JTQLQIEISA-N	1	1	300.318	1.940	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCOCC(F)F)C2)nc1	ZINC000189677571	408076615	/nfs/dbraw/zinc/07/66/15/408076615.db2.gz	VBZSFNHBNMBFGS-JTQLQIEISA-N	1	1	316.308	1.758	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000175211416	408081243	/nfs/dbraw/zinc/08/12/43/408081243.db2.gz	GQXKKMVTSFDMAP-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@H](CC(N)=O)C2)cc1[N+](=O)[O-]	ZINC000175242729	408085858	/nfs/dbraw/zinc/08/58/58/408085858.db2.gz	CAZGNSMIEPJELL-LLVKDONJSA-N	1	1	307.350	1.691	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182242512	408103885	/nfs/dbraw/zinc/10/38/85/408103885.db2.gz	LTJHUTQBLAQSHH-MCIONIFRSA-N	1	1	324.377	1.570	20	5		DDBDMO
CN(C(=O)C[N@@H+](CC(C)(C)O)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000189907761	408134023	/nfs/dbraw/zinc/13/40/23/408134023.db2.gz	ALYDQVDWZCRYHB-UHFFFAOYSA-N	1	1	321.377	1.793	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000246122138	408147762	/nfs/dbraw/zinc/14/77/62/408147762.db2.gz	NMZBZPAPDWCOTL-HIFRSBDPSA-N	1	1	310.350	1.445	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000155871981	408222063	/nfs/dbraw/zinc/22/20/63/408222063.db2.gz	OPVQBRCNMSGQIX-LBPRGKRZSA-N	1	1	313.379	1.027	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000155871981	408222066	/nfs/dbraw/zinc/22/20/66/408222066.db2.gz	OPVQBRCNMSGQIX-LBPRGKRZSA-N	1	1	313.379	1.027	20	5		DDBDMO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1	ZINC000269481613	408323820	/nfs/dbraw/zinc/32/38/20/408323820.db2.gz	KITZUAOVXDLMHN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176070131	408279632	/nfs/dbraw/zinc/27/96/32/408279632.db2.gz	UPAZYYONJZVBIR-JTQLQIEISA-N	1	1	317.349	1.748	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000269450451	408312074	/nfs/dbraw/zinc/31/20/74/408312074.db2.gz	GENMOQIUBKNRMF-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@H](C)C1	ZINC000246820888	408347979	/nfs/dbraw/zinc/34/79/79/408347979.db2.gz	SNABEVJSJGQKDA-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@H](C)O)[C@H](C)C1	ZINC000246820888	408347983	/nfs/dbraw/zinc/34/79/83/408347983.db2.gz	SNABEVJSJGQKDA-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000183583205	408446961	/nfs/dbraw/zinc/44/69/61/408446961.db2.gz	DCVYAGLEZXIJLE-LLVKDONJSA-N	1	1	323.353	1.080	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000264483719	408510471	/nfs/dbraw/zinc/51/04/71/408510471.db2.gz	IFZBUTRPJZUCBB-GFCCVEGCSA-N	1	1	307.350	1.354	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000264538368	408526841	/nfs/dbraw/zinc/52/68/41/408526841.db2.gz	AGVMVPBCJHUVEQ-LBPRGKRZSA-N	1	1	308.338	1.437	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000183647007	408461927	/nfs/dbraw/zinc/46/19/27/408461927.db2.gz	JZYVFDJWOQDEMM-LLVKDONJSA-N	1	1	307.354	1.795	20	5		DDBDMO
CC(C)[N@@H+]1CCC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000274828896	408548359	/nfs/dbraw/zinc/54/83/59/408548359.db2.gz	YZLFSKDVDAYPLL-GFCCVEGCSA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000274828896	408548362	/nfs/dbraw/zinc/54/83/62/408548362.db2.gz	YZLFSKDVDAYPLL-GFCCVEGCSA-N	1	1	307.350	1.903	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1	ZINC000177269597	408567507	/nfs/dbraw/zinc/56/75/07/408567507.db2.gz	KBFUXBNLXVTJJU-YPMHNXCESA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1	ZINC000177269597	408567510	/nfs/dbraw/zinc/56/75/10/408567510.db2.gz	KBFUXBNLXVTJJU-YPMHNXCESA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)C[C@@H]1[NH+]1CCOCC1	ZINC000177269597	408567513	/nfs/dbraw/zinc/56/75/13/408567513.db2.gz	KBFUXBNLXVTJJU-YPMHNXCESA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000248609008	408597015	/nfs/dbraw/zinc/59/70/15/408597015.db2.gz	PTKVMDNXRUNWII-UKRRQHHQSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000248609008	408597019	/nfs/dbraw/zinc/59/70/19/408597019.db2.gz	PTKVMDNXRUNWII-UKRRQHHQSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCOC1	ZINC000178343327	408808364	/nfs/dbraw/zinc/80/83/64/408808364.db2.gz	LSBBIXZBEFWHTH-JSGCOSHPSA-N	1	1	310.350	1.303	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@](C)(O)C1	ZINC000177983921	408750858	/nfs/dbraw/zinc/75/08/58/408750858.db2.gz	RPJIKRUQQIEKCB-ZUZCIYMTSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@](C)(O)C1	ZINC000177983921	408750862	/nfs/dbraw/zinc/75/08/62/408750862.db2.gz	RPJIKRUQQIEKCB-ZUZCIYMTSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000177989383	408751991	/nfs/dbraw/zinc/75/19/91/408751991.db2.gz	MASKDINFEUFIKL-MEBBXXQBSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000177989383	408751998	/nfs/dbraw/zinc/75/19/98/408751998.db2.gz	MASKDINFEUFIKL-MEBBXXQBSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000265733945	408761864	/nfs/dbraw/zinc/76/18/64/408761864.db2.gz	CSVOSSRZAIGDHT-UHFFFAOYSA-N	1	1	321.362	1.352	20	5		DDBDMO
C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCC[C@H](C)C1	ZINC000249890884	408770126	/nfs/dbraw/zinc/77/01/26/408770126.db2.gz	STEKDNZZAHAXKO-NWDGAFQWSA-N	1	1	309.370	1.028	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2nc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000280914791	408858049	/nfs/dbraw/zinc/85/80/49/408858049.db2.gz	FGIKPOUAUZGSDP-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N2CC([NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000276841346	408901517	/nfs/dbraw/zinc/90/15/17/408901517.db2.gz	PVPAXWJNJPPOQG-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000277413196	408936036	/nfs/dbraw/zinc/93/60/36/408936036.db2.gz	CIPCRYDABPEHCH-ZDUSSCGKSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193637237	163262395	/nfs/dbraw/zinc/26/23/95/163262395.db2.gz	ATNUHCIATGAWLG-UPJWGTAASA-N	1	1	318.377	1.415	20	5		DDBDMO
CCC[C@@]1(C(=O)OCC)CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000277617360	408978594	/nfs/dbraw/zinc/97/85/94/408978594.db2.gz	ADNFXSRZVMCBTR-HNNXBMFYSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCC[C@@]1(C(=O)OCC)CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000277617360	408978597	/nfs/dbraw/zinc/97/85/97/408978597.db2.gz	ADNFXSRZVMCBTR-HNNXBMFYSA-N	1	1	324.381	1.989	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000277696435	408994703	/nfs/dbraw/zinc/99/47/03/408994703.db2.gz	HEWLMQQTJSFDLP-UHFFFAOYSA-N	1	1	305.294	1.020	20	5		DDBDMO
COC(=O)[C@]1(C)C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000282261603	409021335	/nfs/dbraw/zinc/02/13/35/409021335.db2.gz	CVQMMJVAEOFLSY-DIOULYMOSA-N	1	1	322.361	1.759	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC)CCC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000277908380	409032532	/nfs/dbraw/zinc/03/25/32/409032532.db2.gz	HQDAPTGWJPZLKQ-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCCO1	ZINC000293237217	409072868	/nfs/dbraw/zinc/07/28/68/409072868.db2.gz	SOXGYDWWQSZGNJ-AWEZNQCLSA-N	1	1	309.366	1.503	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](O)CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000293269502	409079407	/nfs/dbraw/zinc/07/94/07/409079407.db2.gz	UVCJSIJUAHKHBZ-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](O)CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000293269502	409079410	/nfs/dbraw/zinc/07/94/10/409079410.db2.gz	UVCJSIJUAHKHBZ-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000283104571	409089131	/nfs/dbraw/zinc/08/91/31/409089131.db2.gz	WUOBBMLRHXXXIJ-LBPRGKRZSA-N	1	1	307.350	1.262	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000283104571	409089135	/nfs/dbraw/zinc/08/91/35/409089135.db2.gz	WUOBBMLRHXXXIJ-LBPRGKRZSA-N	1	1	307.350	1.262	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000293786034	409179399	/nfs/dbraw/zinc/17/93/99/409179399.db2.gz	WMCLEHXZQJQFAY-NSHDSACASA-N	1	1	321.381	1.275	20	5		DDBDMO
COCCOCC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000289125573	409222465	/nfs/dbraw/zinc/22/24/65/409222465.db2.gz	XJYPYDMFDYMPAS-UHFFFAOYSA-N	1	1	309.322	1.831	20	5		DDBDMO
COCCOCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000289125573	409222467	/nfs/dbraw/zinc/22/24/67/409222467.db2.gz	XJYPYDMFDYMPAS-UHFFFAOYSA-N	1	1	309.322	1.831	20	5		DDBDMO
CN(CC(=O)NCC[N@@H+]1CC=CCC1)c1ccccc1[N+](=O)[O-]	ZINC000280311969	409289660	/nfs/dbraw/zinc/28/96/60/409289660.db2.gz	SYOVTIJTYHFNQX-UHFFFAOYSA-N	1	1	318.377	1.409	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280705258	409417515	/nfs/dbraw/zinc/41/75/15/409417515.db2.gz	ISWGOMXRJUYGSB-HNNXBMFYSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000285393356	409426373	/nfs/dbraw/zinc/42/63/73/409426373.db2.gz	XGDODKWQKXMXBR-UONOGXRCSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1	ZINC000295336939	409440839	/nfs/dbraw/zinc/44/08/39/409440839.db2.gz	MJQDJEDTFBHFBF-JTQLQIEISA-N	1	1	320.349	1.252	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc(F)cc1[N+](=O)[O-]	ZINC000324549123	164051066	/nfs/dbraw/zinc/05/10/66/164051066.db2.gz	YAEUHGAPYHMVND-GHMZBOCLSA-N	1	1	322.340	1.673	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)n1	ZINC000408223283	164266852	/nfs/dbraw/zinc/26/68/52/164266852.db2.gz	TZDJMLWCGKDESQ-UHFFFAOYSA-N	1	1	307.354	1.029	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ncc([N+](=O)[O-])cc1F	ZINC000408462546	164338581	/nfs/dbraw/zinc/33/85/81/164338581.db2.gz	AAMDYPAXLPYZLH-LLVKDONJSA-N	1	1	324.356	1.818	20	5		DDBDMO
C[C@H]1C[N@@H+](C2CC2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798482	409618323	/nfs/dbraw/zinc/61/83/23/409618323.db2.gz	GLOLHYMIOYYQEO-LKFCYVNXSA-N	1	1	305.334	1.513	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798482	409618324	/nfs/dbraw/zinc/61/83/24/409618324.db2.gz	GLOLHYMIOYYQEO-LKFCYVNXSA-N	1	1	305.334	1.513	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432671	409625828	/nfs/dbraw/zinc/62/58/28/409625828.db2.gz	PMDHQMOOWZFLDO-FZMZJTMJSA-N	1	1	305.334	1.014	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432671	409625835	/nfs/dbraw/zinc/62/58/35/409625835.db2.gz	PMDHQMOOWZFLDO-FZMZJTMJSA-N	1	1	305.334	1.014	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000356867443	409677394	/nfs/dbraw/zinc/67/73/94/409677394.db2.gz	YRBZYJRZROCSEU-QWRGUYRKSA-N	1	1	309.341	1.827	20	5		DDBDMO
Cc1ccn(Cc2[nH+]ccn2CC(F)(F)F)c(=O)c1[N+](=O)[O-]	ZINC000349147604	409718088	/nfs/dbraw/zinc/71/80/88/409718088.db2.gz	ZYAKMWIHJHKLKC-UHFFFAOYSA-N	1	1	316.239	1.872	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[NH2+]CC1(F)F	ZINC000342721282	409844603	/nfs/dbraw/zinc/84/46/03/409844603.db2.gz	HQPOPUKCGSUXJQ-LBPRGKRZSA-N	1	1	313.304	1.498	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@H]2C)n1	ZINC000332027118	409814523	/nfs/dbraw/zinc/81/45/23/409814523.db2.gz	UHCQXTOZBHWWMH-VXGBXAGGSA-N	1	1	321.381	1.510	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@H]2C)n1	ZINC000332027118	409814528	/nfs/dbraw/zinc/81/45/28/409814528.db2.gz	UHCQXTOZBHWWMH-VXGBXAGGSA-N	1	1	321.381	1.510	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000354523325	409917960	/nfs/dbraw/zinc/91/79/60/409917960.db2.gz	WTSXUCGTYYGEMC-ZDUSSCGKSA-N	1	1	317.349	2.284	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000317099095	409861708	/nfs/dbraw/zinc/86/17/08/409861708.db2.gz	BIAQNKFBILJHQE-JQWIXIFHSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[N@H+]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1	ZINC000297711004	409967978	/nfs/dbraw/zinc/96/79/78/409967978.db2.gz	BIPGGAYTFCACRJ-UHFFFAOYSA-N	1	1	324.356	1.700	20	5		DDBDMO
CN1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1	ZINC000297711004	409967983	/nfs/dbraw/zinc/96/79/83/409967983.db2.gz	BIPGGAYTFCACRJ-UHFFFAOYSA-N	1	1	324.356	1.700	20	5		DDBDMO
CN1CCC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1	ZINC000297711004	409967989	/nfs/dbraw/zinc/96/79/89/409967989.db2.gz	BIPGGAYTFCACRJ-UHFFFAOYSA-N	1	1	324.356	1.700	20	5		DDBDMO
CC(C)COCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298008175	410076711	/nfs/dbraw/zinc/07/67/11/410076711.db2.gz	BXWMSQLACVNFAP-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@@H]1C	ZINC000343066371	410115324	/nfs/dbraw/zinc/11/53/24/410115324.db2.gz	FKWORRPFEYYIDH-NWDGAFQWSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000357700784	410195266	/nfs/dbraw/zinc/19/52/66/410195266.db2.gz	LQLLXWDRUQVOJR-UHFFFAOYSA-N	1	1	321.377	1.836	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000351779757	410228353	/nfs/dbraw/zinc/22/83/53/410228353.db2.gz	KJRSNMHUEZBJHK-BXKDBHETSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000351779757	410228361	/nfs/dbraw/zinc/22/83/61/410228361.db2.gz	KJRSNMHUEZBJHK-BXKDBHETSA-N	1	1	304.306	1.457	20	5		DDBDMO
CC(C)c1ccc(C[N@@H+]2CC[C@H](NC(N)=O)C2)cc1[N+](=O)[O-]	ZINC000355195843	410374156	/nfs/dbraw/zinc/37/41/56/410374156.db2.gz	XSJMRQWYHIJFDK-LBPRGKRZSA-N	1	1	306.366	1.961	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CC[C@H](NC(N)=O)C2)cc1[N+](=O)[O-]	ZINC000355195843	410374160	/nfs/dbraw/zinc/37/41/60/410374160.db2.gz	XSJMRQWYHIJFDK-LBPRGKRZSA-N	1	1	306.366	1.961	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000343462144	410469883	/nfs/dbraw/zinc/46/98/83/410469883.db2.gz	SVSKYJSTVGPQLM-ZYHUDNBSSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](CO)CC1	ZINC000339748651	410433859	/nfs/dbraw/zinc/43/38/59/410433859.db2.gz	OXUYPDYUPFHPRQ-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](CO)CC1	ZINC000339748651	410433864	/nfs/dbraw/zinc/43/38/64/410433864.db2.gz	OXUYPDYUPFHPRQ-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
O=C([C@H]1CC[NH2+]CC1(F)F)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000343417085	410435464	/nfs/dbraw/zinc/43/54/64/410435464.db2.gz	NGEUYFNLBXNWKV-LLVKDONJSA-N	1	1	311.288	1.729	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])CC1	ZINC000355332113	410447101	/nfs/dbraw/zinc/44/71/01/410447101.db2.gz	FXGCQWULLLEQNN-UHFFFAOYSA-N	1	1	318.377	1.775	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CCC[C@H]2CO)cc1[N+](=O)[O-]	ZINC000355595390	410600199	/nfs/dbraw/zinc/60/01/99/410600199.db2.gz	HAKOXHIFFBCXNF-LBPRGKRZSA-N	1	1	324.333	1.103	20	5		DDBDMO
C[NH+]1CCN(C(=O)[C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2)CC1	ZINC000301120895	410661541	/nfs/dbraw/zinc/66/15/41/410661541.db2.gz	NOBASKIFASLQQS-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cn3)CC2)CCO1	ZINC000301095795	410655207	/nfs/dbraw/zinc/65/52/07/410655207.db2.gz	NKNCEVFAGDVEPZ-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000301430494	410720613	/nfs/dbraw/zinc/72/06/13/410720613.db2.gz	QEUQLFADGMXJQH-DGCLKSJQSA-N	1	1	320.393	1.873	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000330571993	410788292	/nfs/dbraw/zinc/78/82/92/410788292.db2.gz	DKAINMBLKOZFIB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000330571993	410788295	/nfs/dbraw/zinc/78/82/95/410788295.db2.gz	DKAINMBLKOZFIB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1CN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000330585674	410800077	/nfs/dbraw/zinc/80/00/77/410800077.db2.gz	LMJAWGNPQMDSOE-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CN1C	ZINC000330585674	410800084	/nfs/dbraw/zinc/80/00/84/410800084.db2.gz	LMJAWGNPQMDSOE-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CN1C	ZINC000330585674	410800091	/nfs/dbraw/zinc/80/00/91/410800091.db2.gz	LMJAWGNPQMDSOE-VNHYZAJKSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000330659111	410856936	/nfs/dbraw/zinc/85/69/36/410856936.db2.gz	AEWXKEWCSPLNEZ-NSHDSACASA-N	1	1	309.391	1.849	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000330659111	410856943	/nfs/dbraw/zinc/85/69/43/410856943.db2.gz	AEWXKEWCSPLNEZ-NSHDSACASA-N	1	1	309.391	1.849	20	5		DDBDMO
CCCNC(=O)C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000331059953	410925024	/nfs/dbraw/zinc/92/50/24/410925024.db2.gz	NBZDFUVJPPBUMZ-UHFFFAOYSA-N	1	1	309.370	1.067	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000341187161	410925283	/nfs/dbraw/zinc/92/52/83/410925283.db2.gz	CGVZSRHUSOHKHF-TZMCWYRMSA-N	1	1	320.393	1.919	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC[N@H+]1C	ZINC000331135295	410969362	/nfs/dbraw/zinc/96/93/62/410969362.db2.gz	KHKZBGYDEBFGLC-GFCCVEGCSA-N	1	1	308.338	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@@H]21	ZINC000129186877	196027635	/nfs/dbraw/zinc/02/76/35/196027635.db2.gz	ZXCFQFNQFWDPJU-JSGCOSHPSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1CCO	ZINC000419336575	226123070	/nfs/dbraw/zinc/12/30/70/226123070.db2.gz	XHRUDGNGMWGPDC-UONOGXRCSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1CCO	ZINC000419336575	226123073	/nfs/dbraw/zinc/12/30/73/226123073.db2.gz	XHRUDGNGMWGPDC-UONOGXRCSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1CCO	ZINC000419336575	226123076	/nfs/dbraw/zinc/12/30/76/226123076.db2.gz	XHRUDGNGMWGPDC-UONOGXRCSA-N	1	1	307.394	1.524	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000373809447	418462546	/nfs/dbraw/zinc/46/25/46/418462546.db2.gz	JENQDCOINKARCE-HNNXBMFYSA-N	1	1	324.381	1.451	20	5		DDBDMO
C[N@@H+](CCCNC(=O)Cn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000193171132	418529124	/nfs/dbraw/zinc/52/91/24/418529124.db2.gz	UJWDGDVTOJVKJJ-UHFFFAOYSA-N	1	1	323.397	1.562	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCc3n[nH]c(=O)cc3C2)cc1[N+](=O)[O-]	ZINC000361056610	418574290	/nfs/dbraw/zinc/57/42/90/418574290.db2.gz	VWBGHQJTHYBLOH-UHFFFAOYSA-N	1	1	300.318	1.957	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCc3n[nH]c(=O)cc3C2)cc1[N+](=O)[O-]	ZINC000361056610	418574292	/nfs/dbraw/zinc/57/42/92/418574292.db2.gz	VWBGHQJTHYBLOH-UHFFFAOYSA-N	1	1	300.318	1.957	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000360997255	418563008	/nfs/dbraw/zinc/56/30/08/418563008.db2.gz	FUHRKIWPZCWMME-LSDHHAIUSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000290981185	222046592	/nfs/dbraw/zinc/04/65/92/222046592.db2.gz	RPRJJRIOORPPOB-UHFFFAOYSA-N	1	1	315.333	1.847	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000375057014	418597425	/nfs/dbraw/zinc/59/74/25/418597425.db2.gz	DPTNQYBJAPRMEX-WFASDCNBSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC[N@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H](C)OC	ZINC000291348784	222329869	/nfs/dbraw/zinc/32/98/69/222329869.db2.gz	XQHMJHLNLMXWPD-GXTWGEPZSA-N	1	1	312.366	1.691	20	5		DDBDMO
Nc1ccc(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834582	418643558	/nfs/dbraw/zinc/64/35/58/418643558.db2.gz	GKDITEHNWZUOBW-OLZOCXBDSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834582	418643560	/nfs/dbraw/zinc/64/35/60/418643560.db2.gz	GKDITEHNWZUOBW-OLZOCXBDSA-N	1	1	306.366	1.842	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000361408565	418645889	/nfs/dbraw/zinc/64/58/89/418645889.db2.gz	OOKVKJNNYSBSBJ-LBPRGKRZSA-N	1	1	318.333	1.990	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000361408565	418645892	/nfs/dbraw/zinc/64/58/92/418645892.db2.gz	OOKVKJNNYSBSBJ-LBPRGKRZSA-N	1	1	318.333	1.990	20	5		DDBDMO
CO[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000361371510	418638822	/nfs/dbraw/zinc/63/88/22/418638822.db2.gz	GZVOSANBESOCKJ-GFCCVEGCSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000361371510	418638825	/nfs/dbraw/zinc/63/88/25/418638825.db2.gz	GZVOSANBESOCKJ-GFCCVEGCSA-N	1	1	304.306	1.866	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1ncnc2cccc([N+](=O)[O-])c21	ZINC000347414855	418639046	/nfs/dbraw/zinc/63/90/46/418639046.db2.gz	MOQQCRRIRQWUAM-UHFFFAOYSA-N	1	1	319.365	1.918	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])cc1F	ZINC000367988161	418670425	/nfs/dbraw/zinc/67/04/25/418670425.db2.gz	JAJTUWBXYRKKAY-VIFPVBQESA-N	1	1	311.313	1.440	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000361707616	418699841	/nfs/dbraw/zinc/69/98/41/418699841.db2.gz	WMAVSOZLDNEYQR-VXGBXAGGSA-N	1	1	306.366	1.490	20	5		DDBDMO
CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCC[N@H+]1C	ZINC000421000183	419431234	/nfs/dbraw/zinc/43/12/34/419431234.db2.gz	KANZSJACSKSMHN-HUUCEWRRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000183	419431244	/nfs/dbraw/zinc/43/12/44/419431244.db2.gz	KANZSJACSKSMHN-HUUCEWRRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000183	419431253	/nfs/dbraw/zinc/43/12/53/419431253.db2.gz	KANZSJACSKSMHN-HUUCEWRRSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412087447	419642564	/nfs/dbraw/zinc/64/25/64/419642564.db2.gz	GUPYBPWTGXVLJB-TUKIKUTGSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412087447	419642569	/nfs/dbraw/zinc/64/25/69/419642569.db2.gz	GUPYBPWTGXVLJB-TUKIKUTGSA-N	1	1	303.362	1.861	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH+](C[C@H](C)O)CC1	ZINC000421859333	419751532	/nfs/dbraw/zinc/75/15/32/419751532.db2.gz	FGKKSRCSAMPTOK-ZDUSSCGKSA-N	1	1	321.377	1.350	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1CCO	ZINC000413254913	419775729	/nfs/dbraw/zinc/77/57/29/419775729.db2.gz	ZVSUSFHVUSGVAJ-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000299458801	229128458	/nfs/dbraw/zinc/12/84/58/229128458.db2.gz	WVOJEZDZGMZSFE-SECBINFHSA-N	1	1	320.353	1.208	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CNCCO2)o1	ZINC000415095185	419940222	/nfs/dbraw/zinc/94/02/22/419940222.db2.gz	LRVNQKZYXDLGFH-CYBMUJFWSA-N	1	1	317.345	1.933	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000416296641	420313851	/nfs/dbraw/zinc/31/38/51/420313851.db2.gz	OHTONMABVRRVDZ-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@H+](CCO)C[C@@H]1C	ZINC000416296641	420313854	/nfs/dbraw/zinc/31/38/54/420313854.db2.gz	OHTONMABVRRVDZ-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439107430	420480726	/nfs/dbraw/zinc/48/07/26/420480726.db2.gz	LVLIBERHULWRML-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000439162718	420482971	/nfs/dbraw/zinc/48/29/71/420482971.db2.gz	ZUOPFRSNRSMDFD-LLVKDONJSA-N	1	1	306.366	1.980	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCC1(C)C	ZINC000457077256	420602981	/nfs/dbraw/zinc/60/29/81/420602981.db2.gz	OZAPUIUUIBJYBA-UHFFFAOYSA-N	1	1	306.366	1.902	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC2(C)C)n1	ZINC000457064582	420599393	/nfs/dbraw/zinc/59/93/93/420599393.db2.gz	XAGZYONSPGBJFU-UHFFFAOYSA-N	1	1	309.370	1.415	20	5		DDBDMO
COc1ccc(NC(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000455096615	420967915	/nfs/dbraw/zinc/96/79/15/420967915.db2.gz	HAGGLEROFMMCTQ-GXFFZTMASA-N	1	1	320.349	1.771	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489382640	421150431	/nfs/dbraw/zinc/15/04/31/421150431.db2.gz	BQZFXQODBQHFQK-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489382640	421150436	/nfs/dbraw/zinc/15/04/36/421150436.db2.gz	BQZFXQODBQHFQK-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489382640	421150439	/nfs/dbraw/zinc/15/04/39/421150439.db2.gz	BQZFXQODBQHFQK-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(c3cc(C)c([N+](=O)[O-])cn3)[C@H]2C1	ZINC000514720040	421448835	/nfs/dbraw/zinc/44/88/35/421448835.db2.gz	ULTPMPXQKSTJSC-UONOGXRCSA-N	1	1	306.366	1.598	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000518650471	421662239	/nfs/dbraw/zinc/66/22/39/421662239.db2.gz	JPUXXUQMYFYGAT-ZDUSSCGKSA-N	1	1	321.377	1.604	20	5		DDBDMO
C[N@H+]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000557334222	421768710	/nfs/dbraw/zinc/76/87/10/421768710.db2.gz	DAFPTFBAUJWPAX-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000557334222	421768711	/nfs/dbraw/zinc/76/87/11/421768711.db2.gz	DAFPTFBAUJWPAX-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000557334222	421768714	/nfs/dbraw/zinc/76/87/14/421768714.db2.gz	DAFPTFBAUJWPAX-CQSZACIVSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000580889236	421856500	/nfs/dbraw/zinc/85/65/00/421856500.db2.gz	XSOLQUHBGXHIEP-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccnc([C@@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)c1	ZINC000575813473	422330711	/nfs/dbraw/zinc/33/07/11/422330711.db2.gz	XPXNYBUXGBAPRK-CYBMUJFWSA-N	1	1	301.350	1.984	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000342144137	271318321	/nfs/dbraw/zinc/31/83/21/271318321.db2.gz	XDTNIHXUVWSWKU-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
C[C@@H](Cc1[nH]cc[nH+]1)OCc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000344628897	272074000	/nfs/dbraw/zinc/07/40/00/272074000.db2.gz	FNBMILJPOFSADT-VIFPVBQESA-N	1	1	304.306	1.565	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)n1	ZINC000345300448	272213213	/nfs/dbraw/zinc/21/32/13/272213213.db2.gz	KAGSXLZTEIJZJU-LBPRGKRZSA-N	1	1	321.381	1.323	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000345573943	272281872	/nfs/dbraw/zinc/28/18/72/272281872.db2.gz	VNXGISYBOGFQRD-NSHDSACASA-N	1	1	323.397	1.732	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000266326251	274118359	/nfs/dbraw/zinc/11/83/59/274118359.db2.gz	GGUIRBWWCXXQEK-NWDGAFQWSA-N	1	1	309.366	1.495	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CCC[N@H+](CCO)CC3)ccc2c1	ZINC000171506908	275038853	/nfs/dbraw/zinc/03/88/53/275038853.db2.gz	VITJFANNHOVGGM-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000126299593	281233520	/nfs/dbraw/zinc/23/35/20/281233520.db2.gz	UJUFOSXWIRICRB-LLVKDONJSA-N	1	1	309.370	1.036	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)NCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000130568997	281385398	/nfs/dbraw/zinc/38/53/98/281385398.db2.gz	KQQSCFUINZTDHU-UHFFFAOYSA-N	1	1	320.393	1.239	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H](C)[NH2+]1	ZINC000130948009	281400134	/nfs/dbraw/zinc/40/01/34/281400134.db2.gz	QYDVNICIAQGITE-PHIMTYICSA-N	1	1	313.379	1.107	20	5		DDBDMO
C[C@H]1Cc2ccccc2C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000247347520	282047644	/nfs/dbraw/zinc/04/76/44/282047644.db2.gz	GLQMLHMIUYTUQV-BLLLJJGKSA-N	1	1	316.361	1.599	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3ncc(Cl)cc3[N+](=O)[O-])[C@H]2C1	ZINC000284576034	290237925	/nfs/dbraw/zinc/23/79/25/290237925.db2.gz	OUVMIJWTABCKFZ-NWDGAFQWSA-N	1	1	312.757	1.553	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000358038652	299053949	/nfs/dbraw/zinc/05/39/49/299053949.db2.gz	BONMIRGURBLDBF-HNNXBMFYSA-N	1	1	319.317	1.137	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362079098	300001896	/nfs/dbraw/zinc/00/18/96/300001896.db2.gz	SVIYDAWWXKFAQT-VXGBXAGGSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362079098	300001898	/nfs/dbraw/zinc/00/18/98/300001898.db2.gz	SVIYDAWWXKFAQT-VXGBXAGGSA-N	1	1	307.350	1.402	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C[C@H]21	ZINC000362290460	300045162	/nfs/dbraw/zinc/04/51/62/300045162.db2.gz	RVCCBSIBDURWLK-ZWNOBZJWSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2C[N@H+]3CCC[C@H]3CO2)cc([N+](=O)[O-])c1	ZINC000363125569	300215773	/nfs/dbraw/zinc/21/57/73/300215773.db2.gz	RFBOOHWYROVARE-ZFWWWQNUSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)C[C@H]21	ZINC000364307975	300373170	/nfs/dbraw/zinc/37/31/70/300373170.db2.gz	NTTLXUNWYNSWHL-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](N2CCNC2=O)C1	ZINC000370376358	301326692	/nfs/dbraw/zinc/32/66/92/301326692.db2.gz	ZJUWMOTYYHEUEM-OAHLLOKOSA-N	1	1	318.377	1.893	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000521837238	302880978	/nfs/dbraw/zinc/88/09/78/302880978.db2.gz	CVKIQZORZYNMRS-SNVBAGLBSA-N	1	1	305.338	1.504	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000532078036	303275004	/nfs/dbraw/zinc/27/50/04/303275004.db2.gz	IJQDDULYVBYBNF-IINYFYTJSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[NH+]1CCN(c2ccc([N+](=O)[O-])c(N3CCOCC3)c2F)CC1	ZINC000558311026	303766355	/nfs/dbraw/zinc/76/63/55/303766355.db2.gz	JENRHHPUIABAMD-UHFFFAOYSA-N	1	1	324.356	1.322	20	5		DDBDMO
C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000364755330	307050462	/nfs/dbraw/zinc/05/04/62/307050462.db2.gz	PSKYWIGMEZPYDL-WQVCFCJDSA-N	1	1	317.389	1.993	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ncc([N+](=O)[O-])cn1	ZINC000364802578	307051675	/nfs/dbraw/zinc/05/16/75/307051675.db2.gz	FVNKGXLQSHWPBB-NSHDSACASA-N	1	1	307.354	1.074	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC([C@H]2CCCOC2)CC1	ZINC000365013376	307056333	/nfs/dbraw/zinc/05/63/33/307056333.db2.gz	NZVDPNIZVYMFMR-ZDUSSCGKSA-N	1	1	308.382	1.967	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000366655081	307078659	/nfs/dbraw/zinc/07/86/59/307078659.db2.gz	PPHGCWNJCJYTCS-KBPBESRZSA-N	1	1	322.361	1.759	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@@H]([NH3+])[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368615219	307106492	/nfs/dbraw/zinc/10/64/92/307106492.db2.gz	UBACVBSOXWMGML-HBNTYKKESA-N	1	1	321.381	1.470	20	5		DDBDMO
O=C1OCCN1C[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000496780943	307360878	/nfs/dbraw/zinc/36/08/78/307360878.db2.gz	IQYMWXYBLBBDID-CQSZACIVSA-N	1	1	319.361	1.911	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000570000420	308156281	/nfs/dbraw/zinc/15/62/81/308156281.db2.gz	NSOLFDQBVDOSHG-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000570000420	308156282	/nfs/dbraw/zinc/15/62/82/308156282.db2.gz	NSOLFDQBVDOSHG-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000195164313	325709290	/nfs/dbraw/zinc/70/92/90/325709290.db2.gz	NDNSBDORNWTJHA-UHFFFAOYSA-N	1	1	310.329	1.310	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000584308592	332236381	/nfs/dbraw/zinc/23/63/81/332236381.db2.gz	OXUGFTWVLFOXSY-GHMZBOCLSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000584308592	332236382	/nfs/dbraw/zinc/23/63/82/332236382.db2.gz	OXUGFTWVLFOXSY-GHMZBOCLSA-N	1	1	322.365	1.614	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)C[C@H]1C	ZINC000457141484	534331200	/nfs/dbraw/zinc/33/12/00/534331200.db2.gz	YGXLTHXMAKQIKL-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)C[C@H]1C	ZINC000457141484	534331209	/nfs/dbraw/zinc/33/12/09/534331209.db2.gz	YGXLTHXMAKQIKL-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1C	ZINC000331338431	534460281	/nfs/dbraw/zinc/46/02/81/534460281.db2.gz	JMEIXTJWSHQKBG-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1C	ZINC000331338431	534460286	/nfs/dbraw/zinc/46/02/86/534460286.db2.gz	JMEIXTJWSHQKBG-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1C	ZINC000331338431	534460290	/nfs/dbraw/zinc/46/02/90/534460290.db2.gz	JMEIXTJWSHQKBG-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](CCCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000452131847	534549362	/nfs/dbraw/zinc/54/93/62/534549362.db2.gz	PUHIERQIDZLXMO-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](CCCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000452131847	534549365	/nfs/dbraw/zinc/54/93/65/534549365.db2.gz	PUHIERQIDZLXMO-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452183358	527737141	/nfs/dbraw/zinc/73/71/41/527737141.db2.gz	OWPYOEKBDNRZOK-FZMZJTMJSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452183358	527737144	/nfs/dbraw/zinc/73/71/44/527737144.db2.gz	OWPYOEKBDNRZOK-FZMZJTMJSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC000433757216	527998774	/nfs/dbraw/zinc/99/87/74/527998774.db2.gz	IRFIDUWCZQBPRU-NSHDSACASA-N	1	1	321.381	1.608	20	5		DDBDMO
CCOc1cc(-c2nc(C[NH2+]C)no2)c([N+](=O)[O-])cc1OC	ZINC000414497096	528188120	/nfs/dbraw/zinc/18/81/20/528188120.db2.gz	FGWPFWKXJXDFSK-UHFFFAOYSA-N	1	1	308.294	1.772	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000302485922	528311395	/nfs/dbraw/zinc/31/13/95/528311395.db2.gz	YKKMEMRJKHOSHX-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820664759	599589576	/nfs/dbraw/zinc/58/95/76/599589576.db2.gz	BQDHMOSQSCXTNL-ZJUUUORDSA-N	1	1	317.353	1.670	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000797525087	700013162	/nfs/dbraw/zinc/01/31/62/700013162.db2.gz	AKODOWSXMQAENN-ZFWWWQNUSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC1(C)CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])CC[NH2+]1	ZINC000126571070	696763209	/nfs/dbraw/zinc/76/32/09/696763209.db2.gz	JTNWNEYKJBMDOY-UHFFFAOYSA-N	1	1	317.342	1.106	20	5		DDBDMO
C[C@@H](NC(=O)CC[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000775597876	698014267	/nfs/dbraw/zinc/01/42/67/698014267.db2.gz	WVSBZVKANYXQGI-GFCCVEGCSA-N	1	1	307.350	1.494	20	5		DDBDMO
C[N@H+](C[C@@H]1CCOC1)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000749965340	700195684	/nfs/dbraw/zinc/19/56/84/700195684.db2.gz	ZRJRCBQNGSUYPL-QMMMGPOBSA-N	1	1	319.159	1.480	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000749965340	700195686	/nfs/dbraw/zinc/19/56/86/700195686.db2.gz	ZRJRCBQNGSUYPL-QMMMGPOBSA-N	1	1	319.159	1.480	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776599212	698125577	/nfs/dbraw/zinc/12/55/77/698125577.db2.gz	XDFSXOWFLUABFD-OAHLLOKOSA-N	1	1	302.334	1.593	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000750094036	700203578	/nfs/dbraw/zinc/20/35/78/700203578.db2.gz	MMXWKXNHSIZDKF-VXGBXAGGSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@](O)(C(F)(F)F)C2)c1	ZINC000750094036	700203579	/nfs/dbraw/zinc/20/35/79/700203579.db2.gz	MMXWKXNHSIZDKF-VXGBXAGGSA-N	1	1	320.267	1.627	20	5		DDBDMO
Cn1ccnc1[C@H](N[C@@H]1CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000780765201	698558448	/nfs/dbraw/zinc/55/84/48/698558448.db2.gz	WYDDVCKNDXLRGL-UKRRQHHQSA-N	1	1	315.377	1.711	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1csc([N+](=O)[O-])c1)C(C)C	ZINC000780857627	698563645	/nfs/dbraw/zinc/56/36/45/698563645.db2.gz	ZNLAVVICESVPQJ-UHFFFAOYSA-N	1	1	321.424	1.665	20	5		DDBDMO
COCC[N@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@H]1CCOC1	ZINC000782961989	698789784	/nfs/dbraw/zinc/78/97/84/698789784.db2.gz	LOEQTNSNJHIQNF-AWEZNQCLSA-N	1	1	320.349	1.639	20	5		DDBDMO
COCC[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@H]1CCOC1	ZINC000782961989	698789787	/nfs/dbraw/zinc/78/97/87/698789787.db2.gz	LOEQTNSNJHIQNF-AWEZNQCLSA-N	1	1	320.349	1.639	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)CCO1	ZINC000725789952	699334115	/nfs/dbraw/zinc/33/41/15/699334115.db2.gz	SKJKQCXQAGPADY-VIFPVBQESA-N	1	1	307.310	1.264	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)CCO1	ZINC000725789952	699334118	/nfs/dbraw/zinc/33/41/18/699334118.db2.gz	SKJKQCXQAGPADY-VIFPVBQESA-N	1	1	307.310	1.264	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000789516260	699392283	/nfs/dbraw/zinc/39/22/83/699392283.db2.gz	NCBSRLQABKGMAZ-ZDUSSCGKSA-N	1	1	323.397	1.746	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000789516260	699392285	/nfs/dbraw/zinc/39/22/85/699392285.db2.gz	NCBSRLQABKGMAZ-ZDUSSCGKSA-N	1	1	323.397	1.746	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000730806821	699516216	/nfs/dbraw/zinc/51/62/16/699516216.db2.gz	MNKGRPPDMQMJOS-LLVKDONJSA-N	1	1	305.338	1.375	20	5		DDBDMO
CN(c1nc2ccccn2c1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000733192176	699582828	/nfs/dbraw/zinc/58/28/28/699582828.db2.gz	XFZXCUCSDDSDLF-LBPRGKRZSA-N	1	1	301.350	1.915	20	5		DDBDMO
COC(=O)[C@@H]1CC12CC[NH+](Cn1nc(C)c([N+](=O)[O-])c1C)CC2	ZINC000733790837	699617109	/nfs/dbraw/zinc/61/71/09/699617109.db2.gz	FJBIOLADWXGHFT-LBPRGKRZSA-N	1	1	322.365	1.641	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(=O)NC	ZINC000735870759	699707953	/nfs/dbraw/zinc/70/79/53/699707953.db2.gz	YRTKZUWAYVBSLR-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1	ZINC000742058396	699858967	/nfs/dbraw/zinc/85/89/67/699858967.db2.gz	BDMDYHXZBOONGU-OLZOCXBDSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H]2C[C@H]21	ZINC000761095491	700843266	/nfs/dbraw/zinc/84/32/66/700843266.db2.gz	QPCZIXIBTXVFHD-CMPLNLGQSA-N	1	1	303.318	1.987	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CCOC1	ZINC000767028539	701078641	/nfs/dbraw/zinc/07/86/41/701078641.db2.gz	BXKNVMPHQKGIJS-CQSZACIVSA-N	1	1	312.297	1.546	20	5		DDBDMO
Cc1nn(C)c(C(=O)OCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000767607881	701122345	/nfs/dbraw/zinc/12/23/45/701122345.db2.gz	CWURPMLFTGJKMG-UHFFFAOYSA-N	1	1	307.310	1.389	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140405	701234034	/nfs/dbraw/zinc/23/40/34/701234034.db2.gz	OJBJWARMTSCCDH-WDEREUQCSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140405	701234035	/nfs/dbraw/zinc/23/40/35/701234035.db2.gz	OJBJWARMTSCCDH-WDEREUQCSA-N	1	1	306.366	1.650	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC23CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000771585968	701324697	/nfs/dbraw/zinc/32/46/97/701324697.db2.gz	QQEXYKSDWPMVFS-UHFFFAOYSA-N	1	1	321.381	1.752	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCCn1cc[nH+]c1C	ZINC000771940002	701337684	/nfs/dbraw/zinc/33/76/84/701337684.db2.gz	XFIYJVSQUFGEBX-UHFFFAOYSA-N	1	1	307.310	1.238	20	5		DDBDMO
COC(=O)[C@@]1(C)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839668354	701773884	/nfs/dbraw/zinc/77/38/84/701773884.db2.gz	ZRGXFQMRYHLJCZ-ZBFHGGJFSA-N	1	1	322.361	1.903	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000810841889	701859852	/nfs/dbraw/zinc/85/98/52/701859852.db2.gz	RCVGLIZQNKHORD-MNOVXSKESA-N	1	1	308.338	1.595	20	5		DDBDMO
C[N@H+]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CCC1(C)C	ZINC000866114275	706622165	/nfs/dbraw/zinc/62/21/65/706622165.db2.gz	KIJKAZVPTXYQIG-UHFFFAOYSA-N	1	1	306.366	1.614	20	5		DDBDMO
O=C1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)CCCCCCN1	ZINC000879254395	706630074	/nfs/dbraw/zinc/63/00/74/706630074.db2.gz	YZRXKWUZRPFYIM-UHFFFAOYSA-N	1	1	309.370	1.174	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000812332782	702157441	/nfs/dbraw/zinc/15/74/41/702157441.db2.gz	VWKCOQDWJIESLI-CABCVRRESA-N	1	1	317.389	1.938	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)[C@@H]2C1	ZINC000816950099	702234415	/nfs/dbraw/zinc/23/44/15/702234415.db2.gz	LVEWAWGJOSJTTG-QMTHXVAHSA-N	1	1	323.324	1.275	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000817377188	702363928	/nfs/dbraw/zinc/36/39/28/702363928.db2.gz	IXJUWDHISPJXKR-AWEZNQCLSA-N	1	1	303.366	1.928	20	5		DDBDMO
Cc1nn(CCC(=O)OCC[C@H]2CC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000847826196	703473617	/nfs/dbraw/zinc/47/36/17/703473617.db2.gz	CBIKQEHPEWPSJU-CYBMUJFWSA-N	1	1	324.381	1.683	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCC2	ZINC000818971352	704039102	/nfs/dbraw/zinc/03/91/02/704039102.db2.gz	UPIJTTCFYZHHNQ-ZWNOBZJWSA-N	1	1	317.349	1.517	20	5		DDBDMO
CN(C)c1nc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cs1	ZINC000819128159	704072953	/nfs/dbraw/zinc/07/29/53/704072953.db2.gz	GDZRSXBQNMRTMV-CYBMUJFWSA-N	1	1	322.390	1.941	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870912458	704165725	/nfs/dbraw/zinc/16/57/25/704165725.db2.gz	IAUVTJQTFATHKH-GOEBONIOSA-N	1	1	321.377	1.652	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870912461	704165751	/nfs/dbraw/zinc/16/57/51/704165751.db2.gz	IAUVTJQTFATHKH-ZBFHGGJFSA-N	1	1	321.377	1.652	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])nc1Br)C1CC1	ZINC000853064643	704191242	/nfs/dbraw/zinc/19/12/42/704191242.db2.gz	JVKOCKUBRMSBFY-QMMMGPOBSA-N	1	1	319.159	1.009	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871153397	704232698	/nfs/dbraw/zinc/23/26/98/704232698.db2.gz	FSDSSPZAPLYXHC-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871153397	704232701	/nfs/dbraw/zinc/23/27/01/704232701.db2.gz	FSDSSPZAPLYXHC-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871153397	704232702	/nfs/dbraw/zinc/23/27/02/704232702.db2.gz	FSDSSPZAPLYXHC-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CC[N@H+](CCOC)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853490807	704248547	/nfs/dbraw/zinc/24/85/47/704248547.db2.gz	FUSIRHGGLHDVIN-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
CC[N@@H+](CCOC)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853490807	704248548	/nfs/dbraw/zinc/24/85/48/704248548.db2.gz	FUSIRHGGLHDVIN-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@H]4COC[C@H]4C3)c2c1	ZINC000853585904	704276017	/nfs/dbraw/zinc/27/60/17/704276017.db2.gz	KVEJXANPJLIGQZ-CHWSQXEVSA-N	1	1	302.334	1.870	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000856795795	704538995	/nfs/dbraw/zinc/53/89/95/704538995.db2.gz	JZYGBHQKMXLJGP-ZYHUDNBSSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000856795795	704538996	/nfs/dbraw/zinc/53/89/96/704538996.db2.gz	JZYGBHQKMXLJGP-ZYHUDNBSSA-N	1	1	309.322	1.953	20	5		DDBDMO
Cc1ccc(O[C@@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)nc1	ZINC000858036707	704660376	/nfs/dbraw/zinc/66/03/76/704660376.db2.gz	QWVURIQTNVLWPE-CQSZACIVSA-N	1	1	317.349	1.648	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCCF)CC2)c([N+](=O)[O-])c1	ZINC000858599274	704732927	/nfs/dbraw/zinc/73/29/27/704732927.db2.gz	LXQKYKLBKOPCOB-UHFFFAOYSA-N	1	1	312.301	1.985	20	5		DDBDMO
O=[N+]([O-])c1c(NC2CC([NH+]3CCOCC3)C2)nc2ccccn21	ZINC000858601479	704733097	/nfs/dbraw/zinc/73/30/97/704733097.db2.gz	ZGXVTPCSOXISGL-UHFFFAOYSA-N	1	1	317.349	1.518	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1	ZINC000859924850	705042844	/nfs/dbraw/zinc/04/28/44/705042844.db2.gz	PRPXLECBBGWSOE-CWRNSKLLSA-N	1	1	306.362	1.723	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCCOc1ccccc1[N+](=O)[O-]	ZINC000859949735	705051849	/nfs/dbraw/zinc/05/18/49/705051849.db2.gz	SSCUSJJQXMQPLE-UHFFFAOYSA-N	1	1	305.290	1.722	20	5		DDBDMO
Cc1nc(C)c(C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)o1	ZINC000862278961	705693157	/nfs/dbraw/zinc/69/31/57/705693157.db2.gz	KEPFUHCIICAKNH-UKRRQHHQSA-N	1	1	321.333	1.384	20	5		DDBDMO
Cc1ncc(C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)o1	ZINC000862278608	705693172	/nfs/dbraw/zinc/69/31/72/705693172.db2.gz	GATVRWWXPZORKB-ZIAGYGMSSA-N	1	1	307.306	1.075	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825868754	705738502	/nfs/dbraw/zinc/73/85/02/705738502.db2.gz	JQPSUFXAMOBOMK-AWEZNQCLSA-N	1	1	309.366	1.476	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000826970471	705903130	/nfs/dbraw/zinc/90/31/30/705903130.db2.gz	MPINPKCLVFHPEF-IXPVHAAZSA-N	1	1	319.361	1.370	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827252914	705960507	/nfs/dbraw/zinc/96/05/07/705960507.db2.gz	ALTDZYPUZWNRQK-ZYHUDNBSSA-N	1	1	319.365	1.198	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC[C@H]21	ZINC000827300689	705971719	/nfs/dbraw/zinc/97/17/19/705971719.db2.gz	NCAPKWQUKMILIL-ZWNOBZJWSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2C[C@H](CO)[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000877764544	706201504	/nfs/dbraw/zinc/20/15/04/706201504.db2.gz	HRWZSAUDWDBQQJ-OKILXGFUSA-N	1	1	308.378	1.751	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000828905411	706253410	/nfs/dbraw/zinc/25/34/10/706253410.db2.gz	WPIPNMOQBOVGAA-ABAIWWIYSA-N	1	1	319.361	1.395	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(N2CCN(c3[nH]cc[nH+]3)CC2)cc1F	ZINC000865729505	706508037	/nfs/dbraw/zinc/50/80/37/706508037.db2.gz	JWTZYCPTBDGIIB-UHFFFAOYSA-N	1	1	321.312	1.276	20	5		DDBDMO
NC(=O)[C@@H](F)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000879048666	706573339	/nfs/dbraw/zinc/57/33/39/706573339.db2.gz	XUMVHTYKMWFMFI-ZDUSSCGKSA-N	1	1	313.304	1.769	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614366	707041763	/nfs/dbraw/zinc/04/17/63/707041763.db2.gz	UGYSKXHRVSSTSZ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614366	707041766	/nfs/dbraw/zinc/04/17/66/707041766.db2.gz	UGYSKXHRVSSTSZ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614366	707041769	/nfs/dbraw/zinc/04/17/69/707041769.db2.gz	UGYSKXHRVSSTSZ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614366	707041771	/nfs/dbraw/zinc/04/17/71/707041771.db2.gz	UGYSKXHRVSSTSZ-NSHDSACASA-N	1	1	323.397	1.683	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC[C@@H]21	ZINC000872726658	707573973	/nfs/dbraw/zinc/57/39/73/707573973.db2.gz	UEAOAUKBONLFGV-ZFWWWQNUSA-N	1	1	315.377	1.928	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000837189581	707594462	/nfs/dbraw/zinc/59/44/62/707594462.db2.gz	JOIGWQFQYMRZBX-GFCCVEGCSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000882486320	707657393	/nfs/dbraw/zinc/65/73/93/707657393.db2.gz	QCEHBKSNMHRRRC-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)OCC[N@@H+](C)Cc1ccccc1	ZINC000837610702	707695040	/nfs/dbraw/zinc/69/50/40/707695040.db2.gz	YUWJRNPWVGQDHG-UHFFFAOYSA-N	1	1	318.333	1.617	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)CN1CCN(C)CC1	ZINC000873045481	707707491	/nfs/dbraw/zinc/70/74/91/707707491.db2.gz	FVYUGOKFOSAJST-AWEZNQCLSA-N	1	1	320.437	1.937	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1cccnc1[N+](=O)[O-]	ZINC000886090484	708696662	/nfs/dbraw/zinc/69/66/62/708696662.db2.gz	ZJQPKDGKRHEFGZ-UHFFFAOYSA-N	1	1	321.425	1.448	20	5		DDBDMO
CN(CCN(C)C1CC[NH+](C)CC1)Cc1cccnc1[N+](=O)[O-]	ZINC000886090484	708696663	/nfs/dbraw/zinc/69/66/63/708696663.db2.gz	ZJQPKDGKRHEFGZ-UHFFFAOYSA-N	1	1	321.425	1.448	20	5		DDBDMO
C[N@H+](Cc1cccnc1[N+](=O)[O-])C(C)(C)CN1CCOCC1	ZINC000886249583	708725553	/nfs/dbraw/zinc/72/55/53/708725553.db2.gz	NZXIARPCMNCNJT-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
C[N@@H+](Cc1cccnc1[N+](=O)[O-])C(C)(C)CN1CCOCC1	ZINC000886249583	708725555	/nfs/dbraw/zinc/72/55/55/708725555.db2.gz	NZXIARPCMNCNJT-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
CN(Cc1cccnc1[N+](=O)[O-])C(C)(C)C[NH+]1CCOCC1	ZINC000886249583	708725557	/nfs/dbraw/zinc/72/55/57/708725557.db2.gz	NZXIARPCMNCNJT-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
O=C1C[C@H]([N@@H+]2CC[C@@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303590	709012135	/nfs/dbraw/zinc/01/21/35/709012135.db2.gz	XFUJJEKFCRKDRJ-GWCFXTLKSA-N	1	1	321.308	1.518	20	5		DDBDMO
O=C1C[C@H]([N@H+]2CC[C@@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303590	709012138	/nfs/dbraw/zinc/01/21/38/709012138.db2.gz	XFUJJEKFCRKDRJ-GWCFXTLKSA-N	1	1	321.308	1.518	20	5		DDBDMO
CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC[N@H+](C)CC1	ZINC000888993696	709426207	/nfs/dbraw/zinc/42/62/07/709426207.db2.gz	CDOGGPJOGKHHIQ-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC[N@@H+](C)CC1	ZINC000888993696	709426208	/nfs/dbraw/zinc/42/62/08/709426208.db2.gz	CDOGGPJOGKHHIQ-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2c([N+](=O)[O-])cnn2C)CC1	ZINC000891897639	710321094	/nfs/dbraw/zinc/32/10/94/710321094.db2.gz	MFQKDOIZHORZBC-LBPRGKRZSA-N	1	1	310.402	1.014	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000928455747	713204529	/nfs/dbraw/zinc/20/45/29/713204529.db2.gz	UMMYINBGMWZOOQ-ZWNOBZJWSA-N	1	1	306.366	1.483	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)[C@@H]2C1	ZINC000893939090	710893141	/nfs/dbraw/zinc/89/31/41/710893141.db2.gz	HFDVBUMDOKJOLS-XHDPSFHLSA-N	1	1	316.361	1.620	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H](C)C[C@H](CO)C2)c1[N+](=O)[O-]	ZINC000894973828	711346343	/nfs/dbraw/zinc/34/63/43/711346343.db2.gz	BECKRDUSKGUBBT-QWRGUYRKSA-N	1	1	310.350	1.759	20	5		DDBDMO
CCc1nn(C)c(NCc2cc(N(C)C)cc[nH+]2)c1[N+](=O)[O-]	ZINC000895465935	711519200	/nfs/dbraw/zinc/51/92/00/711519200.db2.gz	NQRNMBFRRFSWIA-UHFFFAOYSA-N	1	1	304.354	1.964	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000895738215	711591329	/nfs/dbraw/zinc/59/13/29/711591329.db2.gz	IATWKYPQOBCONY-KOLCDFICSA-N	1	1	313.379	1.503	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895738215	711591331	/nfs/dbraw/zinc/59/13/31/711591331.db2.gz	IATWKYPQOBCONY-KOLCDFICSA-N	1	1	313.379	1.503	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000895776371	711604004	/nfs/dbraw/zinc/60/40/04/711604004.db2.gz	HUNLXVVCAHWUHM-LBPRGKRZSA-N	1	1	304.350	1.603	20	5		DDBDMO
Cc1ccc(CNC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000896219978	711693526	/nfs/dbraw/zinc/69/35/26/711693526.db2.gz	LAJSGXIPOIRIJI-OKILXGFUSA-N	1	1	318.377	1.606	20	5		DDBDMO
CCO[C@@H](C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)CN(C)C	ZINC000905577777	712084176	/nfs/dbraw/zinc/08/41/76/712084176.db2.gz	BOORPHKLJLUQNL-GJZGRUSLSA-N	1	1	311.382	1.185	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000913933882	713321940	/nfs/dbraw/zinc/32/19/40/713321940.db2.gz	USZZDXSDUPAFSR-RYUDHWBXSA-N	1	1	321.381	1.399	20	5		DDBDMO
C[N@H+](CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1Br	ZINC000930470642	713843214	/nfs/dbraw/zinc/84/32/14/713843214.db2.gz	ICCPQXNZKLAJTF-UHFFFAOYSA-N	1	1	316.155	1.665	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1Br	ZINC000930470642	713843217	/nfs/dbraw/zinc/84/32/17/713843217.db2.gz	ICCPQXNZKLAJTF-UHFFFAOYSA-N	1	1	316.155	1.665	20	5		DDBDMO
CC(C)(C)OC(=O)CC[N@@H+](CC[N+](=O)[O-])C1CCOCC1	ZINC000930808753	713925048	/nfs/dbraw/zinc/92/50/48/713925048.db2.gz	KTEZDSFZXWEFLZ-UHFFFAOYSA-N	1	1	302.371	1.476	20	5		DDBDMO
CN1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)CC1	ZINC000930882364	713949080	/nfs/dbraw/zinc/94/90/80/713949080.db2.gz	KEVNGKOXQXQSKN-UHFFFAOYSA-N	1	1	321.381	1.306	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](C3OCCO3)C2)c1	ZINC000932009871	714233846	/nfs/dbraw/zinc/23/38/46/714233846.db2.gz	IVQRCOOMWHDDAU-GFCCVEGCSA-N	1	1	308.334	1.668	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2	ZINC000923309204	714306556	/nfs/dbraw/zinc/30/65/56/714306556.db2.gz	MVWXQHPPUFWHJQ-YPMHNXCESA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@@H]1[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923371045	714331646	/nfs/dbraw/zinc/33/16/46/714331646.db2.gz	URIYHHQVQCWIBF-BRXULGCHSA-N	1	1	323.393	1.311	20	5		DDBDMO
[NH3+]CC[C@H]1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000923481782	714370024	/nfs/dbraw/zinc/37/00/24/714370024.db2.gz	LOPMASGGSAWMTA-WFASDCNBSA-N	1	1	318.377	1.371	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000932649080	714376215	/nfs/dbraw/zinc/37/62/15/714376215.db2.gz	PGYAFGDKHYMZSK-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000932649080	714376217	/nfs/dbraw/zinc/37/62/17/714376217.db2.gz	PGYAFGDKHYMZSK-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
COC[C@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000933326322	714562820	/nfs/dbraw/zinc/56/28/20/714562820.db2.gz	ADWJTAFKSDLMMV-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000933326322	714562822	/nfs/dbraw/zinc/56/28/22/714562822.db2.gz	ADWJTAFKSDLMMV-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925317524	714806889	/nfs/dbraw/zinc/80/68/89/714806889.db2.gz	MCKAOCIKYMURRK-WCQYABFASA-N	1	1	306.366	1.829	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000934832076	714912783	/nfs/dbraw/zinc/91/27/83/714912783.db2.gz	NIFDRDMJQCTBSO-QWHCGFSZSA-N	1	1	308.382	1.967	20	5		DDBDMO
Cc1ccc(CCC[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001126936848	742843507	/nfs/dbraw/zinc/84/35/07/742843507.db2.gz	UNSQJPMAUZPACJ-HUUCEWRRSA-N	1	1	305.378	1.299	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NC/C=C/CNc1ccc([N+](=O)[O-])cn1	ZINC001107234057	749663963	/nfs/dbraw/zinc/66/39/63/749663963.db2.gz	WMEJFWXVVRDHJO-SNAWJCMRSA-N	1	1	321.381	1.414	20	5		DDBDMO
O=C(NCC1([NH2+]C/C=C/Cl)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001115530740	751045519	/nfs/dbraw/zinc/04/55/19/751045519.db2.gz	OMBLSZZFJROUQF-KSOFABFVSA-N	1	1	315.801	1.813	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccccc2)CC1	ZINC000997770906	751268543	/nfs/dbraw/zinc/26/85/43/751268543.db2.gz	AVMGKEVYYMZGDY-HZPDHXFCSA-N	1	1	317.389	1.680	20	5		DDBDMO
CCOC(=O)C1=C(O)CC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169029688	762186241	/nfs/dbraw/zinc/18/62/41/762186241.db2.gz	VFSCUCSJTKGPJQ-FRRDWIJNSA-N	1	1	312.366	1.276	20	5		DDBDMO
COc1cccnc1O[C@@H]1CC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169050669	762207226	/nfs/dbraw/zinc/20/72/26/762207226.db2.gz	CHCYGVHIMOSZOM-MELADBBJSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CCc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139568	760613736	/nfs/dbraw/zinc/61/37/36/760613736.db2.gz	GBZGEMRSJJVGIA-RGCMKSIDSA-N	1	1	321.352	1.270	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2C[C@@H](OC)[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC001170328654	766253868	/nfs/dbraw/zinc/25/38/68/766253868.db2.gz	LAVBFPYZKLLBAD-KNXALSJPSA-N	1	1	324.377	1.880	20	5		DDBDMO
C[C@@H]1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC001170352517	766260706	/nfs/dbraw/zinc/26/07/06/766260706.db2.gz	XNDMNPBVMDMQMM-DVOMOZLQSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC001170352517	766260711	/nfs/dbraw/zinc/26/07/11/766260711.db2.gz	XNDMNPBVMDMQMM-DVOMOZLQSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC001170352517	766260717	/nfs/dbraw/zinc/26/07/17/766260717.db2.gz	XNDMNPBVMDMQMM-DVOMOZLQSA-N	1	1	323.393	1.015	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+](C)CCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC001170352040	766280067	/nfs/dbraw/zinc/28/00/67/766280067.db2.gz	KFWLEMIZZBISDF-GFCCVEGCSA-N	1	1	323.393	1.945	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cnc(N)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC001147741598	773227714	/nfs/dbraw/zinc/22/77/14/773227714.db2.gz	GEKCQQIFFCEZMA-CMPLNLGQSA-N	1	1	321.381	1.517	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N(C)CCNC(=O)C[N@H+](C)C(C)C)c1	ZINC001100149975	775735550	/nfs/dbraw/zinc/73/55/50/775735550.db2.gz	XYRREWWZDXCJHE-UHFFFAOYSA-N	1	1	322.409	1.796	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001094573775	776047576	/nfs/dbraw/zinc/04/75/76/776047576.db2.gz	GSSDVRZTIVCRGR-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1ncccc1[N+](=O)[O-]	ZINC001100546922	776292614	/nfs/dbraw/zinc/29/26/14/776292614.db2.gz	YLCRJXGLDOYOPM-UHFFFAOYSA-N	1	1	323.397	1.273	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172907067	776918263	/nfs/dbraw/zinc/91/82/63/776918263.db2.gz	CMEVWUXUCATIQF-AWEZNQCLSA-N	1	1	305.378	1.910	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1	ZINC001175839402	777922343	/nfs/dbraw/zinc/92/23/43/777922343.db2.gz	XQBMBTRHWSXYOK-VIFPVBQESA-N	1	1	312.757	1.654	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N[C@@H](C)C[N@H+](C)CCCN(C)C	ZINC001118535865	781152876	/nfs/dbraw/zinc/15/28/76/781152876.db2.gz	GSTFGBHLABZIIB-ZDUSSCGKSA-N	1	1	309.414	1.404	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N[C@@H](C)C[N@@H+](C)CCCN(C)C	ZINC001118535865	781152881	/nfs/dbraw/zinc/15/28/81/781152881.db2.gz	GSTFGBHLABZIIB-ZDUSSCGKSA-N	1	1	309.414	1.404	20	5		DDBDMO
C[N@H+](CCNC(=O)C1=COCCO1)Cc1ccccc1[N+](=O)[O-]	ZINC001267186187	837493341	/nfs/dbraw/zinc/49/33/41/837493341.db2.gz	ZFWDSCOZRDQWGE-UHFFFAOYSA-N	1	1	321.333	1.031	20	5		DDBDMO
C[N@@H+](CCNC(=O)C1=COCCO1)Cc1ccccc1[N+](=O)[O-]	ZINC001267186187	837493347	/nfs/dbraw/zinc/49/33/47/837493347.db2.gz	ZFWDSCOZRDQWGE-UHFFFAOYSA-N	1	1	321.333	1.031	20	5		DDBDMO
CC(C)(F)C(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1	ZINC001267673236	838619643	/nfs/dbraw/zinc/61/96/43/838619643.db2.gz	AYCJBTJCDPJFGL-UHFFFAOYSA-N	1	1	309.341	1.891	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc(C)n2)CC1	ZINC001292190694	846474852	/nfs/dbraw/zinc/47/48/52/846474852.db2.gz	ACCZSJFQZLGWJN-UHFFFAOYSA-N	1	1	322.365	1.093	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1C[C@@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975897	859506816	/nfs/dbraw/zinc/50/68/16/859506816.db2.gz	GUSQVLAMRAVGBN-SLEUVZQESA-N	1	1	318.377	1.160	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)cc1[N+](=O)[O-]	ZINC001124109341	859583938	/nfs/dbraw/zinc/58/39/38/859583938.db2.gz	MLWUUPLRAARESF-JHJVBQTASA-N	1	1	318.377	1.707	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C(C)(C)C1	ZINC001156836516	863384395	/nfs/dbraw/zinc/38/43/95/863384395.db2.gz	KOPWEIPPPMRQDD-JTQLQIEISA-N	1	1	307.354	1.032	20	5		DDBDMO
CC(C)[N@@H+](C)[C@H]1CCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C1	ZINC001157009826	863515118	/nfs/dbraw/zinc/51/51/18/863515118.db2.gz	NFFOXEFPSPGNTR-JTQLQIEISA-N	1	1	314.773	1.801	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)c([N+](=O)[O-])c1	ZINC001157266082	863694813	/nfs/dbraw/zinc/69/48/13/863694813.db2.gz	NQEOHOJJWFQXQE-GWCFXTLKSA-N	1	1	320.349	1.307	20	5		DDBDMO
COc1ncnc(N2CC[N@@H+](C)CC23CCCC3)c1[N+](=O)[O-]	ZINC001158408905	864634479	/nfs/dbraw/zinc/63/44/79/864634479.db2.gz	QWKORMOOEWOVLM-UHFFFAOYSA-N	1	1	307.354	1.458	20	5		DDBDMO
CCOC(=O)C1=C(N=c2[nH]ccc(C)c2[N+](=O)[O-])CC[NH2+]C1	ZINC001159453031	865309235	/nfs/dbraw/zinc/30/92/35/865309235.db2.gz	MVRAEVXEXLMSBK-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
CCOC(=O)C1=C(Nc2nccc(C)c2[N+](=O)[O-])CC[NH2+]C1	ZINC001159453031	865309252	/nfs/dbraw/zinc/30/92/52/865309252.db2.gz	MVRAEVXEXLMSBK-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC001160152451	865702664	/nfs/dbraw/zinc/70/26/64/865702664.db2.gz	BISZCSGSGMJCQC-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc(-n2cc(CC[NH3+])c3cnccc32)ncc1[N+](=O)[O-]	ZINC001160945520	866205647	/nfs/dbraw/zinc/20/56/47/866205647.db2.gz	CSDJQDAFFGHMPG-UHFFFAOYSA-N	1	1	313.317	1.839	20	5		DDBDMO
COc1ccc2ncc([N+](=O)[O-])c(N3CC[NH+](C)CC3)c2c1	ZINC001333344730	866654162	/nfs/dbraw/zinc/65/41/62/866654162.db2.gz	XDNFMOAZSUBPOV-UHFFFAOYSA-N	1	1	302.334	1.903	20	5		DDBDMO
O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ncc[nH]1	ZINC001321052234	867266731	/nfs/dbraw/zinc/26/67/31/867266731.db2.gz	CWYIFKUFHFDVGC-UPHRSURJSA-N	1	1	321.362	1.455	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](Nc2c3c(ccc2[N+](=O)[O-])NCC3)C1	ZINC001335513253	868353189	/nfs/dbraw/zinc/35/31/89/868353189.db2.gz	URSDEHKPNPMUKT-NSHDSACASA-N	1	1	320.393	1.820	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC001336746989	869122191	/nfs/dbraw/zinc/12/21/91/869122191.db2.gz	YVHFRIWNOPJHIM-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCOCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC001317204933	870466841	/nfs/dbraw/zinc/46/68/41/870466841.db2.gz	LSYUAGNYKOSGQI-VIKVFOODSA-N	1	1	319.361	1.178	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+]CCN3CCNC3=S)nc2c1	ZINC001308988750	871543691	/nfs/dbraw/zinc/54/36/91/871543691.db2.gz	UIMGDIWFGPXRGC-UHFFFAOYSA-N	1	1	321.362	1.016	20	5		DDBDMO
C[C@H](C[N+](C)(C)C)Oc1ncnc2[nH]nc(Br)c21	ZINC001226667634	882575539	/nfs/dbraw/zinc/57/55/39/882575539.db2.gz	BHXWDWOPAALPSM-SSDOTTSWSA-N	1	1	315.195	1.589	20	5		DDBDMO
COc1ccc(NC(=O)NCCn2cc[nH+]c2C)c([N+](=O)[O-])c1	ZINC001347771105	874271478	/nfs/dbraw/zinc/27/14/78/874271478.db2.gz	HAKABRALTVCBIW-UHFFFAOYSA-N	1	1	319.321	1.930	20	5		DDBDMO
CC(C)[NH+]1CC(Oc2[nH]c(=O)nc3ccc([N+](=O)[O-])cc32)C1	ZINC001227092302	882824255	/nfs/dbraw/zinc/82/42/55/882824255.db2.gz	PJPZPVHUSDZRLK-UHFFFAOYSA-N	1	1	304.306	1.715	20	5		DDBDMO
C[C@H](C(=O)OCc1cn(C)nc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC001349972671	875483282	/nfs/dbraw/zinc/48/32/82/875483282.db2.gz	WZADWBDAQNETCY-OUAUKWLOSA-N	1	1	310.354	1.633	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[N@H+]1C1CCCC1	ZINC001352968521	877044844	/nfs/dbraw/zinc/04/48/44/877044844.db2.gz	FUUSLODMHSUCAA-JTQLQIEISA-N	1	1	307.354	1.407	20	5		DDBDMO
Nc1cc2nc3ccccc3nc2cc1NC(=O)[C@@H]1COC[NH2+]1	ZINC001218857997	877770915	/nfs/dbraw/zinc/77/09/15/877770915.db2.gz	SNDCANSRQVXNJJ-HNNXBMFYSA-N	1	1	309.329	1.250	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CO[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001223943265	881156885	/nfs/dbraw/zinc/15/68/85/881156885.db2.gz	KOBMOMQBNOBZLL-BJJXKVORSA-N	1	1	320.345	1.924	20	5		DDBDMO
C[N@H+]1CC[C@@H](Oc2cc(Br)cnc2[N+](=O)[O-])C1	ZINC001229562772	884049749	/nfs/dbraw/zinc/04/97/49/884049749.db2.gz	IDAAMETVTURVOD-MRVPVSSYSA-N	1	1	302.128	1.835	20	5		DDBDMO
COc1c(C)cc([N+](=O)[O-])c(O[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001229870498	884200367	/nfs/dbraw/zinc/20/03/67/884200367.db2.gz	NKDXKIBVRIDIHB-VIFPVBQESA-N	1	1	311.294	1.903	20	5		DDBDMO
COC(=O)c1cc(O[C@@H]2C[NH+]3CCC2CC3)c(F)cc1[N+](=O)[O-]	ZINC001229943726	884243664	/nfs/dbraw/zinc/24/36/64/884243664.db2.gz	UJWAJFFDSDRHCF-CQSZACIVSA-N	1	1	324.308	1.994	20	5		DDBDMO
N[C@]12C[C@H]1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246870272	892961659	/nfs/dbraw/zinc/96/16/59/892961659.db2.gz	OGZWMFNJWQTFMJ-LRDDRELGSA-N	1	1	302.378	1.597	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](CO)C3)CC2)cc1	ZINC001254479294	896457039	/nfs/dbraw/zinc/45/70/39/896457039.db2.gz	WVTMAJSJBWWWSU-CYBMUJFWSA-N	1	1	305.378	1.878	20	5		DDBDMO
CCC(=O)N1CC[NH+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254596343	896521095	/nfs/dbraw/zinc/52/10/95/896521095.db2.gz	CPWOOLYCRDOSNJ-OAHLLOKOSA-N	1	1	303.362	1.616	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254604015	896528128	/nfs/dbraw/zinc/52/81/28/896528128.db2.gz	SHIZFXYRKMPSHF-CABCVRRESA-N	1	1	301.346	1.369	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254604015	896528141	/nfs/dbraw/zinc/52/81/41/896528141.db2.gz	SHIZFXYRKMPSHF-CABCVRRESA-N	1	1	301.346	1.369	20	5		DDBDMO
CCOC(=O)C[C@@H]1CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC001262013464	899895912	/nfs/dbraw/zinc/89/59/12/899895912.db2.gz	CVEFZZHVHQHGSJ-LBPRGKRZSA-N	1	1	310.354	1.517	20	5		DDBDMO
Cc1c(CNC(=O)C[N@H+](C)[C@@H]2CCC[C@H]2O)cccc1[N+](=O)[O-]	ZINC001296421003	916402443	/nfs/dbraw/zinc/40/24/43/916402443.db2.gz	PTDQZPDSWZMSPJ-HUUCEWRRSA-N	1	1	321.377	1.365	20	5		DDBDMO
Cc1cc(N2CC[N@@H+](C3CCOCC3)C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000278277167	214062851	/nfs/dbraw/zinc/06/28/51/214062851.db2.gz	BHRYIJBITJOIGZ-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000278453614	214162361	/nfs/dbraw/zinc/16/23/61/214162361.db2.gz	RDBVZNBEWGGPDU-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000278453614	214162364	/nfs/dbraw/zinc/16/23/64/214162364.db2.gz	RDBVZNBEWGGPDU-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000278453614	214162375	/nfs/dbraw/zinc/16/23/75/214162375.db2.gz	RDBVZNBEWGGPDU-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000451578513	231129908	/nfs/dbraw/zinc/12/99/08/231129908.db2.gz	XKIGOQXZHCKPGW-HZMBPMFUSA-N	1	1	307.350	1.551	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083173249	185215687	/nfs/dbraw/zinc/21/56/87/185215687.db2.gz	SUXVVMBZZPBTLA-VIFPVBQESA-N	1	1	307.306	1.977	20	5		DDBDMO
CCC(CC)[N@@H+](CCOC)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090525706	282184123	/nfs/dbraw/zinc/18/41/23/282184123.db2.gz	OVSDLOUHPWRYTM-UHFFFAOYSA-N	1	1	311.382	1.894	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000295788908	529504961	/nfs/dbraw/zinc/50/49/61/529504961.db2.gz	UWXUDCADGGURHZ-NSHDSACASA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000295788908	529504964	/nfs/dbraw/zinc/50/49/64/529504964.db2.gz	UWXUDCADGGURHZ-NSHDSACASA-N	1	1	306.322	1.848	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1CCC[N@@H+]1CCCO	ZINC000452345771	231354529	/nfs/dbraw/zinc/35/45/29/231354529.db2.gz	FTSXFBRLCFOOHM-AWEZNQCLSA-N	1	1	321.377	1.100	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000615037698	362123458	/nfs/dbraw/zinc/12/34/58/362123458.db2.gz	IYVPUEPMPMCFLQ-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000615037698	362123464	/nfs/dbraw/zinc/12/34/64/362123464.db2.gz	IYVPUEPMPMCFLQ-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000279671845	215050587	/nfs/dbraw/zinc/05/05/87/215050587.db2.gz	DLYXIGJOPYGWIV-CHWSQXEVSA-N	1	1	309.366	1.382	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000487515346	233812425	/nfs/dbraw/zinc/81/24/25/233812425.db2.gz	KHQTVVDCKUSRLE-WCQYABFASA-N	1	1	321.381	1.153	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1	ZINC000063722336	352921076	/nfs/dbraw/zinc/92/10/76/352921076.db2.gz	UKHFZUSCKORFRR-UHFFFAOYSA-N	1	1	309.370	1.124	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000066048429	352975401	/nfs/dbraw/zinc/97/54/01/352975401.db2.gz	SVWVAVAVAQDNFU-LLVKDONJSA-N	1	1	320.353	1.139	20	5		DDBDMO
CC1(C)C[N@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)CCO1	ZINC000173396255	198210425	/nfs/dbraw/zinc/21/04/25/198210425.db2.gz	AEVDQTULLIRGRO-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC1(C)C[N@@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)CCO1	ZINC000173396255	198210426	/nfs/dbraw/zinc/21/04/26/198210426.db2.gz	AEVDQTULLIRGRO-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2csc([N+](=O)[O-])c2)n1C	ZINC000074094989	353290303	/nfs/dbraw/zinc/29/03/03/353290303.db2.gz	WOYJUWJGVJUECT-UHFFFAOYSA-N	1	1	309.351	1.386	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000076795579	353438728	/nfs/dbraw/zinc/43/87/28/353438728.db2.gz	WEFVZGCJHSKCQN-LLVKDONJSA-N	1	1	308.386	1.891	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000080451185	353609453	/nfs/dbraw/zinc/60/94/53/353609453.db2.gz	OLHCNYXWHCGFPV-AWEZNQCLSA-N	1	1	321.402	1.858	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)n1	ZINC000090145881	353791441	/nfs/dbraw/zinc/79/14/41/353791441.db2.gz	AFAWYIAPAJOWDX-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)n1	ZINC000090145881	353791442	/nfs/dbraw/zinc/79/14/42/353791442.db2.gz	AFAWYIAPAJOWDX-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCC[C@@H](C(N)=O)C1	ZINC000092642215	353865119	/nfs/dbraw/zinc/86/51/19/353865119.db2.gz	DJZBAPDACFDISL-GFCCVEGCSA-N	1	1	321.381	1.298	20	5		DDBDMO
CC(C)(C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1)n1cc([N+](=O)[O-])cn1	ZINC000102487495	353926190	/nfs/dbraw/zinc/92/61/90/353926190.db2.gz	IXKCERWYBJYYAH-NSHDSACASA-N	1	1	321.381	1.127	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000617765322	363298149	/nfs/dbraw/zinc/29/81/49/363298149.db2.gz	WDGNUOTXPCNLQC-GFCCVEGCSA-N	1	1	309.366	1.129	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)C[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119364	354196507	/nfs/dbraw/zinc/19/65/07/354196507.db2.gz	YKYWFEOVEGBPRU-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119364	354196510	/nfs/dbraw/zinc/19/65/10/354196510.db2.gz	YKYWFEOVEGBPRU-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H](O)C1CC1	ZINC000156634181	354220308	/nfs/dbraw/zinc/22/03/08/354220308.db2.gz	CJOCKKKRIWFPJB-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@@H](O)C1CC1	ZINC000156634181	354220312	/nfs/dbraw/zinc/22/03/12/354220312.db2.gz	CJOCKKKRIWFPJB-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305729961	354471215	/nfs/dbraw/zinc/47/12/15/354471215.db2.gz	KFAPPIXVFAAEFK-QMTHXVAHSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCO)Cc1ccccc1	ZINC000309543141	354473154	/nfs/dbraw/zinc/47/31/54/354473154.db2.gz	NDSLESPXSKKVEF-UHFFFAOYSA-N	1	1	304.350	1.594	20	5		DDBDMO
CC[N@@H+]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000318517200	354516545	/nfs/dbraw/zinc/51/65/45/354516545.db2.gz	YZOLNESOQJCECP-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000318517200	354516548	/nfs/dbraw/zinc/51/65/48/354516548.db2.gz	YZOLNESOQJCECP-JTQLQIEISA-N	1	1	308.338	1.307	20	5		DDBDMO
COc1cc(NC[C@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])cc1C	ZINC000320040907	354524920	/nfs/dbraw/zinc/52/49/20/354524920.db2.gz	CNRKKNFNISJMAG-LBPRGKRZSA-N	1	1	308.382	1.570	20	5		DDBDMO
Nc1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc(CO)c1[N+](=O)[O-]	ZINC000587309780	354881905	/nfs/dbraw/zinc/88/19/05/354881905.db2.gz	QUGNMBCJONQTNA-YPMHNXCESA-N	1	1	306.366	1.708	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589501665	354996932	/nfs/dbraw/zinc/99/69/32/354996932.db2.gz	VPWQHTGZJGGUED-JTQLQIEISA-N	1	1	323.349	1.195	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]2CCO)c1	ZINC000589515070	354999121	/nfs/dbraw/zinc/99/91/21/354999121.db2.gz	UVFMXQRKXNBBAP-ZDUSSCGKSA-N	1	1	308.334	1.728	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000590442691	355096780	/nfs/dbraw/zinc/09/67/80/355096780.db2.gz	ACHHCXYGGZBWPW-AAEUAGOBSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)[C@H]2C1	ZINC000590445623	355098722	/nfs/dbraw/zinc/09/87/22/355098722.db2.gz	QZZRWDQHDMEHRP-SKDRFNHKSA-N	1	1	319.317	1.100	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](O)[C@H]1C	ZINC000590759166	355168501	/nfs/dbraw/zinc/16/85/01/355168501.db2.gz	ZPFWRVHBWHLIPB-RISCZKNCSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@@H]1[C@H](O)CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000590762238	355170098	/nfs/dbraw/zinc/17/00/98/355170098.db2.gz	GZSXYNGGYCYODC-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1[C@H](O)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000590762238	355170100	/nfs/dbraw/zinc/17/01/00/355170100.db2.gz	GZSXYNGGYCYODC-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[N@@H+](CCCCNc1cc(N)c([N+](=O)[O-])c(CO)c1)C1CC1	ZINC000591166369	355258313	/nfs/dbraw/zinc/25/83/13/355258313.db2.gz	FUYFZWUIYUTVFG-UHFFFAOYSA-N	1	1	308.382	1.956	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592829333	355705934	/nfs/dbraw/zinc/70/59/34/355705934.db2.gz	NXKHYASARCWTQN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@H+](C)C1	ZINC000592829333	355705935	/nfs/dbraw/zinc/70/59/35/355705935.db2.gz	NXKHYASARCWTQN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592829333	355705939	/nfs/dbraw/zinc/70/59/39/355705939.db2.gz	NXKHYASARCWTQN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC1(C)[C@@H](O)C[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000594003569	356084369	/nfs/dbraw/zinc/08/43/69/356084369.db2.gz	APOPJUAZDSBZJQ-RYUDHWBXSA-N	1	1	318.333	1.894	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1	ZINC000594056835	356101127	/nfs/dbraw/zinc/10/11/27/356101127.db2.gz	ZGVMFTKHHIAXMP-SNVBAGLBSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1	ZINC000594056835	356101133	/nfs/dbraw/zinc/10/11/33/356101133.db2.gz	ZGVMFTKHHIAXMP-SNVBAGLBSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3ncc([N+](=O)[O-])cc3Cl)[C@@H]2C1	ZINC000284571803	283158558	/nfs/dbraw/zinc/15/85/58/283158558.db2.gz	OKWSUCKTVFRBON-VXGBXAGGSA-N	1	1	312.757	1.553	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ncccn1	ZINC000595097697	356381840	/nfs/dbraw/zinc/38/18/40/356381840.db2.gz	CMJRSFRZLCTYCY-NSHDSACASA-N	1	1	315.333	1.892	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000595446562	356496465	/nfs/dbraw/zinc/49/64/65/356496465.db2.gz	MDDYBXVNNXUSEW-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000595663088	356598075	/nfs/dbraw/zinc/59/80/75/356598075.db2.gz	QXDWVMWWJTWTOY-MRXNPFEDSA-N	1	1	324.377	1.837	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc(CCc3c[nH+]cn3C)n2)n1C	ZINC000347174899	283196642	/nfs/dbraw/zinc/19/66/42/283196642.db2.gz	ZJFGNSYAWVBDEB-UHFFFAOYSA-N	1	1	317.309	1.205	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]2[C@@H](C)O)c1	ZINC000595767433	356643691	/nfs/dbraw/zinc/64/36/91/356643691.db2.gz	XHFZXNAVNZBIRN-ZWNOBZJWSA-N	1	1	308.334	1.727	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@]3(O)C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000595758703	356639427	/nfs/dbraw/zinc/63/94/27/356639427.db2.gz	UGSMPSZZYIQOAF-BFQNTYOBSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@]3(O)C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000595758703	356639429	/nfs/dbraw/zinc/63/94/29/356639429.db2.gz	UGSMPSZZYIQOAF-BFQNTYOBSA-N	1	1	319.361	1.687	20	5		DDBDMO
COc1ccc2c(c1)CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000595760096	356641198	/nfs/dbraw/zinc/64/11/98/356641198.db2.gz	QYTQZXVCIFYRJE-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000595760096	356641201	/nfs/dbraw/zinc/64/12/01/356641201.db2.gz	QYTQZXVCIFYRJE-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H]3COC[C@]3(C)C2)c([N+](=O)[O-])c1	ZINC000595762096	356641768	/nfs/dbraw/zinc/64/17/68/356641768.db2.gz	ZXPOWZPUZRFGGD-LRDDRELGSA-N	1	1	322.361	1.951	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)c1ccc(N)c([N+](=O)[O-])n1	ZINC000596214956	356817971	/nfs/dbraw/zinc/81/79/71/356817971.db2.gz	NYSVPNZXPHHAIL-UHFFFAOYSA-N	1	1	309.370	1.119	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)c1ccc(N)c([N+](=O)[O-])n1	ZINC000596214956	356817974	/nfs/dbraw/zinc/81/79/74/356817974.db2.gz	NYSVPNZXPHHAIL-UHFFFAOYSA-N	1	1	309.370	1.119	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596308691	356852564	/nfs/dbraw/zinc/85/25/64/356852564.db2.gz	KWWSHGQXBROTPH-LLVKDONJSA-N	1	1	306.366	1.978	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@]1(C)CO	ZINC000597237040	357106007	/nfs/dbraw/zinc/10/60/07/357106007.db2.gz	VZCDNDMKWCXXHT-ZBEGNZNMSA-N	1	1	322.361	1.816	20	5		DDBDMO
Cc1[nH+]cc(CN2CCN(c3ncccc3[N+](=O)[O-])CC2)n1C	ZINC000597148289	357072669	/nfs/dbraw/zinc/07/26/69/357072669.db2.gz	BDXGBEFRZRMVTN-UHFFFAOYSA-N	1	1	316.365	1.354	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000597921919	357382965	/nfs/dbraw/zinc/38/29/65/357382965.db2.gz	HVDYSPYKVXYHEZ-SNVBAGLBSA-N	1	1	306.366	1.780	20	5		DDBDMO
CC(C)(C)[N@@H+]1CC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000597924405	357383343	/nfs/dbraw/zinc/38/33/43/357383343.db2.gz	QTWGNTWODCRWDZ-LLVKDONJSA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000597924405	357383349	/nfs/dbraw/zinc/38/33/49/357383349.db2.gz	QTWGNTWODCRWDZ-LLVKDONJSA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000347685953	283258807	/nfs/dbraw/zinc/25/88/07/283258807.db2.gz	SAGHZYQKDSPXPV-GFCCVEGCSA-N	1	1	309.370	1.067	20	5		DDBDMO
CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](CC)C1	ZINC000598041440	357439582	/nfs/dbraw/zinc/43/95/82/357439582.db2.gz	LWTAZKRMNMRNSJ-CQSZACIVSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000347685953	283258810	/nfs/dbraw/zinc/25/88/10/283258810.db2.gz	SAGHZYQKDSPXPV-GFCCVEGCSA-N	1	1	309.370	1.067	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000598343408	357546056	/nfs/dbraw/zinc/54/60/56/357546056.db2.gz	ULIMWFNLZVIXGB-ZDUSSCGKSA-N	1	1	320.393	1.632	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598651087	357671815	/nfs/dbraw/zinc/67/18/15/357671815.db2.gz	QQOSGWPRLOODMD-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598651087	357671819	/nfs/dbraw/zinc/67/18/19/357671819.db2.gz	QQOSGWPRLOODMD-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[NH2+][C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598569233	357635213	/nfs/dbraw/zinc/63/52/13/357635213.db2.gz	BZBAGIBJHCTSKN-JTQLQIEISA-N	1	1	309.370	1.511	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[NH+](CCCF)CC2)c([N+](=O)[O-])c1	ZINC000599094660	357814271	/nfs/dbraw/zinc/81/42/71/357814271.db2.gz	XLCUUPGWCOOCIJ-UHFFFAOYSA-N	1	1	324.356	1.436	20	5		DDBDMO
C[N@@H+](CC1(C)COC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000599571973	357979778	/nfs/dbraw/zinc/97/97/78/357979778.db2.gz	ZADGJMCMQQVYHR-CQSZACIVSA-N	1	1	319.361	1.668	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c1	ZINC000599684413	358024205	/nfs/dbraw/zinc/02/42/05/358024205.db2.gz	OHTUIGMTBHQWEP-COLVAYQJSA-N	1	1	320.345	1.727	20	5		DDBDMO
CC[N@@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C1	ZINC000601165107	358428949	/nfs/dbraw/zinc/42/89/49/358428949.db2.gz	KGQFRDDOBNZOLO-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC[N@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C1	ZINC000601165107	358428953	/nfs/dbraw/zinc/42/89/53/358428953.db2.gz	KGQFRDDOBNZOLO-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)C[C@@](C)(O)C1CC1	ZINC000601956526	358752879	/nfs/dbraw/zinc/75/28/79/358752879.db2.gz	RUNLZTJFGASDIC-GDBMZVCRSA-N	1	1	308.378	1.939	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)C[C@@](C)(O)C1CC1	ZINC000601956526	358752883	/nfs/dbraw/zinc/75/28/83/358752883.db2.gz	RUNLZTJFGASDIC-GDBMZVCRSA-N	1	1	308.378	1.939	20	5		DDBDMO
Cn1cc(CN2CC[N@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602425615	358968420	/nfs/dbraw/zinc/96/84/20/358968420.db2.gz	RSEKYPNVSAKHOG-HNNXBMFYSA-N	1	1	315.377	1.817	20	5		DDBDMO
Cn1cc(CN2CC[N@@H+](C)C[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602425615	358968423	/nfs/dbraw/zinc/96/84/23/358968423.db2.gz	RSEKYPNVSAKHOG-HNNXBMFYSA-N	1	1	315.377	1.817	20	5		DDBDMO
C[C@H](CCN(C)C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000602535645	359032831	/nfs/dbraw/zinc/03/28/31/359032831.db2.gz	WEGILRZNUNYBTH-CYBMUJFWSA-N	1	1	321.425	1.888	20	5		DDBDMO
COc1c(C)c[nH+]c(CN(C)Cc2cn(C)nc2[N+](=O)[O-])c1C	ZINC000602607900	359070159	/nfs/dbraw/zinc/07/01/59/359070159.db2.gz	NJYUNEPNOBOUHC-UHFFFAOYSA-N	1	1	319.365	1.981	20	5		DDBDMO
CCNC(=O)C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1	ZINC000602589910	359058825	/nfs/dbraw/zinc/05/88/25/359058825.db2.gz	ZNVKXGOIVLBHQB-UHFFFAOYSA-N	1	1	322.184	1.645	20	5		DDBDMO
CC(=O)NC1CCC([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])CC1	ZINC000602804097	359203039	/nfs/dbraw/zinc/20/30/39/359203039.db2.gz	HYOVDCKKDVUVTJ-UHFFFAOYSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)Cc1cnc(N(C)C)nc1	ZINC000602807284	359204637	/nfs/dbraw/zinc/20/46/37/359204637.db2.gz	RKZVPQPCFFVJPI-UHFFFAOYSA-N	1	1	319.369	1.088	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1cnc(N(C)C)nc1	ZINC000602807284	359204640	/nfs/dbraw/zinc/20/46/40/359204640.db2.gz	RKZVPQPCFFVJPI-UHFFFAOYSA-N	1	1	319.369	1.088	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](OCC2CC2)C1	ZINC000602813828	359209072	/nfs/dbraw/zinc/20/90/72/359209072.db2.gz	ZXYVGOVKTLVXIL-CQSZACIVSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCc2c(O)cccc2C1	ZINC000602915135	359292205	/nfs/dbraw/zinc/29/22/05/359292205.db2.gz	JRMIOPZFGVFADC-UHFFFAOYSA-N	1	1	302.334	1.864	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2c(O)cccc2C1	ZINC000602915135	359292208	/nfs/dbraw/zinc/29/22/08/359292208.db2.gz	JRMIOPZFGVFADC-UHFFFAOYSA-N	1	1	302.334	1.864	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)CC[N@@H+](C)C1CC1	ZINC000602950603	359316677	/nfs/dbraw/zinc/31/66/77/359316677.db2.gz	GTCHJTVFVKVQJN-UHFFFAOYSA-N	1	1	307.354	1.278	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000603142351	359431482	/nfs/dbraw/zinc/43/14/82/359431482.db2.gz	JQTKZYNRNGIDCI-TXEJJXNPSA-N	1	1	309.370	1.123	20	5		DDBDMO
CC1(C)[C@H](Nc2ncc([N+](=O)[O-])cn2)C[C@H]1[NH+]1CCOCC1	ZINC000603400426	359616525	/nfs/dbraw/zinc/61/65/25/359616525.db2.gz	XBEXQESDPOCIIO-VXGBXAGGSA-N	1	1	307.354	1.296	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000276309833	212792902	/nfs/dbraw/zinc/79/29/02/212792902.db2.gz	OFYNUDMOKQMMHB-KBPBESRZSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1	ZINC000187810929	200160068	/nfs/dbraw/zinc/16/00/68/200160068.db2.gz	KIHBIMCPHWAUKI-HIFRSBDPSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H](O)C[C@H]3CO)o2)cc1	ZINC000187664225	200141364	/nfs/dbraw/zinc/14/13/64/200141364.db2.gz	STXIZYIYLVVILL-KBPBESRZSA-N	1	1	318.329	1.782	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609382553	360303014	/nfs/dbraw/zinc/30/30/14/360303014.db2.gz	BZOAUEGMORXJOI-ZDUSSCGKSA-N	1	1	319.361	1.574	20	5		DDBDMO
COCC1([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000611178845	360650164	/nfs/dbraw/zinc/65/01/64/360650164.db2.gz	QEUXHBXFZNIXGW-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
COCC1([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000611178845	360650168	/nfs/dbraw/zinc/65/01/68/360650168.db2.gz	QEUXHBXFZNIXGW-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611088437	360620095	/nfs/dbraw/zinc/62/00/95/360620095.db2.gz	VVXNBZGWZPTJOP-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611088437	360620096	/nfs/dbraw/zinc/62/00/96/360620096.db2.gz	VVXNBZGWZPTJOP-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092538	360620786	/nfs/dbraw/zinc/62/07/86/360620786.db2.gz	YCXOVAUXQWYFGX-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1	ZINC000611195855	360656729	/nfs/dbraw/zinc/65/67/29/360656729.db2.gz	YXFPSHHEEFAWTN-JTQLQIEISA-N	1	1	302.334	1.900	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000194610369	201262849	/nfs/dbraw/zinc/26/28/49/201262849.db2.gz	OZFAOLANAAEJNT-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000195326879	201378471	/nfs/dbraw/zinc/37/84/71/201378471.db2.gz	UEOCNYZSSCMWGM-ZDUSSCGKSA-N	1	1	321.402	1.994	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252434	363945055	/nfs/dbraw/zinc/94/50/55/363945055.db2.gz	LKXFTCIZXGATTF-ZYHUDNBSSA-N	1	1	322.340	1.435	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000275198949	212190333	/nfs/dbraw/zinc/19/03/33/212190333.db2.gz	HFMZLVOXVDPIGJ-UHFFFAOYSA-N	1	1	302.334	1.899	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)[C@H](CC)CN1C(C)=O	ZINC000350487491	284205563	/nfs/dbraw/zinc/20/55/63/284205563.db2.gz	ZNBBBRJACONNRB-ZIAGYGMSSA-N	1	1	323.397	1.513	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@H](CC)CN1C(C)=O	ZINC000350487491	284205565	/nfs/dbraw/zinc/20/55/65/284205565.db2.gz	ZNBBBRJACONNRB-ZIAGYGMSSA-N	1	1	323.397	1.513	20	5		DDBDMO
COc1ccc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000264672160	204069213	/nfs/dbraw/zinc/06/92/13/204069213.db2.gz	WWZKVJYWOFZCLG-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(C)C1=O	ZINC000282470142	217020442	/nfs/dbraw/zinc/02/04/42/217020442.db2.gz	KPMVLZVXVTYAIC-ZDUSSCGKSA-N	1	1	305.334	1.564	20	5		DDBDMO
CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(C)C1=O	ZINC000282470142	217020443	/nfs/dbraw/zinc/02/04/43/217020443.db2.gz	KPMVLZVXVTYAIC-ZDUSSCGKSA-N	1	1	305.334	1.564	20	5		DDBDMO
CC(C)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(N)=O	ZINC000282685232	217175732	/nfs/dbraw/zinc/17/57/32/217175732.db2.gz	NSTFAKWRKRZKIM-UHFFFAOYSA-N	1	1	322.365	1.367	20	5		DDBDMO
COc1ccccc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266406676	205323712	/nfs/dbraw/zinc/32/37/12/205323712.db2.gz	FXJNJFMBGAIFIZ-CQSZACIVSA-N	1	1	320.349	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288490007	220175092	/nfs/dbraw/zinc/17/50/92/220175092.db2.gz	ROIRPQDEJWBKOD-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284408556	218015817	/nfs/dbraw/zinc/01/58/17/218015817.db2.gz	NUHFCYSEFFQDDC-SDBXPKJASA-N	1	1	322.340	1.529	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000104747481	194034010	/nfs/dbraw/zinc/03/40/10/194034010.db2.gz	SZGLRKYDHLVHDU-NSHDSACASA-N	1	1	313.379	1.167	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000104831906	194044596	/nfs/dbraw/zinc/04/45/96/194044596.db2.gz	LIDJXVVKQQSYNO-NSHDSACASA-N	1	1	306.366	1.700	20	5		DDBDMO
C[C@H]1CCNC(=O)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000284739779	218155993	/nfs/dbraw/zinc/15/59/93/218155993.db2.gz	KUCWSWWEFRROMB-UFBFGSQYSA-N	1	1	308.294	1.117	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000338785994	250135466	/nfs/dbraw/zinc/13/54/66/250135466.db2.gz	BSWBUUQZLZBBHT-UHFFFAOYSA-N	1	1	324.333	1.846	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000338785994	250135471	/nfs/dbraw/zinc/13/54/71/250135471.db2.gz	BSWBUUQZLZBBHT-UHFFFAOYSA-N	1	1	324.333	1.846	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000109620155	194277861	/nfs/dbraw/zinc/27/78/61/194277861.db2.gz	UPMFSWGECRFXRM-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[NH+](C3CCCCC3)CC2)c1[N+](=O)[O-]	ZINC000268999678	207155618	/nfs/dbraw/zinc/15/56/18/207155618.db2.gz	UJVPTOPOFJQHKQ-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1O	ZINC000341004211	251329716	/nfs/dbraw/zinc/32/97/16/251329716.db2.gz	AMLIPNGNJFPAGQ-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1O	ZINC000341004211	251329718	/nfs/dbraw/zinc/32/97/18/251329718.db2.gz	AMLIPNGNJFPAGQ-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1[nH]ncc1[N+](=O)[O-])Cc1ccccc1	ZINC000159170416	197333246	/nfs/dbraw/zinc/33/32/46/197333246.db2.gz	VHLVJAIBXNFLII-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[N@H+](CCCNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccccc1	ZINC000159170416	197333248	/nfs/dbraw/zinc/33/32/48/197333248.db2.gz	VHLVJAIBXNFLII-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccccc1	ZINC000159170416	197333250	/nfs/dbraw/zinc/33/32/50/197333250.db2.gz	VHLVJAIBXNFLII-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000154925230	197005944	/nfs/dbraw/zinc/00/59/44/197005944.db2.gz	IYGCODNEPSMXDP-NSHDSACASA-N	1	1	323.397	1.948	20	5		DDBDMO
CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000154925230	197005946	/nfs/dbraw/zinc/00/59/46/197005946.db2.gz	IYGCODNEPSMXDP-NSHDSACASA-N	1	1	323.397	1.948	20	5		DDBDMO
CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000154925230	197005948	/nfs/dbraw/zinc/00/59/48/197005948.db2.gz	IYGCODNEPSMXDP-NSHDSACASA-N	1	1	323.397	1.948	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCC1(F)F	ZINC000289664187	221138375	/nfs/dbraw/zinc/13/83/75/221138375.db2.gz	FNCAMXUEVXLLEI-JTQLQIEISA-N	1	1	301.293	1.734	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000568646885	304303991	/nfs/dbraw/zinc/30/39/91/304303991.db2.gz	KZWVLHYPJSESNW-LBPRGKRZSA-N	1	1	305.338	1.166	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000026918304	406906641	/nfs/dbraw/zinc/90/66/41/406906641.db2.gz	APJMGUJXNYBSGH-UHFFFAOYSA-N	1	1	304.262	1.467	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000076345441	406964096	/nfs/dbraw/zinc/96/40/96/406964096.db2.gz	NMZBZPAPDWCOTL-DZGCQCFKSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000077368709	406986266	/nfs/dbraw/zinc/98/62/66/406986266.db2.gz	UJCROWLDZBLADJ-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000077368709	406986269	/nfs/dbraw/zinc/98/62/69/406986269.db2.gz	UJCROWLDZBLADJ-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000053403975	407168675	/nfs/dbraw/zinc/16/86/75/407168675.db2.gz	UYKFXYZSVLTIPU-GFCCVEGCSA-N	1	1	323.397	1.418	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000124500761	407359979	/nfs/dbraw/zinc/35/99/79/407359979.db2.gz	YZFCDLXBUMBENU-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCOC1	ZINC000106884149	407364748	/nfs/dbraw/zinc/36/47/48/407364748.db2.gz	PJUANTUIJQVJGO-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000124773090	407369469	/nfs/dbraw/zinc/36/94/69/407369469.db2.gz	CBPKZDJZEXYWCN-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000124773090	407369471	/nfs/dbraw/zinc/36/94/71/407369471.db2.gz	CBPKZDJZEXYWCN-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)c1ccco1	ZINC000124806252	407370159	/nfs/dbraw/zinc/37/01/59/407370159.db2.gz	OSWSKHMMASNORW-LLVKDONJSA-N	1	1	320.305	1.321	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000125223884	407382010	/nfs/dbraw/zinc/38/20/10/407382010.db2.gz	IUDPJRCCILMRBC-UONOGXRCSA-N	1	1	319.409	1.960	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000111268394	407404337	/nfs/dbraw/zinc/40/43/37/407404337.db2.gz	SRIISTRUSFWPRN-LLVKDONJSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@@H](C[S@](C)=O)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000126468918	407413771	/nfs/dbraw/zinc/41/37/71/407413771.db2.gz	LLGLWCJQYKMWLV-PRWKNARSSA-N	1	1	300.380	1.672	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000185820226	407510648	/nfs/dbraw/zinc/51/06/48/407510648.db2.gz	QTDXWVQKRDJVPU-WPRPVWTQSA-N	1	1	306.322	1.050	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000170809393	407511834	/nfs/dbraw/zinc/51/18/34/407511834.db2.gz	SQYLJKVUPSKUAM-GFCCVEGCSA-N	1	1	322.365	1.139	20	5		DDBDMO
C[NH+](C)C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000114148407	407545165	/nfs/dbraw/zinc/54/51/65/407545165.db2.gz	ITIASNJQADYCOP-JTQLQIEISA-N	1	1	317.349	1.495	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](CCCN1CCOCC1)C2	ZINC000153121131	407760057	/nfs/dbraw/zinc/76/00/57/407760057.db2.gz	DMPYUVGQQSPXON-UHFFFAOYSA-N	1	1	305.378	1.675	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@@H+](C)C2CCCC2)c1[N+](=O)[O-]	ZINC000171809881	407771894	/nfs/dbraw/zinc/77/18/94/407771894.db2.gz	QTQCYLXWQRNVGB-UHFFFAOYSA-N	1	1	309.370	1.485	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000153191744	407773375	/nfs/dbraw/zinc/77/33/75/407773375.db2.gz	WWPGNGLGERCYGL-MFKMUULPSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])[C@H]2C1	ZINC000272209568	407818180	/nfs/dbraw/zinc/81/81/80/407818180.db2.gz	PXRNYWMHVZGYGQ-ZJUUUORDSA-N	1	1	307.379	1.834	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000133327244	407828989	/nfs/dbraw/zinc/82/89/89/407828989.db2.gz	BGMPYHBUFKTADF-BXUZGUMPSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000133327244	407828995	/nfs/dbraw/zinc/82/89/95/407828995.db2.gz	BGMPYHBUFKTADF-BXUZGUMPSA-N	1	1	322.365	1.113	20	5		DDBDMO
Cc1c(CC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796536	407872635	/nfs/dbraw/zinc/87/26/35/407872635.db2.gz	ZJVYPMFOOOKJHT-DOMZBBRYSA-N	1	1	321.377	1.281	20	5		DDBDMO
Cc1c(CC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796536	407872642	/nfs/dbraw/zinc/87/26/42/407872642.db2.gz	ZJVYPMFOOOKJHT-DOMZBBRYSA-N	1	1	321.377	1.281	20	5		DDBDMO
CC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H](O)C(F)(F)F	ZINC000189476139	408029690	/nfs/dbraw/zinc/02/96/90/408029690.db2.gz	BUADHIKBPRBBMN-SNVBAGLBSA-N	1	1	323.271	1.002	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H](O)C(F)(F)F	ZINC000189476139	408029697	/nfs/dbraw/zinc/02/96/97/408029697.db2.gz	BUADHIKBPRBBMN-SNVBAGLBSA-N	1	1	323.271	1.002	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(CCC)CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000154414949	408033516	/nfs/dbraw/zinc/03/35/16/408033516.db2.gz	QFHGWUZIZICPIY-UHFFFAOYSA-N	1	1	311.386	1.684	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000136171010	408085530	/nfs/dbraw/zinc/08/55/30/408085530.db2.gz	KNVDZKVPTDSYKV-CFVMTHIKSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cccs3)CC2)n1	ZINC000121370446	408193791	/nfs/dbraw/zinc/19/37/91/408193791.db2.gz	AUBNZVFRWVXDIR-UHFFFAOYSA-N	1	1	307.379	1.675	20	5		DDBDMO
C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000189897500	408132906	/nfs/dbraw/zinc/13/29/06/408132906.db2.gz	YCGGCAVWBMVKGD-ZDUSSCGKSA-N	1	1	307.394	1.872	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000175454083	408133762	/nfs/dbraw/zinc/13/37/62/408133762.db2.gz	IHLHTXDICUVUHM-UHFFFAOYSA-N	1	1	308.382	1.947	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000175729275	408189484	/nfs/dbraw/zinc/18/94/84/408189484.db2.gz	BYCCSKXKZZMPGR-BDAKNGLRSA-N	1	1	307.354	1.235	20	5		DDBDMO
C[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000150720619	408192358	/nfs/dbraw/zinc/19/23/58/408192358.db2.gz	IQBUOGWEEOHKFQ-CYBMUJFWSA-N	1	1	321.377	1.222	20	5		DDBDMO
O=C1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]2N1	ZINC000246405744	408247586	/nfs/dbraw/zinc/24/75/86/408247586.db2.gz	BTXKYAHKVXEELQ-HUUCEWRRSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@H]2N1	ZINC000246405744	408247594	/nfs/dbraw/zinc/24/75/94/408247594.db2.gz	BTXKYAHKVXEELQ-HUUCEWRRSA-N	1	1	303.362	1.880	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCC[C@H]1O	ZINC000246425176	408251680	/nfs/dbraw/zinc/25/16/80/408251680.db2.gz	IIQRPQSOFIXUDC-IVMMDQJWSA-N	1	1	324.377	1.427	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000263666831	408199165	/nfs/dbraw/zinc/19/91/65/408199165.db2.gz	LCJKLHUCUXTDBR-MNOVXSKESA-N	1	1	323.397	1.731	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000263801187	408265105	/nfs/dbraw/zinc/26/51/05/408265105.db2.gz	STCPGTSYFABXKM-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
Cc1nn(CCC(=O)NCCn2cc[nH+]c2C)c(C)c1[N+](=O)[O-]	ZINC000263712911	408220006	/nfs/dbraw/zinc/22/00/06/408220006.db2.gz	AOLJPAZLWMFYLF-UHFFFAOYSA-N	1	1	320.353	1.120	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176195745	408307403	/nfs/dbraw/zinc/30/74/03/408307403.db2.gz	QVWZSQPYKNTNCQ-UHFFFAOYSA-N	1	1	320.349	1.811	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC3(C2)CCCCC3)c1	ZINC000173803693	162366461	/nfs/dbraw/zinc/36/64/61/162366461.db2.gz	BUUVMMPNHJUKBP-AWEZNQCLSA-N	1	1	308.382	1.808	20	5		DDBDMO
C[N@@H+](CCNC(=O)Nc1ccncc1[N+](=O)[O-])C1CCCC1	ZINC000183582940	408447245	/nfs/dbraw/zinc/44/72/45/408447245.db2.gz	FMZUZWLLAWCHDY-UHFFFAOYSA-N	1	1	307.354	1.986	20	5		DDBDMO
Cc1c([C@@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cnn1C	ZINC000183364837	408391074	/nfs/dbraw/zinc/39/10/74/408391074.db2.gz	DGMNLZZLNSFPHB-SECBINFHSA-N	1	1	317.349	1.586	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000183569953	408441851	/nfs/dbraw/zinc/44/18/51/408441851.db2.gz	GLEJFVNLDVQJMQ-UHFFFAOYSA-N	1	1	311.342	1.080	20	5		DDBDMO
Cc1cc(NC(=O)NC[C@@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000274861409	408557589	/nfs/dbraw/zinc/55/75/89/408557589.db2.gz	ZDQBSRZCUHXKPS-CYBMUJFWSA-N	1	1	321.381	1.271	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248457080	408572157	/nfs/dbraw/zinc/57/21/57/408572157.db2.gz	MCVMPSLBXVRTED-FRRDWIJNSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248457080	408572161	/nfs/dbraw/zinc/57/21/61/408572161.db2.gz	MCVMPSLBXVRTED-FRRDWIJNSA-N	1	1	310.350	1.444	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000160874135	408534428	/nfs/dbraw/zinc/53/44/28/408534428.db2.gz	AOMQAEYXTOARRG-RKDXNWHRSA-N	1	1	303.322	1.471	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000270763342	408671600	/nfs/dbraw/zinc/67/16/00/408671600.db2.gz	NHDQNSUDHZQBON-LLVKDONJSA-N	1	1	323.397	1.569	20	5		DDBDMO
CCC[C@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@@H+]1CCOC	ZINC000192517584	408603931	/nfs/dbraw/zinc/60/39/31/408603931.db2.gz	QTVJZQOVWAHUQW-NSHDSACASA-N	1	1	314.411	1.988	20	5		DDBDMO
CCC[C@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@H+]1CCOC	ZINC000192517584	408603935	/nfs/dbraw/zinc/60/39/35/408603935.db2.gz	QTVJZQOVWAHUQW-NSHDSACASA-N	1	1	314.411	1.988	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1C1CC1	ZINC000184486878	408627467	/nfs/dbraw/zinc/62/74/67/408627467.db2.gz	NHFFPKODVWPKTA-UWVGGRQHSA-N	1	1	304.350	1.532	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000161979143	408657902	/nfs/dbraw/zinc/65/79/02/408657902.db2.gz	UEKXWSFNNVYELS-CYBMUJFWSA-N	1	1	323.397	1.562	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+](CCO)C2CCC2)c2c(c1)COCO2	ZINC000275912896	408716204	/nfs/dbraw/zinc/71/62/04/408716204.db2.gz	XPSXLRDRRMELEG-UHFFFAOYSA-N	1	1	308.334	1.808	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1O	ZINC000270839071	408702489	/nfs/dbraw/zinc/70/24/89/408702489.db2.gz	DUBCZFTUOQZMBS-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCCC[C@H]2CCO)c1	ZINC000250046720	408774047	/nfs/dbraw/zinc/77/40/47/408774047.db2.gz	CXIGFPVFGCSJGP-DZGCQCFKSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000250945557	408779687	/nfs/dbraw/zinc/77/96/87/408779687.db2.gz	BPBNUZPXEYORQG-KBPBESRZSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000285746211	408855544	/nfs/dbraw/zinc/85/55/44/408855544.db2.gz	HJXCSRZJABAVCB-MNOVXSKESA-N	1	1	321.381	1.701	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000285780973	408863167	/nfs/dbraw/zinc/86/31/67/408863167.db2.gz	NAVAKFBQSMKVFV-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCC(F)(F)[C@H](CO)C2)cc1	ZINC000291624209	408896342	/nfs/dbraw/zinc/89/63/42/408896342.db2.gz	CWUHZYBOZLTKIO-NSHDSACASA-N	1	1	316.304	1.923	20	5		DDBDMO
COCC(C)(C)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000292116370	408983367	/nfs/dbraw/zinc/98/33/67/408983367.db2.gz	JPVPSYGKEPTJSF-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000292116370	408983369	/nfs/dbraw/zinc/98/33/69/408983369.db2.gz	JPVPSYGKEPTJSF-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC[N@@H+](CCOCCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000282187780	409006758	/nfs/dbraw/zinc/00/67/58/409006758.db2.gz	WJJHPSNWODJGFE-UHFFFAOYSA-N	1	1	309.322	1.567	20	5		DDBDMO
O=C(CC[N@@H+]1CCCC[C@H]1CO)Nc1ccccc1[N+](=O)[O-]	ZINC000282193603	409008412	/nfs/dbraw/zinc/00/84/12/409008412.db2.gz	BQTMJDQOCNJXHS-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]([NH2+]CCCN1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293248254	409074860	/nfs/dbraw/zinc/07/48/60/409074860.db2.gz	BKFAUHWOPHATJM-ZDUSSCGKSA-N	1	1	321.425	1.465	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ncccc1[N+](=O)[O-]	ZINC000278811811	409093009	/nfs/dbraw/zinc/09/30/09/409093009.db2.gz	OPSCMGPOXAVDLG-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283219419	409113863	/nfs/dbraw/zinc/11/38/63/409113863.db2.gz	SESKLKPGKOQQLF-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1COC[C@H]1O	ZINC000293485405	409122798	/nfs/dbraw/zinc/12/27/98/409122798.db2.gz	GDTHDUPFQOHNEI-VXGBXAGGSA-N	1	1	320.267	1.805	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1COC[C@H]1O	ZINC000293485405	409122800	/nfs/dbraw/zinc/12/28/00/409122800.db2.gz	GDTHDUPFQOHNEI-VXGBXAGGSA-N	1	1	320.267	1.805	20	5		DDBDMO
Cc1cc(N(C)CCC[N@H+](C)CCN(C)C)ncc1[N+](=O)[O-]	ZINC000289214387	409234364	/nfs/dbraw/zinc/23/43/64/409234364.db2.gz	YQXSFDQUSPLJON-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1cc(N(C)CCCN(C)CC[NH+](C)C)ncc1[N+](=O)[O-]	ZINC000289214387	409234366	/nfs/dbraw/zinc/23/43/66/409234366.db2.gz	YQXSFDQUSPLJON-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCN2CCO[C@H]1C2	ZINC000295099030	409319708	/nfs/dbraw/zinc/31/97/08/409319708.db2.gz	KDAAVTVPAJMUMW-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
Cc1sc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000295240933	409394103	/nfs/dbraw/zinc/39/41/03/409394103.db2.gz	PCNFOQOTHCRVEJ-LBPRGKRZSA-N	1	1	301.343	1.738	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1	ZINC000280536478	409347077	/nfs/dbraw/zinc/34/70/77/409347077.db2.gz	PINDOXLJMZUDAN-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1	ZINC000280536478	409347083	/nfs/dbraw/zinc/34/70/83/409347083.db2.gz	PINDOXLJMZUDAN-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1CN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC[N@H+](C2CC2)C1	ZINC000295268648	409406973	/nfs/dbraw/zinc/40/69/73/409406973.db2.gz	GQWAHMGUYWWICI-GFCCVEGCSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCN2CCO[C@H]1C2	ZINC000295281812	409412370	/nfs/dbraw/zinc/41/23/70/409412370.db2.gz	DACTUVICCOTKAH-GJZGRUSLSA-N	1	1	309.341	1.639	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280750015	409436265	/nfs/dbraw/zinc/43/62/65/409436265.db2.gz	NFEPVVZUZCMBAC-BMIGLBTASA-N	1	1	320.349	1.119	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2cccnc2)cc1	ZINC000342349227	164083886	/nfs/dbraw/zinc/08/38/86/164083886.db2.gz	WMDABBKHCITJJI-UHFFFAOYSA-N	1	1	321.358	1.553	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000408182340	164253684	/nfs/dbraw/zinc/25/36/84/164253684.db2.gz	JJSXAAJFPIDZKI-VXGBXAGGSA-N	1	1	306.366	1.632	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000303047225	409530261	/nfs/dbraw/zinc/53/02/61/409530261.db2.gz	WXFJIQWSDCGWCJ-VXGBXAGGSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000303047225	409530271	/nfs/dbraw/zinc/53/02/71/409530271.db2.gz	WXFJIQWSDCGWCJ-VXGBXAGGSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000297145229	409824130	/nfs/dbraw/zinc/82/41/30/409824130.db2.gz	RCCGTVRSJASVEK-UHFFFAOYSA-N	1	1	316.317	1.390	20	5		DDBDMO
CCOC(=O)CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000342717943	409841709	/nfs/dbraw/zinc/84/17/09/409841709.db2.gz	DWZMWYDIWBSMDC-GFCCVEGCSA-N	1	1	322.365	1.819	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000332028732	409818872	/nfs/dbraw/zinc/81/88/72/409818872.db2.gz	HUPLBMUBCXJNJY-GJZGRUSLSA-N	1	1	303.362	1.880	20	5		DDBDMO
CNc1ccc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000317348115	409867286	/nfs/dbraw/zinc/86/72/86/409867286.db2.gz	DUGCRXKJKYENGM-GFCCVEGCSA-N	1	1	306.366	1.803	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)C1	ZINC000346229194	409871173	/nfs/dbraw/zinc/87/11/73/409871173.db2.gz	ROXQSCVDGWXFEA-SDDRHHMPSA-N	1	1	307.350	1.990	20	5		DDBDMO
O=C(CN1CC[C@H]2C[NH2+]C[C@H]2CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000324104444	409924042	/nfs/dbraw/zinc/92/40/42/409924042.db2.gz	CZIJQSNCNPJHSY-BETUJISGSA-N	1	1	318.377	1.465	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000332238076	410003873	/nfs/dbraw/zinc/00/38/73/410003873.db2.gz	HQWZMQHBXGCXIT-CHWSQXEVSA-N	1	1	319.361	1.960	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H](C)C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC000357547950	410096130	/nfs/dbraw/zinc/09/61/30/410096130.db2.gz	NRVRHVRJVRESIW-JTQLQIEISA-N	1	1	310.354	1.917	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CO)C1	ZINC000298650405	410331029	/nfs/dbraw/zinc/33/10/29/410331029.db2.gz	YBKBZFDMGJWLAV-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CO)C1	ZINC000298650405	410331037	/nfs/dbraw/zinc/33/10/37/410331037.db2.gz	YBKBZFDMGJWLAV-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCCOC1	ZINC000352213518	410550716	/nfs/dbraw/zinc/55/07/16/410550716.db2.gz	VLDKBLMWHVLCCR-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCCOC1	ZINC000352213518	410550720	/nfs/dbraw/zinc/55/07/20/410550720.db2.gz	VLDKBLMWHVLCCR-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
COc1c(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000355639642	410622560	/nfs/dbraw/zinc/62/25/60/410622560.db2.gz	ZGEHRGSFXXCANR-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000301507760	410732232	/nfs/dbraw/zinc/73/22/32/410732232.db2.gz	HMLKTWVJQWVXJL-OLZOCXBDSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC(C)[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761720	410678556	/nfs/dbraw/zinc/67/85/56/410678556.db2.gz	SVXYYAOUBPXEOD-BBRMVZONSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761720	410678562	/nfs/dbraw/zinc/67/85/62/410678562.db2.gz	SVXYYAOUBPXEOD-BBRMVZONSA-N	1	1	324.377	1.691	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000330602656	410816755	/nfs/dbraw/zinc/81/67/55/410816755.db2.gz	WUJUJFGIEFRVGN-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])c4cccnc43)C[C@H]21	ZINC000301692304	410772335	/nfs/dbraw/zinc/77/23/35/410772335.db2.gz	ZDGNQSLMJRHHPY-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000330602656	410816760	/nfs/dbraw/zinc/81/67/60/410816760.db2.gz	WUJUJFGIEFRVGN-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(N2C[C@H]3OCC[N@@H+](C)[C@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000301943195	410832961	/nfs/dbraw/zinc/83/29/61/410832961.db2.gz	XYMNQXUWVUXUFE-GXTWGEPZSA-N	1	1	311.313	1.262	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C[C@@H]1C	ZINC000330677818	410869685	/nfs/dbraw/zinc/86/96/85/410869685.db2.gz	VSIMBSWOWKIZSH-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000341149655	410896251	/nfs/dbraw/zinc/89/62/51/410896251.db2.gz	UIZGBRUZJXSNFZ-LLVKDONJSA-N	1	1	306.370	2.170	20	5		DDBDMO
COc1ccc([C@H](CCO)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1	ZINC000341229085	410953772	/nfs/dbraw/zinc/95/37/72/410953772.db2.gz	OIZKZJSQXCNCGB-ZDUSSCGKSA-N	1	1	320.349	1.550	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(O)CCC1	ZINC000353474767	411012997	/nfs/dbraw/zinc/01/29/97/411012997.db2.gz	WIYNFRRKQXMRKW-CYBMUJFWSA-N	1	1	310.350	1.181	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000360137189	411068077	/nfs/dbraw/zinc/06/80/77/411068077.db2.gz	YQXJKAZAERFWMC-LBPRGKRZSA-N	1	1	323.349	1.514	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CC[C@@H](CO)C1	ZINC000348568596	411021370	/nfs/dbraw/zinc/02/13/70/411021370.db2.gz	CDHHQECVRZDVKG-LLVKDONJSA-N	1	1	321.333	1.207	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000331216887	411022190	/nfs/dbraw/zinc/02/21/90/411022190.db2.gz	PVNYOXLRRUJJDD-VHSXEESVSA-N	1	1	309.370	1.654	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+](C)C2CC(O)C2)cccc1[N+](=O)[O-]	ZINC000353497802	411030871	/nfs/dbraw/zinc/03/08/71/411030871.db2.gz	SYHOGUYNNFSQAX-VOMCLLRMSA-N	1	1	307.350	1.685	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C2CC(O)C2)cccc1[N+](=O)[O-]	ZINC000353497802	411030877	/nfs/dbraw/zinc/03/08/77/411030877.db2.gz	SYHOGUYNNFSQAX-VOMCLLRMSA-N	1	1	307.350	1.685	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000339321899	306735822	/nfs/dbraw/zinc/73/58/22/306735822.db2.gz	RKRPNULOVPSKQG-MELADBBJSA-N	1	1	324.377	1.752	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000361075670	418578085	/nfs/dbraw/zinc/57/80/85/418578085.db2.gz	CQBZEACTWVTGIC-WDEREUQCSA-N	1	1	306.366	1.849	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1	ZINC000375011467	418587617	/nfs/dbraw/zinc/58/76/17/418587617.db2.gz	FZGIKRQOISLMBE-UONOGXRCSA-N	1	1	308.382	1.930	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)[C@@H]2CCO[C@H]2C)cc1[N+](=O)[O-]	ZINC000361563859	418678827	/nfs/dbraw/zinc/67/88/27/418678827.db2.gz	LMIMPQYUSNQCTM-WCQYABFASA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](CO)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000361662032	418697364	/nfs/dbraw/zinc/69/73/64/418697364.db2.gz	PFSWXKMPMJJOFV-ZYHUDNBSSA-N	1	1	310.350	1.672	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000361707609	418699810	/nfs/dbraw/zinc/69/98/10/418699810.db2.gz	WMAVSOZLDNEYQR-NWDGAFQWSA-N	1	1	306.366	1.490	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](C[C@H]2CCOC2)C1	ZINC000371446958	418791958	/nfs/dbraw/zinc/79/19/58/418791958.db2.gz	IENKFCGEZMSPCE-CHWSQXEVSA-N	1	1	308.382	1.967	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000364924584	418822941	/nfs/dbraw/zinc/82/29/41/418822941.db2.gz	AXJYWWQSPNTYKW-CFVMTHIKSA-N	1	1	303.362	1.723	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCO[C@H]2CCC[C@@H]21	ZINC000372352673	418860478	/nfs/dbraw/zinc/86/04/78/418860478.db2.gz	ZYEKAFWAMKQYQB-KBPBESRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)C[C@H]1CCC[N@H+]1C	ZINC000421009411	419445771	/nfs/dbraw/zinc/44/57/71/419445771.db2.gz	QAXQJPDJGVWYRK-IUODEOHRSA-N	1	1	320.393	1.948	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000411960195	419521531	/nfs/dbraw/zinc/52/15/31/419521531.db2.gz	WDWPQENLZYTWEA-SNVBAGLBSA-N	1	1	317.349	1.381	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000411960195	419521540	/nfs/dbraw/zinc/52/15/40/419521540.db2.gz	WDWPQENLZYTWEA-SNVBAGLBSA-N	1	1	317.349	1.381	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)Nc2cc[nH+]c(N(C)C)c2)n1	ZINC000427368741	419645899	/nfs/dbraw/zinc/64/58/99/419645899.db2.gz	ZDFUVBNGXPESAM-UHFFFAOYSA-N	1	1	304.310	1.525	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC000427708105	419718420	/nfs/dbraw/zinc/71/84/20/419718420.db2.gz	WBYBKPDREIAPCB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000427708105	419718428	/nfs/dbraw/zinc/71/84/28/419718428.db2.gz	WBYBKPDREIAPCB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@@H+]1CCO	ZINC000416298474	420316031	/nfs/dbraw/zinc/31/60/31/420316031.db2.gz	QXAOPILEGCUHOQ-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000416298474	420316034	/nfs/dbraw/zinc/31/60/34/420316034.db2.gz	QXAOPILEGCUHOQ-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1NCC[NH+]1CCSCC1	ZINC000420593367	420325211	/nfs/dbraw/zinc/32/52/11/420325211.db2.gz	BQQMPEYJGPFCAA-UHFFFAOYSA-N	1	1	310.379	1.154	20	5		DDBDMO
CCCNC(=O)C1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CCCCC1	ZINC000440390676	420572681	/nfs/dbraw/zinc/57/26/81/420572681.db2.gz	ZKYZAKJOCDRJEG-UHFFFAOYSA-N	1	1	323.397	1.647	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000454193273	420813476	/nfs/dbraw/zinc/81/34/76/420813476.db2.gz	CWAVEDHXUFVNSU-LLVKDONJSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000454193273	420813478	/nfs/dbraw/zinc/81/34/78/420813478.db2.gz	CWAVEDHXUFVNSU-LLVKDONJSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCCC1	ZINC000449093011	420948068	/nfs/dbraw/zinc/94/80/68/420948068.db2.gz	NUYUDQLDHRTGPJ-HIFRSBDPSA-N	1	1	307.394	1.572	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])NC[C@H](O)C[NH+]1CCCC1	ZINC000449093011	420948071	/nfs/dbraw/zinc/94/80/71/420948071.db2.gz	NUYUDQLDHRTGPJ-HIFRSBDPSA-N	1	1	307.394	1.572	20	5		DDBDMO
CNc1nc(C(=O)N2CCC[N@H+](C(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000455387245	421005360	/nfs/dbraw/zinc/00/53/60/421005360.db2.gz	IHUIRKKCGMKGJH-UHFFFAOYSA-N	1	1	321.381	1.588	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CO)[C@H]1C	ZINC000488767290	421114909	/nfs/dbraw/zinc/11/49/09/421114909.db2.gz	VTVTVGZCRIXWSI-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CO)[C@H]1C	ZINC000488767290	421114913	/nfs/dbraw/zinc/11/49/13/421114913.db2.gz	VTVTVGZCRIXWSI-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000489333272	421146875	/nfs/dbraw/zinc/14/68/75/421146875.db2.gz	GHHHQAAQLOGCRE-CYBMUJFWSA-N	1	1	324.356	1.728	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000525805300	421302571	/nfs/dbraw/zinc/30/25/71/421302571.db2.gz	KFCSYMZHRNAVHR-JTQLQIEISA-N	1	1	321.333	1.395	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1	ZINC000548058508	421394945	/nfs/dbraw/zinc/39/49/45/421394945.db2.gz	RIADYHQBPWQEQU-QWRGUYRKSA-N	1	1	321.381	1.422	20	5		DDBDMO
Cn1nccc1[C@@H](CO)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000514873870	421463344	/nfs/dbraw/zinc/46/33/44/421463344.db2.gz	YYGNUXSJHKYICJ-QWHCGFSZSA-N	1	1	302.334	1.639	20	5		DDBDMO
CC1(C)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000570474794	421646932	/nfs/dbraw/zinc/64/69/32/421646932.db2.gz	BTTQFYAGXNHYES-AWEZNQCLSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC1(C)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000570474794	421646935	/nfs/dbraw/zinc/64/69/35/421646935.db2.gz	BTTQFYAGXNHYES-AWEZNQCLSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=C1NCC[C@H]1CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000571893062	421750068	/nfs/dbraw/zinc/75/00/68/421750068.db2.gz	NQFDDMQGMSTPKE-NSHDSACASA-N	1	1	305.334	1.315	20	5		DDBDMO
O=C1NCC[C@H]1CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000571893062	421750071	/nfs/dbraw/zinc/75/00/71/421750071.db2.gz	NQFDDMQGMSTPKE-NSHDSACASA-N	1	1	305.334	1.315	20	5		DDBDMO
COc1ccc(CC(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000540542772	421766091	/nfs/dbraw/zinc/76/60/91/421766091.db2.gz	KLSRBHYODQDTHZ-UHFFFAOYSA-N	1	1	319.361	1.524	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000576595433	422376335	/nfs/dbraw/zinc/37/63/35/422376335.db2.gz	LBZFSGVJVDGOMG-NSHDSACASA-N	1	1	321.381	1.636	20	5		DDBDMO
C[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000577294250	422383941	/nfs/dbraw/zinc/38/39/41/422383941.db2.gz	MGMOGRLPXSVXFO-WDEREUQCSA-N	1	1	321.381	1.565	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2ccnc(NC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000603142272	422450713	/nfs/dbraw/zinc/45/07/13/422450713.db2.gz	JHXCEXLEYVBUNO-PHIMTYICSA-N	1	1	321.381	1.586	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](CCCNc2c(F)cccc2[N+](=O)[O-])C1	ZINC000342099182	271297064	/nfs/dbraw/zinc/29/70/64/271297064.db2.gz	SXEGWLUYZOLEJK-LLVKDONJSA-N	1	1	324.356	1.733	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000342221776	271345036	/nfs/dbraw/zinc/34/50/36/271345036.db2.gz	DBMDCQFEXLCDPX-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
CN1CCNC[C@@H]1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423522046	277116157	/nfs/dbraw/zinc/11/61/57/277116157.db2.gz	RENADVVNARJTTA-CJNGLKHVSA-N	1	1	318.421	1.810	20	5		DDBDMO
Cc1nc(N2CCCC[C@H]2C[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000301641299	293294600	/nfs/dbraw/zinc/29/46/00/293294600.db2.gz	GPVUYYWKAYDYLS-AWEZNQCLSA-N	1	1	320.393	1.989	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000354004236	298335903	/nfs/dbraw/zinc/33/59/03/298335903.db2.gz	AVVLAZXEDVEDSC-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c1	ZINC000368590606	301060203	/nfs/dbraw/zinc/06/02/03/301060203.db2.gz	KZNRBRWFFIZYPJ-ABAIWWIYSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019113	301119811	/nfs/dbraw/zinc/11/98/11/301119811.db2.gz	OATBYQUDBBHFCH-JQWIXIFHSA-N	1	1	307.354	1.095	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019113	301119815	/nfs/dbraw/zinc/11/98/15/301119815.db2.gz	OATBYQUDBBHFCH-JQWIXIFHSA-N	1	1	307.354	1.095	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000369353099	301170215	/nfs/dbraw/zinc/17/02/15/301170215.db2.gz	BLYCICCETVHSGG-KRWDZBQOSA-N	1	1	318.421	1.807	20	5		DDBDMO
O=C1CCCCN1[C@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000370025039	301260574	/nfs/dbraw/zinc/26/05/74/301260574.db2.gz	CFGITGFRIBQGQC-ZDUSSCGKSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000370217829	301296139	/nfs/dbraw/zinc/29/61/39/301296139.db2.gz	BQENGVXURUUPII-ARFHVFGLSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000370217829	301296143	/nfs/dbraw/zinc/29/61/43/301296143.db2.gz	BQENGVXURUUPII-ARFHVFGLSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000370217829	301296146	/nfs/dbraw/zinc/29/61/46/301296146.db2.gz	BQENGVXURUUPII-ARFHVFGLSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000377468633	302182141	/nfs/dbraw/zinc/18/21/41/302182141.db2.gz	CIDNPQDIYJATOW-KGLIPLIRSA-N	1	1	305.334	1.188	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000362254135	307015700	/nfs/dbraw/zinc/01/57/00/307015700.db2.gz	BOCBYPWNTBCYJH-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
C=Cn1cc(C[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000365336546	307065207	/nfs/dbraw/zinc/06/52/07/307065207.db2.gz	JMPIHJFSYYSYGP-CYBMUJFWSA-N	1	1	302.338	1.925	20	5		DDBDMO
C=Cn1cc(C[N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000365336546	307065208	/nfs/dbraw/zinc/06/52/08/307065208.db2.gz	JMPIHJFSYYSYGP-CYBMUJFWSA-N	1	1	302.338	1.925	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@H]([NH3+])[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368615213	307106461	/nfs/dbraw/zinc/10/64/61/307106461.db2.gz	UBACVBSOXWMGML-AXFHLTTASA-N	1	1	321.381	1.470	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@H](O)C4(CC4)C3)o2)cc1	ZINC000368799545	307110266	/nfs/dbraw/zinc/11/02/66/307110266.db2.gz	JKAZVNSYKJGBGF-LBPRGKRZSA-N	1	1	316.317	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@H](O)C4(CC4)C3)o2)cc1	ZINC000368799545	307110267	/nfs/dbraw/zinc/11/02/67/307110267.db2.gz	JKAZVNSYKJGBGF-LBPRGKRZSA-N	1	1	316.317	1.602	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CCN(c2cc[nH+]cc2)CC1	ZINC000368929737	307112925	/nfs/dbraw/zinc/11/29/25/307112925.db2.gz	IUUBTYVEHXKFDL-KGLIPLIRSA-N	1	1	304.350	1.174	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1	ZINC000372086655	307162946	/nfs/dbraw/zinc/16/29/46/307162946.db2.gz	NQSCZDULLJSWJT-LBPRGKRZSA-N	1	1	321.381	1.267	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](n2cncn2)C1	ZINC000377217217	307266422	/nfs/dbraw/zinc/26/64/22/307266422.db2.gz	XRMNYRMIIGWGKR-CYBMUJFWSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](n2cncn2)C1	ZINC000377217217	307266423	/nfs/dbraw/zinc/26/64/23/307266423.db2.gz	XRMNYRMIIGWGKR-CYBMUJFWSA-N	1	1	303.322	1.642	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CN[C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000565169270	308022809	/nfs/dbraw/zinc/02/28/09/308022809.db2.gz	GBXMZLOQTJFXNC-WFASDCNBSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@@H](O)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000565169270	308022810	/nfs/dbraw/zinc/02/28/10/308022810.db2.gz	GBXMZLOQTJFXNC-WFASDCNBSA-N	1	1	311.382	1.185	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ncccc3O)C2)nc1	ZINC000565976312	308039892	/nfs/dbraw/zinc/03/98/92/308039892.db2.gz	AWDCFFKUPHWXLH-LLVKDONJSA-N	1	1	315.333	1.777	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[NH+](C)CC1	ZINC000570164201	308161054	/nfs/dbraw/zinc/16/10/54/308161054.db2.gz	CILKVBRRBHDTGT-LLVKDONJSA-N	1	1	321.381	1.211	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+]C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000570644135	308175230	/nfs/dbraw/zinc/17/52/30/308175230.db2.gz	BCEVTRBGVIIHOO-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000576358566	308309812	/nfs/dbraw/zinc/30/98/12/308309812.db2.gz	AKJGRMXNJUFPTC-UHFFFAOYSA-N	1	1	304.306	1.295	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC[N@@H+]4CCOC[C@H]4C3)c2c1	ZINC000582713096	337123949	/nfs/dbraw/zinc/12/39/49/337123949.db2.gz	ZOVHOCBLZKMOFV-CQSZACIVSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC[N@H+]4CCOC[C@H]4C3)c2c1	ZINC000582713096	337123950	/nfs/dbraw/zinc/12/39/50/337123950.db2.gz	ZOVHOCBLZKMOFV-CQSZACIVSA-N	1	1	314.345	1.664	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000452132178	534480462	/nfs/dbraw/zinc/48/04/62/534480462.db2.gz	QKFOHUREBNHZBC-LLVKDONJSA-N	1	1	307.350	1.288	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1	ZINC000451341752	534889158	/nfs/dbraw/zinc/88/91/58/534889158.db2.gz	LQYRKOANRNAYGL-RRFJBIMHSA-N	1	1	308.382	1.807	20	5		DDBDMO
CC(C)(C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12)n1cc([N+](=O)[O-])cn1	ZINC000331663732	527530223	/nfs/dbraw/zinc/53/02/23/527530223.db2.gz	OSTXSGJXVVBHRF-OLZOCXBDSA-N	1	1	321.381	1.269	20	5		DDBDMO
CC1=CC[N@@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)CC1	ZINC000302139469	528119677	/nfs/dbraw/zinc/11/96/77/528119677.db2.gz	GBQBAHRTQKBANK-UHFFFAOYSA-N	1	1	302.338	1.701	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C[C@@H]1C	ZINC000825465067	607821746	/nfs/dbraw/zinc/82/17/46/607821746.db2.gz	HIGFCIVDFCAILP-JTQLQIEISA-N	1	1	317.353	1.305	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000821095056	606138598	/nfs/dbraw/zinc/13/85/98/606138598.db2.gz	WFXSJCRFVVRBTB-UHFFFAOYSA-N	1	1	319.369	1.919	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000821094309	606138715	/nfs/dbraw/zinc/13/87/15/606138715.db2.gz	GGBVMFKBZALNFN-UHFFFAOYSA-N	1	1	320.357	1.314	20	5		DDBDMO
CCOC(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000143129040	696869178	/nfs/dbraw/zinc/86/91/78/696869178.db2.gz	OUGAANKZPLWQBW-UHFFFAOYSA-N	1	1	307.350	1.670	20	5		DDBDMO
Nc1ccc(C(=O)OCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000748492958	700121705	/nfs/dbraw/zinc/12/17/05/700121705.db2.gz	WZHXTRZBUBZUKD-UHFFFAOYSA-N	1	1	309.322	1.056	20	5		DDBDMO
Cc1cccc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)c1	ZINC000981136674	697015229	/nfs/dbraw/zinc/01/52/29/697015229.db2.gz	DNWNZQPKCISOQH-HZPDHXFCSA-N	1	1	317.389	1.695	20	5		DDBDMO
Cc1cccc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000981136674	697015232	/nfs/dbraw/zinc/01/52/32/697015232.db2.gz	DNWNZQPKCISOQH-HZPDHXFCSA-N	1	1	317.389	1.695	20	5		DDBDMO
Cc1cccc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000981136674	697015235	/nfs/dbraw/zinc/01/52/35/697015235.db2.gz	DNWNZQPKCISOQH-HZPDHXFCSA-N	1	1	317.389	1.695	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678500	700176298	/nfs/dbraw/zinc/17/62/98/700176298.db2.gz	SRUWIYVQWAKQAH-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678500	700176299	/nfs/dbraw/zinc/17/62/99/700176299.db2.gz	SRUWIYVQWAKQAH-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000774863237	697936393	/nfs/dbraw/zinc/93/63/93/697936393.db2.gz	LWUZPEYNYVDTKR-LLVKDONJSA-N	1	1	322.321	1.733	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1CCO[C@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000775577628	698011191	/nfs/dbraw/zinc/01/11/91/698011191.db2.gz	QEKFTLUOSJBKQD-NEPJUHHUSA-N	1	1	307.350	1.493	20	5		DDBDMO
CCOCC[NH+]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776273790	698090361	/nfs/dbraw/zinc/09/03/61/698090361.db2.gz	AAUASWYTTXHUOX-MRXNPFEDSA-N	1	1	323.393	1.282	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-]	ZINC000779865021	698476316	/nfs/dbraw/zinc/47/63/16/698476316.db2.gz	KATDFXIVIBALIU-GFCCVEGCSA-N	1	1	304.354	1.355	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-]	ZINC000779865021	698476317	/nfs/dbraw/zinc/47/63/17/698476317.db2.gz	KATDFXIVIBALIU-GFCCVEGCSA-N	1	1	304.354	1.355	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000783918168	698892656	/nfs/dbraw/zinc/89/26/56/698892656.db2.gz	DVGNYPLWAOJAQA-SNVBAGLBSA-N	1	1	309.370	1.655	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000783918166	698892735	/nfs/dbraw/zinc/89/27/35/698892735.db2.gz	DVGNYPLWAOJAQA-JTQLQIEISA-N	1	1	309.370	1.655	20	5		DDBDMO
CS(=O)(=O)[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000714243907	699269731	/nfs/dbraw/zinc/26/97/31/699269731.db2.gz	POCZSHMBTRAQQZ-XYPYZODXSA-N	1	1	318.782	1.913	20	5		DDBDMO
C[C@H]([NH2+]Cc1cc(C(N)=O)co1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788762523	699337981	/nfs/dbraw/zinc/33/79/81/699337981.db2.gz	HCRNRIOETZDGSD-QMMMGPOBSA-N	1	1	304.306	1.720	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000731455912	699529166	/nfs/dbraw/zinc/52/91/66/699529166.db2.gz	XGRXQMVBAAUZTA-TZMCWYRMSA-N	1	1	323.324	1.327	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+](CC[N+](=O)[O-])C1)Nc1cccc(F)c1	ZINC000791055284	699609257	/nfs/dbraw/zinc/60/92/57/699609257.db2.gz	RHVLJIFRZAPHGS-GFCCVEGCSA-N	1	1	324.356	1.936	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCCCO)CC2)c([N+](=O)[O-])c1	ZINC000741750682	699850438	/nfs/dbraw/zinc/85/04/38/699850438.db2.gz	XIDFKSCTGCIEME-UHFFFAOYSA-N	1	1	324.337	1.398	20	5		DDBDMO
Cc1c[nH+]ccc1NS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000759487547	700754421	/nfs/dbraw/zinc/75/44/21/700754421.db2.gz	RGOHAMJZBCQSNC-UHFFFAOYSA-N	1	1	307.331	1.662	20	5		DDBDMO
C/C(=C\C(=O)NC[C@@]1(O)CC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000762721749	700904893	/nfs/dbraw/zinc/90/48/93/700904893.db2.gz	NKJAXMPIXPXARU-YHVDPYDOSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845777	701140911	/nfs/dbraw/zinc/14/09/11/701140911.db2.gz	YKKIIYRLIWBMAT-REWMRKHYSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845777	701140914	/nfs/dbraw/zinc/14/09/14/701140914.db2.gz	YKKIIYRLIWBMAT-REWMRKHYSA-N	1	1	300.380	1.327	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000771865793	701334798	/nfs/dbraw/zinc/33/47/98/701334798.db2.gz	PHXBEIMWOBBBRW-UHFFFAOYSA-N	1	1	305.290	1.722	20	5		DDBDMO
C[C@H]([NH2+]C(C)(C)CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccccc1	ZINC000839648738	701765977	/nfs/dbraw/zinc/76/59/77/701765977.db2.gz	RASSYBGZPSUVGH-IACUBPJLSA-N	1	1	305.378	1.897	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000866073872	706611212	/nfs/dbraw/zinc/61/12/12/706611212.db2.gz	UVXIRYYAJSZOAI-PWSUYJOCSA-N	1	1	309.341	1.875	20	5		DDBDMO
CC(C)(C(=O)O[C@H]1CC[N@H+]2CCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000810839511	701859451	/nfs/dbraw/zinc/85/94/51/701859451.db2.gz	BSOLGBGUNNNJDT-AAEUAGOBSA-N	1	1	322.365	1.696	20	5		DDBDMO
C[C@@H]1CC[N@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982278	701889962	/nfs/dbraw/zinc/88/99/62/701889962.db2.gz	CDAARUKHQXQVKT-ABAIWWIYSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982278	701889966	/nfs/dbraw/zinc/88/99/66/701889966.db2.gz	CDAARUKHQXQVKT-ABAIWWIYSA-N	1	1	305.334	1.831	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H](CO)[C@H]2CO)cc1	ZINC000879362335	706661415	/nfs/dbraw/zinc/66/14/15/706661415.db2.gz	WCHAWJUTKZOFBA-XJKSGUPXSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000843120796	702823915	/nfs/dbraw/zinc/82/39/15/702823915.db2.gz	CVDHYRHUPSMAMV-IMMZDGJCSA-N	1	1	316.405	1.588	20	5		DDBDMO
C[C@]1(C[NH3+])CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843381313	702870544	/nfs/dbraw/zinc/87/05/44/702870544.db2.gz	COWGVPXZSHIONC-OAHLLOKOSA-N	1	1	324.356	1.733	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)c1[N+](=O)[O-]	ZINC000843488045	702891568	/nfs/dbraw/zinc/89/15/68/702891568.db2.gz	WLUNOSIOCVDWRN-CQSZACIVSA-N	1	1	313.304	1.816	20	5		DDBDMO
CCCN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000843987273	702949386	/nfs/dbraw/zinc/94/93/86/702949386.db2.gz	DLDPBLSKNZATNL-HUUCEWRRSA-N	1	1	321.377	1.571	20	5		DDBDMO
CON(C)C(=O)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831539498	706727927	/nfs/dbraw/zinc/72/79/27/706727927.db2.gz	SIWUMORMCLKVJY-CYBMUJFWSA-N	1	1	307.350	1.794	20	5		DDBDMO
CON(C)C(=O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831539498	706727928	/nfs/dbraw/zinc/72/79/28/706727928.db2.gz	SIWUMORMCLKVJY-CYBMUJFWSA-N	1	1	307.350	1.794	20	5		DDBDMO
C[N@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H]1CCOC1	ZINC000848478685	703555077	/nfs/dbraw/zinc/55/50/77/703555077.db2.gz	QURMULKENIFCHM-CABCVRRESA-N	1	1	319.361	1.589	20	5		DDBDMO
C[N@@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H]1CCOC1	ZINC000848478685	703555078	/nfs/dbraw/zinc/55/50/78/703555078.db2.gz	QURMULKENIFCHM-CABCVRRESA-N	1	1	319.361	1.589	20	5		DDBDMO
COC/C=C/C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000870377092	704014772	/nfs/dbraw/zinc/01/47/72/704014772.db2.gz	GWKXIWXANVUAEG-VFQAQYNWSA-N	1	1	320.345	1.915	20	5		DDBDMO
COC/C=C/C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000870377092	704014774	/nfs/dbraw/zinc/01/47/74/704014774.db2.gz	GWKXIWXANVUAEG-VFQAQYNWSA-N	1	1	320.345	1.915	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1F	ZINC000852708128	704103243	/nfs/dbraw/zinc/10/32/43/704103243.db2.gz	RJDMDSLDLQJSJW-CQSZACIVSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+][C@H]1CCn2ccnc21	ZINC000819337785	704109511	/nfs/dbraw/zinc/10/95/11/704109511.db2.gz	PHCQPLBIQNUYBF-NEPJUHHUSA-N	1	1	318.333	1.266	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCc3cc(F)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000820264838	704248762	/nfs/dbraw/zinc/24/87/62/704248762.db2.gz	SNGZPRRJUHAGET-DOMZBBRYSA-N	1	1	321.352	1.829	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(N2CC(C[NH+]3CCOCC3)C2)c(F)c1	ZINC000820591256	704306502	/nfs/dbraw/zinc/30/65/02/704306502.db2.gz	GKSNZSPCSCNAPH-UHFFFAOYSA-N	1	1	313.304	1.641	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000874822359	705181382	/nfs/dbraw/zinc/18/13/82/705181382.db2.gz	ARBBDDZLZGIVMT-KBPBESRZSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000874834285	705191082	/nfs/dbraw/zinc/19/10/82/705191082.db2.gz	QUSLQUKNTWVUOJ-QWRGUYRKSA-N	1	1	306.322	1.004	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000874840448	705195497	/nfs/dbraw/zinc/19/54/97/705195497.db2.gz	OBJVCMICRZAPKI-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000823926513	705340359	/nfs/dbraw/zinc/34/03/59/705340359.db2.gz	ABQFDOVWGGQBNN-IINYFYTJSA-N	1	1	319.365	1.735	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000823997710	705351598	/nfs/dbraw/zinc/35/15/98/705351598.db2.gz	GRPSLLPCRJZRMQ-UHFFFAOYSA-N	1	1	307.354	1.737	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825777199	705729759	/nfs/dbraw/zinc/72/97/59/705729759.db2.gz	RFSZPCQOXBVXDG-RISCZKNCSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827346626	705982366	/nfs/dbraw/zinc/98/23/66/705982366.db2.gz	PSBOFNCFIKVFKU-WFASDCNBSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000864963738	706314062	/nfs/dbraw/zinc/31/40/62/706314062.db2.gz	YMRGIHMPTXOJCM-NSHDSACASA-N	1	1	321.352	1.877	20	5		DDBDMO
CC(C)[C@@H](O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000878251193	706339009	/nfs/dbraw/zinc/33/90/09/706339009.db2.gz	HPDSOKAPRYAFNY-JSGCOSHPSA-N	1	1	308.382	1.883	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000830112626	706457061	/nfs/dbraw/zinc/45/70/61/706457061.db2.gz	UIILPSNCEFOTFC-GXFFZTMASA-N	1	1	309.341	1.875	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(N[C@H]2CCn3cc[nH+]c3C2)cc1F	ZINC000865688549	706497691	/nfs/dbraw/zinc/49/76/91/706497691.db2.gz	GNZIFZDWCVJUIQ-JTQLQIEISA-N	1	1	306.297	1.850	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(NCC[N@H+]2CCCOCC2)cc1F	ZINC000865711879	706503470	/nfs/dbraw/zinc/50/34/70/706503470.db2.gz	QAVQPSFVPHFHOO-UHFFFAOYSA-N	1	1	313.329	1.360	20	5		DDBDMO
Cn1nnnc1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000879916089	706818124	/nfs/dbraw/zinc/81/81/24/706818124.db2.gz	HKTMAPLWMODTMD-UHFFFAOYSA-N	1	1	320.328	1.637	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000882486134	707657120	/nfs/dbraw/zinc/65/71/20/707657120.db2.gz	ZHQWWFOHLHOBCH-CQSZACIVSA-N	1	1	316.361	1.760	20	5		DDBDMO
Cc1cc(NCC[N@H+](C)CCOCCO)c([N+](=O)[O-])s1	ZINC000882950853	707866994	/nfs/dbraw/zinc/86/69/94/707866994.db2.gz	CWLHQBOCHGASNW-UHFFFAOYSA-N	1	1	303.384	1.317	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000882961267	707874357	/nfs/dbraw/zinc/87/43/57/707874357.db2.gz	JPTJIVQCRWTBJW-ZDUSSCGKSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1OC	ZINC000883167698	707945700	/nfs/dbraw/zinc/94/57/00/707945700.db2.gz	FPMWESZPAHYUEF-ZDUSSCGKSA-N	1	1	322.365	1.497	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1	ZINC000838908551	708001454	/nfs/dbraw/zinc/00/14/54/708001454.db2.gz	GBXKZIFSAVELBC-OKILXGFUSA-N	1	1	320.345	1.923	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+](CCO)CCOCCO)ccc1Cl	ZINC000839194291	708034781	/nfs/dbraw/zinc/03/47/81/708034781.db2.gz	KDGFFKHAAJPNNH-UHFFFAOYSA-N	1	1	318.757	1.051	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c([N+](=O)[O-])c1	ZINC000896913151	708181291	/nfs/dbraw/zinc/18/12/91/708181291.db2.gz	NKQUJXTXIQUTIY-XHDPSFHLSA-N	1	1	320.349	1.164	20	5		DDBDMO
Cc1cccc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897220928	708258720	/nfs/dbraw/zinc/25/87/20/708258720.db2.gz	ZSKMHWBJKIKQDQ-KBPBESRZSA-N	1	1	305.378	1.939	20	5		DDBDMO
Nc1c(F)c(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221448	708259184	/nfs/dbraw/zinc/25/91/84/708259184.db2.gz	NBLFYSJHYRECOP-MNOVXSKESA-N	1	1	324.356	1.352	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000886578212	708780413	/nfs/dbraw/zinc/78/04/13/708780413.db2.gz	NMIWHHPMHQMUFW-UHIISALHSA-N	1	1	305.334	1.236	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000886578212	708780415	/nfs/dbraw/zinc/78/04/15/708780415.db2.gz	NMIWHHPMHQMUFW-UHIISALHSA-N	1	1	305.334	1.236	20	5		DDBDMO
Cc1cc(Cl)c(C(=O)NCC[N@@H+](C)CCO)cc1[N+](=O)[O-]	ZINC000899738498	709184458	/nfs/dbraw/zinc/18/44/58/709184458.db2.gz	DRULNSZFQPCTPM-UHFFFAOYSA-N	1	1	315.757	1.211	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000900098995	709288576	/nfs/dbraw/zinc/28/85/76/709288576.db2.gz	LMOVQGIJKTXQKY-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2c3cc(F)ccc3ncc2[N+](=O)[O-])C1	ZINC000893186701	710568341	/nfs/dbraw/zinc/56/83/41/710568341.db2.gz	BBJCHRLMHFTBLK-HNNXBMFYSA-N	1	1	320.324	1.183	20	5		DDBDMO
COc1cc(OCC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000928442802	713197960	/nfs/dbraw/zinc/19/79/60/713197960.db2.gz	CFFOFIPZLTVHGL-PWSUYJOCSA-N	1	1	323.349	1.191	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000928448999	713201608	/nfs/dbraw/zinc/20/16/08/713201608.db2.gz	DGOWJJVFLKARCK-WPRPVWTQSA-N	1	1	307.306	1.146	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC000893936005	710892512	/nfs/dbraw/zinc/89/25/12/710892512.db2.gz	TYNZPZWGTDGQJQ-HTQZYQBOSA-N	1	1	319.287	1.487	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000893942028	710894793	/nfs/dbraw/zinc/89/47/93/710894793.db2.gz	YQFCSHAPEIVHQU-PWSUYJOCSA-N	1	1	320.349	1.225	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000928571329	713233515	/nfs/dbraw/zinc/23/35/15/713233515.db2.gz	MBFYKBCBMQHGQE-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000928571329	713233517	/nfs/dbraw/zinc/23/35/17/713233517.db2.gz	MBFYKBCBMQHGQE-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@@H+](CCO)CCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-]	ZINC000895241370	711462238	/nfs/dbraw/zinc/46/22/38/711462238.db2.gz	RISFQZSIDDATSP-UHFFFAOYSA-N	1	1	324.768	1.554	20	5		DDBDMO
COC/C(C)=C\C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000929171763	713561079	/nfs/dbraw/zinc/56/10/79/713561079.db2.gz	ODURHLSSXGXLEP-ACAGNQJTSA-N	1	1	306.366	1.705	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000930651587	713887693	/nfs/dbraw/zinc/88/76/93/713887693.db2.gz	YVXJTMNOYPWJIS-CABCVRRESA-N	1	1	303.362	1.909	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000931205331	714035770	/nfs/dbraw/zinc/03/57/70/714035770.db2.gz	LCJMIMGSLRLKNQ-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000931205331	714035772	/nfs/dbraw/zinc/03/57/72/714035772.db2.gz	LCJMIMGSLRLKNQ-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000932646328	714373921	/nfs/dbraw/zinc/37/39/21/714373921.db2.gz	HWUZABZSHROYFM-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000932757590	714406904	/nfs/dbraw/zinc/40/69/04/714406904.db2.gz	WWLQRKQZPKEUGI-CYBMUJFWSA-N	1	1	323.397	1.480	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000923888148	714484842	/nfs/dbraw/zinc/48/48/42/714484842.db2.gz	BYMHKKQBTGBGJV-CYBMUJFWSA-N	1	1	323.349	1.173	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1C	ZINC000925309435	714803161	/nfs/dbraw/zinc/80/31/61/714803161.db2.gz	ZYLBKTMLDMCLLC-KOLCDFICSA-N	1	1	308.338	1.818	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000925410424	714846633	/nfs/dbraw/zinc/84/66/33/714846633.db2.gz	RNDCEQFXXKGJLE-OAHLLOKOSA-N	1	1	318.377	1.973	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4c(cccc4[N+](=O)[O-])n3)C[C@@H]21	ZINC001164666140	719391572	/nfs/dbraw/zinc/39/15/72/719391572.db2.gz	JJVUPWXEAOJVJT-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
CCOC(=O)COc1ncc(N[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001167278825	732888858	/nfs/dbraw/zinc/88/88/58/732888858.db2.gz	UILMBBAVVRSDNG-JTQLQIEISA-N	1	1	324.337	1.048	20	5		DDBDMO
C[C@H](c1nnc(N2CCC[N@H+](C(C)(C)C)CC2)n1C)[N+](=O)[O-]	ZINC001121388797	782486881	/nfs/dbraw/zinc/48/68/81/782486881.db2.gz	GTBLLUJGQLZLQR-LLVKDONJSA-N	1	1	310.402	1.463	20	5		DDBDMO
Cc1c(F)cnc(NCC[NH+]2CCSCC2)c1[N+](=O)[O-]	ZINC001167832604	738953873	/nfs/dbraw/zinc/95/38/73/738953873.db2.gz	LEUUSVKJMXLBKN-UHFFFAOYSA-N	1	1	300.359	1.898	20	5		DDBDMO
Cc1csc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)c1	ZINC001126732429	741864204	/nfs/dbraw/zinc/86/42/04/741864204.db2.gz	HSVWEUAJZAPWKJ-UHFFFAOYSA-N	1	1	323.378	1.218	20	5		DDBDMO
CC(C)=CC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001040699192	744521260	/nfs/dbraw/zinc/52/12/60/744521260.db2.gz	ADMAIQSJCSYLPH-HUUCEWRRSA-N	1	1	321.421	1.932	20	5		DDBDMO
CO[C@H]1CC[NH2+][C@@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)C1	ZINC001212240502	747104809	/nfs/dbraw/zinc/10/48/09/747104809.db2.gz	ALHJPZUGDKGNLQ-DTWKUNHWSA-N	1	1	323.284	1.618	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](CO)[C@H](CCO)C2)c(Cl)c1	ZINC001198752042	747599112	/nfs/dbraw/zinc/59/91/12/747599112.db2.gz	HZEKDJBMNMFTRD-ZYHUDNBSSA-N	1	1	314.769	1.671	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@H](Oc3ncc(F)cn3)C2)C1	ZINC001169054391	762209733	/nfs/dbraw/zinc/20/97/33/762209733.db2.gz	LTEJMGNVMCYJCB-WXHSDQCUSA-N	1	1	310.329	1.514	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001147155433	773054353	/nfs/dbraw/zinc/05/43/53/773054353.db2.gz	ZPDKEMKPVFGQKL-SSDOTTSWSA-N	1	1	315.761	1.574	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ncc([N+](=O)[O-])cc1C	ZINC001093642096	774939710	/nfs/dbraw/zinc/93/97/10/774939710.db2.gz	KFXXDLRVHHARIN-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCO[C@H](CO)C1)CC2	ZINC001172907080	776918125	/nfs/dbraw/zinc/91/81/25/776918125.db2.gz	CRIBLMPUUYPQDC-ZBFHGGJFSA-N	1	1	306.362	1.535	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC([N@@H+](C)[C@H]2CCOC2)C1	ZINC001173235434	777064539	/nfs/dbraw/zinc/06/45/39/777064539.db2.gz	WYJLKJHLROVBGX-CJNGLKHVSA-N	1	1	319.405	1.931	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2cnc(N)c([N+](=O)[O-])c2)C(C)(C)C1	ZINC001178860299	779214794	/nfs/dbraw/zinc/21/47/94/779214794.db2.gz	AAKIRMXOVBTIJT-NSHDSACASA-N	1	1	307.354	1.032	20	5		DDBDMO
Cc1cc(NC(=O)NCCn2cc([N+](=O)[O-])cn2)cc(C)[nH+]1	ZINC001116360273	780500449	/nfs/dbraw/zinc/50/04/49/780500449.db2.gz	JTDSOXURMXKBDL-UHFFFAOYSA-N	1	1	304.310	1.047	20	5		DDBDMO
CCC[NH2+]CCN(Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001271805483	844121568	/nfs/dbraw/zinc/12/15/68/844121568.db2.gz	BHMPJJBBQZZFJG-HUUCEWRRSA-N	1	1	305.378	1.680	20	5		DDBDMO
COc1cc([N+](=O)[O-])cn(Cc2cn3ccccc3[nH+]2)c1=O	ZINC001307378947	836469417	/nfs/dbraw/zinc/46/94/17/836469417.db2.gz	IODGCYNLMIKXDW-UHFFFAOYSA-N	1	1	300.274	1.461	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)n1	ZINC001150120266	862099124	/nfs/dbraw/zinc/09/91/24/862099124.db2.gz	UWVZJAYITBMNDV-YMTOWFKASA-N	1	1	304.350	1.511	20	5		DDBDMO
CCc1onc(C)c1C[NH2+]CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001276001055	854124128	/nfs/dbraw/zinc/12/41/28/854124128.db2.gz	DJIISVUGKYKAFT-DGCLKSJQSA-N	1	1	324.381	1.149	20	5		DDBDMO
C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NCCn3cc([N+](=O)[O-])cn3)C[N@H+]2C1	ZINC001123668800	859353196	/nfs/dbraw/zinc/35/31/96/859353196.db2.gz	HIGHYNGCOLJXKA-UPJWGTAASA-N	1	1	321.381	1.028	20	5		DDBDMO
CSc1nc(Cl)nc(N[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001156580762	863164875	/nfs/dbraw/zinc/16/48/75/863164875.db2.gz	LKNQCYQVFPDFGI-LURJTMIESA-N	1	1	303.775	1.876	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@H+]2CC[C@H]2C1	ZINC001158433927	864652183	/nfs/dbraw/zinc/65/21/83/864652183.db2.gz	PUWMYHJYRPSINR-JTQLQIEISA-N	1	1	306.322	1.061	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[C@@H]1[NH+]1CCOCC1	ZINC001160724980	866072562	/nfs/dbraw/zinc/07/25/62/866072562.db2.gz	NMQYNTXITJZPPM-OLZOCXBDSA-N	1	1	307.354	1.237	20	5		DDBDMO
CCN(CC[NH2+]CCC1=CCCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001320734381	866988979	/nfs/dbraw/zinc/98/89/79/866988979.db2.gz	IHWAURWVEXUXCP-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
COc1ncnc(N[C@@H]2CC[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC001163361653	868397003	/nfs/dbraw/zinc/39/70/03/868397003.db2.gz	JYHWABWIEFKTKG-WDEREUQCSA-N	1	1	309.370	1.924	20	5		DDBDMO
CCOC(=O)C=C(N)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001163448854	868458648	/nfs/dbraw/zinc/45/86/48/868458648.db2.gz	HRWMPKNHNMUXRG-UHFFFAOYSA-N	1	1	320.349	1.925	20	5		DDBDMO
CCOC(=O)C=C(N)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001163448854	868458655	/nfs/dbraw/zinc/45/86/55/868458655.db2.gz	HRWMPKNHNMUXRG-UHFFFAOYSA-N	1	1	320.349	1.925	20	5		DDBDMO
O=C(NCCC1(C[NH2+]C/C=C\Cl)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494416	869231644	/nfs/dbraw/zinc/23/16/44/869231644.db2.gz	IZDSWOIGSJHMTO-ZMYMIGOBSA-N	1	1	301.774	1.280	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)COc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC001337836245	869651569	/nfs/dbraw/zinc/65/15/69/869651569.db2.gz	OTYUDNUGSJGCBD-CQDKDKBSSA-N	1	1	319.361	1.430	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001226431934	882429485	/nfs/dbraw/zinc/42/94/85/882429485.db2.gz	VIXUEQXPOCFHKL-VIFPVBQESA-N	1	1	310.306	1.473	20	5		DDBDMO
C[NH+]1CCN(CCCO[C@H](C[N+](=O)[O-])c2cccnc2)CC1	ZINC001206591221	872459649	/nfs/dbraw/zinc/45/96/49/872459649.db2.gz	RCUIEJWSOZTIAU-OAHLLOKOSA-N	1	1	308.382	1.054	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]3CCCC[C@H]3C2)c1	ZINC001319181581	872481741	/nfs/dbraw/zinc/48/17/41/872481741.db2.gz	MKZCNYDJRIZNDQ-KCQAQPDRSA-N	1	1	308.382	1.664	20	5		DDBDMO
O=C(CC[NH+]1CCOCC1)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001319558766	872693721	/nfs/dbraw/zinc/69/37/21/872693721.db2.gz	MQBFFZZPKPDJKP-UHFFFAOYSA-N	1	1	319.361	1.202	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nnc(CCC[N+](=O)[O-])n2C)[C@H](C)C1	ZINC001355391968	878533285	/nfs/dbraw/zinc/53/32/85/878533285.db2.gz	NSEGMRIUYCCROB-OLZOCXBDSA-N	1	1	324.429	1.191	20	5		DDBDMO
C[C@H](C[NH+](C)C)Oc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC001228659694	883600368	/nfs/dbraw/zinc/60/03/68/883600368.db2.gz	BKQXPMUWLVGCAO-SECBINFHSA-N	1	1	302.352	1.327	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2[N+](=O)[O-])C1	ZINC001233579208	887122225	/nfs/dbraw/zinc/12/22/25/887122225.db2.gz	ZYUMAINRKIEPRP-SNVBAGLBSA-N	1	1	311.294	1.603	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3cccc([N+](=O)[O-])c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233576673	887123226	/nfs/dbraw/zinc/12/32/26/887123226.db2.gz	YLSNELVMFCXEBZ-RLCGTCKNSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3cccc([N+](=O)[O-])c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233576673	887123231	/nfs/dbraw/zinc/12/32/31/887123231.db2.gz	YLSNELVMFCXEBZ-RLCGTCKNSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cocn1)Cc1ccccc1[N+](=O)[O-]	ZINC001235715592	888906337	/nfs/dbraw/zinc/90/63/37/888906337.db2.gz	IDVCTZUTKQWCHJ-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCN4CC[C@@H]4C3)CC2)cc1	ZINC001254482430	896456550	/nfs/dbraw/zinc/45/65/50/896456550.db2.gz	JBPJWJPOXQLQSU-QGZVFWFLSA-N	1	1	316.405	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N3CC[N@@H+]4CC[C@@H]4C3)CC2)cc1	ZINC001254482430	896456558	/nfs/dbraw/zinc/45/65/58/896456558.db2.gz	JBPJWJPOXQLQSU-QGZVFWFLSA-N	1	1	316.405	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N3CC[N@H+]4CC[C@@H]4C3)CC2)cc1	ZINC001254482430	896456567	/nfs/dbraw/zinc/45/65/67/896456567.db2.gz	JBPJWJPOXQLQSU-QGZVFWFLSA-N	1	1	316.405	1.954	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC(C)C)C[C@@H]1C	ZINC001263415598	900605224	/nfs/dbraw/zinc/60/52/24/900605224.db2.gz	HFMFGEIQCCKOEG-STQMWFEESA-N	1	1	324.429	1.802	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ncc[nH]1)Cc1cccc([N+](=O)[O-])c1	ZINC001264983557	901390243	/nfs/dbraw/zinc/39/02/43/901390243.db2.gz	GCQAULCVXOQKJP-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
CC(=O)NC1(CO)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001281796450	905227476	/nfs/dbraw/zinc/22/74/76/905227476.db2.gz	YDLNLHLLKRPKKL-UHFFFAOYSA-N	1	1	307.350	1.058	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000278571655	214244676	/nfs/dbraw/zinc/24/46/76/214244676.db2.gz	KNSRYTXLAWUNOK-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000278571655	214244679	/nfs/dbraw/zinc/24/46/79/214244679.db2.gz	KNSRYTXLAWUNOK-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000278571655	214244682	/nfs/dbraw/zinc/24/46/82/214244682.db2.gz	KNSRYTXLAWUNOK-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000305764468	231043607	/nfs/dbraw/zinc/04/36/07/231043607.db2.gz	PSOCEUPQLBYMFR-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000305764468	231043610	/nfs/dbraw/zinc/04/36/10/231043610.db2.gz	PSOCEUPQLBYMFR-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CO[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000451576904	231129979	/nfs/dbraw/zinc/12/99/79/231129979.db2.gz	VCDXAVXYBVYCHT-RISCZKNCSA-N	1	1	307.350	1.890	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000451576904	231129982	/nfs/dbraw/zinc/12/99/82/231129982.db2.gz	VCDXAVXYBVYCHT-RISCZKNCSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000452351190	231356808	/nfs/dbraw/zinc/35/68/08/231356808.db2.gz	PHCQTEBMJXTKMZ-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(CCn3cc([N+](=O)[O-])ccc3=O)CC[C@@H]21	ZINC000090552603	185303005	/nfs/dbraw/zinc/30/30/05/185303005.db2.gz	IHEYZFTXTUANNS-HIFRSBDPSA-N	1	1	320.393	1.173	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](CCO)C(C)(C)C1	ZINC000615140571	362170517	/nfs/dbraw/zinc/17/05/17/362170517.db2.gz	XXQZPPDLHJYDPK-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444675804	529903300	/nfs/dbraw/zinc/90/33/00/529903300.db2.gz	SBADEHDCSNDULX-UHFFFAOYSA-N	1	1	303.366	1.997	20	5		DDBDMO
O=[N+]([O-])c1c(N2CCN(c3[nH]cc[nH+]3)CC2)nc2sccn21	ZINC000278799612	282326257	/nfs/dbraw/zinc/32/62/57/282326257.db2.gz	YCPUHPYUKNPTID-UHFFFAOYSA-N	1	1	319.350	1.354	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](CO)CC(C)(C)C	ZINC000451774889	529984325	/nfs/dbraw/zinc/98/43/25/529984325.db2.gz	CBFYXXULPDIKRG-CYBMUJFWSA-N	1	1	323.393	1.923	20	5		DDBDMO
C[NH2+]Cc1noc(-c2ccc(OC(F)F)c([N+](=O)[O-])c2)n1	ZINC000414649994	530011711	/nfs/dbraw/zinc/01/17/11/530011711.db2.gz	XNYIHNBKUQAIIQ-UHFFFAOYSA-N	1	1	300.221	1.966	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-]	ZINC000491889107	530057037	/nfs/dbraw/zinc/05/70/37/530057037.db2.gz	UURSUSVHMRGDDF-VUDGCMKMSA-N	1	1	307.325	1.958	20	5		DDBDMO
CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272700796	210105067	/nfs/dbraw/zinc/10/50/67/210105067.db2.gz	UHCUWBHJBDAZLR-OLZOCXBDSA-N	1	1	319.361	1.999	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272700796	210105071	/nfs/dbraw/zinc/10/50/71/210105071.db2.gz	UHCUWBHJBDAZLR-OLZOCXBDSA-N	1	1	319.361	1.999	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000279708060	215079368	/nfs/dbraw/zinc/07/93/68/215079368.db2.gz	HRPSJSAVIJIJMO-JSGCOSHPSA-N	1	1	310.350	1.037	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+](CCCO)Cc2ccccn2)c1	ZINC000287121229	219328685	/nfs/dbraw/zinc/32/86/85/219328685.db2.gz	XGCLOARETBFHME-UHFFFAOYSA-N	1	1	305.338	1.071	20	5		DDBDMO
C[C@H]1OCC[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1C	ZINC000182026217	199376746	/nfs/dbraw/zinc/37/67/46/199376746.db2.gz	MCVMPSLBXVRTED-UPJWGTAASA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@H]1OCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1C	ZINC000182026217	199376748	/nfs/dbraw/zinc/37/67/48/199376748.db2.gz	MCVMPSLBXVRTED-UPJWGTAASA-N	1	1	310.350	1.444	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000617352630	363066912	/nfs/dbraw/zinc/06/69/12/363066912.db2.gz	JAILZQAVGAUBSM-GFCCVEGCSA-N	1	1	319.361	1.818	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOC[C@H]1C	ZINC000026452173	352208849	/nfs/dbraw/zinc/20/88/49/352208849.db2.gz	GAGHHUOBKOXPLW-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@H]1C	ZINC000026452173	352208853	/nfs/dbraw/zinc/20/88/53/352208853.db2.gz	GAGHHUOBKOXPLW-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000052191843	352603499	/nfs/dbraw/zinc/60/34/99/352603499.db2.gz	VXSZJHQJZKOOSY-UHFFFAOYSA-N	1	1	317.349	1.718	20	5		DDBDMO
CCN1CC[NH+](C[C@@H](C)CNc2ncccc2[N+](=O)[O-])CC1	ZINC000060380155	352870065	/nfs/dbraw/zinc/87/00/65/352870065.db2.gz	QZPMGUFITOETSL-ZDUSSCGKSA-N	1	1	307.398	1.675	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1	ZINC000065892030	352967733	/nfs/dbraw/zinc/96/77/33/352967733.db2.gz	KVLSOTTXTCJKNJ-VXGBXAGGSA-N	1	1	323.397	1.336	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000067633346	353059474	/nfs/dbraw/zinc/05/94/74/353059474.db2.gz	KHKUUAABIIENTH-ZDUSSCGKSA-N	1	1	305.378	1.984	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CO)CC1	ZINC000293253720	354454684	/nfs/dbraw/zinc/45/46/84/354454684.db2.gz	UBZSOAFOXWTKCS-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CO)CC1	ZINC000293253720	354454686	/nfs/dbraw/zinc/45/46/86/354454686.db2.gz	UBZSOAFOXWTKCS-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H](C)C1	ZINC000346231299	283035065	/nfs/dbraw/zinc/03/50/65/283035065.db2.gz	OBROETMBQSTOQC-OBJOEFQTSA-N	1	1	320.393	1.736	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CC[N@H+]4C[C@H](O)C[C@H]4C3)ccnc21	ZINC000405214651	354677368	/nfs/dbraw/zinc/67/73/68/354677368.db2.gz	JMRTZJZNIUVNND-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587224639	354881918	/nfs/dbraw/zinc/88/19/18/354881918.db2.gz	VKJPLZDNZVKUQO-LLVKDONJSA-N	1	1	308.382	1.956	20	5		DDBDMO
Cc1cc(C(=O)N2CC(C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000590392089	355083710	/nfs/dbraw/zinc/08/37/10/355083710.db2.gz	LLWPCBZFAWENKF-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nncn1C	ZINC000494791559	235089748	/nfs/dbraw/zinc/08/97/48/235089748.db2.gz	DVNDWQVYBKDPJB-JTQLQIEISA-N	1	1	318.337	1.403	20	5		DDBDMO
CN1C[C@H]2[C@@H](CC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000591037767	355236739	/nfs/dbraw/zinc/23/67/39/355236739.db2.gz	ZMZDFWANZDYMPK-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1C[C@H]2[C@@H](CCN2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000591037767	355236740	/nfs/dbraw/zinc/23/67/40/355236740.db2.gz	ZMZDFWANZDYMPK-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000591037767	355236744	/nfs/dbraw/zinc/23/67/44/355236744.db2.gz	ZMZDFWANZDYMPK-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000592209140	355539455	/nfs/dbraw/zinc/53/94/55/355539455.db2.gz	VKGULDRGKUIRCK-OUCADQQQSA-N	1	1	322.361	1.820	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([C@H]3CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256116	355548250	/nfs/dbraw/zinc/54/82/50/355548250.db2.gz	ZJMFTGMECAGLEG-WDEREUQCSA-N	1	1	307.354	1.088	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593679320	355964704	/nfs/dbraw/zinc/96/47/04/355964704.db2.gz	KQCICCCUHHGJTF-SDSFWRRZSA-N	1	1	317.389	1.749	20	5		DDBDMO
CC1(C)[C@H](O)C[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000594003570	356084252	/nfs/dbraw/zinc/08/42/52/356084252.db2.gz	APOPJUAZDSBZJQ-VXGBXAGGSA-N	1	1	318.333	1.894	20	5		DDBDMO
CCC[N@@H+](CC)CCNS(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594760355	356309596	/nfs/dbraw/zinc/30/95/96/356309596.db2.gz	MFKZGYNNQGLVDU-UHFFFAOYSA-N	1	1	316.383	1.000	20	5		DDBDMO
COCC[N@@H+](C)CCN[C@H](C)c1ccc([N+](=O)[O-])cc1OC	ZINC000595042032	356375999	/nfs/dbraw/zinc/37/59/99/356375999.db2.gz	SKKCGTXMLCFPNS-GFCCVEGCSA-N	1	1	311.382	1.832	20	5		DDBDMO
Cc1noc([C@@H]2CCC[N@H+](Cc3onc(C)c3[N+](=O)[O-])C2)n1	ZINC000595295384	356438137	/nfs/dbraw/zinc/43/81/37/356438137.db2.gz	KZWNHQAUIJHWSV-SNVBAGLBSA-N	1	1	307.310	1.962	20	5		DDBDMO
Cc1noc([C@@H]2CCC[N@@H+](Cc3onc(C)c3[N+](=O)[O-])C2)n1	ZINC000595295384	356438140	/nfs/dbraw/zinc/43/81/40/356438140.db2.gz	KZWNHQAUIJHWSV-SNVBAGLBSA-N	1	1	307.310	1.962	20	5		DDBDMO
CCO[C@@H]1C[C@](CO)([NH2+]Cc2onc(C)c2[N+](=O)[O-])C1(C)C	ZINC000595447070	356496580	/nfs/dbraw/zinc/49/65/80/356496580.db2.gz	FTBFXJHVHYOBAN-BXUZGUMPSA-N	1	1	313.354	1.547	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000081519637	192278013	/nfs/dbraw/zinc/27/80/13/192278013.db2.gz	KPDAHCKUEZWXIY-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1	ZINC000595608365	356575338	/nfs/dbraw/zinc/57/53/38/356575338.db2.gz	OJXSQDBYFBBZJM-GFCCVEGCSA-N	1	1	317.349	1.717	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](Cn2ccnn2)C1	ZINC000595608845	356575737	/nfs/dbraw/zinc/57/57/37/356575737.db2.gz	XJRAZMVJFXZACX-ZDUSSCGKSA-N	1	1	317.349	1.587	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000595744987	356632377	/nfs/dbraw/zinc/63/23/77/356632377.db2.gz	XPLWGVKCKBYEPX-DZGCQCFKSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000595754986	356637469	/nfs/dbraw/zinc/63/74/69/356637469.db2.gz	DOMQTFNESKNIKO-XPKDYRNWSA-N	1	1	322.361	1.303	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c1	ZINC000595761072	356642006	/nfs/dbraw/zinc/64/20/06/356642006.db2.gz	WNUKVDSDRIPXAG-CJNGLKHVSA-N	1	1	320.345	1.850	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595833836	356670428	/nfs/dbraw/zinc/67/04/28/356670428.db2.gz	RZRUGRHRWBHWCM-UPJWGTAASA-N	1	1	319.361	1.890	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](C(=O)NC(C)C)C2)c1[N+](=O)[O-]	ZINC000595852257	356678448	/nfs/dbraw/zinc/67/84/48/356678448.db2.gz	YOEOMARFWZMUJP-LLVKDONJSA-N	1	1	310.354	1.628	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](C(=O)NC(C)C)C2)c1[N+](=O)[O-]	ZINC000595852257	356678451	/nfs/dbraw/zinc/67/84/51/356678451.db2.gz	YOEOMARFWZMUJP-LLVKDONJSA-N	1	1	310.354	1.628	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H]3COC[C@H]3C2)c1	ZINC000595826596	356665885	/nfs/dbraw/zinc/66/58/85/356665885.db2.gz	AWPAMPVMNJOSFM-GZBFAFLISA-N	1	1	322.361	1.303	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595870479	356685752	/nfs/dbraw/zinc/68/57/52/356685752.db2.gz	GOPXMXZZUOLHPO-LRDDRELGSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595870479	356685756	/nfs/dbraw/zinc/68/57/56/356685756.db2.gz	GOPXMXZZUOLHPO-LRDDRELGSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595873317	356686824	/nfs/dbraw/zinc/68/68/24/356686824.db2.gz	LLJFXEFQABKQIV-MLGOLLRUSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595873317	356686827	/nfs/dbraw/zinc/68/68/27/356686827.db2.gz	LLJFXEFQABKQIV-MLGOLLRUSA-N	1	1	321.377	1.792	20	5		DDBDMO
NC(=O)c1cc(NC[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000596078990	356765033	/nfs/dbraw/zinc/76/50/33/356765033.db2.gz	HQGIEBOYCROUBX-SNVBAGLBSA-N	1	1	304.350	1.590	20	5		DDBDMO
CC[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1C	ZINC000618288413	363567603	/nfs/dbraw/zinc/56/76/03/363567603.db2.gz	GFIDKOXNXDTACC-NSHDSACASA-N	1	1	303.366	1.997	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596151944	356792680	/nfs/dbraw/zinc/79/26/80/356792680.db2.gz	MYSZBNFUPDOZAV-MFKMUULPSA-N	1	1	306.366	1.470	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596166796	356799515	/nfs/dbraw/zinc/79/95/15/356799515.db2.gz	WQOGNJRHMGBWAQ-SMDDNHRTSA-N	1	1	318.377	1.614	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000596199690	356811079	/nfs/dbraw/zinc/81/10/79/356811079.db2.gz	FKQBPQWYYQTALW-SNVBAGLBSA-N	1	1	301.306	1.317	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000596516252	356903433	/nfs/dbraw/zinc/90/34/33/356903433.db2.gz	DEVOUTZVPPXMLU-LLVKDONJSA-N	1	1	322.365	1.981	20	5		DDBDMO
Cc1[nH+]cc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)n1C	ZINC000596977378	357032367	/nfs/dbraw/zinc/03/23/67/357032367.db2.gz	KZVDPFXHVMSLKD-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(CC[N@@H+](C)C2)C1	ZINC000597716945	357300059	/nfs/dbraw/zinc/30/00/59/357300059.db2.gz	UFHDEVMLWVCTPH-OAHLLOKOSA-N	1	1	306.366	1.491	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597853902	357357945	/nfs/dbraw/zinc/35/79/45/357357945.db2.gz	DKUBLZWZMUGVEF-JTQLQIEISA-N	1	1	323.397	1.731	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597923123	357384014	/nfs/dbraw/zinc/38/40/14/357384014.db2.gz	LSLLQYBUENYKMR-SECBINFHSA-N	1	1	309.370	1.483	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000598343342	357545130	/nfs/dbraw/zinc/54/51/30/357545130.db2.gz	VEHOFCURLGNCHU-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598559781	357631789	/nfs/dbraw/zinc/63/17/89/357631789.db2.gz	ZJOCTPWOESIWRB-LLVKDONJSA-N	1	1	307.354	1.170	20	5		DDBDMO
COc1ccc(CNC(=O)Cn2c[nH+]cc2C)cc1[N+](=O)[O-]	ZINC000599126595	357822605	/nfs/dbraw/zinc/82/26/05/357822605.db2.gz	OLKXAPCEBNVAFR-UHFFFAOYSA-N	1	1	304.306	1.425	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[NH+](CCCF)CC1	ZINC000600072215	358115232	/nfs/dbraw/zinc/11/52/32/358115232.db2.gz	PPYZTJBKIQONGT-UHFFFAOYSA-N	1	1	313.304	1.851	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCCC[NH2+]C[C@H](O)CN2CCCC2)cc1	ZINC000600721975	358296092	/nfs/dbraw/zinc/29/60/92/358296092.db2.gz	DDGRKBIHLMKAPA-KRWDZBQOSA-N	1	1	321.421	1.964	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000180854428	199218634	/nfs/dbraw/zinc/21/86/34/199218634.db2.gz	XSNCBTBHPRGMNV-VHSXEESVSA-N	1	1	304.350	1.532	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CC[N@H+](C2CC2)C1	ZINC000601109663	358405140	/nfs/dbraw/zinc/40/51/40/358405140.db2.gz	WGIISJIPOZEVHZ-ZETCQYMHSA-N	1	1	319.287	1.996	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000601103271	358402826	/nfs/dbraw/zinc/40/28/26/358402826.db2.gz	SJPJHGGVRWQZOW-ZDUSSCGKSA-N	1	1	324.356	1.820	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCSC[C@@H]1C[N@H+](C)CCO1	ZINC000601918118	358740353	/nfs/dbraw/zinc/74/03/53/358740353.db2.gz	ONFQPCMIERMYNE-NSHDSACASA-N	1	1	300.384	1.164	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCSC[C@@H]1C[N@@H+](C)CCO1	ZINC000601918118	358740359	/nfs/dbraw/zinc/74/03/59/358740359.db2.gz	ONFQPCMIERMYNE-NSHDSACASA-N	1	1	300.384	1.164	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C(=O)NCC3CC3)C2)c([N+](=O)[O-])n1	ZINC000602438183	358977138	/nfs/dbraw/zinc/97/71/38/358977138.db2.gz	BPYSNDMSKQZYGG-GFCCVEGCSA-N	1	1	321.381	1.067	20	5		DDBDMO
Cn1cc(C[C@@H]2CC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)cn1	ZINC000602482230	359007913	/nfs/dbraw/zinc/00/79/13/359007913.db2.gz	HPCQIYRYVSWEFT-NSHDSACASA-N	1	1	304.354	1.126	20	5		DDBDMO
CC[NH+]1CC[C@@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796225	359197989	/nfs/dbraw/zinc/19/79/89/359197989.db2.gz	WOHWKNOSUCWOKD-GXTWGEPZSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[NH+]1CC[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796225	359197994	/nfs/dbraw/zinc/19/79/94/359197994.db2.gz	WOHWKNOSUCWOKD-GXTWGEPZSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796225	359197998	/nfs/dbraw/zinc/19/79/98/359197998.db2.gz	WOHWKNOSUCWOKD-GXTWGEPZSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796225	359198001	/nfs/dbraw/zinc/19/80/01/359198001.db2.gz	WOHWKNOSUCWOKD-GXTWGEPZSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796225	359198003	/nfs/dbraw/zinc/19/80/03/359198003.db2.gz	WOHWKNOSUCWOKD-GXTWGEPZSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796225	359198004	/nfs/dbraw/zinc/19/80/04/359198004.db2.gz	WOHWKNOSUCWOKD-GXTWGEPZSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@]2(CCOC2)O1	ZINC000602823134	359217004	/nfs/dbraw/zinc/21/70/04/359217004.db2.gz	YUGJCAGSRPPTMG-ZFWWWQNUSA-N	1	1	324.381	1.370	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)C[C@]1(C)CO	ZINC000602910444	359289546	/nfs/dbraw/zinc/28/95/46/359289546.db2.gz	YSPOIBZRKHUVFW-GDBMZVCRSA-N	1	1	324.377	1.700	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@]1(C)CO	ZINC000602910444	359289549	/nfs/dbraw/zinc/28/95/49/359289549.db2.gz	YSPOIBZRKHUVFW-GDBMZVCRSA-N	1	1	324.377	1.700	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H]2CCC[C@H]21	ZINC000602914522	359291814	/nfs/dbraw/zinc/29/18/14/359291814.db2.gz	FVRMCLBWQQTHKO-YNEHKIRRSA-N	1	1	322.365	1.492	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H]2CCC[C@H]21	ZINC000602914522	359291818	/nfs/dbraw/zinc/29/18/18/359291818.db2.gz	FVRMCLBWQQTHKO-YNEHKIRRSA-N	1	1	322.365	1.492	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](O)C[C@@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602901550	359282793	/nfs/dbraw/zinc/28/27/93/359282793.db2.gz	ZZASTAKXRNCCNN-DOMZBBRYSA-N	1	1	310.350	1.311	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000602997601	359346090	/nfs/dbraw/zinc/34/60/90/359346090.db2.gz	NKDLRMNACFFHFG-RDBSUJKOSA-N	1	1	308.382	1.725	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cn2cc(C[NH+]3CCCC3)nn2)c(F)c1	ZINC000603224544	359496310	/nfs/dbraw/zinc/49/63/10/359496310.db2.gz	QBTMCWOFYUTALO-UHFFFAOYSA-N	1	1	305.313	1.970	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)CC[N@@H+](C)C1CC1	ZINC000186782698	200009508	/nfs/dbraw/zinc/00/95/08/200009508.db2.gz	GWFRCXGBMCTDBX-LBPRGKRZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000186931650	200033833	/nfs/dbraw/zinc/03/38/33/200033833.db2.gz	HUDQTVUXGWQZQH-LBPRGKRZSA-N	1	1	321.377	1.512	20	5		DDBDMO
COc1ccc(OCCN[C@@H]2C[C@H]([NH3+])C2(C)C)c([N+](=O)[O-])c1	ZINC000603430960	359635285	/nfs/dbraw/zinc/63/52/85/359635285.db2.gz	DDEHABNBOZKNCT-UONOGXRCSA-N	1	1	309.366	1.698	20	5		DDBDMO
CCO[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000604436835	359750493	/nfs/dbraw/zinc/75/04/93/359750493.db2.gz	ASQVPBYQBVPZDN-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000604533251	359761981	/nfs/dbraw/zinc/76/19/81/359761981.db2.gz	DYNCJTDNKHXWPX-CYBMUJFWSA-N	1	1	321.377	1.820	20	5		DDBDMO
COC[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	ZINC000189406229	200395718	/nfs/dbraw/zinc/39/57/18/200395718.db2.gz	CQHZVXHKBKFNJB-SWLSCSKDSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	ZINC000189406229	200395720	/nfs/dbraw/zinc/39/57/20/200395720.db2.gz	CQHZVXHKBKFNJB-SWLSCSKDSA-N	1	1	310.350	1.709	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@H](CCO)C2)c1	ZINC000609204400	360273538	/nfs/dbraw/zinc/27/35/38/360273538.db2.gz	MUQXDZKGYRNRMX-UKRRQHHQSA-N	1	1	324.377	1.429	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Nc2ccncc2[N+](=O)[O-])C[C@H]1C	ZINC000359027165	299310847	/nfs/dbraw/zinc/31/08/47/299310847.db2.gz	NAHPDXIYIUGYBF-GHMZBOCLSA-N	1	1	307.354	1.358	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000359028220	299311255	/nfs/dbraw/zinc/31/12/55/299311255.db2.gz	PJPJJKMDNPUGDK-NWDGAFQWSA-N	1	1	305.338	1.160	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000612672348	361103468	/nfs/dbraw/zinc/10/34/68/361103468.db2.gz	LHKKGOVDHHPYEF-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000612672348	361103469	/nfs/dbraw/zinc/10/34/69/361103469.db2.gz	LHKKGOVDHHPYEF-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
COCC[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000194592699	201259665	/nfs/dbraw/zinc/25/96/65/201259665.db2.gz	FKHLQKVYELXJPA-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252704	363945529	/nfs/dbraw/zinc/94/55/29/363945529.db2.gz	NOMUVPMXMVGGIY-OCCSQVGLSA-N	1	1	307.325	1.853	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000376302052	307242591	/nfs/dbraw/zinc/24/25/91/307242591.db2.gz	IRXPMUXPNTYBDN-CYBMUJFWSA-N	1	1	313.379	1.027	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000376302052	307242592	/nfs/dbraw/zinc/24/25/92/307242592.db2.gz	IRXPMUXPNTYBDN-CYBMUJFWSA-N	1	1	313.379	1.027	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC3(CC[NH2+]C3)CC2)c1[N+](=O)[O-]	ZINC000261782987	203117064	/nfs/dbraw/zinc/11/70/64/203117064.db2.gz	LHFVKDJCRAXLAY-UHFFFAOYSA-N	1	1	321.381	1.486	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000265028009	204352104	/nfs/dbraw/zinc/35/21/04/204352104.db2.gz	XAOGHFNITUKAIH-ZDUSSCGKSA-N	1	1	323.397	1.480	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000266073817	205076164	/nfs/dbraw/zinc/07/61/64/205076164.db2.gz	XMIBDSICGHPCCZ-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
C[C@H](CC[NH+](C)C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000266151782	205139630	/nfs/dbraw/zinc/13/96/30/205139630.db2.gz	FURZHMIUGRSDHV-SECBINFHSA-N	1	1	319.358	1.352	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H](c2[nH+]ccn2C)C1	ZINC000359595604	299495648	/nfs/dbraw/zinc/49/56/48/299495648.db2.gz	WOFCSGDWNPYAEM-LLVKDONJSA-N	1	1	304.354	1.847	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1	ZINC000104977044	194061104	/nfs/dbraw/zinc/06/11/04/194061104.db2.gz	OVKFRCDMRYLCCT-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
Cc1ccc(CN2CCO[C@H]3CC[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000284719168	218147618	/nfs/dbraw/zinc/14/76/18/218147618.db2.gz	UTHHUGJRDMOMSA-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H]2CC[N@@H+](C)C[C@H]21	ZINC000284923278	218235330	/nfs/dbraw/zinc/23/53/30/218235330.db2.gz	UDBBXQCDVTWMIZ-GDBMZVCRSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@@H]1O	ZINC000159481298	197356864	/nfs/dbraw/zinc/35/68/64/197356864.db2.gz	OVGNKEVTBYGJGD-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@@H]1O	ZINC000159481298	197356866	/nfs/dbraw/zinc/35/68/66/197356866.db2.gz	OVGNKEVTBYGJGD-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])NCCC[NH+]1CCOCC1	ZINC000058046735	184070527	/nfs/dbraw/zinc/07/05/27/184070527.db2.gz	SULYBWSDWMNQSC-VOTSOKGWSA-N	1	1	319.361	1.447	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000341106282	251384401	/nfs/dbraw/zinc/38/44/01/251384401.db2.gz	WKAZQVMWPSDXQI-NEPJUHHUSA-N	1	1	306.366	1.321	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1cccc(F)c1	ZINC000158952735	197314059	/nfs/dbraw/zinc/31/40/59/197314059.db2.gz	NHKTZTMUXOCLBN-NSHDSACASA-N	1	1	321.312	1.490	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000158748956	197298006	/nfs/dbraw/zinc/29/80/06/197298006.db2.gz	HHIRCFUHZUXURE-HNNXBMFYSA-N	1	1	316.361	1.952	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](CCn2cncn2)CC1	ZINC000264094488	285163149	/nfs/dbraw/zinc/16/31/49/285163149.db2.gz	OFGKPDKRBREFRE-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+](CCO)Cc2cccnc2)cc1	ZINC000156766101	197139714	/nfs/dbraw/zinc/13/97/14/197139714.db2.gz	BGUVURNETUTDFP-UHFFFAOYSA-N	1	1	317.345	1.863	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000156492816	197118246	/nfs/dbraw/zinc/11/82/46/197118246.db2.gz	GCULUEHOEYCDNJ-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2C[NH2+]C[C@@H]2C1	ZINC000289540721	221053590	/nfs/dbraw/zinc/05/35/90/221053590.db2.gz	BQXURDDJKNKXQN-VHSXEESVSA-N	1	1	315.333	1.153	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C1CC1)[C@@H]1CNCCO1	ZINC000422718201	533223078	/nfs/dbraw/zinc/22/30/78/533223078.db2.gz	PIEMKJNPXZSSRX-HOTGVXAUSA-N	1	1	321.377	1.460	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[NH+](C)CC1	ZINC000121122313	195295757	/nfs/dbraw/zinc/29/57/57/195295757.db2.gz	IIBRPTDJDUMYMC-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(c3nc(C)cc(C)c3[N+](=O)[O-])[C@H]2C1	ZINC000338734567	285380808	/nfs/dbraw/zinc/38/08/08/285380808.db2.gz	SZHZXKIUGRLADI-KBPBESRZSA-N	1	1	320.393	1.906	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1F	ZINC000294869979	533538853	/nfs/dbraw/zinc/53/88/53/533538853.db2.gz	BVXZDLKSWYBXOS-VIFPVBQESA-N	1	1	311.313	1.567	20	5		DDBDMO
COc1ccc(C(=O)N2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-]	ZINC000025136540	406894011	/nfs/dbraw/zinc/89/40/11/406894011.db2.gz	FGOUNLNPLNNSKU-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
NC(=O)C[NH+]1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000037980067	406996009	/nfs/dbraw/zinc/99/60/09/406996009.db2.gz	WGFCUHXWTGZKIF-UHFFFAOYSA-N	1	1	312.757	1.610	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000079338047	407053989	/nfs/dbraw/zinc/05/39/89/407053989.db2.gz	MTPFJCKOTWKOPH-CYBMUJFWSA-N	1	1	320.393	1.632	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123191846	407322516	/nfs/dbraw/zinc/32/25/16/407322516.db2.gz	LUXHWLWXCDWBQL-FZMZJTMJSA-N	1	1	320.393	1.608	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@@](C)(O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000124920098	407374410	/nfs/dbraw/zinc/37/44/10/407374410.db2.gz	SCJZIDPGACAHQQ-OAHLLOKOSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@](C)(O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000124920098	407374412	/nfs/dbraw/zinc/37/44/12/407374412.db2.gz	SCJZIDPGACAHQQ-OAHLLOKOSA-N	1	1	307.350	1.404	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000124811938	407370378	/nfs/dbraw/zinc/37/03/78/407370378.db2.gz	LLPVMHOMXAFNEL-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC000107894122	407381282	/nfs/dbraw/zinc/38/12/82/407381282.db2.gz	YKPMVPRUJSFGPU-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
CC[C@@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000266397156	407536675	/nfs/dbraw/zinc/53/66/75/407536675.db2.gz	OXUDAIOITGXYOQ-QWHCGFSZSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000452106358	533677665	/nfs/dbraw/zinc/67/76/65/533677665.db2.gz	ZZRYPORAAGHOSH-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000452106358	533677672	/nfs/dbraw/zinc/67/76/72/533677672.db2.gz	ZZRYPORAAGHOSH-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](NC(=O)[C@H](C)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000171261795	407642612	/nfs/dbraw/zinc/64/26/12/407642612.db2.gz	HEPBRGGFCJMTPT-STQMWFEESA-N	1	1	320.393	1.408	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000266853759	407652316	/nfs/dbraw/zinc/65/23/16/407652316.db2.gz	GFSAIVWZFIWGFI-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000266853759	407652321	/nfs/dbraw/zinc/65/23/21/407652321.db2.gz	GFSAIVWZFIWGFI-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1C	ZINC000267000400	407712106	/nfs/dbraw/zinc/71/21/06/407712106.db2.gz	CTIGMPOTJVZJGK-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+](CC(C)C)CC2)c1[N+](=O)[O-]	ZINC000171809655	407772982	/nfs/dbraw/zinc/77/29/82/407772982.db2.gz	WJCSWCZKBBKLAZ-UHFFFAOYSA-N	1	1	309.370	1.294	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000153797537	407904711	/nfs/dbraw/zinc/90/47/11/407904711.db2.gz	CNBWWPNGLSFMKT-NSHDSACASA-N	1	1	314.773	1.536	20	5		DDBDMO
CC[N@H+]1CCCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000118827271	407949505	/nfs/dbraw/zinc/94/95/05/407949505.db2.gz	YYVYQUGVPDQCMG-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000118751826	407941091	/nfs/dbraw/zinc/94/10/91/407941091.db2.gz	FOIHHSIMDJBLPM-CQSZACIVSA-N	1	1	322.365	1.515	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])c(N)n1	ZINC000119079939	407990164	/nfs/dbraw/zinc/99/01/64/407990164.db2.gz	XWHZHBWLBJNGKU-NSHDSACASA-N	1	1	308.386	1.889	20	5		DDBDMO
COCCO[C@H]1CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000189654344	408070993	/nfs/dbraw/zinc/07/09/93/408070993.db2.gz	AVYKJPSOWSAYPC-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000189654344	408071000	/nfs/dbraw/zinc/07/10/00/408071000.db2.gz	AVYKJPSOWSAYPC-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
CC1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182209604	408096726	/nfs/dbraw/zinc/09/67/26/408096726.db2.gz	HEWFACPKNJLCML-GFCCVEGCSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182209604	408096733	/nfs/dbraw/zinc/09/67/33/408096733.db2.gz	HEWFACPKNJLCML-GFCCVEGCSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000136330915	408097798	/nfs/dbraw/zinc/09/77/98/408097798.db2.gz	GTLRIYNNDSIICG-YDHLFZDLSA-N	1	1	324.377	1.427	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000246310963	408217126	/nfs/dbraw/zinc/21/71/26/408217126.db2.gz	ZIRMKDXYAXURSF-UKRRQHHQSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000269459844	408317162	/nfs/dbraw/zinc/31/71/62/408317162.db2.gz	HMGNVBZGGJFJQY-VHSXEESVSA-N	1	1	321.381	1.796	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCn3cc([N+](=O)[O-])cn3)[C@H]2C1	ZINC000246522874	408281132	/nfs/dbraw/zinc/28/11/32/408281132.db2.gz	KUBLSILTVRREKE-RDBSUJKOSA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@H]2C1	ZINC000246522874	408281136	/nfs/dbraw/zinc/28/11/36/408281136.db2.gz	KUBLSILTVRREKE-RDBSUJKOSA-N	1	1	310.354	1.060	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000269535072	408345669	/nfs/dbraw/zinc/34/56/69/408345669.db2.gz	TUIDMRHWNOCFOX-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205969	408387163	/nfs/dbraw/zinc/38/71/63/408387163.db2.gz	ROBLWIBQQIZFCS-RAIGVLPGSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205969	408387168	/nfs/dbraw/zinc/38/71/68/408387168.db2.gz	ROBLWIBQQIZFCS-RAIGVLPGSA-N	1	1	308.338	1.065	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(C)(O)CC1	ZINC000177300913	408575937	/nfs/dbraw/zinc/57/59/37/408575937.db2.gz	JMAXLZIWEYJGCK-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000264606081	408541404	/nfs/dbraw/zinc/54/14/04/408541404.db2.gz	OLNPLLRKLCNINY-SNVBAGLBSA-N	1	1	310.310	1.636	20	5		DDBDMO
CN(CC(=O)N1CC[N@@H+](C)CC1(C)C)c1ccccc1[N+](=O)[O-]	ZINC000270885488	408725396	/nfs/dbraw/zinc/72/53/96/408725396.db2.gz	GLEGQADQRIJPOF-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)CC[C@H]21	ZINC000251496174	408781139	/nfs/dbraw/zinc/78/11/39/408781139.db2.gz	DMBWAIRPECDWNB-CMPLNLGQSA-N	1	1	320.349	1.252	20	5		DDBDMO
C[NH+](C)CCc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1	ZINC000276269721	408828309	/nfs/dbraw/zinc/82/83/09/408828309.db2.gz	PZWNZURFTMGMGP-UHFFFAOYSA-N	1	1	317.349	1.352	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@@H](O)C[C@H]3CO)o2)c1	ZINC000187666782	163025928	/nfs/dbraw/zinc/02/59/28/163025928.db2.gz	HLDKAWJFYPQMRQ-KBPBESRZSA-N	1	1	318.329	1.782	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000285924749	408889747	/nfs/dbraw/zinc/88/97/47/408889747.db2.gz	UPXWZPNTQUWKED-ZIAGYGMSSA-N	1	1	323.324	1.279	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2cccc([N+](=O)[O-])c2)CCCO1	ZINC000277396223	408933070	/nfs/dbraw/zinc/93/30/70/408933070.db2.gz	DQDUQLOINNONDA-CYBMUJFWSA-N	1	1	321.377	1.826	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000277570282	408968245	/nfs/dbraw/zinc/96/82/45/408968245.db2.gz	ZTERFYPKXJKZHP-LLVKDONJSA-N	1	1	319.365	1.518	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000282209797	409010956	/nfs/dbraw/zinc/01/09/56/409010956.db2.gz	XWAPLHJJVKLTEZ-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293248190	409075544	/nfs/dbraw/zinc/07/55/44/409075544.db2.gz	BJBBLKOFJMXOHP-PHIMTYICSA-N	1	1	306.366	1.218	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)CN1	ZINC000278848621	409100211	/nfs/dbraw/zinc/10/02/11/409100211.db2.gz	KADHYUKDDVXJSW-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)CN1	ZINC000278848621	409100214	/nfs/dbraw/zinc/10/02/14/409100214.db2.gz	KADHYUKDDVXJSW-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H](C)CO	ZINC000293390540	409104178	/nfs/dbraw/zinc/10/41/78/409104178.db2.gz	KMURYAOGYULMAF-NSHDSACASA-N	1	1	309.366	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000293558968	409138079	/nfs/dbraw/zinc/13/80/79/409138079.db2.gz	ZXIDNLPDTBWHKL-BETUJISGSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@H]1CN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000293786027	409179240	/nfs/dbraw/zinc/17/92/40/409179240.db2.gz	WMCLEHXZQJQFAY-LLVKDONJSA-N	1	1	321.381	1.275	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280316346	409291236	/nfs/dbraw/zinc/29/12/36/409291236.db2.gz	QAGXKCHPBMMAFW-OAHLLOKOSA-N	1	1	307.350	1.691	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCCO[C@H](C)C2)ncc1[N+](=O)[O-]	ZINC000295083731	409315896	/nfs/dbraw/zinc/31/58/96/409315896.db2.gz	RMVOBGIQMXOMLI-LLVKDONJSA-N	1	1	309.370	1.606	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCN2CCO[C@H]1C2	ZINC000295099028	409319615	/nfs/dbraw/zinc/31/96/15/409319615.db2.gz	KDAAVTVPAJMUMW-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])CC1	ZINC000294260676	409269110	/nfs/dbraw/zinc/26/91/10/409269110.db2.gz	QMGWUFFUKKATDV-UHFFFAOYSA-N	1	1	311.313	1.520	20	5		DDBDMO
Cc1ccc(C[N@H+](C)[C@@H]2CCN3CCO[C@H]2C3)cc1[N+](=O)[O-]	ZINC000295135111	409335918	/nfs/dbraw/zinc/33/59/18/409335918.db2.gz	PAJALHKMOURMLX-ZBFHGGJFSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@@H]([N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(C)(C)O	ZINC000295142830	409342901	/nfs/dbraw/zinc/34/29/01/409342901.db2.gz	LDWJYJVEMNUJLV-LLVKDONJSA-N	1	1	321.377	1.575	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000296038366	409408474	/nfs/dbraw/zinc/40/84/74/409408474.db2.gz	FCVJVABIPPHNEQ-IAQYHMDHSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000296038366	409408480	/nfs/dbraw/zinc/40/84/80/409408480.db2.gz	FCVJVABIPPHNEQ-IAQYHMDHSA-N	1	1	319.361	1.329	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1ccccc1[N+](=O)[O-]	ZINC000295339795	409442568	/nfs/dbraw/zinc/44/25/68/409442568.db2.gz	DPDKKVZKOWWJOO-LBPRGKRZSA-N	1	1	307.350	1.171	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000317286339	164027354	/nfs/dbraw/zinc/02/73/54/164027354.db2.gz	KMXJZRUAOOBCEG-GHMZBOCLSA-N	1	1	306.366	1.849	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@](O)(Cn3ccnn3)C2)cs1	ZINC000285582709	409497166	/nfs/dbraw/zinc/49/71/66/409497166.db2.gz	SUSLRYKPOZUYAI-ZDUSSCGKSA-N	1	1	323.378	1.275	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@](O)(Cn3ccnn3)C2)cs1	ZINC000285582709	409497170	/nfs/dbraw/zinc/49/71/70/409497170.db2.gz	SUSLRYKPOZUYAI-ZDUSSCGKSA-N	1	1	323.378	1.275	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881927	409686605	/nfs/dbraw/zinc/68/66/05/409686605.db2.gz	PEFAAVVSPYXNIO-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881927	409686613	/nfs/dbraw/zinc/68/66/13/409686613.db2.gz	PEFAAVVSPYXNIO-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881927	409686621	/nfs/dbraw/zinc/68/66/21/409686621.db2.gz	PEFAAVVSPYXNIO-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881927	409686629	/nfs/dbraw/zinc/68/66/29/409686629.db2.gz	PEFAAVVSPYXNIO-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CC(C)(C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12)n1cc([N+](=O)[O-])cn1	ZINC000331663733	409747661	/nfs/dbraw/zinc/74/76/61/409747661.db2.gz	OSTXSGJXVVBHRF-QWHCGFSZSA-N	1	1	321.381	1.269	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC000356913441	409716515	/nfs/dbraw/zinc/71/65/15/409716515.db2.gz	YFCBZMPDAHMGLU-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000356913441	409716523	/nfs/dbraw/zinc/71/65/23/409716523.db2.gz	YFCBZMPDAHMGLU-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985271	409806377	/nfs/dbraw/zinc/80/63/77/409806377.db2.gz	TZOSZQQBOBTPFZ-HOTGVXAUSA-N	1	1	305.378	1.628	20	5		DDBDMO
CN1CC[C@](O)(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000331985271	409806389	/nfs/dbraw/zinc/80/63/89/409806389.db2.gz	TZOSZQQBOBTPFZ-HOTGVXAUSA-N	1	1	305.378	1.628	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000346144008	409819156	/nfs/dbraw/zinc/81/91/56/409819156.db2.gz	UCIWFUGLJSCOKH-WDEREUQCSA-N	1	1	323.397	1.873	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)C1	ZINC000346229484	409870665	/nfs/dbraw/zinc/87/06/65/409870665.db2.gz	MBNUOODYTMMJMR-JBLDHEPKSA-N	1	1	307.354	1.120	20	5		DDBDMO
CC(C)NC(=O)CC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000297559924	409929024	/nfs/dbraw/zinc/92/90/24/409929024.db2.gz	BBLISFPPCYAUQR-UHFFFAOYSA-N	1	1	321.381	1.027	20	5		DDBDMO
CCC(=O)N[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000354670546	410004918	/nfs/dbraw/zinc/00/49/18/410004918.db2.gz	CESUBINIRMRZJW-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000332695025	410219541	/nfs/dbraw/zinc/21/95/41/410219541.db2.gz	RJERJTBNEAAPTB-GXSJLCMTSA-N	1	1	321.333	1.536	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000343273048	410298109	/nfs/dbraw/zinc/29/81/09/410298109.db2.gz	QTMKWJIMSCIMNO-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000343273048	410298113	/nfs/dbraw/zinc/29/81/13/410298113.db2.gz	QTMKWJIMSCIMNO-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@@H]2C(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000351976390	410386944	/nfs/dbraw/zinc/38/69/44/410386944.db2.gz	ATFIGOTVKOQBJI-CYBMUJFWSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@H]2C(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000351976390	410386953	/nfs/dbraw/zinc/38/69/53/410386953.db2.gz	ATFIGOTVKOQBJI-CYBMUJFWSA-N	1	1	307.350	1.656	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@@H+](C)[C@H]1C	ZINC000343457051	410466644	/nfs/dbraw/zinc/46/66/44/410466644.db2.gz	KOYBYCNWNJOCKQ-GXFFZTMASA-N	1	1	306.366	1.849	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1[C@H](CO)CC[C@H]1CO	ZINC000347329318	410474336	/nfs/dbraw/zinc/47/43/36/410474336.db2.gz	IFNAJRGXBPLJCE-RYUDHWBXSA-N	1	1	300.742	1.566	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000343615844	410573157	/nfs/dbraw/zinc/57/31/57/410573157.db2.gz	RTBLTUWHOUHKOP-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000343568387	410539819	/nfs/dbraw/zinc/53/98/19/410539819.db2.gz	KRGJYNYPXXAZLV-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C[C@H](C)O	ZINC000352202812	410543497	/nfs/dbraw/zinc/54/34/97/410543497.db2.gz	MNIPCFRGUJJXTF-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CCCOC1	ZINC000352203422	410545155	/nfs/dbraw/zinc/54/51/55/410545155.db2.gz	RRUXDFFSQLKSSD-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CCCOC1	ZINC000352203422	410545163	/nfs/dbraw/zinc/54/51/63/410545163.db2.gz	RRUXDFFSQLKSSD-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243509	410668852	/nfs/dbraw/zinc/66/88/52/410668852.db2.gz	HGVHLLITUISMBA-NWDGAFQWSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243509	410668856	/nfs/dbraw/zinc/66/88/56/410668856.db2.gz	HGVHLLITUISMBA-NWDGAFQWSA-N	1	1	323.349	1.005	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCCC[C@@H]2C[NH+]2CCOCC2)nc1	ZINC000301221085	410677276	/nfs/dbraw/zinc/67/72/76/410677276.db2.gz	BGDHJUXOTJCFEX-CQSZACIVSA-N	1	1	306.366	1.681	20	5		DDBDMO
Cn1[nH]c([C@@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000340216325	410761543	/nfs/dbraw/zinc/76/15/43/410761543.db2.gz	YZIAOXPMKHBZSF-ZDUSSCGKSA-N	1	1	316.365	1.515	20	5		DDBDMO
Cn1[nH]c([C@@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000340216325	410761546	/nfs/dbraw/zinc/76/15/46/410761546.db2.gz	YZIAOXPMKHBZSF-ZDUSSCGKSA-N	1	1	316.365	1.515	20	5		DDBDMO
Cc1cc(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)ncc1[N+](=O)[O-]	ZINC000301851327	410812477	/nfs/dbraw/zinc/81/24/77/410812477.db2.gz	FUZISWZFDOCUMR-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)ncc1[N+](=O)[O-]	ZINC000301851327	410812487	/nfs/dbraw/zinc/81/24/87/410812487.db2.gz	FUZISWZFDOCUMR-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000302709283	410849576	/nfs/dbraw/zinc/84/95/76/410849576.db2.gz	DDRCDJFGXZZMDV-NWDGAFQWSA-N	1	1	316.365	1.558	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356142859	410861265	/nfs/dbraw/zinc/86/12/65/410861265.db2.gz	AVRSMYMYTUOGGR-LBPRGKRZSA-N	1	1	323.397	1.713	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000131919866	196209749	/nfs/dbraw/zinc/20/97/49/196209749.db2.gz	PPDQUCIHSJGSJP-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)[C@H](C)CO)c([N+](=O)[O-])c1	ZINC000131919866	196209753	/nfs/dbraw/zinc/20/97/53/196209753.db2.gz	PPDQUCIHSJGSJP-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc(N2CC[NH+]([C@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000366851651	418526653	/nfs/dbraw/zinc/52/66/53/418526653.db2.gz	MNHPUZOVLRBBQG-ZDUSSCGKSA-N	1	1	307.350	1.514	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000374679138	418554174	/nfs/dbraw/zinc/55/41/74/418554174.db2.gz	MOMVAUZIIUYITG-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCC[N@@H+](CCOC)CC1	ZINC000360955724	418554535	/nfs/dbraw/zinc/55/45/35/418554535.db2.gz	XTDQFJZUZRXRII-UHFFFAOYSA-N	1	1	311.386	1.278	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)CCO1	ZINC000367064700	418556823	/nfs/dbraw/zinc/55/68/23/418556823.db2.gz	COGFSDCZGRDMTK-GFCCVEGCSA-N	1	1	320.393	1.867	20	5		DDBDMO
CC(=O)c1cc(N2CCN(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000290941538	222016390	/nfs/dbraw/zinc/01/63/90/222016390.db2.gz	LLTMQWZDUKOQAE-UHFFFAOYSA-N	1	1	315.333	1.847	20	5		DDBDMO
CC[N@@H+](C[C@H](C)OC)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000291312706	222305503	/nfs/dbraw/zinc/30/55/03/222305503.db2.gz	TWUHCQHEWCQJPF-STQMWFEESA-N	1	1	312.366	1.691	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000361422320	418650917	/nfs/dbraw/zinc/65/09/17/418650917.db2.gz	ZRYGHMCAZPLXEI-ZDUSSCGKSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000361593757	418689793	/nfs/dbraw/zinc/68/97/93/418689793.db2.gz	HICVYHGTKJRNPY-ZIAGYGMSSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCC[N@H+]([C@H](C)CO)CC1	ZINC000364922021	418822528	/nfs/dbraw/zinc/82/25/28/418822528.db2.gz	LUSBLPVFAFVWCZ-CQSZACIVSA-N	1	1	307.394	1.792	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000364932852	418824730	/nfs/dbraw/zinc/82/47/30/418824730.db2.gz	KRYWPAUYNHKPAH-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cn2)[C@@H]1c1cccs1	ZINC000364961223	418827735	/nfs/dbraw/zinc/82/77/35/418827735.db2.gz	YAOHNDLEYFUKHU-ZWNOBZJWSA-N	1	1	319.390	2.551	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712158	418893747	/nfs/dbraw/zinc/89/37/47/418893747.db2.gz	FDIZQUSVGWEYTQ-OLZOCXBDSA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712158	418893748	/nfs/dbraw/zinc/89/37/48/418893748.db2.gz	FDIZQUSVGWEYTQ-OLZOCXBDSA-N	1	1	321.381	1.304	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411430316	418903326	/nfs/dbraw/zinc/90/33/26/418903326.db2.gz	OALBNPRODBTTJM-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411430316	418903327	/nfs/dbraw/zinc/90/33/27/418903327.db2.gz	OALBNPRODBTTJM-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411430316	418903329	/nfs/dbraw/zinc/90/33/29/418903329.db2.gz	OALBNPRODBTTJM-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
NC(=O)c1ccc(N2CCC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000372945099	418915332	/nfs/dbraw/zinc/91/53/32/418915332.db2.gz	CXYOELFSFUQRHN-LBPRGKRZSA-N	1	1	304.350	1.368	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420930537	419362688	/nfs/dbraw/zinc/36/26/88/419362688.db2.gz	CKRPACNPDIIOSE-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420930537	419362692	/nfs/dbraw/zinc/36/26/92/419362692.db2.gz	CKRPACNPDIIOSE-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc(OCC(=O)N(C)C[C@@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000421711530	419698592	/nfs/dbraw/zinc/69/85/92/419698592.db2.gz	OOGHTXGXFTZLEY-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(NCCC[NH+]3CCOCC3)c2c1	ZINC000413023021	419765581	/nfs/dbraw/zinc/76/55/81/419765581.db2.gz	HUOLLFDMZOTAEA-UHFFFAOYSA-N	1	1	316.361	2.277	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CNCC[C@H]1C	ZINC000414932426	419877957	/nfs/dbraw/zinc/87/79/57/419877957.db2.gz	RBXQHEKUBICHDF-LALPHHSUSA-N	1	1	320.393	1.900	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000434444370	229296784	/nfs/dbraw/zinc/29/67/84/229296784.db2.gz	BZTWYNXXCIRIPR-NSHDSACASA-N	1	1	307.354	1.075	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NCC(F)(F)C[NH3+]	ZINC000423539283	420076231	/nfs/dbraw/zinc/07/62/31/420076231.db2.gz	ICJAIIMIJOGXRP-UHFFFAOYSA-N	1	1	303.265	1.317	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN(CCN2CC[NH2+]CC2)C2CC2)c1	ZINC000420352428	420229050	/nfs/dbraw/zinc/22/90/50/420229050.db2.gz	ANURRKUVKQMYHN-UHFFFAOYSA-N	1	1	304.394	1.464	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000416287332	420307064	/nfs/dbraw/zinc/30/70/64/420307064.db2.gz	BWMOFCMSGNHBCZ-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000416287332	420307067	/nfs/dbraw/zinc/30/70/67/420307067.db2.gz	BWMOFCMSGNHBCZ-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC[C@@](C)(C(=O)OC)[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC1CC1	ZINC000425509409	420403880	/nfs/dbraw/zinc/40/38/80/420403880.db2.gz	IJLSDWPHLYZSSX-HNNXBMFYSA-N	1	1	324.381	1.845	20	5		DDBDMO
Cc1cc(C)cc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000444699055	230122606	/nfs/dbraw/zinc/12/26/06/230122606.db2.gz	DQLPWOKCBDDLBB-MRXNPFEDSA-N	1	1	318.377	1.901	20	5		DDBDMO
CCn1cncc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000417789200	420479957	/nfs/dbraw/zinc/47/99/57/420479957.db2.gz	IZFBAWCODMNUHA-GFCCVEGCSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1cncc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000417789200	420479959	/nfs/dbraw/zinc/47/99/59/420479959.db2.gz	IZFBAWCODMNUHA-GFCCVEGCSA-N	1	1	316.365	1.893	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)n1	ZINC000451345394	420596024	/nfs/dbraw/zinc/59/60/24/420596024.db2.gz	QROGHMBOQHWSSC-MJBXVCDLSA-N	1	1	308.382	1.807	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457114142	420619230	/nfs/dbraw/zinc/61/92/30/420619230.db2.gz	KGGZXCAPRSYCHI-LLVKDONJSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457114142	420619232	/nfs/dbraw/zinc/61/92/32/420619232.db2.gz	KGGZXCAPRSYCHI-LLVKDONJSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457114142	420619235	/nfs/dbraw/zinc/61/92/35/420619235.db2.gz	KGGZXCAPRSYCHI-LLVKDONJSA-N	1	1	323.397	1.825	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1	ZINC000459803631	420877211	/nfs/dbraw/zinc/87/72/11/420877211.db2.gz	NOWQYUHRVMICOD-GXTWGEPZSA-N	1	1	308.382	1.701	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1	ZINC000459803631	420877214	/nfs/dbraw/zinc/87/72/14/420877214.db2.gz	NOWQYUHRVMICOD-GXTWGEPZSA-N	1	1	308.382	1.701	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C\c3ccc(F)cc3[N+](=O)[O-])C[C@H]2C1	ZINC000493594427	420892828	/nfs/dbraw/zinc/89/28/28/420892828.db2.gz	UCTFPLLMKMVFEG-VFWWJLHSSA-N	1	1	319.336	1.767	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000455769099	421060074	/nfs/dbraw/zinc/06/00/74/421060074.db2.gz	YUSJAPJMERAGML-UWVGGRQHSA-N	1	1	307.354	1.244	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000456172229	421113006	/nfs/dbraw/zinc/11/30/06/421113006.db2.gz	SFSADMINTCZGBD-RISCZKNCSA-N	1	1	304.350	1.169	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000456211311	421122419	/nfs/dbraw/zinc/12/24/19/421122419.db2.gz	NSQBPRVPOVLWMC-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000456211311	421122421	/nfs/dbraw/zinc/12/24/21/421122421.db2.gz	NSQBPRVPOVLWMC-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000489396197	421151742	/nfs/dbraw/zinc/15/17/42/421151742.db2.gz	MJYDABSNKUOQSS-ZDUSSCGKSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000456379834	421154850	/nfs/dbraw/zinc/15/48/50/421154850.db2.gz	NISFKJVQZWTSBB-LLVKDONJSA-N	1	1	308.338	1.252	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1nccc2c1cccc2[N+](=O)[O-]	ZINC000450259203	421173907	/nfs/dbraw/zinc/17/39/07/421173907.db2.gz	VPJJQMBKQSZEQQ-UHFFFAOYSA-N	1	1	318.377	2.523	20	5		DDBDMO
COCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CCOC1	ZINC000490051791	421187287	/nfs/dbraw/zinc/18/72/87/421187287.db2.gz	XEBJUUDGEGTODD-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CCOC1	ZINC000490051791	421187289	/nfs/dbraw/zinc/18/72/89/421187289.db2.gz	XEBJUUDGEGTODD-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CCC[N@H+]2CCCO)n1	ZINC000450598851	421215140	/nfs/dbraw/zinc/21/51/40/421215140.db2.gz	RSCVMKZHEPBCOW-CYBMUJFWSA-N	1	1	308.382	1.865	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](C3CC3)C2)n1	ZINC000561143777	421308010	/nfs/dbraw/zinc/30/80/10/421308010.db2.gz	HVASKMYVXCWKIE-SNVBAGLBSA-N	1	1	320.349	1.673	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000524720014	421267309	/nfs/dbraw/zinc/26/73/09/421267309.db2.gz	UQERUYDFQHVAER-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000548408050	421435964	/nfs/dbraw/zinc/43/59/64/421435964.db2.gz	FHXJSYIPSYCCTH-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CN[C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418846	421506547	/nfs/dbraw/zinc/50/65/47/421506547.db2.gz	QINQVXDWMRYTBR-SWLSCSKDSA-N	1	1	304.394	1.418	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CN[C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418846	421506549	/nfs/dbraw/zinc/50/65/49/421506549.db2.gz	QINQVXDWMRYTBR-SWLSCSKDSA-N	1	1	304.394	1.418	20	5		DDBDMO
Cc1nnc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000570391249	421642888	/nfs/dbraw/zinc/64/28/88/421642888.db2.gz	ZWVWCWRTHCNIGT-LLVKDONJSA-N	1	1	324.362	1.284	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000571577374	421727884	/nfs/dbraw/zinc/72/78/84/421727884.db2.gz	OWLBBQTYIFDNEC-MNOVXSKESA-N	1	1	318.377	1.992	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)C1	ZINC000522145310	421816462	/nfs/dbraw/zinc/81/64/62/421816462.db2.gz	VLXFVGUEZLQMHT-CYBMUJFWSA-N	1	1	318.377	1.195	20	5		DDBDMO
C[N@@H+](CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000522142480	421817389	/nfs/dbraw/zinc/81/73/89/421817389.db2.gz	BIBVSMGFAJOWON-UHFFFAOYSA-N	1	1	322.365	1.367	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000594371567	422346300	/nfs/dbraw/zinc/34/63/00/422346300.db2.gz	LSVCOVRIGBJCJF-UHFFFAOYSA-N	1	1	309.370	1.280	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[N@H+](CCO)C(C)(C)C1	ZINC000594572575	422350394	/nfs/dbraw/zinc/35/03/94/422350394.db2.gz	NSJAALGSHZFCCZ-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000594572575	422350398	/nfs/dbraw/zinc/35/03/98/422350398.db2.gz	NSJAALGSHZFCCZ-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
Nc1ccc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)nc1[N+](=O)[O-]	ZINC000596481101	422378051	/nfs/dbraw/zinc/37/80/51/422378051.db2.gz	XIMMDSJEFSDMQS-LLVKDONJSA-N	1	1	305.382	2.391	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]2COCC[C@@H]21	ZINC000341583122	271127324	/nfs/dbraw/zinc/12/73/24/271127324.db2.gz	UISULLXAWUIHOU-OCCSQVGLSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CCC[N@H+]1C	ZINC000345321783	272219148	/nfs/dbraw/zinc/21/91/48/272219148.db2.gz	OUQYRXIADAGGPE-LDYMZIIASA-N	1	1	310.329	1.529	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)[N@H+]1CCCC[C@H]1C	ZINC000345883204	272356835	/nfs/dbraw/zinc/35/68/35/272356835.db2.gz	YUHOHHCHOJRLKI-VXGBXAGGSA-N	1	1	323.397	1.479	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+](C3CC3)CC2)n1	ZINC000280994392	274004275	/nfs/dbraw/zinc/00/42/75/274004275.db2.gz	OZAOXLFIGSGRCR-UHFFFAOYSA-N	1	1	306.322	1.061	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@@H](C)C1	ZINC000275372757	274272258	/nfs/dbraw/zinc/27/22/58/274272258.db2.gz	NSTMBWMPTMBHEY-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@@H](C)C1	ZINC000275372757	274272259	/nfs/dbraw/zinc/27/22/59/274272259.db2.gz	NSTMBWMPTMBHEY-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000275746937	274272588	/nfs/dbraw/zinc/27/25/88/274272588.db2.gz	CPTWDUAJOKNQAM-SECBINFHSA-N	1	1	300.746	1.146	20	5		DDBDMO
C[C@@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000193522072	274362156	/nfs/dbraw/zinc/36/21/56/274362156.db2.gz	YGXFCQYJZABWQZ-LLVKDONJSA-N	1	1	308.382	1.458	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N3CCC[N@H+](C4CC4)CC3)nn21	ZINC000179288331	275041587	/nfs/dbraw/zinc/04/15/87/275041587.db2.gz	NJHCCKQIYBGAGP-UHFFFAOYSA-N	1	1	302.338	1.312	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1	ZINC000158959721	276071383	/nfs/dbraw/zinc/07/13/83/276071383.db2.gz	QETUVBIGLRJRSE-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000299289169	277081118	/nfs/dbraw/zinc/08/11/18/277081118.db2.gz	PDDYQCIPQLDCLJ-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCC[N@H+]1CCCO	ZINC000452784243	281257655	/nfs/dbraw/zinc/25/76/55/281257655.db2.gz	OETKDMTYJDSHDZ-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1oncc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000129081113	281331100	/nfs/dbraw/zinc/33/11/00/281331100.db2.gz	RPQNKHORYFZPFY-LBPRGKRZSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1oncc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000129081113	281331101	/nfs/dbraw/zinc/33/11/01/281331101.db2.gz	RPQNKHORYFZPFY-LBPRGKRZSA-N	1	1	303.322	1.973	20	5		DDBDMO
C[C@@H](c1ccccc1F)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246725805	282010477	/nfs/dbraw/zinc/01/04/77/282010477.db2.gz	MHADJYQXKOJFQJ-WCQYABFASA-N	1	1	322.340	1.984	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000192572308	295287504	/nfs/dbraw/zinc/28/75/04/295287504.db2.gz	OQQUABFCAZSULY-NWDGAFQWSA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1cnn(C)c1C[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368578585	301056784	/nfs/dbraw/zinc/05/67/84/301056784.db2.gz	OLLLWGZKDLVFBD-LBPRGKRZSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1cnn(C)c1C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368578585	301056787	/nfs/dbraw/zinc/05/67/87/301056787.db2.gz	OLLLWGZKDLVFBD-LBPRGKRZSA-N	1	1	304.354	1.670	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)CC12CC2	ZINC000369007171	301118249	/nfs/dbraw/zinc/11/82/49/301118249.db2.gz	GRHCOKNDLRSWQB-WCQYABFASA-N	1	1	320.349	1.524	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CCNC(=O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000369428708	301185522	/nfs/dbraw/zinc/18/55/22/301185522.db2.gz	TWFNLXWQYJKVGR-NSHDSACASA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCNC(=O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000369428708	301185523	/nfs/dbraw/zinc/18/55/23/301185523.db2.gz	TWFNLXWQYJKVGR-NSHDSACASA-N	1	1	323.349	1.193	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n[nH]1	ZINC000370044645	301264765	/nfs/dbraw/zinc/26/47/65/301264765.db2.gz	FYPOOOUBARLADY-NSHDSACASA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n[nH]1	ZINC000370044645	301264769	/nfs/dbraw/zinc/26/47/69/301264769.db2.gz	FYPOOOUBARLADY-NSHDSACASA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)[nH]n1	ZINC000370044645	301264770	/nfs/dbraw/zinc/26/47/70/301264770.db2.gz	FYPOOOUBARLADY-NSHDSACASA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)[nH]n1	ZINC000370044645	301264772	/nfs/dbraw/zinc/26/47/72/301264772.db2.gz	FYPOOOUBARLADY-NSHDSACASA-N	1	1	304.354	1.739	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1	ZINC000370063260	301268890	/nfs/dbraw/zinc/26/88/90/301268890.db2.gz	ABDBLWGXTNEWFR-UHFFFAOYSA-N	1	1	322.365	1.499	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000377475390	302182684	/nfs/dbraw/zinc/18/26/84/302182684.db2.gz	MBRLWJCLNUGEMC-KBPBESRZSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2nccs2)c1	ZINC000519772400	302853675	/nfs/dbraw/zinc/85/36/75/302853675.db2.gz	UFCKSCBCZFRQSR-NSHDSACASA-N	1	1	309.347	1.581	20	5		DDBDMO
CCc1ccc([C@H](CO)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1	ZINC000359624742	306958326	/nfs/dbraw/zinc/95/83/26/306958326.db2.gz	JJLQTPSYQBWJMW-ZDUSSCGKSA-N	1	1	304.350	1.714	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000365018718	307056573	/nfs/dbraw/zinc/05/65/73/307056573.db2.gz	ORTLMWBXFZELFR-XHDPSFHLSA-N	1	1	318.377	1.485	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000365194451	307061642	/nfs/dbraw/zinc/06/16/42/307061642.db2.gz	DEBNVBQEPMUKSX-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@@H](O)C4(CC4)C3)o2)cc1	ZINC000368799540	307110200	/nfs/dbraw/zinc/11/02/00/307110200.db2.gz	JKAZVNSYKJGBGF-GFCCVEGCSA-N	1	1	316.317	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@@H](O)C4(CC4)C3)o2)cc1	ZINC000368799540	307110201	/nfs/dbraw/zinc/11/02/01/307110201.db2.gz	JKAZVNSYKJGBGF-GFCCVEGCSA-N	1	1	316.317	1.602	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000373972936	307198875	/nfs/dbraw/zinc/19/88/75/307198875.db2.gz	KXMQDAHWEVVUBZ-ARFHVFGLSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000373972936	307198876	/nfs/dbraw/zinc/19/88/76/307198876.db2.gz	KXMQDAHWEVVUBZ-ARFHVFGLSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000373972936	307198877	/nfs/dbraw/zinc/19/88/77/307198877.db2.gz	KXMQDAHWEVVUBZ-ARFHVFGLSA-N	1	1	317.389	1.332	20	5		DDBDMO
CCc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000552341637	307820459	/nfs/dbraw/zinc/82/04/59/307820459.db2.gz	QYGWVYCRYFYMFO-JTQLQIEISA-N	1	1	318.337	1.382	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2NC)C1	ZINC000566564120	308057047	/nfs/dbraw/zinc/05/70/47/308057047.db2.gz	RJFBKBMSKNZGBF-ZDUSSCGKSA-N	1	1	308.338	1.296	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2NC)C1	ZINC000566564120	308057049	/nfs/dbraw/zinc/05/70/49/308057049.db2.gz	RJFBKBMSKNZGBF-ZDUSSCGKSA-N	1	1	308.338	1.296	20	5		DDBDMO
CNc1nc(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000572358498	308218533	/nfs/dbraw/zinc/21/85/33/308218533.db2.gz	DSXVNZXVUZORPD-JTQLQIEISA-N	1	1	307.354	1.103	20	5		DDBDMO
Cc1nnc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])s1	ZINC000577842995	308417955	/nfs/dbraw/zinc/41/79/55/308417955.db2.gz	SJFLBHVGJYFIMP-UHFFFAOYSA-N	1	1	321.362	1.873	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@H]2CC[N@@H+](C)C[C@@H]21	ZINC000584649408	337380547	/nfs/dbraw/zinc/38/05/47/337380547.db2.gz	INEGSBQGXVAGSR-RYUDHWBXSA-N	1	1	309.370	1.029	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@]12CCOC2)Nc1ccccc1[N+](=O)[O-]	ZINC000421019807	484111091	/nfs/dbraw/zinc/11/10/91/484111091.db2.gz	MTVGBCRKWIIISR-HNNXBMFYSA-N	1	1	305.334	1.788	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305766037	533901033	/nfs/dbraw/zinc/90/10/33/533901033.db2.gz	RFDFFFVWCCRSRD-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000459580403	528035537	/nfs/dbraw/zinc/03/55/37/528035537.db2.gz	BJVDIKOHDQNJGU-UHFFFAOYSA-N	1	1	322.365	1.346	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000302456820	528311441	/nfs/dbraw/zinc/31/14/41/528311441.db2.gz	QPDDJNDBRQPHQA-QWHCGFSZSA-N	1	1	323.393	1.885	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444620668	528724345	/nfs/dbraw/zinc/72/43/45/528724345.db2.gz	PDBARIIVQRAGQC-UHFFFAOYSA-N	1	1	306.322	1.856	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444620668	528724354	/nfs/dbraw/zinc/72/43/54/528724354.db2.gz	PDBARIIVQRAGQC-UHFFFAOYSA-N	1	1	306.322	1.856	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000452112040	529077226	/nfs/dbraw/zinc/07/72/26/529077226.db2.gz	DWAIDMQNVVWOFN-AWEZNQCLSA-N	1	1	320.393	1.608	20	5		DDBDMO
CC[NH+]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1	ZINC000411135014	529131674	/nfs/dbraw/zinc/13/16/74/529131674.db2.gz	GMPNRGCEXIPRTI-LSDHHAIUSA-N	1	1	303.362	1.862	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000735883092	598500230	/nfs/dbraw/zinc/50/02/30/598500230.db2.gz	WFBNPWXTFCENPA-SECBINFHSA-N	1	1	318.341	1.065	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736328798	598500611	/nfs/dbraw/zinc/50/06/11/598500611.db2.gz	YQWQMIRDBOXPPV-VIFPVBQESA-N	1	1	320.357	1.312	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000820669007	606711907	/nfs/dbraw/zinc/71/19/07/606711907.db2.gz	YKKPZWLSYHOSIN-IUCAKERBSA-N	1	1	318.341	1.065	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122592642	696723592	/nfs/dbraw/zinc/72/35/92/696723592.db2.gz	QXUHNIGBYNJVIV-OLZOCXBDSA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122592642	696723594	/nfs/dbraw/zinc/72/35/94/696723594.db2.gz	QXUHNIGBYNJVIV-OLZOCXBDSA-N	1	1	323.397	1.766	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC1	ZINC000050693344	696234067	/nfs/dbraw/zinc/23/40/67/696234067.db2.gz	NLPLIKGYQVTFAC-UHFFFAOYSA-N	1	1	312.757	1.608	20	5		DDBDMO
COCC[NH+](CCOC)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000083104494	696550451	/nfs/dbraw/zinc/55/04/51/696550451.db2.gz	OYCKKEVSWOTEJK-UHFFFAOYSA-N	1	1	308.338	1.497	20	5		DDBDMO
Cc1nn(C[NH+]2CCC(Cn3ccnn3)CC2)c(C)c1[N+](=O)[O-]	ZINC000157017546	696971730	/nfs/dbraw/zinc/97/17/30/696971730.db2.gz	AUKNAEQSEQDAMM-UHFFFAOYSA-N	1	1	319.369	1.369	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000773196440	697726440	/nfs/dbraw/zinc/72/64/40/697726440.db2.gz	FFSIYVXBEIUUTA-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000773199221	697727088	/nfs/dbraw/zinc/72/70/88/697727088.db2.gz	QCFBCOJYYVXKSC-JTQLQIEISA-N	1	1	322.321	1.717	20	5		DDBDMO
C[C@H](NC(=O)CC[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000775597877	698014250	/nfs/dbraw/zinc/01/42/50/698014250.db2.gz	WVSBZVKANYXQGI-LBPRGKRZSA-N	1	1	307.350	1.494	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCC[C@@H]2C2OCCO2)c1	ZINC000750055118	700201372	/nfs/dbraw/zinc/20/13/72/700201372.db2.gz	ZBWKEYCIZCSWMO-HUUCEWRRSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCC[C@@H]2C2OCCO2)c1	ZINC000750055118	700201373	/nfs/dbraw/zinc/20/13/73/700201373.db2.gz	ZBWKEYCIZCSWMO-HUUCEWRRSA-N	1	1	322.361	1.856	20	5		DDBDMO
CC1(C)CN(Cc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000781961532	698666240	/nfs/dbraw/zinc/66/62/40/698666240.db2.gz	URGTYJRRJVTGBP-UHFFFAOYSA-N	1	1	311.357	1.622	20	5		DDBDMO
O=C(CCN1C[C@H]2C[NH2+]C[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782480616	698728164	/nfs/dbraw/zinc/72/81/64/698728164.db2.gz	BAGCJZICIGYUMC-PHIMTYICSA-N	1	1	322.340	1.214	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000782507895	698733171	/nfs/dbraw/zinc/73/31/71/698733171.db2.gz	WHUIJTWJYRNJQD-LLVKDONJSA-N	1	1	311.313	1.783	20	5		DDBDMO
C/C(=C\C(=O)N1CC[NH+](CCO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000784647420	699032509	/nfs/dbraw/zinc/03/25/09/699032509.db2.gz	PXNXOOWZHFXMFC-OUKQBFOZSA-N	1	1	319.361	1.135	20	5		DDBDMO
CN1CCC[N@H+](CCCNCc2csc([N+](=O)[O-])c2)CC1	ZINC000729683809	699485184	/nfs/dbraw/zinc/48/51/84/699485184.db2.gz	BNHMPKQQOOHIQE-UHFFFAOYSA-N	1	1	312.439	1.774	20	5		DDBDMO
CN1CCC[N@@H+](CCCNCc2csc([N+](=O)[O-])c2)CC1	ZINC000729683809	699485185	/nfs/dbraw/zinc/48/51/85/699485185.db2.gz	BNHMPKQQOOHIQE-UHFFFAOYSA-N	1	1	312.439	1.774	20	5		DDBDMO
C[C@@H]1CN(C(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])CCO1	ZINC000795222962	699852622	/nfs/dbraw/zinc/85/26/22/699852622.db2.gz	VAAAOFRIKZWVGK-GFCCVEGCSA-N	1	1	321.377	1.667	20	5		DDBDMO
Cc1cc2c(cc1[N+](=O)[O-])N(CCC[NH+]1CCOCC1)CC2	ZINC000754109100	700484458	/nfs/dbraw/zinc/48/44/58/700484458.db2.gz	IMFJQDMJPNOACO-UHFFFAOYSA-N	1	1	305.378	1.988	20	5		DDBDMO
COc1ccc(NC(=O)CN2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000761068763	700838268	/nfs/dbraw/zinc/83/82/68/700838268.db2.gz	JKEYCIQWFNGFHZ-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@@H+]1C	ZINC000763222883	700929586	/nfs/dbraw/zinc/92/95/86/700929586.db2.gz	DKLMVWOVASLBQK-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C	ZINC000763222883	700929587	/nfs/dbraw/zinc/92/95/87/700929587.db2.gz	DKLMVWOVASLBQK-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[C@@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000768843151	701208801	/nfs/dbraw/zinc/20/88/01/701208801.db2.gz	RIAPOFMRZYXWAD-IUCAKERBSA-N	1	1	319.408	1.417	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000808215932	701508335	/nfs/dbraw/zinc/50/83/35/701508335.db2.gz	FDWNDTLMJGVHGP-AWEZNQCLSA-N	1	1	323.397	1.604	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000808215932	701508336	/nfs/dbraw/zinc/50/83/36/701508336.db2.gz	FDWNDTLMJGVHGP-AWEZNQCLSA-N	1	1	323.397	1.604	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000810620468	701802995	/nfs/dbraw/zinc/80/29/95/701802995.db2.gz	HNWOIJJSDCGBQL-SECBINFHSA-N	1	1	304.306	1.927	20	5		DDBDMO
C[C@@H]1CC[N@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982280	701889303	/nfs/dbraw/zinc/88/93/03/701889303.db2.gz	CDAARUKHQXQVKT-IAQYHMDHSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982280	701889308	/nfs/dbraw/zinc/88/93/08/701889308.db2.gz	CDAARUKHQXQVKT-IAQYHMDHSA-N	1	1	305.334	1.831	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@](C)(CO)C1	ZINC000879261388	706633040	/nfs/dbraw/zinc/63/30/40/706633040.db2.gz	JMGVNWZFIXPNRL-ZNMIVQPWSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C2)C1	ZINC000868535303	702183248	/nfs/dbraw/zinc/18/32/48/702183248.db2.gz	REFVXADOGIATRI-INIZCTEOSA-N	1	1	321.352	1.831	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)n1	ZINC000866209057	706649119	/nfs/dbraw/zinc/64/91/19/706649119.db2.gz	PBMVOPDXBBHGPZ-PWSUYJOCSA-N	1	1	320.349	1.307	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000816954085	702237199	/nfs/dbraw/zinc/23/71/99/702237199.db2.gz	STGALXSLNNAYNT-NBVGUUKWSA-N	1	1	301.346	1.771	20	5		DDBDMO
CO[C@H](C)C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000813172857	702308323	/nfs/dbraw/zinc/30/83/23/702308323.db2.gz	OZQIRFUQJHGADM-RISCZKNCSA-N	1	1	308.334	1.747	20	5		DDBDMO
CO[C@H](C)C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000813172857	702308330	/nfs/dbraw/zinc/30/83/30/702308330.db2.gz	OZQIRFUQJHGADM-RISCZKNCSA-N	1	1	308.334	1.747	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000844447173	703032514	/nfs/dbraw/zinc/03/25/14/703032514.db2.gz	MXLKAAFWJTVTBZ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000844447173	703032517	/nfs/dbraw/zinc/03/25/17/703032517.db2.gz	MXLKAAFWJTVTBZ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CCN1C[C@H](C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)OC1=O	ZINC000846893002	703347782	/nfs/dbraw/zinc/34/77/82/703347782.db2.gz	DWEOHQXITBRUEZ-AWEZNQCLSA-N	1	1	307.350	1.910	20	5		DDBDMO
CCN1C[C@H](C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])OC1=O	ZINC000846901845	703349272	/nfs/dbraw/zinc/34/92/72/703349272.db2.gz	QGCQXFQUDUPCOX-ZDUSSCGKSA-N	1	1	307.350	1.910	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc1Cl	ZINC000848925736	703604337	/nfs/dbraw/zinc/60/43/37/703604337.db2.gz	FMQDGOQGAQRCRV-NWDGAFQWSA-N	1	1	311.769	1.499	20	5		DDBDMO
COC(CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)OC	ZINC000851843886	703868906	/nfs/dbraw/zinc/86/89/06/703868906.db2.gz	NYBWTXAJJLYTEE-LLVKDONJSA-N	1	1	310.354	1.485	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCCN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000853540925	704263476	/nfs/dbraw/zinc/26/34/76/704263476.db2.gz	NABGZEHPLIHRSI-SNVBAGLBSA-N	1	1	302.338	1.690	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC000853587166	704276842	/nfs/dbraw/zinc/27/68/42/704276842.db2.gz	FZHUKHOJHPWXHH-VXGBXAGGSA-N	1	1	317.349	1.574	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000821339811	704393445	/nfs/dbraw/zinc/39/34/45/704393445.db2.gz	IPBPFKCGURAISS-LBPRGKRZSA-N	1	1	303.362	1.821	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000821391163	704402821	/nfs/dbraw/zinc/40/28/21/704402821.db2.gz	IMSRUJKUYJIPJF-CYBMUJFWSA-N	1	1	315.801	1.993	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000874828747	705187209	/nfs/dbraw/zinc/18/72/09/705187209.db2.gz	HTYIKJFPUPURPI-CHWSQXEVSA-N	1	1	322.340	1.625	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1	ZINC000874845997	705200675	/nfs/dbraw/zinc/20/06/75/705200675.db2.gz	XBZSUSUIASOXQE-GJZGRUSLSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000823968692	705347079	/nfs/dbraw/zinc/34/70/79/705347079.db2.gz	YILNUUOTXZECBL-SNVBAGLBSA-N	1	1	319.365	1.949	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000823994246	705350774	/nfs/dbraw/zinc/35/07/74/705350774.db2.gz	ORGMDZKJXOJPSI-GFCCVEGCSA-N	1	1	319.365	1.783	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000893877129	710870642	/nfs/dbraw/zinc/87/06/42/710870642.db2.gz	UNAMCPZWJXPKNV-CYBMUJFWSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000861388074	705454720	/nfs/dbraw/zinc/45/47/20/705454720.db2.gz	FFFJEWSSBJISDQ-UHFFFAOYSA-N	1	1	316.317	1.643	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)CC(C)(C)C2)c1	ZINC000877752051	706199681	/nfs/dbraw/zinc/19/96/81/706199681.db2.gz	LZJDGKLJJXMRQX-CYBMUJFWSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)CC(C)(C)C2)c1	ZINC000877752051	706199682	/nfs/dbraw/zinc/19/96/82/706199682.db2.gz	LZJDGKLJJXMRQX-CYBMUJFWSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000829572828	706358668	/nfs/dbraw/zinc/35/86/68/706358668.db2.gz	ZLEONQWLJQGVDS-JTQLQIEISA-N	1	1	310.310	1.006	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000829572828	706358670	/nfs/dbraw/zinc/35/86/70/706358670.db2.gz	ZLEONQWLJQGVDS-JTQLQIEISA-N	1	1	310.310	1.006	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1	ZINC000880092305	706876895	/nfs/dbraw/zinc/87/68/95/706876895.db2.gz	MZSCYGMMOWYSQD-XQQFMLRXSA-N	1	1	321.377	1.929	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872772270	707593540	/nfs/dbraw/zinc/59/35/40/707593540.db2.gz	SABRUXSAYONFRD-LLVKDONJSA-N	1	1	320.353	1.160	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872772270	707593543	/nfs/dbraw/zinc/59/35/43/707593543.db2.gz	SABRUXSAYONFRD-LLVKDONJSA-N	1	1	320.353	1.160	20	5		DDBDMO
CCO[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000897068935	708222325	/nfs/dbraw/zinc/22/23/25/708222325.db2.gz	PNFGLENDJNRTDI-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000897068935	708222328	/nfs/dbraw/zinc/22/23/28/708222328.db2.gz	PNFGLENDJNRTDI-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897219630	708257164	/nfs/dbraw/zinc/25/71/64/708257164.db2.gz	MEXGMYHIKGALJH-CHWSQXEVSA-N	1	1	322.365	1.034	20	5		DDBDMO
C[C@@](O)(C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(F)F	ZINC000885935287	708666188	/nfs/dbraw/zinc/66/61/88/708666188.db2.gz	HGQQXSSGELMJIT-CQSZACIVSA-N	1	1	315.320	1.733	20	5		DDBDMO
O=[N+]([O-])CC[NH2+][C@H](CO)c1ccc(Br)c(F)c1	ZINC000930557250	713865709	/nfs/dbraw/zinc/86/57/09/713865709.db2.gz	BPSHQKDAEFKXPC-SNVBAGLBSA-N	1	1	307.119	1.488	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000889783129	709634076	/nfs/dbraw/zinc/63/40/76/709634076.db2.gz	VLWISJJKFTVIRV-LSDHHAIUSA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@@]2(C)C[C@H](O)C[N@H+]2C)cc1[N+](=O)[O-]	ZINC000900968694	709854561	/nfs/dbraw/zinc/85/45/61/709854561.db2.gz	WRMDPUMODKBGAS-DETPVDSQSA-N	1	1	321.377	1.536	20	5		DDBDMO
C[C@@H](NC(=O)CC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000928247074	713157359	/nfs/dbraw/zinc/15/73/59/713157359.db2.gz	PKSRVOUCOLFRDM-GFCCVEGCSA-N	1	1	307.350	1.494	20	5		DDBDMO
CN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000893264673	710582461	/nfs/dbraw/zinc/58/24/61/710582461.db2.gz	GOSGQAVRVOXNNL-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000928555321	713224796	/nfs/dbraw/zinc/22/47/96/713224796.db2.gz	OJIUNTCRXHZXRV-GFCCVEGCSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000928555321	713224797	/nfs/dbraw/zinc/22/47/97/713224797.db2.gz	OJIUNTCRXHZXRV-GFCCVEGCSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@@H+]1C	ZINC000928569790	713232927	/nfs/dbraw/zinc/23/29/27/713232927.db2.gz	RGLXLMCQQFYNDL-CMPLNLGQSA-N	1	1	309.391	1.896	20	5		DDBDMO
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+]1C	ZINC000928569790	713232930	/nfs/dbraw/zinc/23/29/30/713232930.db2.gz	RGLXLMCQQFYNDL-CMPLNLGQSA-N	1	1	309.391	1.896	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[NH+]2CCOCC2)c1C	ZINC000895464034	711518746	/nfs/dbraw/zinc/51/87/46/711518746.db2.gz	BXYKSGHJFCTONC-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000895701614	711581819	/nfs/dbraw/zinc/58/18/19/711581819.db2.gz	AYAUYZQTIRRUQW-HNNXBMFYSA-N	1	1	308.334	1.321	20	5		DDBDMO
Cc1ccc(CNC(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000896219942	711693535	/nfs/dbraw/zinc/69/35/35/711693535.db2.gz	JMEWOKOFZXWPCK-ZFWWWQNUSA-N	1	1	318.377	1.749	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1	ZINC000917228687	713488385	/nfs/dbraw/zinc/48/83/85/713488385.db2.gz	ZJMIPDVHVTWJMD-QMMMGPOBSA-N	1	1	316.155	1.613	20	5		DDBDMO
C[N@H+]1CCC[C@H]1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1	ZINC000917228687	713488387	/nfs/dbraw/zinc/48/83/87/713488387.db2.gz	ZJMIPDVHVTWJMD-QMMMGPOBSA-N	1	1	316.155	1.613	20	5		DDBDMO
O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(C(F)(F)F)cc1	ZINC000905116646	711941404	/nfs/dbraw/zinc/94/14/04/711941404.db2.gz	HYBKRFFXXAYYLM-LLVKDONJSA-N	1	1	317.267	1.677	20	5		DDBDMO
O=C1[C@@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(F)c(Cl)c1	ZINC000905202481	711966680	/nfs/dbraw/zinc/96/66/80/711966680.db2.gz	MNGPPPIBJBTEQJ-NSHDSACASA-N	1	1	301.705	1.451	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H](C3OCCO3)C2)c1	ZINC000905696097	712121749	/nfs/dbraw/zinc/12/17/49/712121749.db2.gz	SYZMCVHPUZKARB-LLVKDONJSA-N	1	1	318.333	1.597	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCO[C@@H]3CCOC3)C2)nc1	ZINC000929988916	713730009	/nfs/dbraw/zinc/73/00/09/713730009.db2.gz	OOYWMASFHLUNNZ-TZMCWYRMSA-N	1	1	322.365	1.282	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCCS1(=O)=O	ZINC000930354565	713812575	/nfs/dbraw/zinc/81/25/75/713812575.db2.gz	QBEZIWRKULLONV-CQSZACIVSA-N	1	1	312.391	1.646	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCCS1(=O)=O	ZINC000930354565	713812579	/nfs/dbraw/zinc/81/25/79/713812579.db2.gz	QBEZIWRKULLONV-CQSZACIVSA-N	1	1	312.391	1.646	20	5		DDBDMO
CC[N@@H+](C)Cc1cc(O[C@@H]2CCN(CC[N+](=O)[O-])C2)ccn1	ZINC000931095198	714000378	/nfs/dbraw/zinc/00/03/78/714000378.db2.gz	WYCXBPYDMUSYFA-OAHLLOKOSA-N	1	1	308.382	1.263	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000931564208	714129238	/nfs/dbraw/zinc/12/92/38/714129238.db2.gz	VINJQZMPGZQNOI-CHWSQXEVSA-N	1	1	313.398	1.985	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000931564211	714129327	/nfs/dbraw/zinc/12/93/27/714129327.db2.gz	VINJQZMPGZQNOI-STQMWFEESA-N	1	1	313.398	1.985	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](C3OCCO3)C2)cc1	ZINC000932003464	714230776	/nfs/dbraw/zinc/23/07/76/714230776.db2.gz	PWASTLKWPCSLRX-JSGCOSHPSA-N	1	1	308.334	1.323	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000923330845	714317109	/nfs/dbraw/zinc/31/71/09/714317109.db2.gz	CJSDOWYUUOJWJF-SLBVQIDZSA-N	1	1	305.378	1.687	20	5		DDBDMO
C[C@@H]1C[C@H](C)N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C[NH3+]	ZINC000923379846	714334773	/nfs/dbraw/zinc/33/47/73/714334773.db2.gz	ABGFVIVNJNLOMI-FAXLKDOZSA-N	1	1	307.394	1.933	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000933171384	714527280	/nfs/dbraw/zinc/52/72/80/714527280.db2.gz	STKQZOXRRYPUAP-UXIGCNINSA-N	1	1	322.361	1.902	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120441	714747359	/nfs/dbraw/zinc/74/73/59/714747359.db2.gz	HFAHTNJCMULCOG-AAEUAGOBSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120441	714747360	/nfs/dbraw/zinc/74/73/60/714747360.db2.gz	HFAHTNJCMULCOG-AAEUAGOBSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000925345678	714822446	/nfs/dbraw/zinc/82/24/46/714822446.db2.gz	XRTKDYAZUDWVDN-IUODEOHRSA-N	1	1	320.393	1.871	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000925345677	714822455	/nfs/dbraw/zinc/82/24/55/714822455.db2.gz	XRTKDYAZUDWVDN-DOMZBBRYSA-N	1	1	320.393	1.871	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(CC)CCNc1ccc([N+](=O)[O-])cn1	ZINC001106809502	746138268	/nfs/dbraw/zinc/13/82/68/746138268.db2.gz	VJDMNECXCRCRHP-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)CS(C)(=O)=O	ZINC001200471546	748265333	/nfs/dbraw/zinc/26/53/33/748265333.db2.gz	NQNYFYZHBNHWBQ-SNVBAGLBSA-N	1	1	316.379	1.516	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH+](CC2CC2)CC2CC2)CC1	ZINC001039485539	762071925	/nfs/dbraw/zinc/07/19/25/762071925.db2.gz	DOAVHJBDCWIWRH-HZPDHXFCSA-N	1	1	321.421	1.765	20	5		DDBDMO
CCCC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2	ZINC001035186648	751269001	/nfs/dbraw/zinc/26/90/01/751269001.db2.gz	HXZBGWMOGAGPPK-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCCC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035186648	751269007	/nfs/dbraw/zinc/26/90/07/751269007.db2.gz	HXZBGWMOGAGPPK-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCCC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035186648	751269014	/nfs/dbraw/zinc/26/90/14/751269014.db2.gz	HXZBGWMOGAGPPK-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
COC[C@H]1Cn2nccc2C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169026719	762203069	/nfs/dbraw/zinc/20/30/69/762203069.db2.gz	NLIUFLOZFOOPOV-BFHYXJOUSA-N	1	1	308.382	1.407	20	5		DDBDMO
COC(=O)c1cnc2c(c1)C[N@@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169055914	762209771	/nfs/dbraw/zinc/20/97/71/762209771.db2.gz	RFGKWGUWYYRBGX-FZMZJTMJSA-N	1	1	319.361	1.672	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001097212185	756980922	/nfs/dbraw/zinc/98/09/22/756980922.db2.gz	NNGQLYHUSTYPQI-OKILXGFUSA-N	1	1	320.393	1.996	20	5		DDBDMO
CC1(C)CC(C[NH+]2CCC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC001001400321	762826355	/nfs/dbraw/zinc/82/63/55/762826355.db2.gz	QJEQZWRQPXNIHA-HUUCEWRRSA-N	1	1	323.437	1.916	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCOC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC001170335726	766257386	/nfs/dbraw/zinc/25/73/86/766257386.db2.gz	QPIBKPMOHIEPAV-MLGOLLRUSA-N	1	1	324.377	1.618	20	5		DDBDMO
O=C(C1CC1)N1C[C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048635542	769603382	/nfs/dbraw/zinc/60/33/82/769603382.db2.gz	CDGRDRWUVKGHKV-BETUJISGSA-N	1	1	321.402	1.957	20	5		DDBDMO
O=C(C1CC1)N1C[C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048635542	769603384	/nfs/dbraw/zinc/60/33/84/769603384.db2.gz	CDGRDRWUVKGHKV-BETUJISGSA-N	1	1	321.402	1.957	20	5		DDBDMO
CC[C@]([NH3+])(CO)Nc1nccc(Br)c1[N+](=O)[O-]	ZINC001170865266	771778059	/nfs/dbraw/zinc/77/80/59/771778059.db2.gz	ZVJVUJSAUDKUFG-SECBINFHSA-N	1	1	305.132	1.222	20	5		DDBDMO
Cc1cc(N[C@@H](N)CCC[NH3+])nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC001170897296	771897212	/nfs/dbraw/zinc/89/72/12/771897212.db2.gz	LXNCSKFUEFWSON-CYBMUJFWSA-N	1	1	316.365	1.796	20	5		DDBDMO
Cc1ccnc(NCCNC(=O)C[N@H+](C)C2CCC2)c1[N+](=O)[O-]	ZINC001094221356	775541100	/nfs/dbraw/zinc/54/11/00/775541100.db2.gz	AUCIDWBYNJUIKI-UHFFFAOYSA-N	1	1	321.381	1.311	20	5		DDBDMO
COC(=O)[C@H](CN)C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172901364	776915881	/nfs/dbraw/zinc/91/58/81/776915881.db2.gz	MLFIQNNPCBLZCV-KGLIPLIRSA-N	1	1	321.377	1.180	20	5		DDBDMO
O=C1OCC[C@@]12CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001177001139	778383666	/nfs/dbraw/zinc/38/36/66/778383666.db2.gz	BZDITDKELZAOGV-CQSZACIVSA-N	1	1	321.289	1.642	20	5		DDBDMO
O=C1OCC[C@@]12CC[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001177001139	778383670	/nfs/dbraw/zinc/38/36/70/778383670.db2.gz	BZDITDKELZAOGV-CQSZACIVSA-N	1	1	321.289	1.642	20	5		DDBDMO
Cc1nocc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178458354	779058477	/nfs/dbraw/zinc/05/84/77/779058477.db2.gz	CKEDBJCRZMHPKM-ZIAGYGMSSA-N	1	1	324.381	1.414	20	5		DDBDMO
CCc1noc(C)c1C[NH2+]CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268791207	840818587	/nfs/dbraw/zinc/81/85/87/840818587.db2.gz	MYVDLBULLGVAAX-BXUZGUMPSA-N	1	1	324.381	1.149	20	5		DDBDMO
O=C(CCc1cnc[nH]1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC001326852446	861660116	/nfs/dbraw/zinc/66/01/16/861660116.db2.gz	JEPSGXCDYSXXHG-UHFFFAOYSA-N	1	1	318.337	1.311	20	5		DDBDMO
COc1ncnc2c1CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169021298	850518357	/nfs/dbraw/zinc/51/83/57/850518357.db2.gz	KLLPFFRQTUERTH-VXGBXAGGSA-N	1	1	306.366	1.331	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC001121918265	858633108	/nfs/dbraw/zinc/63/31/08/858633108.db2.gz	DEHUSFDCVPKUFH-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H](O)CC1(O)CCC1)CC2	ZINC001329224490	863546528	/nfs/dbraw/zinc/54/65/28/863546528.db2.gz	YHXITANBWMPPBU-OAHLLOKOSA-N	1	1	306.362	1.619	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)CC1(O)CCC1)CC2	ZINC001329224490	863546533	/nfs/dbraw/zinc/54/65/33/863546533.db2.gz	YHXITANBWMPPBU-OAHLLOKOSA-N	1	1	306.362	1.619	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3cc([N+](=O)[O-])cc(Cl)[n+]3[O-])C[C@H]21	ZINC001157271047	863700589	/nfs/dbraw/zinc/70/05/89/863700589.db2.gz	HGXSPGPUIWXBTK-MWLCHTKSSA-N	1	1	312.757	1.412	20	5		DDBDMO
COc1ncnc(NCC[C@H]2CC[NH2+]CC2(F)F)c1[N+](=O)[O-]	ZINC001162810280	867844702	/nfs/dbraw/zinc/84/47/02/867844702.db2.gz	KEHSYCLPSYRFEC-MRVPVSSYSA-N	1	1	317.296	1.440	20	5		DDBDMO
Nc1cc(NCC[C@@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-]	ZINC001162813675	867847144	/nfs/dbraw/zinc/84/71/44/867847144.db2.gz	YAYLIDKJRIZVBK-QMMMGPOBSA-N	1	1	301.297	1.619	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C[C@H](OC)C(F)(F)F)c1[N+](=O)[O-]	ZINC001335441810	868299329	/nfs/dbraw/zinc/29/93/29/868299329.db2.gz	UQERIECOBLWFCI-VIFPVBQESA-N	1	1	324.255	1.976	20	5		DDBDMO
CNc1cc([N+](=O)[O-])cnc1NCC1(N(C)C)CC[NH+](C)CC1	ZINC001164211877	869018717	/nfs/dbraw/zinc/01/87/17/869018717.db2.gz	UUCICZSHICABNW-UHFFFAOYSA-N	1	1	322.413	1.469	20	5		DDBDMO
[NH3+][C@H]1CN(c2ncnc3cccc([N+](=O)[O-])c32)CCC1(F)F	ZINC001164327710	869130952	/nfs/dbraw/zinc/13/09/52/869130952.db2.gz	PYEFTNUKTOUYNU-JTQLQIEISA-N	1	1	309.276	1.711	20	5		DDBDMO
Cc1oncc1C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494559	869232437	/nfs/dbraw/zinc/23/24/37/869232437.db2.gz	MGKVCXDBEPLFOC-CHWSQXEVSA-N	1	1	322.365	1.024	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC001337837313	869653217	/nfs/dbraw/zinc/65/32/17/869653217.db2.gz	ZXRKZUFYVVHDNO-MELADBBJSA-N	1	1	303.362	1.973	20	5		DDBDMO
Cc1cccc(NC[C@@]2(CO)COC[C@@H]3CCC[N@H+]32)c1[N+](=O)[O-]	ZINC001338162753	869842749	/nfs/dbraw/zinc/84/27/49/869842749.db2.gz	MOWNPCGUQRPUCT-XJKSGUPXSA-N	1	1	321.377	1.541	20	5		DDBDMO
Nc1ccn(Cc2[nH+]ccn2CC(F)(F)F)c(=O)c1[N+](=O)[O-]	ZINC001166501171	870029929	/nfs/dbraw/zinc/02/99/29/870029929.db2.gz	OOWBIMAQMNHOKP-UHFFFAOYSA-N	1	1	317.227	1.146	20	5		DDBDMO
CC(CC(=O)OC(C)C)=Nc1ncnc(C2C[NH2+]C2)c1[N+](=O)[O-]	ZINC001166748612	870219147	/nfs/dbraw/zinc/21/91/47/870219147.db2.gz	ZQMCDUCHXOHHLK-WTKPLQERSA-N	1	1	321.337	1.339	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C[C@H](C)[N@H+]1C	ZINC001298676636	870669801	/nfs/dbraw/zinc/66/98/01/870669801.db2.gz	IXOXXSBZDVAIJL-KNVOCYPGSA-N	1	1	301.734	1.136	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C[C@H](C)[N@@H+]1C	ZINC001298676636	870669808	/nfs/dbraw/zinc/66/98/08/870669808.db2.gz	IXOXXSBZDVAIJL-KNVOCYPGSA-N	1	1	301.734	1.136	20	5		DDBDMO
O=C(CCCF)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC001318146369	871778316	/nfs/dbraw/zinc/77/83/16/871778316.db2.gz	RFHIRXXJJHQLEQ-UHFFFAOYSA-N	1	1	309.341	1.893	20	5		DDBDMO
CCc1[nH+]ccn1CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC001213722735	876029988	/nfs/dbraw/zinc/02/99/88/876029988.db2.gz	MYBSOSMUNPXFEE-UHFFFAOYSA-N	1	1	324.362	1.332	20	5		DDBDMO
COC(=O)[C@H](O[C@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC001223644524	881039008	/nfs/dbraw/zinc/03/90/08/881039008.db2.gz	VHJWCLKWPXEDKR-SMDDNHRTSA-N	1	1	308.334	1.920	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228813267	883683806	/nfs/dbraw/zinc/68/38/06/883683806.db2.gz	AKEHBKLNUWUSJH-JTQLQIEISA-N	1	1	324.333	1.950	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228813267	883683816	/nfs/dbraw/zinc/68/38/16/883683816.db2.gz	AKEHBKLNUWUSJH-JTQLQIEISA-N	1	1	324.333	1.950	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccn[nH]1)Cc1cccc([N+](=O)[O-])c1	ZINC001234243575	887783815	/nfs/dbraw/zinc/78/38/15/887783815.db2.gz	JOLXFUBBRJHLPY-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[C@H]1C(=O)NCC[N@@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478765	896457015	/nfs/dbraw/zinc/45/70/15/896457015.db2.gz	IXXOUTZZSNRJDX-LBPRGKRZSA-N	1	1	318.377	1.384	20	5		DDBDMO
C[C@H]1C(=O)NCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478765	896457022	/nfs/dbraw/zinc/45/70/22/896457022.db2.gz	IXXOUTZZSNRJDX-LBPRGKRZSA-N	1	1	318.377	1.384	20	5		DDBDMO
O=C1NCC[C@]12CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254594363	896522226	/nfs/dbraw/zinc/52/22/26/896522226.db2.gz	QIINQQHGKCDKHJ-GOEBONIOSA-N	1	1	301.346	1.274	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@H](N3CCOCC3)C1)C2	ZINC001254601424	896524826	/nfs/dbraw/zinc/52/48/26/896524826.db2.gz	ZSBKLWOGNIYUIX-DLBZAZTESA-N	1	1	317.389	1.469	20	5		DDBDMO
C[N@@H+]([C@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CCS(=O)(=O)CC1	ZINC001254605065	896526450	/nfs/dbraw/zinc/52/64/50/896526450.db2.gz	ZWYGSDCWJWULIC-HNNXBMFYSA-N	1	1	324.402	1.571	20	5		DDBDMO
Cc1cc(NC(=O)C2C[NH+]([C@H]3CCOC3)C2)cc([N+](=O)[O-])c1	ZINC001264010884	900871291	/nfs/dbraw/zinc/87/12/91/900871291.db2.gz	NTGOPCKNHJMBAM-ZDUSSCGKSA-N	1	1	305.334	1.562	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)[NH+]1CCOCC1	ZINC000278374415	214124281	/nfs/dbraw/zinc/12/42/81/214124281.db2.gz	DTEKGMJHBFBTON-GHMZBOCLSA-N	1	1	319.365	1.992	20	5		DDBDMO
CN1CC[NH+](CCCn2cc([N+](=O)[O-])cc(Cl)c2=O)CC1	ZINC000272863891	210257548	/nfs/dbraw/zinc/25/75/48/210257548.db2.gz	VBSDFGLEFNEDIP-UHFFFAOYSA-N	1	1	314.773	1.047	20	5		DDBDMO
C[C@H]1[C@@H](O)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457350	231101965	/nfs/dbraw/zinc/10/19/65/231101965.db2.gz	MGWQVHCBVYCNJO-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H]1[C@@H](O)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457350	231101968	/nfs/dbraw/zinc/10/19/68/231101968.db2.gz	MGWQVHCBVYCNJO-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000452113977	231306137	/nfs/dbraw/zinc/30/61/37/231306137.db2.gz	JDDJVBZRAOBHFN-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
COCCC[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000614996518	362111113	/nfs/dbraw/zinc/11/11/13/362111113.db2.gz	HSIWVPUNRSAELF-UHFFFAOYSA-N	1	1	309.322	1.567	20	5		DDBDMO
C[N@@H+](CC(C)(C)CO)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000451260357	529848236	/nfs/dbraw/zinc/84/82/36/529848236.db2.gz	ZKUVJAYKYVXOHT-CQSZACIVSA-N	1	1	321.377	1.650	20	5		DDBDMO
CN(CC(=O)N(C)[C@@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000266333745	282339942	/nfs/dbraw/zinc/33/99/42/282339942.db2.gz	WJELZZUJZGSIGL-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[NH2+]C[C@H](C)CNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414844968	529999018	/nfs/dbraw/zinc/99/90/18/529999018.db2.gz	RZNNYFGZLKXWMH-LBPRGKRZSA-N	1	1	317.393	1.940	20	5		DDBDMO
C[N@@H+](CCCCCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000279693286	215066549	/nfs/dbraw/zinc/06/65/49/215066549.db2.gz	HYKHGVNOMJXLAN-UHFFFAOYSA-N	1	1	321.377	1.578	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+]Cc3ccccc32)ccc1[N+](=O)[O-]	ZINC000261942619	282568591	/nfs/dbraw/zinc/56/85/91/282568591.db2.gz	LTJBNIPNWSJXNA-UHFFFAOYSA-N	1	1	300.318	1.683	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](CO)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000279953846	215266867	/nfs/dbraw/zinc/26/68/67/215266867.db2.gz	YZUAVVRZDDGWPZ-LBPRGKRZSA-N	1	1	319.361	1.188	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](CO)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000279953846	215266870	/nfs/dbraw/zinc/26/68/70/215266870.db2.gz	YZUAVVRZDDGWPZ-LBPRGKRZSA-N	1	1	319.361	1.188	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000181878947	186214430	/nfs/dbraw/zinc/21/44/30/186214430.db2.gz	SIPZURBNOKEKJI-KBPBESRZSA-N	1	1	324.377	1.693	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)n1	ZINC000191854495	186264771	/nfs/dbraw/zinc/26/47/71/186264771.db2.gz	VMXLUOKTKZIKBP-NEPJUHHUSA-N	1	1	321.381	1.368	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000264264189	186332438	/nfs/dbraw/zinc/33/24/38/186332438.db2.gz	JYRLDHQUUQARIH-UHFFFAOYSA-N	1	1	324.356	1.101	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000281322773	186523826	/nfs/dbraw/zinc/52/38/26/186523826.db2.gz	YECQAMMQYQKFMN-HNNXBMFYSA-N	1	1	307.350	1.561	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCO[C@H](C)C1	ZINC000026342639	352208203	/nfs/dbraw/zinc/20/82/03/352208203.db2.gz	SNQDMJHBKJWJPA-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C)C1	ZINC000026342639	352208205	/nfs/dbraw/zinc/20/82/05/352208205.db2.gz	SNQDMJHBKJWJPA-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000041926523	352318874	/nfs/dbraw/zinc/31/88/74/352318874.db2.gz	FBFFEYAYICOISK-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
COC1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000053898174	352670753	/nfs/dbraw/zinc/67/07/53/352670753.db2.gz	VGJVGZFLNGJQJN-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000061205603	352885565	/nfs/dbraw/zinc/88/55/65/352885565.db2.gz	UDTWCZOVMSVTBJ-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000067413287	353047612	/nfs/dbraw/zinc/04/76/12/353047612.db2.gz	WBUCLYVHMDQEET-HNNXBMFYSA-N	1	1	305.378	1.985	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H](C[NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000174321503	198318895	/nfs/dbraw/zinc/31/88/95/198318895.db2.gz	VBIKHVAJGDKCAG-LLVKDONJSA-N	1	1	321.381	1.438	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000174705039	198372835	/nfs/dbraw/zinc/37/28/35/198372835.db2.gz	CJIWUNZYYZCYRC-NSHDSACASA-N	1	1	323.349	1.246	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccccc2)C2CC2)c1	ZINC000174715832	198373679	/nfs/dbraw/zinc/37/36/79/198373679.db2.gz	BTRPZOLFKTVCCP-INIZCTEOSA-N	1	1	316.361	1.817	20	5		DDBDMO
Cc1nc(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000090146177	353791525	/nfs/dbraw/zinc/79/15/25/353791525.db2.gz	LVJXVQPFSQPTJQ-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1nc(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000090146177	353791527	/nfs/dbraw/zinc/79/15/27/353791527.db2.gz	LVJXVQPFSQPTJQ-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+](CCO)C1CCCCC1	ZINC000090565236	353795495	/nfs/dbraw/zinc/79/54/95/353795495.db2.gz	LHDIJMYYDBPPFA-UHFFFAOYSA-N	1	1	309.366	1.384	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@H](O)C1	ZINC000093343810	353897710	/nfs/dbraw/zinc/89/77/10/353897710.db2.gz	KLMZZELQQXHDAC-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000108342753	353951333	/nfs/dbraw/zinc/95/13/33/353951333.db2.gz	GILLHDNGKFHMJM-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055449	354228773	/nfs/dbraw/zinc/22/87/73/354228773.db2.gz	CACLFRXXZRBNNI-AAEUAGOBSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055449	354228777	/nfs/dbraw/zinc/22/87/77/354228777.db2.gz	CACLFRXXZRBNNI-AAEUAGOBSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H](O)C1CC1	ZINC000305239887	354469817	/nfs/dbraw/zinc/46/98/17/354469817.db2.gz	QLOPQBJCUKUMRD-OAHLLOKOSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H](O)C1CC1	ZINC000305239887	354469820	/nfs/dbraw/zinc/46/98/20/354469820.db2.gz	QLOPQBJCUKUMRD-OAHLLOKOSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](Nc1cc(N)c([N+](=O)[O-])c(CO)c1)[C@H](C)[NH+]1CCOCC1	ZINC000587882051	354886221	/nfs/dbraw/zinc/88/62/21/354886221.db2.gz	RVBINPWAZUTNER-QWRGUYRKSA-N	1	1	324.381	1.190	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588861873	354944154	/nfs/dbraw/zinc/94/41/54/354944154.db2.gz	VTYRTBXSUPIVGC-NWDGAFQWSA-N	1	1	323.324	1.015	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@H]2CCCO2)c1	ZINC000589494150	354996025	/nfs/dbraw/zinc/99/60/25/354996025.db2.gz	GCHYUJLICWYEEL-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@H]2CCCO2)c1	ZINC000589494150	354996028	/nfs/dbraw/zinc/99/60/28/354996028.db2.gz	GCHYUJLICWYEEL-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1	ZINC000590045623	355043757	/nfs/dbraw/zinc/04/37/57/355043757.db2.gz	SKKDWERJXVPTKH-NJZAAPMLSA-N	1	1	303.362	1.861	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000590548467	355110952	/nfs/dbraw/zinc/11/09/52/355110952.db2.gz	FBVBGUNVRJWQIY-QWHCGFSZSA-N	1	1	319.361	1.184	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]([NH+](C)C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000590403651	355085622	/nfs/dbraw/zinc/08/56/22/355085622.db2.gz	LLZRDAJUGYRHRW-VHSXEESVSA-N	1	1	309.370	1.606	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000592205585	355536999	/nfs/dbraw/zinc/53/69/99/355536999.db2.gz	DBOWGBVAMPIWTL-QKCSRTOESA-N	1	1	308.334	1.512	20	5		DDBDMO
CCCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592832113	355707063	/nfs/dbraw/zinc/70/70/63/355707063.db2.gz	QGQURPPYGOWQDV-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCN(c2nncn2C)CC1	ZINC000594612849	356265899	/nfs/dbraw/zinc/26/58/99/356265899.db2.gz	NCXGCZBMBBUADW-UHFFFAOYSA-N	1	1	316.365	1.354	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595494871	356517859	/nfs/dbraw/zinc/51/78/59/356517859.db2.gz	CMSZEHUVAJISER-GFCCVEGCSA-N	1	1	310.354	1.629	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595494871	356517862	/nfs/dbraw/zinc/51/78/62/356517862.db2.gz	CMSZEHUVAJISER-GFCCVEGCSA-N	1	1	310.354	1.629	20	5		DDBDMO
Cc1ccc2c(c1)C[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000595657527	356594726	/nfs/dbraw/zinc/59/47/26/356594726.db2.gz	MKNGNUAQGDWKRP-INIZCTEOSA-N	1	1	316.361	1.519	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595767447	356644293	/nfs/dbraw/zinc/64/42/93/356644293.db2.gz	XKZTXERIGOUDCY-RWMBFGLXSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595757042	356638437	/nfs/dbraw/zinc/63/84/37/356638437.db2.gz	LJOBUPVWQCGXJP-JRPNMDOOSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595757042	356638440	/nfs/dbraw/zinc/63/84/40/356638440.db2.gz	LJOBUPVWQCGXJP-JRPNMDOOSA-N	1	1	305.334	1.379	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@]2(O)C[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595759606	356640627	/nfs/dbraw/zinc/64/06/27/356640627.db2.gz	XSWGROGHVLQOOZ-XHDPSFHLSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595829064	356666817	/nfs/dbraw/zinc/66/68/17/356666817.db2.gz	GZIPKAKGGPCPEG-STQMWFEESA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595829064	356666819	/nfs/dbraw/zinc/66/68/19/356666819.db2.gz	GZIPKAKGGPCPEG-STQMWFEESA-N	1	1	319.361	1.810	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)cs1	ZINC000595866385	356684184	/nfs/dbraw/zinc/68/41/84/356684184.db2.gz	LFNAITSJJSULQB-ZDUSSCGKSA-N	1	1	311.407	1.687	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](F)[C@H](N)C2)cccc1[N+](=O)[O-]	ZINC000595906848	356700955	/nfs/dbraw/zinc/70/09/55/356700955.db2.gz	OISAGILRIMBPST-VXGBXAGGSA-N	1	1	324.356	1.603	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@@H](F)[C@H](N)C2)cccc1[N+](=O)[O-]	ZINC000595906848	356700960	/nfs/dbraw/zinc/70/09/60/356700960.db2.gz	OISAGILRIMBPST-VXGBXAGGSA-N	1	1	324.356	1.603	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1	ZINC000595915181	356703499	/nfs/dbraw/zinc/70/34/99/356703499.db2.gz	KWJAWZSCYDCDRB-QEJZJMRPSA-N	1	1	308.382	1.807	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])C[C@H](C)O1	ZINC000596071068	356761884	/nfs/dbraw/zinc/76/18/84/356761884.db2.gz	XIBSXZWNBDKMDX-PHIMTYICSA-N	1	1	310.354	1.607	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596146732	356791311	/nfs/dbraw/zinc/79/13/11/356791311.db2.gz	IPBQWBODQCQTLS-UHFFFAOYSA-N	1	1	310.354	1.242	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H](C)C1	ZINC000596136092	356786452	/nfs/dbraw/zinc/78/64/52/356786452.db2.gz	HCUIDCOHBPWMAQ-RISCZKNCSA-N	1	1	320.393	1.860	20	5		DDBDMO
CCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](CC)C1	ZINC000598042773	357439443	/nfs/dbraw/zinc/43/94/43/357439443.db2.gz	YATPBODSMDUCKK-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NC3CC([NH+]4CCOCC4)C3)[nH]c2c1	ZINC000599095853	357814171	/nfs/dbraw/zinc/81/41/71/357814171.db2.gz	WPRNRCQXCSLLDR-UHFFFAOYSA-N	1	1	317.349	1.168	20	5		DDBDMO
Cn1cc(CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)nn1	ZINC000599333898	357897723	/nfs/dbraw/zinc/89/77/23/357897723.db2.gz	BMHSWZKTGYKOGE-UHFFFAOYSA-N	1	1	301.350	1.930	20	5		DDBDMO
C/C=C/C[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000599689904	358027142	/nfs/dbraw/zinc/02/71/42/358027142.db2.gz	LLRZMWMUWOUTCZ-MZSZDEQASA-N	1	1	308.382	1.830	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@H](O)CO)cs2)c1	ZINC000276706002	213058027	/nfs/dbraw/zinc/05/80/27/213058027.db2.gz	FYJRPHLAAHGELG-LBPRGKRZSA-N	1	1	309.347	1.161	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000600313120	358193439	/nfs/dbraw/zinc/19/34/39/358193439.db2.gz	HXEYEHYAIFVWLX-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@@H]2COCCN2)c1	ZINC000600677248	358280361	/nfs/dbraw/zinc/28/03/61/358280361.db2.gz	CWZAPKYVJPKINT-SNVBAGLBSA-N	1	1	317.292	1.274	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1	ZINC000276627922	213009000	/nfs/dbraw/zinc/00/90/00/213009000.db2.gz	VRYGDUKREGRVPS-NWDGAFQWSA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1nc(N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000565579969	304077030	/nfs/dbraw/zinc/07/70/30/304077030.db2.gz	OXGREKMDVBFPGM-QWHCGFSZSA-N	1	1	321.381	1.749	20	5		DDBDMO
C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ncc(F)cc1[N+](=O)[O-]	ZINC000601191190	358440671	/nfs/dbraw/zinc/44/06/71/358440671.db2.gz	JZYNVPRVGYUCIL-NSHDSACASA-N	1	1	313.377	1.813	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ncc(F)cc1[N+](=O)[O-]	ZINC000601191190	358440675	/nfs/dbraw/zinc/44/06/75/358440675.db2.gz	JZYNVPRVGYUCIL-NSHDSACASA-N	1	1	313.377	1.813	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602476383	359003758	/nfs/dbraw/zinc/00/37/58/359003758.db2.gz	MJJIZRIVVLQPIJ-JTQLQIEISA-N	1	1	310.354	1.492	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602476383	359003760	/nfs/dbraw/zinc/00/37/60/359003760.db2.gz	MJJIZRIVVLQPIJ-JTQLQIEISA-N	1	1	310.354	1.492	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])n1	ZINC000602620621	359078408	/nfs/dbraw/zinc/07/84/08/359078408.db2.gz	YNAHQTCNGZFUEX-MRXNPFEDSA-N	1	1	314.345	1.960	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@]3(C2)OCc2ccccc23)c([N+](=O)[O-])n1	ZINC000602620621	359078413	/nfs/dbraw/zinc/07/84/13/359078413.db2.gz	YNAHQTCNGZFUEX-MRXNPFEDSA-N	1	1	314.345	1.960	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1	ZINC000602795321	359198262	/nfs/dbraw/zinc/19/82/62/359198262.db2.gz	HUHOLHMXOWNHJD-TZMCWYRMSA-N	1	1	318.381	1.879	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]([C@H]2CCOC2)C1	ZINC000602796884	359199491	/nfs/dbraw/zinc/19/94/91/359199491.db2.gz	ALCHBFJFLALGSF-KBPBESRZSA-N	1	1	308.382	1.848	20	5		DDBDMO
COC[C@](C)(CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000602933118	359303660	/nfs/dbraw/zinc/30/36/60/359303660.db2.gz	RTMCSMKWNGUMQJ-HNNXBMFYSA-N	1	1	312.366	1.869	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1Cn1cc(C[NH+]2CCCC2)nn1	ZINC000603203930	359479129	/nfs/dbraw/zinc/47/91/29/359479129.db2.gz	RXWRRUJPIYHQBL-UHFFFAOYSA-N	1	1	305.313	1.970	20	5		DDBDMO
C[N@@H+](CCn1ccc(N)c([N+](=O)[O-])c1=O)Cc1ccccc1	ZINC000603419831	359629409	/nfs/dbraw/zinc/62/94/09/359629409.db2.gz	AVPVZOHORCTNBO-UHFFFAOYSA-N	1	1	302.334	1.471	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCCO)C1CC1	ZINC000610132992	360385072	/nfs/dbraw/zinc/38/50/72/360385072.db2.gz	PHJQXDGAEIQWOS-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCCO)C1CC1	ZINC000610132992	360385077	/nfs/dbraw/zinc/38/50/77/360385077.db2.gz	PHJQXDGAEIQWOS-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCC1	ZINC000611185703	360653429	/nfs/dbraw/zinc/65/34/29/360653429.db2.gz	OJDAFRHPBZXCPS-UHFFFAOYSA-N	1	1	309.366	1.648	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000611087359	360619078	/nfs/dbraw/zinc/61/90/78/360619078.db2.gz	BOJVPDDJSCYCCG-GFCCVEGCSA-N	1	1	321.377	1.699	20	5		DDBDMO
CC[N@H+]1CCN([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092300	360621362	/nfs/dbraw/zinc/62/13/62/360621362.db2.gz	ODQPXSBFMFBKHQ-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC(C)[NH2+][C@H]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000611555698	360757434	/nfs/dbraw/zinc/75/74/34/360757434.db2.gz	URFYBBXRJVYCFJ-LBPRGKRZSA-N	1	1	307.350	1.903	20	5		DDBDMO
CC1(C)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O	ZINC000619221243	363937715	/nfs/dbraw/zinc/93/77/15/363937715.db2.gz	BKKPHJKRJNWJTA-CQSZACIVSA-N	1	1	308.334	1.569	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O	ZINC000619221243	363937718	/nfs/dbraw/zinc/93/77/18/363937718.db2.gz	BKKPHJKRJNWJTA-CQSZACIVSA-N	1	1	308.334	1.569	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000619578851	364070705	/nfs/dbraw/zinc/07/07/05/364070705.db2.gz	SAORSRHOXZELHL-NSHDSACASA-N	1	1	309.370	1.193	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](O)CC1	ZINC000293061555	223377296	/nfs/dbraw/zinc/37/72/96/223377296.db2.gz	IMNDROKKUWQIEM-RISCZKNCSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](O)CC1	ZINC000293061555	223377297	/nfs/dbraw/zinc/37/72/97/223377297.db2.gz	IMNDROKKUWQIEM-RISCZKNCSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NCC[NH+]1CCSCC1	ZINC000264801749	204166400	/nfs/dbraw/zinc/16/64/00/204166400.db2.gz	MYHARPOLJRJJRE-UHFFFAOYSA-N	1	1	309.391	1.302	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[NH+]2CCN(C)CC2)c1	ZINC000266012910	205026294	/nfs/dbraw/zinc/02/62/94/205026294.db2.gz	IBYJCVBWDFYQOA-UHFFFAOYSA-N	1	1	320.393	1.271	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)[C@@H](C)C1	ZINC000288317845	220081483	/nfs/dbraw/zinc/08/14/83/220081483.db2.gz	HUTIERCHTYGXCI-NSHDSACASA-N	1	1	323.397	1.351	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCc2ccccc21	ZINC000266419197	205333415	/nfs/dbraw/zinc/33/34/15/205333415.db2.gz	IKDZKBBSJWMWAF-GDBMZVCRSA-N	1	1	316.361	1.772	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000266464772	205366509	/nfs/dbraw/zinc/36/65/09/205366509.db2.gz	ANTVJYIWWLQXLU-GHMZBOCLSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464772	205366513	/nfs/dbraw/zinc/36/65/13/205366513.db2.gz	ANTVJYIWWLQXLU-GHMZBOCLSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464772	205366517	/nfs/dbraw/zinc/36/65/17/205366517.db2.gz	ANTVJYIWWLQXLU-GHMZBOCLSA-N	1	1	307.354	1.325	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288490008	220174855	/nfs/dbraw/zinc/17/48/55/220174855.db2.gz	ROIRPQDEJWBKOD-QWRGUYRKSA-N	1	1	321.381	1.579	20	5		DDBDMO
Cc1c(CN2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000284471389	218040585	/nfs/dbraw/zinc/04/05/85/218040585.db2.gz	AGLHBCNXDNPPAF-JKSUJKDBSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1c(F)cncc1F	ZINC000285594559	218528790	/nfs/dbraw/zinc/52/87/90/218528790.db2.gz	IYNIMSWFMKGMMG-SECBINFHSA-N	1	1	324.287	1.781	20	5		DDBDMO
CSc1ccc(C(=O)NC[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000110653769	194346986	/nfs/dbraw/zinc/34/69/86/194346986.db2.gz	VGIDGPZWWIGNEB-SNVBAGLBSA-N	1	1	309.391	1.998	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000341106285	251384438	/nfs/dbraw/zinc/38/44/38/251384438.db2.gz	WKAZQVMWPSDXQI-RYUDHWBXSA-N	1	1	306.366	1.321	20	5		DDBDMO
CN(C(=O)C[N@@H+](CCO)CC1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000352464933	285069958	/nfs/dbraw/zinc/06/99/58/285069958.db2.gz	ZDIYOFUWLUYTJO-UHFFFAOYSA-N	1	1	307.350	1.262	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000452078492	533134235	/nfs/dbraw/zinc/13/42/35/533134235.db2.gz	DPBIPMVMPCERNM-ZDUSSCGKSA-N	1	1	309.366	1.505	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1O	ZINC000352657093	285201344	/nfs/dbraw/zinc/20/13/44/285201344.db2.gz	FAMUJIGAQJNBMP-SCRDCRAPSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[N@H+]([C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)[C@H]1CCC[C@H]1O	ZINC000352668261	285211089	/nfs/dbraw/zinc/21/10/89/285211089.db2.gz	QQJFICOFDACSCV-RRFJBIMHSA-N	1	1	319.361	1.545	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nc(=O)[nH][nH]2)C1	ZINC000289487175	221011790	/nfs/dbraw/zinc/01/17/90/221011790.db2.gz	SGSYDSXLJWGPLF-WDEREUQCSA-N	1	1	317.349	1.947	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[NH2+]C[C@H]1C	ZINC000123486791	291993117	/nfs/dbraw/zinc/99/31/17/291993117.db2.gz	QCPNDMVIOUGOBW-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CCn1ccnc1C[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000569332881	304347045	/nfs/dbraw/zinc/34/70/45/304347045.db2.gz	GEPVHAFYNRVGIW-LBPRGKRZSA-N	1	1	320.349	1.341	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000075848992	406943022	/nfs/dbraw/zinc/94/30/22/406943022.db2.gz	KJGXXGOMSHIQDM-LBPRGKRZSA-N	1	1	319.361	1.574	20	5		DDBDMO
CN(CCn1cc([N+](=O)[O-])ccc1=O)C[C@H]1CCC[N@@H+](C)C1	ZINC000090550397	407170123	/nfs/dbraw/zinc/17/01/23/407170123.db2.gz	YGDDNLZMJVOZLN-ZDUSSCGKSA-N	1	1	308.382	1.030	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000055407960	407203179	/nfs/dbraw/zinc/20/31/79/407203179.db2.gz	XOGZHPKFVRGPIG-NWDGAFQWSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000107891945	407381270	/nfs/dbraw/zinc/38/12/70/407381270.db2.gz	LGVYELJWZIYYQS-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271177868	407556127	/nfs/dbraw/zinc/55/61/27/407556127.db2.gz	YEXPEKQAYFVDTO-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
CCCC[C@H](C[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000261704220	407586563	/nfs/dbraw/zinc/58/65/63/407586563.db2.gz	OPAZUZZSJWZZHH-SECBINFHSA-N	1	1	319.358	1.530	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000266464778	407540012	/nfs/dbraw/zinc/54/00/12/407540012.db2.gz	ANTVJYIWWLQXLU-QWRGUYRKSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464778	407540015	/nfs/dbraw/zinc/54/00/15/407540015.db2.gz	ANTVJYIWWLQXLU-QWRGUYRKSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464778	407540020	/nfs/dbraw/zinc/54/00/20/407540020.db2.gz	ANTVJYIWWLQXLU-QWRGUYRKSA-N	1	1	307.354	1.325	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCn3ccnc3)C2)nc1	ZINC000131883847	407756058	/nfs/dbraw/zinc/75/60/58/407756058.db2.gz	WXNDUIAWACCLGF-GFCCVEGCSA-N	1	1	302.338	1.373	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000186725914	407756954	/nfs/dbraw/zinc/75/69/54/407756954.db2.gz	CDFAUYPTDDIWFH-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[N@@H+](C)[C@@H]1CCSC1	ZINC000179259060	407762772	/nfs/dbraw/zinc/76/27/72/407762772.db2.gz	QLSVBUGEHUCIQH-CYBMUJFWSA-N	1	1	323.418	1.991	20	5		DDBDMO
C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237441407	407818267	/nfs/dbraw/zinc/81/82/67/407818267.db2.gz	TVDXZADYHAEZKR-ZANVPECISA-N	1	1	317.349	1.813	20	5		DDBDMO
C[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@H]1CCOC1	ZINC000117340444	407831841	/nfs/dbraw/zinc/83/18/41/407831841.db2.gz	UCNYGTYKZYFNSY-LBPRGKRZSA-N	1	1	321.333	1.614	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337969	407839804	/nfs/dbraw/zinc/83/98/04/407839804.db2.gz	KQNNCLBQOFLXCO-IAQYHMDHSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337969	407839808	/nfs/dbraw/zinc/83/98/08/407839808.db2.gz	KQNNCLBQOFLXCO-IAQYHMDHSA-N	1	1	307.350	1.687	20	5		DDBDMO
CN1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccc[nH+]c21	ZINC000272300002	407858462	/nfs/dbraw/zinc/85/84/62/407858462.db2.gz	UJIFXPWOHDMASK-OAHLLOKOSA-N	1	1	314.345	1.980	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000268220545	407956431	/nfs/dbraw/zinc/95/64/31/407956431.db2.gz	JSCLGOCZHYZPJX-GFCCVEGCSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[N@H+]1CCO[C@@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000268220545	407956438	/nfs/dbraw/zinc/95/64/38/407956438.db2.gz	JSCLGOCZHYZPJX-GFCCVEGCSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000268233461	407960679	/nfs/dbraw/zinc/96/06/79/407960679.db2.gz	SPFXCJDDDMBGAL-FZMZJTMJSA-N	1	1	318.377	1.606	20	5		DDBDMO
CC[C@H](CSC)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245592727	408021279	/nfs/dbraw/zinc/02/12/79/408021279.db2.gz	LXXCGKVFGDGFLH-ZYHUDNBSSA-N	1	1	302.400	1.226	20	5		DDBDMO
CN(CCC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000181989470	408062166	/nfs/dbraw/zinc/06/21/66/408062166.db2.gz	SXHAALQCZYKEOL-UHFFFAOYSA-N	1	1	305.338	1.495	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCCC2(C1)OCCO2	ZINC000136148476	408081966	/nfs/dbraw/zinc/08/19/66/408081966.db2.gz	HBOHXYOBQXQRMW-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCCC2(C1)OCCO2	ZINC000136148476	408081973	/nfs/dbraw/zinc/08/19/73/408081973.db2.gz	HBOHXYOBQXQRMW-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC1(O)CCOCC1	ZINC000189763240	408100684	/nfs/dbraw/zinc/10/06/84/408100684.db2.gz	IRAYVXOATOCLPH-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CCN1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1=O	ZINC000190221132	408191502	/nfs/dbraw/zinc/19/15/02/408191502.db2.gz	JMMKRXUVEFYILI-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
CCN1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1=O	ZINC000190221132	408191509	/nfs/dbraw/zinc/19/15/09/408191509.db2.gz	JMMKRXUVEFYILI-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
CC[N@H+](C)C[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269273246	408245360	/nfs/dbraw/zinc/24/53/60/408245360.db2.gz	HHXBOTUAVMFXAD-NSHDSACASA-N	1	1	307.350	1.714	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269273246	408245365	/nfs/dbraw/zinc/24/53/65/408245365.db2.gz	HHXBOTUAVMFXAD-NSHDSACASA-N	1	1	307.350	1.714	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269284687	408252622	/nfs/dbraw/zinc/25/26/22/408252622.db2.gz	MXPBYTSBNKWDRY-ZIAGYGMSSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+]2CCCC[C@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284687	408252627	/nfs/dbraw/zinc/25/26/27/408252627.db2.gz	MXPBYTSBNKWDRY-ZIAGYGMSSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284687	408252632	/nfs/dbraw/zinc/25/26/32/408252632.db2.gz	MXPBYTSBNKWDRY-ZIAGYGMSSA-N	1	1	305.334	1.657	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H]1CCN(C(C)=O)C1	ZINC000156523109	408264163	/nfs/dbraw/zinc/26/41/63/408264163.db2.gz	CXHYPRISOWDQAD-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269333256	408274102	/nfs/dbraw/zinc/27/41/02/408274102.db2.gz	AUCGKSRMPUCEEX-QWRGUYRKSA-N	1	1	323.397	1.900	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000246627074	408307402	/nfs/dbraw/zinc/30/74/02/408307402.db2.gz	AQCXSAHEEAAVIC-KOLCDFICSA-N	1	1	322.287	1.427	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000246838140	408350475	/nfs/dbraw/zinc/35/04/75/408350475.db2.gz	SUENZZMPOSULBG-DZGCQCFKSA-N	1	1	319.361	1.695	20	5		DDBDMO
C[NH+](C)[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000170867473	162196793	/nfs/dbraw/zinc/19/67/93/162196793.db2.gz	ICOINSSJNGBAEL-JTQLQIEISA-N	1	1	303.322	1.247	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000173118753	162322404	/nfs/dbraw/zinc/32/24/04/162322404.db2.gz	VZKKAUQMUWBCIL-HNNXBMFYSA-N	1	1	305.378	1.936	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C[C@H](C)O	ZINC000247040189	408394594	/nfs/dbraw/zinc/39/45/94/408394594.db2.gz	XWXODMWXNBECOU-QWHCGFSZSA-N	1	1	321.377	1.512	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000247040189	408394603	/nfs/dbraw/zinc/39/46/03/408394603.db2.gz	XWXODMWXNBECOU-QWHCGFSZSA-N	1	1	321.377	1.512	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000247080535	408403052	/nfs/dbraw/zinc/40/30/52/408403052.db2.gz	HAKDHCBKAAFMLC-QWHCGFSZSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CCO)C(C)C	ZINC000177032494	408500049	/nfs/dbraw/zinc/50/00/49/408500049.db2.gz	QBGIOHCKMIWCRC-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475399	408507370	/nfs/dbraw/zinc/50/73/70/408507370.db2.gz	YPJSBOZDQBIYQZ-SWLSCSKDSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475399	408507375	/nfs/dbraw/zinc/50/73/75/408507375.db2.gz	YPJSBOZDQBIYQZ-SWLSCSKDSA-N	1	1	321.377	1.793	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000177094036	408516602	/nfs/dbraw/zinc/51/66/02/408516602.db2.gz	IWCMWSZXSGEZSB-CMPLNLGQSA-N	1	1	319.361	1.958	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000183975307	408523506	/nfs/dbraw/zinc/52/35/06/408523506.db2.gz	NJYIIIASKZCLQH-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[NH+](C)CC1	ZINC000184794980	408691371	/nfs/dbraw/zinc/69/13/71/408691371.db2.gz	TYMZSDMZHOTTDY-CYBMUJFWSA-N	1	1	320.393	1.786	20	5		DDBDMO
COc1cccc(NC[C@@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000185454493	408810405	/nfs/dbraw/zinc/81/04/05/408810405.db2.gz	IBZWEMUNVLFPNY-GFCCVEGCSA-N	1	1	309.366	1.984	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](C)(O)C1	ZINC000178003534	408754113	/nfs/dbraw/zinc/75/41/13/408754113.db2.gz	KRZAXVZVOADKEB-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000270960227	408760191	/nfs/dbraw/zinc/76/01/91/408760191.db2.gz	XNDGUKIVPDXASH-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000285704953	408847077	/nfs/dbraw/zinc/84/70/77/408847077.db2.gz	IYVGSUYMFUFCBY-UONOGXRCSA-N	1	1	305.334	1.140	20	5		DDBDMO
C[NH+](C)[C@H]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000277303993	408915332	/nfs/dbraw/zinc/91/53/32/408915332.db2.gz	PHEYTMSKIHWGFX-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C2)C1	ZINC000292058280	408971913	/nfs/dbraw/zinc/97/19/13/408971913.db2.gz	APDXXZVHVVEUPZ-HNNXBMFYSA-N	1	1	307.325	1.902	20	5		DDBDMO
Cn1cc([C@@H]2C[N@H+](Cc3csc([N+](=O)[O-])c3)C[C@H]2CO)cn1	ZINC000277866336	409026147	/nfs/dbraw/zinc/02/61/47/409026147.db2.gz	UMFAGOONFMWDNJ-STQMWFEESA-N	1	1	322.390	1.598	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@H]2CO)cn1	ZINC000277866336	409026151	/nfs/dbraw/zinc/02/61/51/409026151.db2.gz	UMFAGOONFMWDNJ-STQMWFEESA-N	1	1	322.390	1.598	20	5		DDBDMO
Cc1cc(N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)c(F)cc1[N+](=O)[O-]	ZINC000292701780	409040200	/nfs/dbraw/zinc/04/02/00/409040200.db2.gz	SBOMCNDSZACXGE-GJZGRUSLSA-N	1	1	309.341	1.952	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](O)CC3)o2)cc1	ZINC000293297470	409084761	/nfs/dbraw/zinc/08/47/61/409084761.db2.gz	WJBACZZEXZKRIP-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](O)CC3)o2)cc1	ZINC000293297470	409084762	/nfs/dbraw/zinc/08/47/62/409084762.db2.gz	WJBACZZEXZKRIP-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000283166131	409102142	/nfs/dbraw/zinc/10/21/42/409102142.db2.gz	PEGKEUIDFWGQTA-JTQLQIEISA-N	1	1	324.356	1.919	20	5		DDBDMO
C[C@@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000294059358	409233402	/nfs/dbraw/zinc/23/34/02/409233402.db2.gz	UVRWKSQDRHSDCJ-TXEJJXNPSA-N	1	1	307.350	1.525	20	5		DDBDMO
CN(CC(=O)N1CC[NH2+]C[C@@](C)(F)C1)c1ccccc1[N+](=O)[O-]	ZINC000295217821	409380808	/nfs/dbraw/zinc/38/08/08/409380808.db2.gz	MHGIILTZDFZNPS-OAHLLOKOSA-N	1	1	324.356	1.191	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN2CCO[C@H]1C2	ZINC000295389149	409460617	/nfs/dbraw/zinc/46/06/17/409460617.db2.gz	KZODMTYQMSYXRX-XHSDSOJGSA-N	1	1	321.377	1.033	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@@H](O)C1(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000361425497	164153824	/nfs/dbraw/zinc/15/38/24/164153824.db2.gz	GZIRJMMRLSRWJD-CYBMUJFWSA-N	1	1	307.350	1.403	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H](O)C1(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000361425497	164153826	/nfs/dbraw/zinc/15/38/26/164153826.db2.gz	GZIRJMMRLSRWJD-CYBMUJFWSA-N	1	1	307.350	1.403	20	5		DDBDMO
Cn1cc([C@@H]2CCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)cn1	ZINC000331550288	409627303	/nfs/dbraw/zinc/62/73/03/409627303.db2.gz	GTCNBFVPAKGSDX-AWEZNQCLSA-N	1	1	304.354	1.752	20	5		DDBDMO
Cn1cc([C@@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cn1	ZINC000331550288	409627307	/nfs/dbraw/zinc/62/73/07/409627307.db2.gz	GTCNBFVPAKGSDX-AWEZNQCLSA-N	1	1	304.354	1.752	20	5		DDBDMO
C[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304290270	409599248	/nfs/dbraw/zinc/59/92/48/409599248.db2.gz	CFDLHPLGNGUOLU-AYRXBEOTSA-N	1	1	308.382	1.805	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccccc2)c1	ZINC000304339054	409609865	/nfs/dbraw/zinc/60/98/65/409609865.db2.gz	PGALAKOWPHARFT-HZPDHXFCSA-N	1	1	316.361	1.989	20	5		DDBDMO
COC[C@H]1CC[N@@H+]1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1	ZINC000354057802	409615396	/nfs/dbraw/zinc/61/53/96/409615396.db2.gz	ZZPHDSUWZJNXFC-GFCCVEGCSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC[C@H]1CC[N@H+]1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1	ZINC000354057802	409615400	/nfs/dbraw/zinc/61/54/00/409615400.db2.gz	ZZPHDSUWZJNXFC-GFCCVEGCSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1cc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000296835453	409659376	/nfs/dbraw/zinc/65/93/76/409659376.db2.gz	DEFCPPMPBDAAFR-YOGCLGLASA-N	1	1	318.377	1.840	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858130	409669089	/nfs/dbraw/zinc/66/90/89/409669089.db2.gz	UALMXNIVYYVRTN-ZIAGYGMSSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858130	409669092	/nfs/dbraw/zinc/66/90/92/409669092.db2.gz	UALMXNIVYYVRTN-ZIAGYGMSSA-N	1	1	323.349	1.401	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCCc3[nH+]ccn32)n1	ZINC000354169977	409713813	/nfs/dbraw/zinc/71/38/13/409713813.db2.gz	PTDWDAKBPDQRQO-MRVPVSSYSA-N	1	1	315.293	1.501	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1	ZINC000357050518	409821261	/nfs/dbraw/zinc/82/12/61/409821261.db2.gz	IEFWAQRTZYFGEO-LBPRGKRZSA-N	1	1	321.381	1.132	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000357005052	409785644	/nfs/dbraw/zinc/78/56/44/409785644.db2.gz	QQQNWFUNWPLTET-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005052	409785655	/nfs/dbraw/zinc/78/56/55/409785655.db2.gz	QQQNWFUNWPLTET-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005052	409785665	/nfs/dbraw/zinc/78/56/65/409785665.db2.gz	QQQNWFUNWPLTET-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357052080	409819070	/nfs/dbraw/zinc/81/90/70/409819070.db2.gz	QXMANWCXANSZMM-QWRGUYRKSA-N	1	1	307.354	1.027	20	5		DDBDMO
CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CC(=O)N(C)C1=O	ZINC000338327236	409913460	/nfs/dbraw/zinc/91/34/60/409913460.db2.gz	XQMUUSOIGDWSSC-AWEZNQCLSA-N	1	1	319.361	1.873	20	5		DDBDMO
CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H]1CC(=O)N(C)C1=O	ZINC000338327236	409913461	/nfs/dbraw/zinc/91/34/61/409913461.db2.gz	XQMUUSOIGDWSSC-AWEZNQCLSA-N	1	1	319.361	1.873	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](C)[NH+](C)[C@@H](C)C2)n1	ZINC000319479772	409897553	/nfs/dbraw/zinc/89/75/53/409897553.db2.gz	XAWNGFFAPXEYSW-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000332309876	410057023	/nfs/dbraw/zinc/05/70/23/410057023.db2.gz	XCILZTUMELFCTK-STQMWFEESA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1COC[C@@H]1O	ZINC000339192480	410069738	/nfs/dbraw/zinc/06/97/38/410069738.db2.gz	GDTHDUPFQOHNEI-RYUDHWBXSA-N	1	1	320.267	1.805	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1COC[C@@H]1O	ZINC000339192480	410069744	/nfs/dbraw/zinc/06/97/44/410069744.db2.gz	GDTHDUPFQOHNEI-RYUDHWBXSA-N	1	1	320.267	1.805	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1C	ZINC000346691743	410086894	/nfs/dbraw/zinc/08/68/94/410086894.db2.gz	WAZSXXSPSZRMFJ-JOYOIKCWSA-N	1	1	321.333	1.077	20	5		DDBDMO
CCNC(=O)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)C(C)C	ZINC000339326888	410098106	/nfs/dbraw/zinc/09/81/06/410098106.db2.gz	TWBUFGXTHBWFNS-CQSZACIVSA-N	1	1	309.366	1.854	20	5		DDBDMO
COc1c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000354811979	410105362	/nfs/dbraw/zinc/10/53/62/410105362.db2.gz	WVKSWVIVJNJVSM-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298105659	410118402	/nfs/dbraw/zinc/11/84/02/410118402.db2.gz	NRCMVBYGIWJKPK-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
C[C@H]1CN(CC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CCO1	ZINC000332604589	410190806	/nfs/dbraw/zinc/19/08/06/410190806.db2.gz	OEOALANOGJLCBK-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H]1CN(CC[N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CCO1	ZINC000332604589	410190813	/nfs/dbraw/zinc/19/08/13/410190813.db2.gz	OEOALANOGJLCBK-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000357907368	410322388	/nfs/dbraw/zinc/32/23/88/410322388.db2.gz	FEJWCSRNMBXCBN-KGLIPLIRSA-N	1	1	323.397	1.513	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)Nc1ccc([N+](=O)[O-])c2nonc21	ZINC000298729041	410370672	/nfs/dbraw/zinc/37/06/72/410370672.db2.gz	RLYVKAHHTWKOHJ-VIFPVBQESA-N	1	1	307.310	1.264	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CC=C(C)CC2)c1	ZINC000355323510	410441237	/nfs/dbraw/zinc/44/12/37/410441237.db2.gz	SVIVOFDDLLXNJR-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000343572768	410542571	/nfs/dbraw/zinc/54/25/71/410542571.db2.gz	PIVGJHPBUVPUPD-CQSZACIVSA-N	1	1	321.377	1.964	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1	ZINC000299180775	410559108	/nfs/dbraw/zinc/55/91/08/410559108.db2.gz	ZCWFMQMIBSGZRQ-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CCOCC3)CC2)nc1	ZINC000301353995	410705434	/nfs/dbraw/zinc/70/54/34/410705434.db2.gz	KAKXNXGSRVMISM-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCNC2=O)cccc1[N+](=O)[O-]	ZINC000340224263	410772358	/nfs/dbraw/zinc/77/23/58/410772358.db2.gz	ZCBLSISZOAKEQP-ZDUSSCGKSA-N	1	1	320.349	1.052	20	5		DDBDMO
C[C@@H]1OCC[NH2+][C@@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000343921699	410811511	/nfs/dbraw/zinc/81/15/11/410811511.db2.gz	VFKPXCAFZKVMBN-WFASDCNBSA-N	1	1	321.377	1.411	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000302750019	410857650	/nfs/dbraw/zinc/85/76/50/410857650.db2.gz	GWKLHYSZFDCPBI-ONGXEEELSA-N	1	1	320.349	1.814	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[NH+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000302778192	410863812	/nfs/dbraw/zinc/86/38/12/410863812.db2.gz	PWKIKCVIFNWDOR-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000348288526	410899085	/nfs/dbraw/zinc/89/90/85/410899085.db2.gz	WMCXNNYDUBSTDS-MIMYLULJSA-N	1	1	322.287	1.425	20	5		DDBDMO
C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000348288525	410900640	/nfs/dbraw/zinc/90/06/40/410900640.db2.gz	WMCXNNYDUBSTDS-IEBDPFPHSA-N	1	1	322.287	1.425	20	5		DDBDMO
C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C1CCN(CCO)CC1	ZINC000353360736	410941631	/nfs/dbraw/zinc/94/16/31/410941631.db2.gz	LIMSSPBDMGUYGM-GQCTYLIASA-N	1	1	319.405	1.997	20	5		DDBDMO
CN(C/C=C/c1ccccc1[N+](=O)[O-])C1CC[NH+](CCO)CC1	ZINC000353360736	410941641	/nfs/dbraw/zinc/94/16/41/410941641.db2.gz	LIMSSPBDMGUYGM-GQCTYLIASA-N	1	1	319.405	1.997	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCC[N@H+](C)C2	ZINC000356293976	410950918	/nfs/dbraw/zinc/95/09/18/410950918.db2.gz	ITYNTFMXJRTQDJ-INIZCTEOSA-N	1	1	318.377	1.856	20	5		DDBDMO
Cc1cc(N2CCC[N@H+]([C@H](C)CO)CC2)c(F)cc1[N+](=O)[O-]	ZINC000360054358	411023191	/nfs/dbraw/zinc/02/31/91/411023191.db2.gz	SVEKSMPTHXNQPY-GFCCVEGCSA-N	1	1	311.357	1.935	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356444448	411034032	/nfs/dbraw/zinc/03/40/32/411034032.db2.gz	IAEYKMDTXCHADH-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)C[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000339326659	306735818	/nfs/dbraw/zinc/73/58/18/306735818.db2.gz	LSQNYWKGZOECNO-KCQAQPDRSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)[C@H]2CCC[N@@H+]2C)c([N+](=O)[O-])c1	ZINC000129192762	196027763	/nfs/dbraw/zinc/02/77/63/196027763.db2.gz	RGMMVGKBMSTYMA-CQSZACIVSA-N	1	1	320.393	1.916	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000130717207	196103452	/nfs/dbraw/zinc/10/34/52/196103452.db2.gz	ZCPSGFIBSFPSED-UHFFFAOYSA-N	1	1	320.353	1.235	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)CC[NH+]1CCOCC1	ZINC000358036053	299053349	/nfs/dbraw/zinc/05/33/49/299053349.db2.gz	BVUMCGOVBOIGAE-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
CCOC(=O)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C1CCCC1	ZINC000177296221	221845588	/nfs/dbraw/zinc/84/55/88/221845588.db2.gz	PECGWISWHNSWFF-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
CCOC(=O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CCCC1	ZINC000177296221	221845591	/nfs/dbraw/zinc/84/55/91/221845591.db2.gz	PECGWISWHNSWFF-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360947548	418551970	/nfs/dbraw/zinc/55/19/70/418551970.db2.gz	XMXCEBHQVHAFGA-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360947548	418551973	/nfs/dbraw/zinc/55/19/73/418551973.db2.gz	XMXCEBHQVHAFGA-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C[C@H](C)O)C[C@@H]1C	ZINC000361006286	418564773	/nfs/dbraw/zinc/56/47/73/418564773.db2.gz	CHBKAXGVKDLERS-QWRGUYRKSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)n1	ZINC000191840293	222110412	/nfs/dbraw/zinc/11/04/12/222110412.db2.gz	YTMOVQFBUWUNFR-UWVGGRQHSA-N	1	1	307.354	1.166	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])C1	ZINC000191830084	222110498	/nfs/dbraw/zinc/11/04/98/222110498.db2.gz	CCIZMBWZRZSUGB-GFCCVEGCSA-N	1	1	323.397	1.615	20	5		DDBDMO
C[C@@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000190240515	222071533	/nfs/dbraw/zinc/07/15/33/222071533.db2.gz	FYAIIRXUAMBPQI-YVARQFDVSA-N	1	1	305.378	1.606	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@H]3C[N@H+](C)C[C@H]3C)n2)n1C	ZINC000361248769	418612267	/nfs/dbraw/zinc/61/22/67/418612267.db2.gz	CXVDLPKPCNYPOU-APPZFPTMSA-N	1	1	306.326	1.352	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](n2cncn2)C1	ZINC000375333421	418630945	/nfs/dbraw/zinc/63/09/45/418630945.db2.gz	POOAGZFPSBIEFW-GFCCVEGCSA-N	1	1	303.322	1.512	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392286	418633185	/nfs/dbraw/zinc/63/31/85/418633185.db2.gz	NNEFQRNJVKMRKE-VXGBXAGGSA-N	1	1	323.397	1.731	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392286	418633187	/nfs/dbraw/zinc/63/31/87/418633187.db2.gz	NNEFQRNJVKMRKE-VXGBXAGGSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)N1CC[C@H]([N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403849	418634479	/nfs/dbraw/zinc/63/44/79/418634479.db2.gz	MOIIZZYJZIWZNZ-OCCSQVGLSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)N1CC[C@H]([N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403849	418634482	/nfs/dbraw/zinc/63/44/82/418634482.db2.gz	MOIIZZYJZIWZNZ-OCCSQVGLSA-N	1	1	321.381	1.438	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC000375508593	418651697	/nfs/dbraw/zinc/65/16/97/418651697.db2.gz	UDIQCSNIVLIHIX-SNVBAGLBSA-N	1	1	314.773	1.536	20	5		DDBDMO
CC(=O)c1ccc(N2CCC[N@H+]([C@@H](C)CO)CC2)c([N+](=O)[O-])c1	ZINC000364954054	418827719	/nfs/dbraw/zinc/82/77/19/418827719.db2.gz	JEKBGCMVJPMVNY-LBPRGKRZSA-N	1	1	321.377	1.690	20	5		DDBDMO
CCc1nc([C@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365724274	418900307	/nfs/dbraw/zinc/90/03/07/418900307.db2.gz	QHMLVSZKVHTJJR-NSHDSACASA-N	1	1	320.353	1.616	20	5		DDBDMO
CCc1nc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365724274	418900309	/nfs/dbraw/zinc/90/03/09/418900309.db2.gz	QHMLVSZKVHTJJR-NSHDSACASA-N	1	1	320.353	1.616	20	5		DDBDMO
CC(C)[C@@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000365848163	418916234	/nfs/dbraw/zinc/91/62/34/418916234.db2.gz	NEPIMNLHQQSWBZ-GFCCVEGCSA-N	1	1	323.397	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@@H]1CCO	ZINC000426230005	419411597	/nfs/dbraw/zinc/41/15/97/419411597.db2.gz	JTHPGXCFCIDNLL-CHWSQXEVSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000430947497	420219174	/nfs/dbraw/zinc/21/91/74/420219174.db2.gz	BHDWQTNXGYSWRK-VXGBXAGGSA-N	1	1	320.393	1.981	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000420774892	420387138	/nfs/dbraw/zinc/38/71/38/420387138.db2.gz	YXBDPTDKVDIOEC-VIFPVBQESA-N	1	1	319.408	1.371	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000420774892	420387141	/nfs/dbraw/zinc/38/71/41/420387141.db2.gz	YXBDPTDKVDIOEC-VIFPVBQESA-N	1	1	319.408	1.371	20	5		DDBDMO
C[C@@H]1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)[N@@H+]1CCO	ZINC000450790781	420532705	/nfs/dbraw/zinc/53/27/05/420532705.db2.gz	HKHFICXGMZFXTI-PHIMTYICSA-N	1	1	319.365	1.362	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1C(C)C	ZINC000453041965	420705444	/nfs/dbraw/zinc/70/54/44/420705444.db2.gz	SBRBRONHRZNGNX-ILXRZTDVSA-N	1	1	310.398	1.765	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000454193276	420812591	/nfs/dbraw/zinc/81/25/91/420812591.db2.gz	CWAVEDHXUFVNSU-NSHDSACASA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000454193276	420812596	/nfs/dbraw/zinc/81/25/96/420812596.db2.gz	CWAVEDHXUFVNSU-NSHDSACASA-N	1	1	322.365	1.434	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000447994167	420831335	/nfs/dbraw/zinc/83/13/35/420831335.db2.gz	TTWINYWTFATHKT-ZDUSSCGKSA-N	1	1	321.381	1.654	20	5		DDBDMO
C[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])N1CCN(C)CC1	ZINC000449134362	420955744	/nfs/dbraw/zinc/95/57/44/420955744.db2.gz	IRBNDVKSUJVSBH-LSDHHAIUSA-N	1	1	320.437	1.751	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC12COC2	ZINC000449360232	420997094	/nfs/dbraw/zinc/99/70/94/420997094.db2.gz	HQONDZWPZJSPGM-AWEZNQCLSA-N	1	1	320.345	1.606	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)C[C@H](C)[N@@H+]1CCO	ZINC000449533346	421024403	/nfs/dbraw/zinc/02/44/03/421024403.db2.gz	KDANLARTCKARJR-TXEJJXNPSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=C1OCCN1C[C@@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000496156009	421140115	/nfs/dbraw/zinc/14/01/15/421140115.db2.gz	DKJBFBHYSNLWTA-SNVBAGLBSA-N	1	1	311.363	1.930	20	5		DDBDMO
O=C1OCCN1C[C@@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000496156009	421140118	/nfs/dbraw/zinc/14/01/18/421140118.db2.gz	DKJBFBHYSNLWTA-SNVBAGLBSA-N	1	1	311.363	1.930	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450291287	421177977	/nfs/dbraw/zinc/17/79/77/421177977.db2.gz	SQTJPOGJCSHKHB-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450291287	421177978	/nfs/dbraw/zinc/17/79/78/421177978.db2.gz	SQTJPOGJCSHKHB-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000522811420	421225486	/nfs/dbraw/zinc/22/54/86/421225486.db2.gz	PHXVLNXYJGYXJP-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000524775240	421271579	/nfs/dbraw/zinc/27/15/79/421271579.db2.gz	AVQPTVZHVZSXRG-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000574643732	422150458	/nfs/dbraw/zinc/15/04/58/422150458.db2.gz	HWIWDHLLIUFLHH-DOMZBBRYSA-N	1	1	319.361	1.445	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CC[N@H+](C2CCC2)C1	ZINC000344696847	272093220	/nfs/dbraw/zinc/09/32/20/272093220.db2.gz	HRXQGDQDDHDJHR-NSHDSACASA-N	1	1	321.381	1.275	20	5		DDBDMO
COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@H](C)C(N)=O	ZINC000347313625	272659664	/nfs/dbraw/zinc/65/96/64/272659664.db2.gz	IIUHGGSENQCYKO-KIWPFMIBSA-N	1	1	321.377	1.820	20	5		DDBDMO
COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@H](C)C(N)=O	ZINC000347313625	272659667	/nfs/dbraw/zinc/65/96/67/272659667.db2.gz	IIUHGGSENQCYKO-KIWPFMIBSA-N	1	1	321.377	1.820	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000067399370	274062957	/nfs/dbraw/zinc/06/29/57/274062957.db2.gz	QTDCVUWOSYGQTH-HUUCEWRRSA-N	1	1	319.361	1.811	20	5		DDBDMO
CO[C@@H]1CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000067399370	274062958	/nfs/dbraw/zinc/06/29/58/274062958.db2.gz	QTDCVUWOSYGQTH-HUUCEWRRSA-N	1	1	319.361	1.811	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c1	ZINC000275432673	274118434	/nfs/dbraw/zinc/11/84/34/274118434.db2.gz	FABGEWJWSNHHFD-LBPRGKRZSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000278292700	274266933	/nfs/dbraw/zinc/26/69/33/274266933.db2.gz	CTORGVGFVFUHLJ-VHSXEESVSA-N	1	1	313.310	1.067	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000278292700	274266936	/nfs/dbraw/zinc/26/69/36/274266936.db2.gz	CTORGVGFVFUHLJ-VHSXEESVSA-N	1	1	313.310	1.067	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000153718271	274272347	/nfs/dbraw/zinc/27/23/47/274272347.db2.gz	BOFAGCIDDGIGHX-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000153718271	274272351	/nfs/dbraw/zinc/27/23/51/274272351.db2.gz	BOFAGCIDDGIGHX-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000332362967	274333172	/nfs/dbraw/zinc/33/31/72/274333172.db2.gz	XAHNMFDKBGPYOB-GFCCVEGCSA-N	1	1	318.377	1.120	20	5		DDBDMO
O=C1NCCCC[C@H]1[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000119973391	275022566	/nfs/dbraw/zinc/02/25/66/275022566.db2.gz	KIGOKQIOSAHHMD-DGCLKSJQSA-N	1	1	319.365	1.145	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@H]3C2)c2cccnc21	ZINC000413230109	275036555	/nfs/dbraw/zinc/03/65/55/275036555.db2.gz	KSWGCFUZYOWYLO-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@H]3C2)c2cccnc21	ZINC000413230109	275036557	/nfs/dbraw/zinc/03/65/57/275036557.db2.gz	KSWGCFUZYOWYLO-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC[NH+](CCO)CC1	ZINC000291595904	275041907	/nfs/dbraw/zinc/04/19/07/275041907.db2.gz	IAVAZBJQJHDOHO-UHFFFAOYSA-N	1	1	302.334	1.257	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CN1CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC000337313358	277045449	/nfs/dbraw/zinc/04/54/49/277045449.db2.gz	ADTGSDZSFSXCSZ-CQSZACIVSA-N	1	1	319.409	1.596	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C[C@H]2C1	ZINC000287617710	277199687	/nfs/dbraw/zinc/19/96/87/277199687.db2.gz	GLVVIRZNQINCPS-AOOOYVTPSA-N	1	1	315.333	1.241	20	5		DDBDMO
O=C(CC[NH+]1CCN(C2CC2)CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000126076783	281225625	/nfs/dbraw/zinc/22/56/25/281225625.db2.gz	MTTQVBFXVFYYIK-UHFFFAOYSA-N	1	1	318.377	1.703	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000128404602	281310339	/nfs/dbraw/zinc/31/03/39/281310339.db2.gz	VRVFGXSYFFRFQA-LBPRGKRZSA-N	1	1	323.397	1.569	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000362444041	300064588	/nfs/dbraw/zinc/06/45/88/300064588.db2.gz	BRXQEAZRXZLQIJ-SMDDNHRTSA-N	1	1	306.366	1.321	20	5		DDBDMO
O=C([C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1)N1CCCC1	ZINC000363106476	300211806	/nfs/dbraw/zinc/21/18/06/300211806.db2.gz	NJWMRNWIMRIZLJ-CYBMUJFWSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=C([C@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1)N1CCCC1	ZINC000363106476	300211808	/nfs/dbraw/zinc/21/18/08/300211808.db2.gz	NJWMRNWIMRIZLJ-CYBMUJFWSA-N	1	1	321.381	1.268	20	5		DDBDMO
Cc1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973693	301114756	/nfs/dbraw/zinc/11/47/56/301114756.db2.gz	KZIZBVIZJKFZQW-YDHLFZDLSA-N	1	1	303.362	1.989	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973693	301114758	/nfs/dbraw/zinc/11/47/58/301114758.db2.gz	KZIZBVIZJKFZQW-YDHLFZDLSA-N	1	1	303.362	1.989	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)C1	ZINC000376176626	302045943	/nfs/dbraw/zinc/04/59/43/302045943.db2.gz	YCGNTZGDKWVNME-AWEZNQCLSA-N	1	1	319.409	1.393	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000532311600	303282195	/nfs/dbraw/zinc/28/21/95/303282195.db2.gz	AYXOSJNZTDWXIW-GFCCVEGCSA-N	1	1	308.382	1.641	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000532397553	303285072	/nfs/dbraw/zinc/28/50/72/303285072.db2.gz	ZNQSPVRDGCOHNW-LBPRGKRZSA-N	1	1	306.366	1.698	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000538918459	303392284	/nfs/dbraw/zinc/39/22/84/303392284.db2.gz	CKZAEYUCECPRGQ-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000538918459	303392286	/nfs/dbraw/zinc/39/22/86/303392286.db2.gz	CKZAEYUCECPRGQ-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000547735021	303550052	/nfs/dbraw/zinc/55/00/52/303550052.db2.gz	GDAYAMZCBNCQHB-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1CO	ZINC000362075628	307012961	/nfs/dbraw/zinc/01/29/61/307012961.db2.gz	ISMIGBUSOBAZOO-DGCLKSJQSA-N	1	1	319.361	1.044	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1CO	ZINC000362089713	307013900	/nfs/dbraw/zinc/01/39/00/307013900.db2.gz	VLDCSMQGTXSQKD-JQWIXIFHSA-N	1	1	318.333	1.705	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000363398878	307027408	/nfs/dbraw/zinc/02/74/08/307027408.db2.gz	QBJWAAMWMCFAND-RRFJBIMHSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccnc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363398878	307027409	/nfs/dbraw/zinc/02/74/09/307027409.db2.gz	QBJWAAMWMCFAND-RRFJBIMHSA-N	1	1	318.377	1.075	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccnc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363398878	307027410	/nfs/dbraw/zinc/02/74/10/307027410.db2.gz	QBJWAAMWMCFAND-RRFJBIMHSA-N	1	1	318.377	1.075	20	5		DDBDMO
Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000373798624	307195521	/nfs/dbraw/zinc/19/55/21/307195521.db2.gz	SNAQHXUZKQFKST-SJXGUFTOSA-N	1	1	315.373	1.795	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]2[C@@H]1C(N)=O	ZINC000373973972	307198734	/nfs/dbraw/zinc/19/87/34/307198734.db2.gz	CLLMSHQCONJHFL-VZJVUDMVSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@@H]2[C@@H]1C(N)=O	ZINC000373973972	307198735	/nfs/dbraw/zinc/19/87/35/307198735.db2.gz	CLLMSHQCONJHFL-VZJVUDMVSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000570780248	308179419	/nfs/dbraw/zinc/17/94/19/308179419.db2.gz	NAJRSLZYSBVGRY-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000575384153	308276072	/nfs/dbraw/zinc/27/60/72/308276072.db2.gz	GMFYCFXZOOUOFS-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000575384153	308276074	/nfs/dbraw/zinc/27/60/74/308276074.db2.gz	GMFYCFXZOOUOFS-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000575384153	308276076	/nfs/dbraw/zinc/27/60/76/308276076.db2.gz	GMFYCFXZOOUOFS-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[NH+]2CCSCC2)nc2sccn21	ZINC000226231078	490701438	/nfs/dbraw/zinc/70/14/38/490701438.db2.gz	XUKCSMPXULIMQC-UHFFFAOYSA-N	1	1	313.408	1.765	20	5		DDBDMO
C[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000305770325	534055975	/nfs/dbraw/zinc/05/59/75/534055975.db2.gz	XINRGLZAGHATTP-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000305770325	534055980	/nfs/dbraw/zinc/05/59/80/534055980.db2.gz	XINRGLZAGHATTP-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC[N@@H+](CC(C)(C)O)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000305721687	527954705	/nfs/dbraw/zinc/95/47/05/527954705.db2.gz	ILSWDPWLMXLFFI-CQSZACIVSA-N	1	1	321.377	1.793	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(-c2nc(C[NH2+]C)no2)cc1OC	ZINC000414495008	528335582	/nfs/dbraw/zinc/33/55/82/528335582.db2.gz	AWEQIZFOIFRBCT-UHFFFAOYSA-N	1	1	308.294	1.772	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CO)(OC)CC1	ZINC000447087548	528611713	/nfs/dbraw/zinc/61/17/13/528611713.db2.gz	OZTGDURKJLYKII-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736328796	598500405	/nfs/dbraw/zinc/50/04/05/598500405.db2.gz	YQWQMIRDBOXPPV-SECBINFHSA-N	1	1	320.357	1.312	20	5		DDBDMO
CC[N@H+]1C[C@H](C)[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000821241150	606731308	/nfs/dbraw/zinc/73/13/08/606731308.db2.gz	KGNQDKJJBORQJO-JOYOIKCWSA-N	1	1	317.353	1.527	20	5		DDBDMO
O=[N+]([O-])c1cccc(CC[NH2+]Cc2ccc(-c3nn[nH]n3)o2)c1	ZINC000826499641	607978143	/nfs/dbraw/zinc/97/81/43/607978143.db2.gz	QQSTXVKSQRXHFT-UHFFFAOYSA-N	1	1	314.305	1.700	20	5		DDBDMO
Cc1nn(C[NH+]2CCC(C(N)=O)CC2)c2cc([N+](=O)[O-])ccc12	ZINC000121053695	696705748	/nfs/dbraw/zinc/70/57/48/696705748.db2.gz	LLLOVTFLFSAVLA-UHFFFAOYSA-N	1	1	317.349	1.408	20	5		DDBDMO
COCC[NH+]1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000798075140	700040208	/nfs/dbraw/zinc/04/02/08/700040208.db2.gz	LAARDYDHSKNRMJ-UHFFFAOYSA-N	1	1	324.406	1.556	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCC3OCCO3)C2)nc1	ZINC000124994680	696748190	/nfs/dbraw/zinc/74/81/90/696748190.db2.gz	YPVMMOLXMSUAON-LLVKDONJSA-N	1	1	308.338	1.239	20	5		DDBDMO
Cc1nn(CN2CCC[C@H]2C[NH+]2CCOCC2)c(C)c1[N+](=O)[O-]	ZINC000173372446	697377758	/nfs/dbraw/zinc/37/77/58/697377758.db2.gz	VNPBCKKISNYAHE-AWEZNQCLSA-N	1	1	323.397	1.162	20	5		DDBDMO
CCOC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776271807	698090097	/nfs/dbraw/zinc/09/00/97/698090097.db2.gz	HKHOOXMNMGWFGO-ZFWWWQNUSA-N	1	1	322.361	1.903	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@H]2C2OCCO2)cc1	ZINC000776582595	698121681	/nfs/dbraw/zinc/12/16/81/698121681.db2.gz	VSHLTWYEIJEWJW-LSDHHAIUSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@H]2C2OCCO2)cc1	ZINC000776582595	698121682	/nfs/dbraw/zinc/12/16/82/698121682.db2.gz	VSHLTWYEIJEWJW-LSDHHAIUSA-N	1	1	322.361	1.856	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCOCC1	ZINC000789556525	699395575	/nfs/dbraw/zinc/39/55/75/699395575.db2.gz	BAYVYANVDJDQCC-UHFFFAOYSA-N	1	1	313.741	1.372	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](CC[N+](=O)[O-])C1)Nc1cccc(F)c1	ZINC000791055289	699609211	/nfs/dbraw/zinc/60/92/11/699609211.db2.gz	RHVLJIFRZAPHGS-LBPRGKRZSA-N	1	1	324.356	1.936	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@H]1C	ZINC000742237815	699868658	/nfs/dbraw/zinc/86/86/58/699868658.db2.gz	PWVYBDFHSCSTBJ-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C1NC2(CO1)CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2	ZINC000801539613	700318369	/nfs/dbraw/zinc/31/83/69/700318369.db2.gz	KERRAZSKHSYHJC-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000753030688	700402978	/nfs/dbraw/zinc/40/29/78/700402978.db2.gz	VEYBTMWOQQVHLM-VIFPVBQESA-N	1	1	312.345	1.775	20	5		DDBDMO
Cc1cc(F)cc(C(=O)NC[C@@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000753452820	700435230	/nfs/dbraw/zinc/43/52/30/700435230.db2.gz	OJXAWRVWGOMSDM-GFCCVEGCSA-N	1	1	324.356	1.018	20	5		DDBDMO
Cc1cc(F)cc(C(=O)NC[C@@H]2C[N@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000753452820	700435231	/nfs/dbraw/zinc/43/52/31/700435231.db2.gz	OJXAWRVWGOMSDM-GFCCVEGCSA-N	1	1	324.356	1.018	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1NCC[N@@H+]1CCCOCC1	ZINC000808043962	701495232	/nfs/dbraw/zinc/49/52/32/701495232.db2.gz	SFHASMMSYREYEV-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1NCC[N@H+]1CCCOCC1	ZINC000808043962	701495234	/nfs/dbraw/zinc/49/52/34/701495234.db2.gz	SFHASMMSYREYEV-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)Cn2cc[nH+]c2C)n1	ZINC000810615857	701802061	/nfs/dbraw/zinc/80/20/61/701802061.db2.gz	OKTSQNXBHBCVBA-VIFPVBQESA-N	1	1	307.310	1.562	20	5		DDBDMO
CCOCCN(CC)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867955045	701851655	/nfs/dbraw/zinc/85/16/55/701851655.db2.gz	VYBVAWXFPWFROS-OAHLLOKOSA-N	1	1	309.366	1.654	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866205425	706647771	/nfs/dbraw/zinc/64/77/71/706647771.db2.gz	LULDMJKBSFQFIX-OLZOCXBDSA-N	1	1	318.377	1.485	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4sccn4c3[N+](=O)[O-])CC[C@@H]21	ZINC000866207488	706648993	/nfs/dbraw/zinc/64/89/93/706648993.db2.gz	PMBFWAWYQMDZMM-ZJUUUORDSA-N	1	1	307.379	1.834	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3nc4sccn4c3[N+](=O)[O-])CC[C@@H]21	ZINC000866207486	706649200	/nfs/dbraw/zinc/64/92/00/706649200.db2.gz	PMBFWAWYQMDZMM-UWVGGRQHSA-N	1	1	307.379	1.834	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@@H]21	ZINC000866210229	706649808	/nfs/dbraw/zinc/64/98/08/706649808.db2.gz	ZTVKBWRTQQZKTQ-HZMBPMFUSA-N	1	1	306.366	1.200	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)c(N)c([N+](=O)[O-])c1	ZINC000816949336	702233146	/nfs/dbraw/zinc/23/31/46/702233146.db2.gz	TUIPTCMYZSUVIR-MFKMUULPSA-N	1	1	304.350	1.262	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000817370098	702356589	/nfs/dbraw/zinc/35/65/89/702356589.db2.gz	GTDSQGRWKGPMSZ-NSHDSACASA-N	1	1	317.349	1.278	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1COC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000845741124	703195796	/nfs/dbraw/zinc/19/57/96/703195796.db2.gz	RXVFZFAGAJTKQP-NSHDSACASA-N	1	1	310.354	1.597	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCOCC1	ZINC000879710469	706767174	/nfs/dbraw/zinc/76/71/74/706767174.db2.gz	ZEMDQNBFTMMEKG-MRXNPFEDSA-N	1	1	324.377	1.756	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972940	704039190	/nfs/dbraw/zinc/03/91/90/704039190.db2.gz	PHWLLUZTRRYJAF-BLLLJJGKSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC[N@@H+](C3CC3)C2)c1	ZINC000818972940	704039191	/nfs/dbraw/zinc/03/91/91/704039191.db2.gz	PHWLLUZTRRYJAF-BLLLJJGKSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972940	704039192	/nfs/dbraw/zinc/03/91/92/704039192.db2.gz	PHWLLUZTRRYJAF-BLLLJJGKSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CC[N@H+](CC3CC3)C2)c1	ZINC000819040288	704057237	/nfs/dbraw/zinc/05/72/37/704057237.db2.gz	ZAQDOKWNMAOFQM-HOCLYGCPSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000819040288	704057242	/nfs/dbraw/zinc/05/72/42/704057242.db2.gz	ZAQDOKWNMAOFQM-HOCLYGCPSA-N	1	1	305.378	1.702	20	5		DDBDMO
CC(C)N1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000870863485	704148824	/nfs/dbraw/zinc/14/88/24/704148824.db2.gz	KGUUVMHNFMOROR-INIZCTEOSA-N	1	1	320.393	1.321	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@@H]2COCCO2)c2cc([N+](=O)[O-])ccc12	ZINC000853556729	704268393	/nfs/dbraw/zinc/26/83/93/704268393.db2.gz	CGFUJXMFEWOYBZ-CYBMUJFWSA-N	1	1	320.349	1.558	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@H]2COCCO2)c2cc([N+](=O)[O-])ccc12	ZINC000853556729	704268395	/nfs/dbraw/zinc/26/83/95/704268395.db2.gz	CGFUJXMFEWOYBZ-CYBMUJFWSA-N	1	1	320.349	1.558	20	5		DDBDMO
C[N@H+](C[C@H]1COCCO1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853558250	704269329	/nfs/dbraw/zinc/26/93/29/704269329.db2.gz	FUUNTKGHBSSFLT-ZDUSSCGKSA-N	1	1	306.322	1.249	20	5		DDBDMO
C[N@@H+](C[C@H]1COCCO1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853558250	704269331	/nfs/dbraw/zinc/26/93/31/704269331.db2.gz	FUUNTKGHBSSFLT-ZDUSSCGKSA-N	1	1	306.322	1.249	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2C	ZINC000874827079	705185459	/nfs/dbraw/zinc/18/54/59/705185459.db2.gz	AXDOFSOVTYSJAD-ZIAGYGMSSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000874828754	705187381	/nfs/dbraw/zinc/18/73/81/705187381.db2.gz	HTYIKJFPUPURPI-STQMWFEESA-N	1	1	322.340	1.625	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000874828752	705187448	/nfs/dbraw/zinc/18/74/48/705187448.db2.gz	HTYIKJFPUPURPI-QWHCGFSZSA-N	1	1	322.340	1.625	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000874850084	705202980	/nfs/dbraw/zinc/20/29/80/705202980.db2.gz	NUJBKPZLAIGDOE-OLZOCXBDSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000827290327	705969590	/nfs/dbraw/zinc/96/95/90/705969590.db2.gz	SWEQCZYCCNCYMZ-CMPLNLGQSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1ccc(O[C@@H]2CC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)nc1	ZINC000877657195	706172225	/nfs/dbraw/zinc/17/22/25/706172225.db2.gz	ARPZARQTSYHPGZ-CYBMUJFWSA-N	1	1	317.349	1.685	20	5		DDBDMO
Cc1ccc(O[C@@H]2CC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)nc1	ZINC000877657195	706172226	/nfs/dbraw/zinc/17/22/26/706172226.db2.gz	ARPZARQTSYHPGZ-CYBMUJFWSA-N	1	1	317.349	1.685	20	5		DDBDMO
C[N@@H+](CCn1nc([N+](=O)[O-])cc1[N+](=O)[O-])Cc1ccc(F)cc1	ZINC000829838046	706404894	/nfs/dbraw/zinc/40/48/94/706404894.db2.gz	QXSQNMVHHPVJSL-UHFFFAOYSA-N	1	1	323.284	1.971	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CC[C@H](CF)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000880296672	706932022	/nfs/dbraw/zinc/93/20/22/706932022.db2.gz	FSVYVZSPYRBSOS-RISCZKNCSA-N	1	1	307.325	1.992	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H]1CCOC[C@H]1OC	ZINC000880425999	706970279	/nfs/dbraw/zinc/97/02/79/706970279.db2.gz	RFROUJYYEIGOJR-UKRRQHHQSA-N	1	1	310.350	1.839	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832976320	706998891	/nfs/dbraw/zinc/99/88/91/706998891.db2.gz	ZHVXLQBETNKYLX-SWLSCSKDSA-N	1	1	323.393	1.865	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880529348	707005689	/nfs/dbraw/zinc/00/56/89/707005689.db2.gz	KXXXSLPMKUJTRF-ZFWWWQNUSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@H](NC[C@@H]1CCC[N@@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851559	707138785	/nfs/dbraw/zinc/13/87/85/707138785.db2.gz	ZNSKQJCHWGVXDI-JSGCOSHPSA-N	1	1	322.409	1.674	20	5		DDBDMO
C[C@H](NC[C@@H]1CCC[N@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851559	707138787	/nfs/dbraw/zinc/13/87/87/707138787.db2.gz	ZNSKQJCHWGVXDI-JSGCOSHPSA-N	1	1	322.409	1.674	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CCC1(C)C	ZINC000881388045	707228119	/nfs/dbraw/zinc/22/81/19/707228119.db2.gz	FINKBJCIBGHTNU-UHFFFAOYSA-N	1	1	308.338	1.252	20	5		DDBDMO
[NH3+]C[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@H]1C(F)(F)F	ZINC000872149838	707303846	/nfs/dbraw/zinc/30/38/46/707303846.db2.gz	RDVSDIJLSMKBSJ-MWLCHTKSSA-N	1	1	319.283	1.869	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000837414254	707641082	/nfs/dbraw/zinc/64/10/82/707641082.db2.gz	RYZCAMDXZOZNTQ-GFCCVEGCSA-N	1	1	310.354	1.597	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C[C@]2(C)C1	ZINC000896912391	708180474	/nfs/dbraw/zinc/18/04/74/708180474.db2.gz	WDMFKQYQGRDSDI-BMIGLBTASA-N	1	1	304.350	1.082	20	5		DDBDMO
CCOCCOCC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000897203844	708252628	/nfs/dbraw/zinc/25/26/28/708252628.db2.gz	FTHXZTVETDKGJH-UHFFFAOYSA-N	1	1	309.322	1.879	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](c2ncccn2)C1	ZINC000886689774	708814460	/nfs/dbraw/zinc/81/44/60/708814460.db2.gz	HNFJTXSIDPWHQV-CYBMUJFWSA-N	1	1	316.365	1.769	20	5		DDBDMO
O=C1C[C@@H]([N@@H+]2CC[C@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303593	709012092	/nfs/dbraw/zinc/01/20/92/709012092.db2.gz	XFUJJEKFCRKDRJ-ZWNOBZJWSA-N	1	1	321.308	1.518	20	5		DDBDMO
O=C1C[C@@H]([N@H+]2CC[C@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303593	709012096	/nfs/dbraw/zinc/01/20/96/709012096.db2.gz	XFUJJEKFCRKDRJ-ZWNOBZJWSA-N	1	1	321.308	1.518	20	5		DDBDMO
C[C@@H](CNC(=O)CN1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000887403212	709037674	/nfs/dbraw/zinc/03/76/74/709037674.db2.gz	RLTBAVYKORUDFK-ZDUSSCGKSA-N	1	1	320.393	1.062	20	5		DDBDMO
CN1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@H+](C)CC1	ZINC000888992355	709425675	/nfs/dbraw/zinc/42/56/75/709425675.db2.gz	IDBSAYSDFPDPGU-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CN1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC[N@@H+](C)CC1	ZINC000888992355	709425677	/nfs/dbraw/zinc/42/56/77/709425677.db2.gz	IDBSAYSDFPDPGU-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000910269078	709853343	/nfs/dbraw/zinc/85/33/43/709853343.db2.gz	DSOGJLVYQBLFKU-DOMZBBRYSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000928249075	713157380	/nfs/dbraw/zinc/15/73/80/713157380.db2.gz	OWPYOEKBDNRZOK-BXUZGUMPSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000928249075	713157381	/nfs/dbraw/zinc/15/73/81/713157381.db2.gz	OWPYOEKBDNRZOK-BXUZGUMPSA-N	1	1	307.350	1.493	20	5		DDBDMO
COc1c(O)ccc(CNCC2=CC[N@H+](C)CC2)c1[N+](=O)[O-]	ZINC000893304368	710591470	/nfs/dbraw/zinc/59/14/70/710591470.db2.gz	MQBPTHIEJGGPQT-UHFFFAOYSA-N	1	1	307.350	1.661	20	5		DDBDMO
COc1c(O)ccc(CNCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000893304368	710591474	/nfs/dbraw/zinc/59/14/74/710591474.db2.gz	MQBPTHIEJGGPQT-UHFFFAOYSA-N	1	1	307.350	1.661	20	5		DDBDMO
CCO[C@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000902528456	710783335	/nfs/dbraw/zinc/78/33/35/710783335.db2.gz	PSSTXEUSULQWSJ-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000902528456	710783339	/nfs/dbraw/zinc/78/33/39/710783339.db2.gz	PSSTXEUSULQWSJ-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC(C)Oc1cc(C(=O)NC[C@@H]2CC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000928554503	713224069	/nfs/dbraw/zinc/22/40/69/713224069.db2.gz	PYIKICOAXGGALX-LBPRGKRZSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC(C)Oc1cc(C(=O)NC[C@@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000928554503	713224070	/nfs/dbraw/zinc/22/40/70/713224070.db2.gz	PYIKICOAXGGALX-LBPRGKRZSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[N@@H+]1CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])C[C@@H]1CO	ZINC000894881214	711306985	/nfs/dbraw/zinc/30/69/85/711306985.db2.gz	LMBMWOMIJGWTAN-SECBINFHSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])C[C@@H]1CO	ZINC000894881214	711306987	/nfs/dbraw/zinc/30/69/87/711306987.db2.gz	LMBMWOMIJGWTAN-SECBINFHSA-N	1	1	319.283	1.726	20	5		DDBDMO
CN(CC(=O)N1[C@@H]2CC[C@H]1C[N@H+](C)C2)c1ccccc1[N+](=O)[O-]	ZINC000913536654	713248672	/nfs/dbraw/zinc/24/86/72/713248672.db2.gz	GLRRQDHUBXUOGH-BETUJISGSA-N	1	1	318.377	1.336	20	5		DDBDMO
C[C@@H](Nc1nc2sccn2c1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895247160	711464781	/nfs/dbraw/zinc/46/47/81/711464781.db2.gz	FEOHBFKRLSFPLT-NXEZZACHSA-N	1	1	324.410	1.350	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H](C3OCCO3)C2)c1	ZINC000905696098	712121691	/nfs/dbraw/zinc/12/16/91/712121691.db2.gz	SYZMCVHPUZKARB-NSHDSACASA-N	1	1	318.333	1.597	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCOCC1	ZINC000908277714	712726674	/nfs/dbraw/zinc/72/66/74/712726674.db2.gz	DMJYHTSEZZLLSC-UHFFFAOYSA-N	1	1	323.349	1.654	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000915278107	713415166	/nfs/dbraw/zinc/41/51/66/713415166.db2.gz	KMQMPQQXHRXGIR-UHFFFAOYSA-N	1	1	317.349	1.109	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCO[C@@H]3CCOC3)C2)nc1	ZINC000929988907	713730072	/nfs/dbraw/zinc/73/00/72/713730072.db2.gz	OOYWMASFHLUNNZ-GXTWGEPZSA-N	1	1	322.365	1.282	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000930362937	713814304	/nfs/dbraw/zinc/81/43/04/713814304.db2.gz	BRWGXFRXUQWHDD-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
O=[N+]([O-])CCN1CCN([C@H]2CC[N@@H+](Cc3ccccc3)C2)CC1	ZINC000930454231	713839372	/nfs/dbraw/zinc/83/93/72/713839372.db2.gz	FLSUVLVKSSZZDJ-KRWDZBQOSA-N	1	1	318.421	1.155	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000930770128	713915987	/nfs/dbraw/zinc/91/59/87/713915987.db2.gz	VUFUOCDWENYWIM-GWCFXTLKSA-N	1	1	320.349	1.771	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@H+]1C	ZINC000931261542	714050796	/nfs/dbraw/zinc/05/07/96/714050796.db2.gz	BBMUBXWZNBGAGJ-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)Cc2c[nH]nc21	ZINC000931459972	714102769	/nfs/dbraw/zinc/10/27/69/714102769.db2.gz	CPFNJDDRWVUTRU-IINYFYTJSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2c[nH]nc21	ZINC000931460725	714103088	/nfs/dbraw/zinc/10/30/88/714103088.db2.gz	LAVKAMLBSSJMMU-JTQLQIEISA-N	1	1	303.322	1.099	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)Cc2c[nH]nc21	ZINC000931460725	714103090	/nfs/dbraw/zinc/10/30/90/714103090.db2.gz	LAVKAMLBSSJMMU-JTQLQIEISA-N	1	1	303.322	1.099	20	5		DDBDMO
O=C1N[C@@H](C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)CO1	ZINC000932779712	714412114	/nfs/dbraw/zinc/41/21/14/714412114.db2.gz	BKRFMGDTFBCPJF-LLVKDONJSA-N	1	1	311.363	1.977	20	5		DDBDMO
C[C@H]([NH2+][C@@H]1C(=O)NCC12CCOCC2)c1ccccc1[N+](=O)[O-]	ZINC000933038615	714505968	/nfs/dbraw/zinc/50/59/68/714505968.db2.gz	NGZIYLMBPLWHOH-SMDDNHRTSA-N	1	1	319.361	1.541	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000933171762	714527251	/nfs/dbraw/zinc/52/72/51/714527251.db2.gz	YQOZCRGCNHZXQS-VXGBXAGGSA-N	1	1	323.349	1.030	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000933440019	714589718	/nfs/dbraw/zinc/58/97/18/714589718.db2.gz	XDMBIQLHULEGAH-AAEUAGOBSA-N	1	1	323.397	1.288	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOC[C@H]2C[C@H]2CCCO2)n1	ZINC000933682110	714647587	/nfs/dbraw/zinc/64/75/87/714647587.db2.gz	OMMSDXQRUWEYBV-CHWSQXEVSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC[C@H]2C[C@H]2CCCO2)n1	ZINC000933682110	714647588	/nfs/dbraw/zinc/64/75/88/714647588.db2.gz	OMMSDXQRUWEYBV-CHWSQXEVSA-N	1	1	310.354	1.061	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000934121147	714747263	/nfs/dbraw/zinc/74/72/63/714747263.db2.gz	KOUPFODPQIFTKG-OCCSQVGLSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@@H]2CC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000934121147	714747266	/nfs/dbraw/zinc/74/72/66/714747266.db2.gz	KOUPFODPQIFTKG-OCCSQVGLSA-N	1	1	323.349	1.651	20	5		DDBDMO
CC[N@H+](Cc1c([N+](=O)[O-])ncn1C)CC1CCN(C(C)=O)CC1	ZINC000957654250	715986223	/nfs/dbraw/zinc/98/62/23/715986223.db2.gz	PXCJKOWGFJOYLQ-UHFFFAOYSA-N	1	1	323.397	1.409	20	5		DDBDMO
CC(C)C[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589294	718844216	/nfs/dbraw/zinc/84/42/16/718844216.db2.gz	QHIFIMVNWCLTGW-LXTVHRRPSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC(C)C[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589294	718844222	/nfs/dbraw/zinc/84/42/22/718844222.db2.gz	QHIFIMVNWCLTGW-LXTVHRRPSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC(C)C[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589294	718844227	/nfs/dbraw/zinc/84/42/27/718844227.db2.gz	QHIFIMVNWCLTGW-LXTVHRRPSA-N	1	1	309.410	1.478	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nccc4ccc([N+](=O)[O-])cc43)C[C@H]21	ZINC001164674828	719426233	/nfs/dbraw/zinc/42/62/33/719426233.db2.gz	XOBFLWRFKXMHKS-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1F	ZINC001022064073	734368610	/nfs/dbraw/zinc/36/86/10/734368610.db2.gz	UPTUODPBIMLATB-QVHKTLOISA-N	1	1	321.352	1.536	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2cccc(Cl)n2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022064071	734368729	/nfs/dbraw/zinc/36/87/29/734368729.db2.gz	UOBVKRAVOMEHDP-WRWGMCAJSA-N	1	1	324.768	1.137	20	5		DDBDMO
COCC[NH+](CCOC)C1CN(c2ncc(C)cc2[N+](=O)[O-])C1	ZINC001120943582	744569646	/nfs/dbraw/zinc/56/96/46/744569646.db2.gz	IEIDTTQCLJQGQL-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2ncnc(NCC3([NH+]4CCCC4)COC3)c12	ZINC001168444565	744946997	/nfs/dbraw/zinc/94/69/97/744946997.db2.gz	VJYOMODCOSWKBT-UHFFFAOYSA-N	1	1	318.337	1.143	20	5		DDBDMO
COC1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC001122029138	745052009	/nfs/dbraw/zinc/05/20/09/745052009.db2.gz	RJEVIVSSVVBRED-OAHLLOKOSA-N	1	1	307.350	1.406	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]C/C(Cl)=C\Cl)CC1	ZINC001200470897	748264703	/nfs/dbraw/zinc/26/47/03/748264703.db2.gz	AFTIQLZYHFMROL-AQKAQLFCSA-N	1	1	322.192	1.551	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccc(F)cc2)CC1	ZINC000996428423	749586004	/nfs/dbraw/zinc/58/60/04/749586004.db2.gz	CFKDWLJEATUCFR-HUUCEWRRSA-N	1	1	321.352	1.572	20	5		DDBDMO
CCOC(=O)[C@H](CCSC)[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001168978820	762147041	/nfs/dbraw/zinc/14/70/41/762147041.db2.gz	UMZLJSCRDHAOSL-TUAOUCFPSA-N	1	1	304.412	1.706	20	5		DDBDMO
CCN1CC[C@@]2(C[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@@H]2C)C1=O	ZINC001169025836	762203647	/nfs/dbraw/zinc/20/36/47/762203647.db2.gz	ZGHNKMYSVBISMA-FQLMCAECSA-N	1	1	309.410	1.622	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](Oc3ncc(F)cn3)C2)C1	ZINC001169054389	762210220	/nfs/dbraw/zinc/21/02/20/762210220.db2.gz	LTEJMGNVMCYJCB-RAIGVLPGSA-N	1	1	310.329	1.514	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1cc2cccnc2c([N+](=O)[O-])c1	ZINC001170342977	766275130	/nfs/dbraw/zinc/27/51/30/766275130.db2.gz	NMYMZZZGTKRORO-UHFFFAOYSA-N	1	1	313.317	1.844	20	5		DDBDMO
CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2	ZINC001048525291	769492560	/nfs/dbraw/zinc/49/25/60/769492560.db2.gz	SMBAJYRTAVVBNC-YIDVYQOGSA-N	1	1	321.421	1.977	20	5		DDBDMO
CC(C)=CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001048525291	769492568	/nfs/dbraw/zinc/49/25/68/769492568.db2.gz	SMBAJYRTAVVBNC-YIDVYQOGSA-N	1	1	321.421	1.977	20	5		DDBDMO
CC(C)=CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001048525291	769492573	/nfs/dbraw/zinc/49/25/73/769492573.db2.gz	SMBAJYRTAVVBNC-YIDVYQOGSA-N	1	1	321.421	1.977	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001093787420	775078134	/nfs/dbraw/zinc/07/81/34/775078134.db2.gz	CBCXAVPCXYAGOB-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2CC[C@@H](CO)C2)c1F	ZINC001173188881	777036330	/nfs/dbraw/zinc/03/63/30/777036330.db2.gz	HPOYHAGYPWJTRD-GHMZBOCLSA-N	1	1	312.341	1.988	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2CC[C@@H](CO)C2)c1F	ZINC001173188892	777036746	/nfs/dbraw/zinc/03/67/46/777036746.db2.gz	HPOYHAGYPWJTRD-WDEREUQCSA-N	1	1	312.341	1.988	20	5		DDBDMO
COCCN1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001173220665	777053531	/nfs/dbraw/zinc/05/35/31/777053531.db2.gz	BTJQXFVHDRBTEV-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1c(CC(=O)NCc2c[nH+]c3n2CCC3)cccc1[N+](=O)[O-]	ZINC001177740627	778718071	/nfs/dbraw/zinc/71/80/71/778718071.db2.gz	WCDGMQMTDSRZQH-UHFFFAOYSA-N	1	1	314.345	1.905	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(C)(C)C1	ZINC001178709318	779154456	/nfs/dbraw/zinc/15/44/56/779154456.db2.gz	MDOBQLYLOGHHHL-ZDUSSCGKSA-N	1	1	309.341	1.733	20	5		DDBDMO
Cc1cc(C[N@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)on1	ZINC001267257758	837680455	/nfs/dbraw/zinc/68/04/55/837680455.db2.gz	SSYPYHFWJUQHTC-ZIAGYGMSSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1cc(C[N@@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)on1	ZINC001267257758	837680459	/nfs/dbraw/zinc/68/04/59/837680459.db2.gz	SSYPYHFWJUQHTC-ZIAGYGMSSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1cc(C[N@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)on1	ZINC001267257758	837680464	/nfs/dbraw/zinc/68/04/64/837680464.db2.gz	SSYPYHFWJUQHTC-ZIAGYGMSSA-N	1	1	324.381	1.365	20	5		DDBDMO
C[NH+](C)C=Cc1cc(Nc2c[nH]c(=O)nc2N)ncc1[N+](=O)[O-]	ZINC001155264151	861910232	/nfs/dbraw/zinc/91/02/32/861910232.db2.gz	ZNGJYVTULVTHOS-ONEGZZNKSA-N	1	1	317.309	1.344	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cc(C)n2)C1	ZINC001148553841	850804825	/nfs/dbraw/zinc/80/48/25/850804825.db2.gz	VYISZYGHLVRCAU-GFCCVEGCSA-N	1	1	306.366	1.712	20	5		DDBDMO
CN(C)C1(CNc2cc(N)c([N+](=O)[O-])cn2)CC[NH+](C)CC1	ZINC001156182353	862787430	/nfs/dbraw/zinc/78/74/30/862787430.db2.gz	QOINSKXDNMQABT-UHFFFAOYSA-N	1	1	308.386	1.010	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C(C)(C)C1	ZINC001156827367	863372361	/nfs/dbraw/zinc/37/23/61/863372361.db2.gz	CCFZCYYAUYSMGK-GFCCVEGCSA-N	1	1	324.356	1.776	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](C(=O)NC3CC3)C2)c1[N+](=O)[O-]	ZINC001333581883	866858932	/nfs/dbraw/zinc/85/89/32/866858932.db2.gz	HNSRLWQAICAPCA-SNVBAGLBSA-N	1	1	308.338	1.382	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](C(=O)NC3CC3)C2)c1[N+](=O)[O-]	ZINC001333581883	866858946	/nfs/dbraw/zinc/85/89/46/866858946.db2.gz	HNSRLWQAICAPCA-SNVBAGLBSA-N	1	1	308.338	1.382	20	5		DDBDMO
[NH3+][C@H]1CN(c2ncnc3cc([N+](=O)[O-])ccc32)CCC1(F)F	ZINC001164319625	869124203	/nfs/dbraw/zinc/12/42/03/869124203.db2.gz	KYXLDRJOQLGDQK-NSHDSACASA-N	1	1	309.276	1.711	20	5		DDBDMO
Cc1cnc(C[NH2+]CC2(CCNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)o1	ZINC001164490660	869230234	/nfs/dbraw/zinc/23/02/34/869230234.db2.gz	QCBTVVGDAKUBAV-VXGBXAGGSA-N	1	1	322.365	1.024	20	5		DDBDMO
CC(=O)c1c(N[C@@H](C)[C@@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085166	869790653	/nfs/dbraw/zinc/79/06/53/869790653.db2.gz	VLQABJDAHZELAA-NHYWBVRUSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1c(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085166	869790659	/nfs/dbraw/zinc/79/06/59/869790659.db2.gz	VLQABJDAHZELAA-NHYWBVRUSA-N	1	1	320.393	1.844	20	5		DDBDMO
CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1C[C@H](C)[N@@H+](CC)C[C@@H]1C	ZINC001340877179	871404664	/nfs/dbraw/zinc/40/46/64/871404664.db2.gz	CRXZWLLICMCJAS-SDDRHHMPSA-N	1	1	310.402	1.555	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC001347181894	874044847	/nfs/dbraw/zinc/04/48/47/874044847.db2.gz	PYCSMZQRQUPWOS-NSHDSACASA-N	1	1	308.382	1.813	20	5		DDBDMO
COCCCCC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001227258592	882939029	/nfs/dbraw/zinc/93/90/29/882939029.db2.gz	SYQWIIDBEYBIAK-ZIAGYGMSSA-N	1	1	313.398	1.049	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC001215998116	876839059	/nfs/dbraw/zinc/83/90/59/876839059.db2.gz	UVDJMWPEBSDAIW-LLVKDONJSA-N	1	1	307.354	1.265	20	5		DDBDMO
Nc1ccc2n(C(=O)[C@@H]3C[C@@H](N)C[NH2+]3)c3ccccc3cc-2c1=O	ZINC001219255825	878060290	/nfs/dbraw/zinc/06/02/90/878060290.db2.gz	LXNWDLSRBIMRFY-RISCZKNCSA-N	1	1	322.368	1.018	20	5		DDBDMO
CC(C)CCC[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001223114769	880835999	/nfs/dbraw/zinc/83/59/99/880835999.db2.gz	RPYHXJWXSNHHOF-HUUCEWRRSA-N	1	1	311.426	1.916	20	5		DDBDMO
COC(=O)c1c(CO[C@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC001223292873	880909340	/nfs/dbraw/zinc/90/93/40/880909340.db2.gz	BEYTXJHGYXPQCT-LBPRGKRZSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1nc(C3CC3)[nH]c(=O)c1[N+](=O)[O-])C2	ZINC001228607514	883571523	/nfs/dbraw/zinc/57/15/23/883571523.db2.gz	WBGYYDYTBSLRGV-URLYPYJESA-N	1	1	320.349	1.972	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1nc(C3CC3)[nH]c(=O)c1[N+](=O)[O-])C2	ZINC001228607514	883571533	/nfs/dbraw/zinc/57/15/33/883571533.db2.gz	WBGYYDYTBSLRGV-URLYPYJESA-N	1	1	320.349	1.972	20	5		DDBDMO
CC(C)C(=O)Nc1nc2nc[nH]c2c(O[C@H](C)C[N+](C)(C)C)n1	ZINC001230446754	884492924	/nfs/dbraw/zinc/49/29/24/884492924.db2.gz	WFZDBACOGKHVGN-SNVBAGLBSA-O	1	1	321.405	1.421	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCO[C@@H](CO)C3)CC2)cc1	ZINC001254474072	896456345	/nfs/dbraw/zinc/45/63/45/896456345.db2.gz	KVHBWBSJOSQSFL-MRXNPFEDSA-N	1	1	321.377	1.257	20	5		DDBDMO
CC(=O)N1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@@H](C)C1	ZINC001254608703	896530836	/nfs/dbraw/zinc/53/08/36/896530836.db2.gz	SJYLCYWGSNSCRG-ZBEGNZNMSA-N	1	1	303.362	1.615	20	5		DDBDMO
CC(=O)N1CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@@H](C)C1	ZINC001254608703	896530845	/nfs/dbraw/zinc/53/08/45/896530845.db2.gz	SJYLCYWGSNSCRG-ZBEGNZNMSA-N	1	1	303.362	1.615	20	5		DDBDMO
CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccsc1	ZINC001266042800	902824373	/nfs/dbraw/zinc/82/43/73/902824373.db2.gz	PDMSMCPMNDVPKU-CHWSQXEVSA-N	1	1	311.407	1.742	20	5		DDBDMO
CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccsc1	ZINC001266042800	902824389	/nfs/dbraw/zinc/82/43/89/902824389.db2.gz	PDMSMCPMNDVPKU-CHWSQXEVSA-N	1	1	311.407	1.742	20	5		DDBDMO
CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccsc1	ZINC001266042800	902824402	/nfs/dbraw/zinc/82/44/02/902824402.db2.gz	PDMSMCPMNDVPKU-CHWSQXEVSA-N	1	1	311.407	1.742	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001293854983	914734116	/nfs/dbraw/zinc/73/41/16/914734116.db2.gz	KABQUWDTXATABP-UHFFFAOYSA-N	1	1	317.349	1.892	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+]1C1CC1	ZINC000278503522	214196445	/nfs/dbraw/zinc/19/64/45/214196445.db2.gz	VVHBUINZYQHHKX-OAHLLOKOSA-N	1	1	303.362	1.880	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C(C)(C)C(N)=O	ZINC000451138521	231017039	/nfs/dbraw/zinc/01/70/39/231017039.db2.gz	ZMUFKIRGCSHSDZ-UHFFFAOYSA-N	1	1	322.365	1.428	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](CCO)C[C@@H]1C	ZINC000452123110	231310230	/nfs/dbraw/zinc/31/02/30/231310230.db2.gz	IAXXAPLDBIYJLB-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](CCCO)C1	ZINC000452136607	231317850	/nfs/dbraw/zinc/31/78/50/231317850.db2.gz	YSWUJQZHDXKHCC-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](CCCO)C1	ZINC000452136607	231317853	/nfs/dbraw/zinc/31/78/53/231317853.db2.gz	YSWUJQZHDXKHCC-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
C[N@@H+](CCCCNc1cccc(C(N)=O)c1[N+](=O)[O-])C1CC1	ZINC000413348890	529884296	/nfs/dbraw/zinc/88/42/96/529884296.db2.gz	PSMUXEOCOBIKED-UHFFFAOYSA-N	1	1	306.366	1.980	20	5		DDBDMO
C[N@@H+](CCNC(=O)OC(C)(C)C)CCn1cc([N+](=O)[O-])cn1	ZINC000297322165	529915795	/nfs/dbraw/zinc/91/57/95/529915795.db2.gz	CSPWLVNMISGXTO-UHFFFAOYSA-N	1	1	313.358	1.248	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000330897379	232145625	/nfs/dbraw/zinc/14/56/25/232145625.db2.gz	HLLLYKIXJRLJSP-VXGBXAGGSA-N	1	1	307.350	1.573	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000286837785	219190402	/nfs/dbraw/zinc/19/04/02/219190402.db2.gz	XYCLGEQDXSBUFB-UHFFFAOYSA-N	1	1	321.337	1.505	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C	ZINC000358391862	299140327	/nfs/dbraw/zinc/14/03/27/299140327.db2.gz	ITIQALUXLALPCD-CMPLNLGQSA-N	1	1	309.341	1.875	20	5		DDBDMO
COC[C@@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000279783346	215144132	/nfs/dbraw/zinc/14/41/32/215144132.db2.gz	LNLCGOSHGZQLEF-GFCCVEGCSA-N	1	1	323.374	1.815	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O	ZINC000159581685	186129241	/nfs/dbraw/zinc/12/92/41/186129241.db2.gz	OOWAGRPRUYSLNB-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](CCn1cccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181868728	186212732	/nfs/dbraw/zinc/21/27/32/186212732.db2.gz	AOPHEOIMUYJGTD-ZDUSSCGKSA-N	1	1	320.349	1.163	20	5		DDBDMO
C[C@H]1CSCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000172590333	198118960	/nfs/dbraw/zinc/11/89/60/198118960.db2.gz	DRLUAKVRTAVZJX-AAEUAGOBSA-N	1	1	312.391	1.772	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000043149044	352362921	/nfs/dbraw/zinc/36/29/21/352362921.db2.gz	VAROWPPOVPOZMM-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000060410898	352872562	/nfs/dbraw/zinc/87/25/62/352872562.db2.gz	KCYGONHABKWOPT-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000068520257	353116448	/nfs/dbraw/zinc/11/64/48/353116448.db2.gz	BYDSONUEWRBGFN-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000070870427	353184734	/nfs/dbraw/zinc/18/47/34/353184734.db2.gz	FMABQHAZTDEHSI-UHFFFAOYSA-N	1	1	321.333	1.144	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000174104996	198292562	/nfs/dbraw/zinc/29/25/62/198292562.db2.gz	MAQIPKSCXZQCPZ-CQSZACIVSA-N	1	1	324.377	1.959	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000174189028	198303231	/nfs/dbraw/zinc/30/32/31/198303231.db2.gz	FSFSBNGSGJHRBV-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1	ZINC000074764473	353329585	/nfs/dbraw/zinc/32/95/85/353329585.db2.gz	XXTVLTJKPUPLNM-UHFFFAOYSA-N	1	1	306.366	1.484	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000080389911	353605561	/nfs/dbraw/zinc/60/55/61/353605561.db2.gz	UGPUFPSDNGQEFY-UHFFFAOYSA-N	1	1	318.333	1.685	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000080605773	353617785	/nfs/dbraw/zinc/61/77/85/353617785.db2.gz	ZVFNSHYMZHDVCO-UHFFFAOYSA-N	1	1	308.382	1.847	20	5		DDBDMO
CC[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1N1CCOC1=O	ZINC000091461459	353827379	/nfs/dbraw/zinc/82/73/79/353827379.db2.gz	GSSQTBBHMNQSAB-UHFFFAOYSA-N	1	1	308.338	1.915	20	5		DDBDMO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000093064733	353884109	/nfs/dbraw/zinc/88/41/09/353884109.db2.gz	SUAKRCKROVPJES-KGLIPLIRSA-N	1	1	304.350	1.079	20	5		DDBDMO
CCNC(=O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000131311531	354099364	/nfs/dbraw/zinc/09/93/64/354099364.db2.gz	AGHLNGIEALJLGV-UHFFFAOYSA-N	1	1	303.265	1.422	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CC2)CC1	ZINC000149245095	354172274	/nfs/dbraw/zinc/17/22/74/354172274.db2.gz	PRLPODPIQNDCPE-UHFFFAOYSA-N	1	1	319.361	1.670	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000143978993	354152095	/nfs/dbraw/zinc/15/20/95/354152095.db2.gz	ICARADYTZUZCBE-NSHDSACASA-N	1	1	304.350	1.603	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739655	354200880	/nfs/dbraw/zinc/20/08/80/354200880.db2.gz	DYOOXXGQBNOPRR-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739655	354200885	/nfs/dbraw/zinc/20/08/85/354200885.db2.gz	DYOOXXGQBNOPRR-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346192525	283017438	/nfs/dbraw/zinc/01/74/38/283017438.db2.gz	NLMHDWPAINVCFG-HBNTYKKESA-N	1	1	307.354	1.120	20	5		DDBDMO
O=c1[nH]cnc2cc(N[C@H]3CC[N@H+](C4CC4)C3)c([N+](=O)[O-])cc21	ZINC000320983901	354530450	/nfs/dbraw/zinc/53/04/50/354530450.db2.gz	BNZSXYRURXVRHY-VIFPVBQESA-N	1	1	315.333	1.892	20	5		DDBDMO
C[C@@H](NC(=O)NC[C@]1(O)CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000358668487	299218168	/nfs/dbraw/zinc/21/81/68/299218168.db2.gz	XNRIFYZIDPGCGH-IAQYHMDHSA-N	1	1	322.365	1.022	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000322570957	354537626	/nfs/dbraw/zinc/53/76/26/354537626.db2.gz	FUMKGRKYHOUMSJ-CHWSQXEVSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706850	354831190	/nfs/dbraw/zinc/83/11/90/354831190.db2.gz	SKBFFHFHMQBQGB-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706850	354831195	/nfs/dbraw/zinc/83/11/95/354831195.db2.gz	SKBFFHFHMQBQGB-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2cc(N)c([N+](=O)[O-])c(CO)c2)C[C@H]1C	ZINC000588009276	354893472	/nfs/dbraw/zinc/89/34/72/354893472.db2.gz	DSMJUAXWGLCCQJ-MNOVXSKESA-N	1	1	308.382	1.588	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CCc3c[nH+]cn3C2)c([N+](=O)[O-])c1	ZINC000588067577	354898696	/nfs/dbraw/zinc/89/86/96/354898696.db2.gz	AADFNHOZZAZWGH-JTQLQIEISA-N	1	1	317.305	1.400	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Nc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000587416339	354882734	/nfs/dbraw/zinc/88/27/34/354882734.db2.gz	XSIYIENJPXOHHK-NSHDSACASA-N	1	1	322.365	1.981	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2CCCOC2)c1	ZINC000589516638	354998848	/nfs/dbraw/zinc/99/88/48/354998848.db2.gz	OOHQXABZDHWACI-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CCCOC2)c1	ZINC000589516638	354998852	/nfs/dbraw/zinc/99/88/52/354998852.db2.gz	OOHQXABZDHWACI-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590044137	355042333	/nfs/dbraw/zinc/04/23/33/355042333.db2.gz	HGHYQLITGDWLKP-YPMHNXCESA-N	1	1	305.334	1.136	20	5		DDBDMO
COC(=O)[C@H]1C[C@H](O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000592196511	355533116	/nfs/dbraw/zinc/53/31/16/355533116.db2.gz	CBXZXDGZKCIPFD-STQMWFEESA-N	1	1	308.334	1.259	20	5		DDBDMO
CC1([NH3+])CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000592485243	355596094	/nfs/dbraw/zinc/59/60/94/355596094.db2.gz	SWVBSLDZMKPWTM-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
COc1ncncc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000592513989	355609088	/nfs/dbraw/zinc/60/90/88/355609088.db2.gz	NVAMAXXEPCZXGM-UHFFFAOYSA-N	1	1	318.337	1.427	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000593107958	355800035	/nfs/dbraw/zinc/80/00/35/355800035.db2.gz	RTRVCCUDSCLMQD-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000593107958	355800039	/nfs/dbraw/zinc/80/00/39/355800039.db2.gz	RTRVCCUDSCLMQD-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H](C)C(C)(C)O)c1	ZINC000593029601	355774737	/nfs/dbraw/zinc/77/47/37/355774737.db2.gz	CTSLGAVMKAXGFX-SNVBAGLBSA-N	1	1	310.350	1.973	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000593516281	355910722	/nfs/dbraw/zinc/91/07/22/355910722.db2.gz	CRUODMQKTVPYPT-UHFFFAOYSA-N	1	1	324.381	1.083	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593573239	355930529	/nfs/dbraw/zinc/93/05/29/355930529.db2.gz	VWKNNMAZCWBHRY-WDEREUQCSA-N	1	1	309.341	1.827	20	5		DDBDMO
[NH3+]C[C@H]1C[N@H+](Cc2cc([O-])ccc2[N+](=O)[O-])CC12CCOCC2	ZINC000593727030	355977034	/nfs/dbraw/zinc/97/70/34/355977034.db2.gz	APWCMFNOQRIXEH-ZDUSSCGKSA-N	1	1	321.377	1.488	20	5		DDBDMO
[NH3+]C[C@H]1C[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])CC12CCOCC2	ZINC000593727030	355977036	/nfs/dbraw/zinc/97/70/36/355977036.db2.gz	APWCMFNOQRIXEH-ZDUSSCGKSA-N	1	1	321.377	1.488	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000594055358	356101411	/nfs/dbraw/zinc/10/14/11/356101411.db2.gz	KZDXKESHWMJTCX-BXUZGUMPSA-N	1	1	310.350	1.180	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594200385	356137912	/nfs/dbraw/zinc/13/79/12/356137912.db2.gz	LRQWSSHZPJDCFR-OLZOCXBDSA-N	1	1	306.366	1.680	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594200417	356138357	/nfs/dbraw/zinc/13/83/57/356138357.db2.gz	LVXPZTJKPOFQEM-NWDGAFQWSA-N	1	1	321.381	1.383	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC[C@H]2c2ccc(F)cc2)c1	ZINC000594716036	356294397	/nfs/dbraw/zinc/29/43/97/356294397.db2.gz	GWZOXUPYWIFDGD-GJZGRUSLSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H]2c2ccc(F)cc2)c1	ZINC000594716036	356294401	/nfs/dbraw/zinc/29/44/01/356294401.db2.gz	GWZOXUPYWIFDGD-GJZGRUSLSA-N	1	1	320.324	1.738	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019557	356372814	/nfs/dbraw/zinc/37/28/14/356372814.db2.gz	QXZWBVXBCNAQGA-STQMWFEESA-N	1	1	323.393	1.975	20	5		DDBDMO
COCC[N@H+]1CC[C@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019557	356372818	/nfs/dbraw/zinc/37/28/18/356372818.db2.gz	QXZWBVXBCNAQGA-STQMWFEESA-N	1	1	323.393	1.975	20	5		DDBDMO
O=C(CC[N@H+]1CCn2cncc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595491620	356516870	/nfs/dbraw/zinc/51/68/70/356516870.db2.gz	SQGWFIWBVDPZTR-UHFFFAOYSA-N	1	1	315.333	1.636	20	5		DDBDMO
Cc1noc(CN2CCC([N@@H+]3CCOC[C@H]3C)CC2)c1[N+](=O)[O-]	ZINC000595496403	356518917	/nfs/dbraw/zinc/51/89/17/356518917.db2.gz	BLJIFNFYEVADKU-LLVKDONJSA-N	1	1	324.381	1.576	20	5		DDBDMO
CCCC[C@H](C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236935457	202079470	/nfs/dbraw/zinc/07/94/70/202079470.db2.gz	SUABWTKFUIIPQK-SECBINFHSA-N	1	1	305.338	1.718	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@@H]1COCCO1	ZINC000595744994	356632605	/nfs/dbraw/zinc/63/26/05/356632605.db2.gz	XQNZRENLMQTPJL-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H]1COCCO1	ZINC000595744994	356632607	/nfs/dbraw/zinc/63/26/07/356632607.db2.gz	XQNZRENLMQTPJL-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2NC(=O)CC[C@H]2C1	ZINC000595736345	356628330	/nfs/dbraw/zinc/62/83/30/356628330.db2.gz	FAVGTCMYXPGLPT-SMDDNHRTSA-N	1	1	319.361	1.704	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CC[C@@]3(O)C[C@H]3C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595757466	356640151	/nfs/dbraw/zinc/64/01/51/356640151.db2.gz	MCSPSAMWCKWMRP-HZUKXOBISA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CC[C@@]3(O)C[C@H]3C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595757466	356640154	/nfs/dbraw/zinc/64/01/54/356640154.db2.gz	MCSPSAMWCKWMRP-HZUKXOBISA-N	1	1	317.345	1.157	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+](C2CC2)C1	ZINC000596255402	356834525	/nfs/dbraw/zinc/83/45/25/356834525.db2.gz	OKKSUUPBOWELEO-LLVKDONJSA-N	1	1	318.377	1.614	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)n1	ZINC000597861453	357362596	/nfs/dbraw/zinc/36/25/96/357362596.db2.gz	UNMKCFBFTRCDTL-NSHDSACASA-N	1	1	323.397	1.661	20	5		DDBDMO
CCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](CC)C1	ZINC000598042774	357439625	/nfs/dbraw/zinc/43/96/25/357439625.db2.gz	YATPBODSMDUCKK-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598512441	357612002	/nfs/dbraw/zinc/61/20/02/357612002.db2.gz	SQXHOCALEUJVLA-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598512441	357612008	/nfs/dbraw/zinc/61/20/08/357612008.db2.gz	SQXHOCALEUJVLA-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000598648771	357669920	/nfs/dbraw/zinc/66/99/20/357669920.db2.gz	HGEAZGKGYOHXAO-CHWSQXEVSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000598648771	357669927	/nfs/dbraw/zinc/66/99/27/357669927.db2.gz	HGEAZGKGYOHXAO-CHWSQXEVSA-N	1	1	321.377	1.508	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000598716206	357701753	/nfs/dbraw/zinc/70/17/53/357701753.db2.gz	AIFMNIWVMXDIRD-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599643654	358003804	/nfs/dbraw/zinc/00/38/04/358003804.db2.gz	BUJDNDFIDKKDMY-KLPPZKSPSA-N	1	1	320.349	1.037	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@H]2CCC[C@H]21	ZINC000599661224	358013712	/nfs/dbraw/zinc/01/37/12/358013712.db2.gz	TVCUSCRLCKCBBO-XQQFMLRXSA-N	1	1	322.365	1.455	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000599704830	358032964	/nfs/dbraw/zinc/03/29/64/358032964.db2.gz	UVHWKCCOKKHLPY-AWEZNQCLSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CCCF)CC1	ZINC000600071546	358115151	/nfs/dbraw/zinc/11/51/51/358115151.db2.gz	DOPWVGBXCRVYFA-UHFFFAOYSA-N	1	1	310.329	1.416	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000600205853	358156584	/nfs/dbraw/zinc/15/65/84/358156584.db2.gz	XVFBOIYKQLTNCQ-IYBDPMFKSA-N	1	1	308.378	1.716	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000600312986	358192782	/nfs/dbraw/zinc/19/27/82/358192782.db2.gz	WLZOLQLNSKIGLF-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=C(NCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C1CC1	ZINC000601100585	358402219	/nfs/dbraw/zinc/40/22/19/358402219.db2.gz	OELWELSHZYYGII-UHFFFAOYSA-N	1	1	300.318	1.503	20	5		DDBDMO
Cc1nccc([C@@H]2CCC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000602448570	358983926	/nfs/dbraw/zinc/98/39/26/358983926.db2.gz	MKUJIYUBPHXQLN-GFCCVEGCSA-N	1	1	316.365	1.806	20	5		DDBDMO
Cc1nccc([C@@H]2CCC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000602448570	358983928	/nfs/dbraw/zinc/98/39/28/358983928.db2.gz	MKUJIYUBPHXQLN-GFCCVEGCSA-N	1	1	316.365	1.806	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]2C1	ZINC000602673581	359118565	/nfs/dbraw/zinc/11/85/65/359118565.db2.gz	WAVQSHPJGFRCTJ-MFKMUULPSA-N	1	1	302.334	1.872	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@H](Cc2cnn(C)c2)C1	ZINC000602778368	359185248	/nfs/dbraw/zinc/18/52/48/359185248.db2.gz	AYXALHGQCISMIB-CYBMUJFWSA-N	1	1	318.381	1.398	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602829656	359222688	/nfs/dbraw/zinc/22/26/88/359222688.db2.gz	WZUIXVGCQXCROH-GFCCVEGCSA-N	1	1	309.370	1.209	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC000602950566	359316559	/nfs/dbraw/zinc/31/65/59/359316559.db2.gz	FUZFZLMGKIXLHL-WDEREUQCSA-N	1	1	307.354	1.276	20	5		DDBDMO
CCN(C(=O)Nc1c(C)cncc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000602961630	359325030	/nfs/dbraw/zinc/32/50/30/359325030.db2.gz	XZMKUTDSPXHDIS-LBPRGKRZSA-N	1	1	321.381	1.668	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cn2cc(C[N@H+]3CCC[C@@H]3CO)nn2)c1	ZINC000603165175	359449799	/nfs/dbraw/zinc/44/97/99/359449799.db2.gz	VKOIGJMHZDKRBZ-OAHLLOKOSA-N	1	1	317.349	1.191	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cn2cc(C[N@@H+]3CCC[C@@H]3CO)nn2)c1	ZINC000603165175	359449804	/nfs/dbraw/zinc/44/98/04/359449804.db2.gz	VKOIGJMHZDKRBZ-OAHLLOKOSA-N	1	1	317.349	1.191	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000186758478	200005263	/nfs/dbraw/zinc/00/52/63/200005263.db2.gz	CMFKGAQTQTZNQR-HNNXBMFYSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000186758478	200005264	/nfs/dbraw/zinc/00/52/64/200005264.db2.gz	CMFKGAQTQTZNQR-HNNXBMFYSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN(CC[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000186758478	200005266	/nfs/dbraw/zinc/00/52/66/200005266.db2.gz	CMFKGAQTQTZNQR-HNNXBMFYSA-N	1	1	323.393	1.361	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000187675240	200143047	/nfs/dbraw/zinc/14/30/47/200143047.db2.gz	IIRBQNMORBKUNW-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000604278244	359731911	/nfs/dbraw/zinc/73/19/11/359731911.db2.gz	XTTSHDRRJFMUCQ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N[C@@H]1CCC[N@H+](C)C1	ZINC000604278244	359731913	/nfs/dbraw/zinc/73/19/13/359731913.db2.gz	XTTSHDRRJFMUCQ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609399730	360304645	/nfs/dbraw/zinc/30/46/45/360304645.db2.gz	MLENLWSTPZLRND-CQSZACIVSA-N	1	1	318.377	1.878	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C(C)(C)CO)c([N+](=O)[O-])c1	ZINC000609895008	360364047	/nfs/dbraw/zinc/36/40/47/360364047.db2.gz	YXNDBPRYUHMFIM-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C(C)(C)CO)c([N+](=O)[O-])c1	ZINC000609895008	360364052	/nfs/dbraw/zinc/36/40/52/360364052.db2.gz	YXNDBPRYUHMFIM-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1	ZINC000610504991	360455487	/nfs/dbraw/zinc/45/54/87/360455487.db2.gz	PSJITOCUXNSNOU-HUUCEWRRSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1	ZINC000610504991	360455492	/nfs/dbraw/zinc/45/54/92/360455492.db2.gz	PSJITOCUXNSNOU-HUUCEWRRSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762617	360530817	/nfs/dbraw/zinc/53/08/17/360530817.db2.gz	GUAXHQIEJUSUCF-JSGCOSHPSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762617	360530822	/nfs/dbraw/zinc/53/08/22/360530822.db2.gz	GUAXHQIEJUSUCF-JSGCOSHPSA-N	1	1	301.346	1.968	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611564061	360760951	/nfs/dbraw/zinc/76/09/51/360760951.db2.gz	VAXGEIWCBLSGSI-NWDGAFQWSA-N	1	1	322.361	1.959	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000611823804	360835077	/nfs/dbraw/zinc/83/50/77/360835077.db2.gz	XVXPNCYYBWXYHN-UHFFFAOYSA-N	1	1	320.349	1.915	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@]2(CC[N@H+](C)C2)C1	ZINC000292596647	223164860	/nfs/dbraw/zinc/16/48/60/223164860.db2.gz	RIQXUGDPVHDKBY-HNNXBMFYSA-N	1	1	321.381	1.044	20	5		DDBDMO
COCC[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000193651043	201096297	/nfs/dbraw/zinc/09/62/97/201096297.db2.gz	GGSVAZIEELYHSI-UHFFFAOYSA-N	1	1	324.337	1.267	20	5		DDBDMO
COCCC[N@H+](CCO)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194821796	201295706	/nfs/dbraw/zinc/29/57/06/201295706.db2.gz	FAWIMVWBPVLUHP-UHFFFAOYSA-N	1	1	313.310	1.334	20	5		DDBDMO
COCCC[N@@H+](CCO)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194821796	201295709	/nfs/dbraw/zinc/29/57/09/201295709.db2.gz	FAWIMVWBPVLUHP-UHFFFAOYSA-N	1	1	313.310	1.334	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252433	363945204	/nfs/dbraw/zinc/94/52/04/363945204.db2.gz	LKXFTCIZXGATTF-PWSUYJOCSA-N	1	1	322.340	1.435	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000275271071	212238030	/nfs/dbraw/zinc/23/80/30/212238030.db2.gz	UUZPFOOFPHFJBE-NSHDSACASA-N	1	1	305.334	1.834	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000275271071	212238032	/nfs/dbraw/zinc/23/80/32/212238032.db2.gz	UUZPFOOFPHFJBE-NSHDSACASA-N	1	1	305.334	1.834	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288576827	220254070	/nfs/dbraw/zinc/25/40/70/220254070.db2.gz	UUSWGKUZJHVSJC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288576827	220254073	/nfs/dbraw/zinc/25/40/73/220254073.db2.gz	UUSWGKUZJHVSJC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288576827	220254076	/nfs/dbraw/zinc/25/40/76/220254076.db2.gz	UUSWGKUZJHVSJC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288576827	220254080	/nfs/dbraw/zinc/25/40/80/220254080.db2.gz	UUSWGKUZJHVSJC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000334042163	249190630	/nfs/dbraw/zinc/19/06/30/249190630.db2.gz	GZFYJTBZHWJYGS-PWSUYJOCSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000159482580	197357311	/nfs/dbraw/zinc/35/73/11/197357311.db2.gz	JINJVWZMNLFTIV-BDAKNGLRSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000159482580	197357313	/nfs/dbraw/zinc/35/73/13/197357313.db2.gz	JINJVWZMNLFTIV-BDAKNGLRSA-N	1	1	315.757	1.888	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1(CO)CC1	ZINC000285350465	218392316	/nfs/dbraw/zinc/39/23/16/218392316.db2.gz	AVSYZLMRVDHBHI-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nnnc2Sc2ccc([N+](=O)[O-])cc2)C1	ZINC000340745915	251189499	/nfs/dbraw/zinc/18/94/99/251189499.db2.gz	SABCAHMFWCZGEE-JTQLQIEISA-N	1	1	320.378	1.684	20	5		DDBDMO
C[C@H]1CCCC[N@@H+]1CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269193920	207313959	/nfs/dbraw/zinc/31/39/59/207313959.db2.gz	PBWGHVGIRHYRAX-NSHDSACASA-N	1	1	307.350	1.905	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269193920	207313963	/nfs/dbraw/zinc/31/39/63/207313963.db2.gz	PBWGHVGIRHYRAX-NSHDSACASA-N	1	1	307.350	1.905	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](CCO)CC2CC2)c([N+](=O)[O-])c1	ZINC000352458979	285063810	/nfs/dbraw/zinc/06/38/10/285063810.db2.gz	RIJXQUJZUBMYNV-UHFFFAOYSA-N	1	1	323.349	1.246	20	5		DDBDMO
C[C@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000288616590	220292320	/nfs/dbraw/zinc/29/23/20/220292320.db2.gz	RAWJXEVIOZRPMR-GZMMTYOYSA-N	1	1	318.782	1.771	20	5		DDBDMO
CNc1nc(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000458216833	533076199	/nfs/dbraw/zinc/07/61/99/533076199.db2.gz	VPLPULVINRFJCW-NSHDSACASA-N	1	1	321.381	1.493	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000158701264	197295246	/nfs/dbraw/zinc/29/52/46/197295246.db2.gz	MVIZKTMFILADPE-CQSZACIVSA-N	1	1	307.354	1.096	20	5		DDBDMO
COc1cc(C[NH+]2CCC(C(N)=O)CC2)c([N+](=O)[O-])cc1OC	ZINC000158604852	197287432	/nfs/dbraw/zinc/28/74/32/197287432.db2.gz	CYSXRBKEWXWANK-UHFFFAOYSA-N	1	1	323.349	1.309	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000155354028	197047411	/nfs/dbraw/zinc/04/74/11/197047411.db2.gz	IPIWDDOHYMRRPW-NSHDSACASA-N	1	1	322.365	1.380	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@H](O)C(F)(F)F)C2)nc1	ZINC000121613588	195317325	/nfs/dbraw/zinc/31/73/25/195317325.db2.gz	CUHSTHUGSJZPTG-WPRPVWTQSA-N	1	1	320.271	1.399	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@H](O)C(F)(F)F)C2)nc1	ZINC000121613588	195317327	/nfs/dbraw/zinc/31/73/27/195317327.db2.gz	CUHSTHUGSJZPTG-WPRPVWTQSA-N	1	1	320.271	1.399	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000451565644	533410279	/nfs/dbraw/zinc/41/02/79/533410279.db2.gz	LMYGYWPNHWHDKR-IUODEOHRSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000451565644	533410282	/nfs/dbraw/zinc/41/02/82/533410282.db2.gz	LMYGYWPNHWHDKR-IUODEOHRSA-N	1	1	321.377	1.914	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000452063833	533671351	/nfs/dbraw/zinc/67/13/51/533671351.db2.gz	CKWOCFPCJRPCEB-BXUZGUMPSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000452063833	533671354	/nfs/dbraw/zinc/67/13/54/533671354.db2.gz	CKWOCFPCJRPCEB-BXUZGUMPSA-N	1	1	319.361	1.187	20	5		DDBDMO
COc1ccc(C[NH2+][C@@H](C)c2ccc(=O)[nH]n2)cc1[N+](=O)[O-]	ZINC000353383568	285698692	/nfs/dbraw/zinc/69/86/92/285698692.db2.gz	GBHCRJZVWKOWGW-VIFPVBQESA-N	1	1	304.306	1.950	20	5		DDBDMO
COCCC[N@H+](CCO)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000189926509	292342488	/nfs/dbraw/zinc/34/24/88/292342488.db2.gz	DKUIAEJHVKCSRU-UHFFFAOYSA-N	1	1	316.329	1.573	20	5		DDBDMO
COCCC[N@@H+](CCO)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000189926509	292342489	/nfs/dbraw/zinc/34/24/89/292342489.db2.gz	DKUIAEJHVKCSRU-UHFFFAOYSA-N	1	1	316.329	1.573	20	5		DDBDMO
CCC[N@H+]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000074290041	406908718	/nfs/dbraw/zinc/90/87/18/406908718.db2.gz	RZEGDDBKIAYZDO-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000084440155	407089009	/nfs/dbraw/zinc/08/90/09/407089009.db2.gz	QIVXXCWMVNOYLO-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
COCC[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000054353708	407183517	/nfs/dbraw/zinc/18/35/17/407183517.db2.gz	QPIAMHRCXCSKSH-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
COCC[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000054353708	407183520	/nfs/dbraw/zinc/18/35/20/407183520.db2.gz	QPIAMHRCXCSKSH-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000066832884	407260030	/nfs/dbraw/zinc/26/00/30/407260030.db2.gz	JLMMPGPZUXHHML-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000123247023	407323874	/nfs/dbraw/zinc/32/38/74/407323874.db2.gz	WHTUENXVUYFUOZ-RYUDHWBXSA-N	1	1	323.397	1.468	20	5		DDBDMO
CCOc1ccc(C(=O)N2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000098072430	407305403	/nfs/dbraw/zinc/30/54/03/407305403.db2.gz	FQIMQUYBCXQOAU-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000126047937	407403587	/nfs/dbraw/zinc/40/35/87/407403587.db2.gz	GDPPBWZYJCQJLZ-OCCSQVGLSA-N	1	1	320.393	1.805	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1	ZINC000127027912	407426179	/nfs/dbraw/zinc/42/61/79/407426179.db2.gz	NISICDHMDTZEGH-UHFFFAOYSA-N	1	1	308.338	1.253	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000265762648	407442928	/nfs/dbraw/zinc/44/29/28/407442928.db2.gz	HISXIZFDRNSJKR-TZMCWYRMSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[C@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266540034	407550936	/nfs/dbraw/zinc/55/09/36/407550936.db2.gz	PRXSKKMKVQBXKL-SWLSCSKDSA-N	1	1	316.361	1.772	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Cc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000152172120	407576775	/nfs/dbraw/zinc/57/67/75/407576775.db2.gz	ZDWORJDQPBYLPR-UHFFFAOYSA-N	1	1	309.341	1.877	20	5		DDBDMO
CC[C@@H]1CN(c2ncc(C)cc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000266216031	407533198	/nfs/dbraw/zinc/53/31/98/407533198.db2.gz	OXRYOESIPHCNJY-CYBMUJFWSA-N	1	1	308.382	1.845	20	5		DDBDMO
CC[C@H]1CN(c2ncc(C)cc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000266216036	407535317	/nfs/dbraw/zinc/53/53/17/407535317.db2.gz	OXRYOESIPHCNJY-ZDUSSCGKSA-N	1	1	308.382	1.845	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](CO)C1	ZINC000260675610	407536649	/nfs/dbraw/zinc/53/66/49/407536649.db2.gz	YBGFALMGHNWEKR-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](CO)C1	ZINC000260675610	407536655	/nfs/dbraw/zinc/53/66/55/407536655.db2.gz	YBGFALMGHNWEKR-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
C[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])CN1CC[NH+](C)CC1	ZINC000114140988	407545204	/nfs/dbraw/zinc/54/52/04/407545204.db2.gz	JXTPSNHKTDHTHQ-CYBMUJFWSA-N	1	1	320.393	1.208	20	5		DDBDMO
Cc1nn(C)c(N2CCC(Cc3[nH+]ccn3C)CC2)c1[N+](=O)[O-]	ZINC000114709660	407602376	/nfs/dbraw/zinc/60/23/76/407602376.db2.gz	QYDNNUDRUGIVBM-UHFFFAOYSA-N	1	1	318.381	1.829	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC([C@H](C)[NH3+])CC2)c1[N+](=O)[O-]	ZINC000178850790	407624454	/nfs/dbraw/zinc/62/44/54/407624454.db2.gz	RBIVBPFDJCSFLE-VIFPVBQESA-N	1	1	309.370	1.470	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000267214644	407793954	/nfs/dbraw/zinc/79/39/54/407793954.db2.gz	IALYZZVJWWALTP-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272336853	407873670	/nfs/dbraw/zinc/87/36/70/407873670.db2.gz	MLXBGIVGXBNKDP-LBPRGKRZSA-N	1	1	313.304	1.897	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000268242970	407965618	/nfs/dbraw/zinc/96/56/18/407965618.db2.gz	VGABIQLVQBMZAW-MFKMUULPSA-N	1	1	319.361	1.816	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000245418488	407972270	/nfs/dbraw/zinc/97/22/70/407972270.db2.gz	AVNOIIBWGRTLRJ-RISCZKNCSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000245418488	407972279	/nfs/dbraw/zinc/97/22/79/407972279.db2.gz	AVNOIIBWGRTLRJ-RISCZKNCSA-N	1	1	307.350	1.493	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000268177658	407928645	/nfs/dbraw/zinc/92/86/45/407928645.db2.gz	KWSHIZRJLPPIEF-XHDPSFHLSA-N	1	1	319.361	1.573	20	5		DDBDMO
CC[C@@H](c1ccncc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245714591	408048680	/nfs/dbraw/zinc/04/86/80/408048680.db2.gz	PWTOXOXDNXDGBV-CABCVRRESA-N	1	1	319.365	1.630	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCOC3(CCC3)C2)c1	ZINC000154158016	407984548	/nfs/dbraw/zinc/98/45/48/407984548.db2.gz	HASUCRIQGLQWSF-AWEZNQCLSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOC3(CCC3)C2)c1	ZINC000154158016	407984553	/nfs/dbraw/zinc/98/45/53/407984553.db2.gz	HASUCRIQGLQWSF-AWEZNQCLSA-N	1	1	322.361	1.589	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000154862961	408098397	/nfs/dbraw/zinc/09/83/97/408098397.db2.gz	MPIRBIBVYGPGJR-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
CCOC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000136806011	408127633	/nfs/dbraw/zinc/12/76/33/408127633.db2.gz	UIODTKGWPISSPQ-ZFWWWQNUSA-N	1	1	322.361	1.903	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)CC1	ZINC000190218575	408191065	/nfs/dbraw/zinc/19/10/65/408191065.db2.gz	LKMBQJHCUNNYIW-UHFFFAOYSA-N	1	1	307.350	1.690	20	5		DDBDMO
C[NH+]1CCC(N2CCC(Nc3ncc([N+](=O)[O-])cn3)CC2)CC1	ZINC000273614532	408265407	/nfs/dbraw/zinc/26/54/07/408265407.db2.gz	MYCPTWQBGJMPIR-UHFFFAOYSA-N	1	1	320.397	1.355	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176221223	408315637	/nfs/dbraw/zinc/31/56/37/408315637.db2.gz	SHWWDMWFIMONNO-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@]3(CCOC3)C2)c1	ZINC000246739043	408330044	/nfs/dbraw/zinc/33/00/44/408330044.db2.gz	AWLGLJXJMURAHC-GOEBONIOSA-N	1	1	322.361	1.447	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]2C[NH+](C)C)c1[N+](=O)[O-]	ZINC000269445295	408313367	/nfs/dbraw/zinc/31/33/67/408313367.db2.gz	QIKWCFCULXJNDL-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000274244932	408340211	/nfs/dbraw/zinc/34/02/11/408340211.db2.gz	SNWGRWSVIZJDAK-XJKSGUPXSA-N	1	1	323.393	1.281	20	5		DDBDMO
CC[C@](C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C(N)=O	ZINC000133965602	162068792	/nfs/dbraw/zinc/06/87/92/162068792.db2.gz	MSTNSHNZWVGMCC-AWEZNQCLSA-N	1	1	308.338	1.085	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000246844236	408352830	/nfs/dbraw/zinc/35/28/30/408352830.db2.gz	UMHLTFHMGWLTJB-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000246844236	408352833	/nfs/dbraw/zinc/35/28/33/408352833.db2.gz	UMHLTFHMGWLTJB-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000246977515	408378920	/nfs/dbraw/zinc/37/89/20/408378920.db2.gz	GFTGUXUIHIDTMX-DGCLKSJQSA-N	1	1	309.370	1.026	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000274548927	408445718	/nfs/dbraw/zinc/44/57/18/408445718.db2.gz	WQFMCJIZVLXLEM-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1	ZINC000183625345	408458883	/nfs/dbraw/zinc/45/88/83/408458883.db2.gz	JUAJWOTUOXLHAJ-UHFFFAOYSA-N	1	1	307.306	1.101	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000159446022	408408667	/nfs/dbraw/zinc/40/86/67/408408667.db2.gz	JEZKNLTWQLCCKI-ZJUUUORDSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000159446022	408408673	/nfs/dbraw/zinc/40/86/73/408408673.db2.gz	JEZKNLTWQLCCKI-ZJUUUORDSA-N	1	1	311.338	1.243	20	5		DDBDMO
O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[N@H+]2CCC[C@H]2C1	ZINC000264286479	408427769	/nfs/dbraw/zinc/42/77/69/408427769.db2.gz	KTPNOWVTIIACPO-LBPRGKRZSA-N	1	1	314.345	1.996	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C	ZINC000191482970	408431240	/nfs/dbraw/zinc/43/12/40/408431240.db2.gz	BEMCXCLUPRJUKH-LBPRGKRZSA-N	1	1	321.377	1.983	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000264410912	408480020	/nfs/dbraw/zinc/48/00/20/408480020.db2.gz	JNOAHRHTJIKRKO-GXFFZTMASA-N	1	1	307.350	1.429	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+](CCO)C2CCOCC2)cc1	ZINC000275639882	408630223	/nfs/dbraw/zinc/63/02/23/408630223.db2.gz	WBVGJPLEMFVSEY-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CC[N@@H+](CCO)CCNCc1ccc([N+](=O)[O-])cc1Cl	ZINC000184548209	408639574	/nfs/dbraw/zinc/63/95/74/408639574.db2.gz	QEFMCFITFSTFMP-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
CCN(CCO)CC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000184548209	408639581	/nfs/dbraw/zinc/63/95/81/408639581.db2.gz	QEFMCFITFSTFMP-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+](CCO)C1CCC1	ZINC000275920613	408719217	/nfs/dbraw/zinc/71/92/17/408719217.db2.gz	ZHBWHZMZGCSSFV-CYBMUJFWSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])[C@H](C)C1	ZINC000290814700	408838038	/nfs/dbraw/zinc/83/80/38/408838038.db2.gz	RQZRQIRZHWGZRH-PWSUYJOCSA-N	1	1	321.381	1.255	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000285773570	408861184	/nfs/dbraw/zinc/86/11/84/408861184.db2.gz	MQKZKYSPAZBLLD-NEPJUHHUSA-N	1	1	320.349	1.072	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000285773570	408861187	/nfs/dbraw/zinc/86/11/87/408861187.db2.gz	MQKZKYSPAZBLLD-NEPJUHHUSA-N	1	1	320.349	1.072	20	5		DDBDMO
C[C@H](O)C[C@H]1CCCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000286166586	408936240	/nfs/dbraw/zinc/93/62/40/408936240.db2.gz	WOIPALXJXAUSHJ-UONOGXRCSA-N	1	1	323.393	1.772	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000277620272	408978860	/nfs/dbraw/zinc/97/88/60/408978860.db2.gz	QWLUVAZLLRKAGJ-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C	ZINC000277638662	408982461	/nfs/dbraw/zinc/98/24/61/408982461.db2.gz	TUHZCGDKHVQUOJ-YGRLFVJLSA-N	1	1	319.361	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](O)CC3)o2)cc1	ZINC000293297474	409084466	/nfs/dbraw/zinc/08/44/66/409084466.db2.gz	WJBACZZEXZKRIP-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](O)CC3)o2)cc1	ZINC000293297474	409084469	/nfs/dbraw/zinc/08/44/69/409084469.db2.gz	WJBACZZEXZKRIP-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@H]1C[C@@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000279165401	409161832	/nfs/dbraw/zinc/16/18/32/409161832.db2.gz	IQFZFLPGDNRFQS-STQMWFEESA-N	1	1	320.393	1.853	20	5		DDBDMO
COc1cc(C[NH2+]Cc2cc(C)nn2C)c([N+](=O)[O-])cc1OC	ZINC000283812839	409220775	/nfs/dbraw/zinc/22/07/75/409220775.db2.gz	DEXIQWQEKJDPCD-UHFFFAOYSA-N	1	1	320.349	1.944	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC	ZINC000280403913	409308091	/nfs/dbraw/zinc/30/80/91/409308091.db2.gz	HHLRFXONAIUMRH-AWEZNQCLSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](O)C(C)(C)C2)c([N+](=O)[O-])cc1OC	ZINC000280403913	409308093	/nfs/dbraw/zinc/30/80/93/409308093.db2.gz	HHLRFXONAIUMRH-AWEZNQCLSA-N	1	1	310.350	1.815	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284321180	409318236	/nfs/dbraw/zinc/31/82/36/409318236.db2.gz	HXTDCEBXPSSCSQ-UHFFFAOYSA-N	1	1	312.345	1.778	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+](C1CC1)C1COC1	ZINC000295536799	409336206	/nfs/dbraw/zinc/33/62/06/409336206.db2.gz	VXCNETRKAAHLQA-CYBMUJFWSA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+](C1CC1)C1COC1	ZINC000295536799	409336211	/nfs/dbraw/zinc/33/62/11/409336211.db2.gz	VXCNETRKAAHLQA-CYBMUJFWSA-N	1	1	308.334	1.198	20	5		DDBDMO
C[N@@H+](CCCN1CCOCC1)CCc1ccccc1[N+](=O)[O-]	ZINC000285203258	409402869	/nfs/dbraw/zinc/40/28/69/409402869.db2.gz	DCXRDXVZNIWGGI-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
COc1ccc(OCC[N@H+](C2CC2)C2COC2)c([N+](=O)[O-])c1	ZINC000295395694	409466777	/nfs/dbraw/zinc/46/67/77/409466777.db2.gz	LNTIAGXDTBRZBD-UHFFFAOYSA-N	1	1	308.334	1.845	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C2CC2)C2COC2)c([N+](=O)[O-])c1	ZINC000295395694	409466779	/nfs/dbraw/zinc/46/67/79/409466779.db2.gz	LNTIAGXDTBRZBD-UHFFFAOYSA-N	1	1	308.334	1.845	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408156402	164245360	/nfs/dbraw/zinc/24/53/60/164245360.db2.gz	ZJLFGGFCYWXNAQ-RYUDHWBXSA-N	1	1	321.381	1.222	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)[N@H+](C)C1	ZINC000331658521	409742851	/nfs/dbraw/zinc/74/28/51/409742851.db2.gz	WTUPUCLPOKJBGJ-JSGCOSHPSA-N	1	1	305.334	1.203	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)[N@@H+](C)C1	ZINC000331658521	409742855	/nfs/dbraw/zinc/74/28/55/409742855.db2.gz	WTUPUCLPOKJBGJ-JSGCOSHPSA-N	1	1	305.334	1.203	20	5		DDBDMO
C[N@@H+](CC[C@H]1CCCO1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000342609863	409762648	/nfs/dbraw/zinc/76/26/48/409762648.db2.gz	WGULFFXXYIXQOS-LSDHHAIUSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC(=O)N[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000354670548	410005254	/nfs/dbraw/zinc/00/52/54/410005254.db2.gz	CESUBINIRMRZJW-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@H]1C	ZINC000343066372	410116320	/nfs/dbraw/zinc/11/63/20/410116320.db2.gz	FKWORRPFEYYIDH-VXGBXAGGSA-N	1	1	309.370	1.170	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@H](O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000355043804	410262109	/nfs/dbraw/zinc/26/21/09/410262109.db2.gz	SNXIWNUJOQSTQZ-CMPLNLGQSA-N	1	1	324.333	1.102	20	5		DDBDMO
COc1ccc(OCCN2CC[C@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])c1	ZINC000351847587	410284441	/nfs/dbraw/zinc/28/44/41/410284441.db2.gz	AQPRIDCYSKHMQV-NEPJUHHUSA-N	1	1	309.366	1.651	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCn3cc[nH+]c3C2)n1	ZINC000347103798	410347049	/nfs/dbraw/zinc/34/70/49/410347049.db2.gz	ANLLGQKMAGKKBF-MRVPVSSYSA-N	1	1	315.293	1.305	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000352013313	410413428	/nfs/dbraw/zinc/41/34/28/410413428.db2.gz	IPRQUWYDWRMPJD-MNOVXSKESA-N	1	1	309.370	1.041	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000343462141	410471610	/nfs/dbraw/zinc/47/16/10/410471610.db2.gz	SVSKYJSTVGPQLM-CMPLNLGQSA-N	1	1	307.350	1.816	20	5		DDBDMO
CCOCCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000339742047	410430036	/nfs/dbraw/zinc/43/00/36/410430036.db2.gz	YGIHUISJUOFYQT-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1	ZINC000358295505	410441846	/nfs/dbraw/zinc/44/18/46/410441846.db2.gz	BRBMLXOIMXDKGO-CYBMUJFWSA-N	1	1	317.292	1.675	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000343645196	410592326	/nfs/dbraw/zinc/59/23/26/410592326.db2.gz	TVCUNPWHGGQQOE-LLVKDONJSA-N	1	1	309.370	1.415	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000352201193	410544799	/nfs/dbraw/zinc/54/47/99/410544799.db2.gz	DTBGCEAGJXVXBV-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000352201193	410544804	/nfs/dbraw/zinc/54/48/04/410544804.db2.gz	DTBGCEAGJXVXBV-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ncccc3[N+](=O)[O-])CC2)C1	ZINC000301301642	410696001	/nfs/dbraw/zinc/69/60/01/410696001.db2.gz	RKKUVLFDLJKLEJ-CYBMUJFWSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337310863	410707392	/nfs/dbraw/zinc/70/73/92/410707392.db2.gz	BOQVATCONKFUIF-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CN(C)[C@@H](C)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337310863	410707397	/nfs/dbraw/zinc/70/73/97/410707397.db2.gz	BOQVATCONKFUIF-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CN(C)[C@@H](C)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337310863	410707401	/nfs/dbraw/zinc/70/74/01/410707401.db2.gz	BOQVATCONKFUIF-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[C@@H](C)[NH2+][C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccco1	ZINC000359533381	410714950	/nfs/dbraw/zinc/71/49/50/410714950.db2.gz	AFCSYKBEFBUAQV-NXEZZACHSA-N	1	1	321.337	1.770	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2C)c1	ZINC000330419126	410678984	/nfs/dbraw/zinc/67/89/84/410678984.db2.gz	CFSONBMJNZMYLS-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2C)c1	ZINC000330419126	410678988	/nfs/dbraw/zinc/67/89/88/410678988.db2.gz	CFSONBMJNZMYLS-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c4cccnc43)C[C@@H]21	ZINC000301692307	410774032	/nfs/dbraw/zinc/77/40/32/410774032.db2.gz	ZDGNQSLMJRHHPY-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C[C@@H](C)O)C[C@H]1C	ZINC000337427430	410777445	/nfs/dbraw/zinc/77/74/45/410777445.db2.gz	SWWNABANKIRICT-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343851573	410748325	/nfs/dbraw/zinc/74/83/25/410748325.db2.gz	DMPRQEQLFFAHNJ-GXTWGEPZSA-N	1	1	320.393	1.919	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000301928576	410834226	/nfs/dbraw/zinc/83/42/26/410834226.db2.gz	ITWBEZSZLFXIID-WCQYABFASA-N	1	1	307.398	1.811	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344032847	410909337	/nfs/dbraw/zinc/90/93/37/410909337.db2.gz	DXYADTZBPRABOV-BAESOJJISA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344064104	410931504	/nfs/dbraw/zinc/93/15/04/410931504.db2.gz	OSNAMWMAWKDLEC-NWJSVONSSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344064104	410931508	/nfs/dbraw/zinc/93/15/08/410931508.db2.gz	OSNAMWMAWKDLEC-NWJSVONSSA-N	1	1	319.361	1.625	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)c1[N+](=O)[O-]	ZINC000331300874	411066164	/nfs/dbraw/zinc/06/61/64/411066164.db2.gz	QZAUCAPYJLHYBQ-UHFFFAOYSA-N	1	1	323.397	1.732	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000331216403	411022479	/nfs/dbraw/zinc/02/24/79/411022479.db2.gz	VVYBLNLRTWBHDE-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC000331216403	411022482	/nfs/dbraw/zinc/02/24/82/411022482.db2.gz	VVYBLNLRTWBHDE-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1C[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000344215504	411032703	/nfs/dbraw/zinc/03/27/03/411032703.db2.gz	KVGSQMLKHXEROH-NXEZZACHSA-N	1	1	317.349	2.140	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000366332969	418459444	/nfs/dbraw/zinc/45/94/44/418459444.db2.gz	PNBADEOIFUWTCF-ADEWGFFLSA-N	1	1	303.318	1.250	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)[C@@H](C)C1	ZINC000360740318	418504110	/nfs/dbraw/zinc/50/41/10/418504110.db2.gz	VZUDDLHQLRPBNV-WDEREUQCSA-N	1	1	309.370	1.131	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000374836177	418567862	/nfs/dbraw/zinc/56/78/62/418567862.db2.gz	ZICQNKHAXYJCMX-VHSXEESVSA-N	1	1	322.340	1.673	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000195164490	418553613	/nfs/dbraw/zinc/55/36/13/418553613.db2.gz	NNGRMPWPDSSFNE-UHFFFAOYSA-N	1	1	310.329	1.310	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[NH+](CC(C)(C)O)CC1	ZINC000360961829	418556617	/nfs/dbraw/zinc/55/66/17/418556617.db2.gz	VHYOHPKWMADHFJ-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CCOc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000375036892	418593118	/nfs/dbraw/zinc/59/31/18/418593118.db2.gz	IJGGVTLPBJRZJV-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000341798428	418626043	/nfs/dbraw/zinc/62/60/43/418626043.db2.gz	KYDVACWGURZCKD-TUAOUCFPSA-N	1	1	320.397	1.809	20	5		DDBDMO
CO[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000361355985	418632971	/nfs/dbraw/zinc/63/29/71/418632971.db2.gz	KHLMITUNAQEBIN-LBPRGKRZSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000361355985	418632972	/nfs/dbraw/zinc/63/29/72/418632972.db2.gz	KHLMITUNAQEBIN-LBPRGKRZSA-N	1	1	304.306	1.866	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000368238172	418708554	/nfs/dbraw/zinc/70/85/54/418708554.db2.gz	BLLGAWVFIYEJSD-CMPLNLGQSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000368238172	418708556	/nfs/dbraw/zinc/70/85/56/418708556.db2.gz	BLLGAWVFIYEJSD-CMPLNLGQSA-N	1	1	309.753	1.816	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000364933276	418825445	/nfs/dbraw/zinc/82/54/45/418825445.db2.gz	MCAKHAHZJYAURR-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC1(CNC(=O)[C@H]2CC2[N+](=O)[O-])C[NH+](Cc2ccccc2)C1	ZINC000365564747	418876424	/nfs/dbraw/zinc/87/64/24/418876424.db2.gz	NQUKJWWCAIJFKQ-UONOGXRCSA-N	1	1	303.362	1.290	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2)C1CC1	ZINC000372840209	418907699	/nfs/dbraw/zinc/90/76/99/418907699.db2.gz	VWHYNTQPSQAING-IACUBPJLSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@H+](C[C@@H]1CC12CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840209	418907702	/nfs/dbraw/zinc/90/77/02/418907702.db2.gz	VWHYNTQPSQAING-IACUBPJLSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840209	418907705	/nfs/dbraw/zinc/90/77/05/418907705.db2.gz	VWHYNTQPSQAING-IACUBPJLSA-N	1	1	307.394	1.375	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000372933797	418914510	/nfs/dbraw/zinc/91/45/10/418914510.db2.gz	QQRQIOYPVFIMLG-LSDHHAIUSA-N	1	1	319.361	1.266	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000372933796	418914575	/nfs/dbraw/zinc/91/45/75/418914575.db2.gz	QQRQIOYPVFIMLG-HUUCEWRRSA-N	1	1	319.361	1.266	20	5		DDBDMO
CN1C[C@@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000365852762	418916147	/nfs/dbraw/zinc/91/61/47/418916147.db2.gz	XVZKOPSXLIVMEK-CYBMUJFWSA-N	1	1	320.349	1.025	20	5		DDBDMO
CN1C[C@@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000365852762	418916148	/nfs/dbraw/zinc/91/61/48/418916148.db2.gz	XVZKOPSXLIVMEK-CYBMUJFWSA-N	1	1	320.349	1.025	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]3CCO)n2)cc1	ZINC000426225412	419409538	/nfs/dbraw/zinc/40/95/38/419409538.db2.gz	FBRYOVKMNVMLIP-LBPRGKRZSA-N	1	1	318.333	1.992	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](C)C[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000420943304	419374022	/nfs/dbraw/zinc/37/40/22/419374022.db2.gz	POQPOECQNYKBRA-STQMWFEESA-N	1	1	324.377	1.933	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954655	419385581	/nfs/dbraw/zinc/38/55/81/419385581.db2.gz	ZPLPEHVUYXORML-QWRGUYRKSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954655	419385585	/nfs/dbraw/zinc/38/55/85/419385585.db2.gz	ZPLPEHVUYXORML-QWRGUYRKSA-N	1	1	304.350	1.921	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c1	ZINC000411938079	419507180	/nfs/dbraw/zinc/50/71/80/419507180.db2.gz	JOCWHSLPFUPVNQ-GJZGRUSLSA-N	1	1	302.334	1.599	20	5		DDBDMO
CNC(=O)NC1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000412056873	419602371	/nfs/dbraw/zinc/60/23/71/419602371.db2.gz	VJEKQYXDZXPSGM-UHFFFAOYSA-N	1	1	322.365	1.497	20	5		DDBDMO
C[C@@H](O)[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103855	419663638	/nfs/dbraw/zinc/66/36/38/419663638.db2.gz	ZKUCPNWBEXUSAX-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](O)[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103855	419663644	/nfs/dbraw/zinc/66/36/44/419663644.db2.gz	ZKUCPNWBEXUSAX-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](c1ccccc1)[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)C(N)=O	ZINC000428855622	419941307	/nfs/dbraw/zinc/94/13/07/419941307.db2.gz	HICHYZIFRZTDMR-GXFFZTMASA-N	1	1	317.349	1.076	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000430787131	420190331	/nfs/dbraw/zinc/19/03/31/420190331.db2.gz	FFLGINURLBHFHV-OCCSQVGLSA-N	1	1	321.377	1.881	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000416291928	420310586	/nfs/dbraw/zinc/31/05/86/420310586.db2.gz	IFTBUKDPRHEWEQ-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](CCO)C[C@H]1C	ZINC000416291928	420310587	/nfs/dbraw/zinc/31/05/87/420310587.db2.gz	IFTBUKDPRHEWEQ-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
COC(=O)c1cc(C)nc(N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000420638582	420338260	/nfs/dbraw/zinc/33/82/60/420338260.db2.gz	QQAWEXXOKDCXHM-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000455769101	421060160	/nfs/dbraw/zinc/06/01/60/421060160.db2.gz	YUSJAPJMERAGML-ZJUUUORDSA-N	1	1	307.354	1.244	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456026295	421091099	/nfs/dbraw/zinc/09/10/99/421091099.db2.gz	WZIYGHJULSACPS-NXEZZACHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456026295	421091103	/nfs/dbraw/zinc/09/11/03/421091103.db2.gz	WZIYGHJULSACPS-NXEZZACHSA-N	1	1	307.354	1.196	20	5		DDBDMO
NC(=O)c1ccc(N[C@@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000489939526	421180995	/nfs/dbraw/zinc/18/09/95/421180995.db2.gz	OYBBAMSOUOWQAV-SNVBAGLBSA-N	1	1	301.306	1.317	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000527119523	421357379	/nfs/dbraw/zinc/35/73/79/421357379.db2.gz	DORSLBRVMKISFR-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000527119523	421357382	/nfs/dbraw/zinc/35/73/82/421357382.db2.gz	DORSLBRVMKISFR-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000548739583	421469403	/nfs/dbraw/zinc/46/94/03/421469403.db2.gz	JJZNFXTYRBAOAV-PHIMTYICSA-N	1	1	323.397	1.804	20	5		DDBDMO
CC(C)(O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CCOCC1	ZINC000531416300	421633753	/nfs/dbraw/zinc/63/37/53/421633753.db2.gz	ALYISWCLRQBIHA-UHFFFAOYSA-N	1	1	312.370	1.043	20	5		DDBDMO
COc1ccc(CNC[C@@H](O)C[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000571577280	421727948	/nfs/dbraw/zinc/72/79/48/421727948.db2.gz	JTEHJVNBWYISEM-CYBMUJFWSA-N	1	1	309.366	1.148	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)C1CC1	ZINC000520549487	421755707	/nfs/dbraw/zinc/75/57/07/421755707.db2.gz	ZPUBNDCFEJRYNU-UHFFFAOYSA-N	1	1	321.333	1.538	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000542651509	421826135	/nfs/dbraw/zinc/82/61/35/421826135.db2.gz	GJAKEZXNICBHNP-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
CN(C)C(=O)CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000574627811	422144297	/nfs/dbraw/zinc/14/42/97/422144297.db2.gz	AWAUWAKPNDIPSF-LBPRGKRZSA-N	1	1	321.381	1.344	20	5		DDBDMO
CC(=O)NCC[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000578010672	422476338	/nfs/dbraw/zinc/47/63/38/422476338.db2.gz	YEIYOTLCJAGHTF-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3cccc(C(N)=O)c3[N+](=O)[O-])CC[C@@H]21	ZINC000342706710	271483431	/nfs/dbraw/zinc/48/34/31/271483431.db2.gz	ROVWMGGYPISMEF-YPMHNXCESA-N	1	1	318.377	1.614	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCCCS2(=O)=O)cs1	ZINC000344355424	272005850	/nfs/dbraw/zinc/00/58/50/272005850.db2.gz	LKXVUDZUWLBNLF-JTQLQIEISA-N	1	1	304.393	1.713	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000345282719	272208345	/nfs/dbraw/zinc/20/83/45/272208345.db2.gz	GQZPHLHXPBGOES-NXEZZACHSA-N	1	1	309.370	1.483	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000347479195	272703729	/nfs/dbraw/zinc/70/37/29/272703729.db2.gz	RUFGDDGNJQTUAN-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
COC(=O)Cc1ccc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000294851141	277331393	/nfs/dbraw/zinc/33/13/93/277331393.db2.gz	CCSMJWSZMGLKRO-TXEJJXNPSA-N	1	1	321.377	1.839	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421002728	279237235	/nfs/dbraw/zinc/23/72/35/279237235.db2.gz	MOXRGLXWLLBSRP-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCN1CCCC1	ZINC000089898545	281027108	/nfs/dbraw/zinc/02/71/08/281027108.db2.gz	FUZURQWGMOLQIL-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCN1CCCC1	ZINC000089898545	281027111	/nfs/dbraw/zinc/02/71/11/281027111.db2.gz	FUZURQWGMOLQIL-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000125231033	281204637	/nfs/dbraw/zinc/20/46/37/281204637.db2.gz	TUCRKFAXGKSFBY-IVMMDQJWSA-N	1	1	324.377	1.427	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2C[C@H](CO)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000362072582	300000444	/nfs/dbraw/zinc/00/04/44/300000444.db2.gz	OVIGEHNKKJIUOL-GHMZBOCLSA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2C[C@H](CO)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000362072582	300000446	/nfs/dbraw/zinc/00/04/46/300000446.db2.gz	OVIGEHNKKJIUOL-GHMZBOCLSA-N	1	1	323.349	1.102	20	5		DDBDMO
CCc1[nH+]ccn1[C@@H]1CCCN(Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000363451146	300269582	/nfs/dbraw/zinc/26/95/82/300269582.db2.gz	WQPIUXHIKXQXOO-GFCCVEGCSA-N	1	1	318.381	1.924	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000364208657	300357174	/nfs/dbraw/zinc/35/71/74/300357174.db2.gz	CZGCCGFTJMGHDQ-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
C[C@@H](c1cnccn1)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422064	301024952	/nfs/dbraw/zinc/02/49/52/301024952.db2.gz	KGZPAKLKQORXRQ-RYUDHWBXSA-N	1	1	302.338	1.979	20	5		DDBDMO
C[C@@H](c1cnccn1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422064	301024954	/nfs/dbraw/zinc/02/49/54/301024954.db2.gz	KGZPAKLKQORXRQ-RYUDHWBXSA-N	1	1	302.338	1.979	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000369136220	301135725	/nfs/dbraw/zinc/13/57/25/301135725.db2.gz	ARLBGOKATIXBSH-SNVBAGLBSA-N	1	1	321.381	1.627	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c1C	ZINC000054371024	301429368	/nfs/dbraw/zinc/42/93/68/301429368.db2.gz	JDOUVIPPSLRPDB-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000377058245	302138977	/nfs/dbraw/zinc/13/89/77/302138977.db2.gz	VKAYDHXURRATFT-WDEREUQCSA-N	1	1	306.322	1.052	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641906	302360134	/nfs/dbraw/zinc/36/01/34/302360134.db2.gz	XMMALNVQKMATHG-NWDGAFQWSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641906	302360135	/nfs/dbraw/zinc/36/01/35/302360135.db2.gz	XMMALNVQKMATHG-NWDGAFQWSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)c1ccco1	ZINC000531887977	303263790	/nfs/dbraw/zinc/26/37/90/303263790.db2.gz	PSWVLFGVKFEDDW-GFCCVEGCSA-N	1	1	304.306	1.616	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532143142	303277122	/nfs/dbraw/zinc/27/71/22/303277122.db2.gz	ILDQSLNUEIAVRC-GFCCVEGCSA-N	1	1	306.366	1.936	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)S(C)(=O)=O	ZINC000533129075	303311234	/nfs/dbraw/zinc/31/12/34/303311234.db2.gz	WUZALUKHSIKQRN-JTQLQIEISA-N	1	1	316.379	1.516	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1CO	ZINC000362090445	307013993	/nfs/dbraw/zinc/01/39/93/307013993.db2.gz	NHQPITCKCCIFJK-AAEUAGOBSA-N	1	1	319.361	1.044	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000362254293	307015642	/nfs/dbraw/zinc/01/56/42/307015642.db2.gz	ZFTWMTJZXLPMRR-LBPRGKRZSA-N	1	1	308.382	1.737	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000364894536	307052830	/nfs/dbraw/zinc/05/28/30/307052830.db2.gz	KJRYQMPIIXWBNE-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
Cc1ccn(C2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)n1	ZINC000364895767	307052893	/nfs/dbraw/zinc/05/28/93/307052893.db2.gz	NRFNSMNSZQUIAU-UHFFFAOYSA-N	1	1	304.354	1.670	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000365078312	307057931	/nfs/dbraw/zinc/05/79/31/307057931.db2.gz	STZDXCWYRUIEIG-ZWNOBZJWSA-N	1	1	320.349	1.307	20	5		DDBDMO
CC(=O)c1cc(N2CCC[N@H+]([C@@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000367450000	307093935	/nfs/dbraw/zinc/09/39/35/307093935.db2.gz	GEAGKCHGIABNAW-LBPRGKRZSA-N	1	1	321.377	1.690	20	5		DDBDMO
Nc1c(C(=O)NCc2c[nH+]c3n2CCCC3)cccc1[N+](=O)[O-]	ZINC000367641412	307099993	/nfs/dbraw/zinc/09/99/93/307099993.db2.gz	FQMOMWBQMQXDFT-UHFFFAOYSA-N	1	1	315.333	1.640	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1ccc(C(N)=O)cc1[N+](=O)[O-])CC2	ZINC000368881836	307112312	/nfs/dbraw/zinc/11/23/12/307112312.db2.gz	IIJUCQDAIUJYCL-UHFFFAOYSA-N	1	1	318.377	1.758	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CN1	ZINC000369483124	307121434	/nfs/dbraw/zinc/12/14/34/307121434.db2.gz	GLICAXYPFYNNRM-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CN1	ZINC000369483124	307121435	/nfs/dbraw/zinc/12/14/35/307121435.db2.gz	GLICAXYPFYNNRM-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]2[C@H]1C(N)=O	ZINC000373973973	307198893	/nfs/dbraw/zinc/19/88/93/307198893.db2.gz	CLLMSHQCONJHFL-XEGUGMAKSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@@H]2[C@H]1C(N)=O	ZINC000373973973	307198894	/nfs/dbraw/zinc/19/88/94/307198894.db2.gz	CLLMSHQCONJHFL-XEGUGMAKSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C[C@H]21	ZINC000378474493	307288791	/nfs/dbraw/zinc/28/87/91/307288791.db2.gz	RBEOYIPRHRRNOW-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC1(C)CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCS1	ZINC000434696157	307304458	/nfs/dbraw/zinc/30/44/58/307304458.db2.gz	XBGHLPRKAPFRHF-LBPRGKRZSA-N	1	1	314.411	1.370	20	5		DDBDMO
O=C1OCCN1C[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000496780942	307360909	/nfs/dbraw/zinc/36/09/09/307360909.db2.gz	IQYMWXYBLBBDID-AWEZNQCLSA-N	1	1	319.361	1.911	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC1	ZINC000571041529	308189626	/nfs/dbraw/zinc/18/96/26/308189626.db2.gz	UFEJHOBSSLRPLH-LBPRGKRZSA-N	1	1	320.393	1.371	20	5		DDBDMO
COC[C@@H](C)OC[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361707	332353745	/nfs/dbraw/zinc/35/37/45/332353745.db2.gz	PNXLTCHCCYVXKF-OCCSQVGLSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@@H](C)OC[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361707	332353746	/nfs/dbraw/zinc/35/37/46/332353746.db2.gz	PNXLTCHCCYVXKF-OCCSQVGLSA-N	1	1	324.377	1.365	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000451634546	534298627	/nfs/dbraw/zinc/29/86/27/534298627.db2.gz	RQCMMHGSWHRGIR-TYNCELHUSA-N	1	1	318.377	1.558	20	5		DDBDMO
CC(C)C(=O)N[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000330999371	527527574	/nfs/dbraw/zinc/52/75/74/527527574.db2.gz	NJOPKJWRSPZUAD-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC(C)C(=O)N[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000330999371	527527581	/nfs/dbraw/zinc/52/75/81/527527581.db2.gz	NJOPKJWRSPZUAD-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444643263	527820003	/nfs/dbraw/zinc/82/00/03/527820003.db2.gz	YRJGMKAFYDDTGT-UHFFFAOYSA-N	1	1	305.338	1.429	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H](C)CO	ZINC000292360272	527900951	/nfs/dbraw/zinc/90/09/51/527900951.db2.gz	XYVYYICFYUNISA-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000444174250	528513313	/nfs/dbraw/zinc/51/33/13/528513313.db2.gz	GIOUWSKVOHPOEV-UHFFFAOYSA-N	1	1	315.395	1.603	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000490293376	528721951	/nfs/dbraw/zinc/72/19/51/528721951.db2.gz	NPDLXRYBCATRJW-HNNXBMFYSA-N	1	1	320.393	1.805	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000797415227	700008252	/nfs/dbraw/zinc/00/82/52/700008252.db2.gz	SSYYQQVFUSXVGU-HNNXBMFYSA-N	1	1	317.349	1.360	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccc(C(N)=O)c1	ZINC000746663627	700035549	/nfs/dbraw/zinc/03/55/49/700035549.db2.gz	TVDPYSNPGOEGON-UHFFFAOYSA-N	1	1	303.322	1.022	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964242	696378805	/nfs/dbraw/zinc/37/88/05/696378805.db2.gz	UJZCOFAZXRSHMP-STQMWFEESA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964242	696378806	/nfs/dbraw/zinc/37/88/06/696378806.db2.gz	UJZCOFAZXRSHMP-STQMWFEESA-N	1	1	323.397	1.766	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000151983835	696893299	/nfs/dbraw/zinc/89/32/99/696893299.db2.gz	OCHWVYLDKPGKCE-UHFFFAOYSA-N	1	1	306.322	1.787	20	5		DDBDMO
COc1ccc(C(=O)OCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000748494025	700121742	/nfs/dbraw/zinc/12/17/42/700121742.db2.gz	GGFZTJYRDQJYEV-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCC2CCCC2)CC1	ZINC000981138004	697015711	/nfs/dbraw/zinc/01/57/11/697015711.db2.gz	KNROTTZZSCRCFH-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCC2CCCC2)CC1	ZINC000981138004	697015712	/nfs/dbraw/zinc/01/57/12/697015712.db2.gz	KNROTTZZSCRCFH-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCC2CCCC2)CC1	ZINC000981138004	697015716	/nfs/dbraw/zinc/01/57/16/697015716.db2.gz	KNROTTZZSCRCFH-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
CC(C)C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278623	697082016	/nfs/dbraw/zinc/08/20/16/697082016.db2.gz	LXVFFTZWPWGUEJ-XOUADPBQSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC(C)C[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278623	697082019	/nfs/dbraw/zinc/08/20/19/697082019.db2.gz	LXVFFTZWPWGUEJ-XOUADPBQSA-N	1	1	309.410	1.478	20	5		DDBDMO
CC(C)C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278623	697082021	/nfs/dbraw/zinc/08/20/21/697082021.db2.gz	LXVFFTZWPWGUEJ-XOUADPBQSA-N	1	1	309.410	1.478	20	5		DDBDMO
Cc1cccnc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000983649845	697286499	/nfs/dbraw/zinc/28/64/99/697286499.db2.gz	SRUAKYHHLJQYLC-RGCMKSIDSA-N	1	1	318.377	1.040	20	5		DDBDMO
CCCNC(=O)C[N@H+](CCC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579869	698120407	/nfs/dbraw/zinc/12/04/07/698120407.db2.gz	PAFXLQSBDZICOM-OAHLLOKOSA-N	1	1	323.393	1.866	20	5		DDBDMO
CCCNC(=O)C[N@@H+](CCC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579869	698120409	/nfs/dbraw/zinc/12/04/09/698120409.db2.gz	PAFXLQSBDZICOM-OAHLLOKOSA-N	1	1	323.393	1.866	20	5		DDBDMO
C[N@@H+](CCN1CCCC1=O)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581998	698120949	/nfs/dbraw/zinc/12/09/49/698120949.db2.gz	LHMCJNPEEMDIHA-CQSZACIVSA-N	1	1	307.350	1.182	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000742239767	699868940	/nfs/dbraw/zinc/86/89/40/699868940.db2.gz	HDANIGSDQGSUQR-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H]1C	ZINC000801934920	700357184	/nfs/dbraw/zinc/35/71/84/700357184.db2.gz	SSQPQBGYBXLIFK-ZJUUUORDSA-N	1	1	324.356	1.871	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@@H+]4CCOC[C@@H]4C3)sc2c1	ZINC000754080379	700481579	/nfs/dbraw/zinc/48/15/79/700481579.db2.gz	DNHUYZYOTBXRAY-NSHDSACASA-N	1	1	320.374	1.725	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4CCOC[C@@H]4C3)sc2c1	ZINC000754080379	700481580	/nfs/dbraw/zinc/48/15/80/700481580.db2.gz	DNHUYZYOTBXRAY-NSHDSACASA-N	1	1	320.374	1.725	20	5		DDBDMO
O=C1O[C@@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CC2	ZINC000763760042	700948102	/nfs/dbraw/zinc/94/81/02/700948102.db2.gz	LSUJLBFMUFQGFQ-GFCCVEGCSA-N	1	1	303.318	1.444	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CC2	ZINC000763760042	700948104	/nfs/dbraw/zinc/94/81/04/700948104.db2.gz	LSUJLBFMUFQGFQ-GFCCVEGCSA-N	1	1	303.318	1.444	20	5		DDBDMO
CN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000866068641	706609794	/nfs/dbraw/zinc/60/97/94/706609794.db2.gz	USDYQXYNGYMQJF-LBPRGKRZSA-N	1	1	309.341	1.829	20	5		DDBDMO
CCOCCN(CC)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867955044	701851786	/nfs/dbraw/zinc/85/17/86/701851786.db2.gz	VYBVAWXFPWFROS-HNNXBMFYSA-N	1	1	309.366	1.654	20	5		DDBDMO
CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000867970200	701863172	/nfs/dbraw/zinc/86/31/72/701863172.db2.gz	XLXMFFWTIXRHSW-TZMCWYRMSA-N	1	1	309.391	1.733	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC000866204650	706648052	/nfs/dbraw/zinc/64/80/52/706648052.db2.gz	FMUURESLXBONGC-BXUZGUMPSA-N	1	1	318.377	1.485	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3nc4ccccn4c3[N+](=O)[O-])CC[C@H]21	ZINC000866206014	706648490	/nfs/dbraw/zinc/64/84/90/706648490.db2.gz	ICIDIQGBTCXJBY-NWDGAFQWSA-N	1	1	301.350	1.773	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000840993563	702304733	/nfs/dbraw/zinc/30/47/33/702304733.db2.gz	CDGQTUDCUGMLFL-JTQLQIEISA-N	1	1	306.278	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH2+]C[C@@H]3CCCO3)n2)cc1	ZINC000842568849	702734325	/nfs/dbraw/zinc/73/43/25/702734325.db2.gz	CMIRGVHUQSBACW-LBPRGKRZSA-N	1	1	304.306	1.913	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)c1[N+](=O)[O-]	ZINC000843488043	702891598	/nfs/dbraw/zinc/89/15/98/702891598.db2.gz	WLUNOSIOCVDWRN-AWEZNQCLSA-N	1	1	313.304	1.816	20	5		DDBDMO
CC(C)[C@@H](C(=O)OCc1cn(C)nc1[N+](=O)[O-])[NH+]1CCCCC1	ZINC000847784447	703466198	/nfs/dbraw/zinc/46/61/98/703466198.db2.gz	SEVXRJPGRNOCEW-ZDUSSCGKSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H](N3CCOC3=O)C2)cccc1[N+](=O)[O-]	ZINC000852431658	704044787	/nfs/dbraw/zinc/04/47/87/704044787.db2.gz	JHGUHQFHJGPZCJ-ZDUSSCGKSA-N	1	1	305.334	1.930	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000852495439	704062441	/nfs/dbraw/zinc/06/24/41/704062441.db2.gz	KXFFXVZGFSMXHA-SNPRPXQTSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000852701694	704102691	/nfs/dbraw/zinc/10/26/91/704102691.db2.gz	DXFSUVZJJPASQZ-IINYFYTJSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000852701694	704102692	/nfs/dbraw/zinc/10/26/92/704102692.db2.gz	DXFSUVZJJPASQZ-IINYFYTJSA-N	1	1	309.322	1.953	20	5		DDBDMO
COc1cc(N2CC[N@@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])cc1C	ZINC000853477817	704246237	/nfs/dbraw/zinc/24/62/37/704246237.db2.gz	ZQYBYVCPHOPBKW-LBPRGKRZSA-N	1	1	307.350	1.433	20	5		DDBDMO
COc1cc(N2CC[N@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])cc1C	ZINC000853477817	704246239	/nfs/dbraw/zinc/24/62/39/704246239.db2.gz	ZQYBYVCPHOPBKW-LBPRGKRZSA-N	1	1	307.350	1.433	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[C@]2(CC[N@H+](C)C2)C1	ZINC000821030225	704361746	/nfs/dbraw/zinc/36/17/46/704361746.db2.gz	CPCSHHBHTPMPND-OAHLLOKOSA-N	1	1	321.381	1.044	20	5		DDBDMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC(C[NH+]2CCOCC2)C1	ZINC000854589931	704423181	/nfs/dbraw/zinc/42/31/81/704423181.db2.gz	IREWPDDVRAMBTR-UHFFFAOYSA-N	1	1	323.324	1.138	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000855163133	704471605	/nfs/dbraw/zinc/47/16/05/704471605.db2.gz	SYCVAGYSIKKEFR-ZIAGYGMSSA-N	1	1	321.377	1.617	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000855163132	704471614	/nfs/dbraw/zinc/47/16/14/704471614.db2.gz	SYCVAGYSIKKEFR-UONOGXRCSA-N	1	1	321.377	1.617	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000874444554	705068635	/nfs/dbraw/zinc/06/86/35/705068635.db2.gz	WTMKBNORHOWNLG-CYBMUJFWSA-N	1	1	321.377	1.662	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000824003001	705352668	/nfs/dbraw/zinc/35/26/68/705352668.db2.gz	LCFJYEHIXOROSD-RYUDHWBXSA-N	1	1	319.365	1.925	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000861345109	705436839	/nfs/dbraw/zinc/43/68/39/705436839.db2.gz	YWBYYBNHHFWONT-QMTHXVAHSA-N	1	1	311.338	1.199	20	5		DDBDMO
C[C@H](CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000825664409	705710549	/nfs/dbraw/zinc/71/05/49/705710549.db2.gz	FAAVRXXHNGPZMH-YGRLFVJLSA-N	1	1	307.350	1.227	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826646702	705833593	/nfs/dbraw/zinc/83/35/93/705833593.db2.gz	DRMGDQRVUIVVHS-SWLSCSKDSA-N	1	1	321.377	1.428	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1	ZINC000827330868	705977352	/nfs/dbraw/zinc/97/73/52/705977352.db2.gz	SKINIXDAJLKNPX-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000828145558	706127296	/nfs/dbraw/zinc/12/72/96/706127296.db2.gz	MHRFTKIOLOPHNN-CYBMUJFWSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000828145558	706127299	/nfs/dbraw/zinc/12/72/99/706127299.db2.gz	MHRFTKIOLOPHNN-CYBMUJFWSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000877618447	706160687	/nfs/dbraw/zinc/16/06/87/706160687.db2.gz	UXKIYMDEQYBLBT-UONOGXRCSA-N	1	1	305.378	1.462	20	5		DDBDMO
C[C@H]1CN(C(=O)CCC(C)(C)[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000829736425	706386072	/nfs/dbraw/zinc/38/60/72/706386072.db2.gz	IKKYZFNWBMQDEL-LBPRGKRZSA-N	1	1	315.414	1.126	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@@](C)(O)c1ccccc1	ZINC000878728337	706482884	/nfs/dbraw/zinc/48/28/84/706482884.db2.gz	LTSVJDSDYLHBRT-MRXNPFEDSA-N	1	1	318.377	1.939	20	5		DDBDMO
COc1ccc(CNc2cc3n(n2)CC[N@@H+](C)C3)cc1[N+](=O)[O-]	ZINC000865844288	706541897	/nfs/dbraw/zinc/54/18/97/706541897.db2.gz	HVJFBKRAPSSZIB-UHFFFAOYSA-N	1	1	317.349	1.857	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000879920539	706819849	/nfs/dbraw/zinc/81/98/49/706819849.db2.gz	ASCPUEYQFVGGBE-UHFFFAOYSA-N	1	1	323.349	1.493	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CO)(CO)CC1	ZINC000879971160	706839245	/nfs/dbraw/zinc/83/92/45/706839245.db2.gz	MXJWUAPZVBQYIP-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2CCC[N@H+]2C[C@@H]1CO	ZINC000880069017	706869350	/nfs/dbraw/zinc/86/93/50/706869350.db2.gz	RJSQSBVHGKKOFC-LSDHHAIUSA-N	1	1	321.377	1.244	20	5		DDBDMO
COCC1([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCC1	ZINC000880187366	706905355	/nfs/dbraw/zinc/90/53/55/706905355.db2.gz	JUIIYNANDAUWEL-AWEZNQCLSA-N	1	1	324.377	1.835	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000880302216	706933503	/nfs/dbraw/zinc/93/35/03/706933503.db2.gz	DPUPHITYDDAWMX-SNVBAGLBSA-N	1	1	308.260	1.445	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000880302216	706933506	/nfs/dbraw/zinc/93/35/06/706933506.db2.gz	DPUPHITYDDAWMX-SNVBAGLBSA-N	1	1	308.260	1.445	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2O	ZINC000872263110	707354469	/nfs/dbraw/zinc/35/44/69/707354469.db2.gz	WKQBXWBSGWPGDT-YUTCNCBUSA-N	1	1	308.382	1.581	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000837187659	707593551	/nfs/dbraw/zinc/59/35/51/707593551.db2.gz	AWXNEKKIGZBJAS-LSDHHAIUSA-N	1	1	321.377	1.569	20	5		DDBDMO
Cc1cc(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000838911490	708001729	/nfs/dbraw/zinc/00/17/29/708001729.db2.gz	BTCIROGQBIELDU-OKILXGFUSA-N	1	1	320.345	1.923	20	5		DDBDMO
Nc1ccc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897219935	708258022	/nfs/dbraw/zinc/25/80/22/708258022.db2.gz	QIXSAFORLSYVGA-OLZOCXBDSA-N	1	1	306.366	1.212	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897221371	708259254	/nfs/dbraw/zinc/25/92/54/708259254.db2.gz	MBDSGDKSQTZXHM-QWHCGFSZSA-N	1	1	323.397	1.155	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](Cn2ccnn2)C1	ZINC000886084240	708695421	/nfs/dbraw/zinc/69/54/21/708695421.db2.gz	SZYGCJDRSKFNKL-GFCCVEGCSA-N	1	1	302.338	1.494	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H]4[C@H](O)CC[C@@H]4C3)nc2c1	ZINC000886574119	708779204	/nfs/dbraw/zinc/77/92/04/708779204.db2.gz	OQTYTQARUOFPNU-OLUVUFQESA-N	1	1	302.334	1.674	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4[C@H](O)CC[C@@H]4C3)nc2c1	ZINC000886574119	708779206	/nfs/dbraw/zinc/77/92/06/708779206.db2.gz	OQTYTQARUOFPNU-OLUVUFQESA-N	1	1	302.334	1.674	20	5		DDBDMO
C[N@H+](CCc1ccc2c(c1)OCO2)CCn1ccc([N+](=O)[O-])n1	ZINC000887095275	708953978	/nfs/dbraw/zinc/95/39/78/708953978.db2.gz	FTQPACRHJPKESK-UHFFFAOYSA-N	1	1	318.333	1.695	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887929287	709168183	/nfs/dbraw/zinc/16/81/83/709168183.db2.gz	QOGTZILIVRBPMD-BMIGLBTASA-N	1	1	304.350	1.201	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000890078336	709737199	/nfs/dbraw/zinc/73/71/99/709737199.db2.gz	AWLCOWBOFBJOEW-UHFFFAOYSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C	ZINC000928440063	713197047	/nfs/dbraw/zinc/19/70/47/713197047.db2.gz	AMGROLIEJPFZIE-RNCFNFMXSA-N	1	1	311.769	2.000	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+][C@@H](C)C(=O)N(C)OC)cc([N+](=O)[O-])c1	ZINC000903209004	711065920	/nfs/dbraw/zinc/06/59/20/711065920.db2.gz	DDHWHSWYRYJWII-ZJUUUORDSA-N	1	1	311.338	1.662	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2c(N)cccc2[N+](=O)[O-])C[C@@H]1C	ZINC000912025196	711129737	/nfs/dbraw/zinc/12/97/37/711129737.db2.gz	ZKJWEAWMDPAOHM-PHIMTYICSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000913533341	713247627	/nfs/dbraw/zinc/24/76/27/713247627.db2.gz	NPYDWDUXCWLTOI-TXEJJXNPSA-N	1	1	307.325	1.581	20	5		DDBDMO
O=[N+]([O-])c1cc(Br)cnc1N[C@@H]1Cc2c[nH+]cn2C1	ZINC000894997227	711357442	/nfs/dbraw/zinc/35/74/42/711357442.db2.gz	XMDJKAXVXVIKTL-MRVPVSSYSA-N	1	1	324.138	1.986	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000913537410	713249042	/nfs/dbraw/zinc/24/90/42/713249042.db2.gz	HQDNVZMKSBCVGH-PHIMTYICSA-N	1	1	323.324	1.418	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000913537410	713249043	/nfs/dbraw/zinc/24/90/43/713249043.db2.gz	HQDNVZMKSBCVGH-PHIMTYICSA-N	1	1	323.324	1.418	20	5		DDBDMO
C[C@H]1[C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000895738214	711591093	/nfs/dbraw/zinc/59/10/93/711591093.db2.gz	IATWKYPQOBCONY-GXSJLCMTSA-N	1	1	313.379	1.503	20	5		DDBDMO
C[C@H]1[C@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895738214	711591096	/nfs/dbraw/zinc/59/10/96/711591096.db2.gz	IATWKYPQOBCONY-GXSJLCMTSA-N	1	1	313.379	1.503	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CCC([C@@H](C)O)CC2)c1[N+](=O)[O-]	ZINC000895815922	711615219	/nfs/dbraw/zinc/61/52/19/711615219.db2.gz	ORPXYRIYQXHMNJ-SNVBAGLBSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000913933883	713321845	/nfs/dbraw/zinc/32/18/45/713321845.db2.gz	USZZDXSDUPAFSR-VXGBXAGGSA-N	1	1	321.381	1.399	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)C2(O)CCC2)C2CC2)c1	ZINC000929853342	713707430	/nfs/dbraw/zinc/70/74/30/713707430.db2.gz	LYDONWWDJYYHMX-OAHLLOKOSA-N	1	1	306.362	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)C1(O)CCC1)C1CC1	ZINC000930061230	713746926	/nfs/dbraw/zinc/74/69/26/713746926.db2.gz	PGYQSKNINMUWHG-OAHLLOKOSA-N	1	1	306.362	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)C1(O)CCC1)C1CC1	ZINC000930061230	713746928	/nfs/dbraw/zinc/74/69/28/713746928.db2.gz	PGYQSKNINMUWHG-OAHLLOKOSA-N	1	1	306.362	1.835	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@H]2COC[C@@H]2O1	ZINC000930441066	713835924	/nfs/dbraw/zinc/83/59/24/713835924.db2.gz	QXWKVHMGTLHOKI-DZKIICNBSA-N	1	1	306.362	1.873	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000921681045	713841266	/nfs/dbraw/zinc/84/12/66/713841266.db2.gz	PPKIZLWIFJQNTH-BXUZGUMPSA-N	1	1	306.366	1.529	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000930684316	713895904	/nfs/dbraw/zinc/89/59/04/713895904.db2.gz	OVJANDGHURFVPJ-RYUDHWBXSA-N	1	1	301.387	1.746	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000931434145	714096216	/nfs/dbraw/zinc/09/62/16/714096216.db2.gz	NITZHVJCXGGUJL-OLZOCXBDSA-N	1	1	318.377	1.417	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](C3OCCO3)C2)cc1	ZINC000932003465	714230690	/nfs/dbraw/zinc/23/06/90/714230690.db2.gz	PWASTLKWPCSLRX-OCCSQVGLSA-N	1	1	308.334	1.323	20	5		DDBDMO
C[C@]1([C@@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)COC(=O)N1	ZINC000932016807	714236009	/nfs/dbraw/zinc/23/60/09/714236009.db2.gz	PLDAUXNTJOCUFG-IUODEOHRSA-N	1	1	320.349	1.700	20	5		DDBDMO
COc1c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cccc1[N+](=O)[O-]	ZINC000923267392	714290196	/nfs/dbraw/zinc/29/01/96/714290196.db2.gz	DVHVWZOLQDVEBN-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCn3nc(C4CC4)cc3C2)n1	ZINC000932605541	714366155	/nfs/dbraw/zinc/36/61/55/714366155.db2.gz	FYFAMJLTCOBJQT-UHFFFAOYSA-N	1	1	302.338	1.381	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCn3nc(C4CC4)cc3C2)n1	ZINC000932605541	714366158	/nfs/dbraw/zinc/36/61/58/714366158.db2.gz	FYFAMJLTCOBJQT-UHFFFAOYSA-N	1	1	302.338	1.381	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H]2C2OCCO2)c1	ZINC000933900313	714696637	/nfs/dbraw/zinc/69/66/37/714696637.db2.gz	JIUMPIXXMAFMMM-UONOGXRCSA-N	1	1	308.334	1.466	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H]2C2OCCO2)c1	ZINC000933900313	714696639	/nfs/dbraw/zinc/69/66/39/714696639.db2.gz	JIUMPIXXMAFMMM-UONOGXRCSA-N	1	1	308.334	1.466	20	5		DDBDMO
O=C1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCCCCN1	ZINC000934162294	714758369	/nfs/dbraw/zinc/75/83/69/714758369.db2.gz	INORZFKVTLOGBZ-UHFFFAOYSA-N	1	1	321.377	1.966	20	5		DDBDMO
Cc1cc(Cl)c([N+](=O)[O-])c(N2C[C@H]3OCC[N@H+](C)[C@@H]3C2)n1	ZINC001164664952	719386522	/nfs/dbraw/zinc/38/65/22/719386522.db2.gz	DCKYTSDPZIORCL-GHMZBOCLSA-N	1	1	312.757	1.471	20	5		DDBDMO
COc1ncnc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)c1[N+](=O)[O-]	ZINC001164774286	721288458	/nfs/dbraw/zinc/28/84/58/721288458.db2.gz	YTFQGBHSECVVHY-UHFFFAOYSA-N	1	1	319.365	1.316	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000610514187	721901535	/nfs/dbraw/zinc/90/15/35/721901535.db2.gz	JSCUDUBLNRXPJZ-CQSZACIVSA-N	1	1	306.366	1.599	20	5		DDBDMO
CN(CCNC(=O)C[N@@H+](C)C1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC001100386793	732306068	/nfs/dbraw/zinc/30/60/68/732306068.db2.gz	VWFPLRPTCGFDMG-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
CC(C)c1cccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])n1	ZINC001126932224	742776505	/nfs/dbraw/zinc/77/65/05/742776505.db2.gz	NBZICUGFIAZPSR-TZMCWYRMSA-N	1	1	306.366	1.076	20	5		DDBDMO
Cn1cc(C[NH2+]C2(C(=O)NCC3CC3)CCCC2)c([N+](=O)[O-])n1	ZINC001191831231	745623983	/nfs/dbraw/zinc/62/39/83/745623983.db2.gz	FSQKWBLPRDMOEC-UHFFFAOYSA-N	1	1	321.381	1.257	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC001198883807	747645400	/nfs/dbraw/zinc/64/54/00/747645400.db2.gz	VJIJPXFAFVAJBI-HNNXBMFYSA-N	1	1	320.393	1.584	20	5		DDBDMO
O=C(c1ccco1)N1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169007156	762174893	/nfs/dbraw/zinc/17/48/93/762174893.db2.gz	LOHCKSDVOTZOBN-STQMWFEESA-N	1	1	307.350	1.483	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)sn1	ZINC001086084067	760944871	/nfs/dbraw/zinc/94/48/71/760944871.db2.gz	AVCAZONRFHSKGR-LYIQGSDWSA-N	1	1	324.406	1.101	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CC2CC3(CCC3)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363318	761493055	/nfs/dbraw/zinc/49/30/55/761493055.db2.gz	NXMURTOLNLLCFA-NMFUWQPSSA-N	1	1	321.421	1.716	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1cc2cc[nH]c2c([N+](=O)[O-])c1	ZINC001170340370	766274124	/nfs/dbraw/zinc/27/41/24/766274124.db2.gz	UXJCCLYBTANPGF-UHFFFAOYSA-N	1	1	301.306	1.777	20	5		DDBDMO
COC(=O)C[C@H]1COCC[N@@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173231913	777063630	/nfs/dbraw/zinc/06/36/30/777063630.db2.gz	OTFMTZKPJQMVRV-DOMZBBRYSA-N	1	1	322.361	1.790	20	5		DDBDMO
COC(=O)C[C@H]1COCC[N@H+]1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173231913	777063636	/nfs/dbraw/zinc/06/36/36/777063636.db2.gz	OTFMTZKPJQMVRV-DOMZBBRYSA-N	1	1	322.361	1.790	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(C(=O)N(C)C)CC1	ZINC001173229407	777063698	/nfs/dbraw/zinc/06/36/98/777063698.db2.gz	UJYDXJXLWBRFSG-ZDUSSCGKSA-N	1	1	320.393	1.825	20	5		DDBDMO
CCN(C(=O)OC(C)(C)C)C1CC[NH+](CC[N+](=O)[O-])CC1	ZINC001177057030	778417858	/nfs/dbraw/zinc/41/78/58/778417858.db2.gz	KNPKJXQSJPAAEN-UHFFFAOYSA-N	1	1	301.387	1.985	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC001116442116	780509969	/nfs/dbraw/zinc/50/99/69/780509969.db2.gz	IHJOAANFQBJTMH-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC001116442116	780509974	/nfs/dbraw/zinc/50/99/74/780509974.db2.gz	IHJOAANFQBJTMH-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CCn1cc([C@@H](O)C[N@H+](CC[N+](=O)[O-])Cc2ccccc2)cn1	ZINC001119767203	781600307	/nfs/dbraw/zinc/60/03/07/781600307.db2.gz	QCIJWLLNMSEZPD-INIZCTEOSA-N	1	1	318.377	1.715	20	5		DDBDMO
CCn1cc([C@@H](O)C[N@@H+](CC[N+](=O)[O-])Cc2ccccc2)cn1	ZINC001119767203	781600313	/nfs/dbraw/zinc/60/03/13/781600313.db2.gz	QCIJWLLNMSEZPD-INIZCTEOSA-N	1	1	318.377	1.715	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@]2(C1)CCC[N@@H+](C)C2	ZINC001120040271	781734597	/nfs/dbraw/zinc/73/45/97/781734597.db2.gz	CBVCMYYIFCQQCF-OAHLLOKOSA-N	1	1	306.366	1.921	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001326482966	861401164	/nfs/dbraw/zinc/40/11/64/861401164.db2.gz	RPNNPAOIBDOEBH-BYCMXARLSA-N	1	1	321.377	1.427	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cnon1	ZINC001272138810	844648416	/nfs/dbraw/zinc/64/84/16/844648416.db2.gz	ZJPPQTNBUWAXCY-UHFFFAOYSA-N	1	1	319.321	1.182	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CC1=CCCCC1	ZINC001124810593	859820265	/nfs/dbraw/zinc/82/02/65/859820265.db2.gz	WPBLDOGRRFHBDD-UHFFFAOYSA-N	1	1	321.381	1.425	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC1	ZINC001137818863	859981454	/nfs/dbraw/zinc/98/14/54/859981454.db2.gz	ABUDNXZKBIUBOK-UHFFFAOYSA-N	1	1	324.768	1.822	20	5		DDBDMO
O=C(NCC[NH+]1CC=CC1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC001320144172	866507459	/nfs/dbraw/zinc/50/74/59/866507459.db2.gz	SQYYJFVPADJFDZ-UHFFFAOYSA-N	1	1	311.288	1.675	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC001320576748	866848730	/nfs/dbraw/zinc/84/87/30/866848730.db2.gz	ZOKZOIBGIOBMSB-CYBMUJFWSA-N	1	1	306.366	1.457	20	5		DDBDMO
Nc1ccc(NC(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC001333885846	867116416	/nfs/dbraw/zinc/11/64/16/867116416.db2.gz	QWQFOYYBYDPHQN-GFCCVEGCSA-N	1	1	319.365	1.879	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N[C@H]2CCCNC(=O)C2)ncc1[N+](=O)[O-]	ZINC001162454031	867546260	/nfs/dbraw/zinc/54/62/60/867546260.db2.gz	NBUYKNDAOICSSR-PZBABLGHSA-N	1	1	319.365	1.603	20	5		DDBDMO
C[N@H+](CCC(N)=O)Cc1ccc([N+](=O)[O-])cc1Br	ZINC001321850087	867832783	/nfs/dbraw/zinc/83/27/83/867832783.db2.gz	NRCIRPLGTIYDGH-UHFFFAOYSA-N	1	1	316.155	1.665	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1ccc([N+](=O)[O-])cc1Br	ZINC001321850087	867832795	/nfs/dbraw/zinc/83/27/95/867832795.db2.gz	NRCIRPLGTIYDGH-UHFFFAOYSA-N	1	1	316.155	1.665	20	5		DDBDMO
Cn1cc[nH+]c1C[C@H]1CCCN(c2c([N+](=O)[O-])cnn2C)C1	ZINC001334951693	867942049	/nfs/dbraw/zinc/94/20/49/867942049.db2.gz	LITKOBKVEHJLNP-LLVKDONJSA-N	1	1	304.354	1.521	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC001163920413	868791463	/nfs/dbraw/zinc/79/14/63/868791463.db2.gz	ZYVHIQXTEBTXHY-UHFFFAOYSA-N	1	1	319.321	1.702	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC1CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC001336713440	869105570	/nfs/dbraw/zinc/10/55/70/869105570.db2.gz	VUENUJHHHXVCGB-UHFFFAOYSA-N	1	1	322.409	1.909	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762923	869128217	/nfs/dbraw/zinc/12/82/17/869128217.db2.gz	JQZIEUZWERRKAH-CJNGLKHVSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762923	869128226	/nfs/dbraw/zinc/12/82/26/869128226.db2.gz	JQZIEUZWERRKAH-CJNGLKHVSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762923	869128233	/nfs/dbraw/zinc/12/82/33/869128233.db2.gz	JQZIEUZWERRKAH-CJNGLKHVSA-N	1	1	307.394	1.948	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cc(NCC[C@H]2CCC[N@@H+](C)C2)n1	ZINC001165261588	869475359	/nfs/dbraw/zinc/47/53/59/869475359.db2.gz	RPYSAYARJZOWGI-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC001337536868	869530124	/nfs/dbraw/zinc/53/01/24/869530124.db2.gz	YJEZRZSZXVNQQA-JTQLQIEISA-N	1	1	321.333	1.538	20	5		DDBDMO
COC(=O)c1cnc(N2CCn3c(C)[nH+]cc3C2)c([N+](=O)[O-])c1	ZINC001165384988	869556040	/nfs/dbraw/zinc/55/60/40/869556040.db2.gz	OCLZJODPIVQQKA-UHFFFAOYSA-N	1	1	317.305	1.302	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H](C)[C@@H]1C[N@H+](C)CCN1C	ZINC001338083933	869790790	/nfs/dbraw/zinc/79/07/90/869790790.db2.gz	LTUGOHOVOAPTHT-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001338083933	869790800	/nfs/dbraw/zinc/79/08/00/869790800.db2.gz	LTUGOHOVOAPTHT-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CCC(OC(C)=O)CC2)c1[N+](=O)[O-]	ZINC001204347680	871068765	/nfs/dbraw/zinc/06/87/65/871068765.db2.gz	KLTPLKVBXYBSPD-UHFFFAOYSA-N	1	1	324.333	1.837	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC001318620815	872173543	/nfs/dbraw/zinc/17/35/43/872173543.db2.gz	ONLWQHOXZZFHQX-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
Cc1c(C(=O)OCC(C)(C)[N+](=O)[O-])cnn1-c1cc[nH+]cc1	ZINC001345048311	873237637	/nfs/dbraw/zinc/23/76/37/873237637.db2.gz	APCCKDCYFIYJRO-UHFFFAOYSA-N	1	1	304.306	1.788	20	5		DDBDMO
Cn1cc[nH+]c1C[C@@H]1CCCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001350473183	875711552	/nfs/dbraw/zinc/71/15/52/875711552.db2.gz	AERZGPSNDQPXIO-NSHDSACASA-N	1	1	317.349	1.888	20	5		DDBDMO
Nc1c(C(=O)NC[C@@]23CC[N@@H+](C2)CCC3)cc(F)cc1[N+](=O)[O-]	ZINC001300104021	876905472	/nfs/dbraw/zinc/90/54/72/876905472.db2.gz	NCKKPFUXUJZKSY-OAHLLOKOSA-N	1	1	322.340	1.532	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2cn(C3CCC3)nn2)cc1	ZINC001356545363	879095878	/nfs/dbraw/zinc/09/58/78/879095878.db2.gz	VGMZZDQACBIUTJ-OAHLLOKOSA-N	1	1	317.349	1.735	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cn[nH]c1)Cc1ccccc1[N+](=O)[O-]	ZINC001234368201	887908086	/nfs/dbraw/zinc/90/80/86/887908086.db2.gz	AABPBLUZQJQVPH-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC001291881664	913591817	/nfs/dbraw/zinc/59/18/17/913591817.db2.gz	DKWQVWFUMBYDOV-NSHDSACASA-N	1	1	311.769	1.859	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C)CCN1CCOCC1	ZINC001254550953	896499463	/nfs/dbraw/zinc/49/94/63/896499463.db2.gz	TZJBBPFQGGQJEH-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCNC(=O)[C@@H]2C1	ZINC001254567614	896505259	/nfs/dbraw/zinc/50/52/59/896505259.db2.gz	XSCGOVWJYXFGQZ-FPMFFAJLSA-N	1	1	303.362	1.594	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(C)c1nccc(C)c1[N+](=O)[O-]	ZINC001316594027	903190381	/nfs/dbraw/zinc/19/03/81/903190381.db2.gz	JDQIQTHMKXJNIF-UHFFFAOYSA-N	1	1	323.397	1.192	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)[C@H](C)C1	ZINC000286538455	219041973	/nfs/dbraw/zinc/04/19/73/219041973.db2.gz	OAYUQOLZHBLBGN-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000153623415	290649672	/nfs/dbraw/zinc/64/96/72/290649672.db2.gz	KZRKFLOZAOBYCW-MGPQQGTHSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC[N@H+](C2CC2)C1	ZINC000452178289	231326770	/nfs/dbraw/zinc/32/67/70/231326770.db2.gz	YVKKASSXXHIJEY-SNVBAGLBSA-N	1	1	319.365	1.128	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](CCO)C(C)(C)C1	ZINC000614895368	362066668	/nfs/dbraw/zinc/06/66/68/362066668.db2.gz	QPBHIXJWPDDRLQ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000614895368	362066672	/nfs/dbraw/zinc/06/66/72/362066672.db2.gz	QPBHIXJWPDDRLQ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000615037697	362123196	/nfs/dbraw/zinc/12/31/96/362123196.db2.gz	IYVPUEPMPMCFLQ-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000615037697	362123203	/nfs/dbraw/zinc/12/32/03/362123203.db2.gz	IYVPUEPMPMCFLQ-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NCCC[N@@H+](C)CCOC	ZINC000443429008	529932861	/nfs/dbraw/zinc/93/28/61/529932861.db2.gz	PNMASNCBMCCSAY-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H]2CCN3CCO[C@H]2C3)cc1[N+](=O)[O-]	ZINC000295159549	282363735	/nfs/dbraw/zinc/36/37/35/282363735.db2.gz	SAVKNRQRDNWELI-CJNGLKHVSA-N	1	1	321.377	1.508	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000330783996	232065060	/nfs/dbraw/zinc/06/50/60/232065060.db2.gz	RGGXFNOXTSORRT-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000330783996	232065062	/nfs/dbraw/zinc/06/50/62/232065062.db2.gz	RGGXFNOXTSORRT-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]([C@H](C)O)C1	ZINC000305655407	282398605	/nfs/dbraw/zinc/39/86/05/282398605.db2.gz	PFCXZYMTTOADHT-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]([C@H](C)O)C1	ZINC000305655407	282398608	/nfs/dbraw/zinc/39/86/08/282398608.db2.gz	PFCXZYMTTOADHT-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(=O)c1cc(N2CC[NH+](C[C@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000286854384	219195943	/nfs/dbraw/zinc/19/59/43/219195943.db2.gz	MNNBMXQXTQIIEN-NSHDSACASA-N	1	1	307.350	1.300	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000150712928	186059079	/nfs/dbraw/zinc/05/90/79/186059079.db2.gz	KZYVZOTYAKBQNH-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851834	186193198	/nfs/dbraw/zinc/19/31/98/186193198.db2.gz	DOSKMLLLVZWTPP-SMDDNHRTSA-N	1	1	307.350	1.411	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851834	186193200	/nfs/dbraw/zinc/19/32/00/186193200.db2.gz	DOSKMLLLVZWTPP-SMDDNHRTSA-N	1	1	307.350	1.411	20	5		DDBDMO
COCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000490047925	233989082	/nfs/dbraw/zinc/98/90/82/233989082.db2.gz	UIAHOWLYCFDBOA-CYBMUJFWSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC1CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1	ZINC000042567334	352343894	/nfs/dbraw/zinc/34/38/94/352343894.db2.gz	ZJZPKBLGGRBYLA-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC3CCOCC3)C2)nc1	ZINC000072665118	191211253	/nfs/dbraw/zinc/21/12/53/191211253.db2.gz	XQCIZLYOJJRBTJ-CYBMUJFWSA-N	1	1	306.366	1.903	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC3CCOCC3)C2)nc1	ZINC000072665119	191211687	/nfs/dbraw/zinc/21/16/87/191211687.db2.gz	XQCIZLYOJJRBTJ-ZDUSSCGKSA-N	1	1	306.366	1.903	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](O)C3)o2)cc1	ZINC000048615474	352544166	/nfs/dbraw/zinc/54/41/66/352544166.db2.gz	GVBUPYXMTCTIEY-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](O)C3)o2)cc1	ZINC000048615474	352544169	/nfs/dbraw/zinc/54/41/69/352544169.db2.gz	GVBUPYXMTCTIEY-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NCC[N@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000067717805	353063983	/nfs/dbraw/zinc/06/39/83/353063983.db2.gz	BIAUOSLAQWMAGB-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000067273256	353041701	/nfs/dbraw/zinc/04/17/01/353041701.db2.gz	LFQCMKMOISSGNY-VMPITWQZSA-N	1	1	307.350	1.302	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](CNC(C)=O)C1	ZINC000067417875	353048371	/nfs/dbraw/zinc/04/83/71/353048371.db2.gz	SGCSLPFVPPIVAA-CYBMUJFWSA-N	1	1	321.377	1.952	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](CNC(C)=O)C1	ZINC000067417875	353048373	/nfs/dbraw/zinc/04/83/73/353048373.db2.gz	SGCSLPFVPPIVAA-CYBMUJFWSA-N	1	1	321.377	1.952	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000332012026	234386896	/nfs/dbraw/zinc/38/68/96/234386896.db2.gz	SGHRPCRYVRAJPQ-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1cnc(N2CC[NH+](CCOC(C)C)CC2)c([N+](=O)[O-])c1	ZINC000074773370	353330435	/nfs/dbraw/zinc/33/04/35/353330435.db2.gz	ZNSMDYZFPODHIN-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000174655335	198365377	/nfs/dbraw/zinc/36/53/77/198365377.db2.gz	IWTCXSTXISEBPA-UHFFFAOYSA-N	1	1	324.337	1.965	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CC[NH+](C[C@H]3CCCO3)CC2)cs1	ZINC000079481802	353563404	/nfs/dbraw/zinc/56/34/04/353563404.db2.gz	YABHCMGCBJWXLM-CYBMUJFWSA-N	1	1	311.407	1.953	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000157813732	354227201	/nfs/dbraw/zinc/22/72/01/354227201.db2.gz	OLNGSEGAEQVKJF-NOZJJQNGSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000157813732	354227204	/nfs/dbraw/zinc/22/72/04/354227204.db2.gz	OLNGSEGAEQVKJF-NOZJJQNGSA-N	1	1	311.313	1.183	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000357243405	291030041	/nfs/dbraw/zinc/03/00/41/291030041.db2.gz	XEWZKHLHQUZTAC-JTQLQIEISA-N	1	1	319.365	1.518	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000601310471	358490204	/nfs/dbraw/zinc/49/02/04/358490204.db2.gz	PMJFASSNPBLPCY-BXKDBHETSA-N	1	1	307.325	1.946	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588862580	354944393	/nfs/dbraw/zinc/94/43/93/354944393.db2.gz	GNUWJJLRWMGECZ-KGLIPLIRSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[C@H]([N@H+]3CC[C@H](O)C3)C2)c1[N+](=O)[O-]	ZINC000588863639	354944485	/nfs/dbraw/zinc/94/44/85/354944485.db2.gz	SGMITZDFPYJMLW-STQMWFEESA-N	1	1	319.361	1.184	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000588976805	354953623	/nfs/dbraw/zinc/95/36/23/354953623.db2.gz	YUAOPLBYHXYMFR-VIFPVBQESA-N	1	1	303.322	1.168	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000588976805	354953630	/nfs/dbraw/zinc/95/36/30/354953630.db2.gz	YUAOPLBYHXYMFR-VIFPVBQESA-N	1	1	303.322	1.168	20	5		DDBDMO
CCC[N@H+](CC(=O)NC)Cc1ccc([N+](=O)[O-])c(OCC)c1	ZINC000276974566	213212444	/nfs/dbraw/zinc/21/24/44/213212444.db2.gz	XKEJXLWCVOPSQB-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
CCC[N@@H+](CC(=O)NC)Cc1ccc([N+](=O)[O-])c(OCC)c1	ZINC000276974566	213212447	/nfs/dbraw/zinc/21/24/47/213212447.db2.gz	XKEJXLWCVOPSQB-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000591510741	355323069	/nfs/dbraw/zinc/32/30/69/355323069.db2.gz	GADNKSURVSCSTA-IUODEOHRSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000591510741	355323074	/nfs/dbraw/zinc/32/30/74/355323074.db2.gz	GADNKSURVSCSTA-IUODEOHRSA-N	1	1	321.377	1.661	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000592999799	355765674	/nfs/dbraw/zinc/76/56/74/355765674.db2.gz	DYTGWZCCXMRIIN-CQSZACIVSA-N	1	1	304.394	1.811	20	5		DDBDMO
C[C@H](CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000593448322	355888160	/nfs/dbraw/zinc/88/81/60/355888160.db2.gz	QKGUPGHPFCHLQU-SNVBAGLBSA-N	1	1	309.341	1.875	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc1[N+](=O)[O-]	ZINC000594058110	356102525	/nfs/dbraw/zinc/10/25/25/356102525.db2.gz	FMQVXXXFXKWDIX-QWHCGFSZSA-N	1	1	320.349	1.186	20	5		DDBDMO
CCN1CC[C@H]([N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373216	356469698	/nfs/dbraw/zinc/46/96/98/356469698.db2.gz	YPFNLAJVTUIKPC-AAEUAGOBSA-N	1	1	319.365	1.097	20	5		DDBDMO
CCN1CC[C@H]([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373216	356469701	/nfs/dbraw/zinc/46/97/01/356469701.db2.gz	YPFNLAJVTUIKPC-AAEUAGOBSA-N	1	1	319.365	1.097	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000081362741	192256997	/nfs/dbraw/zinc/25/69/97/192256997.db2.gz	NRFIZTDRRQFFAR-ZDUSSCGKSA-N	1	1	323.397	1.372	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CSCc1ccc([N+](=O)[O-])cc1	ZINC000565224454	304055055	/nfs/dbraw/zinc/05/50/55/304055055.db2.gz	JCUAANSZRLUIGI-CQSZACIVSA-N	1	1	314.407	1.767	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@H]1COCCO1	ZINC000595738009	356629445	/nfs/dbraw/zinc/62/94/45/356629445.db2.gz	UUDJBLBKBVADAM-RISCZKNCSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1COCCO1	ZINC000595738009	356629446	/nfs/dbraw/zinc/62/94/46/356629446.db2.gz	UUDJBLBKBVADAM-RISCZKNCSA-N	1	1	323.349	1.269	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595756493	356638953	/nfs/dbraw/zinc/63/89/53/356638953.db2.gz	GMPCFPUGDNDKMI-BLLLJJGKSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595756493	356638956	/nfs/dbraw/zinc/63/89/56/356638956.db2.gz	GMPCFPUGDNDKMI-BLLLJJGKSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595759871	356640492	/nfs/dbraw/zinc/64/04/92/356640492.db2.gz	QLCVJRQXWFAFMZ-BLLLJJGKSA-N	1	1	319.361	1.892	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760094	356641193	/nfs/dbraw/zinc/64/11/93/356641193.db2.gz	SAAVOGBZDSXQDV-XHDPSFHLSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760094	356641195	/nfs/dbraw/zinc/64/11/95/356641195.db2.gz	SAAVOGBZDSXQDV-XHDPSFHLSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000618265119	363551165	/nfs/dbraw/zinc/55/11/65/363551165.db2.gz	UWIUCVGCOZZTKY-ZDUSSCGKSA-N	1	1	317.349	1.572	20	5		DDBDMO
CC(C)[C@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C	ZINC000596206013	356813402	/nfs/dbraw/zinc/81/34/02/356813402.db2.gz	JWLIDHNVNHCMNZ-CQSZACIVSA-N	1	1	306.366	1.470	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596272242	356840144	/nfs/dbraw/zinc/84/01/44/356840144.db2.gz	VHSIFWUFXKRTRJ-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1nncn1C	ZINC000358788527	299255227	/nfs/dbraw/zinc/25/52/27/299255227.db2.gz	FSTWMGBATNBYBF-SNVBAGLBSA-N	1	1	318.337	1.403	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000597677978	357281391	/nfs/dbraw/zinc/28/13/91/357281391.db2.gz	KIARSQNZOHAKBK-LLVKDONJSA-N	1	1	322.365	1.248	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000597922517	357382948	/nfs/dbraw/zinc/38/29/48/357382948.db2.gz	FKLRSAUMPFVPJU-LBPRGKRZSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000598342515	357545964	/nfs/dbraw/zinc/54/59/64/357545964.db2.gz	OCWWWLZGKKAOOX-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598646918	357668767	/nfs/dbraw/zinc/66/87/67/357668767.db2.gz	AVPAXNZJYHFJBK-ZWNOBZJWSA-N	1	1	307.350	1.144	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000598648869	357670396	/nfs/dbraw/zinc/67/03/96/357670396.db2.gz	IAHAZUMIZJXQCD-STQMWFEESA-N	1	1	321.377	1.874	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000599779356	358057141	/nfs/dbraw/zinc/05/71/41/358057141.db2.gz	HCSGWDYQEUDRRB-LBPRGKRZSA-N	1	1	308.338	1.091	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000600534614	358250799	/nfs/dbraw/zinc/25/07/99/358250799.db2.gz	OYFCNKOISNKTEH-GFCCVEGCSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000180931588	199228985	/nfs/dbraw/zinc/22/89/85/199228985.db2.gz	DDQMAYLUHYSTNI-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
O=C1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CN1C1CC1	ZINC000601126408	358413491	/nfs/dbraw/zinc/41/34/91/358413491.db2.gz	XYSRQNAMVLKMEA-JTQLQIEISA-N	1	1	312.329	1.740	20	5		DDBDMO
CC[N@@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@@H]1C	ZINC000601134820	358416273	/nfs/dbraw/zinc/41/62/73/358416273.db2.gz	LXJVXQBCFXDYOB-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC[N@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@@H]1C	ZINC000601134820	358416276	/nfs/dbraw/zinc/41/62/76/358416276.db2.gz	LXJVXQBCFXDYOB-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@H]2CC[N@H+](C)C2)c([N+](=O)[O-])s1	ZINC000601434228	358551696	/nfs/dbraw/zinc/55/16/96/358551696.db2.gz	NOIKOOXFYAHVGA-SECBINFHSA-N	1	1	319.408	1.195	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000601583515	358611395	/nfs/dbraw/zinc/61/13/95/358611395.db2.gz	BULNLEZDMKSBNN-QWRGUYRKSA-N	1	1	323.324	1.015	20	5		DDBDMO
O=C(NCC[N@@H+]1CCCOCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601521350	358586494	/nfs/dbraw/zinc/58/64/94/358586494.db2.gz	XNCSURMFFGXTHS-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601521350	358586497	/nfs/dbraw/zinc/58/64/97/358586497.db2.gz	XNCSURMFFGXTHS-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@H](O)C(F)(F)F	ZINC000602775666	359182597	/nfs/dbraw/zinc/18/25/97/359182597.db2.gz	MAFJAVFFTSAAQN-KOLCDFICSA-N	1	1	322.287	1.487	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](C(=O)OC(C)(C)C)C1	ZINC000602783087	359189166	/nfs/dbraw/zinc/18/91/66/359189166.db2.gz	YESKUXVPIIDHBT-LBPRGKRZSA-N	1	1	324.381	1.763	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C2CCC2)C[C@H](C)C1	ZINC000602840546	359230354	/nfs/dbraw/zinc/23/03/54/359230354.db2.gz	NUEJYOOMXWADMU-CYBMUJFWSA-N	1	1	321.425	1.906	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CCN(C)c2[nH+]cccc21	ZINC000602799868	359200609	/nfs/dbraw/zinc/20/06/09/359200609.db2.gz	QMUPJLUVPKKFMQ-UHFFFAOYSA-N	1	1	302.338	1.451	20	5		DDBDMO
Cn1cc(CN[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822936	359217059	/nfs/dbraw/zinc/21/70/59/359217059.db2.gz	HJXFEDOHUVNYHR-CABCVRRESA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cc(CN[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822936	359217066	/nfs/dbraw/zinc/21/70/66/359217066.db2.gz	HJXFEDOHUVNYHR-CABCVRRESA-N	1	1	315.377	1.863	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000602951364	359316057	/nfs/dbraw/zinc/31/60/57/359316057.db2.gz	JAIATILNGJUXIF-AAEUAGOBSA-N	1	1	319.365	1.278	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@]2(CC[N@H+](C)C2)C1	ZINC000602961503	359324013	/nfs/dbraw/zinc/32/40/13/359324013.db2.gz	UUKSYINBAUEHPO-HNNXBMFYSA-N	1	1	319.365	1.280	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1(CO)CC1	ZINC000186798465	200013480	/nfs/dbraw/zinc/01/34/80/200013480.db2.gz	DKUSVCGKAHPJPB-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1(CO)CC1	ZINC000186798465	200013481	/nfs/dbraw/zinc/01/34/81/200013481.db2.gz	DKUSVCGKAHPJPB-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
Cc1c(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)cccc1[N+](=O)[O-]	ZINC000186804715	200014001	/nfs/dbraw/zinc/01/40/01/200014001.db2.gz	OBTGSCHUJMOFPV-LLVKDONJSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1	ZINC000186806659	200014325	/nfs/dbraw/zinc/01/43/25/200014325.db2.gz	YWVTZMFIBSKNPA-WXJAXGNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000603401261	359617824	/nfs/dbraw/zinc/61/78/24/359617824.db2.gz	KPMNSPJOJHQTOA-LLVKDONJSA-N	1	1	324.356	1.818	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)CCCCO	ZINC000276225932	212741670	/nfs/dbraw/zinc/74/16/70/212741670.db2.gz	BTPRWVCDTMKMPH-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CC[N@H+](CC(N)=O)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000188064402	200188715	/nfs/dbraw/zinc/18/87/15/200188715.db2.gz	FQAUGBPIIRXTAA-UHFFFAOYSA-N	1	1	317.349	1.303	20	5		DDBDMO
CC[N@@H+](CC(N)=O)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000188064402	200188716	/nfs/dbraw/zinc/18/87/16/200188716.db2.gz	FQAUGBPIIRXTAA-UHFFFAOYSA-N	1	1	317.349	1.303	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCN1CCN(C)CC1	ZINC000449220721	296006838	/nfs/dbraw/zinc/00/68/38/296006838.db2.gz	RBIBRXNCSCYVNL-HNNXBMFYSA-N	1	1	320.437	1.753	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000609044639	360258167	/nfs/dbraw/zinc/25/81/67/360258167.db2.gz	NVQMWTQYHZDBMK-GFCCVEGCSA-N	1	1	307.350	1.356	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000609283851	360287043	/nfs/dbraw/zinc/28/70/43/360287043.db2.gz	FREMKTLZMUTXFV-ZFWWWQNUSA-N	1	1	323.393	1.361	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000610208768	360390747	/nfs/dbraw/zinc/39/07/47/360390747.db2.gz	KRPRCMCVDQXJMO-WCQYABFASA-N	1	1	321.377	1.745	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](C)CCO1	ZINC000610899533	360567219	/nfs/dbraw/zinc/56/72/19/360567219.db2.gz	YYGOFWFMAJOMNP-FZMZJTMJSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCO1	ZINC000610899533	360567225	/nfs/dbraw/zinc/56/72/25/360567225.db2.gz	YYGOFWFMAJOMNP-FZMZJTMJSA-N	1	1	322.365	1.113	20	5		DDBDMO
CCOC(=O)C[C@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000611237165	360672339	/nfs/dbraw/zinc/67/23/39/360672339.db2.gz	CLFXXMMMSKZBMO-AWEZNQCLSA-N	1	1	322.361	1.873	20	5		DDBDMO
CCOC(=O)C[C@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000611237165	360672342	/nfs/dbraw/zinc/67/23/42/360672342.db2.gz	CLFXXMMMSKZBMO-AWEZNQCLSA-N	1	1	322.361	1.873	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619253067	363946911	/nfs/dbraw/zinc/94/69/11/363946911.db2.gz	QYEQFLJPDWXFFL-KGLIPLIRSA-N	1	1	307.325	1.853	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000619704908	364122631	/nfs/dbraw/zinc/12/26/31/364122631.db2.gz	YDOILUHDMFAQEP-ZDUSSCGKSA-N	1	1	306.366	1.538	20	5		DDBDMO
C[C@H](c1ccccn1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000091704438	193094633	/nfs/dbraw/zinc/09/46/33/193094633.db2.gz	QTHUBOOFELLQSQ-GFCCVEGCSA-N	1	1	302.334	1.845	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000264654992	204056112	/nfs/dbraw/zinc/05/61/12/204056112.db2.gz	PRIQNDJQIGQCBE-CYBMUJFWSA-N	1	1	321.381	1.271	20	5		DDBDMO
Cc1ccc(C(=O)NCC[NH+]2CCSCC2)cc1[N+](=O)[O-]	ZINC000264840955	204198857	/nfs/dbraw/zinc/19/88/57/204198857.db2.gz	WZAQIILKUQWXOU-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
COCC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1C	ZINC000266338977	205278053	/nfs/dbraw/zinc/27/80/53/205278053.db2.gz	IAJOSKAXUPPWQB-GFCCVEGCSA-N	1	1	309.366	1.760	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000336859132	249266765	/nfs/dbraw/zinc/26/67/65/249266765.db2.gz	FIZDEHBJZDGWGA-JQWIXIFHSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCCC[C@@H]1C	ZINC000339003576	250241627	/nfs/dbraw/zinc/24/16/27/250241627.db2.gz	OCJKYRYAEGHHQS-QWRGUYRKSA-N	1	1	321.381	1.764	20	5		DDBDMO
Cc1nnc([C@H](C)[NH2+]CCn2cc([N+](=O)[O-])ccc2=O)s1	ZINC000273537727	210851004	/nfs/dbraw/zinc/85/10/04/210851004.db2.gz	ABDYNTLGJJHJCY-QMMMGPOBSA-N	1	1	309.351	1.267	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H](C(N)=O)CC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000352404119	285027817	/nfs/dbraw/zinc/02/78/17/285027817.db2.gz	CGCLMCGKIYZDIR-PWSUYJOCSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[N@H+](CCO)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000120020958	195081970	/nfs/dbraw/zinc/08/19/70/195081970.db2.gz	HCPUPRGBNQCBIF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CCO)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000120020958	195081972	/nfs/dbraw/zinc/08/19/72/195081972.db2.gz	HCPUPRGBNQCBIF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2CN2CCOCC2)cc1	ZINC000174014506	285112618	/nfs/dbraw/zinc/11/26/18/285112618.db2.gz	ONTBZBJYOZXGOM-MRXNPFEDSA-N	1	1	305.378	1.891	20	5		DDBDMO
Cc1cc(C(=O)NCCC[N@H+](C)CCN(C)C)cc([N+](=O)[O-])c1	ZINC000288729580	220375810	/nfs/dbraw/zinc/37/58/10/220375810.db2.gz	NLLSODWVHWMWBI-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1cc(C(=O)NCCCN(C)CC[NH+](C)C)cc([N+](=O)[O-])c1	ZINC000288729580	220375814	/nfs/dbraw/zinc/37/58/14/220375814.db2.gz	NLLSODWVHWMWBI-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCC[C@@H]1O	ZINC000352657399	285201884	/nfs/dbraw/zinc/20/18/84/285201884.db2.gz	AEEYUQQXBRDGAU-OLZOCXBDSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCC[C@@H]1O	ZINC000352657399	285201888	/nfs/dbraw/zinc/20/18/88/285201888.db2.gz	AEEYUQQXBRDGAU-OLZOCXBDSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)CN1CC[NH+](C)CC1	ZINC000121848832	195360710	/nfs/dbraw/zinc/36/07/10/195360710.db2.gz	DWVAZBZPNKPVMU-ZDUSSCGKSA-N	1	1	320.393	1.208	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000124812084	195681536	/nfs/dbraw/zinc/68/15/36/195681536.db2.gz	LLPVMHOMXAFNEL-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1nncn1C	ZINC000494791560	533373146	/nfs/dbraw/zinc/37/31/46/533373146.db2.gz	DVNDWQVYBKDPJB-SNVBAGLBSA-N	1	1	318.337	1.403	20	5		DDBDMO
C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc([S@@](C)=O)cc1	ZINC000360211955	299616074	/nfs/dbraw/zinc/61/60/74/299616074.db2.gz	HJUCOAFYFVMDQZ-ZQJOYCHOSA-N	1	1	322.390	1.917	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000076951554	406975527	/nfs/dbraw/zinc/97/55/27/406975527.db2.gz	MABRLSLBUMBHOJ-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](CC)CCO)c([N+](=O)[O-])c1	ZINC000029839095	406927451	/nfs/dbraw/zinc/92/74/51/406927451.db2.gz	BJSZBUFWFJJTAZ-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](CC)CCO)c([N+](=O)[O-])c1	ZINC000029839095	406927454	/nfs/dbraw/zinc/92/74/54/406927454.db2.gz	BJSZBUFWFJJTAZ-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@H](C)C1	ZINC000046952150	407067473	/nfs/dbraw/zinc/06/74/73/407067473.db2.gz	WKGPRRHWSMEWIA-RYUDHWBXSA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000091081658	407177061	/nfs/dbraw/zinc/17/70/61/407177061.db2.gz	JJCWLFCATOGALW-CYBMUJFWSA-N	1	1	304.354	1.968	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000102486967	407323554	/nfs/dbraw/zinc/32/35/54/407323554.db2.gz	IDMTWLYJRKIHBE-ZDUSSCGKSA-N	1	1	323.397	1.399	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@](C)(O)C1	ZINC000123947477	407343460	/nfs/dbraw/zinc/34/34/60/407343460.db2.gz	VCVGDZGAPWNQLO-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](C)(O)C1	ZINC000123947477	407343461	/nfs/dbraw/zinc/34/34/61/407343461.db2.gz	VCVGDZGAPWNQLO-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000124497760	407360388	/nfs/dbraw/zinc/36/03/88/407360388.db2.gz	ANOYWGXQRWWUGK-OCCSQVGLSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@@H+](CCn1cccn1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000111283784	407406200	/nfs/dbraw/zinc/40/62/00/407406200.db2.gz	MEZJVBQOJXDIDU-CQSZACIVSA-N	1	1	320.349	1.163	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CC[NH+](CCO)CC1	ZINC000151695483	407478912	/nfs/dbraw/zinc/47/89/12/407478912.db2.gz	BARNAEYXXAKOEA-UHFFFAOYSA-N	1	1	322.365	1.353	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185766172	407497355	/nfs/dbraw/zinc/49/73/55/407497355.db2.gz	DSLONXRDFORPEW-LLVKDONJSA-N	1	1	315.395	1.603	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000185774876	407499590	/nfs/dbraw/zinc/49/95/90/407499590.db2.gz	SLAFDLLXCGXMLA-LLVKDONJSA-N	1	1	313.379	1.215	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccsc1	ZINC000270978322	407449229	/nfs/dbraw/zinc/44/92/29/407449229.db2.gz	ILIGBWHJUZJLIU-VIFPVBQESA-N	1	1	309.351	1.412	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000170639936	407459472	/nfs/dbraw/zinc/45/94/72/407459472.db2.gz	VNZGNYLUFWGRDA-NSHDSACASA-N	1	1	304.350	1.986	20	5		DDBDMO
CC[N@@H+](CC(=O)NCc1cc([N+](=O)[O-])ccc1OC)C1CC1	ZINC000151607644	407461847	/nfs/dbraw/zinc/46/18/47/407461847.db2.gz	KUGKOFDVTOAAAR-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000265807059	407463431	/nfs/dbraw/zinc/46/34/31/407463431.db2.gz	PFCITIFFAKMQBN-LBPRGKRZSA-N	1	1	319.361	1.452	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC1	ZINC000271321503	407635087	/nfs/dbraw/zinc/63/50/87/407635087.db2.gz	OPOZDAHQBRXDEQ-UHFFFAOYSA-N	1	1	321.362	1.377	20	5		DDBDMO
Cc1cc(N2CC[C@H](C[NH+]3CCOCC3)C2)ncc1[N+](=O)[O-]	ZINC000266796832	407639628	/nfs/dbraw/zinc/63/96/28/407639628.db2.gz	AUUDRUAKZWMOHQ-CYBMUJFWSA-N	1	1	306.366	1.457	20	5		DDBDMO
O=C(NCC1=CC[NH2+]CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000186335487	407641274	/nfs/dbraw/zinc/64/12/74/407641274.db2.gz	DSJKNCDVPIZFCI-UHFFFAOYSA-N	1	1	301.306	1.121	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000115436478	407679634	/nfs/dbraw/zinc/67/96/34/407679634.db2.gz	MPUZIVRAPKGMKM-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)CC[N@@H+](C)C1CC1	ZINC000186735233	407762821	/nfs/dbraw/zinc/76/28/21/407762821.db2.gz	OQNMNVPVMCWNLU-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1nn(C[C@@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-]	ZINC000179858446	407837646	/nfs/dbraw/zinc/83/76/46/407837646.db2.gz	IFLRJGCOLSEDER-HNNXBMFYSA-N	1	1	316.361	1.519	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@]2(CCOC2)C1	ZINC000153745829	407895200	/nfs/dbraw/zinc/89/52/00/407895200.db2.gz	YWBMAAQWCOMFIY-MRXNPFEDSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@]2(CCOC2)C1	ZINC000153745829	407895205	/nfs/dbraw/zinc/89/52/05/407895205.db2.gz	YWBMAAQWCOMFIY-MRXNPFEDSA-N	1	1	319.361	1.954	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)c1	ZINC000268213356	407953028	/nfs/dbraw/zinc/95/30/28/407953028.db2.gz	AZOSRUCRJISFRS-GXTWGEPZSA-N	1	1	320.349	1.972	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000272506527	407953712	/nfs/dbraw/zinc/95/37/12/407953712.db2.gz	JHLUUSGATXIKIQ-ZYHUDNBSSA-N	1	1	307.350	1.855	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000272506527	407953717	/nfs/dbraw/zinc/95/37/17/407953717.db2.gz	JHLUUSGATXIKIQ-ZYHUDNBSSA-N	1	1	307.350	1.855	20	5		DDBDMO
CCOc1cccc(N2CCC[N@@H+](CCO)CC2)c1[N+](=O)[O-]	ZINC000181213381	407968842	/nfs/dbraw/zinc/96/88/42/407968842.db2.gz	ODWRHMHBTQNTAA-UHFFFAOYSA-N	1	1	309.366	1.498	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H]1CCCC[C@H]1O	ZINC000272451898	407929371	/nfs/dbraw/zinc/92/93/71/407929371.db2.gz	CHDQCEJBJNBSJL-GXTWGEPZSA-N	1	1	309.366	1.239	20	5		DDBDMO
CCOC(=O)c1ccnc(N(C)[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000175047675	408039308	/nfs/dbraw/zinc/03/93/08/408039308.db2.gz	UFURRJWMHSDGLX-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
CCSCC[C@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245449879	407987505	/nfs/dbraw/zinc/98/75/05/407987505.db2.gz	OCPWBMFZPPXVSR-WCQYABFASA-N	1	1	316.427	1.616	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000189655498	408070596	/nfs/dbraw/zinc/07/05/96/408070596.db2.gz	XXJNXROHGCNSKT-GOEBONIOSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@](C)(O)C1	ZINC000245916108	408098360	/nfs/dbraw/zinc/09/83/60/408098360.db2.gz	NBZYONFCINZDKK-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](C)(O)C1	ZINC000245916108	408098365	/nfs/dbraw/zinc/09/83/65/408098365.db2.gz	NBZYONFCINZDKK-ABAIWWIYSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCOCC12CCC2	ZINC000182229210	408099807	/nfs/dbraw/zinc/09/98/07/408099807.db2.gz	JTJDLOAHIWSSTK-CYBMUJFWSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCOCC12CCC2	ZINC000182229210	408099811	/nfs/dbraw/zinc/09/98/11/408099811.db2.gz	JTJDLOAHIWSSTK-CYBMUJFWSA-N	1	1	322.361	1.589	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(O)CCCC1	ZINC000182242286	408104203	/nfs/dbraw/zinc/10/42/03/408104203.db2.gz	MXDVAMIGJIGSGO-ZDUSSCGKSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](C)(O)C1	ZINC000245962869	408110607	/nfs/dbraw/zinc/11/06/07/408110607.db2.gz	VCVGDZGAPWNQLO-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@](C)(O)C1	ZINC000245962869	408110608	/nfs/dbraw/zinc/11/06/08/408110608.db2.gz	VCVGDZGAPWNQLO-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNc2c([N+](=O)[O-])ncn2C)C[C@@H](C)O1	ZINC000140404439	408176768	/nfs/dbraw/zinc/17/67/68/408176768.db2.gz	XYBBPFQOUZZIHP-GHMZBOCLSA-N	1	1	311.386	1.628	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2CCc3sccc3C2)nc1	ZINC000273611818	408265337	/nfs/dbraw/zinc/26/53/37/408265337.db2.gz	MFKRHYWENVTSDT-UHFFFAOYSA-N	1	1	305.363	1.917	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@H+]2CCc3sccc3C2)nc1	ZINC000273611818	408265342	/nfs/dbraw/zinc/26/53/42/408265342.db2.gz	MFKRHYWENVTSDT-UHFFFAOYSA-N	1	1	305.363	1.917	20	5		DDBDMO
CCCCNC(=O)[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176221418	408314903	/nfs/dbraw/zinc/31/49/03/408314903.db2.gz	CHWIDDVXVJJSMS-ZDUSSCGKSA-N	1	1	323.397	1.420	20	5		DDBDMO
Cc1nn(CCC(=O)NCC[N@H+](C)C2CC2)c(C)c1[N+](=O)[O-]	ZINC000263842596	408282709	/nfs/dbraw/zinc/28/27/09/408282709.db2.gz	STVWGOXXIQWUBW-UHFFFAOYSA-N	1	1	309.370	1.009	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000269450452	408312851	/nfs/dbraw/zinc/31/28/51/408312851.db2.gz	GENMOQIUBKNRMF-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000171584554	162225980	/nfs/dbraw/zinc/22/59/80/162225980.db2.gz	TYDHVVOLCGIPTR-LFAOLKIESA-N	1	1	301.346	1.915	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000173465905	162341438	/nfs/dbraw/zinc/34/14/38/162341438.db2.gz	ASJVGUJWZUEBDQ-NSHDSACASA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000173465905	162341442	/nfs/dbraw/zinc/34/14/42/162341442.db2.gz	ASJVGUJWZUEBDQ-NSHDSACASA-N	1	1	303.322	1.973	20	5		DDBDMO
CC[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O	ZINC000247392343	408460715	/nfs/dbraw/zinc/46/07/15/408460715.db2.gz	XGBSDKIGFSONRA-WCQYABFASA-N	1	1	313.423	1.933	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000176969490	408487093	/nfs/dbraw/zinc/48/70/93/408487093.db2.gz	VRQWHMARDLKRGF-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177198731	408550503	/nfs/dbraw/zinc/55/05/03/408550503.db2.gz	SKEKEJPYNHMTPE-VXGBXAGGSA-N	1	1	319.361	1.715	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000248620974	408599948	/nfs/dbraw/zinc/59/99/48/408599948.db2.gz	MXOZXUWPJWJYAP-BXKDBHETSA-N	1	1	307.354	1.031	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@H]21	ZINC000248067806	408532539	/nfs/dbraw/zinc/53/25/39/408532539.db2.gz	ZXCFQFNQFWDPJU-TZMCWYRMSA-N	1	1	318.377	1.733	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)C1	ZINC000264565780	408536506	/nfs/dbraw/zinc/53/65/06/408536506.db2.gz	RJXAEXUGQGTIMW-GFCCVEGCSA-N	1	1	307.350	1.354	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000177162548	408539292	/nfs/dbraw/zinc/53/92/92/408539292.db2.gz	GXZLDTRBHQKFAE-MWLCHTKSSA-N	1	1	304.350	1.653	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC[N@H+](C)C1CC1	ZINC000265354804	408623228	/nfs/dbraw/zinc/62/32/28/408623228.db2.gz	CSOLSIFCWREYFP-UHFFFAOYSA-N	1	1	320.349	1.052	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000270763343	408673225	/nfs/dbraw/zinc/67/32/25/408673225.db2.gz	NHDQNSUDHZQBON-NSHDSACASA-N	1	1	323.397	1.569	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000248858434	408648991	/nfs/dbraw/zinc/64/89/91/408648991.db2.gz	ROBLWIBQQIZFCS-DRZSPHRISA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000248858434	408648996	/nfs/dbraw/zinc/64/89/96/408648996.db2.gz	ROBLWIBQQIZFCS-DRZSPHRISA-N	1	1	308.338	1.065	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@](C)(O)C1	ZINC000177973305	408747400	/nfs/dbraw/zinc/74/74/00/408747400.db2.gz	XSHDEPCOTZIPCC-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
[NH3+][C@H]1CC[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@H]21	ZINC000185130825	408763480	/nfs/dbraw/zinc/76/34/80/408763480.db2.gz	NBERQTNIEKNCIX-AXTRIDKLSA-N	1	1	315.333	1.280	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000249893491	408772518	/nfs/dbraw/zinc/77/25/18/408772518.db2.gz	UMQOGJQANOALJJ-GHMZBOCLSA-N	1	1	323.397	1.487	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000249893497	408772813	/nfs/dbraw/zinc/77/28/13/408772813.db2.gz	UMQOGJQANOALJJ-MNOVXSKESA-N	1	1	323.397	1.487	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000250945566	408779852	/nfs/dbraw/zinc/77/98/52/408779852.db2.gz	BPBNUZPXEYORQG-UONOGXRCSA-N	1	1	319.361	1.496	20	5		DDBDMO
CCOCCOCC[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000276286604	408829085	/nfs/dbraw/zinc/82/90/85/408829085.db2.gz	SJYWHWKXDLEOQW-OAHLLOKOSA-N	1	1	312.366	1.613	20	5		DDBDMO
COCCN1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000190784557	163158420	/nfs/dbraw/zinc/15/84/20/163158420.db2.gz	CXFUVDWHJJTQBD-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
COCCN1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000190784557	163158423	/nfs/dbraw/zinc/15/84/23/163158423.db2.gz	CXFUVDWHJJTQBD-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190908379	163165122	/nfs/dbraw/zinc/16/51/22/163165122.db2.gz	DKEPZBCAXYRCFU-WOPDTQHZSA-N	1	1	307.350	1.482	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[N@@H+](C)CC1	ZINC000192850308	163239989	/nfs/dbraw/zinc/23/99/89/163239989.db2.gz	SIZREYNOWLVWSR-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CCC[N@H+](C)CC1	ZINC000192850308	163239990	/nfs/dbraw/zinc/23/99/90/163239990.db2.gz	SIZREYNOWLVWSR-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2cccc([N+](=O)[O-])c2)CCCO1	ZINC000277396225	408933166	/nfs/dbraw/zinc/93/31/66/408933166.db2.gz	DQDUQLOINNONDA-ZDUSSCGKSA-N	1	1	321.377	1.826	20	5		DDBDMO
CCCNC(=O)NC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000292080366	408975839	/nfs/dbraw/zinc/97/58/39/408975839.db2.gz	FRANMXRXEIXELR-UHFFFAOYSA-N	1	1	322.365	1.655	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292149112	408989735	/nfs/dbraw/zinc/98/97/35/408989735.db2.gz	IKAJFCQOXIRWOH-MRXNPFEDSA-N	1	1	319.361	1.528	20	5		DDBDMO
COCCO[C@H]1C[C@H](CO)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000278037455	409055543	/nfs/dbraw/zinc/05/55/43/409055543.db2.gz	BZOGZTXUHWQUBM-HOCLYGCPSA-N	1	1	324.377	1.441	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@H](c3nc(=O)[nH][nH]3)C2)cccc1[N+](=O)[O-]	ZINC000289466458	409278181	/nfs/dbraw/zinc/27/81/81/409278181.db2.gz	QPLPLBSECSBTNL-LBPRGKRZSA-N	1	1	317.349	1.694	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CC(N)=O)c1ccccc1	ZINC000280291608	409286379	/nfs/dbraw/zinc/28/63/79/409286379.db2.gz	FFEQEONMFCTILK-CQSZACIVSA-N	1	1	317.349	1.340	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000317845295	164029253	/nfs/dbraw/zinc/02/92/53/164029253.db2.gz	YAJXIMXGAIDACF-WDEREUQCSA-N	1	1	309.370	1.166	20	5		DDBDMO
COc1cc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000347017735	164097355	/nfs/dbraw/zinc/09/73/55/164097355.db2.gz	UVAAOQWECWAIQV-CYBMUJFWSA-N	1	1	319.361	1.912	20	5		DDBDMO
NC(=O)[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccccc1[N+](=O)[O-]	ZINC000342423407	409622331	/nfs/dbraw/zinc/62/23/31/409622331.db2.gz	RDXKGXZGFCKXER-AWEZNQCLSA-N	1	1	317.320	1.920	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C	ZINC000342471209	409657974	/nfs/dbraw/zinc/65/79/74/409657974.db2.gz	WUPHNLZKBSKSRV-IINYFYTJSA-N	1	1	319.361	1.816	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1CCC2)c1ccccc1[N+](=O)[O-]	ZINC000342475253	409663157	/nfs/dbraw/zinc/66/31/57/409663157.db2.gz	RNUSOYXKEITLHJ-WFASDCNBSA-N	1	1	318.377	1.162	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1C	ZINC000354405384	409833328	/nfs/dbraw/zinc/83/33/28/409833328.db2.gz	UQPXDKDFALEWRQ-ZYHUDNBSSA-N	1	1	323.397	1.582	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000297169121	409836231	/nfs/dbraw/zinc/83/62/31/409836231.db2.gz	PKYXVPFMHMMACH-JTQLQIEISA-N	1	1	305.338	1.604	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@@H]1C	ZINC000354379685	409809950	/nfs/dbraw/zinc/80/99/50/409809950.db2.gz	CHBINFKHNOOXFL-NWDGAFQWSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000357308685	409967654	/nfs/dbraw/zinc/96/76/54/409967654.db2.gz	WQTOKLLVZUTBRL-WDEREUQCSA-N	1	1	321.381	1.764	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC[C@H](C)C1	ZINC000332355527	410090478	/nfs/dbraw/zinc/09/04/78/410090478.db2.gz	PVAOXFIMSDRNFB-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCOC[C@H](C)C1	ZINC000332355527	410090485	/nfs/dbraw/zinc/09/04/85/410090485.db2.gz	PVAOXFIMSDRNFB-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091605	410109150	/nfs/dbraw/zinc/10/91/50/410109150.db2.gz	RZYJRFAKINTBDQ-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091605	410109158	/nfs/dbraw/zinc/10/91/58/410109158.db2.gz	RZYJRFAKINTBDQ-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000339395814	410158003	/nfs/dbraw/zinc/15/80/03/410158003.db2.gz	LYMRGMPUKVYWSK-HZPDHXFCSA-N	1	1	305.378	1.890	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000351826458	410267028	/nfs/dbraw/zinc/26/70/28/410267028.db2.gz	KBFVHADWRBKBPM-QMTHXVAHSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@@H+]1CCO	ZINC000351833538	410274698	/nfs/dbraw/zinc/27/46/98/410274698.db2.gz	IBQLKXZYPXFLEF-SNVBAGLBSA-N	1	1	315.320	1.371	20	5		DDBDMO
C[C@@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1CCO	ZINC000351833538	410274703	/nfs/dbraw/zinc/27/47/03/410274703.db2.gz	IBQLKXZYPXFLEF-SNVBAGLBSA-N	1	1	315.320	1.371	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000351779760	410229759	/nfs/dbraw/zinc/22/97/59/410229759.db2.gz	KJRSNMHUEZBJHK-SKDRFNHKSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000351779760	410229765	/nfs/dbraw/zinc/22/97/65/410229765.db2.gz	KJRSNMHUEZBJHK-SKDRFNHKSA-N	1	1	304.306	1.457	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CC([NH+](C)C)C2)c1	ZINC000351913342	410331839	/nfs/dbraw/zinc/33/18/39/410331839.db2.gz	QSNKBKFWPKQEMV-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)c1	ZINC000343511885	410502994	/nfs/dbraw/zinc/50/29/94/410502994.db2.gz	JGHXPOMPNDTBTQ-GXFFZTMASA-N	1	1	307.350	1.816	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@@H](OC)C2)cc1[N+](=O)[O-]	ZINC000355720617	410659821	/nfs/dbraw/zinc/65/98/21/410659821.db2.gz	AJYYEXVYIDMIAQ-GFCCVEGCSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2CC[C@@H](OC)C2)cc1[N+](=O)[O-]	ZINC000355720617	410659827	/nfs/dbraw/zinc/65/98/27/410659827.db2.gz	AJYYEXVYIDMIAQ-GFCCVEGCSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@@H]3C2)c1[N+](=O)[O-]	ZINC000301324762	410698283	/nfs/dbraw/zinc/69/82/83/410698283.db2.gz	ACWCFPCQNVDJRL-XQQFMLRXSA-N	1	1	305.382	1.557	20	5		DDBDMO
COC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337307868	410704125	/nfs/dbraw/zinc/70/41/25/410704125.db2.gz	XAUFFFCALJPGLE-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
COC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337307868	410704129	/nfs/dbraw/zinc/70/41/29/410704129.db2.gz	XAUFFFCALJPGLE-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
C[C@@H]1CC[C@@]2(CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)C1	ZINC000359555596	410726064	/nfs/dbraw/zinc/72/60/64/410726064.db2.gz	KRSMRNGVPDYUGD-BPLDGKMQSA-N	1	1	308.382	1.664	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000330579883	410794227	/nfs/dbraw/zinc/79/42/27/410794227.db2.gz	IIXFFANDUBLSPZ-NWDGAFQWSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCC[C@H](C)C1	ZINC000330586040	410801879	/nfs/dbraw/zinc/80/18/79/410801879.db2.gz	SIRJJKNKNLOYKY-NWDGAFQWSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343914971	410804322	/nfs/dbraw/zinc/80/43/22/410804322.db2.gz	WJUIARQZKPMYLV-SWLSCSKDSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000330599614	410814742	/nfs/dbraw/zinc/81/47/42/410814742.db2.gz	ULMZLCIZBONOSL-NWDGAFQWSA-N	1	1	307.350	1.525	20	5		DDBDMO
CC(C)C[C@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[NH+]1CCOCC1	ZINC000340586392	410860012	/nfs/dbraw/zinc/86/00/12/410860012.db2.gz	WEAVPNZPWJMCKP-GFCCVEGCSA-N	1	1	324.381	1.400	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCC[C@@H](C)C1	ZINC000356150100	410864330	/nfs/dbraw/zinc/86/43/30/410864330.db2.gz	HTHWUJYCCXUDRA-MNOVXSKESA-N	1	1	309.370	1.179	20	5		DDBDMO
CC[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1C[C@H](C)O	ZINC000330602314	410817924	/nfs/dbraw/zinc/81/79/24/410817924.db2.gz	FHKOUZBNQXMHOU-JSGCOSHPSA-N	1	1	323.393	1.577	20	5		DDBDMO
CC[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000330602314	410817928	/nfs/dbraw/zinc/81/79/28/410817928.db2.gz	FHKOUZBNQXMHOU-JSGCOSHPSA-N	1	1	323.393	1.577	20	5		DDBDMO
COc1c(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000356203258	410893994	/nfs/dbraw/zinc/89/39/94/410893994.db2.gz	LLTGALCDHMZTNG-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353486021	411022842	/nfs/dbraw/zinc/02/28/42/411022842.db2.gz	WDZXCXDZNJVFJL-KPPDAEKUSA-N	1	1	323.349	1.386	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353486021	411022847	/nfs/dbraw/zinc/02/28/47/411022847.db2.gz	WDZXCXDZNJVFJL-KPPDAEKUSA-N	1	1	323.349	1.386	20	5		DDBDMO
CNc1nccc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000516313077	416721403	/nfs/dbraw/zinc/72/14/03/416721403.db2.gz	JLFPRAAGGFUALY-SNVBAGLBSA-N	1	1	319.365	1.412	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@@H]2[C@H]1C(N)=O	ZINC000373737046	418455216	/nfs/dbraw/zinc/45/52/16/418455216.db2.gz	FMRWXBWBEOBUHG-QEJZJMRPSA-N	1	1	303.362	1.989	20	5		DDBDMO
Cc1c(CNC(=O)C[N@H+](C)[C@H]2CCSC2)cccc1[N+](=O)[O-]	ZINC000360529604	418457261	/nfs/dbraw/zinc/45/72/61/418457261.db2.gz	RJWHICUKICXYSA-ZDUSSCGKSA-N	1	1	323.418	1.957	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000361027802	418569017	/nfs/dbraw/zinc/56/90/17/418569017.db2.gz	ZUFJEMGAWFFTDD-SCZZXKLOSA-N	1	1	303.322	1.892	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000194599765	222178757	/nfs/dbraw/zinc/17/87/57/222178757.db2.gz	UUVIWUXSZDYOLS-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1	ZINC000367563094	418611385	/nfs/dbraw/zinc/61/13/85/418611385.db2.gz	KEGFLVVEXWMUCH-NSHDSACASA-N	1	1	321.381	1.417	20	5		DDBDMO
CO[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000361361758	418634151	/nfs/dbraw/zinc/63/41/51/418634151.db2.gz	LEOWYXGZNRKKCI-GFCCVEGCSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000361361758	418634153	/nfs/dbraw/zinc/63/41/53/418634153.db2.gz	LEOWYXGZNRKKCI-GFCCVEGCSA-N	1	1	304.306	1.866	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)[C@@H]2CCO[C@@H]2C)cc1[N+](=O)[O-]	ZINC000361563857	418678809	/nfs/dbraw/zinc/67/88/09/418678809.db2.gz	LMIMPQYUSNQCTM-DGCLKSJQSA-N	1	1	310.350	1.575	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000368063934	418683343	/nfs/dbraw/zinc/68/33/43/418683343.db2.gz	OSKDVYXRDQEYCF-CMPLNLGQSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000368063934	418683346	/nfs/dbraw/zinc/68/33/46/418683346.db2.gz	OSKDVYXRDQEYCF-CMPLNLGQSA-N	1	1	309.753	1.816	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1ccc([N+](=O)[O-])cn1)CC2	ZINC000368190756	418700703	/nfs/dbraw/zinc/70/07/03/418700703.db2.gz	WLXGYWONQFVBCC-UHFFFAOYSA-N	1	1	304.350	1.690	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CC[N@@H+](CC3CCCC3)C2)ccc1[N+](=O)[O-]	ZINC000362054580	418746017	/nfs/dbraw/zinc/74/60/17/418746017.db2.gz	DLPUGEMOZJGPGX-ZDUSSCGKSA-N	1	1	320.393	1.928	20	5		DDBDMO
CC1CC[NH+](C2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000370938556	418751815	/nfs/dbraw/zinc/75/18/15/418751815.db2.gz	BFUBWUIXPRNQAS-NEXFUWMNSA-N	1	1	309.410	1.811	20	5		DDBDMO
COc1ccc(CN[C@@H]2CCOC[C@@H]2[C@H](C)[NH3+])cc1[N+](=O)[O-]	ZINC000422945643	227273740	/nfs/dbraw/zinc/27/37/40/227273740.db2.gz	NOEDKENZSZCAOH-CYZMBNFOSA-N	1	1	309.366	1.445	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[C@H]([NH3+])C3)c1[N+](=O)[O-]	ZINC000372497088	418877944	/nfs/dbraw/zinc/87/79/44/418877944.db2.gz	OLBHUZGBJYGCOS-OWUUHHOZSA-N	1	1	307.354	1.365	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000365587280	418878879	/nfs/dbraw/zinc/87/88/79/418878879.db2.gz	KLXZKYVHNKTIBK-JYJNAYRXSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000365587280	418878881	/nfs/dbraw/zinc/87/88/81/418878881.db2.gz	KLXZKYVHNKTIBK-JYJNAYRXSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000365587280	418878882	/nfs/dbraw/zinc/87/88/82/418878882.db2.gz	KLXZKYVHNKTIBK-JYJNAYRXSA-N	1	1	317.389	1.680	20	5		DDBDMO
Cn1ccnc1[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000365649780	418888890	/nfs/dbraw/zinc/88/88/90/418888890.db2.gz	PKJXJYSQFHYCOI-LBPRGKRZSA-N	1	1	304.354	1.404	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H]1CCO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000426257555	419421211	/nfs/dbraw/zinc/42/12/11/419421211.db2.gz	QCADBUBMOBOXEN-CYBMUJFWSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]1C(=O)OC(C)(C)C	ZINC000412081135	419635313	/nfs/dbraw/zinc/63/53/13/419635313.db2.gz	WQYMILFRBVMOCY-GHMZBOCLSA-N	1	1	324.381	1.738	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]1C(=O)OC(C)(C)C	ZINC000412081135	419635323	/nfs/dbraw/zinc/63/53/23/419635323.db2.gz	WQYMILFRBVMOCY-GHMZBOCLSA-N	1	1	324.381	1.738	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044273	419587306	/nfs/dbraw/zinc/58/73/06/419587306.db2.gz	WPPMAFWQJZSQIP-COPLHBTASA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044273	419587314	/nfs/dbraw/zinc/58/73/14/419587314.db2.gz	WPPMAFWQJZSQIP-COPLHBTASA-N	1	1	307.350	1.625	20	5		DDBDMO
COCC[NH2+]CCN[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1	ZINC000423326010	420013421	/nfs/dbraw/zinc/01/34/21/420013421.db2.gz	IWSCJUDQULLFTD-QWHCGFSZSA-N	1	1	311.386	1.101	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@H]2[C@H](C)CCN[C@@H]2C)c([N+](=O)[O-])c1	ZINC000420364686	420239071	/nfs/dbraw/zinc/23/90/71/420239071.db2.gz	KLBYWHVIRVIXEP-XHBSWPGZSA-N	1	1	323.393	1.958	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@H]([NH3+])[C@H](C)C1	ZINC000430946078	420219121	/nfs/dbraw/zinc/21/91/21/420219121.db2.gz	YYXIOKUZANYTAX-TZMCWYRMSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000416296638	420312438	/nfs/dbraw/zinc/31/24/38/420312438.db2.gz	OHTONMABVRRVDZ-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@H+](CCO)C[C@@H]1C	ZINC000416296638	420312443	/nfs/dbraw/zinc/31/24/43/420312443.db2.gz	OHTONMABVRRVDZ-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000416497969	420394086	/nfs/dbraw/zinc/39/40/86/420394086.db2.gz	VOBXNCRWIKHSCA-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CC[N@H+](C)C1	ZINC000416497971	420395878	/nfs/dbraw/zinc/39/58/78/420395878.db2.gz	VOBXNCRWIKHSCA-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
Cn1cc[nH+]c1C[C@@H]1CCCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000302129112	230109503	/nfs/dbraw/zinc/10/95/03/230109503.db2.gz	BLFYMHBPQLQYBH-NSHDSACASA-N	1	1	302.338	1.577	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1	ZINC000444697969	230123063	/nfs/dbraw/zinc/12/30/63/230123063.db2.gz	RIFCAGAKKRDMMC-KOLCDFICSA-N	1	1	322.287	1.427	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1C	ZINC000444700027	230123438	/nfs/dbraw/zinc/12/34/38/230123438.db2.gz	FOSHXCNRDUJYOA-MWLCHTKSSA-N	1	1	318.333	1.855	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H]1C	ZINC000444700027	230123441	/nfs/dbraw/zinc/12/34/41/230123441.db2.gz	FOSHXCNRDUJYOA-MWLCHTKSSA-N	1	1	318.333	1.855	20	5		DDBDMO
Cc1cc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000450796042	420534600	/nfs/dbraw/zinc/53/46/00/420534600.db2.gz	PZBKVXQGOHUXJR-TXEJJXNPSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1cc(N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000450796042	420534603	/nfs/dbraw/zinc/53/46/03/420534603.db2.gz	PZBKVXQGOHUXJR-TXEJJXNPSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000451635524	420605858	/nfs/dbraw/zinc/60/58/58/420605858.db2.gz	RHUYMEFGDNFENO-TVYUQYBPSA-N	1	1	303.318	1.169	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000457084934	420605946	/nfs/dbraw/zinc/60/59/46/420605946.db2.gz	GYFPFMFFXJUHHD-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000457084934	420605950	/nfs/dbraw/zinc/60/59/50/420605950.db2.gz	GYFPFMFFXJUHHD-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000457025254	420591106	/nfs/dbraw/zinc/59/11/06/420591106.db2.gz	OKNJMQKQTVJGIY-NSHDSACASA-N	1	1	301.306	1.105	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@@H](C)C[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452068827	420619790	/nfs/dbraw/zinc/61/97/90/420619790.db2.gz	PCPCWBCBKNHKGC-AAEUAGOBSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](CCNC(=O)Nc1ccncc1[N+](=O)[O-])C1CCCCC1	ZINC000443609995	420754070	/nfs/dbraw/zinc/75/40/70/420754070.db2.gz	XKJYBYUQPBHYHJ-UHFFFAOYSA-N	1	1	321.381	1.798	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000493298964	420813115	/nfs/dbraw/zinc/81/31/15/420813115.db2.gz	ZTFULIUITSYUIV-SZZPACECSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000493298964	420813120	/nfs/dbraw/zinc/81/31/20/420813120.db2.gz	ZTFULIUITSYUIV-SZZPACECSA-N	1	1	319.361	1.133	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1F	ZINC000448795579	420898147	/nfs/dbraw/zinc/89/81/47/420898147.db2.gz	PVCOYSPNGMSOIS-VIFPVBQESA-N	1	1	323.324	1.709	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455095375	420968185	/nfs/dbraw/zinc/96/81/85/420968185.db2.gz	TWHJABRFRGVTEQ-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455095375	420968189	/nfs/dbraw/zinc/96/81/89/420968189.db2.gz	TWHJABRFRGVTEQ-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
CCN1C[C@@H]([NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1=O	ZINC000449515626	421018299	/nfs/dbraw/zinc/01/82/99/421018299.db2.gz	AJVAUVGFMAMHFS-NSHDSACASA-N	1	1	323.349	1.322	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000488717125	421108179	/nfs/dbraw/zinc/10/81/79/421108179.db2.gz	KGBTXMSTHOJIKE-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000488724934	421108674	/nfs/dbraw/zinc/10/86/74/421108674.db2.gz	AXHIHJCOCBBSEZ-QWRGUYRKSA-N	1	1	308.334	1.664	20	5		DDBDMO
[NH3+]C[C@H]1CC[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449716771	421067514	/nfs/dbraw/zinc/06/75/14/421067514.db2.gz	LYOUCWUVHBVEAY-IUCAKERBSA-N	1	1	303.322	1.328	20	5		DDBDMO
Cc1nn(CCC(=O)NCC[N@@H+]2CC[C@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000525291743	421284364	/nfs/dbraw/zinc/28/43/64/421284364.db2.gz	PMBMTQZXEKMUEH-NSHDSACASA-N	1	1	323.397	1.256	20	5		DDBDMO
CN1C(=O)C[C@H]([N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010345	421588123	/nfs/dbraw/zinc/58/81/23/421588123.db2.gz	JOZYWROWBHFUFA-JSGCOSHPSA-N	1	1	317.345	1.532	20	5		DDBDMO
CN1C(=O)C[C@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010345	421588125	/nfs/dbraw/zinc/58/81/25/421588125.db2.gz	JOZYWROWBHFUFA-JSGCOSHPSA-N	1	1	317.345	1.532	20	5		DDBDMO
O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)c1c[nH]nc1[N+](=O)[O-]	ZINC000554835947	421662622	/nfs/dbraw/zinc/66/26/22/421662622.db2.gz	RYDSPINPLVTZHL-NSHDSACASA-N	1	1	319.321	1.478	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000521114779	421773625	/nfs/dbraw/zinc/77/36/25/421773625.db2.gz	JMPCYWCIZJSTEI-LBPRGKRZSA-N	1	1	307.350	1.214	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C1	ZINC000557526595	421774089	/nfs/dbraw/zinc/77/40/89/421774089.db2.gz	DQISNBKQKLVHFG-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C1	ZINC000557526595	421774093	/nfs/dbraw/zinc/77/40/93/421774093.db2.gz	DQISNBKQKLVHFG-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1C1CC1	ZINC000584383764	422299289	/nfs/dbraw/zinc/29/92/89/422299289.db2.gz	PEOQRFYKDGKYIK-NXEZZACHSA-N	1	1	302.338	1.675	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000596306832	422374109	/nfs/dbraw/zinc/37/41/09/422374109.db2.gz	IQHTWZRORSKDSO-SNVBAGLBSA-N	1	1	321.381	1.621	20	5		DDBDMO
NC(=O)c1cccc(NCC[NH+]2CCSCC2)c1[N+](=O)[O-]	ZINC000342165776	271328012	/nfs/dbraw/zinc/32/80/12/271328012.db2.gz	RETLRAQEVTUOQL-UHFFFAOYSA-N	1	1	310.379	1.154	20	5		DDBDMO
CC(=O)[C@@H](NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000342284090	271366022	/nfs/dbraw/zinc/36/60/22/271366022.db2.gz	QVXIHJKLOCDFST-ZBEGNZNMSA-N	1	1	321.377	1.975	20	5		DDBDMO
CCOc1ccc(C(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000343257855	271704670	/nfs/dbraw/zinc/70/46/70/271704670.db2.gz	ZPABDORABUNRBF-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000419010342	274348789	/nfs/dbraw/zinc/34/87/89/274348789.db2.gz	XSEZIOCNOCUCNK-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000419010342	274348790	/nfs/dbraw/zinc/34/87/90/274348790.db2.gz	XSEZIOCNOCUCNK-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000452067093	274395663	/nfs/dbraw/zinc/39/56/63/274395663.db2.gz	LWLHJQPXAYUXRN-BXUZGUMPSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000452067093	274395664	/nfs/dbraw/zinc/39/56/64/274395664.db2.gz	LWLHJQPXAYUXRN-BXUZGUMPSA-N	1	1	319.361	1.187	20	5		DDBDMO
NC(=O)c1ccc(Cn2c[nH+]c3c2CCCC3)c([N+](=O)[O-])c1	ZINC000295162489	274940581	/nfs/dbraw/zinc/94/05/81/274940581.db2.gz	HBXUGSSIMKSZLG-UHFFFAOYSA-N	1	1	300.318	1.817	20	5		DDBDMO
Nc1ccc(N2CC[NH+](Cc3ccncc3)CC2)c([N+](=O)[O-])c1	ZINC000285800210	274964574	/nfs/dbraw/zinc/96/45/74/274964574.db2.gz	YBMHPEVMFDIMNS-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CCN(c3[nH]cc[nH+]3)CC1)CCN2	ZINC000290921569	275038586	/nfs/dbraw/zinc/03/85/86/275038586.db2.gz	IJRHQPZNFSHPGQ-UHFFFAOYSA-N	1	1	314.349	1.613	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H](C)OC	ZINC000291361922	276082231	/nfs/dbraw/zinc/08/22/31/276082231.db2.gz	YXONXBDZDRNTPH-LBPRGKRZSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H](C)OC	ZINC000291361922	276082232	/nfs/dbraw/zinc/08/22/32/276082232.db2.gz	YXONXBDZDRNTPH-LBPRGKRZSA-N	1	1	321.377	1.841	20	5		DDBDMO
C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2N2CCOC2=O)CC1	ZINC000266132656	277113164	/nfs/dbraw/zinc/11/31/64/277113164.db2.gz	ORMSAAOCDPFHDA-UHFFFAOYSA-N	1	1	306.322	1.303	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)[C@@H]2C)c1[N+](=O)[O-]	ZINC000286989446	280188626	/nfs/dbraw/zinc/18/86/26/280188626.db2.gz	GXVHQJYVZHKGAX-QWRGUYRKSA-N	1	1	307.354	1.325	20	5		DDBDMO
NC(=O)c1cccc(N2CCC(c3[nH]cc[nH+]3)CC2)c1[N+](=O)[O-]	ZINC000439164829	295187669	/nfs/dbraw/zinc/18/76/69/295187669.db2.gz	VAYSARCWEJJQDJ-UHFFFAOYSA-N	1	1	315.333	1.801	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)cc1[N+](=O)[O-]	ZINC000354011360	298338213	/nfs/dbraw/zinc/33/82/13/298338213.db2.gz	ZQSLJQRFUFYQMJ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)cc1[N+](=O)[O-]	ZINC000362287200	300044517	/nfs/dbraw/zinc/04/45/17/300044517.db2.gz	OKAYVEIMXGJVHB-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000363052876	300204599	/nfs/dbraw/zinc/20/45/99/300204599.db2.gz	BFFUIIZGLKHCMK-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363052876	300204601	/nfs/dbraw/zinc/20/46/01/300204601.db2.gz	BFFUIIZGLKHCMK-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363052876	300204604	/nfs/dbraw/zinc/20/46/04/300204604.db2.gz	BFFUIIZGLKHCMK-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)Nc1ccc([N+](=O)[O-])cc1	ZINC000363094666	300209405	/nfs/dbraw/zinc/20/94/05/300209405.db2.gz	GGYUPMQZFODIRT-UONOGXRCSA-N	1	1	320.349	1.580	20	5		DDBDMO
COc1cccc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000368486705	301038991	/nfs/dbraw/zinc/03/89/91/301038991.db2.gz	OVOOCYZDYUSQDC-NWDGAFQWSA-N	1	1	307.350	1.879	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368587544	301058686	/nfs/dbraw/zinc/05/86/86/301058686.db2.gz	DACMUPGTYLDVJN-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368587544	301058687	/nfs/dbraw/zinc/05/86/87/301058687.db2.gz	DACMUPGTYLDVJN-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368587544	301058688	/nfs/dbraw/zinc/05/86/88/301058688.db2.gz	DACMUPGTYLDVJN-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000536033835	303354191	/nfs/dbraw/zinc/35/41/91/303354191.db2.gz	BTWOFIRRTHGLGH-CYBMUJFWSA-N	1	1	300.318	1.839	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000536033835	303354193	/nfs/dbraw/zinc/35/41/93/303354193.db2.gz	BTWOFIRRTHGLGH-CYBMUJFWSA-N	1	1	300.318	1.839	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC3(C2)CC[NH2+]CC3)c1[N+](=O)[O-]	ZINC000373140637	307180274	/nfs/dbraw/zinc/18/02/74/307180274.db2.gz	SGFOUCIBEMEBIX-UHFFFAOYSA-N	1	1	321.381	1.486	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(CNC(=O)O2)C1	ZINC000375556966	307228032	/nfs/dbraw/zinc/22/80/32/307228032.db2.gz	JOYQBGGLQJPEIC-OAHLLOKOSA-N	1	1	305.334	1.978	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@@H]1CC[N@H+](C)[C@H]1c1ccccc1	ZINC000377645093	307275483	/nfs/dbraw/zinc/27/54/83/307275483.db2.gz	BNGGDEYZRINVDP-HIFRSBDPSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@@H]1CC[N@@H+](C)[C@H]1c1ccccc1	ZINC000377645093	307275484	/nfs/dbraw/zinc/27/54/84/307275484.db2.gz	BNGGDEYZRINVDP-HIFRSBDPSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](O)C[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000412036307	307298733	/nfs/dbraw/zinc/29/87/33/307298733.db2.gz	MHNDMTOVROIHGC-WCFLWFBJSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](O)C[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000412036307	307298734	/nfs/dbraw/zinc/29/87/34/307298734.db2.gz	MHNDMTOVROIHGC-WCFLWFBJSA-N	1	1	321.377	1.933	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000583274242	337300045	/nfs/dbraw/zinc/30/00/45/337300045.db2.gz	SGRSUNFMQXZCDT-TXEJJXNPSA-N	1	1	309.366	1.495	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000583274242	337300046	/nfs/dbraw/zinc/30/00/46/337300046.db2.gz	SGRSUNFMQXZCDT-TXEJJXNPSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000420997704	534260533	/nfs/dbraw/zinc/26/05/33/534260533.db2.gz	BCLNCNVTXGJOHY-RISCZKNCSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000420997704	534260535	/nfs/dbraw/zinc/26/05/35/534260535.db2.gz	BCLNCNVTXGJOHY-RISCZKNCSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000294983892	527795492	/nfs/dbraw/zinc/79/54/92/527795492.db2.gz	SMEZGZBDECYNGT-UHFFFAOYSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1COC1	ZINC000451282151	528399574	/nfs/dbraw/zinc/39/95/74/528399574.db2.gz	AYZZYFYRNRFGKW-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000331744406	528548286	/nfs/dbraw/zinc/54/82/86/528548286.db2.gz	YFZFDLCICWNKPK-ZYHUDNBSSA-N	1	1	321.381	1.627	20	5		DDBDMO
COCC[N@@H+](CCC(=O)OC)Cc1cccc([N+](=O)[O-])c1C	ZINC000113255358	696656516	/nfs/dbraw/zinc/65/65/16/696656516.db2.gz	UWRWIGPCZBPAHP-UHFFFAOYSA-N	1	1	310.350	1.915	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCc2cccs2)CC1	ZINC000981137939	697015583	/nfs/dbraw/zinc/01/55/83/697015583.db2.gz	HWCPNTWHDCNLJD-ZIAGYGMSSA-N	1	1	323.418	1.490	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCc2cccs2)CC1	ZINC000981137939	697015586	/nfs/dbraw/zinc/01/55/86/697015586.db2.gz	HWCPNTWHDCNLJD-ZIAGYGMSSA-N	1	1	323.418	1.490	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCc2cccs2)CC1	ZINC000981137939	697015587	/nfs/dbraw/zinc/01/55/87/697015587.db2.gz	HWCPNTWHDCNLJD-ZIAGYGMSSA-N	1	1	323.418	1.490	20	5		DDBDMO
C[N@H+](C[C@@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000176096163	697401323	/nfs/dbraw/zinc/40/13/23/697401323.db2.gz	FQKUCBQOQHYENE-JTQLQIEISA-N	1	1	307.306	1.429	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000176096163	697401325	/nfs/dbraw/zinc/40/13/25/697401325.db2.gz	FQKUCBQOQHYENE-JTQLQIEISA-N	1	1	307.306	1.429	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CCC[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000773195913	697726602	/nfs/dbraw/zinc/72/66/02/697726602.db2.gz	BZXFWLJCBHRVEO-NSHDSACASA-N	1	1	306.366	1.700	20	5		DDBDMO
CC(C)C1(O)C[NH+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000773894839	697820256	/nfs/dbraw/zinc/82/02/56/697820256.db2.gz	CDZCESJVRSYATO-CYBMUJFWSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000749964876	700195269	/nfs/dbraw/zinc/19/52/69/700195269.db2.gz	RIJQUABPNXJQET-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](C3OCCO3)C2)cc1	ZINC000776582953	698121542	/nfs/dbraw/zinc/12/15/42/698121542.db2.gz	XSCFOWVCVMUPSE-DZGCQCFKSA-N	1	1	322.361	1.713	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](C3OCCO3)C2)cc1	ZINC000776582957	698121643	/nfs/dbraw/zinc/12/16/43/698121643.db2.gz	XSCFOWVCVMUPSE-UKRRQHHQSA-N	1	1	322.361	1.713	20	5		DDBDMO
CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000750066372	700202035	/nfs/dbraw/zinc/20/20/35/700202035.db2.gz	ISYXXUOBHMDGHR-HOTGVXAUSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1	ZINC000750066372	700202037	/nfs/dbraw/zinc/20/20/37/700202037.db2.gz	ISYXXUOBHMDGHR-HOTGVXAUSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN(C2CC2)C1	ZINC000750066372	700202039	/nfs/dbraw/zinc/20/20/39/700202039.db2.gz	ISYXXUOBHMDGHR-HOTGVXAUSA-N	1	1	305.378	1.797	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])cc1OC	ZINC000783745357	698873017	/nfs/dbraw/zinc/87/30/17/698873017.db2.gz	WEEDQDLQHJCHEW-ABAIWWIYSA-N	1	1	308.334	1.426	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])cc1OC	ZINC000783745357	698873018	/nfs/dbraw/zinc/87/30/18/698873018.db2.gz	WEEDQDLQHJCHEW-ABAIWWIYSA-N	1	1	308.334	1.426	20	5		DDBDMO
CC(C)[C@H](C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-])[NH+](C)C	ZINC000787960887	699261049	/nfs/dbraw/zinc/26/10/49/699261049.db2.gz	IWOIXXZWNAFLFV-CQSZACIVSA-N	1	1	323.349	1.663	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000729185177	699473024	/nfs/dbraw/zinc/47/30/24/699473024.db2.gz	MOHISKWHDUOOGP-SECBINFHSA-N	1	1	307.310	1.264	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000729185177	699473026	/nfs/dbraw/zinc/47/30/26/699473026.db2.gz	MOHISKWHDUOOGP-SECBINFHSA-N	1	1	307.310	1.264	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000742239766	699869115	/nfs/dbraw/zinc/86/91/15/699869115.db2.gz	HDANIGSDQGSUQR-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@H+](CCc1ccccn1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000761672044	700866620	/nfs/dbraw/zinc/86/66/20/700866620.db2.gz	DVSRUBLHHKRWRS-UHFFFAOYSA-N	1	1	316.361	1.716	20	5		DDBDMO
COCC[NH+](CCOC)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000764882294	700990162	/nfs/dbraw/zinc/99/01/62/700990162.db2.gz	KTYGIYUXCDLSJI-UHFFFAOYSA-N	1	1	322.365	1.805	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768815886	701205784	/nfs/dbraw/zinc/20/57/84/701205784.db2.gz	XOTHTWNSEIUGRQ-MRVPVSSYSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000768815886	701205787	/nfs/dbraw/zinc/20/57/87/701205787.db2.gz	XOTHTWNSEIUGRQ-MRVPVSSYSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839699019	701788748	/nfs/dbraw/zinc/78/87/48/701788748.db2.gz	UURHDVPYWKHEFK-DRPJVOAASA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839699019	701788753	/nfs/dbraw/zinc/78/87/53/701788753.db2.gz	UURHDVPYWKHEFK-DRPJVOAASA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839699019	701788758	/nfs/dbraw/zinc/78/87/58/701788758.db2.gz	UURHDVPYWKHEFK-DRPJVOAASA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1CCN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1=O	ZINC000840057949	701943151	/nfs/dbraw/zinc/94/31/51/701943151.db2.gz	GRFKDHASNPDNQE-NSHDSACASA-N	1	1	307.354	1.254	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000866209646	706649826	/nfs/dbraw/zinc/64/98/26/706649826.db2.gz	UOGOAHRHDBXVSX-ZYHUDNBSSA-N	1	1	320.349	1.307	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=S)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000840799352	702242022	/nfs/dbraw/zinc/24/20/22/702242022.db2.gz	CNLRWCVZRRYAOT-MFKMUULPSA-N	1	1	306.391	1.928	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000840993564	702305660	/nfs/dbraw/zinc/30/56/60/702305660.db2.gz	CDGQTUDCUGMLFL-SNVBAGLBSA-N	1	1	306.278	1.598	20	5		DDBDMO
CC[NH2+]Cc1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1	ZINC000843225309	702846065	/nfs/dbraw/zinc/84/60/65/702846065.db2.gz	GXLMTBQSAGEHIZ-UHFFFAOYSA-N	1	1	322.321	1.695	20	5		DDBDMO
O=C1O[C@@H](C[N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1C1CC1	ZINC000844310616	703010347	/nfs/dbraw/zinc/01/03/47/703010347.db2.gz	VIIYJGFZSWDQHV-ZDUSSCGKSA-N	1	1	317.345	1.936	20	5		DDBDMO
O=C1O[C@@H](C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CN1C1CC1	ZINC000844310616	703010350	/nfs/dbraw/zinc/01/03/50/703010350.db2.gz	VIIYJGFZSWDQHV-ZDUSSCGKSA-N	1	1	317.345	1.936	20	5		DDBDMO
C[N@H+]1CC[C@@H](CCOC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000847823020	703472802	/nfs/dbraw/zinc/47/28/02/703472802.db2.gz	JJWQTJQZDWESGM-JTQLQIEISA-N	1	1	322.317	1.822	20	5		DDBDMO
Cc1cc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c(Cl)cc1[N+](=O)[O-]	ZINC000848768322	703586332	/nfs/dbraw/zinc/58/63/32/703586332.db2.gz	YIESHXNWJSDBPR-WDEREUQCSA-N	1	1	311.769	1.812	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](N2CCOC2=O)C1	ZINC000852438600	704048921	/nfs/dbraw/zinc/04/89/21/704048921.db2.gz	UKRGFROVVWLUJF-CYBMUJFWSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](N2CCOC2=O)C1	ZINC000852438600	704048924	/nfs/dbraw/zinc/04/89/24/704048924.db2.gz	UKRGFROVVWLUJF-CYBMUJFWSA-N	1	1	321.333	1.630	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CCC1(C)C	ZINC000871153997	704232352	/nfs/dbraw/zinc/23/23/52/704232352.db2.gz	YHKVOMYJXHTDJN-UHFFFAOYSA-N	1	1	309.370	1.124	20	5		DDBDMO
CC(C)[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[NH+]1CCOCC1	ZINC000822317874	704915730	/nfs/dbraw/zinc/91/57/30/704915730.db2.gz	UIEGDSBSRJUISC-ZDUSSCGKSA-N	1	1	315.414	1.295	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2cc(C)cc([N+](=O)[O-])c2)no1	ZINC000823270916	705189851	/nfs/dbraw/zinc/18/98/51/705189851.db2.gz	XYNNHTUNEOQRSE-LLVKDONJSA-N	1	1	320.305	1.906	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836661	705193585	/nfs/dbraw/zinc/19/35/85/705193585.db2.gz	HOCSLVMOBSCQKT-ZIAGYGMSSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836661	705193586	/nfs/dbraw/zinc/19/35/86/705193586.db2.gz	HOCSLVMOBSCQKT-ZIAGYGMSSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000823932861	705340931	/nfs/dbraw/zinc/34/09/31/705340931.db2.gz	GJWAVHLYRIVRFC-AOOOYVTPSA-N	1	1	307.354	1.733	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Nc3ccc(N)c([N+](=O)[O-])c3)C2)C1	ZINC000823933353	705341805	/nfs/dbraw/zinc/34/18/05/705341805.db2.gz	PIJNLFMEDBBLBV-OAHLLOKOSA-N	1	1	319.365	1.737	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000824020985	705357386	/nfs/dbraw/zinc/35/73/86/705357386.db2.gz	FFQSJQMFCPCMCW-CYBMUJFWSA-N	1	1	319.361	1.103	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000824020985	705357390	/nfs/dbraw/zinc/35/73/90/705357390.db2.gz	FFQSJQMFCPCMCW-CYBMUJFWSA-N	1	1	319.361	1.103	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825868755	705738743	/nfs/dbraw/zinc/73/87/43/705738743.db2.gz	JQPSUFXAMOBOMK-CQSZACIVSA-N	1	1	309.366	1.476	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000826574040	705818435	/nfs/dbraw/zinc/81/84/35/705818435.db2.gz	KPTBXFIEPGQNKN-BZUAXINKSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000826574040	705818439	/nfs/dbraw/zinc/81/84/39/705818439.db2.gz	KPTBXFIEPGQNKN-BZUAXINKSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000826574040	705818443	/nfs/dbraw/zinc/81/84/43/705818443.db2.gz	KPTBXFIEPGQNKN-BZUAXINKSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])ccc1F	ZINC000826867947	705887407	/nfs/dbraw/zinc/88/74/07/705887407.db2.gz	NOKKPJLUBYUDKS-NSHDSACASA-N	1	1	307.325	1.948	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000827675019	706047086	/nfs/dbraw/zinc/04/70/86/706047086.db2.gz	NHDQVPLWNOXMCS-BXUZGUMPSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000827675019	706047090	/nfs/dbraw/zinc/04/70/90/706047090.db2.gz	NHDQVPLWNOXMCS-BXUZGUMPSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[C@@H](NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000828905412	706253423	/nfs/dbraw/zinc/25/34/23/706253423.db2.gz	WPIPNMOQBOVGAA-IAQYHMDHSA-N	1	1	319.361	1.395	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@]1(O)CCc2ccccc21	ZINC000829337405	706320829	/nfs/dbraw/zinc/32/08/29/706320829.db2.gz	GTIXNJDWGJTBGY-INIZCTEOSA-N	1	1	316.361	1.557	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000830110208	706456582	/nfs/dbraw/zinc/45/65/82/706456582.db2.gz	BQSDJGYEUARYBU-SDJAHQOYSA-N	1	1	303.362	1.907	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN2CCO[C@H]1C2	ZINC000830292910	706491271	/nfs/dbraw/zinc/49/12/71/706491271.db2.gz	UENYDHHNEJPHFK-XHSDSOJGSA-N	1	1	321.377	1.033	20	5		DDBDMO
COC(=O)CC[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000880039117	706860267	/nfs/dbraw/zinc/86/02/67/706860267.db2.gz	FSCFBCYKAPIKCZ-GFCCVEGCSA-N	1	1	310.354	1.457	20	5		DDBDMO
O=C1CC2(CCC2)[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CCN1	ZINC000880168537	706898928	/nfs/dbraw/zinc/89/89/28/706898928.db2.gz	PCGOUVPSOHOBDF-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)CCN1	ZINC000880168537	706898931	/nfs/dbraw/zinc/89/89/31/706898931.db2.gz	PCGOUVPSOHOBDF-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](CF)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000880296489	706932065	/nfs/dbraw/zinc/93/20/65/706932065.db2.gz	BBXUTEXMNSHMDH-LLVKDONJSA-N	1	1	307.325	1.775	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](CF)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000880296489	706932067	/nfs/dbraw/zinc/93/20/67/706932067.db2.gz	BBXUTEXMNSHMDH-LLVKDONJSA-N	1	1	307.325	1.775	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3C[C@@H]4COC[C@@H]4C3)n2)cc1	ZINC000872784928	707599978	/nfs/dbraw/zinc/59/99/78/707599978.db2.gz	IAKQUZKYOKJKJE-BETUJISGSA-N	1	1	315.333	1.389	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)OC[C@H]1CCCC[N@@H+]1C(C)C	ZINC000837475163	707658790	/nfs/dbraw/zinc/65/87/90/707658790.db2.gz	HFUJIGSGAJZUNG-CYBMUJFWSA-N	1	1	324.381	1.906	20	5		DDBDMO
O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000838909188	708001286	/nfs/dbraw/zinc/00/12/86/708001286.db2.gz	OFMQUDDFCASOBY-XBXGTLAGSA-N	1	1	324.308	1.754	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c([N+](=O)[O-])c1	ZINC000896915481	708181721	/nfs/dbraw/zinc/18/17/21/708181721.db2.gz	YOBASGUYJRNKRT-BLLLJJGKSA-N	1	1	318.377	1.342	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897216831	708255991	/nfs/dbraw/zinc/25/59/91/708255991.db2.gz	VTKMGRUDZGWOLA-STQMWFEESA-N	1	1	310.329	1.164	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897221370	708259128	/nfs/dbraw/zinc/25/91/28/708259128.db2.gz	MBDSGDKSQTZXHM-OLZOCXBDSA-N	1	1	323.397	1.155	20	5		DDBDMO
CC(C)c1ccc(C(=O)N(C)CC[N@@H+](C)CCO)cc1[N+](=O)[O-]	ZINC000912605424	713045160	/nfs/dbraw/zinc/04/51/60/713045160.db2.gz	SLWBSEULWMYDNE-UHFFFAOYSA-N	1	1	323.393	1.714	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCn2nncc2C1	ZINC000886447576	708761919	/nfs/dbraw/zinc/76/19/19/708761919.db2.gz	POGYMBBEVKMZJU-UHFFFAOYSA-N	1	1	303.322	1.601	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCn2nncc2C1	ZINC000886447576	708761920	/nfs/dbraw/zinc/76/19/20/708761920.db2.gz	POGYMBBEVKMZJU-UHFFFAOYSA-N	1	1	303.322	1.601	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593765	708785895	/nfs/dbraw/zinc/78/58/95/708785895.db2.gz	ZEDMTKURQILELG-NSHDSACASA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593765	708785898	/nfs/dbraw/zinc/78/58/98/708785898.db2.gz	ZEDMTKURQILELG-NSHDSACASA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593765	708785900	/nfs/dbraw/zinc/78/59/00/708785900.db2.gz	ZEDMTKURQILELG-NSHDSACASA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593765	708785901	/nfs/dbraw/zinc/78/59/01/708785901.db2.gz	ZEDMTKURQILELG-NSHDSACASA-N	1	1	309.370	1.429	20	5		DDBDMO
C[C@H](CNC(=O)[C@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402447	709037449	/nfs/dbraw/zinc/03/74/49/709037449.db2.gz	CDMRAWQHEIGACO-BXUZGUMPSA-N	1	1	307.350	1.145	20	5		DDBDMO
C[C@H](CNC(=O)[C@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402447	709037450	/nfs/dbraw/zinc/03/74/50/709037450.db2.gz	CDMRAWQHEIGACO-BXUZGUMPSA-N	1	1	307.350	1.145	20	5		DDBDMO
C[C@@H](CNC(=O)CC[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000887404417	709038036	/nfs/dbraw/zinc/03/80/36/709038036.db2.gz	DSANOKYOTSGVIA-ZDUSSCGKSA-N	1	1	321.377	1.537	20	5		DDBDMO
CC(C)(CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000912955507	713134754	/nfs/dbraw/zinc/13/47/54/713134754.db2.gz	ZXUOSFXGNAXMOP-UHFFFAOYSA-N	1	1	321.377	1.826	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000912021302	711126507	/nfs/dbraw/zinc/12/65/07/711126507.db2.gz	KCVDNBDOXQCWKG-TYNCELHUSA-N	1	1	321.377	1.569	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H]1C(C)(C)C	ZINC000912034947	711136559	/nfs/dbraw/zinc/13/65/59/711136559.db2.gz	XBBUNZDAYKYBFT-CQSZACIVSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000928570537	713233069	/nfs/dbraw/zinc/23/30/69/713233069.db2.gz	FIYMCBNFEKWUPM-CQSZACIVSA-N	1	1	303.362	1.837	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000928570537	713233070	/nfs/dbraw/zinc/23/30/70/713233070.db2.gz	FIYMCBNFEKWUPM-CQSZACIVSA-N	1	1	303.362	1.837	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000894592610	711199025	/nfs/dbraw/zinc/19/90/25/711199025.db2.gz	ZHDWVDQLUXHZTP-UHFFFAOYSA-N	1	1	321.299	1.974	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](C)[C@H](CO)C2)c1[N+](=O)[O-]	ZINC000895515980	711531403	/nfs/dbraw/zinc/53/14/03/711531403.db2.gz	YRQDJJSKZNFNFG-PWSUYJOCSA-N	1	1	310.350	1.759	20	5		DDBDMO
C[C@@H]1[C@H](Nc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)CC[N@H+]1C	ZINC000895737459	711590678	/nfs/dbraw/zinc/59/06/78/711590678.db2.gz	VRHXZQUCZAELLD-NXEZZACHSA-N	1	1	319.365	1.290	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](C(C)(C)O)C2)c1[N+](=O)[O-]	ZINC000895952777	711654581	/nfs/dbraw/zinc/65/45/81/711654581.db2.gz	JIYDAUGFZBETCU-LLVKDONJSA-N	1	1	310.350	1.902	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cc(C[N@@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1[O-]	ZINC000904420632	711855960	/nfs/dbraw/zinc/85/59/60/711855960.db2.gz	CGSUPRXCJWJDDF-GXSJLCMTSA-N	1	1	311.769	1.995	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cc(C[N@H+]2C[C@@H]3CC[NH2+]C[C@@H]3C2)c1[O-]	ZINC000904420632	711855961	/nfs/dbraw/zinc/85/59/61/711855961.db2.gz	CGSUPRXCJWJDDF-GXSJLCMTSA-N	1	1	311.769	1.995	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](C)C1	ZINC000930362848	713814104	/nfs/dbraw/zinc/81/41/04/713814104.db2.gz	RDLFLNVSNMZAIS-JTQLQIEISA-N	1	1	309.391	1.998	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@@H]2COC[C@H]2O1	ZINC000930441070	713835695	/nfs/dbraw/zinc/83/56/95/713835695.db2.gz	QXWKVHMGTLHOKI-IJEWVQPXSA-N	1	1	306.362	1.873	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000930619791	713878996	/nfs/dbraw/zinc/87/89/96/713878996.db2.gz	HWKXEYHQRBSTKL-GFCCVEGCSA-N	1	1	321.381	1.606	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000930619791	713878997	/nfs/dbraw/zinc/87/89/97/713878997.db2.gz	HWKXEYHQRBSTKL-GFCCVEGCSA-N	1	1	321.381	1.606	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[N@H+](C(C)C)CC1	ZINC000931795097	714187016	/nfs/dbraw/zinc/18/70/16/714187016.db2.gz	QZCRANOYTXTXLS-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC[NH2+]CC1	ZINC000923279991	714295660	/nfs/dbraw/zinc/29/56/60/714295660.db2.gz	VYIQEPVYYNYJPW-AWEZNQCLSA-N	1	1	309.366	1.018	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@@H]1CNC(=O)OC(C)(C)C	ZINC000932710165	714394960	/nfs/dbraw/zinc/39/49/60/714394960.db2.gz	LFXLZLXKEMBGPC-VXGBXAGGSA-N	1	1	301.387	1.746	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000935478838	715065807	/nfs/dbraw/zinc/06/58/07/715065807.db2.gz	CKVRCRCFGAVDLZ-UHFFFAOYSA-N	1	1	309.341	1.875	20	5		DDBDMO
Cc1cc(Cl)c([N+](=O)[O-])c(N2C[C@H]3OCC[N@H+](C)[C@H]3C2)n1	ZINC001164664958	719386514	/nfs/dbraw/zinc/38/65/14/719386514.db2.gz	DCKYTSDPZIORCL-WDEREUQCSA-N	1	1	312.757	1.471	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncc([N+](=O)[O-])c4ccccc43)C[C@H]21	ZINC001164668056	719389132	/nfs/dbraw/zinc/38/91/32/719389132.db2.gz	PUMXRXNIQFDKDI-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CC(C)(C)C2)C1	ZINC000950056132	720469866	/nfs/dbraw/zinc/46/98/66/720469866.db2.gz	TZTPKWCRITZBMJ-ZIAGYGMSSA-N	1	1	309.410	1.621	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2cc([N+](=O)[O-])cc(Br)n2)C1	ZINC001167275579	732886081	/nfs/dbraw/zinc/88/60/81/732886081.db2.gz	SRZDRVPMXBLYMH-ZETCQYMHSA-N	1	1	301.144	1.868	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3cccc(F)c3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025776079	736853183	/nfs/dbraw/zinc/85/31/83/736853183.db2.gz	WJMYQSCYHGAREQ-QMIVOQANSA-N	1	1	319.336	1.037	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc(F)c3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025776079	736853186	/nfs/dbraw/zinc/85/31/86/736853186.db2.gz	WJMYQSCYHGAREQ-QMIVOQANSA-N	1	1	319.336	1.037	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3cccc(F)c3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025776079	736853188	/nfs/dbraw/zinc/85/31/88/736853188.db2.gz	WJMYQSCYHGAREQ-QMIVOQANSA-N	1	1	319.336	1.037	20	5		DDBDMO
COc1nc(C)nc(NCc2ccc(N)[nH+]c2C)c1[N+](=O)[O-]	ZINC001167781756	738340645	/nfs/dbraw/zinc/34/06/45/738340645.db2.gz	NZVPRKDFWVXLJL-UHFFFAOYSA-N	1	1	304.310	1.600	20	5		DDBDMO
N=C(NCCCC[NH3+])Nc1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC001167880288	739170747	/nfs/dbraw/zinc/17/07/47/739170747.db2.gz	GHRPSVBPCWWVJM-UHFFFAOYSA-N	1	1	306.370	1.544	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208401	743782173	/nfs/dbraw/zinc/78/21/73/743782173.db2.gz	KBTPCSOUHKYHAL-AAEUAGOBSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208401	743782171	/nfs/dbraw/zinc/78/21/71/743782171.db2.gz	KBTPCSOUHKYHAL-AAEUAGOBSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208403	743782402	/nfs/dbraw/zinc/78/24/02/743782402.db2.gz	KBTPCSOUHKYHAL-WCQYABFASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208403	743782403	/nfs/dbraw/zinc/78/24/03/743782403.db2.gz	KBTPCSOUHKYHAL-WCQYABFASA-N	1	1	300.742	1.566	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC001184065550	743956650	/nfs/dbraw/zinc/95/66/50/743956650.db2.gz	IOJPHULCHZTONT-NSHDSACASA-N	1	1	324.333	1.694	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC001184065550	743956651	/nfs/dbraw/zinc/95/66/51/743956651.db2.gz	IOJPHULCHZTONT-NSHDSACASA-N	1	1	324.333	1.694	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1ccc[nH]1	ZINC001031543973	746994945	/nfs/dbraw/zinc/99/49/45/746994945.db2.gz	QGDZPJFOMNYXBT-UHFFFAOYSA-N	1	1	314.345	1.785	20	5		DDBDMO
C[N@@H+]1CCc2c(NCCn3cnnc3)ccc([N+](=O)[O-])c2C1	ZINC001168876824	762096880	/nfs/dbraw/zinc/09/68/80/762096880.db2.gz	ZWMDPMFHPVZTEX-UHFFFAOYSA-N	1	1	302.338	1.286	20	5		DDBDMO
C[N@H+]1CCc2c(NCCn3cnnc3)ccc([N+](=O)[O-])c2C1	ZINC001168876824	762096887	/nfs/dbraw/zinc/09/68/87/762096887.db2.gz	ZWMDPMFHPVZTEX-UHFFFAOYSA-N	1	1	302.338	1.286	20	5		DDBDMO
O=C(c1ccco1)N1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169037073	762192710	/nfs/dbraw/zinc/19/27/10/762192710.db2.gz	IOZMOAPQUFWNIL-KGLIPLIRSA-N	1	1	321.377	1.873	20	5		DDBDMO
Cc1noc(C2(C)CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)n1	ZINC001169152038	762263146	/nfs/dbraw/zinc/26/31/46/762263146.db2.gz	JDGKKIDNKXHPOD-UHFFFAOYSA-N	1	1	320.353	1.573	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CC1CCCC1)CC2	ZINC001050517455	763694218	/nfs/dbraw/zinc/69/42/18/763694218.db2.gz	UJVXYQMJFJDOAS-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
COC(=O)CCN(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001156816771	763887635	/nfs/dbraw/zinc/88/76/35/763887635.db2.gz	WEXCNIBQXRNUQX-FNORWQNLSA-N	1	1	308.338	1.521	20	5		DDBDMO
CCC(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC001096243318	768740441	/nfs/dbraw/zinc/74/04/41/768740441.db2.gz	LHEONULKFVZQIQ-UHFFFAOYSA-N	1	1	320.393	1.633	20	5		DDBDMO
CC(C)CCCC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001134195882	770745714	/nfs/dbraw/zinc/74/57/14/770745714.db2.gz	NWRQZNIIWZQSGZ-UHFFFAOYSA-N	1	1	311.386	1.360	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1N[C@@H](N)CCC[NH3+]	ZINC001170903441	771900979	/nfs/dbraw/zinc/90/09/79/771900979.db2.gz	JVIIUOZPYXONNJ-LLVKDONJSA-N	1	1	316.745	1.470	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)n1	ZINC001136342798	771942432	/nfs/dbraw/zinc/94/24/32/771942432.db2.gz	DAPVWLKVVPPWIA-LLVKDONJSA-N	1	1	304.350	1.512	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC001093770969	775068141	/nfs/dbraw/zinc/06/81/41/775068141.db2.gz	QZFFETPZNALTEG-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
O=[N+]([O-])CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC001171560561	776343946	/nfs/dbraw/zinc/34/39/46/776343946.db2.gz	IGURVWGPIZJVQR-HDJSIYSDSA-N	1	1	323.349	1.977	20	5		DDBDMO
O=[N+]([O-])CC[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC001171560561	776343961	/nfs/dbraw/zinc/34/39/61/776343961.db2.gz	IGURVWGPIZJVQR-HDJSIYSDSA-N	1	1	323.349	1.977	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](C)(CO)[C@H](O)C1	ZINC001173223385	777057025	/nfs/dbraw/zinc/05/70/25/777057025.db2.gz	ZNSRRHMZRJZCMO-DAXOMENPSA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN1CCOCC1	ZINC001173228943	777062478	/nfs/dbraw/zinc/06/24/78/777062478.db2.gz	OEXVEUBSWGYNDO-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
CC(=O)N(C)CC[NH+]1CCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC001102409537	778120228	/nfs/dbraw/zinc/12/02/28/778120228.db2.gz	GODOZILUEODERL-UHFFFAOYSA-N	1	1	320.393	1.504	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[N@@H+](C)CC1(C)C	ZINC001178707907	779153390	/nfs/dbraw/zinc/15/33/90/779153390.db2.gz	BNOWLZIDSRBKLY-CYBMUJFWSA-N	1	1	307.350	1.673	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1C1CCOCC1	ZINC001119977755	781703640	/nfs/dbraw/zinc/70/36/40/781703640.db2.gz	SPEDRLQKIIRGGA-CYBMUJFWSA-N	1	1	306.366	1.385	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@H]([NH3+])CC(F)F)n2)n1C	ZINC001326513950	861419755	/nfs/dbraw/zinc/41/97/55/861419755.db2.gz	ZMOBLICSYHSALC-RXMQYKEDSA-N	1	1	302.241	1.342	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCC(C)(C)C(N)=O)ncc1[N+](=O)[O-]	ZINC001156738744	863311193	/nfs/dbraw/zinc/31/11/93/863311193.db2.gz	SUQICYWKXCOZAN-AATRIKPKSA-N	1	1	307.354	1.446	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@@H]([N@@H+](C)C(C)C)C2)c([N+](=O)[O-])c1	ZINC001157010083	863514653	/nfs/dbraw/zinc/51/46/53/863514653.db2.gz	OGRWJRGDKWLRNA-GFCCVEGCSA-N	1	1	322.365	1.695	20	5		DDBDMO
O=C(NCCC[NH2+]C/C=C/c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761386	864111469	/nfs/dbraw/zinc/11/14/69/864111469.db2.gz	QDNNXRARWMYTDP-GMLRFVCHSA-N	1	1	303.362	1.461	20	5		DDBDMO
CCc1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157766807	864116155	/nfs/dbraw/zinc/11/61/55/864116155.db2.gz	AAAJLQUIKCMBOK-HUUCEWRRSA-N	1	1	305.378	1.510	20	5		DDBDMO
Cc1ccc(CCC[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157767042	864118562	/nfs/dbraw/zinc/11/85/62/864118562.db2.gz	FAFZFFWAVWIUBP-HZPDHXFCSA-N	1	1	319.405	1.689	20	5		DDBDMO
C=CC(=O)NCCNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001158835063	864927092	/nfs/dbraw/zinc/92/70/92/864927092.db2.gz	LTLVAWZWPHAAMZ-VMPITWQZSA-N	1	1	305.338	1.236	20	5		DDBDMO
Nc1nc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160724460	866072055	/nfs/dbraw/zinc/07/20/55/866072055.db2.gz	LBZZQSCCFPMECE-MNOVXSKESA-N	1	1	307.354	1.237	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)CN1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001333586571	866860782	/nfs/dbraw/zinc/86/07/82/866860782.db2.gz	JZVGQGLLYKGAGR-MRXNPFEDSA-N	1	1	307.394	1.654	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(F)c(F)cc2[N+](=O)[O-])C1	ZINC001225780381	882022859	/nfs/dbraw/zinc/02/28/59/882022859.db2.gz	ZUZVSHISHOXUMI-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
Cc1nc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC001324417765	867267845	/nfs/dbraw/zinc/26/78/45/867267845.db2.gz	QKPXDKGHJYWEIR-ZDUSSCGKSA-N	1	1	321.381	1.384	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1	ZINC001334111554	867304621	/nfs/dbraw/zinc/30/46/21/867304621.db2.gz	VQFUAHYIAXTKMY-NEPJUHHUSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2C[N@H+](C)CCN2C)c1C	ZINC001334414896	867552998	/nfs/dbraw/zinc/55/29/98/867552998.db2.gz	HROWKMAQGYJQLQ-ZDUSSCGKSA-N	1	1	320.393	1.187	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NCCC[N@H+]1CCCO[C@@H](C)C1	ZINC001322552433	868243166	/nfs/dbraw/zinc/24/31/66/868243166.db2.gz	CVSLKDAHLTWUPF-ZDUSSCGKSA-N	1	1	308.382	1.633	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC001336746988	869121865	/nfs/dbraw/zinc/12/18/65/869121865.db2.gz	YVHFRIWNOPJHIM-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@@H+](C1CN(c2ncc(Cl)cc2[N+](=O)[O-])C1)[C@@H]1CCOC1	ZINC001165203810	869424002	/nfs/dbraw/zinc/42/40/02/869424002.db2.gz	HEKYPVHCSAVGHH-SNVBAGLBSA-N	1	1	312.757	1.553	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC001337971094	869722061	/nfs/dbraw/zinc/72/20/61/869722061.db2.gz	PJBZTZDCUNQIQA-UHFFFAOYSA-N	1	1	322.409	1.909	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C1	ZINC001166444186	870001332	/nfs/dbraw/zinc/00/13/32/870001332.db2.gz	JRRINFJXYQBHHL-JTQLQIEISA-N	1	1	306.366	1.780	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCC([N@H+]2CCCOCC2)CC1	ZINC001347251250	874071998	/nfs/dbraw/zinc/07/19/98/874071998.db2.gz	CLVWMWZJPNUHDJ-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
CC(C)[C@@H](C(=O)Oc1cc2c(cc1[N+](=O)[O-])OCCO2)[NH+](C)C	ZINC001347948130	874315411	/nfs/dbraw/zinc/31/54/11/874315411.db2.gz	BQSWIDNVNOCYBB-AWEZNQCLSA-N	1	1	324.333	1.858	20	5		DDBDMO
COC(=O)c1ccc(O[C@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1	ZINC001227297279	882958296	/nfs/dbraw/zinc/95/82/96/882958296.db2.gz	BYLWJYGIUCPWHU-NSHDSACASA-N	1	1	317.301	1.972	20	5		DDBDMO
COC(=O)c1ccc(CO[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001223413080	880951204	/nfs/dbraw/zinc/95/12/04/880951204.db2.gz	ILRIEJCUYIUGRM-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
O=c1[nH]cnc(O[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-]	ZINC001228144380	883363821	/nfs/dbraw/zinc/36/38/21/883363821.db2.gz	TVHKOZYBBPUDHK-GFCCVEGCSA-N	1	1	316.317	1.744	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](O)[C@@](C)(CO)C1	ZINC001254553816	896499615	/nfs/dbraw/zinc/49/96/15/896499615.db2.gz	ZQALIKTUIKTVQP-DAXOMENPSA-N	1	1	308.378	1.591	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC001263094412	900493001	/nfs/dbraw/zinc/49/30/01/900493001.db2.gz	GFABFLMPVFRACR-HNNXBMFYSA-N	1	1	320.393	1.921	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2nnc(C[N+](=O)[O-])n2CC2CC2)C[C@H]1C	ZINC001263676061	900668324	/nfs/dbraw/zinc/66/83/24/900668324.db2.gz	FYMXXAPGPJEQQC-NEPJUHHUSA-N	1	1	322.413	1.384	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@]12CC[N@@H+](C1)CCC2	ZINC001263859559	900776775	/nfs/dbraw/zinc/77/67/75/900776775.db2.gz	QOHUUFBPXDIOBS-MRXNPFEDSA-N	1	1	303.362	1.739	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001316594238	903194851	/nfs/dbraw/zinc/19/48/51/903194851.db2.gz	SBGABSMXPSVUPI-UHFFFAOYSA-N	1	1	308.382	1.489	20	5		DDBDMO
COc1ccc(NC(=O)C[C@]2(O)CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001295474643	915832988	/nfs/dbraw/zinc/83/29/88/915832988.db2.gz	GKDJMSGNEMXKBT-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1ccnc(N)c1[N+](=O)[O-])CC2	ZINC000579242789	422733102	/nfs/dbraw/zinc/73/31/02/422733102.db2.gz	LZLWRZXPUDCIRL-UHFFFAOYSA-N	1	1	319.365	1.272	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000451925624	231236640	/nfs/dbraw/zinc/23/66/40/231236640.db2.gz	LDZHPZPYBIMJSJ-OAHLLOKOSA-N	1	1	310.350	1.304	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000451250278	529485192	/nfs/dbraw/zinc/48/51/92/529485192.db2.gz	DEJJOPRJGSIONL-SWLSCSKDSA-N	1	1	321.377	1.650	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000452351189	231356705	/nfs/dbraw/zinc/35/67/05/231356705.db2.gz	PHCQTEBMJXTKMZ-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1c(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000154024734	290659852	/nfs/dbraw/zinc/65/98/52/290659852.db2.gz	NSXBPFQOMKQSSA-YRGRVCCFSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000252013755	282208026	/nfs/dbraw/zinc/20/80/26/282208026.db2.gz	XXJNXROHGCNSKT-ZBFHGGJFSA-N	1	1	324.377	1.571	20	5		DDBDMO
CN1C(=O)CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1=O	ZINC000090027071	185278842	/nfs/dbraw/zinc/27/88/42/185278842.db2.gz	QOFXAVUUFUQTFK-LLVKDONJSA-N	1	1	311.725	1.485	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000425047011	529821936	/nfs/dbraw/zinc/82/19/36/529821936.db2.gz	LWTXKYIIAAQFER-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000491874425	530053140	/nfs/dbraw/zinc/05/31/40/530053140.db2.gz	VODGKKADEZEMHZ-GQCTYLIASA-N	1	1	307.325	1.911	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000297137771	282369840	/nfs/dbraw/zinc/36/98/40/282369840.db2.gz	UQFDSESQEWCHAB-YOGCLGLASA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000330780625	232062092	/nfs/dbraw/zinc/06/20/92/232062092.db2.gz	XEMGCJOGLCJIGR-SECBINFHSA-N	1	1	307.354	1.017	20	5		DDBDMO
C[C@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612907	210014385	/nfs/dbraw/zinc/01/43/85/210014385.db2.gz	ZPOUCBKJMFAFRX-JQWIXIFHSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612907	210014388	/nfs/dbraw/zinc/01/43/88/210014388.db2.gz	ZPOUCBKJMFAFRX-JQWIXIFHSA-N	1	1	305.334	1.609	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000048428426	352540000	/nfs/dbraw/zinc/54/00/00/352540000.db2.gz	MXIZDPGZYJTROG-UHFFFAOYSA-N	1	1	307.350	1.389	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H]1C	ZINC000177877265	186197507	/nfs/dbraw/zinc/19/75/07/186197507.db2.gz	LSQFRHMNRDIBEM-NXEZZACHSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H]1C	ZINC000177877265	186197509	/nfs/dbraw/zinc/19/75/09/186197509.db2.gz	LSQFRHMNRDIBEM-NXEZZACHSA-N	1	1	321.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H](OCCO)C2)cc1	ZINC000172301748	198075187	/nfs/dbraw/zinc/07/51/87/198075187.db2.gz	MQRJJVOQAJXYIA-OAHLLOKOSA-N	1	1	310.350	1.447	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC1=CC[N@@H+](C)CC1	ZINC000277188957	213354300	/nfs/dbraw/zinc/35/43/00/213354300.db2.gz	BGMLLOKHGIBPEC-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)C1	ZINC000032267687	352276791	/nfs/dbraw/zinc/27/67/91/352276791.db2.gz	GOQUXCYIENCYNE-NSHDSACASA-N	1	1	311.338	1.274	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)CC1	ZINC000355627878	290954148	/nfs/dbraw/zinc/95/41/48/290954148.db2.gz	YBFUQPOHTXGAAF-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)n1	ZINC000331725255	234049092	/nfs/dbraw/zinc/04/90/92/234049092.db2.gz	MPZRHBFUMSRBSC-QWRGUYRKSA-N	1	1	307.354	1.168	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]3CCCC[C@H]32)c1	ZINC000331773881	234107054	/nfs/dbraw/zinc/10/70/54/234107054.db2.gz	KWJAWZSCYDCDRB-BPLDGKMQSA-N	1	1	308.382	1.807	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000172831562	198155588	/nfs/dbraw/zinc/15/55/88/198155588.db2.gz	OLTQPEBYUCUXOC-LBPRGKRZSA-N	1	1	323.397	1.583	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000047145553	352484218	/nfs/dbraw/zinc/48/42/18/352484218.db2.gz	LLENYMKGDNZZHQ-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCn3cccn3)CC2)cn1	ZINC000049983202	352560033	/nfs/dbraw/zinc/56/00/33/352560033.db2.gz	GVTGPYVILGLHES-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000072714770	191221625	/nfs/dbraw/zinc/22/16/25/191221625.db2.gz	SHHHIDOAQAZKLM-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CC[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000072714770	191221627	/nfs/dbraw/zinc/22/16/27/191221627.db2.gz	SHHHIDOAQAZKLM-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CCCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000056283615	352765365	/nfs/dbraw/zinc/76/53/65/352765365.db2.gz	RKLVOLOGROETPD-UHFFFAOYSA-N	1	1	308.382	1.929	20	5		DDBDMO
C[C@H](CNC(=O)COc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000057710414	352826030	/nfs/dbraw/zinc/82/60/30/352826030.db2.gz	AVAGEZWSUPWORZ-LLVKDONJSA-N	1	1	307.350	1.573	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000057159661	352802389	/nfs/dbraw/zinc/80/23/89/352802389.db2.gz	XIYBSZJHIJRCLO-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000066138049	352979040	/nfs/dbraw/zinc/97/90/40/352979040.db2.gz	GUHNYHOFIIZCHO-LBPRGKRZSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000067413289	353047776	/nfs/dbraw/zinc/04/77/76/353047776.db2.gz	WBUCLYVHMDQEET-OAHLLOKOSA-N	1	1	305.378	1.985	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c([N+](=O)[O-])c1	ZINC000173729837	198244863	/nfs/dbraw/zinc/24/48/63/198244863.db2.gz	AVZRURFQWSUPBY-FUNVUKJBSA-N	1	1	322.361	1.970	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CC[N@H+]3CCOC[C@H]3C2)c1	ZINC000579315653	422743487	/nfs/dbraw/zinc/74/34/87/422743487.db2.gz	YQADQXKTAWVFIN-CQSZACIVSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CC[N@@H+]3CCOC[C@H]3C2)c1	ZINC000579315653	422743483	/nfs/dbraw/zinc/74/34/83/422743483.db2.gz	YQADQXKTAWVFIN-CQSZACIVSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)NC1CC1	ZINC000174245968	198310461	/nfs/dbraw/zinc/31/04/61/198310461.db2.gz	CDRSYAVYHBUUHQ-UHFFFAOYSA-N	1	1	319.361	1.717	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000074741738	353327707	/nfs/dbraw/zinc/32/77/07/353327707.db2.gz	AFSOFAUEUNBHOT-CYBMUJFWSA-N	1	1	321.425	1.984	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(C)O	ZINC000075746052	353378906	/nfs/dbraw/zinc/37/89/06/353378906.db2.gz	OZMIXTAJZCXHCS-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(C)O	ZINC000075746052	353378909	/nfs/dbraw/zinc/37/89/09/353378909.db2.gz	OZMIXTAJZCXHCS-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@@H]2C1	ZINC000078203728	353505169	/nfs/dbraw/zinc/50/51/69/353505169.db2.gz	DUQVIHZZTVSCAF-QJPTWQEYSA-N	1	1	305.334	1.744	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000078404030	353515270	/nfs/dbraw/zinc/51/52/70/353515270.db2.gz	ZFHASLKTCWNFDD-CYBMUJFWSA-N	1	1	306.366	1.457	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1	ZINC000078523754	353520322	/nfs/dbraw/zinc/52/03/22/353520322.db2.gz	ARSVCAWDEXPHCO-AWEZNQCLSA-N	1	1	321.377	1.690	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC[N@H+](C2CCOCC2)CC1	ZINC000077990383	353500493	/nfs/dbraw/zinc/50/04/93/353500493.db2.gz	BCRVLCQVOBYTBJ-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000083217007	353708331	/nfs/dbraw/zinc/70/83/31/353708331.db2.gz	ZIBXUOZFOJZCET-SNVBAGLBSA-N	1	1	318.333	1.823	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000108298462	353949358	/nfs/dbraw/zinc/94/93/58/353949358.db2.gz	MEFMCXJHEGMDSU-CYBMUJFWSA-N	1	1	321.381	1.090	20	5		DDBDMO
NC(=O)N[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000270623443	354408158	/nfs/dbraw/zinc/40/81/58/354408158.db2.gz	KHPOTJDWTHBITP-NSHDSACASA-N	1	1	308.338	1.106	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]([C@H](C)O)C2)c1	ZINC000589510629	354997954	/nfs/dbraw/zinc/99/79/54/354997954.db2.gz	BIRNOFJFECCVKQ-WCQYABFASA-N	1	1	322.361	1.974	20	5		DDBDMO
COc1ccc(OCCN2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC000590010308	355038900	/nfs/dbraw/zinc/03/89/00/355038900.db2.gz	AUZNHXZRCRARHM-DOMZBBRYSA-N	1	1	321.377	1.618	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH+](C)C)[C@H]2C)c1[N+](=O)[O-]	ZINC000590403324	355085425	/nfs/dbraw/zinc/08/54/25/355085425.db2.gz	KSBNHEGZLQRNQW-KOLCDFICSA-N	1	1	309.370	1.435	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000590578390	355119604	/nfs/dbraw/zinc/11/96/04/355119604.db2.gz	QGXVUBXBHPFXAY-NSHDSACASA-N	1	1	322.365	1.554	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590442882	355096368	/nfs/dbraw/zinc/09/63/68/355096368.db2.gz	HRYNJIYFQBPIJK-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590442882	355096370	/nfs/dbraw/zinc/09/63/70/355096370.db2.gz	HRYNJIYFQBPIJK-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590442882	355096372	/nfs/dbraw/zinc/09/63/72/355096372.db2.gz	HRYNJIYFQBPIJK-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1	ZINC000590445470	355098902	/nfs/dbraw/zinc/09/89/02/355098902.db2.gz	MYSYZPLZJCWVOV-BONVTDFDSA-N	1	1	314.345	1.852	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])cc2F)C1	ZINC000591136852	355253444	/nfs/dbraw/zinc/25/34/44/355253444.db2.gz	MCVCAIJETWOSNT-LBPRGKRZSA-N	1	1	312.345	1.898	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([C@H]3CCC[NH2+]3)C2)c1[N+](=O)[O-]	ZINC000591893465	355414785	/nfs/dbraw/zinc/41/47/85/355414785.db2.gz	YKEJWFKTCDVTSV-WDEREUQCSA-N	1	1	307.354	1.231	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000593062201	355784042	/nfs/dbraw/zinc/78/40/42/355784042.db2.gz	CDPHQUFCFPNGCX-NWDGAFQWSA-N	1	1	323.349	1.005	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000593065151	355784661	/nfs/dbraw/zinc/78/46/61/355784661.db2.gz	YAVSHMWGQFVLHK-BPLDGKMQSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000593065151	355784666	/nfs/dbraw/zinc/78/46/66/355784666.db2.gz	YAVSHMWGQFVLHK-BPLDGKMQSA-N	1	1	324.377	1.834	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@]3(CC3(F)F)C2)c([N+](=O)[O-])c1	ZINC000593117431	355804644	/nfs/dbraw/zinc/80/46/44/355804644.db2.gz	NEKHSHXTSGFEIB-CYBMUJFWSA-N	1	1	311.288	1.925	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000594065805	356104101	/nfs/dbraw/zinc/10/41/01/356104101.db2.gz	UZHSQUVKMKCUQO-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1CC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CS1(=O)=O	ZINC000594973895	356367078	/nfs/dbraw/zinc/36/70/78/356367078.db2.gz	GGCMOLCDQFDRBM-WCBMZHEXSA-N	1	1	304.393	1.712	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595330795	356452233	/nfs/dbraw/zinc/45/22/33/356452233.db2.gz	PBBCCGYUZLFZTK-CYBMUJFWSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595330795	356452235	/nfs/dbraw/zinc/45/22/35/356452235.db2.gz	PBBCCGYUZLFZTK-CYBMUJFWSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000595299527	356439166	/nfs/dbraw/zinc/43/91/66/356439166.db2.gz	TUYQJYCZMIRWKZ-ZDUSSCGKSA-N	1	1	324.381	1.578	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373217	356469430	/nfs/dbraw/zinc/46/94/30/356469430.db2.gz	YPFNLAJVTUIKPC-DGCLKSJQSA-N	1	1	319.365	1.097	20	5		DDBDMO
CCN1CC[C@@H]([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373217	356469435	/nfs/dbraw/zinc/46/94/35/356469435.db2.gz	YPFNLAJVTUIKPC-DGCLKSJQSA-N	1	1	319.365	1.097	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000081522083	192281337	/nfs/dbraw/zinc/28/13/37/192281337.db2.gz	LURJJRARIKCLPW-LLVKDONJSA-N	1	1	307.350	1.552	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000595551445	356546743	/nfs/dbraw/zinc/54/67/43/356546743.db2.gz	LZMGPXFKDXOHES-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
CNC(=O)NC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000595546124	356541727	/nfs/dbraw/zinc/54/17/27/356541727.db2.gz	WPJZJQDJRHTGPG-UHFFFAOYSA-N	1	1	310.329	1.627	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000595659801	356596570	/nfs/dbraw/zinc/59/65/70/356596570.db2.gz	AOZLARFOVZVIAH-OAHLLOKOSA-N	1	1	310.350	1.447	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](C3CCC3)C2)c1	ZINC000595838738	356673318	/nfs/dbraw/zinc/67/33/18/356673318.db2.gz	VHVLNKQLXHPJTC-UKRRQHHQSA-N	1	1	308.382	1.664	20	5		DDBDMO
N[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1F	ZINC000595907501	356701124	/nfs/dbraw/zinc/70/11/24/356701124.db2.gz	WBOYCXSEPOGKJV-CHWSQXEVSA-N	1	1	310.329	1.295	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)ccc1[N+](=O)[O-]	ZINC000597574946	357234001	/nfs/dbraw/zinc/23/40/01/357234001.db2.gz	JEJUEPKJRNKHDZ-MNOVXSKESA-N	1	1	310.329	1.192	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@]2(CC[N@H+](C)C2)C1	ZINC000597716752	357299886	/nfs/dbraw/zinc/29/98/86/357299886.db2.gz	UBISLZBRIGFCEI-OAHLLOKOSA-N	1	1	321.381	1.044	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000597859537	357361433	/nfs/dbraw/zinc/36/14/33/357361433.db2.gz	FFAVXBWBFWLNAE-LLVKDONJSA-N	1	1	306.366	1.840	20	5		DDBDMO
CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597945948	357394280	/nfs/dbraw/zinc/39/42/80/357394280.db2.gz	KYAIOCCKIRDARM-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@@H]1CC[N@@H+](CC)C1	ZINC000598041818	357439679	/nfs/dbraw/zinc/43/96/79/357439679.db2.gz	NKCTVYMJVXRVRV-LLVKDONJSA-N	1	1	309.370	1.193	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1	ZINC000598220003	357497434	/nfs/dbraw/zinc/49/74/34/357497434.db2.gz	NFWKKIKPUQUAJA-LLVKDONJSA-N	1	1	321.381	1.465	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)Nc1ccc([N+](=O)[O-])cc1	ZINC000599682010	358023093	/nfs/dbraw/zinc/02/30/93/358023093.db2.gz	UZRNMGLGOOXPKT-SGIREYDYSA-N	1	1	319.361	1.769	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC000600228808	358163250	/nfs/dbraw/zinc/16/32/50/358163250.db2.gz	FQVFCKDQQLXMGG-NSHDSACASA-N	1	1	307.354	1.455	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000600694605	358284869	/nfs/dbraw/zinc/28/48/69/358284869.db2.gz	JZBAJWASLKPXID-VIFPVBQESA-N	1	1	307.306	1.148	20	5		DDBDMO
Cc1cn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)nc1[N+](=O)[O-]	ZINC000601956009	358752339	/nfs/dbraw/zinc/75/23/39/358752339.db2.gz	CUHUQJRFIBYCII-INIZCTEOSA-N	1	1	316.361	1.737	20	5		DDBDMO
CCN(CC)C(=O)[C@@H]1CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602770037	359177873	/nfs/dbraw/zinc/17/78/73/359177873.db2.gz	SRYOTZMEKIPJKB-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])n1	ZINC000602837062	359228025	/nfs/dbraw/zinc/22/80/25/359228025.db2.gz	SSLCJSSRUCPKKP-BFHYXJOUSA-N	1	1	308.382	1.844	20	5		DDBDMO
CC[NH+]1CC[C@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796229	359197505	/nfs/dbraw/zinc/19/75/05/359197505.db2.gz	WOHWKNOSUCWOKD-JSGCOSHPSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[NH+]1CC[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796229	359197509	/nfs/dbraw/zinc/19/75/09/359197509.db2.gz	WOHWKNOSUCWOKD-JSGCOSHPSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796229	359197513	/nfs/dbraw/zinc/19/75/13/359197513.db2.gz	WOHWKNOSUCWOKD-JSGCOSHPSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796229	359197516	/nfs/dbraw/zinc/19/75/16/359197516.db2.gz	WOHWKNOSUCWOKD-JSGCOSHPSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@@H+]1CC[C@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796229	359197518	/nfs/dbraw/zinc/19/75/18/359197518.db2.gz	WOHWKNOSUCWOKD-JSGCOSHPSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602796229	359197522	/nfs/dbraw/zinc/19/75/22/359197522.db2.gz	WOHWKNOSUCWOKD-JSGCOSHPSA-N	1	1	309.414	1.762	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602820572	359215924	/nfs/dbraw/zinc/21/59/24/359215924.db2.gz	GTRVUIILGWYCTH-LBPRGKRZSA-N	1	1	323.397	1.013	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C)O[C@]2(CCCOC2)C1	ZINC000602831139	359223503	/nfs/dbraw/zinc/22/35/03/359223503.db2.gz	ZCKKLFJEWGBIME-SWLSCSKDSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](C)O[C@]2(CCCOC2)C1	ZINC000602831139	359223509	/nfs/dbraw/zinc/22/35/09/359223509.db2.gz	ZCKKLFJEWGBIME-SWLSCSKDSA-N	1	1	324.381	1.370	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000186776642	200008256	/nfs/dbraw/zinc/00/82/56/200008256.db2.gz	UTJPAYKJUOKOTB-UHFFFAOYSA-N	1	1	322.321	1.669	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000609279535	360285738	/nfs/dbraw/zinc/28/57/38/360285738.db2.gz	FIPKBVPJLJVMKN-CYBMUJFWSA-N	1	1	322.365	1.827	20	5		DDBDMO
Cc1cnc(N[C@@H]2CC[N@@H+](C3CCN(C)CC3)C2)c([N+](=O)[O-])c1	ZINC000610284013	360408511	/nfs/dbraw/zinc/40/85/11/360408511.db2.gz	YNDDSZDYEABKAX-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1cnc(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)c([N+](=O)[O-])c1	ZINC000610284013	360408512	/nfs/dbraw/zinc/40/85/12/360408512.db2.gz	YNDDSZDYEABKAX-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000610522707	360460864	/nfs/dbraw/zinc/46/08/64/360460864.db2.gz	RHCFFBOTYLBCPH-LLVKDONJSA-N	1	1	304.350	1.391	20	5		DDBDMO
O=C(C[N@@H+]1C[C@H]2CCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762618	360531051	/nfs/dbraw/zinc/53/10/51/360531051.db2.gz	GUAXHQIEJUSUCF-OCCSQVGLSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@H]2CCC[C@@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762618	360531057	/nfs/dbraw/zinc/53/10/57/360531057.db2.gz	GUAXHQIEJUSUCF-OCCSQVGLSA-N	1	1	301.346	1.968	20	5		DDBDMO
C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000610899188	360566217	/nfs/dbraw/zinc/56/62/17/360566217.db2.gz	DTBTYTVAZKCQIQ-GWCFXTLKSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000610899188	360566222	/nfs/dbraw/zinc/56/62/22/360566222.db2.gz	DTBTYTVAZKCQIQ-GWCFXTLKSA-N	1	1	308.338	1.435	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000611268421	360683789	/nfs/dbraw/zinc/68/37/89/360683789.db2.gz	LNIPCCMFWJOJDE-JKSUJKDBSA-N	1	1	321.377	1.331	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619574252	364067885	/nfs/dbraw/zinc/06/78/85/364067885.db2.gz	LKWHLJZCHSUKJP-GHMZBOCLSA-N	1	1	313.354	1.915	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)c1[N+](=O)[O-]	ZINC000619874033	364170199	/nfs/dbraw/zinc/17/01/99/364170199.db2.gz	WWHKUUKURIORCJ-ZDUSSCGKSA-N	1	1	318.377	1.023	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000275457183	212347347	/nfs/dbraw/zinc/34/73/47/212347347.db2.gz	HHUPTGOQJMQTIH-LBPRGKRZSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000275318033	212267540	/nfs/dbraw/zinc/26/75/40/212267540.db2.gz	DBEZBKQSBIIHDR-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000275318033	212267543	/nfs/dbraw/zinc/26/75/43/212267543.db2.gz	DBEZBKQSBIIHDR-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC(CC[NH3+])CC2)c1[N+](=O)[O-]	ZINC000566405767	304150736	/nfs/dbraw/zinc/15/07/36/304150736.db2.gz	DKMBXOYKMPWNJV-UHFFFAOYSA-N	1	1	309.370	1.471	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)CCO1	ZINC000282538873	217072645	/nfs/dbraw/zinc/07/26/45/217072645.db2.gz	VWWODLAKRZJBRA-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H](c2ccccc2)C1	ZINC000351486887	284337193	/nfs/dbraw/zinc/33/71/93/284337193.db2.gz	YJPGXAFELDWRIB-JSGCOSHPSA-N	1	1	314.345	1.751	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000266105827	205102429	/nfs/dbraw/zinc/10/24/29/205102429.db2.gz	GQLVYCFXFFJJFY-ZDUSSCGKSA-N	1	1	323.397	1.514	20	5		DDBDMO
C[C@@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000288343464	220095332	/nfs/dbraw/zinc/09/53/32/220095332.db2.gz	JXMCWJSRBAIJOQ-RISCZKNCSA-N	1	1	319.361	1.999	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000267514991	206117878	/nfs/dbraw/zinc/11/78/78/206117878.db2.gz	JZQMYRUNRYZSAO-LBPRGKRZSA-N	1	1	306.366	1.980	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000423964888	296226360	/nfs/dbraw/zinc/22/63/60/296226360.db2.gz	HHSXPPZZRVYPBP-HNNXBMFYSA-N	1	1	312.329	1.777	20	5		DDBDMO
Cc1ccc(CN2CC[N@H+](C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000284432067	218025112	/nfs/dbraw/zinc/02/51/12/218025112.db2.gz	SBADETLVKFJRMB-KBPBESRZSA-N	1	1	307.394	1.790	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000285352549	218393814	/nfs/dbraw/zinc/39/38/14/218393814.db2.gz	ACFUCHFWQHXUSX-CHWSQXEVSA-N	1	1	323.349	1.387	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000110997427	194379801	/nfs/dbraw/zinc/37/98/01/194379801.db2.gz	DROLEYLIEPHDLP-LBPRGKRZSA-N	1	1	306.366	1.902	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000340590703	251127407	/nfs/dbraw/zinc/12/74/07/251127407.db2.gz	GIXNUUIIVGICJX-ZDUSSCGKSA-N	1	1	314.345	1.927	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+](CCN2CCOCC2)C2CC2)c1	ZINC000269097511	207238178	/nfs/dbraw/zinc/23/81/78/207238178.db2.gz	PCOUZQNYJMDOKW-UHFFFAOYSA-N	1	1	305.378	1.891	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000341106287	251383319	/nfs/dbraw/zinc/38/33/19/251383319.db2.gz	WKAZQVMWPSDXQI-VXGBXAGGSA-N	1	1	306.366	1.321	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CC(N)=O)C(C)C	ZINC000063483184	184282948	/nfs/dbraw/zinc/28/29/48/184282948.db2.gz	ILCSLNAYCMLVCJ-UHFFFAOYSA-N	1	1	322.365	1.428	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000065761226	184379076	/nfs/dbraw/zinc/37/90/76/184379076.db2.gz	OZNOBUJGUHRTRN-XQQFMLRXSA-N	1	1	323.397	1.274	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000352436694	285049675	/nfs/dbraw/zinc/04/96/75/285049675.db2.gz	IVIPMDGUAWXOQP-UHFFFAOYSA-N	1	1	323.349	1.785	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CC(C)(C)CO)c([N+](=O)[O-])c1	ZINC000451251777	533014558	/nfs/dbraw/zinc/01/45/58/533014558.db2.gz	WFJJIYDBKWWKAD-UHFFFAOYSA-N	1	1	312.366	1.933	20	5		DDBDMO
Cn1ccc(N2CC[C@H]([NH2+]Cc3csc([N+](=O)[O-])c3)C2=O)n1	ZINC000360091406	299590882	/nfs/dbraw/zinc/59/08/82/299590882.db2.gz	CYCVJEIZYCGLCL-JTQLQIEISA-N	1	1	321.362	1.285	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nc(=O)[nH][nH]2)C1	ZINC000289482051	221006174	/nfs/dbraw/zinc/00/61/74/221006174.db2.gz	RVDLJZZBSPQZCO-PWSUYJOCSA-N	1	1	317.349	1.947	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@H](n3cc(Cl)cn3)C2)c1	ZINC000289910705	221310422	/nfs/dbraw/zinc/31/04/22/221310422.db2.gz	NZQNURMNBIGENK-NSHDSACASA-N	1	1	310.745	1.588	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)c1	ZINC000289910705	221310424	/nfs/dbraw/zinc/31/04/24/221310424.db2.gz	NZQNURMNBIGENK-NSHDSACASA-N	1	1	310.745	1.588	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305770782	533327796	/nfs/dbraw/zinc/32/77/96/533327796.db2.gz	XYLPSRHELDHNNT-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305770782	533327803	/nfs/dbraw/zinc/32/78/03/533327803.db2.gz	XYLPSRHELDHNNT-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299529276	533667179	/nfs/dbraw/zinc/66/71/79/533667179.db2.gz	LJMHPMTVSDYRGR-UWVGGRQHSA-N	1	1	309.370	1.477	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000068338285	406634630	/nfs/dbraw/zinc/63/46/30/406634630.db2.gz	VHQUPZQBELGFHM-SECBINFHSA-N	1	1	312.345	1.776	20	5		DDBDMO
CC(C)C[C@H]1COCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090549256	407169974	/nfs/dbraw/zinc/16/99/74/407169974.db2.gz	NQWBLBJJQMGUKX-AWEZNQCLSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC(C)C[C@H]1COCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090549256	407169976	/nfs/dbraw/zinc/16/99/76/407169976.db2.gz	NQWBLBJJQMGUKX-AWEZNQCLSA-N	1	1	309.366	1.503	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C	ZINC000094092972	407203482	/nfs/dbraw/zinc/20/34/82/407203482.db2.gz	QNIBGXHAXHSODY-UHFFFAOYSA-N	1	1	323.393	1.828	20	5		DDBDMO
COCCCNC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000067458502	407273665	/nfs/dbraw/zinc/27/36/65/407273665.db2.gz	UHXNEDNMPBVDQG-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
COCCCNC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000067458502	407273667	/nfs/dbraw/zinc/27/36/67/407273667.db2.gz	UHXNEDNMPBVDQG-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C(C)C	ZINC000171057118	407581225	/nfs/dbraw/zinc/58/12/25/407581225.db2.gz	LRUNNCWECWHQJY-UHFFFAOYSA-N	1	1	309.322	1.992	20	5		DDBDMO
CCn1nccc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000128906195	407581856	/nfs/dbraw/zinc/58/18/56/407581856.db2.gz	YCWFUIOBRDWHSB-LBPRGKRZSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1nccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000128906195	407581866	/nfs/dbraw/zinc/58/18/66/407581866.db2.gz	YCWFUIOBRDWHSB-LBPRGKRZSA-N	1	1	316.365	1.893	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CCOC1	ZINC000178756397	407586004	/nfs/dbraw/zinc/58/60/04/407586004.db2.gz	XZCLADODYOWOBH-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNCc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000218989491	407525545	/nfs/dbraw/zinc/52/55/45/407525545.db2.gz	RSLZBGNXMYPYJE-ZDUSSCGKSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CCN(C)[C@@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000218989491	407525552	/nfs/dbraw/zinc/52/55/52/407525552.db2.gz	RSLZBGNXMYPYJE-ZDUSSCGKSA-N	1	1	312.801	1.584	20	5		DDBDMO
CC[N@@H+](CCNC(=O)NCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000171157236	407614647	/nfs/dbraw/zinc/61/46/47/407614647.db2.gz	GANBQKAXVOHQBM-UHFFFAOYSA-N	1	1	306.366	1.878	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@@H]2CCC[N@@H+]2C)c(C)c1[N+](=O)[O-]	ZINC000171400807	407680853	/nfs/dbraw/zinc/68/08/53/407680853.db2.gz	HWXXAUTWDDQSKM-LBPRGKRZSA-N	1	1	309.370	1.009	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000152821544	407698894	/nfs/dbraw/zinc/69/88/94/407698894.db2.gz	XVMUNMUJUVJSFZ-LBPRGKRZSA-N	1	1	309.341	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1CC[N@@H+](C2CC2)C1	ZINC000354279708	298391543	/nfs/dbraw/zinc/39/15/43/298391543.db2.gz	CTRXGBHZSNVOCK-JTQLQIEISA-N	1	1	311.363	1.110	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000354279708	298391545	/nfs/dbraw/zinc/39/15/45/298391545.db2.gz	CTRXGBHZSNVOCK-JTQLQIEISA-N	1	1	311.363	1.110	20	5		DDBDMO
C[C@H](C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000272107413	407777649	/nfs/dbraw/zinc/77/76/49/407777649.db2.gz	MUDWPPDSMKLHGD-QWHCGFSZSA-N	1	1	320.393	1.408	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000133550519	407857634	/nfs/dbraw/zinc/85/76/34/407857634.db2.gz	YXRJVUHWJAOUHU-ZYHUDNBSSA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1cc(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000153623293	407864543	/nfs/dbraw/zinc/86/45/43/407864543.db2.gz	KZRKFLOZAOBYCW-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cc(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000153623293	407864549	/nfs/dbraw/zinc/86/45/49/407864549.db2.gz	KZRKFLOZAOBYCW-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[N@@H+](CCOCC1CC1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000268118590	407897903	/nfs/dbraw/zinc/89/79/03/407897903.db2.gz	NKVCYIWJGIUSIX-HNNXBMFYSA-N	1	1	324.377	1.693	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180572156	407900792	/nfs/dbraw/zinc/90/07/92/407900792.db2.gz	XUWGZLGPGZBXMH-UHFFFAOYSA-N	1	1	318.337	1.287	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](C2CCC2)CC1	ZINC000272405189	407904530	/nfs/dbraw/zinc/90/45/30/407904530.db2.gz	IJTGVNUTMDESHV-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000268248141	407967523	/nfs/dbraw/zinc/96/75/23/407967523.db2.gz	WKVDDGCYFPWOSJ-IAQYHMDHSA-N	1	1	303.362	1.736	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1CCc1ccc([N+](=O)[O-])cc1	ZINC000189431028	408014801	/nfs/dbraw/zinc/01/48/01/408014801.db2.gz	HBKFPJNVPUCTFB-CQSZACIVSA-N	1	1	321.421	1.914	20	5		DDBDMO
CC(=O)N1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000182168468	408084784	/nfs/dbraw/zinc/08/47/84/408084784.db2.gz	QTBFLMKBFIRMJT-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(=O)N1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000182168468	408084788	/nfs/dbraw/zinc/08/47/88/408084788.db2.gz	QTBFLMKBFIRMJT-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000189729015	408094135	/nfs/dbraw/zinc/09/41/35/408094135.db2.gz	XDLXHRCTTREPRC-CYBMUJFWSA-N	1	1	310.350	1.711	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000246250960	408192854	/nfs/dbraw/zinc/19/28/54/408192854.db2.gz	SXDVPVAYEIDZFY-GHMZBOCLSA-N	1	1	322.365	1.236	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000246726278	408324908	/nfs/dbraw/zinc/32/49/08/408324908.db2.gz	AHUMEXGWCLDOTE-BXKDBHETSA-N	1	1	324.356	1.775	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000156657749	408269139	/nfs/dbraw/zinc/26/91/39/408269139.db2.gz	XVVBGWZJJHHFBW-HNNXBMFYSA-N	1	1	305.378	1.938	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269432753	408307887	/nfs/dbraw/zinc/30/78/87/408307887.db2.gz	CIWNUFWVEGQKAL-ONGXEEELSA-N	1	1	321.381	1.654	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183197074	408348926	/nfs/dbraw/zinc/34/89/26/408348926.db2.gz	MVDYXJUNXOXCFN-VXGBXAGGSA-N	1	1	310.350	1.685	20	5		DDBDMO
CS[C@H]1CCCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000246849180	408353035	/nfs/dbraw/zinc/35/30/35/408353035.db2.gz	OZUOWPPISNWEDN-OLZOCXBDSA-N	1	1	314.411	1.370	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209100	408355524	/nfs/dbraw/zinc/35/55/24/408355524.db2.gz	IIRBZIFUPCGPBY-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209100	408355527	/nfs/dbraw/zinc/35/55/27/408355527.db2.gz	IIRBZIFUPCGPBY-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000176935082	408479533	/nfs/dbraw/zinc/47/95/33/408479533.db2.gz	WLBDONHHXDRCQM-ONGXEEELSA-N	1	1	309.370	1.339	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCN(c3ccccn3)CC2)c1	ZINC000183822879	408496329	/nfs/dbraw/zinc/49/63/29/408496329.db2.gz	TZTPTFSNRTYHRA-UHFFFAOYSA-N	1	1	316.365	1.399	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475401	408507678	/nfs/dbraw/zinc/50/76/78/408507678.db2.gz	YPJSBOZDQBIYQZ-WFASDCNBSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475401	408507679	/nfs/dbraw/zinc/50/76/79/408507679.db2.gz	YPJSBOZDQBIYQZ-WFASDCNBSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248475570	408577147	/nfs/dbraw/zinc/57/71/47/408577147.db2.gz	XUDAERMVVUVILN-FRRDWIJNSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1COC[C@H](C)[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248475570	408577151	/nfs/dbraw/zinc/57/71/51/408577151.db2.gz	XUDAERMVVUVILN-FRRDWIJNSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000265198927	408577823	/nfs/dbraw/zinc/57/78/23/408577823.db2.gz	JEBJVJMMWMFVBJ-UHFFFAOYSA-N	1	1	307.394	1.873	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000248525012	408580797	/nfs/dbraw/zinc/58/07/97/408580797.db2.gz	CMCIEMWMFLZBEV-GRYCIOLGSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000275543580	408596513	/nfs/dbraw/zinc/59/65/13/408596513.db2.gz	QSMHCDNDPOAZEW-CYBMUJFWSA-N	1	1	321.381	1.271	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)CCO1	ZINC000192782712	408646988	/nfs/dbraw/zinc/64/69/88/408646988.db2.gz	LIAJAQUQUVLQKS-LBPRGKRZSA-N	1	1	320.393	1.867	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000162614658	408718728	/nfs/dbraw/zinc/71/87/28/408718728.db2.gz	VQSOVEMHNMHAQT-NSHDSACASA-N	1	1	309.370	1.416	20	5		DDBDMO
CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000162614658	408718736	/nfs/dbraw/zinc/71/87/36/408718736.db2.gz	VQSOVEMHNMHAQT-NSHDSACASA-N	1	1	309.370	1.416	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000162614658	408718740	/nfs/dbraw/zinc/71/87/40/408718740.db2.gz	VQSOVEMHNMHAQT-NSHDSACASA-N	1	1	309.370	1.416	20	5		DDBDMO
COc1cc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000193631207	408734220	/nfs/dbraw/zinc/73/42/20/408734220.db2.gz	UUCCKLGTUCMREL-TXEJJXNPSA-N	1	1	309.341	1.736	20	5		DDBDMO
Cn1cc([C@H]2C[NH2+]CCN2C(=O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000181389863	162790041	/nfs/dbraw/zinc/79/00/41/162790041.db2.gz	RKKWXNARCDVBRN-CQSZACIVSA-N	1	1	315.333	1.115	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC000275818373	408686646	/nfs/dbraw/zinc/68/66/46/408686646.db2.gz	HAABJYCUUPBSPW-HAQNSBGRSA-N	1	1	307.350	1.769	20	5		DDBDMO
CCc1ccc([C@H](COC)[NH2+]CCn2ccc([N+](=O)[O-])n2)o1	ZINC000184794198	408690912	/nfs/dbraw/zinc/69/09/12/408690912.db2.gz	ITPBTXHVQGWQDD-LBPRGKRZSA-N	1	1	308.338	1.924	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000251842404	408786718	/nfs/dbraw/zinc/78/67/18/408786718.db2.gz	OCWBEPSFWGQKRI-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@](C)(O)C1	ZINC000177973288	408747437	/nfs/dbraw/zinc/74/74/37/408747437.db2.gz	XSHDEPCOTZIPCC-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000177980357	408750721	/nfs/dbraw/zinc/75/07/21/408750721.db2.gz	GQFVRRIOOBUKTL-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@]3(CCOC3)C2)cc1	ZINC000185170899	408773190	/nfs/dbraw/zinc/77/31/90/408773190.db2.gz	RNNXSXOCVFASRQ-OAHLLOKOSA-N	1	1	308.334	1.465	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@]3(CCOC3)C2)cc1	ZINC000185170899	408773192	/nfs/dbraw/zinc/77/31/92/408773192.db2.gz	RNNXSXOCVFASRQ-OAHLLOKOSA-N	1	1	308.334	1.465	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000250112837	408775775	/nfs/dbraw/zinc/77/57/75/408775775.db2.gz	MTEDCFXTRIGYGB-TZMCWYRMSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000250112837	408775780	/nfs/dbraw/zinc/77/57/80/408775780.db2.gz	MTEDCFXTRIGYGB-TZMCWYRMSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000285857042	408877636	/nfs/dbraw/zinc/87/76/36/408877636.db2.gz	IJSILTPKOHRNOT-XJKSGUPXSA-N	1	1	305.378	1.890	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000276309839	408832845	/nfs/dbraw/zinc/83/28/45/408832845.db2.gz	OFYNUDMOKQMMHB-KGLIPLIRSA-N	1	1	304.350	1.534	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285912851	408887801	/nfs/dbraw/zinc/88/78/01/408887801.db2.gz	ZECFFXYIXNLSNO-NSHDSACASA-N	1	1	309.370	1.416	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000285924739	408889526	/nfs/dbraw/zinc/88/95/26/408889526.db2.gz	UPXWZPNTQUWKED-KBPBESRZSA-N	1	1	323.324	1.279	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CCC[N@@H+](C)C1	ZINC000277362752	408926294	/nfs/dbraw/zinc/92/62/94/408926294.db2.gz	CJCZBOOHZVEHTQ-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1C[C@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000193626939	163261664	/nfs/dbraw/zinc/26/16/64/163261664.db2.gz	OIIVTAICBQWVBE-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000193626939	163261667	/nfs/dbraw/zinc/26/16/67/163261667.db2.gz	OIIVTAICBQWVBE-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000194712306	163293873	/nfs/dbraw/zinc/29/38/73/163293873.db2.gz	PJYZLSJTGKKXSW-LBPRGKRZSA-N	1	1	306.366	1.607	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000277550127	408963270	/nfs/dbraw/zinc/96/32/70/408963270.db2.gz	IUPAXSBNKIGCAB-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCC(N)=O	ZINC000286439179	408985636	/nfs/dbraw/zinc/98/56/36/408985636.db2.gz	LQPVVIXMQYEURG-VIFPVBQESA-N	1	1	319.321	1.513	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCC(N)=O	ZINC000286439179	408985639	/nfs/dbraw/zinc/98/56/39/408985639.db2.gz	LQPVVIXMQYEURG-VIFPVBQESA-N	1	1	319.321	1.513	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000293315081	409087397	/nfs/dbraw/zinc/08/73/97/409087397.db2.gz	FQJOTUBRKVGDKM-XQQFMLRXSA-N	1	1	320.393	1.946	20	5		DDBDMO
C[C@H]1[C@@H](O)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106472	409324405	/nfs/dbraw/zinc/32/44/05/409324405.db2.gz	VODZDWMWYRMMNU-HZMBPMFUSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@H]1[C@@H](O)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106472	409324414	/nfs/dbraw/zinc/32/44/14/409324414.db2.gz	VODZDWMWYRMMNU-HZMBPMFUSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000295154636	409348671	/nfs/dbraw/zinc/34/86/71/409348671.db2.gz	DBCHNWJTOAYGBP-CQSZACIVSA-N	1	1	311.313	1.134	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+](CCCO)C1	ZINC000296075452	409421106	/nfs/dbraw/zinc/42/11/06/409421106.db2.gz	CYMPETPSDHLOHQ-CYBMUJFWSA-N	1	1	322.365	1.563	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1cccc([N+](=O)[O-])c1	ZINC000295389570	409462599	/nfs/dbraw/zinc/46/25/99/409462599.db2.gz	HMWSHXVDZWYLHV-ZDUSSCGKSA-N	1	1	307.350	1.171	20	5		DDBDMO
C[C@H]1C[N@@H+]2CCCC[C@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056018	164211604	/nfs/dbraw/zinc/21/16/04/164211604.db2.gz	ZXDBQFPOGNWTQW-QWRGUYRKSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056018	164211606	/nfs/dbraw/zinc/21/16/06/164211606.db2.gz	ZXDBQFPOGNWTQW-QWRGUYRKSA-N	1	1	307.354	1.027	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000290690850	409488895	/nfs/dbraw/zinc/48/88/95/409488895.db2.gz	UZRNJANFBAZVFL-GFCCVEGCSA-N	1	1	311.386	1.418	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)n1	ZINC000285594903	409502734	/nfs/dbraw/zinc/50/27/34/409502734.db2.gz	PGTGLWLFVMFPPE-LLVKDONJSA-N	1	1	322.287	1.571	20	5		DDBDMO
CNC(=O)N[C@@H]1CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000344919661	409553473	/nfs/dbraw/zinc/55/34/73/409553473.db2.gz	CXBYFKRAGPWNFT-RYWCDNDXSA-N	1	1	304.350	1.611	20	5		DDBDMO
CNC(=O)N[C@@H]1CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000344919661	409553478	/nfs/dbraw/zinc/55/34/78/409553478.db2.gz	CXBYFKRAGPWNFT-RYWCDNDXSA-N	1	1	304.350	1.611	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])nc2C)C1	ZINC000338073916	409696102	/nfs/dbraw/zinc/69/61/02/409696102.db2.gz	RELNXQSOCGSKHP-ZDUSSCGKSA-N	1	1	323.397	1.338	20	5		DDBDMO
CCOCC[N@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)C[C@@H]1CC	ZINC000297054974	409780587	/nfs/dbraw/zinc/78/05/87/409780587.db2.gz	IQCSLXYDYAOSLT-ZDUSSCGKSA-N	1	1	323.397	1.630	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCOC[C@@H]2[C@@H]2CCC[C@H]2O)cc1	ZINC000332024445	409811034	/nfs/dbraw/zinc/81/10/34/409811034.db2.gz	ZYTCQYXWZHDMCZ-ARFHVFGLSA-N	1	1	306.362	1.957	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCC[C@H]2O)cc1	ZINC000332024445	409811037	/nfs/dbraw/zinc/81/10/37/409811037.db2.gz	ZYTCQYXWZHDMCZ-ARFHVFGLSA-N	1	1	306.362	1.957	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000297126082	409817423	/nfs/dbraw/zinc/81/74/23/409817423.db2.gz	MUYPSMWXMWJPKZ-UHFFFAOYSA-N	1	1	307.354	1.851	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357425035	410033621	/nfs/dbraw/zinc/03/36/21/410033621.db2.gz	RNABGSZGIMXGOO-OLZOCXBDSA-N	1	1	321.377	1.963	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239812	410006719	/nfs/dbraw/zinc/00/67/19/410006719.db2.gz	IOIPQZRZMLZKKB-UWVGGRQHSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000332239812	410006725	/nfs/dbraw/zinc/00/67/25/410006725.db2.gz	IOIPQZRZMLZKKB-UWVGGRQHSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239812	410006728	/nfs/dbraw/zinc/00/67/28/410006728.db2.gz	IOIPQZRZMLZKKB-UWVGGRQHSA-N	1	1	317.349	1.684	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000354859299	410134044	/nfs/dbraw/zinc/13/40/44/410134044.db2.gz	OPGIGVBZXVYBJY-OAHLLOKOSA-N	1	1	308.334	1.267	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000354859299	410134050	/nfs/dbraw/zinc/13/40/50/410134050.db2.gz	OPGIGVBZXVYBJY-OAHLLOKOSA-N	1	1	308.334	1.267	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)NCC[N@@H+]1CC=CCC1	ZINC000357621986	410144026	/nfs/dbraw/zinc/14/40/26/410144026.db2.gz	POCSZOWYGWNORM-UHFFFAOYSA-N	1	1	307.325	1.655	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC[C@@H]2CCCC[N@H+]2C)c1	ZINC000298505825	410263447	/nfs/dbraw/zinc/26/34/47/410263447.db2.gz	KSAFKPCFOSDHRG-LBPRGKRZSA-N	1	1	323.349	1.418	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(OCCO)CC3)nc2c1	ZINC000339777861	410451663	/nfs/dbraw/zinc/45/16/63/410451663.db2.gz	CMQQVNBFXVXTIS-UHFFFAOYSA-N	1	1	321.333	1.709	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358408007	410460819	/nfs/dbraw/zinc/46/08/19/410460819.db2.gz	GOLHVTBXCIUCER-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000299082761	410515021	/nfs/dbraw/zinc/51/50/21/410515021.db2.gz	SJGDPFMKMXLCLH-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000352186865	410534767	/nfs/dbraw/zinc/53/47/67/410534767.db2.gz	OJQDLPLIFVPMMG-KGLIPLIRSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+]2CCC)c1[N+](=O)[O-]	ZINC000343631477	410581954	/nfs/dbraw/zinc/58/19/54/410581954.db2.gz	QSWQWNMAIKWAQM-NSHDSACASA-N	1	1	323.397	1.875	20	5		DDBDMO
CN(C)c1cc[nH+]c(NCCNc2ccccc2[N+](=O)[O-])n1	ZINC000301697261	410774493	/nfs/dbraw/zinc/77/44/93/410774493.db2.gz	QKVPKZSIAMCYGE-UHFFFAOYSA-N	1	1	302.338	1.975	20	5		DDBDMO
COc1cc(N[C@H](C)[C@H]2C[N@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935491	410832847	/nfs/dbraw/zinc/83/28/47/410832847.db2.gz	RLDRMVVBQWTPIS-YMTOWFKASA-N	1	1	313.329	1.874	20	5		DDBDMO
COc1cc(N[C@H](C)[C@H]2C[N@@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935491	410832851	/nfs/dbraw/zinc/83/28/51/410832851.db2.gz	RLDRMVVBQWTPIS-YMTOWFKASA-N	1	1	313.329	1.874	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000302709285	410849445	/nfs/dbraw/zinc/84/94/45/410849445.db2.gz	DDRCDJFGXZZMDV-VXGBXAGGSA-N	1	1	316.365	1.558	20	5		DDBDMO
C[C@H]1[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080046	410934602	/nfs/dbraw/zinc/93/46/02/410934602.db2.gz	XGQMVQPEAGSVAE-OCCSQVGLSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCOC1(C)C	ZINC000331080046	410934606	/nfs/dbraw/zinc/93/46/06/410934606.db2.gz	XGQMVQPEAGSVAE-OCCSQVGLSA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344070165	410936048	/nfs/dbraw/zinc/93/60/48/410936048.db2.gz	QCESWHXJBJBEJF-OBJOEFQTSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344070165	410936054	/nfs/dbraw/zinc/93/60/54/410936054.db2.gz	QCESWHXJBJBEJF-OBJOEFQTSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000348484800	410983503	/nfs/dbraw/zinc/98/35/03/410983503.db2.gz	NCCSWJLPUDIGFA-UHFFFAOYSA-N	1	1	319.340	1.790	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000353765113	411125156	/nfs/dbraw/zinc/12/51/56/411125156.db2.gz	GIJMQPCQSQUTCD-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@H]1CC[N@H+](C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000353765113	411125157	/nfs/dbraw/zinc/12/51/57/411125157.db2.gz	GIJMQPCQSQUTCD-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000353765113	411125158	/nfs/dbraw/zinc/12/51/58/411125158.db2.gz	GIJMQPCQSQUTCD-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000600314884	416618200	/nfs/dbraw/zinc/61/82/00/416618200.db2.gz	QHCJHOWBDQSUPR-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
C[C@@H]1C[C@]2(CCO1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H](C)O2	ZINC000374018912	418483912	/nfs/dbraw/zinc/48/39/12/418483912.db2.gz	QCDWTCAAEFIBHI-VNHYZAJKSA-N	1	1	324.381	1.450	20	5		DDBDMO
C[C@@H]1C[C@]2(CCO1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H](C)O2	ZINC000374018912	418483916	/nfs/dbraw/zinc/48/39/16/418483916.db2.gz	QCDWTCAAEFIBHI-VNHYZAJKSA-N	1	1	324.381	1.450	20	5		DDBDMO
O=C(N[C@@H]1CC12CC[NH2+]CC2)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000366556504	418490108	/nfs/dbraw/zinc/49/01/08/418490108.db2.gz	PODIHHXYWOPHCI-GFCCVEGCSA-N	1	1	315.333	1.343	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@@H]1CO	ZINC000194361042	418543291	/nfs/dbraw/zinc/54/32/91/418543291.db2.gz	BZMPORYJMHIJSV-OLZOCXBDSA-N	1	1	310.350	1.181	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000375053879	418596028	/nfs/dbraw/zinc/59/60/28/418596028.db2.gz	IJANSJJBAVLURK-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1c1nc(Cc2ccc([N+](=O)[O-])cn2)no1	ZINC000361262702	418614641	/nfs/dbraw/zinc/61/46/41/418614641.db2.gz	OOIHAIMKVUPMRK-JOYOIKCWSA-N	1	1	303.322	1.629	20	5		DDBDMO
O=C1[C@H]([N@@H+]2C[C@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316760	418627538	/nfs/dbraw/zinc/62/75/38/418627538.db2.gz	ZHMWGBYYEFISPT-KGLIPLIRSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C1[C@H]([N@H+]2C[C@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316760	418627541	/nfs/dbraw/zinc/62/75/41/418627541.db2.gz	ZHMWGBYYEFISPT-KGLIPLIRSA-N	1	1	317.345	1.157	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000367811328	418637521	/nfs/dbraw/zinc/63/75/21/418637521.db2.gz	CYHWRNKCNWUEDY-TXEJJXNPSA-N	1	1	319.361	1.688	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](CC(N)=O)C2)c([N+](=O)[O-])c1	ZINC000367982415	418668066	/nfs/dbraw/zinc/66/80/66/418668066.db2.gz	JEHRQCUPTWCVQO-LLVKDONJSA-N	1	1	323.349	1.180	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)C[C@@H]21	ZINC000408465702	418804081	/nfs/dbraw/zinc/80/40/81/418804081.db2.gz	KQRUTQQRNIPUHA-YGRLFVJLSA-N	1	1	314.345	1.852	20	5		DDBDMO
CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000372839449	418907202	/nfs/dbraw/zinc/90/72/02/418907202.db2.gz	OOYWVLVNBPGOQL-HUUCEWRRSA-N	1	1	318.377	1.422	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]2CC[NH2+][C@H]2C1	ZINC000372871597	418910830	/nfs/dbraw/zinc/91/08/30/418910830.db2.gz	QSCUGXZZQZQJPX-RNCFNFMXSA-N	1	1	315.333	1.295	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@H]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000426220770	419412706	/nfs/dbraw/zinc/41/27/06/419412706.db2.gz	SZQQOKRWRSKUSJ-ZDUSSCGKSA-N	1	1	307.350	1.404	20	5		DDBDMO
O=C(CC[N@@H+]1CCOCC12CC2)Nc1ccc([N+](=O)[O-])cc1	ZINC000411697075	419383614	/nfs/dbraw/zinc/38/36/14/419383614.db2.gz	RBQCPZQNLVWIKY-UHFFFAOYSA-N	1	1	305.334	1.788	20	5		DDBDMO
O=C(CC[N@H+]1CCOCC12CC2)Nc1ccc([N+](=O)[O-])cc1	ZINC000411697075	419383617	/nfs/dbraw/zinc/38/36/17/419383617.db2.gz	RBQCPZQNLVWIKY-UHFFFAOYSA-N	1	1	305.334	1.788	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000426884616	419565730	/nfs/dbraw/zinc/56/57/30/419565730.db2.gz	YWVACVDUXKFUDI-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000412079917	419634480	/nfs/dbraw/zinc/63/44/80/419634480.db2.gz	LKJRHFUZRYJXID-ZWNOBZJWSA-N	1	1	307.350	1.287	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)[nH]1	ZINC000412023010	419570806	/nfs/dbraw/zinc/57/08/06/419570806.db2.gz	BMFQKNTXCICOJY-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000412023010	419570809	/nfs/dbraw/zinc/57/08/09/419570809.db2.gz	BMFQKNTXCICOJY-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000412023010	419570815	/nfs/dbraw/zinc/57/08/15/419570815.db2.gz	BMFQKNTXCICOJY-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000412023010	419570822	/nfs/dbraw/zinc/57/08/22/419570822.db2.gz	BMFQKNTXCICOJY-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000412023010	419570826	/nfs/dbraw/zinc/57/08/26/419570826.db2.gz	BMFQKNTXCICOJY-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](CO)[C@H]1C	ZINC000412072591	419625556	/nfs/dbraw/zinc/62/55/56/419625556.db2.gz	HJLUJOKWROZUNS-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](CO)[C@H]1C	ZINC000412072591	419625562	/nfs/dbraw/zinc/62/55/62/419625562.db2.gz	HJLUJOKWROZUNS-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](C(C)C)C2)n1	ZINC000427493199	419673261	/nfs/dbraw/zinc/67/32/61/419673261.db2.gz	RRDPVDWHKWOOFL-NSHDSACASA-N	1	1	309.370	1.223	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)n1	ZINC000427493199	419673268	/nfs/dbraw/zinc/67/32/68/419673268.db2.gz	RRDPVDWHKWOOFL-NSHDSACASA-N	1	1	309.370	1.223	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1	ZINC000421706658	419692365	/nfs/dbraw/zinc/69/23/65/419692365.db2.gz	VKMUPIMSJYAIFF-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H](CCc1ccccc1[N+](=O)[O-])NC[C@H]1C[NH2+]CCCO1	ZINC000415030491	419917529	/nfs/dbraw/zinc/91/75/29/419917529.db2.gz	CMKSRSCDGLUONV-DZGCQCFKSA-N	1	1	307.394	1.884	20	5		DDBDMO
[NH3+]CC1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000430624754	420163176	/nfs/dbraw/zinc/16/31/76/420163176.db2.gz	PKHPYPSHIMXOSE-OAHLLOKOSA-N	1	1	318.377	1.371	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CCCC[N@@H+]1CCO	ZINC000450619985	420499569	/nfs/dbraw/zinc/49/95/69/420499569.db2.gz	UVUQPTZGNXVGQS-NSHDSACASA-N	1	1	314.773	1.902	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@H+]1CCCO	ZINC000452784242	420661617	/nfs/dbraw/zinc/66/16/17/420661617.db2.gz	OETKDMTYJDSHDZ-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
CN(C(=O)CN1CCC[C@@H](CC[NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000443070151	420741713	/nfs/dbraw/zinc/74/17/13/420741713.db2.gz	KTAUACHHIHUOJL-ZDUSSCGKSA-N	1	1	320.393	1.618	20	5		DDBDMO
COCC[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cncs1	ZINC000447841051	420807200	/nfs/dbraw/zinc/80/72/00/420807200.db2.gz	WAQHHDRDIYSECD-UHFFFAOYSA-N	1	1	311.367	1.396	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cncs1	ZINC000447841051	420807204	/nfs/dbraw/zinc/80/72/04/420807204.db2.gz	WAQHHDRDIYSECD-UHFFFAOYSA-N	1	1	311.367	1.396	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@H](O)[C@@H](CO)C2)o1	ZINC000459712813	420855288	/nfs/dbraw/zinc/85/52/88/420855288.db2.gz	RTXHBDLSVLIVMA-ABAIWWIYSA-N	1	1	318.329	1.640	20	5		DDBDMO
CNc1nc(C(=O)N2CC[NH+](CC3CC3)CC2)ccc1[N+](=O)[O-]	ZINC000454871745	420935774	/nfs/dbraw/zinc/93/57/74/420935774.db2.gz	OMFMRHNBLUYRNZ-UHFFFAOYSA-N	1	1	319.365	1.199	20	5		DDBDMO
Cc1ccc(CNC[C@@H]2CCC[N@@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449387359	421002570	/nfs/dbraw/zinc/00/25/70/421002570.db2.gz	LDVDOKAWWRTBAU-HNNXBMFYSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1ccc(CNC[C@@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449387359	421002574	/nfs/dbraw/zinc/00/25/74/421002574.db2.gz	LDVDOKAWWRTBAU-HNNXBMFYSA-N	1	1	307.394	1.840	20	5		DDBDMO
COC(=O)[C@@H](C1CC1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000488722513	421107831	/nfs/dbraw/zinc/10/78/31/421107831.db2.gz	OQVRURUYZDJYPC-CYBMUJFWSA-N	1	1	308.338	1.380	20	5		DDBDMO
Cn1c(C(=O)NCc2c[nH+]c3n2CCCC3)ccc1[N+](=O)[O-]	ZINC000560156002	421237737	/nfs/dbraw/zinc/23/77/37/421237737.db2.gz	SDUNYJYKEQNJMJ-UHFFFAOYSA-N	1	1	303.322	1.396	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000546104471	421284543	/nfs/dbraw/zinc/28/45/43/421284543.db2.gz	KHFGXGRUUMSMHX-UKRRQHHQSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000562351221	421355030	/nfs/dbraw/zinc/35/50/30/421355030.db2.gz	SBNFYAHJSSFMEV-INIZCTEOSA-N	1	1	318.377	1.832	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000543141264	421834133	/nfs/dbraw/zinc/83/41/33/421834133.db2.gz	USEHCVPIPDLEBB-IHRRRGAJSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000594282473	422345000	/nfs/dbraw/zinc/34/50/00/422345000.db2.gz	QGZDBNIXYIOQPE-PHIMTYICSA-N	1	1	321.381	1.565	20	5		DDBDMO
Nc1ccc(NC[C@H]2CC[N@H+]2Cc2ccccc2)nc1[N+](=O)[O-]	ZINC000596559443	422379973	/nfs/dbraw/zinc/37/99/73/422379973.db2.gz	YPNIWIAOKYUXQH-CYBMUJFWSA-N	1	1	313.361	2.258	20	5		DDBDMO
C[C@@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@H]1C[N@H+](C)CCO1	ZINC000590694557	422322212	/nfs/dbraw/zinc/32/22/12/422322212.db2.gz	PHMSXOGQHWNILY-IAQYHMDHSA-N	1	1	316.361	2.274	20	5		DDBDMO
C[C@@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@H]1C[N@@H+](C)CCO1	ZINC000590694557	422322220	/nfs/dbraw/zinc/32/22/20/422322220.db2.gz	PHMSXOGQHWNILY-IAQYHMDHSA-N	1	1	316.361	2.274	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@]1(O)CC[N@@H+](C)C1	ZINC000344869419	272132611	/nfs/dbraw/zinc/13/26/11/272132611.db2.gz	RSIKXSZJQXYRFY-LPDYGMJQSA-N	1	1	305.378	1.654	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@]1(O)CC[N@H+](C)C1	ZINC000344869419	272132613	/nfs/dbraw/zinc/13/26/13/272132613.db2.gz	RSIKXSZJQXYRFY-LPDYGMJQSA-N	1	1	305.378	1.654	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000345923100	272365762	/nfs/dbraw/zinc/36/57/62/272365762.db2.gz	QJPUVYDDXVDPQP-BETUJISGSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3nccc(C(N)=O)c3[N+](=O)[O-])CC[C@H]21	ZINC000290497368	277085112	/nfs/dbraw/zinc/08/51/12/277085112.db2.gz	ALVTTYSONHAHAQ-CMPLNLGQSA-N	1	1	319.365	1.009	20	5		DDBDMO
C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000289813695	279118345	/nfs/dbraw/zinc/11/83/45/279118345.db2.gz	NPUXYNTYOUQVMO-UKRRQHHQSA-N	1	1	305.378	1.890	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH+]2CCN(C3CC3)CC2)c1	ZINC000125908896	281220157	/nfs/dbraw/zinc/22/01/57/281220157.db2.gz	TZTXPNJNHDTIHG-OAHLLOKOSA-N	1	1	321.377	1.115	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c([N+](=O)[O-])c1	ZINC000362454460	300067553	/nfs/dbraw/zinc/06/75/53/300067553.db2.gz	QNQJGKAMIONJMU-KBPBESRZSA-N	1	1	319.361	1.695	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000362985818	300194297	/nfs/dbraw/zinc/19/42/97/300194297.db2.gz	JVZOOQBEOJIVBQ-HZPDHXFCSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)cccc1[N+](=O)[O-]	ZINC000363689699	300296324	/nfs/dbraw/zinc/29/63/24/300296324.db2.gz	GWNPRVCFQTYLCF-QWHCGFSZSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCOCC3(CCCC3)C2)c1	ZINC000364322098	300375894	/nfs/dbraw/zinc/37/58/94/300375894.db2.gz	DOKOMUQWSWULDN-CQSZACIVSA-N	1	1	324.381	1.045	20	5		DDBDMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367994915	300928983	/nfs/dbraw/zinc/92/89/83/300928983.db2.gz	WIEVRNKJAWKNHR-SNVBAGLBSA-N	1	1	303.240	1.413	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000370163938	301286671	/nfs/dbraw/zinc/28/66/71/301286671.db2.gz	UURHDVPYWKHEFK-OEAJRASXSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000370163938	301286672	/nfs/dbraw/zinc/28/66/72/301286672.db2.gz	UURHDVPYWKHEFK-OEAJRASXSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000370163938	301286673	/nfs/dbraw/zinc/28/66/73/301286673.db2.gz	UURHDVPYWKHEFK-OEAJRASXSA-N	1	1	317.389	1.678	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000375994947	302021187	/nfs/dbraw/zinc/02/11/87/302021187.db2.gz	OJLALPCUDGNNMF-BZPMIXESSA-N	1	1	308.382	1.844	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079657	302140496	/nfs/dbraw/zinc/14/04/96/302140496.db2.gz	CVGROMQSKOONJR-NMFUWQPSSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000377079657	302140498	/nfs/dbraw/zinc/14/04/98/302140498.db2.gz	CVGROMQSKOONJR-NMFUWQPSSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079657	302140499	/nfs/dbraw/zinc/14/04/99/302140499.db2.gz	CVGROMQSKOONJR-NMFUWQPSSA-N	1	1	303.362	1.431	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1F	ZINC000377510191	302187496	/nfs/dbraw/zinc/18/74/96/302187496.db2.gz	FKHBQBSVJBESCW-RYUDHWBXSA-N	1	1	323.324	1.327	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000533226805	303313925	/nfs/dbraw/zinc/31/39/25/303313925.db2.gz	MECGHNAZOORVMU-NSHDSACASA-N	1	1	321.381	1.752	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)CC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000357632575	306900749	/nfs/dbraw/zinc/90/07/49/306900749.db2.gz	ZJJDVPNJKIEUGK-LBPRGKRZSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073897	307012832	/nfs/dbraw/zinc/01/28/32/307012832.db2.gz	AHQVSVJMRYQPRD-IJLUTSLNSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073897	307012833	/nfs/dbraw/zinc/01/28/33/307012833.db2.gz	AHQVSVJMRYQPRD-IJLUTSLNSA-N	1	1	307.350	1.482	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000363939919	307038263	/nfs/dbraw/zinc/03/82/63/307038263.db2.gz	VKHWGRNMCGBCGF-CHWSQXEVSA-N	1	1	319.361	1.960	20	5		DDBDMO
CC1(C)CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)CC[NH2+]1	ZINC000573459846	308241972	/nfs/dbraw/zinc/24/19/72/308241972.db2.gz	PGQYLOUUYNXBIH-UHFFFAOYSA-N	1	1	305.381	1.029	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](n3cncn3)C2)c1	ZINC000372370476	483932471	/nfs/dbraw/zinc/93/24/71/483932471.db2.gz	UBSAKUIZRVSRHK-KBPBESRZSA-N	1	1	303.322	1.167	20	5		DDBDMO
Cc1nc(NCCCN2CCC[N@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000610754767	483936546	/nfs/dbraw/zinc/93/65/46/483936546.db2.gz	GUZLDHXIWKUECD-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000610754767	483936555	/nfs/dbraw/zinc/93/65/55/483936555.db2.gz	GUZLDHXIWKUECD-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1nc(NCCC[N@@H+]2CCCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000610754767	483936561	/nfs/dbraw/zinc/93/65/61/483936561.db2.gz	GUZLDHXIWKUECD-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H](n2cc(CO)nn2)C1	ZINC000292981388	534887121	/nfs/dbraw/zinc/88/71/21/534887121.db2.gz	NCNYCICJNOKYNC-CQSZACIVSA-N	1	1	317.349	1.516	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H](n2cc(CO)nn2)C1	ZINC000292981388	534887122	/nfs/dbraw/zinc/88/71/22/534887122.db2.gz	NCNYCICJNOKYNC-CQSZACIVSA-N	1	1	317.349	1.516	20	5		DDBDMO
CC[N@@H+](CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])C(C)C	ZINC000821213796	606706445	/nfs/dbraw/zinc/70/64/45/606706445.db2.gz	DXIWRGPZGIZEEB-UHFFFAOYSA-N	1	1	320.357	1.312	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000112401299	696650512	/nfs/dbraw/zinc/65/05/12/696650512.db2.gz	UOYVKRUXPUOUPF-UHFFFAOYSA-N	1	1	308.382	1.947	20	5		DDBDMO
CCOC(C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)OCC	ZINC000124994433	696748352	/nfs/dbraw/zinc/74/83/52/696748352.db2.gz	VAUTUHLBYRFDBB-GFCCVEGCSA-N	1	1	324.381	1.875	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC3(CC[NH+](C)CC3)C2)c1[N+](=O)[O-]	ZINC000799029182	700110942	/nfs/dbraw/zinc/11/09/42/700110942.db2.gz	UMAQNSPUYNKVHA-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCCF)C2	ZINC000982278677	697082005	/nfs/dbraw/zinc/08/20/05/697082005.db2.gz	OAQCNKUBUYFGKM-GBOPCIDUSA-N	1	1	313.373	1.182	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CCCF)C2	ZINC000982278677	697082007	/nfs/dbraw/zinc/08/20/07/697082007.db2.gz	OAQCNKUBUYFGKM-GBOPCIDUSA-N	1	1	313.373	1.182	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CCCF)C2	ZINC000982278677	697082009	/nfs/dbraw/zinc/08/20/09/697082009.db2.gz	OAQCNKUBUYFGKM-GBOPCIDUSA-N	1	1	313.373	1.182	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@H]2CCOC2)c2ncc([N+](=O)[O-])cc12	ZINC000749964589	700195448	/nfs/dbraw/zinc/19/54/48/700195448.db2.gz	QJWJZPYRTNKTPX-LLVKDONJSA-N	1	1	305.338	1.574	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776580555	698120520	/nfs/dbraw/zinc/12/05/20/698120520.db2.gz	WJWWKQOYHIPELB-BBRMVZONSA-N	1	1	321.377	1.476	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000781663013	698637468	/nfs/dbraw/zinc/63/74/68/698637468.db2.gz	NBJAXIPWVMXSQS-UHFFFAOYSA-N	1	1	319.321	1.714	20	5		DDBDMO
COc1cc(C[NH2+]C[C@@H](OC)C(F)(F)F)c([N+](=O)[O-])cc1O	ZINC000733330428	699588951	/nfs/dbraw/zinc/58/89/51/699588951.db2.gz	ZDQDPNOOQRATDP-LLVKDONJSA-N	1	1	324.255	1.976	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c1C	ZINC000790679152	699591510	/nfs/dbraw/zinc/59/15/10/699591510.db2.gz	SWGWABALMOPUOZ-SNVBAGLBSA-N	1	1	307.350	1.688	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c1C	ZINC000790679152	699591512	/nfs/dbraw/zinc/59/15/12/699591512.db2.gz	SWGWABALMOPUOZ-SNVBAGLBSA-N	1	1	307.350	1.688	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@H+]1CC[N+](=O)[O-])Nc1ccccc1	ZINC000791051419	699608897	/nfs/dbraw/zinc/60/88/97/699608897.db2.gz	CSAIUJINIXBWAP-CQSZACIVSA-N	1	1	306.366	1.939	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CC[N+](=O)[O-])Nc1ccccc1	ZINC000791051419	699608898	/nfs/dbraw/zinc/60/88/98/699608898.db2.gz	CSAIUJINIXBWAP-CQSZACIVSA-N	1	1	306.366	1.939	20	5		DDBDMO
C[N@H+](C[C@@H]1CCCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794626965	699819960	/nfs/dbraw/zinc/81/99/60/699819960.db2.gz	YKIJUZRTWAGJFZ-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794626965	699819963	/nfs/dbraw/zinc/81/99/63/699819963.db2.gz	YKIJUZRTWAGJFZ-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
O=C(OCC[NH+]1CCSCC1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000757925423	700676405	/nfs/dbraw/zinc/67/64/05/700676405.db2.gz	KQTPKMWPQCNRSW-UHFFFAOYSA-N	1	1	314.338	1.940	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])C[C@@]1(C)C(=O)NC2=O	ZINC000879157384	706602032	/nfs/dbraw/zinc/60/20/32/706602032.db2.gz	IHSLXICEFONDCQ-GASCZTMLSA-N	1	1	321.308	1.219	20	5		DDBDMO
CN(C[C@H]1CCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867945228	701846883	/nfs/dbraw/zinc/84/68/83/701846883.db2.gz	BANUTZZDIYCQNI-IAQYHMDHSA-N	1	1	307.350	1.264	20	5		DDBDMO
CC(C)(C(=O)O[C@H]1CC[N@H+]2CCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000810839516	701859300	/nfs/dbraw/zinc/85/93/00/701859300.db2.gz	BSOLGBGUNNNJDT-YPMHNXCESA-N	1	1	322.365	1.696	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000840092780	701965043	/nfs/dbraw/zinc/96/50/43/701965043.db2.gz	XVAMOJCBFBQMRG-LLVKDONJSA-N	1	1	320.349	1.486	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)OCC[C@H]1CCCC[N@@H+]1C	ZINC000840223449	702034278	/nfs/dbraw/zinc/03/42/78/702034278.db2.gz	JAIFDTPQFAWCRJ-GFCCVEGCSA-N	1	1	310.354	1.517	20	5		DDBDMO
CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000840333430	702073222	/nfs/dbraw/zinc/07/32/22/702073222.db2.gz	BHIKTZWTEMYOQY-HUUCEWRRSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC(C)[N@H+](C)Cc1cccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC000840333430	702073230	/nfs/dbraw/zinc/07/32/30/702073230.db2.gz	BHIKTZWTEMYOQY-HUUCEWRRSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC(C)[N@@H+](C)Cc1cccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC000840333430	702073239	/nfs/dbraw/zinc/07/32/39/702073239.db2.gz	BHIKTZWTEMYOQY-HUUCEWRRSA-N	1	1	305.378	1.808	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])cc2F)CC[N@@H+](C)C1	ZINC000840358612	702083073	/nfs/dbraw/zinc/08/30/73/702083073.db2.gz	CLUYPZUTCOJTAQ-JTQLQIEISA-N	1	1	311.313	1.275	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1	ZINC000812337727	702161827	/nfs/dbraw/zinc/16/18/27/702161827.db2.gz	HDRUHPKOYFNNLE-NWDGAFQWSA-N	1	1	319.361	1.627	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1	ZINC000812338349	702162643	/nfs/dbraw/zinc/16/26/43/702162643.db2.gz	NCEBCSCJBRHCCB-OLZOCXBDSA-N	1	1	303.362	1.927	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)n1	ZINC000866209059	706649166	/nfs/dbraw/zinc/64/91/66/706649166.db2.gz	PBMVOPDXBBHGPZ-ZYHUDNBSSA-N	1	1	320.349	1.307	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](N2CCOC2=O)C1	ZINC000852431432	704044414	/nfs/dbraw/zinc/04/44/14/704044414.db2.gz	RQFBZOYIRQKAQD-CYBMUJFWSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](N2CCOC2=O)C1	ZINC000852431432	704044416	/nfs/dbraw/zinc/04/44/16/704044416.db2.gz	RQFBZOYIRQKAQD-CYBMUJFWSA-N	1	1	321.333	1.630	20	5		DDBDMO
CC[NH+]1CCN(CCNc2cc([N+](=O)[O-])ccc2C(C)=O)CC1	ZINC000853151379	704205255	/nfs/dbraw/zinc/20/52/55/704205255.db2.gz	ORGHDDBJECLSSK-UHFFFAOYSA-N	1	1	320.393	1.847	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000820264841	704248747	/nfs/dbraw/zinc/24/87/47/704248747.db2.gz	SNGZPRRJUHAGET-WFASDCNBSA-N	1	1	321.352	1.829	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC3(COC3)C2)c2ccc([N+](=O)[O-])cc12	ZINC000853598238	704281591	/nfs/dbraw/zinc/28/15/91/704281591.db2.gz	OYMJOLHJUVDCFC-UHFFFAOYSA-N	1	1	302.334	1.933	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000856281495	704521362	/nfs/dbraw/zinc/52/13/62/704521362.db2.gz	DUBHUKORXSFAHV-AWEZNQCLSA-N	1	1	323.393	1.865	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1	ZINC000859924851	705042926	/nfs/dbraw/zinc/04/29/26/705042926.db2.gz	PRPXLECBBGWSOE-NUEKZKHPSA-N	1	1	306.362	1.723	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836392	705193969	/nfs/dbraw/zinc/19/39/69/705193969.db2.gz	CCQQCIVJAKQEKN-VXGBXAGGSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874836392	705193974	/nfs/dbraw/zinc/19/39/74/705193974.db2.gz	CCQQCIVJAKQEKN-VXGBXAGGSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836392	705193980	/nfs/dbraw/zinc/19/39/80/705193980.db2.gz	CCQQCIVJAKQEKN-VXGBXAGGSA-N	1	1	321.381	1.579	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000824003222	705353109	/nfs/dbraw/zinc/35/31/09/705353109.db2.gz	SYPNBSUMTQFFHB-QWHCGFSZSA-N	1	1	319.365	1.925	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000824369052	705437556	/nfs/dbraw/zinc/43/75/56/705437556.db2.gz	VANYXIZMURAWIG-CHWSQXEVSA-N	1	1	321.381	1.233	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC([N@@H+]4CC[C@@H](O)C4)C3)sc2c1	ZINC000826573533	705817937	/nfs/dbraw/zinc/81/79/37/705817937.db2.gz	COMKNMOSNQDKGG-LLVKDONJSA-N	1	1	320.374	1.460	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC([N@H+]4CC[C@@H](O)C4)C3)sc2c1	ZINC000826573533	705817938	/nfs/dbraw/zinc/81/79/38/705817938.db2.gz	COMKNMOSNQDKGG-LLVKDONJSA-N	1	1	320.374	1.460	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000863320121	705900225	/nfs/dbraw/zinc/90/02/25/705900225.db2.gz	JMLCEEONKNTJDG-SNVBAGLBSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827338667	705979461	/nfs/dbraw/zinc/97/94/61/705979461.db2.gz	PZSGNMIGLFJPAO-JSGCOSHPSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c([N+](=O)[O-])n1	ZINC000877316031	706061200	/nfs/dbraw/zinc/06/12/00/706061200.db2.gz	HBEABNBFTSWBIB-LBPRGKRZSA-N	1	1	310.354	1.303	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2cc(F)c([N+](=O)[O-])cc2CO)C1	ZINC000865526844	706454867	/nfs/dbraw/zinc/45/48/67/706454867.db2.gz	XBCURQBUPLKVAR-LLVKDONJSA-N	1	1	313.329	1.359	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2C[C@]2(O)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000880419753	706968322	/nfs/dbraw/zinc/96/83/22/706968322.db2.gz	PPJAXSIWPNHPSJ-XPTSAGLGSA-N	1	1	309.297	1.129	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000880564954	707019954	/nfs/dbraw/zinc/01/99/54/707019954.db2.gz	ALSKIPFRDOPQGH-NHYWBVRUSA-N	1	1	308.334	1.574	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OCC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC000835603225	707290907	/nfs/dbraw/zinc/29/09/07/707290907.db2.gz	PPGRAOSOYIYUBF-YOGCLGLASA-N	1	1	322.365	1.841	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897222769	708260561	/nfs/dbraw/zinc/26/05/61/708260561.db2.gz	XMKVGCYVANMTET-KBPBESRZSA-N	1	1	305.378	1.939	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000912606089	713045772	/nfs/dbraw/zinc/04/57/72/713045772.db2.gz	KACSDRQYLZJXBE-UHFFFAOYSA-N	1	1	323.393	1.255	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000912608105	713047357	/nfs/dbraw/zinc/04/73/57/713047357.db2.gz	QVZRMAATGMSDRJ-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
C[C@@](O)(C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(F)F	ZINC000886067227	708691344	/nfs/dbraw/zinc/69/13/44/708691344.db2.gz	IPYOMZYTXVUBMZ-TVQRCGJNSA-N	1	1	316.308	1.492	20	5		DDBDMO
CCN1CCN(CC(C)(C)[NH2+]Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886236252	708721408	/nfs/dbraw/zinc/72/14/08/708721408.db2.gz	CNAGWJDXCUOEGF-UHFFFAOYSA-N	1	1	321.425	1.496	20	5		DDBDMO
CC1CC[NH+](Cc2cn(Cc3cccnc3[N+](=O)[O-])nn2)CC1	ZINC000887462983	709048704	/nfs/dbraw/zinc/04/87/04/709048704.db2.gz	LGYSVTAOVVFIOJ-UHFFFAOYSA-N	1	1	316.365	1.862	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@]1(O)CCC[N@H+](C)C1	ZINC000899911699	709234955	/nfs/dbraw/zinc/23/49/55/709234955.db2.gz	VQEDLCSRTNIKNQ-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc(NC(=O)C[C@@]2(O)CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000899911121	709235106	/nfs/dbraw/zinc/23/51/06/709235106.db2.gz	OAXNEZWABKTOKH-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC(C)(CCC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12)[N+](=O)[O-]	ZINC000928084743	713122363	/nfs/dbraw/zinc/12/23/63/713122363.db2.gz	XPRKLSFGLPZEPD-VXGBXAGGSA-N	1	1	315.439	1.518	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OCC[C@H]1CCCC[N@@H+]1C	ZINC000910203563	709812668	/nfs/dbraw/zinc/81/26/68/709812668.db2.gz	BGHHVUMTZIVGOT-GFCCVEGCSA-N	1	1	310.354	1.517	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@H](C)C1	ZINC000910286379	709867005	/nfs/dbraw/zinc/86/70/05/709867005.db2.gz	AANMWWMHJDDIEK-SNVBAGLBSA-N	1	1	309.370	1.193	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000892144411	710379710	/nfs/dbraw/zinc/37/97/10/710379710.db2.gz	OAHJCJKAVALSSE-PWSUYJOCSA-N	1	1	308.338	1.274	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928446196	713199935	/nfs/dbraw/zinc/19/99/35/713199935.db2.gz	VCVPHJQOJPNRSR-ZANVPECISA-N	1	1	302.334	1.899	20	5		DDBDMO
COC[C@@H](CO)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-]	ZINC000894621897	711220667	/nfs/dbraw/zinc/22/06/67/711220667.db2.gz	XMQGTDPAUOXQLK-SECBINFHSA-N	1	1	309.149	1.999	20	5		DDBDMO
Cc1cc(N(C)CC(=O)N2CC[NH+](C)CC2)c([N+](=O)[O-])s1	ZINC000894957192	711338747	/nfs/dbraw/zinc/33/87/47/711338747.db2.gz	DBWGXFVUHLTJDZ-UHFFFAOYSA-N	1	1	312.395	1.175	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000913537855	713249091	/nfs/dbraw/zinc/24/90/91/713249091.db2.gz	SRDMSEURFUVDLV-TXEJJXNPSA-N	1	1	304.350	1.312	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000895101576	711411913	/nfs/dbraw/zinc/41/19/13/711411913.db2.gz	HUUITOCQKVHLOZ-PHIMTYICSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895246340	711463836	/nfs/dbraw/zinc/46/38/36/711463836.db2.gz	NBFHJVGEASGMPJ-JQWIXIFHSA-N	1	1	310.402	1.166	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2CC[N@H+]2C2CCOCC2)c1[N+](=O)[O-]	ZINC000896521584	711737665	/nfs/dbraw/zinc/73/76/65/711737665.db2.gz	JZBBSBZQMRCDST-LBPRGKRZSA-N	1	1	323.397	1.556	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000896568493	711754722	/nfs/dbraw/zinc/75/47/22/711754722.db2.gz	NLSJDHOVGYFGJI-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
COc1cc(C[NH2+]CC[N+](=O)[O-])cc(Br)c1OC	ZINC000905083590	711930627	/nfs/dbraw/zinc/93/06/27/711930627.db2.gz	XABUFCDOZYQQFD-UHFFFAOYSA-N	1	1	319.155	1.833	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]C/C=C\Cl)cc1	ZINC000905704586	712125533	/nfs/dbraw/zinc/12/55/33/712125533.db2.gz	ANYVVJCXQOPBAX-BHQIHCQQSA-N	1	1	304.755	1.711	20	5		DDBDMO
COc1ccc(CNC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000914300032	713372979	/nfs/dbraw/zinc/37/29/79/713372979.db2.gz	HTEHOWVAIWSVAU-JQWIXIFHSA-N	1	1	322.365	1.495	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000917481076	713499802	/nfs/dbraw/zinc/49/98/02/713499802.db2.gz	XZHNEJAECOSWED-JTQLQIEISA-N	1	1	304.306	1.397	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000917481076	713499804	/nfs/dbraw/zinc/49/98/04/713499804.db2.gz	XZHNEJAECOSWED-JTQLQIEISA-N	1	1	304.306	1.397	20	5		DDBDMO
C[C@H]1CCCN(C(=O)OC[C@@H]2CCCC[N@@H+]2CC[N+](=O)[O-])C1	ZINC000930471136	713843434	/nfs/dbraw/zinc/84/34/34/713843434.db2.gz	VBELWUKJZFWQQP-KBPBESRZSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[C@H]1CCCN(C(=O)OC[C@@H]2CCCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000930471136	713843438	/nfs/dbraw/zinc/84/34/38/713843438.db2.gz	VBELWUKJZFWQQP-KBPBESRZSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931389993	714081935	/nfs/dbraw/zinc/08/19/35/714081935.db2.gz	NVUJFWVQUYBZAL-BETUJISGSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](C4OCCO4)C3)nc2c1	ZINC000932005440	714231740	/nfs/dbraw/zinc/23/17/40/714231740.db2.gz	RMOASYLIGZYUAN-SNVBAGLBSA-N	1	1	319.317	1.931	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](C2OCCO2)C1	ZINC000932007805	714232824	/nfs/dbraw/zinc/23/28/24/714232824.db2.gz	KDPLKWUHWJBEPQ-GFCCVEGCSA-N	1	1	308.334	1.668	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000923275735	714293929	/nfs/dbraw/zinc/29/39/29/714293929.db2.gz	UUKXBHMRMHRWMT-WDEREUQCSA-N	1	1	304.350	1.486	20	5		DDBDMO
CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[NH2+]CC1	ZINC000923335930	714319350	/nfs/dbraw/zinc/31/93/50/714319350.db2.gz	SGXPIPUFIDIMDB-ZIAGYGMSSA-N	1	1	323.393	1.408	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000932646327	714374135	/nfs/dbraw/zinc/37/41/35/714374135.db2.gz	HWUZABZSHROYFM-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000933372684	714574594	/nfs/dbraw/zinc/57/45/94/714574594.db2.gz	UPNUBXYBWPCHSM-WCQYABFASA-N	1	1	323.397	1.431	20	5		DDBDMO
CN1CCN(CCOc2cccc([N+](=O)[O-])c2)CC[N@@H+](C)CC1	ZINC000933998555	714719242	/nfs/dbraw/zinc/71/92/42/714719242.db2.gz	JRZGMIQMEOIZRM-UHFFFAOYSA-N	1	1	322.409	1.153	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CC[C@H]2OC)c1	ZINC000934104984	714742024	/nfs/dbraw/zinc/74/20/24/714742024.db2.gz	APFMXUDUWLBOLA-ZIAGYGMSSA-N	1	1	308.334	1.991	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2CC[C@H]2OC)c1	ZINC000934104984	714742025	/nfs/dbraw/zinc/74/20/25/714742025.db2.gz	APFMXUDUWLBOLA-ZIAGYGMSSA-N	1	1	308.334	1.991	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](Cc3nccs3)C2)n1	ZINC000934335270	714797736	/nfs/dbraw/zinc/79/77/36/714797736.db2.gz	ZRWIMXSLZADQFF-LLVKDONJSA-N	1	1	307.379	1.812	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@@H]2[C@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923254	721849240	/nfs/dbraw/zinc/84/92/40/721849240.db2.gz	UNHOKRDCMBXEFW-ZIAGYGMSSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@@H]2[C@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923254	721849241	/nfs/dbraw/zinc/84/92/41/721849241.db2.gz	UNHOKRDCMBXEFW-ZIAGYGMSSA-N	1	1	305.382	1.204	20	5		DDBDMO
Cc1nc(N2CC[NH+](C[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC000610754496	721901529	/nfs/dbraw/zinc/90/15/29/721901529.db2.gz	HWGWAHPWXSQZQW-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)ncnc2N1CCc2[nH+]ccn2CC1	ZINC001167181663	732809685	/nfs/dbraw/zinc/80/96/85/732809685.db2.gz	BELMHDYMWFEFTC-UHFFFAOYSA-N	1	1	310.317	1.797	20	5		DDBDMO
CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1ccccc1[N+](=O)[O-]	ZINC001100546830	734502385	/nfs/dbraw/zinc/50/23/85/734502385.db2.gz	TXHZGEVJKPRDAT-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
CCC/C=C/CC[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001195762113	746689223	/nfs/dbraw/zinc/68/92/23/746689223.db2.gz	WXKPLWGZYYENFC-DPOFCPOHSA-N	1	1	309.410	1.932	20	5		DDBDMO
CCC/C=C/CC[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195762113	746689226	/nfs/dbraw/zinc/68/92/26/746689226.db2.gz	WXKPLWGZYYENFC-DPOFCPOHSA-N	1	1	309.410	1.932	20	5		DDBDMO
CCC/C=C/CC[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195762113	746689228	/nfs/dbraw/zinc/68/92/28/746689228.db2.gz	WXKPLWGZYYENFC-DPOFCPOHSA-N	1	1	309.410	1.932	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001095574722	750049007	/nfs/dbraw/zinc/04/90/07/750049007.db2.gz	KWPFMWJYDIPAMT-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCN(C)c1ncccc1[N+](=O)[O-]	ZINC001095574719	750049726	/nfs/dbraw/zinc/04/97/26/750049726.db2.gz	KUMQAZAJSBPZKR-UHFFFAOYSA-N	1	1	323.397	1.273	20	5		DDBDMO
[NH3+]C1(c2cccnc2)CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001168992057	762165791	/nfs/dbraw/zinc/16/57/91/762165791.db2.gz	JFHAJNCAOBBSHF-DZGCQCFKSA-N	1	1	304.394	1.777	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011999	762178899	/nfs/dbraw/zinc/17/88/99/762178899.db2.gz	OMIMZTMCAYEEAZ-ZNSHCXBVSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011999	762178901	/nfs/dbraw/zinc/17/89/01/762178901.db2.gz	OMIMZTMCAYEEAZ-ZNSHCXBVSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=C(c1ccco1)N1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169037076	762192715	/nfs/dbraw/zinc/19/27/15/762192715.db2.gz	IOZMOAPQUFWNIL-ZIAGYGMSSA-N	1	1	321.377	1.873	20	5		DDBDMO
Cc1nc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)sc1C	ZINC001020139035	760612644	/nfs/dbraw/zinc/61/26/44/760612644.db2.gz	NSSRMXONFGWAEN-DDHJBXDOSA-N	1	1	324.406	1.162	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363117	761493188	/nfs/dbraw/zinc/49/31/88/761493188.db2.gz	CLPOAHRNWIBLGH-KBUPBQIOSA-N	1	1	303.362	1.336	20	5		DDBDMO
CC[N@H+](C)C(C)(C)C(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001130419206	767523724	/nfs/dbraw/zinc/52/37/24/767523724.db2.gz	PCOHSRUVLSOOEG-UHFFFAOYSA-N	1	1	322.409	1.531	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001130419206	767523726	/nfs/dbraw/zinc/52/37/26/767523726.db2.gz	PCOHSRUVLSOOEG-UHFFFAOYSA-N	1	1	322.409	1.531	20	5		DDBDMO
CC[NH+](CC)CC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001135511410	771557192	/nfs/dbraw/zinc/55/71/92/771557192.db2.gz	RDFIQKZTRHSLOV-UHFFFAOYSA-N	1	1	308.382	1.142	20	5		DDBDMO
CC[C@@](N)(CO)Nc1ccc([N+](=O)[O-])c(OCC[NH+](C)C)c1	ZINC001170863053	771773980	/nfs/dbraw/zinc/77/39/80/771773980.db2.gz	LNFRIWZAAFARKE-AWEZNQCLSA-N	1	1	312.370	1.004	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1ccc(-c2cccc([N+](=O)[O-])c2)nn1	ZINC001170897949	771896942	/nfs/dbraw/zinc/89/69/42/771896942.db2.gz	QVLMVFNAFVFXNV-ZDUSSCGKSA-N	1	1	302.338	1.487	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCCCCF)C2	ZINC001147505957	773155172	/nfs/dbraw/zinc/15/51/72/773155172.db2.gz	BNUDUOPTYNTCLH-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CCCCCF)C2	ZINC001147505957	773155173	/nfs/dbraw/zinc/15/51/73/773155173.db2.gz	BNUDUOPTYNTCLH-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CCCCCF)C2	ZINC001147505957	773155174	/nfs/dbraw/zinc/15/51/74/773155174.db2.gz	BNUDUOPTYNTCLH-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094515380	775971889	/nfs/dbraw/zinc/97/18/89/775971889.db2.gz	SLGJQUZJSGFOAL-UHFFFAOYSA-N	1	1	323.397	1.640	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172907068	776917809	/nfs/dbraw/zinc/91/78/09/776917809.db2.gz	CMEVWUXUCATIQF-CQSZACIVSA-N	1	1	305.378	1.910	20	5		DDBDMO
C[C@@H]1CNC(=O)C[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172921358	776930939	/nfs/dbraw/zinc/93/09/39/776930939.db2.gz	PENWSIJRWAQTDV-BXUZGUMPSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H]1CNC(=O)C[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172921358	776930945	/nfs/dbraw/zinc/93/09/45/776930945.db2.gz	PENWSIJRWAQTDV-BXUZGUMPSA-N	1	1	303.362	1.663	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101829026	777574490	/nfs/dbraw/zinc/57/44/90/777574490.db2.gz	BGLLZTFOMXKLKQ-UHFFFAOYSA-N	1	1	323.397	1.590	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)nc1C	ZINC001267240863	837587347	/nfs/dbraw/zinc/58/73/47/837587347.db2.gz	BBEUOLUZOCCQPG-HUUCEWRRSA-N	1	1	320.393	1.302	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)nc1C	ZINC001267240863	837587353	/nfs/dbraw/zinc/58/73/53/837587353.db2.gz	BBEUOLUZOCCQPG-HUUCEWRRSA-N	1	1	320.393	1.302	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)nc1C	ZINC001267240863	837587359	/nfs/dbraw/zinc/58/73/59/837587359.db2.gz	BBEUOLUZOCCQPG-HUUCEWRRSA-N	1	1	320.393	1.302	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc([N+](=O)[O-])c1Cl)[C@@H]1CC[N@@H+](C)C1	ZINC001143030062	861347809	/nfs/dbraw/zinc/34/78/09/861347809.db2.gz	XXPAUMJIWTYUJH-MRVPVSSYSA-N	1	1	315.761	1.528	20	5		DDBDMO
Cc1ccc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)s1	ZINC001122716080	858947446	/nfs/dbraw/zinc/94/74/46/858947446.db2.gz	VLIVBMNDWJPZOT-UHFFFAOYSA-N	1	1	323.378	1.218	20	5		DDBDMO
C[C@@H]1C[C@H]2CC[C@@H](C(=O)NCCn3cc([N+](=O)[O-])cn3)C[N@H+]2C1	ZINC001123668798	859352750	/nfs/dbraw/zinc/35/27/50/859352750.db2.gz	HIGHYNGCOLJXKA-JHJVBQTASA-N	1	1	321.381	1.028	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@H](C)OCCC[NH+]1CCOCC1	ZINC001224870033	881567193	/nfs/dbraw/zinc/56/71/93/881567193.db2.gz	JMZLSUXEZNGWET-LBPRGKRZSA-N	1	1	312.370	1.227	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001325875295	860909872	/nfs/dbraw/zinc/90/98/72/860909872.db2.gz	UILNHUPTGUHFSQ-JKSUJKDBSA-N	1	1	308.378	1.969	20	5		DDBDMO
CN1CC[NH+](C(C)(C)CNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001329978077	863990436	/nfs/dbraw/zinc/99/04/36/863990436.db2.gz	ZXYAVTDNVQFVEQ-UHFFFAOYSA-N	1	1	309.370	1.133	20	5		DDBDMO
CCCc1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157767815	864117588	/nfs/dbraw/zinc/11/75/88/864117588.db2.gz	VTYCYFXRGXYZJZ-HZPDHXFCSA-N	1	1	319.405	1.900	20	5		DDBDMO
Cc1cc(NCC(C)(C)[NH+]2CCN(C)CC2)ncc1[N+](=O)[O-]	ZINC001330377746	864285634	/nfs/dbraw/zinc/28/56/34/864285634.db2.gz	MSQIJSUYANHRFW-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2CC[N@@H+](C)CC23CCCC3)n1	ZINC001158408907	864634591	/nfs/dbraw/zinc/63/45/91/864634591.db2.gz	RADYNNACBWBLKP-UHFFFAOYSA-N	1	1	321.381	1.766	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+]3CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001158432745	864653206	/nfs/dbraw/zinc/65/32/06/864653206.db2.gz	YZFQCDXFSDWYIT-SNVBAGLBSA-N	1	1	306.322	1.061	20	5		DDBDMO
CC[N@H+]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C(C)(C)C1	ZINC001158563004	864728726	/nfs/dbraw/zinc/72/87/26/864728726.db2.gz	RGQHOIKZWLFXGZ-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
COc1nc(NCC[NH+]2CCC(F)(F)CC2)ncc1[N+](=O)[O-]	ZINC001160748640	866095977	/nfs/dbraw/zinc/09/59/77/866095977.db2.gz	YKAFFCVJLJSUCS-UHFFFAOYSA-N	1	1	317.296	1.536	20	5		DDBDMO
Cn1cc(CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)cn1	ZINC001161856554	867036395	/nfs/dbraw/zinc/03/63/95/867036395.db2.gz	CPZCRVOZRXKZKN-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
Cn1cc(CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)cn1	ZINC001161856554	867036411	/nfs/dbraw/zinc/03/64/11/867036411.db2.gz	CPZCRVOZRXKZKN-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@]2(C)CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001162338155	867468770	/nfs/dbraw/zinc/46/87/70/867468770.db2.gz	XCWWSNHXPHFJFD-AWEZNQCLSA-N	1	1	308.338	1.673	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC001335117119	868076244	/nfs/dbraw/zinc/07/62/44/868076244.db2.gz	KNCAUYVTBUACJQ-QWHCGFSZSA-N	1	1	309.341	1.769	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC001335420939	868284894	/nfs/dbraw/zinc/28/48/94/868284894.db2.gz	KFACAIAOJWPRQN-CYBMUJFWSA-N	1	1	320.393	1.778	20	5		DDBDMO
COc1ccc(NCC2(N(C)C)CC[NH+](C)CC2)nc1[N+](=O)[O-]	ZINC001164206832	869014865	/nfs/dbraw/zinc/01/48/65/869014865.db2.gz	GKWKHLZEKCISEW-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC([NH2+]C4COC4)C3)sc2c1	ZINC001164220336	869030028	/nfs/dbraw/zinc/03/00/28/869030028.db2.gz	GFNFKUKBQTVPNZ-UHFFFAOYSA-N	1	1	306.347	1.382	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC001337735042	869611521	/nfs/dbraw/zinc/61/15/21/869611521.db2.gz	RRJVFKFRLHUQKX-HUUCEWRRSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)ccc1[N+](=O)[O-]	ZINC001337837314	869652733	/nfs/dbraw/zinc/65/27/33/869652733.db2.gz	ZXRKZUFYVVHDNO-MGPQQGTHSA-N	1	1	303.362	1.973	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)cc1[N+](=O)[O-]	ZINC001339318227	870444272	/nfs/dbraw/zinc/44/42/72/870444272.db2.gz	SPVRSVWKEFGSQB-FRRDWIJNSA-N	1	1	319.361	1.673	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC001346923456	873937396	/nfs/dbraw/zinc/93/73/96/873937396.db2.gz	WRWDTNGTGGNTHY-ZDUSSCGKSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC001346923455	873937428	/nfs/dbraw/zinc/93/74/28/873937428.db2.gz	WRWDTNGTGGNTHY-CYBMUJFWSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3[O-])[C@@H]2C1	ZINC001347597691	874205792	/nfs/dbraw/zinc/20/57/92/874205792.db2.gz	RYERSXZWKPHXGH-BIMULSAOSA-N	1	1	305.334	1.370	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](O)[C@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC001349958756	875475516	/nfs/dbraw/zinc/47/55/16/875475516.db2.gz	QBQUYRGSQCZQHF-ZWNOBZJWSA-N	1	1	305.338	1.451	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](O)[C@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC001349958756	875475527	/nfs/dbraw/zinc/47/55/27/875475527.db2.gz	QBQUYRGSQCZQHF-ZWNOBZJWSA-N	1	1	305.338	1.451	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001350089624	875530687	/nfs/dbraw/zinc/53/06/87/875530687.db2.gz	VSHCNEHRKXSEJC-CFVMTHIKSA-N	1	1	303.362	1.594	20	5		DDBDMO
Nc1ncc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC001300131225	876970746	/nfs/dbraw/zinc/97/07/46/876970746.db2.gz	ODWSCNNCXSVDSC-NWDGAFQWSA-N	1	1	319.365	1.319	20	5		DDBDMO
C[C@@H](C[N+](C)(C)C)Oc1[nH]c(=O)nc2cc([N+](=O)[O-])ccc21	ZINC001228243435	883404231	/nfs/dbraw/zinc/40/42/31/883404231.db2.gz	YDJLFCUJLQVJSC-VIFPVBQESA-O	1	1	307.330	1.717	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](N2CCOCC2)C1	ZINC001254562875	896502888	/nfs/dbraw/zinc/50/28/88/896502888.db2.gz	QKPRWMRYZQAKBV-HOCLYGCPSA-N	1	1	319.405	1.932	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](C)CCN1[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569256	896504696	/nfs/dbraw/zinc/50/46/96/896504696.db2.gz	JEQQCRNZZCGRBS-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C)CCN1[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569256	896504708	/nfs/dbraw/zinc/50/47/08/896504708.db2.gz	JEQQCRNZZCGRBS-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
Cc1nc(CC[N@H+](C)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)no1	ZINC001254595037	896521595	/nfs/dbraw/zinc/52/15/95/896521595.db2.gz	VDDPKVIDURHZNT-CQSZACIVSA-N	1	1	302.334	1.928	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCOC3(CCOCC3)C1)C2	ZINC001254608184	896531136	/nfs/dbraw/zinc/53/11/36/896531136.db2.gz	OZUVYJOOAOLJIR-MRXNPFEDSA-N	1	1	318.373	1.943	20	5		DDBDMO
Cc1cc(F)ccc1C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001264985196	901392621	/nfs/dbraw/zinc/39/26/21/901392621.db2.gz	PVZWVVJFLDQMHD-HUUCEWRRSA-N	1	1	323.368	1.737	20	5		DDBDMO
Cc1cc(F)ccc1C[N@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985196	901392631	/nfs/dbraw/zinc/39/26/31/901392631.db2.gz	PVZWVVJFLDQMHD-HUUCEWRRSA-N	1	1	323.368	1.737	20	5		DDBDMO
Cc1cc(F)ccc1C[N@@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985196	901392642	/nfs/dbraw/zinc/39/26/42/901392642.db2.gz	PVZWVVJFLDQMHD-HUUCEWRRSA-N	1	1	323.368	1.737	20	5		DDBDMO
O=[N+]([O-])c1ncn(C[C@H]2C[N@@H+](Cc3ccccc3)CCCO2)n1	ZINC000278579115	214252402	/nfs/dbraw/zinc/25/24/02/214252402.db2.gz	OMOXBIAOEHRDTD-CQSZACIVSA-N	1	1	317.349	1.477	20	5		DDBDMO
C[C@H](CNc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[NH+](C)CC1	ZINC000278597606	214265016	/nfs/dbraw/zinc/26/50/16/214265016.db2.gz	ZHXSCGHKCBHKLD-LLVKDONJSA-N	1	1	318.381	1.519	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O	ZINC000305361541	231003758	/nfs/dbraw/zinc/00/37/58/231003758.db2.gz	UEYDNHKERNMGSR-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
COC[C@@H]1CCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000452028473	231274457	/nfs/dbraw/zinc/27/44/57/231274457.db2.gz	HFXUIFUSYPTRKX-GJZGRUSLSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](CCO)C[C@H]1C	ZINC000452123109	231310965	/nfs/dbraw/zinc/31/09/65/231310965.db2.gz	IAXXAPLDBIYJLB-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)c1csc([N+](=O)[O-])c1	ZINC000452348120	231355287	/nfs/dbraw/zinc/35/52/87/231355287.db2.gz	KOINODGLXODLFB-LLVKDONJSA-N	1	1	313.379	1.233	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000614924736	362081913	/nfs/dbraw/zinc/08/19/13/362081913.db2.gz	LFCDNRKGILYDDC-NSHDSACASA-N	1	1	322.287	1.835	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000614924736	362081915	/nfs/dbraw/zinc/08/19/15/362081915.db2.gz	LFCDNRKGILYDDC-NSHDSACASA-N	1	1	322.287	1.835	20	5		DDBDMO
CCOC(=O)[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090552550	185302603	/nfs/dbraw/zinc/30/26/03/185302603.db2.gz	WWEADVNLVZWENF-GFCCVEGCSA-N	1	1	323.349	1.032	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCS1	ZINC000090551234	185302977	/nfs/dbraw/zinc/30/29/77/185302977.db2.gz	KJWXBHPLYSUPIB-CYBMUJFWSA-N	1	1	311.407	1.830	20	5		DDBDMO
Cn1cc(Cl)cc1C[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090552235	185303032	/nfs/dbraw/zinc/30/30/32/185303032.db2.gz	IWYRWEIPBXCJQB-UHFFFAOYSA-N	1	1	324.768	1.880	20	5		DDBDMO
Cn1cc(Cl)cc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090552235	185303033	/nfs/dbraw/zinc/30/30/33/185303033.db2.gz	IWYRWEIPBXCJQB-UHFFFAOYSA-N	1	1	324.768	1.880	20	5		DDBDMO
CC[N@@H+](CC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)C1CC1	ZINC000269699406	282313207	/nfs/dbraw/zinc/31/32/07/282313207.db2.gz	QLZSOWDMGMOJAD-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000155768582	186111367	/nfs/dbraw/zinc/11/13/67/186111367.db2.gz	KCTHFDRRDGIYLI-NWDGAFQWSA-N	1	1	321.381	1.193	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCO[C@@H](C)C1	ZINC000026342654	352207940	/nfs/dbraw/zinc/20/79/40/352207940.db2.gz	RORUIZWVOSQKBP-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C)C1	ZINC000026342654	352207943	/nfs/dbraw/zinc/20/79/43/352207943.db2.gz	RORUIZWVOSQKBP-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC(=O)N(C)C	ZINC000041894462	352317643	/nfs/dbraw/zinc/31/76/43/352317643.db2.gz	SGKMMFSVSNAMIU-UHFFFAOYSA-N	1	1	322.365	1.252	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C2	ZINC000072832168	353219871	/nfs/dbraw/zinc/21/98/71/353219871.db2.gz	WTLYIHFJKBJXEQ-OAHLLOKOSA-N	1	1	307.325	1.836	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C2	ZINC000072832168	353219873	/nfs/dbraw/zinc/21/98/73/353219873.db2.gz	WTLYIHFJKBJXEQ-OAHLLOKOSA-N	1	1	307.325	1.836	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3c([N+](=O)[O-])ncn3C)CC2)CCO1	ZINC000078960990	353543015	/nfs/dbraw/zinc/54/30/15/353543015.db2.gz	IHVKREMAINXHPQ-LLVKDONJSA-N	1	1	309.370	1.018	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@H](C)[NH+]1CCN(C)CC1	ZINC000080611188	353617822	/nfs/dbraw/zinc/61/78/22/353617822.db2.gz	IKWGTFMBAMGEAI-ZDUSSCGKSA-N	1	1	322.409	1.789	20	5		DDBDMO
C[N@H+](Cc1cn[nH]c1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000085825085	353736879	/nfs/dbraw/zinc/73/68/79/353736879.db2.gz	ZUFGEVQMUHVSMM-ZDUSSCGKSA-N	1	1	306.322	1.190	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCc3cc(F)ccc3C2)c1	ZINC000091894444	353838441	/nfs/dbraw/zinc/83/84/41/353838441.db2.gz	YOIGVTNQFISGOK-HNNXBMFYSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3cc(F)ccc3C2)c1	ZINC000091894444	353838444	/nfs/dbraw/zinc/83/84/44/353838444.db2.gz	YOIGVTNQFISGOK-HNNXBMFYSA-N	1	1	320.324	1.350	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@H](N3CCNC3=O)C2)cc1[N+](=O)[O-]	ZINC000092188575	353846523	/nfs/dbraw/zinc/84/65/23/353846523.db2.gz	NSUOQMSBTRTBNW-AWEZNQCLSA-N	1	1	318.377	1.893	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@H](N3CCNC3=O)C2)cc1[N+](=O)[O-]	ZINC000092188575	353846526	/nfs/dbraw/zinc/84/65/26/353846526.db2.gz	NSUOQMSBTRTBNW-AWEZNQCLSA-N	1	1	318.377	1.893	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000617765323	363297227	/nfs/dbraw/zinc/29/72/27/363297227.db2.gz	WDGNUOTXPCNLQC-LBPRGKRZSA-N	1	1	309.366	1.129	20	5		DDBDMO
Nc1ccc(C(=O)N2CCC[N@H+](C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000149247154	354172488	/nfs/dbraw/zinc/17/24/88/354172488.db2.gz	IODKXKCYNYONGG-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H](O)C1CC1	ZINC000305238627	354469969	/nfs/dbraw/zinc/46/99/69/354469969.db2.gz	OZXJITONZSZEMT-HNNXBMFYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H](O)C1CC1	ZINC000305238627	354469973	/nfs/dbraw/zinc/46/99/73/354469973.db2.gz	OZXJITONZSZEMT-HNNXBMFYSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(NCCC[NH+]3CCOCC3)c2c1	ZINC000321954652	354534324	/nfs/dbraw/zinc/53/43/24/354534324.db2.gz	DQTXXWQHFPBYBR-UHFFFAOYSA-N	1	1	317.349	1.672	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](CCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000314680527	354488160	/nfs/dbraw/zinc/48/81/60/354488160.db2.gz	COASLPFWWNXLSO-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](CCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000314680527	354488163	/nfs/dbraw/zinc/48/81/63/354488163.db2.gz	COASLPFWWNXLSO-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@](O)(C(F)(F)F)C1	ZINC000314926011	354490093	/nfs/dbraw/zinc/49/00/93/354490093.db2.gz	WKBSHWMINIVAMZ-SNVBAGLBSA-N	1	1	308.260	1.099	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@](O)(C(F)(F)F)C1	ZINC000314926011	354490096	/nfs/dbraw/zinc/49/00/96/354490096.db2.gz	WKBSHWMINIVAMZ-SNVBAGLBSA-N	1	1	308.260	1.099	20	5		DDBDMO
C[C@H](NC(=O)NC[C@@]1(O)CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000358668488	299218457	/nfs/dbraw/zinc/21/84/57/299218457.db2.gz	XNRIFYZIDPGCGH-NHYWBVRUSA-N	1	1	322.365	1.022	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]([C@@H](C)O)C2)c1	ZINC000589510628	354998134	/nfs/dbraw/zinc/99/81/34/354998134.db2.gz	BIRNOFJFECCVKQ-DGCLKSJQSA-N	1	1	322.361	1.974	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCC[C@@H]1C1(O)CC1	ZINC000590969160	355226053	/nfs/dbraw/zinc/22/60/53/355226053.db2.gz	RZEYIOYMBFCNRZ-CYBMUJFWSA-N	1	1	307.350	1.136	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2c(=O)onc2-c2cccc([N+](=O)[O-])c2)C1	ZINC000592349567	355564406	/nfs/dbraw/zinc/56/44/06/355564406.db2.gz	GKUGKDQXDGANSV-SNVBAGLBSA-N	1	1	304.306	1.363	20	5		DDBDMO
CCCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@H]1CC[N@@H+](C)C1	ZINC000592833287	355707646	/nfs/dbraw/zinc/70/76/46/355707646.db2.gz	YDOAFEHLTXJVQI-NSHDSACASA-N	1	1	309.370	1.193	20	5		DDBDMO
CCC(C)(C)[NH+]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC000594389102	356193761	/nfs/dbraw/zinc/19/37/61/356193761.db2.gz	FIVBOJAPRGPQCP-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
CC(C)([NH2+]CC(=O)Nc1cnccn1)c1ccccc1[N+](=O)[O-]	ZINC000595510592	356525135	/nfs/dbraw/zinc/52/51/35/356525135.db2.gz	LFHFVAQKVZSVJR-UHFFFAOYSA-N	1	1	315.333	1.848	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595766584	356643869	/nfs/dbraw/zinc/64/38/69/356643869.db2.gz	QDPKINPPQGBTGK-NWDGAFQWSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595766584	356643874	/nfs/dbraw/zinc/64/38/74/356643874.db2.gz	QDPKINPPQGBTGK-NWDGAFQWSA-N	1	1	307.350	1.687	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000595751425	356636474	/nfs/dbraw/zinc/63/64/74/356636474.db2.gz	QGXHRZNKKRZAFU-INIZCTEOSA-N	1	1	319.361	1.431	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC2(COC2)C1	ZINC000595833530	356670498	/nfs/dbraw/zinc/67/04/98/356670498.db2.gz	MBNXMUSNLSYVIA-NSHDSACASA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(COC2)C1	ZINC000595833530	356670499	/nfs/dbraw/zinc/67/04/99/356670499.db2.gz	MBNXMUSNLSYVIA-NSHDSACASA-N	1	1	305.334	1.644	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@H]1C	ZINC000347202607	283207195	/nfs/dbraw/zinc/20/71/95/283207195.db2.gz	KTMUWLZPDKJMIW-CMPLNLGQSA-N	1	1	308.334	1.987	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@]1(C)CO	ZINC000595873337	356686595	/nfs/dbraw/zinc/68/65/95/356686595.db2.gz	LVCGPQARYWNKSD-BONVTDFDSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@]1(C)CO	ZINC000595873337	356686601	/nfs/dbraw/zinc/68/66/01/356686601.db2.gz	LVCGPQARYWNKSD-BONVTDFDSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H](C)[NH+]1CCOCC1	ZINC000596113921	356777094	/nfs/dbraw/zinc/77/70/94/356777094.db2.gz	FBFHWMGQHMKLNZ-QWRGUYRKSA-N	1	1	322.365	1.215	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(CO)(CO)C1	ZINC000597218853	357098346	/nfs/dbraw/zinc/09/83/46/357098346.db2.gz	LZYHZANPUFTNPA-QPEQYQDCSA-N	1	1	306.362	1.675	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000347670951	283250849	/nfs/dbraw/zinc/25/08/49/283250849.db2.gz	YDJLZRQJVRLCTL-ZDUSSCGKSA-N	1	1	309.370	1.030	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)n1	ZINC000597860017	357362093	/nfs/dbraw/zinc/36/20/93/357362093.db2.gz	JWJRPTUBTRLQBQ-JTQLQIEISA-N	1	1	309.370	1.179	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000597922938	357382928	/nfs/dbraw/zinc/38/29/28/357382928.db2.gz	HEHQTSLPPCTRTM-NSHDSACASA-N	1	1	309.370	1.170	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000598343107	357545994	/nfs/dbraw/zinc/54/59/94/357545994.db2.gz	SJZPIJJXQCXPCL-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](Nc2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000598632779	357662592	/nfs/dbraw/zinc/66/25/92/357662592.db2.gz	AVHCHJVHDCCVPJ-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598648527	357669346	/nfs/dbraw/zinc/66/93/46/357669346.db2.gz	UCQWXYUOKGHQGN-MCIONIFRSA-N	1	1	324.377	1.285	20	5		DDBDMO
CC1(C)CC[C@H](CO)[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000598650038	357670076	/nfs/dbraw/zinc/67/00/76/357670076.db2.gz	XLOPKFKOYCRIBN-CYBMUJFWSA-N	1	1	309.366	1.239	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000598648867	357670388	/nfs/dbraw/zinc/67/03/88/357670388.db2.gz	IAHAZUMIZJXQCD-QWHCGFSZSA-N	1	1	321.377	1.874	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[NH+](CCCF)CC2)nc2sccn21	ZINC000599091591	357812906	/nfs/dbraw/zinc/81/29/06/357812906.db2.gz	COAJJCMPFJDLNA-UHFFFAOYSA-N	1	1	313.358	1.786	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@@H](O)C2)c2ncccc12	ZINC000599175935	357840368	/nfs/dbraw/zinc/84/03/68/357840368.db2.gz	JYDFTLPBNNFGCO-LLVKDONJSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)CC1(O)CCC1	ZINC000599412154	357925671	/nfs/dbraw/zinc/92/56/71/357925671.db2.gz	GIKYEOLAKLQVRX-AWEZNQCLSA-N	1	1	308.378	1.735	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(C)COC1	ZINC000599571545	357979252	/nfs/dbraw/zinc/97/92/52/357979252.db2.gz	KUVUUMXVSGAJKM-NSHDSACASA-N	1	1	307.350	1.890	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000599632392	357998669	/nfs/dbraw/zinc/99/86/69/357998669.db2.gz	IIXWGNIOZSORMD-GPAUDHNESA-N	1	1	324.402	1.959	20	5		DDBDMO
Cc1ccc(C[N@@H+]2C[C@](C)(CO)[C@](C)(CO)C2)cc1[N+](=O)[O-]	ZINC000600204432	358155557	/nfs/dbraw/zinc/15/55/57/358155557.db2.gz	PQAUFAYFBYIXJR-IYBDPMFKSA-N	1	1	308.378	1.716	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600310389	358192196	/nfs/dbraw/zinc/19/21/96/358192196.db2.gz	IOJHNJWVRZFUPI-NSHDSACASA-N	1	1	309.370	1.098	20	5		DDBDMO
COC(=O)c1cnc(NCCC[N@@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC000276635965	213015356	/nfs/dbraw/zinc/01/53/56/213015356.db2.gz	WWTZWCLHIZEZJY-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
Cc1nc(N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000565579968	304077017	/nfs/dbraw/zinc/07/70/17/304077017.db2.gz	OXGREKMDVBFPGM-OLZOCXBDSA-N	1	1	321.381	1.749	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1	ZINC000601957864	358752873	/nfs/dbraw/zinc/75/28/73/358752873.db2.gz	KPTPRVJEWPQDPT-INIZCTEOSA-N	1	1	316.361	1.737	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN(C)CC[C@@H]1CCCC[N@H+]1C	ZINC000602787494	359191160	/nfs/dbraw/zinc/19/11/60/359191160.db2.gz	ZBVQLZFQFFMRSK-AWEZNQCLSA-N	1	1	309.414	1.906	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN(C)CC[C@H]1CCCC[N@H+]1C	ZINC000602787499	359191518	/nfs/dbraw/zinc/19/15/18/359191518.db2.gz	ZBVQLZFQFFMRSK-CQSZACIVSA-N	1	1	309.414	1.906	20	5		DDBDMO
C[NH+](C)C[C@@]1(O)CCCN(Cc2cc(O)ccc2[N+](=O)[O-])C1	ZINC000602875828	359258843	/nfs/dbraw/zinc/25/88/43/359258843.db2.gz	ATJUCEFASORBSL-HNNXBMFYSA-N	1	1	309.366	1.189	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCCO)Cc1ccccn1	ZINC000602820272	359214445	/nfs/dbraw/zinc/21/44/45/359214445.db2.gz	HRYIWIVQFPXFSK-UHFFFAOYSA-N	1	1	319.365	1.379	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](n3ccnn3)CC2)n1	ZINC000602889806	359273033	/nfs/dbraw/zinc/27/30/33/359273033.db2.gz	WAMAFVLVYFUWOO-LBPRGKRZSA-N	1	1	305.342	1.110	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CCC[N@H+](C(C)C)CC1	ZINC000602955994	359320932	/nfs/dbraw/zinc/32/09/32/359320932.db2.gz	GVVUUTUSBUQGLO-UHFFFAOYSA-N	1	1	321.381	1.668	20	5		DDBDMO
COc1ccc(Cn2cc(C[NH+]3CCCC3)nn2)cc1[N+](=O)[O-]	ZINC000603205477	359480135	/nfs/dbraw/zinc/48/01/35/359480135.db2.gz	CSOPDGQGPNKSIT-UHFFFAOYSA-N	1	1	317.349	1.839	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000186779009	200009368	/nfs/dbraw/zinc/00/93/68/200009368.db2.gz	AOLWBDWEVYZBSN-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610605354	360481403	/nfs/dbraw/zinc/48/14/03/360481403.db2.gz	ZMHUPJLJGJBCGV-KGLIPLIRSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2CCCOc1ccc([N+](=O)[O-])cc1	ZINC000610506737	360456483	/nfs/dbraw/zinc/45/64/83/360456483.db2.gz	SUKMTCVEUGOQOL-KGLIPLIRSA-N	1	1	319.361	1.717	20	5		DDBDMO
COCC1([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000611178758	360650724	/nfs/dbraw/zinc/65/07/24/360650724.db2.gz	MGNIRZVZJNOOMI-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
COCC1([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000611178758	360650728	/nfs/dbraw/zinc/65/07/28/360650728.db2.gz	MGNIRZVZJNOOMI-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@H+]1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000611092121	360621981	/nfs/dbraw/zinc/62/19/81/360621981.db2.gz	JFIFQSJQYSRZOS-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@H](CCO)C1)OCCO2	ZINC000611268914	360684165	/nfs/dbraw/zinc/68/41/65/360684165.db2.gz	FAIQNSNPZRQYAD-GFCCVEGCSA-N	1	1	322.361	1.960	20	5		DDBDMO
COc1cc(C[NH2+][C@H]2C(=O)NCC[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000193651791	201094940	/nfs/dbraw/zinc/09/49/40/201094940.db2.gz	XMFHCHKRELALFN-AMIZOPFISA-N	1	1	311.313	1.357	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000619566960	364063799	/nfs/dbraw/zinc/06/37/99/364063799.db2.gz	CVSMLBILXDBGDK-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@@H]2CCC[N@@H+]2C)c1	ZINC000281735322	216510209	/nfs/dbraw/zinc/51/02/09/216510209.db2.gz	XUPJVOLNZOUNRI-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000264592874	204014513	/nfs/dbraw/zinc/01/45/13/204014513.db2.gz	ANYJFTCOCQQRFU-GFCCVEGCSA-N	1	1	319.361	1.574	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1nc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000288304775	220073412	/nfs/dbraw/zinc/07/34/12/220073412.db2.gz	IFZVHKUEBHTYBD-UHFFFAOYSA-N	1	1	310.354	1.920	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)NC)CC1	ZINC000175054843	248389748	/nfs/dbraw/zinc/38/97/48/248389748.db2.gz	VXOLORMBCVGYTD-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000334103050	249215190	/nfs/dbraw/zinc/21/51/90/249215190.db2.gz	IAGMSTNGCWECQK-QWRGUYRKSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCO[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000284715652	218146068	/nfs/dbraw/zinc/14/60/68/218146068.db2.gz	ULZRFXDBGTWFQS-HZPDHXFCSA-N	1	1	305.378	1.808	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCOCCO)C(C)C	ZINC000338592192	250046845	/nfs/dbraw/zinc/04/68/45/250046845.db2.gz	KXYOMPJKGYOVSM-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000285312479	218376173	/nfs/dbraw/zinc/37/61/73/218376173.db2.gz	MYPWVJJPDSNSKY-AWEZNQCLSA-N	1	1	313.304	1.831	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000285312479	218376177	/nfs/dbraw/zinc/37/61/77/218376177.db2.gz	MYPWVJJPDSNSKY-AWEZNQCLSA-N	1	1	313.304	1.831	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000285312484	218376564	/nfs/dbraw/zinc/37/65/64/218376564.db2.gz	MYPWVJJPDSNSKY-CQSZACIVSA-N	1	1	313.304	1.831	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000285312484	218376567	/nfs/dbraw/zinc/37/65/67/218376567.db2.gz	MYPWVJJPDSNSKY-CQSZACIVSA-N	1	1	313.304	1.831	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000352426392	285042379	/nfs/dbraw/zinc/04/23/79/285042379.db2.gz	UCGREUOOKJKWSW-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C(C)C	ZINC000352439580	285051354	/nfs/dbraw/zinc/05/13/54/285051354.db2.gz	XMTSDQFYQNQWDC-UHFFFAOYSA-N	1	1	323.349	1.784	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC=C(C(F)(F)F)CC2)c1	ZINC000270158591	208218253	/nfs/dbraw/zinc/21/82/53/208218253.db2.gz	ICQMSCSCKCBVID-NSHDSACASA-N	1	1	320.271	1.347	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)CC1CC1	ZINC000352492352	285088847	/nfs/dbraw/zinc/08/88/47/285088847.db2.gz	XFXNMFVJXCREFJ-UHFFFAOYSA-N	1	1	323.349	1.246	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCC[C@@H]1O	ZINC000352661252	285205428	/nfs/dbraw/zinc/20/54/28/285205428.db2.gz	RNRJCJHJGZXACX-OLZOCXBDSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCC[C@@H]1O	ZINC000352661252	285205431	/nfs/dbraw/zinc/20/54/31/285205431.db2.gz	RNRJCJHJGZXACX-OLZOCXBDSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000352659751	285204037	/nfs/dbraw/zinc/20/40/37/285204037.db2.gz	LDZFEUSGPDYADK-HONMWMINSA-N	1	1	307.350	1.767	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[C@H]1O	ZINC000352660114	285204602	/nfs/dbraw/zinc/20/46/02/285204602.db2.gz	MJJOEPKTTUQPIO-DZGCQCFKSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[N@@H+](CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000352662458	285206115	/nfs/dbraw/zinc/20/61/15/285206115.db2.gz	ACFKPKYRLCRANP-UHFFFAOYSA-N	1	1	321.381	1.400	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000155242409	197035758	/nfs/dbraw/zinc/03/57/58/197035758.db2.gz	QALOFRAAOAHGHO-UHFFFAOYSA-N	1	1	306.322	1.694	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](N3CCCC3=O)C2)ccc1[N+](=O)[O-]	ZINC000352777735	285294515	/nfs/dbraw/zinc/29/45/15/285294515.db2.gz	ICWNHPVHHKDMEX-ZDUSSCGKSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](N3CCCC3=O)C2)ccc1[N+](=O)[O-]	ZINC000352777735	285294517	/nfs/dbraw/zinc/29/45/17/285294517.db2.gz	ICWNHPVHHKDMEX-ZDUSSCGKSA-N	1	1	319.361	1.800	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@H](C)C1	ZINC000122321680	195434105	/nfs/dbraw/zinc/43/41/05/195434105.db2.gz	QUFUXUDOBALSOL-YPMHNXCESA-N	1	1	323.397	1.288	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCC(C)(C)C1	ZINC000568700184	304306396	/nfs/dbraw/zinc/30/63/96/304306396.db2.gz	MHKPWOSIWYCFJV-UHFFFAOYSA-N	1	1	308.382	1.785	20	5		DDBDMO
C[C@@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1	ZINC000569115926	304336939	/nfs/dbraw/zinc/33/69/39/304336939.db2.gz	ARGXHVUPJIMMDD-BBRMVZONSA-N	1	1	318.421	1.808	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC[N@@H+]1CCCC[C@@H]1C	ZINC000068410433	406640407	/nfs/dbraw/zinc/64/04/07/406640407.db2.gz	FAVJCNWSSKMZCU-LBPRGKRZSA-N	1	1	323.397	1.480	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)cc1[N+](=O)[O-]	ZINC000073996089	406899664	/nfs/dbraw/zinc/89/96/64/406899664.db2.gz	DRDMZFMXXVAUEF-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
CO[C@@H]1CCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000076345140	406964400	/nfs/dbraw/zinc/96/44/00/406964400.db2.gz	GMFCEABNXJTZNJ-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000076345140	406964404	/nfs/dbraw/zinc/96/44/04/406964404.db2.gz	GMFCEABNXJTZNJ-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CC1	ZINC000029913203	406927789	/nfs/dbraw/zinc/92/77/89/406927789.db2.gz	YSJDIZGRJTUZOB-UHFFFAOYSA-N	1	1	307.306	1.746	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CC1	ZINC000029913203	406927791	/nfs/dbraw/zinc/92/77/91/406927791.db2.gz	YSJDIZGRJTUZOB-UHFFFAOYSA-N	1	1	307.306	1.746	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000078644202	407038543	/nfs/dbraw/zinc/03/85/43/407038543.db2.gz	YCOCNYWGLCMUSA-CQSZACIVSA-N	1	1	322.365	1.827	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000054987101	407192182	/nfs/dbraw/zinc/19/21/82/407192182.db2.gz	DEZNJIPCHABDEP-HNNXBMFYSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000054987101	407192183	/nfs/dbraw/zinc/19/21/83/407192183.db2.gz	DEZNJIPCHABDEP-HNNXBMFYSA-N	1	1	319.361	1.717	20	5		DDBDMO
CC[C@](C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(N)=O	ZINC000089913374	407158607	/nfs/dbraw/zinc/15/86/07/407158607.db2.gz	IBEPUNQTSFHRHI-HNNXBMFYSA-N	1	1	318.333	1.993	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000123492972	407330205	/nfs/dbraw/zinc/33/02/05/407330205.db2.gz	CFWJLSFMUFSWES-PWSUYJOCSA-N	1	1	309.370	1.041	20	5		DDBDMO
NS(=O)(=O)CC1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000104065847	407345920	/nfs/dbraw/zinc/34/59/20/407345920.db2.gz	AIMPYFPETNAYGT-UHFFFAOYSA-N	1	1	313.379	1.095	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000124481186	407359823	/nfs/dbraw/zinc/35/98/23/407359823.db2.gz	DBZZVXKEZWXKQB-DZGCQCFKSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000107890892	407381125	/nfs/dbraw/zinc/38/11/25/407381125.db2.gz	MMEWSCYBWIFWLI-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270980674	407447350	/nfs/dbraw/zinc/44/73/50/407447350.db2.gz	XDCLSMQQAWQUCD-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270980674	407447358	/nfs/dbraw/zinc/44/73/58/407447358.db2.gz	XDCLSMQQAWQUCD-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
COC[C@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000265794732	407456528	/nfs/dbraw/zinc/45/65/28/407456528.db2.gz	MVLYFBIICQMYGL-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000265794732	407456532	/nfs/dbraw/zinc/45/65/32/407456532.db2.gz	MVLYFBIICQMYGL-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H](CO)C3)n2)c1	ZINC000265924700	407511971	/nfs/dbraw/zinc/51/19/71/407511971.db2.gz	YXINDWPOEMONFY-JTQLQIEISA-N	1	1	304.306	1.459	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@H](CO)C3)n2)c1	ZINC000265924700	407511975	/nfs/dbraw/zinc/51/19/75/407511975.db2.gz	YXINDWPOEMONFY-JTQLQIEISA-N	1	1	304.306	1.459	20	5		DDBDMO
CCN1CC[NH+]([C@H]2CCN(c3cc(C)c([N+](=O)[O-])cn3)C2)CC1	ZINC000266849202	407652590	/nfs/dbraw/zinc/65/25/90/407652590.db2.gz	QLNZZVLQAASNNO-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1C	ZINC000267000402	407710690	/nfs/dbraw/zinc/71/06/90/407710690.db2.gz	CTIGMPOTJVZJGK-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000187253142	407838331	/nfs/dbraw/zinc/83/83/31/407838331.db2.gz	SYAJZLSPPHLKHE-URWSZGRFSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000187253142	407838336	/nfs/dbraw/zinc/83/83/36/407838336.db2.gz	SYAJZLSPPHLKHE-URWSZGRFSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000187280455	407840084	/nfs/dbraw/zinc/84/00/84/407840084.db2.gz	ZUZLXQKUEMCSLT-LVDDQXARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000187280455	407840089	/nfs/dbraw/zinc/84/00/89/407840089.db2.gz	ZUZLXQKUEMCSLT-LVDDQXARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)C[N@H+]1C1CC1	ZINC000133535997	407856247	/nfs/dbraw/zinc/85/62/47/407856247.db2.gz	DVHHENDGNCALHP-DTWKUNHWSA-N	1	1	305.338	1.126	20	5		DDBDMO
CN1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccc[nH+]c21	ZINC000272300000	407859604	/nfs/dbraw/zinc/85/96/04/407859604.db2.gz	UJIFXPWOHDMASK-HNNXBMFYSA-N	1	1	314.345	1.980	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000272527312	407965925	/nfs/dbraw/zinc/96/59/25/407965925.db2.gz	IAQOFUNTCFSODX-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1	ZINC000246411141	408249571	/nfs/dbraw/zinc/24/95/71/408249571.db2.gz	KBFUXBNLXVTJJU-DGCLKSJQSA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1	ZINC000246411141	408249578	/nfs/dbraw/zinc/24/95/78/408249578.db2.gz	KBFUXBNLXVTJJU-DGCLKSJQSA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)C[C@H]1[NH+]1CCOCC1	ZINC000246411141	408249582	/nfs/dbraw/zinc/24/95/82/408249582.db2.gz	KBFUXBNLXVTJJU-DGCLKSJQSA-N	1	1	311.407	1.809	20	5		DDBDMO
CCOC(=O)C1([N@H+](C)CCn2ccc([N+](=O)[O-])n2)CCCCC1	ZINC000151193379	408275378	/nfs/dbraw/zinc/27/53/78/408275378.db2.gz	STBRNFKJLQCFJZ-UHFFFAOYSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCOC(=O)C1([N@@H+](C)CCn2ccc([N+](=O)[O-])n2)CCCCC1	ZINC000151193379	408275381	/nfs/dbraw/zinc/27/53/81/408275381.db2.gz	STBRNFKJLQCFJZ-UHFFFAOYSA-N	1	1	324.381	1.989	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000183198517	408350644	/nfs/dbraw/zinc/35/06/44/408350644.db2.gz	KUASMYUWIGSIRS-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000183198517	408350647	/nfs/dbraw/zinc/35/06/47/408350647.db2.gz	KUASMYUWIGSIRS-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000158853369	408364776	/nfs/dbraw/zinc/36/47/76/408364776.db2.gz	PRPHRYSDOXCDLX-AAEUAGOBSA-N	1	1	323.397	1.371	20	5		DDBDMO
CCC[NH+]1CCC(N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC000264151135	408383024	/nfs/dbraw/zinc/38/30/24/408383024.db2.gz	HXBWEUOCZOBLEF-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
C[N@@H+](CCNC(=O)COc1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000264233223	408414778	/nfs/dbraw/zinc/41/47/78/408414778.db2.gz	YJSXGPDWGRBQKU-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000264432112	408487338	/nfs/dbraw/zinc/48/73/38/408487338.db2.gz	AUCYFVYQMMMMJI-LBPRGKRZSA-N	1	1	323.349	1.054	20	5		DDBDMO
C[C@]1(O)CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000248332139	408548730	/nfs/dbraw/zinc/54/87/30/408548730.db2.gz	FFSCZOLLSZKKHY-ZFWWWQNUSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[C@]1(O)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000248332139	408548735	/nfs/dbraw/zinc/54/87/35/408548735.db2.gz	FFSCZOLLSZKKHY-ZFWWWQNUSA-N	1	1	305.334	1.157	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248450127	408568476	/nfs/dbraw/zinc/56/84/76/408568476.db2.gz	ILUOZQZLESQXEL-UONOGXRCSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000270594450	408595876	/nfs/dbraw/zinc/59/58/76/408595876.db2.gz	YRQLOPYVVBJRBC-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000248666711	408614222	/nfs/dbraw/zinc/61/42/22/408614222.db2.gz	OHIPZHYPJABUSW-NEPJUHHUSA-N	1	1	309.366	1.495	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000184458914	408622358	/nfs/dbraw/zinc/62/23/58/408622358.db2.gz	QZKNUEHXTUHXSL-SNVBAGLBSA-N	1	1	307.354	1.176	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270761446	408669530	/nfs/dbraw/zinc/66/95/30/408669530.db2.gz	MTKAFFZOLWEBHW-QWRGUYRKSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[C@H](O)CC1	ZINC000275905572	408715527	/nfs/dbraw/zinc/71/55/27/408715527.db2.gz	SOEQNLYZTVVHCH-QEJZJMRPSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CCO)C3CCC3)n2)c1	ZINC000275915955	408717121	/nfs/dbraw/zinc/71/71/21/408717121.db2.gz	YGALAXBXGHPJJE-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CCO)C3CCC3)n2)c1	ZINC000275915955	408717125	/nfs/dbraw/zinc/71/71/25/408717125.db2.gz	YGALAXBXGHPJJE-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
Cc1cc([N+](=O)[O-])nn1C[C@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000184767532	408686144	/nfs/dbraw/zinc/68/61/44/408686144.db2.gz	XNKFPHAXEVZWNE-OAHLLOKOSA-N	1	1	316.361	1.519	20	5		DDBDMO
Nc1c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000178174432	408783184	/nfs/dbraw/zinc/78/31/84/408783184.db2.gz	KTRYHNZXIQNUHN-JTQLQIEISA-N	1	1	304.350	1.391	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21	ZINC000164563995	408801117	/nfs/dbraw/zinc/80/11/17/408801117.db2.gz	DWCUXHPOLMRTLQ-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC2([NH+](C)C)CCC2)c1[N+](=O)[O-]	ZINC000276130358	408822428	/nfs/dbraw/zinc/82/24/28/408822428.db2.gz	ZXISGEUAZHTCGY-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)[C@@H]2C1	ZINC000276337654	408838976	/nfs/dbraw/zinc/83/89/76/408838976.db2.gz	HOPWYXVSVWSKNP-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-]	ZINC000281695391	408911437	/nfs/dbraw/zinc/91/14/37/408911437.db2.gz	VQLAJFMEKIPYKF-UHFFFAOYSA-N	1	1	309.366	1.740	20	5		DDBDMO
Cc1ccnc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000282284584	409026267	/nfs/dbraw/zinc/02/62/67/409026267.db2.gz	PXRLVNROBBENPX-CQSZACIVSA-N	1	1	320.393	1.847	20	5		DDBDMO
CC(=O)c1cc(NC[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000287520507	409049099	/nfs/dbraw/zinc/04/90/99/409049099.db2.gz	VFWMDQAQLAUZGM-CYBMUJFWSA-N	1	1	306.366	1.455	20	5		DDBDMO
CC(=O)c1cc(NC[C@@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000287520507	409049101	/nfs/dbraw/zinc/04/91/01/409049101.db2.gz	VFWMDQAQLAUZGM-CYBMUJFWSA-N	1	1	306.366	1.455	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000289044590	409211396	/nfs/dbraw/zinc/21/13/96/409211396.db2.gz	PVXWHSINWAOKJG-IHRRRGAJSA-N	1	1	324.377	1.427	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@H+]2CC=CCC2)c([N+](=O)[O-])c1	ZINC000280167580	409261999	/nfs/dbraw/zinc/26/19/99/409261999.db2.gz	GXCXRLFHUDYHAO-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@@H+]2CC=CCC2)c([N+](=O)[O-])c1	ZINC000280167580	409262000	/nfs/dbraw/zinc/26/20/00/409262000.db2.gz	GXCXRLFHUDYHAO-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H]1c1ccccc1	ZINC000285492502	409466922	/nfs/dbraw/zinc/46/69/22/409466922.db2.gz	AMVVQRPHEXNCQG-RISCZKNCSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408075847	164219744	/nfs/dbraw/zinc/21/97/44/164219744.db2.gz	ZYLWWTSLUVZGDQ-VHSXEESVSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408075847	164219746	/nfs/dbraw/zinc/21/97/46/164219746.db2.gz	ZYLWWTSLUVZGDQ-VHSXEESVSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1c(F)cncc1F	ZINC000285594561	409502321	/nfs/dbraw/zinc/50/23/21/409502321.db2.gz	IYNIMSWFMKGMMG-VIFPVBQESA-N	1	1	324.287	1.781	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000356853674	409664960	/nfs/dbraw/zinc/66/49/60/409664960.db2.gz	OCQLLPAPJFTRSG-NEPJUHHUSA-N	1	1	307.350	1.525	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC2C[NH+](C(C)C)C2)c1	ZINC000297154534	409826625	/nfs/dbraw/zinc/82/66/25/409826625.db2.gz	RXVOHHMFNOPLSZ-UHFFFAOYSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[C@@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000357308675	409966553	/nfs/dbraw/zinc/96/65/53/409966553.db2.gz	WQTOKLLVZUTBRL-QWRGUYRKSA-N	1	1	321.381	1.764	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298105662	410117670	/nfs/dbraw/zinc/11/76/70/410117670.db2.gz	NRCMVBYGIWJKPK-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298777749	410393954	/nfs/dbraw/zinc/39/39/54/410393954.db2.gz	DIIBZXMFQSDFJR-MNOVXSKESA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298777749	410393959	/nfs/dbraw/zinc/39/39/59/410393959.db2.gz	DIIBZXMFQSDFJR-MNOVXSKESA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000298822785	410411637	/nfs/dbraw/zinc/41/16/37/410411637.db2.gz	ZYXUDXVBUZTPBP-LLVKDONJSA-N	1	1	321.333	1.053	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000298822785	410411642	/nfs/dbraw/zinc/41/16/42/410411642.db2.gz	ZYXUDXVBUZTPBP-LLVKDONJSA-N	1	1	321.333	1.053	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000343415855	410433467	/nfs/dbraw/zinc/43/34/67/410433467.db2.gz	LPVLZNPDNXGZJM-IPYPFGDCSA-N	1	1	324.377	1.427	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)c1	ZINC000343511886	410502366	/nfs/dbraw/zinc/50/23/66/410502366.db2.gz	JGHXPOMPNDTBTQ-MFKMUULPSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C[C@H](C)O	ZINC000352188386	410534456	/nfs/dbraw/zinc/53/44/56/410534456.db2.gz	YJVZYJUWKHEQOF-NSHDSACASA-N	1	1	323.349	1.596	20	5		DDBDMO
CCCC(=O)NC[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355541669	410572351	/nfs/dbraw/zinc/57/23/51/410572351.db2.gz	JAMFXCLPBYPRFD-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCCC(=O)NC[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355541669	410572355	/nfs/dbraw/zinc/57/23/55/410572355.db2.gz	JAMFXCLPBYPRFD-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCCOC1	ZINC000352201993	410545585	/nfs/dbraw/zinc/54/55/85/410545585.db2.gz	HSARQZSPIRCPLU-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCCOC1	ZINC000352201993	410545590	/nfs/dbraw/zinc/54/55/90/410545590.db2.gz	HSARQZSPIRCPLU-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cc1cn2c([nH+]1)CC[C@@H](Nc1ncc([N+](=O)[O-])cc1C(N)=O)C2	ZINC000301127172	410661990	/nfs/dbraw/zinc/66/19/90/410661990.db2.gz	OXUWJRZXEGKRMG-SECBINFHSA-N	1	1	316.321	1.021	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c2cnccc21	ZINC000301155534	410666894	/nfs/dbraw/zinc/66/68/94/410666894.db2.gz	PWCKVEOMNWTROQ-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[N@H+](C)C1	ZINC000330542480	410762055	/nfs/dbraw/zinc/76/20/55/410762055.db2.gz	IVNKWAKYVNBWCN-WHOFXGATSA-N	1	1	321.377	1.800	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000330542480	410762062	/nfs/dbraw/zinc/76/20/62/410762062.db2.gz	IVNKWAKYVNBWCN-WHOFXGATSA-N	1	1	321.377	1.800	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000330663766	410860707	/nfs/dbraw/zinc/86/07/07/410860707.db2.gz	UCLVTWYQWLQXTK-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000330663766	410860712	/nfs/dbraw/zinc/86/07/12/410860712.db2.gz	UCLVTWYQWLQXTK-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882401	410901715	/nfs/dbraw/zinc/90/17/15/410901715.db2.gz	ZSFLJIARVHBWQJ-GHMZBOCLSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882401	410901722	/nfs/dbraw/zinc/90/17/22/410901722.db2.gz	ZSFLJIARVHBWQJ-GHMZBOCLSA-N	1	1	309.341	2.000	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344068251	410935667	/nfs/dbraw/zinc/93/56/67/410935667.db2.gz	QIRRRIFZUGCELZ-KYEXWDHISA-N	1	1	322.361	1.037	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000344117201	410966376	/nfs/dbraw/zinc/96/63/76/410966376.db2.gz	BLLUILYXXDOUDF-NFAWXSAZSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000331188578	411007509	/nfs/dbraw/zinc/00/75/09/411007509.db2.gz	ZJLJNNODJLIZGI-JSGCOSHPSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000331188578	411007511	/nfs/dbraw/zinc/00/75/11/411007511.db2.gz	ZJLJNNODJLIZGI-JSGCOSHPSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC1CC[NH+](CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000360108657	411051246	/nfs/dbraw/zinc/05/12/46/411051246.db2.gz	XYHZISKHQJGHOX-CABCVRRESA-N	1	1	309.410	1.622	20	5		DDBDMO
COc1ccc(OCCN2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000331279234	411053830	/nfs/dbraw/zinc/05/38/30/411053830.db2.gz	SRXRHTHBRZYIOX-GFCCVEGCSA-N	1	1	309.366	1.618	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](CN3CCOCC3)C2)cs1	ZINC000129480428	196051995	/nfs/dbraw/zinc/05/19/95/196051995.db2.gz	NAXQNTKGOAVSGW-LBPRGKRZSA-N	1	1	311.407	1.810	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)cs1	ZINC000129480428	196051998	/nfs/dbraw/zinc/05/19/98/196051998.db2.gz	NAXQNTKGOAVSGW-LBPRGKRZSA-N	1	1	311.407	1.810	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000131919618	196209681	/nfs/dbraw/zinc/20/96/81/196209681.db2.gz	PPDQUCIHSJGSJP-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)CO)c([N+](=O)[O-])c1	ZINC000131919618	196209683	/nfs/dbraw/zinc/20/96/83/196209683.db2.gz	PPDQUCIHSJGSJP-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000296640435	226077050	/nfs/dbraw/zinc/07/70/50/226077050.db2.gz	IHGSEAOATIQFKW-HNNXBMFYSA-N	1	1	307.350	1.552	20	5		DDBDMO
O=C([C@H]1C[C@@H]1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933509	418474832	/nfs/dbraw/zinc/47/48/32/418474832.db2.gz	MPPRPDAPADBXQF-GJZGRUSLSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2)CC1	ZINC000373933509	418474836	/nfs/dbraw/zinc/47/48/36/418474836.db2.gz	MPPRPDAPADBXQF-GJZGRUSLSA-N	1	1	303.362	1.386	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](Cc2ccccc2)CC1	ZINC000373933509	418474839	/nfs/dbraw/zinc/47/48/39/418474839.db2.gz	MPPRPDAPADBXQF-GJZGRUSLSA-N	1	1	303.362	1.386	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@@H]3C[N@H+](C)C[C@H]3C)n2)n1C	ZINC000361248776	418611733	/nfs/dbraw/zinc/61/17/33/418611733.db2.gz	CXVDLPKPCNYPOU-VXNVDRBHSA-N	1	1	306.326	1.352	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2ncccc2C1	ZINC000367849568	418645051	/nfs/dbraw/zinc/64/50/51/418645051.db2.gz	NDHRJMMIZIRULY-UHFFFAOYSA-N	1	1	300.318	1.210	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2ncccc2C1	ZINC000367849568	418645054	/nfs/dbraw/zinc/64/50/54/418645054.db2.gz	NDHRJMMIZIRULY-UHFFFAOYSA-N	1	1	300.318	1.210	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N[C@H]1CCC[NH2+]CC1	ZINC000375621054	418663582	/nfs/dbraw/zinc/66/35/82/418663582.db2.gz	NYLVHJSBMHCKPI-VIFPVBQESA-N	1	1	317.342	1.154	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1	ZINC000370308931	418742437	/nfs/dbraw/zinc/74/24/37/418742437.db2.gz	QJBNFLMFWHVIBF-BBRMVZONSA-N	1	1	313.361	2.490	20	5		DDBDMO
CC(=O)N[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000420961018	419387547	/nfs/dbraw/zinc/38/75/47/419387547.db2.gz	SCKCXUKQBYWHBT-LBPRGKRZSA-N	1	1	320.349	1.134	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000426484130	419480696	/nfs/dbraw/zinc/48/06/96/419480696.db2.gz	KZIDLFIZJLALFQ-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
CCOc1cc(C[NH2+]C2(C(=O)N(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000411914922	419482837	/nfs/dbraw/zinc/48/28/37/419482837.db2.gz	RILJFCHYSOGZDU-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)N(C)C)C1	ZINC000411943426	419515718	/nfs/dbraw/zinc/51/57/18/419515718.db2.gz	QOZXWQUDZGHPBC-NSHDSACASA-N	1	1	307.350	1.514	20	5		DDBDMO
CNC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000412054693	419599937	/nfs/dbraw/zinc/59/99/37/419599937.db2.gz	MSTZLFGOEIFNAI-UHFFFAOYSA-N	1	1	322.365	1.497	20	5		DDBDMO
C[C@H](O)[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101483	419665654	/nfs/dbraw/zinc/66/56/54/419665654.db2.gz	WZXDFPRIFFUEST-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H](O)[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101483	419665667	/nfs/dbraw/zinc/66/56/67/419665667.db2.gz	WZXDFPRIFFUEST-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CC=C(C)CC2)n1	ZINC000427689845	419715736	/nfs/dbraw/zinc/71/57/36/419715736.db2.gz	QZBFCCOBYZHWSJ-UHFFFAOYSA-N	1	1	307.354	1.193	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000422018759	419808644	/nfs/dbraw/zinc/80/86/44/419808644.db2.gz	JMNGYKSFCSONKP-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@H]1C[NH2+]CCCO1	ZINC000415030496	419917421	/nfs/dbraw/zinc/91/74/21/419917421.db2.gz	CMKSRSCDGLUONV-UKRRQHHQSA-N	1	1	307.394	1.884	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](CO)COC(C)C	ZINC000430237139	420094666	/nfs/dbraw/zinc/09/46/66/420094666.db2.gz	OOGQLSFSZWMLSU-CQSZACIVSA-N	1	1	312.366	1.821	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](CO)COC(C)C	ZINC000430237139	420094671	/nfs/dbraw/zinc/09/46/71/420094671.db2.gz	OOGQLSFSZWMLSU-CQSZACIVSA-N	1	1	312.366	1.821	20	5		DDBDMO
Cc1c(CNC(=O)[C@H]2CC[NH2+]CC2(F)F)cccc1[N+](=O)[O-]	ZINC000423794518	420188768	/nfs/dbraw/zinc/18/87/68/420188768.db2.gz	DVLISBKLSPKQKM-LLVKDONJSA-N	1	1	313.304	1.764	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC([NH+](C)C)C2)c(C)cc1[N+](=O)[O-]	ZINC000416452100	420377638	/nfs/dbraw/zinc/37/76/38/420377638.db2.gz	COGQGZHWHBORFO-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
C[C@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@H](C)[NH+]1CCOCC1	ZINC000301959861	230004951	/nfs/dbraw/zinc/00/49/51/230004951.db2.gz	HIDUFXOOPKJATL-QWRGUYRKSA-N	1	1	320.353	1.159	20	5		DDBDMO
Cc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)ncc1[N+](=O)[O-]	ZINC000302487351	230264954	/nfs/dbraw/zinc/26/49/54/230264954.db2.gz	IVJGABCLFKNWML-GFCCVEGCSA-N	1	1	308.382	1.580	20	5		DDBDMO
CC(C)c1ccc(C(=O)NC[C@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000439715100	420532944	/nfs/dbraw/zinc/53/29/44/420532944.db2.gz	DDFKINXTFFLAEJ-MRXNPFEDSA-N	1	1	321.377	1.515	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000456908927	420567141	/nfs/dbraw/zinc/56/71/41/420567141.db2.gz	XPUDLABNOIAXJB-UHFFFAOYSA-N	1	1	323.397	1.069	20	5		DDBDMO
O=C1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C[C@H]2CCCCN12	ZINC000453628714	420738149	/nfs/dbraw/zinc/73/81/49/420738149.db2.gz	NOBLTICRJVPHLS-BXUZGUMPSA-N	1	1	307.325	1.977	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C\c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000493186308	420780546	/nfs/dbraw/zinc/78/05/46/420780546.db2.gz	GYTLTOQBZAIMRF-YTELKSAQSA-N	1	1	301.346	1.771	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000454276410	420828467	/nfs/dbraw/zinc/82/84/67/420828467.db2.gz	ORRBBUICXQUKKD-AWEZNQCLSA-N	1	1	322.365	1.563	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000493392995	420836451	/nfs/dbraw/zinc/83/64/51/420836451.db2.gz	RGDQNIDBGATEGH-LLPBQKLSSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000493392995	420836452	/nfs/dbraw/zinc/83/64/52/420836452.db2.gz	RGDQNIDBGATEGH-LLPBQKLSSA-N	1	1	319.361	1.133	20	5		DDBDMO
CNc1nc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000455613541	421044893	/nfs/dbraw/zinc/04/48/93/421044893.db2.gz	NMCYNRGQIZQYGM-NSHDSACASA-N	1	1	319.365	1.340	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC12COC2	ZINC000449366759	420998566	/nfs/dbraw/zinc/99/85/66/420998566.db2.gz	SMXGFTDZHPSRAM-AWEZNQCLSA-N	1	1	320.345	1.606	20	5		DDBDMO
CCOC(=O)[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC12COC2	ZINC000449366760	420998651	/nfs/dbraw/zinc/99/86/51/420998651.db2.gz	SMXGFTDZHPSRAM-CQSZACIVSA-N	1	1	320.345	1.606	20	5		DDBDMO
CC(C)[C@@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1C	ZINC000487084097	421001458	/nfs/dbraw/zinc/00/14/58/421001458.db2.gz	JDARCFMHSUJSTC-NSHDSACASA-N	1	1	304.354	1.414	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@H]2CCCC[N@H+]2CCO)c(F)c1	ZINC000449394344	421004150	/nfs/dbraw/zinc/00/41/50/421004150.db2.gz	NTLPDSHHHAJCSZ-CQSZACIVSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@H]2CCCC[N@@H+]2CCO)c(F)c1	ZINC000449394344	421004153	/nfs/dbraw/zinc/00/41/53/421004153.db2.gz	NTLPDSHHHAJCSZ-CQSZACIVSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)c1	ZINC000449433160	421011170	/nfs/dbraw/zinc/01/11/70/421011170.db2.gz	LASCQXKMVCSYIC-IMJJTQAJSA-N	1	1	306.362	1.957	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]1CCNc1nccc2cc([N+](=O)[O-])ccc21	ZINC000450310923	421180527	/nfs/dbraw/zinc/18/05/27/421180527.db2.gz	CBZRTBADRNLGMI-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1CCNc1nccc2cc([N+](=O)[O-])ccc21	ZINC000450310923	421180528	/nfs/dbraw/zinc/18/05/28/421180528.db2.gz	CBZRTBADRNLGMI-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
CC[N@H+](Cc1ccc(C)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000524753474	421268924	/nfs/dbraw/zinc/26/89/24/421268924.db2.gz	JDNNQPZMJDOJPX-MRXNPFEDSA-N	1	1	318.377	1.983	20	5		DDBDMO
CNc1nc(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000515130797	421480881	/nfs/dbraw/zinc/48/08/81/421480881.db2.gz	MLQQIIPQAFRTSB-NSHDSACASA-N	1	1	321.381	1.492	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])CC1	ZINC000563374315	421494407	/nfs/dbraw/zinc/49/44/07/421494407.db2.gz	ODGSCIFUQGEDAB-UHFFFAOYSA-N	1	1	321.381	1.518	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000516379331	421542318	/nfs/dbraw/zinc/54/23/18/421542318.db2.gz	IAYHNTOFSBYVOH-JTQLQIEISA-N	1	1	321.333	1.538	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H](C)C1	ZINC000554128839	421632730	/nfs/dbraw/zinc/63/27/30/421632730.db2.gz	SWZXXCGQGZBWGH-OBJOEFQTSA-N	1	1	320.393	1.736	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000571302463	421704548	/nfs/dbraw/zinc/70/45/48/421704548.db2.gz	PBIANFHOIRTEGL-UHFFFAOYSA-N	1	1	305.378	1.998	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(OC)c1	ZINC000574665411	422154824	/nfs/dbraw/zinc/15/48/24/422154824.db2.gz	GKSKABOSNJLVFG-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(OC)c1	ZINC000574665411	422154830	/nfs/dbraw/zinc/15/48/30/422154830.db2.gz	GKSKABOSNJLVFG-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000577076012	422381605	/nfs/dbraw/zinc/38/16/05/422381605.db2.gz	AUGBPNDDGOJNLL-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000577076012	422381611	/nfs/dbraw/zinc/38/16/11/422381611.db2.gz	AUGBPNDDGOJNLL-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1c(N)cccc1[N+](=O)[O-])C2	ZINC000597710151	422389868	/nfs/dbraw/zinc/38/98/68/422389868.db2.gz	IJXUXVJQJFKMKS-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(NCC[N@@H+]3CC[C@@H](O)C3)ccc2c1	ZINC000599175510	422404421	/nfs/dbraw/zinc/40/44/21/422404421.db2.gz	DKRKSDKCRMYNMU-CYBMUJFWSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589559	422600945	/nfs/dbraw/zinc/60/09/45/422600945.db2.gz	ZVUCRLSZDBDBCQ-HIFRSBDPSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589559	422600954	/nfs/dbraw/zinc/60/09/54/422600954.db2.gz	ZVUCRLSZDBDBCQ-HIFRSBDPSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589559	422600960	/nfs/dbraw/zinc/60/09/60/422600960.db2.gz	ZVUCRLSZDBDBCQ-HIFRSBDPSA-N	1	1	323.393	1.361	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000342144136	271318797	/nfs/dbraw/zinc/31/87/97/271318797.db2.gz	XDTNIHXUVWSWKU-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000344621520	272072648	/nfs/dbraw/zinc/07/26/48/272072648.db2.gz	SWJUAFZLFKQCJF-LBPRGKRZSA-N	1	1	321.381	1.422	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000345282722	272208293	/nfs/dbraw/zinc/20/82/93/272208293.db2.gz	GQZPHLHXPBGOES-VHSXEESVSA-N	1	1	309.370	1.483	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3ncc([N+](=O)[O-])cc3Cl)C[C@H]21	ZINC000284414796	277130113	/nfs/dbraw/zinc/13/01/13/277130113.db2.gz	BUPBFPSAYNBTBK-NEPJUHHUSA-N	1	1	312.757	1.553	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc(-c4ccc([N+](=O)[O-])cc4)no3)C[C@@H]21	ZINC000450782297	277150069	/nfs/dbraw/zinc/15/00/69/277150069.db2.gz	WZZBLNKKMZIJBT-YPMHNXCESA-N	1	1	315.333	1.785	20	5		DDBDMO
C[C@@H](C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000192464654	278200658	/nfs/dbraw/zinc/20/06/58/278200658.db2.gz	OLQVQBQVYJPGRG-UTUOFQBUSA-N	1	1	321.352	1.857	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000122739634	281160594	/nfs/dbraw/zinc/16/05/94/281160594.db2.gz	IYBYMRQMYUVXHS-CYBMUJFWSA-N	1	1	309.391	1.648	20	5		DDBDMO
O=C([C@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1)N1CCCC1	ZINC000357937511	299025737	/nfs/dbraw/zinc/02/57/37/299025737.db2.gz	WYPILQZYANJAFS-ZDUSSCGKSA-N	1	1	321.381	1.126	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000364173984	300353694	/nfs/dbraw/zinc/35/36/94/300353694.db2.gz	KKHOUPHJNCJFPF-XQLPTFJDSA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000364173984	300353695	/nfs/dbraw/zinc/35/36/95/300353695.db2.gz	KKHOUPHJNCJFPF-XQLPTFJDSA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000364173984	300353697	/nfs/dbraw/zinc/35/36/97/300353697.db2.gz	KKHOUPHJNCJFPF-XQLPTFJDSA-N	1	1	318.377	1.198	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c1	ZINC000368590607	301060001	/nfs/dbraw/zinc/06/00/01/301060001.db2.gz	KZNRBRWFFIZYPJ-IAQYHMDHSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC23CCOCC3)c1	ZINC000368893131	301102298	/nfs/dbraw/zinc/10/22/98/301102298.db2.gz	AQHOFBBJLJFWFB-AWEZNQCLSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC12CCOCC2	ZINC000368898025	301103942	/nfs/dbraw/zinc/10/39/42/301103942.db2.gz	VVPNJTVIEPMMBB-ZDUSSCGKSA-N	1	1	322.361	1.589	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000368976932	301116319	/nfs/dbraw/zinc/11/63/19/301116319.db2.gz	ZVOQIXYJCRFJCJ-RZFFKMDDSA-N	1	1	319.361	1.214	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1	ZINC000370285624	301308816	/nfs/dbraw/zinc/30/88/16/301308816.db2.gz	ONIMVCQAXAVSMO-CHWSQXEVSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)c1	ZINC000370285624	301308818	/nfs/dbraw/zinc/30/88/18/301308818.db2.gz	ONIMVCQAXAVSMO-CHWSQXEVSA-N	1	1	306.366	1.842	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@@H]2CCCN(c3[nH+]cnc4[nH]ccc43)C2)c1	ZINC000375381726	301928860	/nfs/dbraw/zinc/92/88/60/301928860.db2.gz	TZOBATKCRUQYNJ-SNVBAGLBSA-N	1	1	313.321	1.904	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000376512277	302087840	/nfs/dbraw/zinc/08/78/40/302087840.db2.gz	JDHRWABTFYZNIQ-LBPRGKRZSA-N	1	1	304.350	1.487	20	5		DDBDMO
O=C(N[C@H]1CCCC[C@H]1[NH+]1CCOCC1)c1cc([N+](=O)[O-])c[nH]1	ZINC000531918226	303265898	/nfs/dbraw/zinc/26/58/98/303265898.db2.gz	APWQKZBWFCKHIR-GXTWGEPZSA-N	1	1	322.365	1.296	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532144683	303277198	/nfs/dbraw/zinc/27/71/98/303277198.db2.gz	GWLFHOYYWXIAFL-UHFFFAOYSA-N	1	1	303.322	1.705	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])c1	ZINC000370864271	307138780	/nfs/dbraw/zinc/13/87/80/307138780.db2.gz	YUCZNQZSSDSKOF-SNVBAGLBSA-N	1	1	315.333	1.647	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000370864271	307138781	/nfs/dbraw/zinc/13/87/81/307138781.db2.gz	YUCZNQZSSDSKOF-SNVBAGLBSA-N	1	1	315.333	1.647	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000373972941	307198743	/nfs/dbraw/zinc/19/87/43/307198743.db2.gz	KXMQDAHWEVVUBZ-XHSDSOJGSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000373972941	307198744	/nfs/dbraw/zinc/19/87/44/307198744.db2.gz	KXMQDAHWEVVUBZ-XHSDSOJGSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000373972941	307198745	/nfs/dbraw/zinc/19/87/45/307198745.db2.gz	KXMQDAHWEVVUBZ-XHSDSOJGSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(CC[N@H+]1CCCOCC1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000375366178	307224524	/nfs/dbraw/zinc/22/45/24/307224524.db2.gz	JGPTYVNGPRPYQD-UHFFFAOYSA-N	1	1	311.313	1.785	20	5		DDBDMO
Cc1nc(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)ccc1[N+](=O)[O-]	ZINC000376666744	307252574	/nfs/dbraw/zinc/25/25/74/307252574.db2.gz	VKKXJNTYBVKYAW-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1nc(N[C@H]2CCN(C3CC[NH+](C)CC3)C2)ccc1[N+](=O)[O-]	ZINC000376666744	307252575	/nfs/dbraw/zinc/25/25/75/307252575.db2.gz	VKKXJNTYBVKYAW-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
O=C(N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])[nH]1	ZINC000531665063	307621856	/nfs/dbraw/zinc/62/18/56/307621856.db2.gz	PIVDEXDLUCWNTJ-AAEUAGOBSA-N	1	1	322.365	1.296	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNc1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC000564893259	308010850	/nfs/dbraw/zinc/01/08/50/308010850.db2.gz	KSGQDOJZQFMDII-CYBMUJFWSA-N	1	1	319.409	1.526	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC000564893259	308010851	/nfs/dbraw/zinc/01/08/51/308010851.db2.gz	KSGQDOJZQFMDII-CYBMUJFWSA-N	1	1	319.409	1.526	20	5		DDBDMO
COc1ccc(CNC(=O)C[N@H+]2CCC(C)(C)C2)cc1[N+](=O)[O-]	ZINC000567364716	308079097	/nfs/dbraw/zinc/07/90/97/308079097.db2.gz	SAXSIVFHVKHUCL-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
Cc1c(CN2C[C@H](C)[N@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000419331796	533847925	/nfs/dbraw/zinc/84/79/25/533847925.db2.gz	RUTJOXPZBVJYDN-QWHCGFSZSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1c(CNC(=O)[C@H](C)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000331160256	533862825	/nfs/dbraw/zinc/86/28/25/533862825.db2.gz	ZZGGGQYJDFYMEW-ZDUSSCGKSA-N	1	1	320.393	1.155	20	5		DDBDMO
Cn1nnc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1	ZINC000494355678	534335848	/nfs/dbraw/zinc/33/58/48/534335848.db2.gz	HAPPXZWNNHTNFT-AAEUAGOBSA-N	1	1	316.365	1.619	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000736571073	598499178	/nfs/dbraw/zinc/49/91/78/598499178.db2.gz	PHRRYZCGNLGANA-SECBINFHSA-N	1	1	318.341	1.066	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc(-c3nn[nH]n3)c([N+](=O)[O-])c2)CC1	ZINC000821266709	606645515	/nfs/dbraw/zinc/64/55/15/606645515.db2.gz	GLUHOHHVDHQSRG-UHFFFAOYSA-N	1	1	317.353	1.307	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C1(C(N)=O)CCCC1	ZINC000746474942	700026151	/nfs/dbraw/zinc/02/61/51/700026151.db2.gz	HYWQBLQLCKTLIY-UHFFFAOYSA-N	1	1	320.349	1.229	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCS(=O)(=O)C2)c1	ZINC000035368065	696128625	/nfs/dbraw/zinc/12/86/25/696128625.db2.gz	PRGQZXFWVASXNX-SECBINFHSA-N	1	1	304.755	1.525	20	5		DDBDMO
C[N@H+](CC1CCOCC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000124758800	696745934	/nfs/dbraw/zinc/74/59/34/696745934.db2.gz	OECVWQLLSIQBKH-UHFFFAOYSA-N	1	1	321.333	1.819	20	5		DDBDMO
C[N@@H+](CC1CCOCC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000124758800	696745935	/nfs/dbraw/zinc/74/59/35/696745935.db2.gz	OECVWQLLSIQBKH-UHFFFAOYSA-N	1	1	321.333	1.819	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccc(F)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983649727	697286482	/nfs/dbraw/zinc/28/64/82/697286482.db2.gz	QUGMIYUTLJXSGW-NMFUWQPSSA-N	1	1	321.352	1.475	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000195157969	697732766	/nfs/dbraw/zinc/73/27/66/697732766.db2.gz	CDONLMAPKWWTGA-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776588827	698122971	/nfs/dbraw/zinc/12/29/71/698122971.db2.gz	CFHPUYIXBYEGLS-CZUORRHYSA-N	1	1	307.394	1.902	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN2CC[NH+]([C@@H]3CCOC3)CC2)cc1	ZINC000776593481	698124302	/nfs/dbraw/zinc/12/43/02/698124302.db2.gz	JVTARQUHJAORIA-HZPDHXFCSA-N	1	1	321.377	1.035	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000780864926	698564548	/nfs/dbraw/zinc/56/45/48/698564548.db2.gz	HCWFWBSYDGOKMP-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
COCC[N@@H+](C)CCC[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526261	699321433	/nfs/dbraw/zinc/32/14/33/699321433.db2.gz	ONTOHIGVDKCQEX-GFCCVEGCSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCC[N@H+](C)CCCN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526261	699321435	/nfs/dbraw/zinc/32/14/35/699321435.db2.gz	ONTOHIGVDKCQEX-GFCCVEGCSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCC[N@@H+](C)CCCN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526261	699321438	/nfs/dbraw/zinc/32/14/38/699321438.db2.gz	ONTOHIGVDKCQEX-GFCCVEGCSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCCN(C)CCC[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000788526261	699321440	/nfs/dbraw/zinc/32/14/40/699321440.db2.gz	ONTOHIGVDKCQEX-GFCCVEGCSA-N	1	1	310.398	1.796	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+](CCCCCO)CC1	ZINC000727025439	699395140	/nfs/dbraw/zinc/39/51/40/699395140.db2.gz	CTQAFNHFRWZRDA-UHFFFAOYSA-N	1	1	321.377	1.515	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@@H](O)C2CC2)CC1	ZINC000736221333	699721220	/nfs/dbraw/zinc/72/12/20/699721220.db2.gz	XNBNAOSVTJVGNK-OAHLLOKOSA-N	1	1	319.361	1.124	20	5		DDBDMO
C[C@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000742195527	699864904	/nfs/dbraw/zinc/86/49/04/699864904.db2.gz	PQWAYABJTPZLTN-NSHDSACASA-N	1	1	309.391	1.849	20	5		DDBDMO
C[C@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000742195527	699864906	/nfs/dbraw/zinc/86/49/06/699864906.db2.gz	PQWAYABJTPZLTN-NSHDSACASA-N	1	1	309.391	1.849	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000744408200	699948247	/nfs/dbraw/zinc/94/82/47/699948247.db2.gz	OHAADNHEJMQPQW-UHFFFAOYSA-N	1	1	317.349	1.927	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801893265	700351052	/nfs/dbraw/zinc/35/10/52/700351052.db2.gz	UKUWOTYFXNCDKV-UHFFFAOYSA-N	1	1	312.345	1.778	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000753803832	700458193	/nfs/dbraw/zinc/45/81/93/700458193.db2.gz	ARBVAMVTDIZXLW-UHFFFAOYSA-N	1	1	320.353	1.063	20	5		DDBDMO
C[C@@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C	ZINC000761080656	700841191	/nfs/dbraw/zinc/84/11/91/700841191.db2.gz	VBJCBSXPSPIZPJ-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
CC[N@@H+]1CCCC[C@H]1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000761400967	700859039	/nfs/dbraw/zinc/85/90/39/700859039.db2.gz	CPDBIUITCAKNLY-ZDUSSCGKSA-N	1	1	323.349	1.174	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000761400967	700859041	/nfs/dbraw/zinc/85/90/41/700859041.db2.gz	CPDBIUITCAKNLY-ZDUSSCGKSA-N	1	1	323.349	1.174	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000763876569	700951472	/nfs/dbraw/zinc/95/14/72/700951472.db2.gz	UYGFDXFLXQIWBJ-GJZGRUSLSA-N	1	1	312.366	1.346	20	5		DDBDMO
C[C@H]1C[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000768843149	701208773	/nfs/dbraw/zinc/20/87/73/701208773.db2.gz	RIAPOFMRZYXWAD-DTWKUNHWSA-N	1	1	319.408	1.417	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1(C)C	ZINC000808005998	701494142	/nfs/dbraw/zinc/49/41/42/701494142.db2.gz	OKLYTOLXSBBQTF-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1(C)C	ZINC000808005998	701494143	/nfs/dbraw/zinc/49/41/43/701494143.db2.gz	OKLYTOLXSBBQTF-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
O=C(N[C@H](C[NH+]1CCCC1)c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839502368	701718833	/nfs/dbraw/zinc/71/88/33/701718833.db2.gz	IIVNKZHHWDBSJX-RBSFLKMASA-N	1	1	303.362	1.605	20	5		DDBDMO
C[C@@H]1[C@H](C)OCCN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867970143	701863226	/nfs/dbraw/zinc/86/32/26/701863226.db2.gz	WWQQIXYKRLNUPJ-JRPNMDOOSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[C@@H]1CN(Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C[C@H](C)[N@@H+]1C	ZINC000840090254	701963137	/nfs/dbraw/zinc/96/31/37/701963137.db2.gz	NVMDEWZEJMIFTH-PHIMTYICSA-N	1	1	320.349	1.485	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840458602	702116902	/nfs/dbraw/zinc/11/69/02/702116902.db2.gz	CVGROMQSKOONJR-REBRKWNGSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000840458602	702116907	/nfs/dbraw/zinc/11/69/07/702116907.db2.gz	CVGROMQSKOONJR-REBRKWNGSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840458602	702116911	/nfs/dbraw/zinc/11/69/11/702116911.db2.gz	CVGROMQSKOONJR-REBRKWNGSA-N	1	1	303.362	1.431	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]2CSC[C@@H]2C1	ZINC000879564388	706718645	/nfs/dbraw/zinc/71/86/45/706718645.db2.gz	ZQNKABISTZYTBL-RYUDHWBXSA-N	1	1	309.391	1.441	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@H]3CN(C(C)=O)C[C@H]3C2)cc1[N+](=O)[O-]	ZINC000880308701	706935637	/nfs/dbraw/zinc/93/56/37/706935637.db2.gz	KZZWHPIHHJNYSI-OKILXGFUSA-N	1	1	319.361	1.514	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823968185	705347104	/nfs/dbraw/zinc/34/71/04/705347104.db2.gz	MNTNISDNQSXLPM-NXEZZACHSA-N	1	1	307.354	1.733	20	5		DDBDMO
Nc1ccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc1[N+](=O)[O-]	ZINC000863033757	705853435	/nfs/dbraw/zinc/85/34/35/705853435.db2.gz	MFORKNSZYOBRSN-CYBMUJFWSA-N	1	1	318.377	1.924	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2[C@@H](CC[N@@H+]2C)C1	ZINC000827328346	705976176	/nfs/dbraw/zinc/97/61/76/705976176.db2.gz	DWTPPJCEGZMBLM-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC[C@H]21	ZINC000827339434	705979917	/nfs/dbraw/zinc/97/99/17/705979917.db2.gz	TUPMZCUBSQPLLA-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](c3nccn3C)C2)c([N+](=O)[O-])n1	ZINC000877481125	706119008	/nfs/dbraw/zinc/11/90/08/706119008.db2.gz	VSUMMNRUUWXCCA-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000877611813	706159252	/nfs/dbraw/zinc/15/92/52/706159252.db2.gz	ATMDAGAZLQVYMH-CQSZACIVSA-N	1	1	305.378	1.462	20	5		DDBDMO
COC(=O)Cc1ccc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000828991247	706269494	/nfs/dbraw/zinc/26/94/94/706269494.db2.gz	JILOIGGWCUXALI-SWLSCSKDSA-N	1	1	319.361	1.451	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1	ZINC000865998593	706589610	/nfs/dbraw/zinc/58/96/10/706589610.db2.gz	NZBNKLIETQHDBD-VIFPVBQESA-N	1	1	314.773	1.900	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CC[C@@H](CF)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000880296670	706931746	/nfs/dbraw/zinc/93/17/46/706931746.db2.gz	FSVYVZSPYRBSOS-FZMZJTMJSA-N	1	1	307.325	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1C[C@@H](O)CC2(CCOCC2)C1	ZINC000880584088	707027105	/nfs/dbraw/zinc/02/71/05/707027105.db2.gz	DWHFYUYSASOAIF-AWEZNQCLSA-N	1	1	306.362	1.958	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1Cn1cc(C[NH+]2CCCC2)nn1	ZINC000881226502	707158762	/nfs/dbraw/zinc/15/87/62/707158762.db2.gz	PHDNOTBNBQASNW-UHFFFAOYSA-N	1	1	305.313	1.970	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1ccc([N+](=O)[O-])c2nonc21	ZINC000872780111	707596669	/nfs/dbraw/zinc/59/66/69/707596669.db2.gz	JPCLUSJEILYYIA-NXEZZACHSA-N	1	1	303.322	1.804	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000837478087	707659564	/nfs/dbraw/zinc/65/95/64/707659564.db2.gz	SNEBUNMUULEAOB-ZDUSSCGKSA-N	1	1	324.381	1.988	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000882489927	707660041	/nfs/dbraw/zinc/66/00/41/707660041.db2.gz	HKEQPIFGYNFZRC-JTQLQIEISA-N	1	1	307.306	1.148	20	5		DDBDMO
CC[NH+](CC)Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC000839472360	708050207	/nfs/dbraw/zinc/05/02/07/708050207.db2.gz	OWZLTZNEBMFMTJ-HUUCEWRRSA-N	1	1	305.378	1.810	20	5		DDBDMO
C[C@@H](CNC(=O)NC[C@H]1CC[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000896619910	708098912	/nfs/dbraw/zinc/09/89/12/708098912.db2.gz	OMGMOUBJDIKLFS-NWDGAFQWSA-N	1	1	306.366	1.702	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896912145	708180661	/nfs/dbraw/zinc/18/06/61/708180661.db2.gz	OWFPWHPIMGVQTQ-BMIGLBTASA-N	1	1	304.350	1.082	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885980285	708675448	/nfs/dbraw/zinc/67/54/48/708675448.db2.gz	XXJRVNAKPZMFNO-CYBMUJFWSA-N	1	1	320.393	1.974	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885980285	708675451	/nfs/dbraw/zinc/67/54/51/708675451.db2.gz	XXJRVNAKPZMFNO-CYBMUJFWSA-N	1	1	320.393	1.974	20	5		DDBDMO
CC(=O)NC1CCC([N@@H+](C)Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886125301	708702312	/nfs/dbraw/zinc/70/23/12/708702312.db2.gz	NLOXSPSGUFWJMB-UHFFFAOYSA-N	1	1	306.366	1.869	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](n2ccnn2)CC1	ZINC000886281193	708735088	/nfs/dbraw/zinc/73/50/88/708735088.db2.gz	UOLBDRODCAYVDC-ZDUSSCGKSA-N	1	1	302.338	1.809	20	5		DDBDMO
Cc1cccc(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)c1[N+](=O)[O-]	ZINC000887936630	709172165	/nfs/dbraw/zinc/17/21/65/709172165.db2.gz	RAORHTCUYVMZRZ-WBMJQRKESA-N	1	1	303.362	1.927	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928430892	713192310	/nfs/dbraw/zinc/19/23/10/713192310.db2.gz	JUQJTQLZXFDYKF-BSLXNSKLSA-N	1	1	303.362	1.907	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOC(=O)c2cc([N+](=O)[O-])cn2C)CCO1	ZINC000893390499	710631392	/nfs/dbraw/zinc/63/13/92/710631392.db2.gz	GXCKKOTVHSKIJJ-NSHDSACASA-N	1	1	311.338	1.201	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C	ZINC000928447858	713201294	/nfs/dbraw/zinc/20/12/94/713201294.db2.gz	AHXPGXYLZZGPRL-RNCFNFMXSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000928448993	713201516	/nfs/dbraw/zinc/20/15/16/713201516.db2.gz	DGOWJJVFLKARCK-WCBMZHEXSA-N	1	1	307.306	1.146	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2	ZINC000894598620	711202363	/nfs/dbraw/zinc/20/23/63/711202363.db2.gz	DFUQMNAIZUJEGB-CHWSQXEVSA-N	1	1	321.381	1.384	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000896096664	711675475	/nfs/dbraw/zinc/67/54/75/711675475.db2.gz	CBRXXGYNUOADOP-UHFFFAOYSA-N	1	1	309.366	1.520	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000913931063	713321469	/nfs/dbraw/zinc/32/14/69/713321469.db2.gz	QGRFUOVZSOMDMA-CYBMUJFWSA-N	1	1	307.354	1.010	20	5		DDBDMO
Cc1c(CNC(=O)C[C@@]2(O)CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000907695767	712615173	/nfs/dbraw/zinc/61/51/73/712615173.db2.gz	PMMQYGUPWOKQPD-INIZCTEOSA-N	1	1	321.377	1.366	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000917480109	713499389	/nfs/dbraw/zinc/49/93/89/713499389.db2.gz	JFACCYBGUCYSHZ-LLVKDONJSA-N	1	1	304.306	1.397	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000917480109	713499391	/nfs/dbraw/zinc/49/93/91/713499391.db2.gz	JFACCYBGUCYSHZ-LLVKDONJSA-N	1	1	304.306	1.397	20	5		DDBDMO
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCC[N@H+](CC[N+](=O)[O-])C1	ZINC000929887084	713713373	/nfs/dbraw/zinc/71/33/73/713713373.db2.gz	JPVSZFVDWYBHOW-SNVBAGLBSA-N	1	1	312.757	1.662	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCO[C@H]3CCOC3)C2)nc1	ZINC000929988913	713729776	/nfs/dbraw/zinc/72/97/76/713729776.db2.gz	OOYWMASFHLUNNZ-OCCSQVGLSA-N	1	1	322.365	1.282	20	5		DDBDMO
COc1cccc([C@@H]2[C@@H](NCC[N+](=O)[O-])CC[N@@H+]2C2CC2)c1	ZINC000930353779	713812079	/nfs/dbraw/zinc/81/20/79/713812079.db2.gz	KGWLYTVHIBTOOE-JKSUJKDBSA-N	1	1	305.378	1.839	20	5		DDBDMO
O=[N+]([O-])CC[NH2+][C@H](CCO)c1cccc(OC(F)(F)F)c1	ZINC000930816390	713927099	/nfs/dbraw/zinc/92/70/99/713927099.db2.gz	KVVIMHIKIGXUST-LLVKDONJSA-N	1	1	308.256	1.875	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000931207612	714036686	/nfs/dbraw/zinc/03/66/86/714036686.db2.gz	MOEHFMARTWZVBV-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
COc1cc(C[NH2+][C@H]2C(=O)NCC2(C)C)c([N+](=O)[O-])cc1F	ZINC000931655378	714150792	/nfs/dbraw/zinc/15/07/92/714150792.db2.gz	YLORNHQIZMQYGR-LBPRGKRZSA-N	1	1	311.313	1.357	20	5		DDBDMO
COC1(OC)CCOC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000931675905	714158278	/nfs/dbraw/zinc/15/82/78/714158278.db2.gz	RJAYMJOBJVIHCH-CYBMUJFWSA-N	1	1	314.313	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](C4OCCO4)C3)nc2c1	ZINC000932001120	714229726	/nfs/dbraw/zinc/22/97/26/714229726.db2.gz	KMJQDXGDKYVTPB-SNVBAGLBSA-N	1	1	318.333	1.666	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](C4OCCO4)C3)nc2c1	ZINC000932001120	714229729	/nfs/dbraw/zinc/22/97/29/714229729.db2.gz	KMJQDXGDKYVTPB-SNVBAGLBSA-N	1	1	318.333	1.666	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C[NH3+]	ZINC000923497704	714378812	/nfs/dbraw/zinc/37/88/12/714378812.db2.gz	CMVOTGKBZAZCKN-OLZOCXBDSA-N	1	1	320.393	1.474	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H]1C(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000923888152	714484833	/nfs/dbraw/zinc/48/48/33/714484833.db2.gz	BYMHKKQBTGBGJV-ZDUSSCGKSA-N	1	1	323.349	1.173	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@H]1CC[C@@H]2C1	ZINC000933709696	714652889	/nfs/dbraw/zinc/65/28/89/714652889.db2.gz	UMDLCUOOHJWRKQ-PTNZTPPNSA-N	1	1	320.393	1.520	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](Cc3nccs3)C2)c1	ZINC000934333747	714797002	/nfs/dbraw/zinc/79/70/02/714797002.db2.gz	QVYVEUAYTZZXPY-NSHDSACASA-N	1	1	307.379	1.812	20	5		DDBDMO
CC(C)C[NH+]1CCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])CC1	ZINC001164654436	719333849	/nfs/dbraw/zinc/33/38/49/719333849.db2.gz	PVRRVLOWBKLOGY-UHFFFAOYSA-N	1	1	314.773	1.660	20	5		DDBDMO
Cc1nc(C)c(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC001022063734	734368138	/nfs/dbraw/zinc/36/81/38/734368138.db2.gz	KGEPOXCWYXWQBL-WRWGMCAJSA-N	1	1	324.406	1.162	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nnc(CCC[N+](=O)[O-])n2C)C1	ZINC001121288399	782442655	/nfs/dbraw/zinc/44/26/55/782442655.db2.gz	CYDDJYPFDMKZFX-CYBMUJFWSA-N	1	1	324.429	1.193	20	5		DDBDMO
C[C@@H](c1nnc(N2CCC[N@H+](C(C)(C)C)CC2)n1C)[N+](=O)[O-]	ZINC001121388798	782486838	/nfs/dbraw/zinc/48/68/38/782486838.db2.gz	GTBLLUJGQLZLQR-NSHDSACASA-N	1	1	310.402	1.463	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@]3(CCN3c3ncccn3)C2)C1	ZINC001169019737	762199947	/nfs/dbraw/zinc/19/99/47/762199947.db2.gz	JEJZIQYLZAAPHA-IIAWOOMASA-N	1	1	317.393	1.577	20	5		DDBDMO
O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169026250	762203273	/nfs/dbraw/zinc/20/32/73/762203273.db2.gz	WOEASBNNHKOJIK-ILTLLKDXSA-N	1	1	307.394	1.519	20	5		DDBDMO
CC(C)NC(=O)N[C@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169052514	762207884	/nfs/dbraw/zinc/20/78/84/762207884.db2.gz	GSFVCUQYRVUDRY-IHRRRGAJSA-N	1	1	312.414	1.604	20	5		DDBDMO
COc1cccc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169053577	762208619	/nfs/dbraw/zinc/20/86/19/762208619.db2.gz	IZFUONYPSVFUIN-BFHYXJOUSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@H](N3CCOCC3)[C@@H](F)C2)C1	ZINC001169055292	762210054	/nfs/dbraw/zinc/21/00/54/762210054.db2.gz	PBRGGDSERKFASP-CBBWQLFWSA-N	1	1	315.389	1.176	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(CCOc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000823806414	758357382	/nfs/dbraw/zinc/35/73/82/758357382.db2.gz	YPMYHQJUKPTZBD-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000823806414	758357393	/nfs/dbraw/zinc/35/73/93/758357393.db2.gz	YPMYHQJUKPTZBD-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
CCCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001040699197	762652778	/nfs/dbraw/zinc/65/27/78/762652778.db2.gz	AERZAWWZMZNDRA-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1	ZINC001054265664	759369202	/nfs/dbraw/zinc/36/92/02/759369202.db2.gz	VBZBMNTVFUXNHS-HUUCEWRRSA-N	1	1	303.362	1.694	20	5		DDBDMO
CCC[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1	ZINC001054265664	759369209	/nfs/dbraw/zinc/36/92/09/759369209.db2.gz	VBZBMNTVFUXNHS-HUUCEWRRSA-N	1	1	303.362	1.694	20	5		DDBDMO
CCC[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1	ZINC001054265664	759369217	/nfs/dbraw/zinc/36/92/17/759369217.db2.gz	VBZBMNTVFUXNHS-HUUCEWRRSA-N	1	1	303.362	1.694	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]Cc2ccc(F)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086082441	760940177	/nfs/dbraw/zinc/94/01/77/760940177.db2.gz	OBRLJHJUKFVBDN-FAAHXZRKSA-N	1	1	321.352	1.475	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CCc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086084072	760945171	/nfs/dbraw/zinc/94/51/71/760945171.db2.gz	BIVXXNVEPIQHQK-ZMJPVWNMSA-N	1	1	323.418	1.440	20	5		DDBDMO
Cc1csc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)n1	ZINC001086363383	761492690	/nfs/dbraw/zinc/49/26/90/761492690.db2.gz	QUHXRIIMRORRRN-DDHJBXDOSA-N	1	1	324.406	1.101	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N(C)[C@@H]1CC[N@@H+](CC)C[C@@H]1C	ZINC001121698267	782631938	/nfs/dbraw/zinc/63/19/38/782631938.db2.gz	FMIPUTPRBXVRJO-NWDGAFQWSA-N	1	1	310.402	1.241	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC001097052858	771599298	/nfs/dbraw/zinc/59/92/98/771599298.db2.gz	BJVVSZGWKOOAHD-HAQNSBGRSA-N	1	1	321.381	1.391	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001135813381	771731767	/nfs/dbraw/zinc/73/17/67/771731767.db2.gz	DGQGAANPVMIXPO-LLVKDONJSA-N	1	1	321.381	1.566	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)c1	ZINC001093642030	774939583	/nfs/dbraw/zinc/93/95/83/774939583.db2.gz	HCCQOXPZZWQDDO-UHFFFAOYSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCN(C)c1ncccc1[N+](=O)[O-]	ZINC001100203974	775816580	/nfs/dbraw/zinc/81/65/80/775816580.db2.gz	OAVMLNPRNCQVPO-UHFFFAOYSA-N	1	1	323.397	1.273	20	5		DDBDMO
Cc1ccnc(NCCCNC(=O)C[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC001094456815	775894893	/nfs/dbraw/zinc/89/48/93/775894893.db2.gz	SBNBSFCNYFLIGA-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001101756588	777479157	/nfs/dbraw/zinc/47/91/57/777479157.db2.gz	FLJUHOZOPPDCNI-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
O=C1OCC[C@]12CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001177001138	778383705	/nfs/dbraw/zinc/38/37/05/778383705.db2.gz	BZDITDKELZAOGV-AWEZNQCLSA-N	1	1	321.289	1.642	20	5		DDBDMO
O=C1OCC[C@]12CC[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001177001138	778383713	/nfs/dbraw/zinc/38/37/13/778383713.db2.gz	BZDITDKELZAOGV-AWEZNQCLSA-N	1	1	321.289	1.642	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC001177513970	778630590	/nfs/dbraw/zinc/63/05/90/778630590.db2.gz	KYMQLGJOJFBONV-UHFFFAOYSA-N	1	1	306.297	1.923	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC001119984891	781709517	/nfs/dbraw/zinc/70/95/17/781709517.db2.gz	WZNLULNCDVLPPQ-STQMWFEESA-N	1	1	306.366	1.334	20	5		DDBDMO
CC[N@H+](CCNC(=O)c1cnco1)Cc1ccccc1[N+](=O)[O-]	ZINC001266406115	836214673	/nfs/dbraw/zinc/21/46/73/836214673.db2.gz	UZNDLCKGEVRCDA-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cnco1)Cc1ccccc1[N+](=O)[O-]	ZINC001266406115	836214680	/nfs/dbraw/zinc/21/46/80/836214680.db2.gz	UZNDLCKGEVRCDA-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3N)[C@@H]2C1	ZINC001142701853	861237257	/nfs/dbraw/zinc/23/72/57/861237257.db2.gz	GNQQVCJPBOJEIQ-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](C/C=C\Cl)CC1	ZINC001270878955	843004698	/nfs/dbraw/zinc/00/46/98/843004698.db2.gz	GTCFZSIPJWVKDQ-YNNXIKFZSA-N	1	1	315.801	1.622	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC001326838086	861647216	/nfs/dbraw/zinc/64/72/16/861647216.db2.gz	AFNXLKZGSVWKEA-UPJWGTAASA-N	1	1	308.382	1.630	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC001326838086	861647224	/nfs/dbraw/zinc/64/72/24/861647224.db2.gz	AFNXLKZGSVWKEA-UPJWGTAASA-N	1	1	308.382	1.630	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C(C)(C)C1	ZINC001156836517	863384520	/nfs/dbraw/zinc/38/45/20/863384520.db2.gz	KOPWEIPPPMRQDD-SNVBAGLBSA-N	1	1	307.354	1.032	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001156828108	863372156	/nfs/dbraw/zinc/37/21/56/863372156.db2.gz	JTIAZRBHDDXRMB-AWEZNQCLSA-N	1	1	320.393	1.853	20	5		DDBDMO
C[N@@H+]1CCC[C@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@@H]21	ZINC001157264859	863693271	/nfs/dbraw/zinc/69/32/71/863693271.db2.gz	GEPSZCIJDYKNPW-ONGXEEELSA-N	1	1	312.757	1.412	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@@H]21	ZINC001157264859	863693276	/nfs/dbraw/zinc/69/32/76/863693276.db2.gz	GEPSZCIJDYKNPW-ONGXEEELSA-N	1	1	312.757	1.412	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1N1CC[N@H+](C)CC12CCCC2	ZINC001158409835	864635985	/nfs/dbraw/zinc/63/59/85/864635985.db2.gz	BTWSTAGCMHQKLS-UHFFFAOYSA-N	1	1	306.366	1.601	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001330963588	864740758	/nfs/dbraw/zinc/74/07/58/864740758.db2.gz	FOGSMMGTFHWSNE-AWEZNQCLSA-N	1	1	304.350	1.714	20	5		DDBDMO
CC(=O)O[C@H]1C[C@@H]2C[C@H](Oc3cccnc3[N+](=O)[O-])C[C@H]1[N@H+]2C	ZINC001225629919	881944417	/nfs/dbraw/zinc/94/44/17/881944417.db2.gz	SUPDTKQTLZJECC-FMSGJZPZSA-N	1	1	321.333	1.535	20	5		DDBDMO
O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC001324437770	867279614	/nfs/dbraw/zinc/27/96/14/867279614.db2.gz	BXZIUFYWYHXUNM-HUUCEWRRSA-N	1	1	319.361	1.325	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](C)[N@H+]1CCC[C@H](C)C1	ZINC001334111557	867303393	/nfs/dbraw/zinc/30/33/93/867303393.db2.gz	VQFUAHYIAXTKMY-RYUDHWBXSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)no1	ZINC001325147783	867819848	/nfs/dbraw/zinc/81/98/48/867819848.db2.gz	NKHVAGSBBZOYGZ-UHFFFAOYSA-N	1	1	316.317	1.800	20	5		DDBDMO
Cc1nc(NCCCN2CCC[N@H+](C)CC2)ncc1[N+](=O)[O-]	ZINC001325179654	867844699	/nfs/dbraw/zinc/84/46/99/867844699.db2.gz	HJIRTYBQDJLLBN-UHFFFAOYSA-N	1	1	308.386	1.133	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCCN(C)CC2)ncc1[N+](=O)[O-]	ZINC001325179654	867844705	/nfs/dbraw/zinc/84/47/05/867844705.db2.gz	HJIRTYBQDJLLBN-UHFFFAOYSA-N	1	1	308.386	1.133	20	5		DDBDMO
Cc1nc(NCCC[N@@H+]2CCCN(C)CC2)ncc1[N+](=O)[O-]	ZINC001325179654	867844717	/nfs/dbraw/zinc/84/47/17/867844717.db2.gz	HJIRTYBQDJLLBN-UHFFFAOYSA-N	1	1	308.386	1.133	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@]1(O)CCC[N@@H+](C)C1	ZINC001163063114	868047524	/nfs/dbraw/zinc/04/75/24/868047524.db2.gz	YFDYYDWDWYESQF-HNNXBMFYSA-N	1	1	322.365	1.422	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC001335442052	868299206	/nfs/dbraw/zinc/29/92/06/868299206.db2.gz	VWJSTCPDWTWLGM-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@@H]2CCN(CC3CC3)C2)c1[N+](=O)[O-]	ZINC001335442052	868299214	/nfs/dbraw/zinc/29/92/14/868299214.db2.gz	VWJSTCPDWTWLGM-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])cc1NCCn1cc[nH+]c1C	ZINC001163932736	868804138	/nfs/dbraw/zinc/80/41/38/868804138.db2.gz	AWKPNSPZNONZQU-UHFFFAOYSA-N	1	1	305.294	1.393	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1ccc([N+](=O)[O-])cc1C(N)=O	ZINC001226173994	882251520	/nfs/dbraw/zinc/25/15/20/882251520.db2.gz	VTTMPCGUKWSSCR-QHBPRCKVSA-N	1	1	319.361	1.803	20	5		DDBDMO
Cc1cc(NCC2(N(C)C)CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC001164210350	869017344	/nfs/dbraw/zinc/01/73/44/869017344.db2.gz	BRIGVIIICLNFRW-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N[C@@H]1CCC[N@H+]2CCSC[C@H]12	ZINC001336836578	869174087	/nfs/dbraw/zinc/17/40/87/869174087.db2.gz	IOTRVKKINRNRJA-DGCLKSJQSA-N	1	1	308.407	1.712	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)cc1	ZINC001337289147	869417629	/nfs/dbraw/zinc/41/76/29/869417629.db2.gz	MJAGDDMYRLENJR-CSOLROPVSA-N	1	1	306.362	1.721	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNc2ccc([N+](=O)[O-])c(C(N)=O)n2)C1	ZINC001165260875	869475300	/nfs/dbraw/zinc/47/53/00/869475300.db2.gz	KMLSVRJIOOCEGR-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC001337735048	869611067	/nfs/dbraw/zinc/61/10/67/869611067.db2.gz	RRJVFKFRLHUQKX-LSDHHAIUSA-N	1	1	318.377	1.993	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1C[C@@H](C)[N@@H+](CC)C[C@H]1C	ZINC001340012696	870838228	/nfs/dbraw/zinc/83/82/28/870838228.db2.gz	TVFQQSITVPWUBU-CHWSQXEVSA-N	1	1	324.429	1.426	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)NCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC001341343888	871614733	/nfs/dbraw/zinc/61/47/33/871614733.db2.gz	JFYXXXOYBVLAAJ-QEJZJMRPSA-N	1	1	318.377	1.734	20	5		DDBDMO
CC(C)CC[NH+]1CCC(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001319019243	872399727	/nfs/dbraw/zinc/39/97/27/872399727.db2.gz	QQDHQIDUQZRYSY-HUUCEWRRSA-N	1	1	311.426	1.916	20	5		DDBDMO
CNc1nccc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC001349784650	875365841	/nfs/dbraw/zinc/36/58/41/875365841.db2.gz	LENVALQPGXSWMK-NSHDSACASA-N	1	1	319.365	1.342	20	5		DDBDMO
C[N@@H+]1CC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001227498051	883046878	/nfs/dbraw/zinc/04/68/78/883046878.db2.gz	KPKOBEHVNDUHIT-MRVPVSSYSA-N	1	1	312.238	1.494	20	5		DDBDMO
C[N@H+]1CC[C@@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001227498051	883046895	/nfs/dbraw/zinc/04/68/95/883046895.db2.gz	KPKOBEHVNDUHIT-MRVPVSSYSA-N	1	1	312.238	1.494	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c1[N+](=O)[O-]	ZINC001352971972	877047103	/nfs/dbraw/zinc/04/71/03/877047103.db2.gz	YHXZOYKECKIWJG-SNVBAGLBSA-N	1	1	321.381	1.715	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C3CCCC3)[C@H](C)C2)c1[N+](=O)[O-]	ZINC001352971972	877047120	/nfs/dbraw/zinc/04/71/20/877047120.db2.gz	YHXZOYKECKIWJG-SNVBAGLBSA-N	1	1	321.381	1.715	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c1[N+](=O)[O-]	ZINC001352971972	877047133	/nfs/dbraw/zinc/04/71/33/877047133.db2.gz	YHXZOYKECKIWJG-SNVBAGLBSA-N	1	1	321.381	1.715	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCc2c(C(=O)OC)cccc2[N+](=O)[O-])C1	ZINC001222773192	880693063	/nfs/dbraw/zinc/69/30/63/880693063.db2.gz	IJHJJMAVWWEDCR-LLVKDONJSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@H](O[C@@H](C(=O)OC)c2ccccc2[N+](=O)[O-])C1	ZINC001223641647	881038229	/nfs/dbraw/zinc/03/82/29/881038229.db2.gz	BWAWFJWQFFSOLE-SMDDNHRTSA-N	1	1	308.334	1.920	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228808570	883679423	/nfs/dbraw/zinc/67/94/23/883679423.db2.gz	CBCBNWVUYDESCG-SECBINFHSA-N	1	1	310.306	1.560	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228808570	883679429	/nfs/dbraw/zinc/67/94/29/883679429.db2.gz	CBCBNWVUYDESCG-SECBINFHSA-N	1	1	310.306	1.560	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H]1O	ZINC001254474693	896456679	/nfs/dbraw/zinc/45/66/79/896456679.db2.gz	SVXRQHSQOFNNGX-BLLLJJGKSA-N	1	1	305.378	1.876	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254602289	896527021	/nfs/dbraw/zinc/52/70/21/896527021.db2.gz	CRDDCHAPHCZJPJ-UONOGXRCSA-N	1	1	303.318	1.198	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254602289	896527034	/nfs/dbraw/zinc/52/70/34/896527034.db2.gz	CRDDCHAPHCZJPJ-UONOGXRCSA-N	1	1	303.318	1.198	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612476	896532977	/nfs/dbraw/zinc/53/29/77/896532977.db2.gz	WTGHAYFTYDWFBV-ZBFHGGJFSA-N	1	1	304.346	1.947	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC001295987745	916165374	/nfs/dbraw/zinc/16/53/74/916165374.db2.gz	CUFWUJWKNYMSMF-UHFFFAOYSA-N	1	1	300.278	1.615	20	5		DDBDMO
NC(=O)[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000079192529	185161290	/nfs/dbraw/zinc/16/12/90/185161290.db2.gz	JJDJNAUJKCBEJH-AWEZNQCLSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@](O)(C(F)F)C1	ZINC000451432902	231093518	/nfs/dbraw/zinc/09/35/18/231093518.db2.gz	OPRWQZOGZCNAHA-ZDUSSCGKSA-N	1	1	302.277	1.676	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)c(F)c1	ZINC000319271561	231182233	/nfs/dbraw/zinc/18/22/33/231182233.db2.gz	FBEGNJRNQYUUQH-AWEZNQCLSA-N	1	1	309.341	1.640	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](N3CCOCC3)C2)c(F)c1	ZINC000319271561	231182235	/nfs/dbraw/zinc/18/22/35/231182235.db2.gz	FBEGNJRNQYUUQH-AWEZNQCLSA-N	1	1	309.341	1.640	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC[C@@H](CCCO)C2)c1	ZINC000452135389	231316455	/nfs/dbraw/zinc/31/64/55/231316455.db2.gz	VWWUZLUEUSBKAP-HIFRSBDPSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC[C@@H](CCCO)C2)c1	ZINC000452135390	231316594	/nfs/dbraw/zinc/31/65/94/231316594.db2.gz	VWWUZLUEUSBKAP-UKRRQHHQSA-N	1	1	324.377	1.429	20	5		DDBDMO
CCOC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090549243	185302539	/nfs/dbraw/zinc/30/25/39/185302539.db2.gz	TUJQOAGNSNJDSH-ZDUSSCGKSA-N	1	1	309.366	1.505	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000255113671	282233357	/nfs/dbraw/zinc/23/33/57/282233357.db2.gz	BDECBPOLLZTWIK-FPLPWBNLSA-N	1	1	321.377	1.693	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)n1	ZINC000457082139	231982535	/nfs/dbraw/zinc/98/25/35/231982535.db2.gz	DOWWDCGNNOAHGB-LLVKDONJSA-N	1	1	309.370	1.366	20	5		DDBDMO
C[N@@H+](Cc1cnccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181963653	199367839	/nfs/dbraw/zinc/36/78/39/199367839.db2.gz	OLXVJFRTXVVZKQ-CYBMUJFWSA-N	1	1	318.333	1.257	20	5		DDBDMO
C[N@H+](Cc1cnccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181963653	199367841	/nfs/dbraw/zinc/36/78/41/199367841.db2.gz	OLXVJFRTXVVZKQ-CYBMUJFWSA-N	1	1	318.333	1.257	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C(N)=O)C(C)(C)C	ZINC000173342857	186178303	/nfs/dbraw/zinc/17/83/03/186178303.db2.gz	GLKFXPQJPUGLLK-ZDUSSCGKSA-N	1	1	322.365	1.331	20	5		DDBDMO
CC(C)(O)C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000189945979	186253135	/nfs/dbraw/zinc/25/31/35/186253135.db2.gz	BSFBPXXAWMFSMN-ZDUSSCGKSA-N	1	1	324.377	1.570	20	5		DDBDMO
CC[C@@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)CC[N@H+]1C[C@H](C)O	ZINC000266849092	186358407	/nfs/dbraw/zinc/35/84/07/186358407.db2.gz	QBOPVBYYCFYYRJ-QWHCGFSZSA-N	1	1	308.382	1.580	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000171651756	197961140	/nfs/dbraw/zinc/96/11/40/197961140.db2.gz	KFYBSRSFPXVESE-LLVKDONJSA-N	1	1	313.379	1.185	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](OCCO)C2)c1	ZINC000172298880	198073681	/nfs/dbraw/zinc/07/36/81/198073681.db2.gz	QHRMWKLIQDYILM-OAHLLOKOSA-N	1	1	310.350	1.447	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000026198155	352206407	/nfs/dbraw/zinc/20/64/07/352206407.db2.gz	GPOINSKHXWILSI-GZBFAFLISA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000026198155	352206411	/nfs/dbraw/zinc/20/64/11/352206411.db2.gz	GPOINSKHXWILSI-GZBFAFLISA-N	1	1	324.377	1.834	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046995086	352475419	/nfs/dbraw/zinc/47/54/19/352475419.db2.gz	DHVZYKURDPKTGB-CHWSQXEVSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+](C)C1CC1	ZINC000067717839	353064063	/nfs/dbraw/zinc/06/40/63/353064063.db2.gz	HSVGKVAMVXBPOD-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000173636174	198234248	/nfs/dbraw/zinc/23/42/48/198234248.db2.gz	OTKJRWGVHQHGSM-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000072714446	353210678	/nfs/dbraw/zinc/21/06/78/353210678.db2.gz	JRSVQZPDZCJNEG-SMDDNHRTSA-N	1	1	307.350	1.403	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000174643868	198364829	/nfs/dbraw/zinc/36/48/29/198364829.db2.gz	KLZHNMDTAZWZQP-UHFFFAOYSA-N	1	1	312.345	1.778	20	5		DDBDMO
CCC[N@H+](CCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000076951619	353445151	/nfs/dbraw/zinc/44/51/51/353445151.db2.gz	NDHRRYIVEILUOC-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
CCC[N@@H+](CCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000076951619	353445152	/nfs/dbraw/zinc/44/51/52/353445152.db2.gz	NDHRRYIVEILUOC-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[N@@H+](CCCc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174732915	198376954	/nfs/dbraw/zinc/37/69/54/198376954.db2.gz	LYTPRIKMITZHMW-INIZCTEOSA-N	1	1	318.377	1.717	20	5		DDBDMO
C[C@H](c1cccs1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174752891	198379871	/nfs/dbraw/zinc/37/98/71/198379871.db2.gz	JXKPKNZWVOZHHW-PWSUYJOCSA-N	1	1	310.379	1.907	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000154690767	354207424	/nfs/dbraw/zinc/20/74/24/354207424.db2.gz	JUYJFLYYQLDMHT-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000154690767	354207426	/nfs/dbraw/zinc/20/74/26/354207426.db2.gz	JUYJFLYYQLDMHT-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000584787607	354770041	/nfs/dbraw/zinc/77/00/41/354770041.db2.gz	GCSDLYHWRCYLRO-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CN(C(=O)CN1CC[C@@H]2C[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1	ZINC000590012325	355040263	/nfs/dbraw/zinc/04/02/63/355040263.db2.gz	QWZXLAMFDMQCFV-IUODEOHRSA-N	1	1	318.377	1.194	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000590012853	355041269	/nfs/dbraw/zinc/04/12/69/355041269.db2.gz	ZWWMMEGCKZHOJH-HZMBPMFUSA-N	1	1	301.350	1.607	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000590402433	355085604	/nfs/dbraw/zinc/08/56/04/355085604.db2.gz	UDGVNVRIDJSCJA-LSDHHAIUSA-N	1	1	319.361	1.530	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000590655895	355139124	/nfs/dbraw/zinc/13/91/24/355139124.db2.gz	CRLUBNDLXSHCSK-OCCSQVGLSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[C@H](O)[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056165	355239272	/nfs/dbraw/zinc/23/92/72/355239272.db2.gz	CXRWCONQMQRKHM-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056165	355239276	/nfs/dbraw/zinc/23/92/76/355239276.db2.gz	CXRWCONQMQRKHM-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c1	ZINC000591505240	355322116	/nfs/dbraw/zinc/32/21/16/355322116.db2.gz	TUHUIZSJGQFRAO-NWDGAFQWSA-N	1	1	322.361	1.832	20	5		DDBDMO
Cc1[nH]c2nc[nH+]c(NCCn3cc([N+](=O)[O-])cn3)c2c1C	ZINC000591923926	355436123	/nfs/dbraw/zinc/43/61/23/355436123.db2.gz	PHXOLQBOBNCGIE-UHFFFAOYSA-N	1	1	301.310	1.792	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC2(CCCC2)O1	ZINC000592196861	355533404	/nfs/dbraw/zinc/53/34/04/355533404.db2.gz	ZBTSKBUMEQDYDC-TZMCWYRMSA-N	1	1	324.381	1.186	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000592209141	355539057	/nfs/dbraw/zinc/53/90/57/355539057.db2.gz	VKGULDRGKUIRCK-SCRDCRAPSA-N	1	1	322.361	1.820	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](OC3CCC3)C2)c1	ZINC000594027794	356094146	/nfs/dbraw/zinc/09/41/46/356094146.db2.gz	ZVFYKPXMTXZKLD-ZFWWWQNUSA-N	1	1	324.381	1.186	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000594065806	356103499	/nfs/dbraw/zinc/10/34/99/356103499.db2.gz	UZHSQUVKMKCUQO-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000595357114	356463074	/nfs/dbraw/zinc/46/30/74/356463074.db2.gz	YNHHWJOUKPHQHY-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
O=C1N=NCN1C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000595466604	356504004	/nfs/dbraw/zinc/50/40/04/356504004.db2.gz	WDNUITFAEZYANT-UHFFFAOYSA-N	1	1	321.312	1.868	20	5		DDBDMO
O=C1C[C@@H](C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000595521969	356532166	/nfs/dbraw/zinc/53/21/66/356532166.db2.gz	HHNSATOMPDZWQN-OCCSQVGLSA-N	1	1	303.362	1.910	20	5		DDBDMO
CC[N@H+]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000595536898	356539187	/nfs/dbraw/zinc/53/91/87/356539187.db2.gz	XAMZZABQUBYAQY-GFCCVEGCSA-N	1	1	320.393	1.610	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)c(F)c1	ZINC000595608462	356575920	/nfs/dbraw/zinc/57/59/20/356575920.db2.gz	QOCXKCFXVNPXGE-LLVKDONJSA-N	1	1	305.313	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000595783355	356650796	/nfs/dbraw/zinc/65/07/96/356650796.db2.gz	MWDYWEXGRXMKMX-VNHYZAJKSA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(O)C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000595755968	356637503	/nfs/dbraw/zinc/63/75/03/356637503.db2.gz	AIKUTPIQUQCJRW-BLLLJJGKSA-N	1	1	319.361	1.689	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC2(COC2)C1	ZINC000595835711	356671379	/nfs/dbraw/zinc/67/13/79/356671379.db2.gz	XBKCYAWIPLJJGY-GFCCVEGCSA-N	1	1	308.334	1.057	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](Nc2c(Cl)cncc2[N+](=O)[O-])C1	ZINC000596122836	356781104	/nfs/dbraw/zinc/78/11/04/356781104.db2.gz	PAMNQKYNZWLCAH-SECBINFHSA-N	1	1	300.746	1.198	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2c(Cl)cncc2[N+](=O)[O-])C1	ZINC000596122836	356781107	/nfs/dbraw/zinc/78/11/07/356781107.db2.gz	PAMNQKYNZWLCAH-SECBINFHSA-N	1	1	300.746	1.198	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596143228	356789898	/nfs/dbraw/zinc/78/98/98/356789898.db2.gz	ZWSIVLBAYHYKJW-UHFFFAOYSA-N	1	1	310.354	1.074	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(c3ccc(N)c([N+](=O)[O-])n3)CC2)c1	ZINC000596170219	356801049	/nfs/dbraw/zinc/80/10/49/356801049.db2.gz	YKVYKFUXZIMQML-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C	ZINC000596137026	356787431	/nfs/dbraw/zinc/78/74/31/356787431.db2.gz	OCOUWMXJLSARGC-PWSUYJOCSA-N	1	1	306.366	1.613	20	5		DDBDMO
CCN(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@H]1CC[N@@H+](C)C1	ZINC000597943990	357393083	/nfs/dbraw/zinc/39/30/83/357393083.db2.gz	BMJVVPBLGFJEHV-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](CC)C1	ZINC000598040870	357438401	/nfs/dbraw/zinc/43/84/01/357438401.db2.gz	IEBRLNFSCDHNGY-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000598341646	357544578	/nfs/dbraw/zinc/54/45/78/357544578.db2.gz	FFOHHSVQAUMUMV-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc(OC)ccc2[N+](=O)[O-])C1	ZINC000598342278	357545380	/nfs/dbraw/zinc/54/53/80/357545380.db2.gz	LMGHEJPVDZDDOA-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598650811	357670599	/nfs/dbraw/zinc/67/05/99/357670599.db2.gz	OXQNQBOIWBPGGZ-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598650811	357670604	/nfs/dbraw/zinc/67/06/04/357670604.db2.gz	OXQNQBOIWBPGGZ-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@H]2C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000599671895	358018339	/nfs/dbraw/zinc/01/83/39/358018339.db2.gz	KJARKPSPVAHVRM-PHIMTYICSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1c(NC(=O)NCC[N@H+]2CC[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000599701487	358032251	/nfs/dbraw/zinc/03/22/51/358032251.db2.gz	IZSQLHGKCQSNQV-NSHDSACASA-N	1	1	308.338	1.091	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CCCC[N@H+](C)C1	ZINC000600315546	358193736	/nfs/dbraw/zinc/19/37/36/358193736.db2.gz	UVTQJTUPOHPTQF-CYBMUJFWSA-N	1	1	323.397	1.338	20	5		DDBDMO
CC(C)(C(=O)NCC[N@H+]1CC[C@@H](O)C1)c1ccccc1[N+](=O)[O-]	ZINC000600531629	358250046	/nfs/dbraw/zinc/25/00/46/358250046.db2.gz	HGSVJSABEVBWLB-GFCCVEGCSA-N	1	1	321.377	1.055	20	5		DDBDMO
C[C@@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C[N@@H+]1C	ZINC000601137120	358416861	/nfs/dbraw/zinc/41/68/61/358416861.db2.gz	TVBJAUHYINMSQL-SFYZADRCSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C[N@H+]1C	ZINC000601137120	358416864	/nfs/dbraw/zinc/41/68/64/358416864.db2.gz	TVBJAUHYINMSQL-SFYZADRCSA-N	1	1	321.303	1.876	20	5		DDBDMO
Cc1nn(C)cc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149160	358422568	/nfs/dbraw/zinc/42/25/68/358422568.db2.gz	KBGQDAVFLFNBMJ-HNNXBMFYSA-N	1	1	304.350	1.634	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601179329	358436325	/nfs/dbraw/zinc/43/63/25/358436325.db2.gz	QKIJRAUIFGOUFN-UHFFFAOYSA-N	1	1	312.345	1.676	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1cn(C)nc1[N+](=O)[O-])Cc1ccccc1	ZINC000602451260	358984411	/nfs/dbraw/zinc/98/44/11/358984411.db2.gz	FEMLDTARSXEHAW-LBPRGKRZSA-N	1	1	304.350	1.711	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])Cc1ccccc1	ZINC000602451260	358984417	/nfs/dbraw/zinc/98/44/17/358984417.db2.gz	FEMLDTARSXEHAW-LBPRGKRZSA-N	1	1	304.350	1.711	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCc2ncnn21	ZINC000602832341	359223334	/nfs/dbraw/zinc/22/33/34/359223334.db2.gz	UPMLFLLCGUVUBB-ZDUSSCGKSA-N	1	1	301.350	1.848	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@](C)(CO)C1	ZINC000602964529	359327777	/nfs/dbraw/zinc/32/77/77/359327777.db2.gz	QZKMVBBUWMCDFW-CABCVRRESA-N	1	1	310.350	1.445	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@](C)(CO)C1	ZINC000602965035	359329157	/nfs/dbraw/zinc/32/91/57/359329157.db2.gz	YDDXYAJCFPXIQG-HUUCEWRRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000186879230	200026316	/nfs/dbraw/zinc/02/63/16/200026316.db2.gz	FJBBQDJVHUNRMA-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000187007392	200046237	/nfs/dbraw/zinc/04/62/37/200046237.db2.gz	LGRKVBSWWMXUKK-GHMZBOCLSA-N	1	1	322.365	1.546	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000281095453	216076898	/nfs/dbraw/zinc/07/68/98/216076898.db2.gz	RXINFMKIJCYETJ-BETUJISGSA-N	1	1	319.361	1.302	20	5		DDBDMO
Cc1cc(OCC(=O)N(C)CC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000281121435	216093175	/nfs/dbraw/zinc/09/31/75/216093175.db2.gz	ULBQKCWDMTVKFE-UHFFFAOYSA-N	1	1	321.377	1.835	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188704567	200290586	/nfs/dbraw/zinc/29/05/86/200290586.db2.gz	FWUUQNGPLJLNFO-NSHDSACASA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188704567	200290589	/nfs/dbraw/zinc/29/05/89/200290589.db2.gz	FWUUQNGPLJLNFO-NSHDSACASA-N	1	1	307.350	1.042	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2CO1	ZINC000281201897	216150797	/nfs/dbraw/zinc/15/07/97/216150797.db2.gz	CLXHUEQMRUVWRN-KWCYVHTRSA-N	1	1	321.333	1.059	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000609919667	360364706	/nfs/dbraw/zinc/36/47/06/360364706.db2.gz	WWQNTAJVGAJIJP-ZDUSSCGKSA-N	1	1	322.365	1.115	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](CCO)C1	ZINC000610213851	360391905	/nfs/dbraw/zinc/39/19/05/360391905.db2.gz	WYGNJOUZVOJJDX-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](CCO)C1	ZINC000610213851	360391908	/nfs/dbraw/zinc/39/19/08/360391908.db2.gz	WYGNJOUZVOJJDX-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1)N1CCCC1	ZINC000610453353	360440627	/nfs/dbraw/zinc/44/06/27/360440627.db2.gz	XFYNYNWNQLZZJA-CYBMUJFWSA-N	1	1	321.381	1.126	20	5		DDBDMO
C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000610899191	360566251	/nfs/dbraw/zinc/56/62/51/360566251.db2.gz	DTBTYTVAZKCQIQ-ZWNOBZJWSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000610899191	360566255	/nfs/dbraw/zinc/56/62/55/360566255.db2.gz	DTBTYTVAZKCQIQ-ZWNOBZJWSA-N	1	1	308.338	1.435	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000611092457	360620705	/nfs/dbraw/zinc/62/07/05/360620705.db2.gz	UQRMQOSOMUEWKW-LLVKDONJSA-N	1	1	306.366	1.220	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1C	ZINC000611092425	360621905	/nfs/dbraw/zinc/62/19/05/360621905.db2.gz	UESDFZPNADHCDF-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000611528070	360749162	/nfs/dbraw/zinc/74/91/62/360749162.db2.gz	BPJFSVPSCRHTDX-NSHDSACASA-N	1	1	304.350	1.391	20	5		DDBDMO
Cc1cc([N+](=O)[O-])nn1C[C@@H](O)C[N@H+](C)Cc1ccccc1	ZINC000612605180	361079291	/nfs/dbraw/zinc/07/92/91/361079291.db2.gz	IELZJPXQHKJIQA-AWEZNQCLSA-N	1	1	304.350	1.593	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000359086612	299324069	/nfs/dbraw/zinc/32/40/69/299324069.db2.gz	VZAZVOBQPBDIPZ-UHFFFAOYSA-N	1	1	321.381	1.229	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](C(C)(C)CO)CC1	ZINC000619481706	364030750	/nfs/dbraw/zinc/03/07/50/364030750.db2.gz	YIYPDQQDJYJPRE-UHFFFAOYSA-N	1	1	311.386	1.013	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000619566995	364063615	/nfs/dbraw/zinc/06/36/15/364063615.db2.gz	GUILFSCCCUILBY-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=C(CC[N@H+](CCCO)C1CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000619718055	364129462	/nfs/dbraw/zinc/12/94/62/364129462.db2.gz	SIVFEZHQNBNKAV-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@H](C)c2nncn2C)c([N+](=O)[O-])c1	ZINC000275164362	212163295	/nfs/dbraw/zinc/16/32/95/212163295.db2.gz	JPEGAWIMGKVZPD-JTQLQIEISA-N	1	1	321.337	1.462	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCCC[C@H]1C	ZINC000350014785	284132336	/nfs/dbraw/zinc/13/23/36/284132336.db2.gz	QMUXUGYLPUOYTD-GHMZBOCLSA-N	1	1	321.381	1.565	20	5		DDBDMO
CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000350487488	284205654	/nfs/dbraw/zinc/20/56/54/284205654.db2.gz	ZNBBBRJACONNRB-KGLIPLIRSA-N	1	1	323.397	1.513	20	5		DDBDMO
CC[C@@H]1CN(C(C)=O)[C@@H](CC)C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000350487488	284205657	/nfs/dbraw/zinc/20/56/57/284205657.db2.gz	ZNBBBRJACONNRB-KGLIPLIRSA-N	1	1	323.397	1.513	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000264954366	204300821	/nfs/dbraw/zinc/30/08/21/204300821.db2.gz	VCLHFWKWQWDHLX-LLVKDONJSA-N	1	1	323.397	1.875	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000265028007	204351818	/nfs/dbraw/zinc/35/18/18/204351818.db2.gz	XAOGHFNITUKAIH-CYBMUJFWSA-N	1	1	323.397	1.480	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288205036	220016992	/nfs/dbraw/zinc/01/69/92/220016992.db2.gz	CAXGOXISPFUSLE-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
COc1ccc(NC(=O)NC[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000274879553	212003975	/nfs/dbraw/zinc/00/39/75/212003975.db2.gz	HTFCEOYJEXLGRG-JTQLQIEISA-N	1	1	308.338	1.677	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c([N+](=O)[O-])c1	ZINC000351501990	284349126	/nfs/dbraw/zinc/34/91/26/284349126.db2.gz	YQKLZXUMUABKEY-UBHSHLNASA-N	1	1	321.377	1.651	20	5		DDBDMO
C[C@@H]1C[NH+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C	ZINC000267798274	206290334	/nfs/dbraw/zinc/29/03/34/206290334.db2.gz	KNGGUMPOSJYHHJ-NXEZZACHSA-N	1	1	321.333	1.850	20	5		DDBDMO
COC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000351983689	284687688	/nfs/dbraw/zinc/68/76/88/284687688.db2.gz	IRKIBTDMVWUXQZ-UHFFFAOYSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[N@@H+]1CC=C(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000273973720	211229721	/nfs/dbraw/zinc/22/97/21/211229721.db2.gz	PQEFANZNIHOBEK-UHFFFAOYSA-N	1	1	311.363	1.135	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000338717661	250102613	/nfs/dbraw/zinc/10/26/13/250102613.db2.gz	ZHMOSLPDTWTUHV-UHFFFAOYSA-N	1	1	303.322	1.701	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000285264907	218358045	/nfs/dbraw/zinc/35/80/45/218358045.db2.gz	DGMJXAXZVGHEDD-OKILXGFUSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000285264907	218358047	/nfs/dbraw/zinc/35/80/47/218358047.db2.gz	DGMJXAXZVGHEDD-OKILXGFUSA-N	1	1	319.361	1.593	20	5		DDBDMO
CNC(=O)NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000064349999	184295553	/nfs/dbraw/zinc/29/55/53/184295553.db2.gz	QNFGPBZLBHPTDR-UHFFFAOYSA-N	1	1	322.365	1.651	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[NH2+]C1	ZINC000269159272	207284422	/nfs/dbraw/zinc/28/44/22/207284422.db2.gz	APJHZENUJBSFQX-ZJUUUORDSA-N	1	1	317.349	1.589	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C1(CO)CC1	ZINC000298019042	533138640	/nfs/dbraw/zinc/13/86/40/533138640.db2.gz	AZTXOZPQKAWCHV-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000451671835	533221628	/nfs/dbraw/zinc/22/16/28/533221628.db2.gz	ZNHBWLTZGBIFGM-BETUJISGSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)C[C@@H]1COCCN1	ZINC000422711133	533222072	/nfs/dbraw/zinc/22/20/72/533222072.db2.gz	GRAUZRNZMPFUIJ-DGCLKSJQSA-N	1	1	309.366	1.460	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C1CC1)[C@@H]1CNCCO1	ZINC000422718203	533222410	/nfs/dbraw/zinc/22/24/10/533222410.db2.gz	PIEMKJNPXZSSRX-JKSUJKDBSA-N	1	1	321.377	1.460	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000299690376	533554283	/nfs/dbraw/zinc/55/42/83/533554283.db2.gz	VWTLYVGPBKJMKC-QWHCGFSZSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1ccnc([C@@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)c1	ZINC000569739209	304376168	/nfs/dbraw/zinc/37/61/68/304376168.db2.gz	LHQSCHXQXSSHPZ-CYBMUJFWSA-N	1	1	301.350	1.984	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1ccc([N+](=O)[O-])n1)C1CCCCC1	ZINC000068899947	406669863	/nfs/dbraw/zinc/66/98/63/406669863.db2.gz	USPRWOBORLEFDZ-UHFFFAOYSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC(C)[C@@H](CNc1ncccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000045851952	407049607	/nfs/dbraw/zinc/04/96/07/407049607.db2.gz	CMFBKZHZJSNQHI-CQSZACIVSA-N	1	1	307.398	1.674	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000088349354	407122012	/nfs/dbraw/zinc/12/20/12/407122012.db2.gz	IOJGJPVYXVTRLG-HNNXBMFYSA-N	1	1	319.361	1.200	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000088349354	407122017	/nfs/dbraw/zinc/12/20/17/407122017.db2.gz	IOJGJPVYXVTRLG-HNNXBMFYSA-N	1	1	319.361	1.200	20	5		DDBDMO
CN(CC[NH+]1CCCC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000103117963	407331482	/nfs/dbraw/zinc/33/14/82/407331482.db2.gz	AMRMNIGIDNNIIY-UHFFFAOYSA-N	1	1	317.349	1.639	20	5		DDBDMO
C[NH+](C)C1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000068079699	407294415	/nfs/dbraw/zinc/29/44/15/407294415.db2.gz	IQJQLTBJSQHBPL-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000111262950	407402928	/nfs/dbraw/zinc/40/29/28/407402928.db2.gz	QWIJDSXXOHTKFC-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCS2(=O)=O)c(Cl)c1	ZINC000127015825	407426101	/nfs/dbraw/zinc/42/61/01/407426101.db2.gz	TYMHWJJCVDNCEN-NSHDSACASA-N	1	1	318.782	1.915	20	5		DDBDMO
O=C(NC1CC[NH+](C2CCCCC2)CC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000127330617	407433968	/nfs/dbraw/zinc/43/39/68/407433968.db2.gz	QSMOMDWADOKXPB-UHFFFAOYSA-N	1	1	321.381	1.845	20	5		DDBDMO
C[C@@H](C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000266541449	407552124	/nfs/dbraw/zinc/55/21/24/407552124.db2.gz	QCHAPEJHYKOPMU-BBRMVZONSA-N	1	1	318.377	1.888	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000178780309	407598264	/nfs/dbraw/zinc/59/82/64/407598264.db2.gz	FHUVDBOOGVKANM-SWLSCSKDSA-N	1	1	319.361	1.668	20	5		DDBDMO
CC(C)(CC(N)=O)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000186234327	407616869	/nfs/dbraw/zinc/61/68/69/407616869.db2.gz	TUMUDYCASPBANC-UHFFFAOYSA-N	1	1	319.321	1.388	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000152359174	407621188	/nfs/dbraw/zinc/62/11/88/407621188.db2.gz	HDPGCOCPCULSQK-UHFFFAOYSA-N	1	1	315.395	1.663	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC([C@@H](C)[NH3+])CC2)c1[N+](=O)[O-]	ZINC000178850782	407624671	/nfs/dbraw/zinc/62/46/71/407624671.db2.gz	RBIVBPFDJCSFLE-SECBINFHSA-N	1	1	309.370	1.470	20	5		DDBDMO
CCN(C)C(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000153512032	407841183	/nfs/dbraw/zinc/84/11/83/407841183.db2.gz	BBJXIGPASNABMT-GFCCVEGCSA-N	1	1	321.381	1.344	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272336842	407873357	/nfs/dbraw/zinc/87/33/57/407873357.db2.gz	MLXBGIVGXBNKDP-GFCCVEGCSA-N	1	1	313.304	1.897	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CCN([C@@H]3CC[NH2+]C3)CC2)cc1	ZINC000262583743	407874894	/nfs/dbraw/zinc/87/48/94/407874894.db2.gz	ZKILLPCTQGZJHB-MRXNPFEDSA-N	1	1	304.394	1.117	20	5		DDBDMO
CC(C)NC(=O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173470802	407882453	/nfs/dbraw/zinc/88/24/53/407882453.db2.gz	XFEOEDCLGOGLQS-LBPRGKRZSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[N@H+]1CCCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000118827024	407948393	/nfs/dbraw/zinc/94/83/93/407948393.db2.gz	HFVOEAYYINJYEI-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1OC[C@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000154015117	407952019	/nfs/dbraw/zinc/95/20/19/407952019.db2.gz	LSQNYWKGZOECNO-UMVBOHGHSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000272520980	407961583	/nfs/dbraw/zinc/96/15/83/407961583.db2.gz	PWWGFRJQIGPQFO-BBRMVZONSA-N	1	1	317.389	1.998	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000268242968	407964131	/nfs/dbraw/zinc/96/41/31/407964131.db2.gz	VGABIQLVQBMZAW-GWCFXTLKSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH+](CC)CC)C2)c1[N+](=O)[O-]	ZINC000174120546	407918674	/nfs/dbraw/zinc/91/86/74/407918674.db2.gz	NAWNDYRJJGMMJQ-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
COc1cc(NCCC[NH+]2CCOCC2)c([N+](=O)[O-])cc1F	ZINC000268162899	407924315	/nfs/dbraw/zinc/92/43/15/407924315.db2.gz	NVJPHEQUORXCFF-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC000272596237	408001691	/nfs/dbraw/zinc/00/16/91/408001691.db2.gz	IMISXLNLOUTTKI-YGRLFVJLSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000273121061	408065063	/nfs/dbraw/zinc/06/50/63/408065063.db2.gz	HMMOILAFVIHNSM-YRGRVCCFSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000245778838	408068183	/nfs/dbraw/zinc/06/81/83/408068183.db2.gz	LWQMDCPVJAABLM-RKDXNWHRSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000245778838	408068189	/nfs/dbraw/zinc/06/81/89/408068189.db2.gz	LWQMDCPVJAABLM-RKDXNWHRSA-N	1	1	315.757	1.888	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182224872	408100153	/nfs/dbraw/zinc/10/01/53/408100153.db2.gz	BXARNSSQBODSOK-SWLSCSKDSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCSC1	ZINC000182259727	408111118	/nfs/dbraw/zinc/11/11/18/408111118.db2.gz	RLDNYIMREMTOMM-NEPJUHHUSA-N	1	1	312.391	1.772	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000246206935	408176778	/nfs/dbraw/zinc/17/67/78/408176778.db2.gz	AARMECHHBSQGDS-DOMZBBRYSA-N	1	1	318.377	1.702	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000263650788	408189060	/nfs/dbraw/zinc/18/90/60/408189060.db2.gz	GTNLQRBKMGYRHH-NSHDSACASA-N	1	1	323.397	1.875	20	5		DDBDMO
CCOC(=O)C[C@@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000182625916	408208903	/nfs/dbraw/zinc/20/89/03/408208903.db2.gz	QOBRXDPWTZDNBD-LLVKDONJSA-N	1	1	311.338	1.030	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000190313981	408219589	/nfs/dbraw/zinc/21/95/89/408219589.db2.gz	VXOHONXKZMVCSY-UHFFFAOYSA-N	1	1	316.308	1.497	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1(CO)CCOCC1	ZINC000191027638	408361560	/nfs/dbraw/zinc/36/15/60/408361560.db2.gz	MXISDSAKSDEWLF-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000183376735	408393800	/nfs/dbraw/zinc/39/38/00/408393800.db2.gz	WKOCYRFOOGVRMF-UHFFFAOYSA-N	1	1	314.345	1.555	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000183376735	408393804	/nfs/dbraw/zinc/39/38/04/408393804.db2.gz	WKOCYRFOOGVRMF-UHFFFAOYSA-N	1	1	314.345	1.555	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000177094004	408516512	/nfs/dbraw/zinc/51/65/12/408516512.db2.gz	IWCMWSZXSGEZSB-JQWIXIFHSA-N	1	1	319.361	1.958	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000177094021	408517167	/nfs/dbraw/zinc/51/71/67/408517167.db2.gz	IWCMWSZXSGEZSB-ZYHUDNBSSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H](O)C1CC1	ZINC000160834784	408530014	/nfs/dbraw/zinc/53/00/14/408530014.db2.gz	QVYJPWWUFGRZFH-CQSZACIVSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+](CCO)CCOCC(F)(F)F)c1	ZINC000264891203	408549165	/nfs/dbraw/zinc/54/91/65/408549165.db2.gz	SNMYGTPWJNZLSD-UHFFFAOYSA-N	1	1	322.283	1.968	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C)(O)CC1	ZINC000177341945	408584026	/nfs/dbraw/zinc/58/40/26/408584026.db2.gz	PXUZJAKBXPRKOG-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1	ZINC000177159455	408540037	/nfs/dbraw/zinc/54/00/37/408540037.db2.gz	QULFGRXFEHRGLQ-QWRGUYRKSA-N	1	1	319.361	1.958	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](N2CCCC2=O)C1	ZINC000270841175	408704131	/nfs/dbraw/zinc/70/41/31/408704131.db2.gz	FFHZRDOSDQBJOY-CQSZACIVSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](N2CCCC2=O)C1	ZINC000270841175	408704132	/nfs/dbraw/zinc/70/41/32/408704132.db2.gz	FFHZRDOSDQBJOY-CQSZACIVSA-N	1	1	319.361	1.800	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000270882007	408723938	/nfs/dbraw/zinc/72/39/38/408723938.db2.gz	KGILFXLFFMUKSD-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000270882007	408723944	/nfs/dbraw/zinc/72/39/44/408723944.db2.gz	KGILFXLFFMUKSD-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000249146435	408698316	/nfs/dbraw/zinc/69/83/16/408698316.db2.gz	ULPXXBLXQSENTR-MWLCHTKSSA-N	1	1	308.338	1.108	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@H]1O	ZINC000249568584	408743002	/nfs/dbraw/zinc/74/30/02/408743002.db2.gz	NOXJMGAIKGNBIV-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@H]1O	ZINC000249568584	408743011	/nfs/dbraw/zinc/74/30/11/408743011.db2.gz	NOXJMGAIKGNBIV-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)NCc1cc([N+](=O)[O-])ccc1OC	ZINC000194837169	408801034	/nfs/dbraw/zinc/80/10/34/408801034.db2.gz	TWVSMOBYVKFRDO-UHFFFAOYSA-N	1	1	310.354	1.354	20	5		DDBDMO
C[C@@]1(O)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000178009874	408757206	/nfs/dbraw/zinc/75/72/06/408757206.db2.gz	IWGZOWCQTBSZGB-CQSZACIVSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000178009874	408757210	/nfs/dbraw/zinc/75/72/10/408757210.db2.gz	IWGZOWCQTBSZGB-CQSZACIVSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@]1(O)CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000178025292	408759125	/nfs/dbraw/zinc/75/91/25/408759125.db2.gz	XXYVXOHCOWLMPD-CQSZACIVSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000178025292	408759131	/nfs/dbraw/zinc/75/91/31/408759131.db2.gz	XXYVXOHCOWLMPD-CQSZACIVSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000290839174	408841203	/nfs/dbraw/zinc/84/12/03/408841203.db2.gz	VQPLXSDNOHAHHA-KOLCDFICSA-N	1	1	304.350	1.731	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H](C)CO	ZINC000292037211	408966080	/nfs/dbraw/zinc/96/60/80/408966080.db2.gz	ACLJBZCRDILFNY-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H](C)CO	ZINC000292051291	408970762	/nfs/dbraw/zinc/97/07/62/408970762.db2.gz	BGXKXBUEIQABQF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H](C)CO	ZINC000292051291	408970764	/nfs/dbraw/zinc/97/07/64/408970764.db2.gz	BGXKXBUEIQABQF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cn2)C[C@H]1Cc1ccccc1	ZINC000286374315	408972304	/nfs/dbraw/zinc/97/23/04/408972304.db2.gz	DGSYFXIGSBEANE-CQSZACIVSA-N	1	1	313.361	1.748	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000292074132	408974586	/nfs/dbraw/zinc/97/45/86/408974586.db2.gz	LPHPESPCPLEAQY-GFCCVEGCSA-N	1	1	308.382	1.852	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)C1	ZINC000277791495	409012825	/nfs/dbraw/zinc/01/28/25/409012825.db2.gz	NJIXGLTXAXHXQR-UWVGGRQHSA-N	1	1	321.337	1.022	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000288610874	409172761	/nfs/dbraw/zinc/17/27/61/409172761.db2.gz	WZXQKNDXZAYYJQ-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000288610874	409172765	/nfs/dbraw/zinc/17/27/65/409172765.db2.gz	WZXQKNDXZAYYJQ-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000283597681	409183215	/nfs/dbraw/zinc/18/32/15/409183215.db2.gz	QJSWEKMYLZBQCM-HNNXBMFYSA-N	1	1	308.382	1.946	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280301329	409287397	/nfs/dbraw/zinc/28/73/97/409287397.db2.gz	FTKIORFUJPQEIM-UHOFOFEASA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280301329	409287399	/nfs/dbraw/zinc/28/73/99/409287399.db2.gz	FTKIORFUJPQEIM-UHOFOFEASA-N	1	1	322.361	1.508	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCC[N@@H+](CCCO)C1	ZINC000295498739	409318286	/nfs/dbraw/zinc/31/82/86/409318286.db2.gz	PBGBMBXMUBAYGJ-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000290458406	409408839	/nfs/dbraw/zinc/40/88/39/409408839.db2.gz	YBFNZIPHZFTLKE-LLVKDONJSA-N	1	1	322.365	1.378	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000285595586	409503016	/nfs/dbraw/zinc/50/30/16/409503016.db2.gz	VTRWQXOYNOQUFS-UHFFFAOYSA-N	1	1	315.333	1.106	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2ccccc2C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000285595586	409503017	/nfs/dbraw/zinc/50/30/17/409503017.db2.gz	VTRWQXOYNOQUFS-UHFFFAOYSA-N	1	1	315.333	1.106	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[NH+]2CCC(O)CC2)c(Cl)c1	ZINC000295486448	409503340	/nfs/dbraw/zinc/50/33/40/409503340.db2.gz	AFJOVXQONNPUAR-UHFFFAOYSA-N	1	1	300.746	1.512	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CCO1	ZINC000345051014	409606740	/nfs/dbraw/zinc/60/67/40/409606740.db2.gz	JFTCDUUAMAJHTE-NSHDSACASA-N	1	1	322.365	1.248	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C	ZINC000342471211	409659848	/nfs/dbraw/zinc/65/98/48/409659848.db2.gz	WUPHNLZKBSKSRV-YGRLFVJLSA-N	1	1	319.361	1.816	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC000356979642	409765722	/nfs/dbraw/zinc/76/57/22/409765722.db2.gz	DMPQLUPTUSTFHT-OLZOCXBDSA-N	1	1	320.393	1.866	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCOC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1	ZINC000332024451	409811151	/nfs/dbraw/zinc/81/11/51/409811151.db2.gz	ZYTCQYXWZHDMCZ-XHSDSOJGSA-N	1	1	306.362	1.957	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCOC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1	ZINC000332024451	409811157	/nfs/dbraw/zinc/81/11/57/409811157.db2.gz	ZYTCQYXWZHDMCZ-XHSDSOJGSA-N	1	1	306.362	1.957	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](C[C@@H]3COCCO3)CC2)c1	ZINC000354633012	409983368	/nfs/dbraw/zinc/98/33/68/409983368.db2.gz	OOJDQAGNJGFVKJ-OAHLLOKOSA-N	1	1	307.350	1.132	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000298288921	410166713	/nfs/dbraw/zinc/16/67/13/410166713.db2.gz	IFPWOMWYPSKKFA-LLVKDONJSA-N	1	1	321.381	1.765	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000351773561	410223723	/nfs/dbraw/zinc/22/37/23/410223723.db2.gz	HFFCSLWHRYPXEV-CABZTGNLSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000351773561	410223727	/nfs/dbraw/zinc/22/37/27/410223727.db2.gz	HFFCSLWHRYPXEV-CABZTGNLSA-N	1	1	304.306	1.457	20	5		DDBDMO
Cc1sc(C(=O)NCc2c[nH+]c(N(C)C)n2C)cc1[N+](=O)[O-]	ZINC000358080520	410355129	/nfs/dbraw/zinc/35/51/29/410355129.db2.gz	UAOMSHIXXLHFIX-UHFFFAOYSA-N	1	1	323.378	1.694	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC3(CC[NH2+]CC3)CC2)c1[N+](=O)[O-]	ZINC000357849205	410293211	/nfs/dbraw/zinc/29/32/11/410293211.db2.gz	BHKVKDNENYZMGY-UHFFFAOYSA-N	1	1	307.354	1.232	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347015245	410315524	/nfs/dbraw/zinc/31/55/24/410315524.db2.gz	VYWVSPFFUUZRQY-LBPRGKRZSA-N	1	1	304.350	1.607	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](CO)C1	ZINC000298626051	410320631	/nfs/dbraw/zinc/32/06/31/410320631.db2.gz	DGODCZSNIXGGQS-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](CO)C1	ZINC000298626051	410320638	/nfs/dbraw/zinc/32/06/38/410320638.db2.gz	DGODCZSNIXGGQS-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000298729431	410370181	/nfs/dbraw/zinc/37/01/81/410370181.db2.gz	SEKVNJQCBGUXCF-NWDGAFQWSA-N	1	1	305.338	1.127	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H](C)O1	ZINC000298840258	410421303	/nfs/dbraw/zinc/42/13/03/410421303.db2.gz	HKWJQPAIXSAQGC-QWRGUYRKSA-N	1	1	324.381	1.541	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC[C@H]1CC1CCC1	ZINC000339779716	410456008	/nfs/dbraw/zinc/45/60/08/410456008.db2.gz	XGRTVAHADKJEEF-OAHLLOKOSA-N	1	1	321.377	1.648	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@H]1CC1CCC1	ZINC000339779716	410456015	/nfs/dbraw/zinc/45/60/15/410456015.db2.gz	XGRTVAHADKJEEF-OAHLLOKOSA-N	1	1	321.377	1.648	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343472010	410476754	/nfs/dbraw/zinc/47/67/54/410476754.db2.gz	ZGDWPQBAXGHDIO-QWHCGFSZSA-N	1	1	320.393	1.630	20	5		DDBDMO
CCOc1cc(C[N@H+]2[C@@H](CO)CC[C@H]2CO)ccc1[N+](=O)[O-]	ZINC000347335132	410479691	/nfs/dbraw/zinc/47/96/91/410479691.db2.gz	NKQHOKHAALBMNA-BETUJISGSA-N	1	1	310.350	1.311	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+](CCO)C2CC2)cc1[N+](=O)[O-]	ZINC000355589742	410594641	/nfs/dbraw/zinc/59/46/41/410594641.db2.gz	YBFKIOBCFGJSOJ-UHFFFAOYSA-N	1	1	324.333	1.103	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000347521639	410597352	/nfs/dbraw/zinc/59/73/52/410597352.db2.gz	MTYFLNNZGHFOFE-UHFFFAOYSA-N	1	1	306.326	1.043	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)O)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000352202911	410543228	/nfs/dbraw/zinc/54/32/28/410543228.db2.gz	NLQALLCWHRECLO-PWSUYJOCSA-N	1	1	309.366	1.933	20	5		DDBDMO
C[C@@H]1CN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000330585669	410802407	/nfs/dbraw/zinc/80/24/07/410802407.db2.gz	LMJAWGNPQMDSOE-IPYPFGDCSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CN1C	ZINC000330585669	410802413	/nfs/dbraw/zinc/80/24/13/410802413.db2.gz	LMJAWGNPQMDSOE-IPYPFGDCSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CN1C	ZINC000330585669	410802418	/nfs/dbraw/zinc/80/24/18/410802418.db2.gz	LMJAWGNPQMDSOE-IPYPFGDCSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)C[C@H]1C	ZINC000330663418	410858673	/nfs/dbraw/zinc/85/86/73/410858673.db2.gz	FCCVQLYOJRHALH-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)n1	ZINC000356253897	410922380	/nfs/dbraw/zinc/92/23/80/410922380.db2.gz	NKZSBITVCYXNFV-OAHLLOKOSA-N	1	1	321.381	1.369	20	5		DDBDMO
C[C@H]1C[C@H](CO)CC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344127849	410974231	/nfs/dbraw/zinc/97/42/31/410974231.db2.gz	KDROLZXLTLMFNA-QWHCGFSZSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1C[C@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344127849	410974234	/nfs/dbraw/zinc/97/42/34/410974234.db2.gz	KDROLZXLTLMFNA-QWHCGFSZSA-N	1	1	321.377	1.650	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C1CC(O)C1	ZINC000353473737	411011837	/nfs/dbraw/zinc/01/18/37/411011837.db2.gz	VBFUAKJVPXNERP-UHFFFAOYSA-N	1	1	307.350	1.687	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC1(O)CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000353488483	411022686	/nfs/dbraw/zinc/02/26/86/411022686.db2.gz	HOWGHRJPRRNSHX-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCCCCn1cc[nH+]c1C	ZINC000129725278	196071222	/nfs/dbraw/zinc/07/12/22/196071222.db2.gz	WTTKDTTWSWKFQO-UHFFFAOYSA-N	1	1	320.353	1.201	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000361035522	418571365	/nfs/dbraw/zinc/57/13/65/418571365.db2.gz	NWHVANVFSOLSMD-GFCCVEGCSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000361035522	418571367	/nfs/dbraw/zinc/57/13/67/418571367.db2.gz	NWHVANVFSOLSMD-GFCCVEGCSA-N	1	1	305.382	1.570	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000189309505	222042355	/nfs/dbraw/zinc/04/23/55/222042355.db2.gz	PAIVTQZEVCATCD-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000189309505	222042358	/nfs/dbraw/zinc/04/23/58/222042358.db2.gz	PAIVTQZEVCATCD-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000291018244	222075488	/nfs/dbraw/zinc/07/54/88/222075488.db2.gz	SGASAAWLOGLQLG-LLVKDONJSA-N	1	1	311.386	1.336	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]21	ZINC000375015951	418588315	/nfs/dbraw/zinc/58/83/15/418588315.db2.gz	DHABDNAWXQEBJG-ABAIWWIYSA-N	1	1	318.377	1.220	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@@H+](CCOC)C2)cccc1[N+](=O)[O-]	ZINC000361213209	418607274	/nfs/dbraw/zinc/60/72/74/418607274.db2.gz	QCHLAQITNSQUEA-LLVKDONJSA-N	1	1	322.365	1.087	20	5		DDBDMO
CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H](C)OC	ZINC000291302887	222298690	/nfs/dbraw/zinc/29/86/90/222298690.db2.gz	SFLRKVBFFHHDFR-GFCCVEGCSA-N	1	1	309.366	1.914	20	5		DDBDMO
CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H](C)OC	ZINC000291302887	222298693	/nfs/dbraw/zinc/29/86/93/222298693.db2.gz	SFLRKVBFFHHDFR-GFCCVEGCSA-N	1	1	309.366	1.914	20	5		DDBDMO
Nc1ccc(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834584	418642917	/nfs/dbraw/zinc/64/29/17/418642917.db2.gz	GKDITEHNWZUOBW-STQMWFEESA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834584	418642921	/nfs/dbraw/zinc/64/29/21/418642921.db2.gz	GKDITEHNWZUOBW-STQMWFEESA-N	1	1	306.366	1.842	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@H]2CCCN(c3[nH+]cnc4[nH]ccc43)C2)c1	ZINC000375381725	418632539	/nfs/dbraw/zinc/63/25/39/418632539.db2.gz	TZOBATKCRUQYNJ-JTQLQIEISA-N	1	1	313.321	1.904	20	5		DDBDMO
CC(C)N(C)C(=O)[C@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400324	418634636	/nfs/dbraw/zinc/63/46/36/418634636.db2.gz	BUPXGKJSNJVKFQ-STQMWFEESA-N	1	1	323.397	1.684	20	5		DDBDMO
CC(C)N(C)C(=O)[C@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400324	418634638	/nfs/dbraw/zinc/63/46/38/418634638.db2.gz	BUPXGKJSNJVKFQ-STQMWFEESA-N	1	1	323.397	1.684	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C2(CO)CCOCC2)cc1[N+](=O)[O-]	ZINC000362023312	418740725	/nfs/dbraw/zinc/74/07/25/418740725.db2.gz	HYJRROFQCXCXPI-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cn2)[C@@H]1c1cccs1	ZINC000364961221	418827727	/nfs/dbraw/zinc/82/77/27/418827727.db2.gz	YAOHNDLEYFUKHU-GXFFZTMASA-N	1	1	319.390	2.551	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000365631936	418884781	/nfs/dbraw/zinc/88/47/81/418884781.db2.gz	RUARDFNILZLJGN-NSHDSACASA-N	1	1	320.349	1.442	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](C3CCCC3)C2)c1	ZINC000420966309	419388230	/nfs/dbraw/zinc/38/82/30/419388230.db2.gz	VBLOFDOAZGSXIY-ZFWWWQNUSA-N	1	1	308.382	1.664	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](O)[C@@H](CO)C1	ZINC000412111120	419672901	/nfs/dbraw/zinc/67/29/01/419672901.db2.gz	VQTMZJJUJBKXEK-HIFRSBDPSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](O)[C@@H](CO)C1	ZINC000412111120	419672905	/nfs/dbraw/zinc/67/29/05/419672905.db2.gz	VQTMZJJUJBKXEK-HIFRSBDPSA-N	1	1	324.377	1.557	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000421705316	419690456	/nfs/dbraw/zinc/69/04/56/419690456.db2.gz	QZLAUXLJRUMRJM-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)C[C@H]1C	ZINC000421902516	419763297	/nfs/dbraw/zinc/76/32/97/419763297.db2.gz	UXPSHEMLMVPKEY-CYBMUJFWSA-N	1	1	321.377	1.350	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)C[C@H]1C	ZINC000421902516	419763302	/nfs/dbraw/zinc/76/33/02/419763302.db2.gz	UXPSHEMLMVPKEY-CYBMUJFWSA-N	1	1	321.377	1.350	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000430265356	420097794	/nfs/dbraw/zinc/09/77/94/420097794.db2.gz	UZISAMBOHPKNEI-OAHLLOKOSA-N	1	1	317.349	1.429	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000430265356	420097799	/nfs/dbraw/zinc/09/77/99/420097799.db2.gz	UZISAMBOHPKNEI-OAHLLOKOSA-N	1	1	317.349	1.429	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4CC[C@H](O)[C@@H]4C3)nc2c1	ZINC000444689731	230121968	/nfs/dbraw/zinc/12/19/68/230121968.db2.gz	OQTYTQARUOFPNU-PXWWUCIGSA-N	1	1	302.334	1.674	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@@H]4C3)nc2c1	ZINC000444689731	230121969	/nfs/dbraw/zinc/12/19/69/230121969.db2.gz	OQTYTQARUOFPNU-PXWWUCIGSA-N	1	1	302.334	1.674	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000457130105	420626730	/nfs/dbraw/zinc/62/67/30/420626730.db2.gz	RCXZLZBOMDHQSA-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000457130105	420626732	/nfs/dbraw/zinc/62/67/32/420626732.db2.gz	RCXZLZBOMDHQSA-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)n1	ZINC000444830514	420759528	/nfs/dbraw/zinc/75/95/28/420759528.db2.gz	WNTPDWJZGCATNH-STQMWFEESA-N	1	1	308.382	1.498	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(NC)n1)C(C)C	ZINC000455662337	421052124	/nfs/dbraw/zinc/05/21/24/421052124.db2.gz	KQTKSPFEUQTLGY-UHFFFAOYSA-N	1	1	309.370	1.492	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000455996172	421086148	/nfs/dbraw/zinc/08/61/48/421086148.db2.gz	OZMSABPLEXPVTN-MFKMUULPSA-N	1	1	319.365	1.198	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000488724936	421108733	/nfs/dbraw/zinc/10/87/33/421108733.db2.gz	AXHIHJCOCBBSEZ-WDEREUQCSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@](O)(C2CC2)C1	ZINC000489268548	421142727	/nfs/dbraw/zinc/14/27/27/421142727.db2.gz	MSPKXGAXGXGEQD-MRXNPFEDSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000489268548	421142729	/nfs/dbraw/zinc/14/27/29/421142729.db2.gz	MSPKXGAXGXGEQD-MRXNPFEDSA-N	1	1	319.361	1.689	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000456387420	421157936	/nfs/dbraw/zinc/15/79/36/421157936.db2.gz	SNBOMWFWQRXTGI-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
CCc1nn(C)c(N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000574898175	422209149	/nfs/dbraw/zinc/20/91/49/422209149.db2.gz	HEASUWOBIJBEAC-NSHDSACASA-N	1	1	307.398	1.811	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(NCC[N@@H+]3CC[C@H](O)C3)ccc2c1	ZINC000599198979	422404717	/nfs/dbraw/zinc/40/47/17/422404717.db2.gz	DKRKSDKCRMYNMU-ZDUSSCGKSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000186017245	263395419	/nfs/dbraw/zinc/39/54/19/263395419.db2.gz	FWLHAEHFIFPBQC-GFCCVEGCSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[N@H+]1CCO[C@@H](C(=O)NCc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000186017245	263395421	/nfs/dbraw/zinc/39/54/21/263395421.db2.gz	FWLHAEHFIFPBQC-GFCCVEGCSA-N	1	1	313.741	1.195	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000337576271	271035200	/nfs/dbraw/zinc/03/52/00/271035200.db2.gz	GGEODQHESYTMGO-UHFFFAOYSA-N	1	1	315.333	1.216	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000193462243	273540726	/nfs/dbraw/zinc/54/07/26/273540726.db2.gz	AWEMZPNMEAJAMB-UHFFFAOYSA-N	1	1	308.382	1.724	20	5		DDBDMO
CC[N@@H+](CCO)CCNCc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000274461100	276132837	/nfs/dbraw/zinc/13/28/37/276132837.db2.gz	XNFKKKDLNKHGGG-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
CCN(CCO)CC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000274461100	276132838	/nfs/dbraw/zinc/13/28/38/276132838.db2.gz	XNFKKKDLNKHGGG-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
Cc1n[nH]c(C)c1[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000091081889	279057389	/nfs/dbraw/zinc/05/73/89/279057389.db2.gz	XRRSZGRJULLEGD-GFCCVEGCSA-N	1	1	304.354	1.968	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3ncc(Cl)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000284576030	290169846	/nfs/dbraw/zinc/16/98/46/290169846.db2.gz	OUVMIJWTABCKFZ-NEPJUHHUSA-N	1	1	312.757	1.553	20	5		DDBDMO
O=C([C@H]1C[C@@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295550	300246275	/nfs/dbraw/zinc/24/62/75/300246275.db2.gz	HVUGFFZWCLUJPT-GJZGRUSLSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2CCCCC2)CC1	ZINC000363295550	300246277	/nfs/dbraw/zinc/24/62/77/300246277.db2.gz	HVUGFFZWCLUJPT-GJZGRUSLSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295550	300246279	/nfs/dbraw/zinc/24/62/79/300246279.db2.gz	HVUGFFZWCLUJPT-GJZGRUSLSA-N	1	1	309.410	1.766	20	5		DDBDMO
COc1cc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)ccc1[N+](=O)[O-]	ZINC000368005008	300931416	/nfs/dbraw/zinc/93/14/16/300931416.db2.gz	GQDNWADPQKMTHL-SNVBAGLBSA-N	1	1	315.276	1.283	20	5		DDBDMO
CC(C)OC[C@H](O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012210	301119099	/nfs/dbraw/zinc/11/90/99/301119099.db2.gz	UMXJYJZBBXLXBR-TZMCWYRMSA-N	1	1	312.370	1.214	20	5		DDBDMO
CN(c1ccc2ncc([N+](=O)[O-])n2n1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000376236463	302054402	/nfs/dbraw/zinc/05/44/02/302054402.db2.gz	GVLHRFWZKGSTSX-FOSCPWQOSA-N	1	1	316.365	1.699	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@@H]3C2)n1	ZINC000377963507	302257806	/nfs/dbraw/zinc/25/78/06/302257806.db2.gz	UYDKLOYVNBJCGI-MGPQQGTHSA-N	1	1	305.382	1.207	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000531878014	303262943	/nfs/dbraw/zinc/26/29/43/303262943.db2.gz	CCDYWVUAYPCOHL-SNVBAGLBSA-N	1	1	303.322	1.561	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000532397205	303284929	/nfs/dbraw/zinc/28/49/29/303284929.db2.gz	AZCIKGZNLDMMBM-ZDUSSCGKSA-N	1	1	318.377	1.794	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21	ZINC000532873516	303300102	/nfs/dbraw/zinc/30/01/02/303300102.db2.gz	PCRBDDJMHNKITI-DGCLKSJQSA-N	1	1	306.366	1.490	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3CC[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000365018716	307056524	/nfs/dbraw/zinc/05/65/24/307056524.db2.gz	ORTLMWBXFZELFR-IAQYHMDHSA-N	1	1	318.377	1.485	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)CN1	ZINC000369483085	307121401	/nfs/dbraw/zinc/12/14/01/307121401.db2.gz	GDKYUPSPEKDYBW-CQSZACIVSA-N	1	1	320.305	1.215	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)CN1	ZINC000369483085	307121402	/nfs/dbraw/zinc/12/14/02/307121402.db2.gz	GDKYUPSPEKDYBW-CQSZACIVSA-N	1	1	320.305	1.215	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1	ZINC000372265761	307166658	/nfs/dbraw/zinc/16/66/58/307166658.db2.gz	BTLHOFYTRSRNQR-UHFFFAOYSA-N	1	1	318.337	1.160	20	5		DDBDMO
CSC[C@H](O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372294468	307167656	/nfs/dbraw/zinc/16/76/56/307167656.db2.gz	JNMAYJPFDUZMTI-ZYHUDNBSSA-N	1	1	300.384	1.152	20	5		DDBDMO
CCOC(=O)CCC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000373587933	307190794	/nfs/dbraw/zinc/19/07/94/307190794.db2.gz	ZLPALCRXDDSVGM-LBPRGKRZSA-N	1	1	310.354	1.772	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCC[C@H]1Cn1cccn1	ZINC000374055083	307201319	/nfs/dbraw/zinc/20/13/19/307201319.db2.gz	RISDQJSMWXPTBB-LBPRGKRZSA-N	1	1	304.354	1.580	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@H]1Cn1cccn1	ZINC000374055083	307201320	/nfs/dbraw/zinc/20/13/20/307201320.db2.gz	RISDQJSMWXPTBB-LBPRGKRZSA-N	1	1	304.354	1.580	20	5		DDBDMO
C[C@H]1[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCC12CCOCC2	ZINC000375243276	307219515	/nfs/dbraw/zinc/21/95/15/307219515.db2.gz	WICBLJBSSBMTMH-CYBMUJFWSA-N	1	1	321.377	1.648	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000376642890	307251188	/nfs/dbraw/zinc/25/11/88/307251188.db2.gz	MLLUEUZLLUSESB-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N2CC[NH2+][C@H](C)C2)cc1[N+](=O)[O-]	ZINC000571880795	308205440	/nfs/dbraw/zinc/20/54/40/308205440.db2.gz	HZRQHQBXQXPOLS-SNVBAGLBSA-N	1	1	313.379	1.140	20	5		DDBDMO
Cc1nn(C)c(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000488736631	484216859	/nfs/dbraw/zinc/21/68/59/484216859.db2.gz	VIZKZPOXXSEUNP-NTZNESFSSA-N	1	1	307.398	1.803	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCn3cc([N+](=O)[O-])cn3)[C@@H]2C1	ZINC000158062331	523725732	/nfs/dbraw/zinc/72/57/32/523725732.db2.gz	KUBLSILTVRREKE-MGPQQGTHSA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@@H]2C1	ZINC000158062331	523725737	/nfs/dbraw/zinc/72/57/37/523725737.db2.gz	KUBLSILTVRREKE-MGPQQGTHSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000154783556	525712203	/nfs/dbraw/zinc/71/22/03/525712203.db2.gz	ALQFSOYTBYEBRJ-RNCFNFMXSA-N	1	1	310.310	1.634	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000154783556	525712211	/nfs/dbraw/zinc/71/22/11/525712211.db2.gz	ALQFSOYTBYEBRJ-RNCFNFMXSA-N	1	1	310.310	1.634	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1	ZINC000820127058	606702771	/nfs/dbraw/zinc/70/27/71/606702771.db2.gz	ICWANCVJOOSPGO-SECBINFHSA-N	1	1	318.341	1.065	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCOC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1	ZINC000748487044	700121335	/nfs/dbraw/zinc/12/13/35/700121335.db2.gz	VQYUPMJHXWLPSM-GFCCVEGCSA-N	1	1	323.349	1.174	20	5		DDBDMO
CCOC(=O)CC[C@@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000154869825	696938545	/nfs/dbraw/zinc/93/85/45/696938545.db2.gz	IYYQVUFEOAUZJA-LBPRGKRZSA-N	1	1	310.354	1.804	20	5		DDBDMO
CCOC(=O)CC[C@@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000154869825	696938549	/nfs/dbraw/zinc/93/85/49/696938549.db2.gz	IYYQVUFEOAUZJA-LBPRGKRZSA-N	1	1	310.354	1.804	20	5		DDBDMO
CC[N@@H+](C[C@H]1CCOC1)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000749953224	700194436	/nfs/dbraw/zinc/19/44/36/700194436.db2.gz	CJFAQWQAHJMRJY-GFCCVEGCSA-N	1	1	319.365	1.964	20	5		DDBDMO
Cc1nccnc1[C@@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000783243628	698824118	/nfs/dbraw/zinc/82/41/18/698824118.db2.gz	ONGVXCKJVUBETB-LLVKDONJSA-N	1	1	315.333	1.983	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1C	ZINC000787326588	699206178	/nfs/dbraw/zinc/20/61/78/699206178.db2.gz	IMCGWWXDCBCSOX-GDLCADMTSA-N	1	1	308.334	1.512	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000711786616	699259640	/nfs/dbraw/zinc/25/96/40/699259640.db2.gz	RAWJXEVIOZRPMR-KCJUWKMLSA-N	1	1	318.782	1.771	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC000744800164	699961341	/nfs/dbraw/zinc/96/13/41/699961341.db2.gz	UIPAULPENBVXKW-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000751951369	700329877	/nfs/dbraw/zinc/32/98/77/700329877.db2.gz	TVGCNHYJPYNOHR-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000751951369	700329881	/nfs/dbraw/zinc/32/98/81/700329881.db2.gz	TVGCNHYJPYNOHR-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@@](C)(CC(=O)OC)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000755980973	700597271	/nfs/dbraw/zinc/59/72/71/700597271.db2.gz	YEGUUMFXYPHVIX-CQSZACIVSA-N	1	1	314.313	1.792	20	5		DDBDMO
COc1ccc(OCCN2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000761075299	700839702	/nfs/dbraw/zinc/83/97/02/700839702.db2.gz	DODGVOIISCJACE-LBPRGKRZSA-N	1	1	309.366	1.618	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H]2C[C@@H]21	ZINC000761095495	700843203	/nfs/dbraw/zinc/84/32/03/700843203.db2.gz	QPCZIXIBTXVFHD-PWSUYJOCSA-N	1	1	303.318	1.987	20	5		DDBDMO
C/C(=C/C(=O)NC[C@@]1(O)CC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000762721491	700904533	/nfs/dbraw/zinc/90/45/33/700904533.db2.gz	NKJAXMPIXPXARU-CKDIWJPDSA-N	1	1	319.361	1.181	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000763268524	700932612	/nfs/dbraw/zinc/93/26/12/700932612.db2.gz	SXNFQVWGTYCFOX-GFCCVEGCSA-N	1	1	323.349	1.443	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCCCn1cc[nH+]c1C	ZINC000767618272	701123578	/nfs/dbraw/zinc/12/35/78/701123578.db2.gz	MOAKDOTYMGWNRR-UHFFFAOYSA-N	1	1	321.337	1.628	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@]3(CCOC3)C2)cc1	ZINC000769220545	701237194	/nfs/dbraw/zinc/23/71/94/701237194.db2.gz	MCERGUOIDGXQHK-HUUCEWRRSA-N	1	1	308.334	1.120	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@]3(CCOC3)C2)cc1	ZINC000769220545	701237196	/nfs/dbraw/zinc/23/71/96/701237196.db2.gz	MCERGUOIDGXQHK-HUUCEWRRSA-N	1	1	308.334	1.120	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000807987421	701493422	/nfs/dbraw/zinc/49/34/22/701493422.db2.gz	LHVZBCVGBFYGEC-SNVBAGLBSA-N	1	1	324.356	1.872	20	5		DDBDMO
COC(C)(C)CN(C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867927186	701834998	/nfs/dbraw/zinc/83/49/98/701834998.db2.gz	CQMKMTHSYLNHSQ-HNNXBMFYSA-N	1	1	309.366	1.652	20	5		DDBDMO
CN(C[C@H]1CCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867945227	701846782	/nfs/dbraw/zinc/84/67/82/701846782.db2.gz	BANUTZZDIYCQNI-ABAIWWIYSA-N	1	1	307.350	1.264	20	5		DDBDMO
C[N@H+](CC1CC1)CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839969359	701884010	/nfs/dbraw/zinc/88/40/10/701884010.db2.gz	OARUWVOBJLCVNS-HNNXBMFYSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[N@@H+](CC1CC1)CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839969359	701884015	/nfs/dbraw/zinc/88/40/15/701884015.db2.gz	OARUWVOBJLCVNS-HNNXBMFYSA-N	1	1	305.334	1.831	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000816953611	702237956	/nfs/dbraw/zinc/23/79/56/702237956.db2.gz	KJWUOKUPMYUVMQ-GXFFZTMASA-N	1	1	307.325	1.818	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](CO)[C@H]2CO)c1	ZINC000879362636	706661365	/nfs/dbraw/zinc/66/13/65/706661365.db2.gz	XXLHLULSCNVKOX-SWLSCSKDSA-N	1	1	310.350	1.039	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000869284010	702552775	/nfs/dbraw/zinc/55/27/75/702552775.db2.gz	CCJDNDGOUJSJKJ-LBPRGKRZSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C[N@H+]1CCO	ZINC000842163525	702678645	/nfs/dbraw/zinc/67/86/45/702678645.db2.gz	PEVFRQXIONNIRI-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
NS(=O)(=O)CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831538349	706727223	/nfs/dbraw/zinc/72/72/23/706727223.db2.gz	AWZIKRYLTUTKDZ-LBPRGKRZSA-N	1	1	313.379	1.063	20	5		DDBDMO
NS(=O)(=O)CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000831538349	706727225	/nfs/dbraw/zinc/72/72/25/706727225.db2.gz	AWZIKRYLTUTKDZ-LBPRGKRZSA-N	1	1	313.379	1.063	20	5		DDBDMO
O=C1CC[C@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000831538570	706727887	/nfs/dbraw/zinc/72/78/87/706727887.db2.gz	FEQNXDSZNFNWOX-OCCSQVGLSA-N	1	1	317.345	1.579	20	5		DDBDMO
O=C1CC2(CN1)CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2	ZINC000851794894	703857842	/nfs/dbraw/zinc/85/78/42/703857842.db2.gz	LTWQSTRKWSVYIG-UHFFFAOYSA-N	1	1	307.325	1.836	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C	ZINC000818631008	703948618	/nfs/dbraw/zinc/94/86/18/703948618.db2.gz	ZNFYHBPWKPMVAT-AOOOYVTPSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000818631008	703948622	/nfs/dbraw/zinc/94/86/22/703948622.db2.gz	ZNFYHBPWKPMVAT-AOOOYVTPSA-N	1	1	322.321	1.668	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000818977736	704040965	/nfs/dbraw/zinc/04/09/65/704040965.db2.gz	LEVLANLFTNQCHZ-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000818977736	704040966	/nfs/dbraw/zinc/04/09/66/704040966.db2.gz	LEVLANLFTNQCHZ-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCc3cn[nH]c3C2)c1	ZINC000819155070	704077604	/nfs/dbraw/zinc/07/76/04/704077604.db2.gz	OKXGSMGTSRQLQO-IUODEOHRSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCc3[nH]cnc3C2)c1	ZINC000819323309	704107238	/nfs/dbraw/zinc/10/72/38/704107238.db2.gz	ZIBAMQBWSVVNRL-ABAIWWIYSA-N	1	1	302.334	1.498	20	5		DDBDMO
Cc1noc(COC(=O)C[N@@H+](C)[C@@H]2CCSC2)c1[N+](=O)[O-]	ZINC000853908122	704333584	/nfs/dbraw/zinc/33/35/84/704333584.db2.gz	VQGXAPRBAIWVQL-SECBINFHSA-N	1	1	315.351	1.372	20	5		DDBDMO
Cc1noc(COC(=O)C[N@H+](C)[C@@H]2CCSC2)c1[N+](=O)[O-]	ZINC000853908122	704333586	/nfs/dbraw/zinc/33/35/86/704333586.db2.gz	VQGXAPRBAIWVQL-SECBINFHSA-N	1	1	315.351	1.372	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000855285677	704477460	/nfs/dbraw/zinc/47/74/60/704477460.db2.gz	ICYWRCVLKSVKJF-SECBINFHSA-N	1	1	324.356	1.919	20	5		DDBDMO
Cc1ccc(O[C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)nc1	ZINC000858036706	704660607	/nfs/dbraw/zinc/66/06/07/704660607.db2.gz	QWVURIQTNVLWPE-AWEZNQCLSA-N	1	1	317.349	1.648	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1	ZINC000859888694	705031038	/nfs/dbraw/zinc/03/10/38/705031038.db2.gz	JJPXQCLLLDAOGW-SGRMJCNGSA-N	1	1	324.402	1.614	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1	ZINC000859888697	705031155	/nfs/dbraw/zinc/03/11/55/705031155.db2.gz	JJPXQCLLLDAOGW-DQMOJMCFSA-N	1	1	324.402	1.614	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2C	ZINC000874845027	705199243	/nfs/dbraw/zinc/19/92/43/705199243.db2.gz	FFHMFTMKXKPHGU-KBPBESRZSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](n3ccnn3)C2)c1	ZINC000823469100	705250269	/nfs/dbraw/zinc/25/02/69/705250269.db2.gz	OQPLJUWJXPHQFP-GJZGRUSLSA-N	1	1	317.349	1.557	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825379944	705658452	/nfs/dbraw/zinc/65/84/52/705658452.db2.gz	UECFAZGVPIEYPG-XHDPSFHLSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000826970469	705902854	/nfs/dbraw/zinc/90/28/54/705902854.db2.gz	MPINPKCLVFHPEF-IFUGULHKSA-N	1	1	319.361	1.370	20	5		DDBDMO
Cc1nn(C[N@@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c2ccc([N+](=O)[O-])cc12	ZINC000863338843	705906396	/nfs/dbraw/zinc/90/63/96/705906396.db2.gz	UUTNZHJZFLQPMG-ZWNOBZJWSA-N	1	1	316.317	1.315	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c2ccc([N+](=O)[O-])cc12	ZINC000863338843	705906399	/nfs/dbraw/zinc/90/63/99/705906399.db2.gz	UUTNZHJZFLQPMG-ZWNOBZJWSA-N	1	1	316.317	1.315	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000827035607	705916207	/nfs/dbraw/zinc/91/62/07/705916207.db2.gz	RPHTYFSOPSWULA-ONERCXAPSA-N	1	1	319.361	1.227	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321180	705974887	/nfs/dbraw/zinc/97/48/87/705974887.db2.gz	USKDPSJOXSECDK-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321180	705974891	/nfs/dbraw/zinc/97/48/91/705974891.db2.gz	USKDPSJOXSECDK-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321180	705974893	/nfs/dbraw/zinc/97/48/93/705974893.db2.gz	USKDPSJOXSECDK-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[N@@H+](CCO)CC1	ZINC000881923541	707427071	/nfs/dbraw/zinc/42/70/71/707427071.db2.gz	BVSHHMJZNZDBDG-UHFFFAOYSA-N	1	1	307.350	1.302	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000830787743	706579308	/nfs/dbraw/zinc/57/93/08/706579308.db2.gz	ZVBZQLDTQHVXRI-UHFFFAOYSA-N	1	1	315.414	1.391	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000830787743	706579311	/nfs/dbraw/zinc/57/93/11/706579311.db2.gz	ZVBZQLDTQHVXRI-UHFFFAOYSA-N	1	1	315.414	1.391	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867147790	706909344	/nfs/dbraw/zinc/90/93/44/706909344.db2.gz	OJTOCWCQVJXYPU-QWRGUYRKSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867147788	706909436	/nfs/dbraw/zinc/90/94/36/706909436.db2.gz	OJTOCWCQVJXYPU-GHMZBOCLSA-N	1	1	309.341	1.827	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@H+](Cn1nc(C)c([N+](=O)[O-])c1C)CC2	ZINC000872827559	707617359	/nfs/dbraw/zinc/61/73/59/707617359.db2.gz	HLJLICRCHXTBPG-DOMZBBRYSA-N	1	1	322.365	1.783	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](Cn1nc(C)c([N+](=O)[O-])c1C)CC2	ZINC000872827559	707617360	/nfs/dbraw/zinc/61/73/60/707617360.db2.gz	HLJLICRCHXTBPG-DOMZBBRYSA-N	1	1	322.365	1.783	20	5		DDBDMO
C[C@@H]([NH2+][C@H]1C[C@H](S(C)(=O)=O)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000883376720	707987920	/nfs/dbraw/zinc/98/79/20/707987920.db2.gz	RNUYAWIPJFMLQP-OPRDCNLKSA-N	1	1	316.354	1.960	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1	ZINC000838912776	708002250	/nfs/dbraw/zinc/00/22/50/708002250.db2.gz	ONUQNNZRVNAUGY-GASCZTMLSA-N	1	1	320.345	1.544	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000883896427	708078246	/nfs/dbraw/zinc/07/82/46/708078246.db2.gz	PDJDVDXFZOORNF-CYBMUJFWSA-N	1	1	318.377	1.757	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000885931574	708665333	/nfs/dbraw/zinc/66/53/33/708665333.db2.gz	VRBYSPJECBHZIO-CQSZACIVSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H]1CN1CCOCC1	ZINC000886020471	708682658	/nfs/dbraw/zinc/68/26/58/708682658.db2.gz	AHORHOSPSFISKR-AWEZNQCLSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H]1CN1CCOCC1	ZINC000886020471	708682660	/nfs/dbraw/zinc/68/26/60/708682660.db2.gz	AHORHOSPSFISKR-AWEZNQCLSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCOCC2(CCOCC2)C1	ZINC000886125635	708702290	/nfs/dbraw/zinc/70/22/90/708702290.db2.gz	XMVJRCLUNOGXSD-UHFFFAOYSA-N	1	1	307.350	1.619	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCOCC2(CCOCC2)C1	ZINC000886125635	708702291	/nfs/dbraw/zinc/70/22/91/708702291.db2.gz	XMVJRCLUNOGXSD-UHFFFAOYSA-N	1	1	307.350	1.619	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)n1	ZINC000886597933	708788283	/nfs/dbraw/zinc/78/82/83/708788283.db2.gz	PTXCUHNLPMVFFJ-GFCCVEGCSA-N	1	1	323.397	1.614	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)n1	ZINC000886597933	708788285	/nfs/dbraw/zinc/78/82/85/708788285.db2.gz	PTXCUHNLPMVFFJ-GFCCVEGCSA-N	1	1	323.397	1.614	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]([C@H]2CCCO2)C1	ZINC000886823104	708854044	/nfs/dbraw/zinc/85/40/44/708854044.db2.gz	ZAIWXAMQLVNYLE-GXTWGEPZSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096537	713128858	/nfs/dbraw/zinc/12/88/58/713128858.db2.gz	MVOBRTKUXJWBPO-TZMCWYRMSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096537	713128859	/nfs/dbraw/zinc/12/88/59/713128859.db2.gz	MVOBRTKUXJWBPO-TZMCWYRMSA-N	1	1	321.402	1.904	20	5		DDBDMO
Cn1c2ccccc2c(N2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1=O	ZINC000891439004	710201245	/nfs/dbraw/zinc/20/12/45/710201245.db2.gz	YYIHCOFHNKQYSY-UHFFFAOYSA-N	1	1	316.361	1.589	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000892417922	710434104	/nfs/dbraw/zinc/43/41/04/710434104.db2.gz	KGYDYGUNERFCSF-HUUCEWRRSA-N	1	1	318.377	1.973	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928453564	713204274	/nfs/dbraw/zinc/20/42/74/713204274.db2.gz	OWSUDWXEZYAJAP-NEPJUHHUSA-N	1	1	306.366	1.606	20	5		DDBDMO
CC1(C)[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)C[C@@H]1[NH+]1CCOCC1	ZINC000911837027	711023995	/nfs/dbraw/zinc/02/39/95/711023995.db2.gz	BTWMRJDQWWSYAD-NEPJUHHUSA-N	1	1	323.349	1.417	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[N@@H+]2CCSC[C@H]12	ZINC000895570476	711545806	/nfs/dbraw/zinc/54/58/06/711545806.db2.gz	UMDURPGDSTZAHN-VXGBXAGGSA-N	1	1	324.406	1.990	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[N@H+]2CCSC[C@H]12	ZINC000895570476	711545808	/nfs/dbraw/zinc/54/58/08/711545808.db2.gz	UMDURPGDSTZAHN-VXGBXAGGSA-N	1	1	324.406	1.990	20	5		DDBDMO
C[C@H]1[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C	ZINC000895737879	711591294	/nfs/dbraw/zinc/59/12/94/711591294.db2.gz	GDCHUZWKTVPIMR-ONGXEEELSA-N	1	1	304.350	1.984	20	5		DDBDMO
C[C@@H]1[C@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[N@H+]1C	ZINC000895739555	711591881	/nfs/dbraw/zinc/59/18/81/711591881.db2.gz	GWAMZUUMLUEGIS-RKDXNWHRSA-N	1	1	306.322	1.430	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1NC[C@H]1CC[N@H+]1C1CCOCC1	ZINC000896526573	711738966	/nfs/dbraw/zinc/73/89/66/711738966.db2.gz	YXEGEJLLAPNSRL-LLVKDONJSA-N	1	1	310.329	1.794	20	5		DDBDMO
CN(C)c1cc[nH+]c(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000905524619	712064481	/nfs/dbraw/zinc/06/44/81/712064481.db2.gz	KFIUFXKJNNRSSA-MRXNPFEDSA-N	1	1	316.361	1.879	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C	ZINC000908123563	712693387	/nfs/dbraw/zinc/69/33/87/712693387.db2.gz	CUROJBWGSDJAMX-CZUORRHYSA-N	1	1	321.377	1.051	20	5		DDBDMO
O=[N+]([O-])c1nccn1Cc1cccc(C[NH+]2CCOCC2)c1	ZINC000918388076	713540929	/nfs/dbraw/zinc/54/09/29/713540929.db2.gz	WTWRXOKXAQIXDX-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000920599391	713682119	/nfs/dbraw/zinc/68/21/19/713682119.db2.gz	TUYFZWKSOOISLL-AAEUAGOBSA-N	1	1	306.366	1.529	20	5		DDBDMO
Cc1cc(NC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000930732764	713905961	/nfs/dbraw/zinc/90/59/61/713905961.db2.gz	VEPRLZDDTHALIN-TXEJJXNPSA-N	1	1	304.350	1.929	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)c1	ZINC000934255649	714776604	/nfs/dbraw/zinc/77/66/04/714776604.db2.gz	UYKMPXXWQJCOLF-CVEARBPZSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H]3[C@H]2CCCN3CCO)cc1	ZINC000934259195	714778414	/nfs/dbraw/zinc/77/84/14/714778414.db2.gz	HHRNWSJIZRUSNC-IAGOWNOFSA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)cc1	ZINC000934259195	714778416	/nfs/dbraw/zinc/77/84/16/714778416.db2.gz	HHRNWSJIZRUSNC-IAGOWNOFSA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)cc1	ZINC000934259195	714778418	/nfs/dbraw/zinc/77/84/18/714778418.db2.gz	HHRNWSJIZRUSNC-IAGOWNOFSA-N	1	1	319.405	1.668	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nccc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000591186751	719426860	/nfs/dbraw/zinc/42/68/60/719426860.db2.gz	XOBFLWRFKXMHKS-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc(C(F)(F)F)c([N+](=O)[O-])c1	ZINC001167358617	733288445	/nfs/dbraw/zinc/28/84/45/733288445.db2.gz	WTXOIKIKHYEXIL-UHFFFAOYSA-N	1	1	313.239	1.737	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022061530	734366924	/nfs/dbraw/zinc/36/69/24/734366924.db2.gz	MJSXMQJWAVVYHF-GFQSEFKGSA-N	1	1	307.325	1.228	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCCC1	ZINC001039583171	735103528	/nfs/dbraw/zinc/10/35/28/735103528.db2.gz	FRPVYODUZSDOOJ-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CCCC1	ZINC001039583171	735103529	/nfs/dbraw/zinc/10/35/29/735103529.db2.gz	FRPVYODUZSDOOJ-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCCC1	ZINC001039583171	735103530	/nfs/dbraw/zinc/10/35/30/735103530.db2.gz	FRPVYODUZSDOOJ-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC001167778647	738255251	/nfs/dbraw/zinc/25/52/51/738255251.db2.gz	JZEUDNPHWHDTPD-GFCCVEGCSA-N	1	1	319.365	1.002	20	5		DDBDMO
O=C(NCC[NH2+]CCCCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936819	742839046	/nfs/dbraw/zinc/83/90/46/742839046.db2.gz	SNFLAFUVRHQKHK-HUUCEWRRSA-N	1	1	305.378	1.380	20	5		DDBDMO
CNc1cc([N+](=O)[O-])cnc1NCC1([NH+]2CCCC2)COC1	ZINC001168443653	744923398	/nfs/dbraw/zinc/92/33/98/744923398.db2.gz	NSUSVGKGBBVZKG-UHFFFAOYSA-N	1	1	307.354	1.308	20	5		DDBDMO
C[C@@H](O)[C@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC001194723994	746450134	/nfs/dbraw/zinc/45/01/34/746450134.db2.gz	PKXDHVRPLYZCIT-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccsc2)CC1	ZINC000996442558	749576605	/nfs/dbraw/zinc/57/66/05/749576605.db2.gz	XSKZWOTYJJZVFO-CHWSQXEVSA-N	1	1	309.391	1.494	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@]3(CCN3c3ncccn3)C2)C1	ZINC001169019739	762199859	/nfs/dbraw/zinc/19/98/59/762199859.db2.gz	JEJZIQYLZAAPHA-YCPHGPKFSA-N	1	1	317.393	1.577	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CC2CC3(CCC3)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139988	760614022	/nfs/dbraw/zinc/61/40/22/760614022.db2.gz	RXJYMGCZGUEGKS-AAVRWANBSA-N	1	1	307.394	1.469	20	5		DDBDMO
Cc1ccncc1C[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086363099	761492479	/nfs/dbraw/zinc/49/24/79/761492479.db2.gz	BNZXKZNVSYMNQE-NMFUWQPSSA-N	1	1	318.377	1.040	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CCc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363573	761499423	/nfs/dbraw/zinc/49/94/23/761499423.db2.gz	BIVXXNVEPIQHQK-HBJVGIJOSA-N	1	1	323.418	1.440	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@@H+](C)C1	ZINC001136342456	771942472	/nfs/dbraw/zinc/94/24/72/771942472.db2.gz	RAUSYUYVGUBVAY-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101757067	777479790	/nfs/dbraw/zinc/47/97/90/777479790.db2.gz	YDOHQROQQUKOGN-UHFFFAOYSA-N	1	1	309.370	1.202	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC001176556450	778180520	/nfs/dbraw/zinc/18/05/20/778180520.db2.gz	YDQDVIGRLOOVNS-BJJXKVORSA-N	1	1	319.361	1.216	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001177513636	778629790	/nfs/dbraw/zinc/62/97/90/778629790.db2.gz	GEHYSYZMAPZTPR-UHFFFAOYSA-N	1	1	303.322	1.366	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2	ZINC001177879695	778790281	/nfs/dbraw/zinc/79/02/81/778790281.db2.gz	LRMQPRZYZVIHOM-WCQYABFASA-N	1	1	318.377	1.945	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCNc2ccc(C)c[nH+]2)n1	ZINC001178609429	779112440	/nfs/dbraw/zinc/11/24/40/779112440.db2.gz	KNUCUAHKZYCINQ-UHFFFAOYSA-N	1	1	318.337	1.357	20	5		DDBDMO
Cc1c[nH]nc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001267195184	837514943	/nfs/dbraw/zinc/51/49/43/837514943.db2.gz	QIFZXVNTCWDINA-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
Cc1c[nH]nc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001267195184	837514947	/nfs/dbraw/zinc/51/49/47/837514947.db2.gz	QIFZXVNTCWDINA-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCN(C)Cc1ccccc1[N+](=O)[O-]	ZINC001267232729	837574724	/nfs/dbraw/zinc/57/47/24/837574724.db2.gz	LKBSCJFDHXQLMX-UHFFFAOYSA-N	1	1	322.409	1.483	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc([N+](=O)[O-])c1Cl)[C@H]1CC[N@@H+](C)C1	ZINC001143030063	861347038	/nfs/dbraw/zinc/34/70/38/861347038.db2.gz	XXPAUMJIWTYUJH-QMMMGPOBSA-N	1	1	315.761	1.528	20	5		DDBDMO
Cc1nc(Cl)c([N+](=O)[O-])c(N2C[C@H]3CCC[N@H+](C)[C@@H]3C2)n1	ZINC001157260241	863688658	/nfs/dbraw/zinc/68/86/58/863688658.db2.gz	INIQPVVXJDNMCV-NXEZZACHSA-N	1	1	311.773	1.877	20	5		DDBDMO
COc1nc(NCC2([NH+]3CCCC3)COC2)ccc1[N+](=O)[O-]	ZINC001157649792	864011111	/nfs/dbraw/zinc/01/11/11/864011111.db2.gz	CARHZWGEMXJEMZ-UHFFFAOYSA-N	1	1	308.338	1.275	20	5		DDBDMO
Cc1ccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1F	ZINC001157767504	864118152	/nfs/dbraw/zinc/11/81/52/864118152.db2.gz	PDYYKCLHVQPLHF-TZMCWYRMSA-N	1	1	309.341	1.395	20	5		DDBDMO
O=C(NCCC[NH2+]CC/C=C\c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767503	864117705	/nfs/dbraw/zinc/11/77/05/864117705.db2.gz	PCNYGMQTINUUFC-JKUHXPQUSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[C@@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC001154042474	864352593	/nfs/dbraw/zinc/35/25/93/864352593.db2.gz	ISWWEGZOYGYSBU-SECBINFHSA-N	1	1	306.322	1.076	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCC[C@@H](CF)C1)c1cccc([N+](=O)[O-])c1	ZINC001333216287	866528123	/nfs/dbraw/zinc/52/81/23/866528123.db2.gz	UUNXPZIEIZNOLN-NHYWBVRUSA-N	1	1	309.341	1.977	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@H](C(C)C)[NH+]1CCOCC1	ZINC001320575395	866846642	/nfs/dbraw/zinc/84/66/42/866846642.db2.gz	BIQFAEQOFUBONU-CYBMUJFWSA-N	1	1	308.382	1.489	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@H]2[C@H](CCC[N@H+]2C)C1	ZINC001333710525	866954659	/nfs/dbraw/zinc/95/46/59/866954659.db2.gz	LHTNYPBFYRVNIE-YPMHNXCESA-N	1	1	306.366	1.919	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N[C@@]2(C)CCC[N@H+](C)C2)n1	ZINC001162339565	867472013	/nfs/dbraw/zinc/47/20/13/867472013.db2.gz	LYYOFRQKBGDFTQ-AWEZNQCLSA-N	1	1	322.369	1.548	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@](O)(C3CC3)C1)OCCO2	ZINC001321356383	867524131	/nfs/dbraw/zinc/52/41/31/867524131.db2.gz	FGHNWRITLOPFIH-MRXNPFEDSA-N	1	1	320.345	1.713	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H]1C[C@H]3COC[C@H]3O1)CC2	ZINC001334613744	867710836	/nfs/dbraw/zinc/71/08/36/867710836.db2.gz	JGWGQTPHQHFIPT-CWRNSKLLSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@H]3COC[C@H]3O1)CC2	ZINC001334613744	867710843	/nfs/dbraw/zinc/71/08/43/867710843.db2.gz	JGWGQTPHQHFIPT-CWRNSKLLSA-N	1	1	304.346	1.757	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC001335420940	868286350	/nfs/dbraw/zinc/28/63/50/868286350.db2.gz	KFACAIAOJWPRQN-ZDUSSCGKSA-N	1	1	320.393	1.778	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])cc1NCCn1cc[nH+]c1C	ZINC001163923408	868794942	/nfs/dbraw/zinc/79/49/42/868794942.db2.gz	IGEBAYPOXCKYQK-UHFFFAOYSA-N	1	1	304.306	1.998	20	5		DDBDMO
O=C(CC[N@@H+]1C2CCC1(CO)CC2)Nc1ccc([N+](=O)[O-])cc1	ZINC001336287333	868842797	/nfs/dbraw/zinc/84/27/97/868842797.db2.gz	MHOCLGFGASOSGQ-UHFFFAOYSA-N	1	1	319.361	1.913	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1ccc([N+](=O)[O-])cc1C(N)=O)C2	ZINC001226165629	882242266	/nfs/dbraw/zinc/24/22/66/882242266.db2.gz	MLHFNFXEIRIIJO-PEGIJTEDSA-N	1	1	305.334	1.698	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCCC[N@H+](C)C2)n1	ZINC001300873793	870965274	/nfs/dbraw/zinc/96/52/74/870965274.db2.gz	NCZBGSBASOPRTO-LBPRGKRZSA-N	1	1	306.366	1.760	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C	ZINC001340856772	871389535	/nfs/dbraw/zinc/38/95/35/871389535.db2.gz	JXJSOYXBNJLVIS-ZDUSSCGKSA-N	1	1	320.393	1.875	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N1CCC(c2c[nH+]cn2C)CC1	ZINC001340864620	871398255	/nfs/dbraw/zinc/39/82/55/871398255.db2.gz	GQGQOJDBAILCBA-UHFFFAOYSA-N	1	1	319.369	1.192	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)NCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC001341343880	871615910	/nfs/dbraw/zinc/61/59/10/871615910.db2.gz	JFYXXXOYBVLAAJ-AEGPPILISA-N	1	1	318.377	1.734	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC001318815850	872286326	/nfs/dbraw/zinc/28/63/26/872286326.db2.gz	UEHBQLRXBUXWOK-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC001348031230	874340293	/nfs/dbraw/zinc/34/02/93/874340293.db2.gz	IQROKTLJSHSKOU-ONGXEEELSA-N	1	1	302.338	1.532	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CNc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC001348747745	874758264	/nfs/dbraw/zinc/75/82/64/874758264.db2.gz	PBKDVQJZQYUTPO-RWMBFGLXSA-N	1	1	318.377	1.463	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC001348969842	874902543	/nfs/dbraw/zinc/90/25/43/874902543.db2.gz	JICKUAJEBJEVGG-NHYWBVRUSA-N	1	1	318.377	1.803	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC001353102719	877121311	/nfs/dbraw/zinc/12/13/11/877121311.db2.gz	PRVPKVIHLYNYLO-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H](C)C[N+](C)(C)C)cc1O	ZINC001228813390	883685234	/nfs/dbraw/zinc/68/52/34/883685234.db2.gz	BZIOBONGOVGEPR-SECBINFHSA-O	1	1	313.330	1.561	20	5		DDBDMO
C[C@@H]1CNC(=O)C[N@@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254479811	896455506	/nfs/dbraw/zinc/45/55/06/896455506.db2.gz	MNZSLXJPVQNXIK-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
C[C@@H]1CNC(=O)C[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254479811	896455511	/nfs/dbraw/zinc/45/55/11/896455511.db2.gz	MNZSLXJPVQNXIK-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
CN1CCO[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21	ZINC001254593922	896520354	/nfs/dbraw/zinc/52/03/54/896520354.db2.gz	BULMUPHZKPLLIM-XHSDSOJGSA-N	1	1	303.362	1.077	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000305768955	231046626	/nfs/dbraw/zinc/04/66/26/231046626.db2.gz	VJXIKCWAOIZXTL-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@]12C[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000451378525	231081343	/nfs/dbraw/zinc/08/13/43/231081343.db2.gz	YCSRAVJDXLUOAI-IVCRCZCHSA-N	1	1	318.377	1.296	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@](O)(C(F)F)C1	ZINC000451432901	231093101	/nfs/dbraw/zinc/09/31/01/231093101.db2.gz	OPRWQZOGZCNAHA-CYBMUJFWSA-N	1	1	302.277	1.676	20	5		DDBDMO
COc1ccccc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090512176	185299638	/nfs/dbraw/zinc/29/96/38/185299638.db2.gz	MQSMDVRJERHWGH-UHFFFAOYSA-N	1	1	317.345	1.897	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090550847	185302257	/nfs/dbraw/zinc/30/22/57/185302257.db2.gz	ZULAFDQXPPPVQS-AWEZNQCLSA-N	1	1	322.409	1.563	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000092763118	185338474	/nfs/dbraw/zinc/33/84/74/185338474.db2.gz	URAFSQWVMZKADY-LBPRGKRZSA-N	1	1	316.361	1.810	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000425047900	529821862	/nfs/dbraw/zinc/82/18/62/529821862.db2.gz	AHUHGPNRBPEALX-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1(CO)CCOCC1	ZINC000444701071	530022790	/nfs/dbraw/zinc/02/27/90/530022790.db2.gz	HAGBSYKPKBDTTB-UHFFFAOYSA-N	1	1	320.349	1.444	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000299295495	530063496	/nfs/dbraw/zinc/06/34/96/530063496.db2.gz	CREWJXFWCYRLIL-AWEZNQCLSA-N	1	1	316.361	1.760	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)(C)O	ZINC000265125741	282357294	/nfs/dbraw/zinc/35/72/94/282357294.db2.gz	LCJIYALNOVIARC-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)(C)O	ZINC000265125741	282357298	/nfs/dbraw/zinc/35/72/98/282357298.db2.gz	LCJIYALNOVIARC-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)[C@@H]2C)c1[N+](=O)[O-]	ZINC000287100140	219311865	/nfs/dbraw/zinc/31/18/65/219311865.db2.gz	LIENOEOBFRFOQW-JQWIXIFHSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)n1	ZINC000191854519	186264767	/nfs/dbraw/zinc/26/47/67/186264767.db2.gz	VMXLUOKTKZIKBP-RYUDHWBXSA-N	1	1	321.381	1.368	20	5		DDBDMO
CC(C)C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[NH+]1CCOCC1	ZINC000041887894	352317384	/nfs/dbraw/zinc/31/73/84/352317384.db2.gz	SKNPQDKWEOWRIE-LBPRGKRZSA-N	1	1	324.381	1.400	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@H]3CO)n2)c1	ZINC000047496301	352498774	/nfs/dbraw/zinc/49/87/74/352498774.db2.gz	CFZCWCOOOVJZPP-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@H]3CO)n2)c1	ZINC000047496301	352498779	/nfs/dbraw/zinc/49/87/79/352498779.db2.gz	CFZCWCOOOVJZPP-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000491236702	234111739	/nfs/dbraw/zinc/11/17/39/234111739.db2.gz	LFLATDWQKVCQAT-LLPBQKLSSA-N	1	1	301.346	1.961	20	5		DDBDMO
O=C(CCNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000057553761	352820533	/nfs/dbraw/zinc/82/05/33/352820533.db2.gz	AUURCQFOPPDLOT-LBPRGKRZSA-N	1	1	318.377	1.750	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000067724508	353064985	/nfs/dbraw/zinc/06/49/85/353064985.db2.gz	YXFVCFUBMZTSRV-UHFFFAOYSA-N	1	1	324.381	1.362	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccco1	ZINC000067285419	353042131	/nfs/dbraw/zinc/04/21/31/353042131.db2.gz	HPTNFLUUIGXJFD-LBPRGKRZSA-N	1	1	321.337	1.194	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+](C)CC	ZINC000068960811	353138808	/nfs/dbraw/zinc/13/88/08/353138808.db2.gz	ITXXTWMNPGGOMY-UHFFFAOYSA-N	1	1	315.395	1.387	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1csc([N+](=O)[O-])c1	ZINC000076002451	353390029	/nfs/dbraw/zinc/39/00/29/353390029.db2.gz	WMEJLPXMBQAWOM-NSHDSACASA-N	1	1	313.379	1.497	20	5		DDBDMO
C[C@H](c1ccccc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174663749	198367350	/nfs/dbraw/zinc/36/73/50/198367350.db2.gz	AWSBLIBGLYVMAC-DOMZBBRYSA-N	1	1	304.350	1.845	20	5		DDBDMO
Cc1ncc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)s1	ZINC000174738281	198378313	/nfs/dbraw/zinc/37/83/13/198378313.db2.gz	OKLAZSYZRVYCJF-LLVKDONJSA-N	1	1	311.367	1.049	20	5		DDBDMO
CC(=O)N1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000182180934	199399309	/nfs/dbraw/zinc/39/93/09/199399309.db2.gz	IVTSANSPVYZGOV-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(=O)N1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000182180934	199399310	/nfs/dbraw/zinc/39/93/10/199399310.db2.gz	IVTSANSPVYZGOV-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1ccnc(N2CC[NH+](CCOC(C)C)CC2)c1[N+](=O)[O-]	ZINC000080606359	353617833	/nfs/dbraw/zinc/61/78/33/353617833.db2.gz	SVXRODJYBMEVOC-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CC[NH+](C)C)Cc2ccco2)c1[N+](=O)[O-]	ZINC000088348546	353754174	/nfs/dbraw/zinc/75/41/74/353754174.db2.gz	YTXDAZNQGNKKFT-UHFFFAOYSA-N	1	1	321.337	1.423	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000092642226	353865041	/nfs/dbraw/zinc/86/50/41/353865041.db2.gz	LFLQMISBZFBRNX-ZDUSSCGKSA-N	1	1	320.393	1.903	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000093332711	353895663	/nfs/dbraw/zinc/89/56/63/353895663.db2.gz	JELPDOFQFIXSMW-ZLDLUXBVSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H](C)C1	ZINC000346178542	283014302	/nfs/dbraw/zinc/01/43/02/283014302.db2.gz	LLZLRWIMXJCWIV-SDDRHHMPSA-N	1	1	321.381	1.131	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000587862309	354886426	/nfs/dbraw/zinc/88/64/26/354886426.db2.gz	ZYLVHXOSICBFEU-GXTWGEPZSA-N	1	1	309.341	1.769	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[NH+](C(C)(C)CO)CC1	ZINC000588818984	354939601	/nfs/dbraw/zinc/93/96/01/354939601.db2.gz	FEKNHXZHJKPVDL-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)cc([N+](=O)[O-])c1	ZINC000588830348	354940295	/nfs/dbraw/zinc/94/02/95/354940295.db2.gz	XXOSGUDASVGQJY-OAHLLOKOSA-N	1	1	318.377	1.023	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)c1sccc1[N+](=O)[O-]	ZINC000588858285	354943425	/nfs/dbraw/zinc/94/34/25/354943425.db2.gz	XKYLBTCLKBGEMH-UHFFFAOYSA-N	1	1	300.428	1.976	20	5		DDBDMO
CN(CCCN(C)c1sccc1[N+](=O)[O-])CC[NH+](C)C	ZINC000588858285	354943427	/nfs/dbraw/zinc/94/34/27/354943427.db2.gz	XKYLBTCLKBGEMH-UHFFFAOYSA-N	1	1	300.428	1.976	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC[N@@H+](C)CC2)c1	ZINC000589494319	354995828	/nfs/dbraw/zinc/99/58/28/354995828.db2.gz	INTPRRSLCHUVOJ-UHFFFAOYSA-N	1	1	307.350	1.519	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@@H](C)O)C(C)C)c1	ZINC000589499610	354997042	/nfs/dbraw/zinc/99/70/42/354997042.db2.gz	XOWVQSIBVRXKSP-LLVKDONJSA-N	1	1	310.350	1.973	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](O)CC2)c1	ZINC000590381708	355079060	/nfs/dbraw/zinc/07/90/60/355079060.db2.gz	BPEMHNDWXHCBLU-CYBMUJFWSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](O)CC2)c1	ZINC000590381708	355079061	/nfs/dbraw/zinc/07/90/61/355079061.db2.gz	BPEMHNDWXHCBLU-CYBMUJFWSA-N	1	1	308.334	1.728	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000590522886	355107762	/nfs/dbraw/zinc/10/77/62/355107762.db2.gz	DIOAERDSMRAYFP-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000590522886	355107764	/nfs/dbraw/zinc/10/77/64/355107764.db2.gz	DIOAERDSMRAYFP-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000590442695	355096727	/nfs/dbraw/zinc/09/67/27/355096727.db2.gz	ACHHCXYGGZBWPW-WCQYABFASA-N	1	1	305.334	1.380	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000590445087	355098890	/nfs/dbraw/zinc/09/88/90/355098890.db2.gz	MZZOLIKOZFCJBD-WCQYABFASA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000590446510	355099710	/nfs/dbraw/zinc/09/97/10/355099710.db2.gz	WBWYIZYCOOEZEF-FZMZJTMJSA-N	1	1	323.780	1.953	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000590697140	355150158	/nfs/dbraw/zinc/15/01/58/355150158.db2.gz	GHKFQGBSUVFVMR-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2N1CC[N@H+]2CCOC[C@H]2C1	ZINC000590697140	355150164	/nfs/dbraw/zinc/15/01/64/355150164.db2.gz	GHKFQGBSUVFVMR-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000565159466	304047734	/nfs/dbraw/zinc/04/77/34/304047734.db2.gz	YVFNQMVCYPTKCR-INIZCTEOSA-N	1	1	307.394	1.872	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593029221	355774383	/nfs/dbraw/zinc/77/43/83/355774383.db2.gz	RPAJQNRKIOGVPE-LLVKDONJSA-N	1	1	310.350	1.974	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000593130627	355807855	/nfs/dbraw/zinc/80/78/55/355807855.db2.gz	BAXQGSZIVBHVTE-CYBMUJFWSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593130627	355807859	/nfs/dbraw/zinc/80/78/59/355807859.db2.gz	BAXQGSZIVBHVTE-CYBMUJFWSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000593188341	355820946	/nfs/dbraw/zinc/82/09/46/355820946.db2.gz	DHWAWRGMLVUYSP-GRYCIOLGSA-N	1	1	323.397	1.429	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000593455560	355890659	/nfs/dbraw/zinc/89/06/59/355890659.db2.gz	WEWXEMXIJMKCMV-AWEZNQCLSA-N	1	1	321.352	1.877	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000594360318	356182909	/nfs/dbraw/zinc/18/29/09/356182909.db2.gz	QUUMHVCVHMDJCX-VHSXEESVSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000594360318	356182914	/nfs/dbraw/zinc/18/29/14/356182914.db2.gz	QUUMHVCVHMDJCX-VHSXEESVSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000594360318	356182917	/nfs/dbraw/zinc/18/29/17/356182917.db2.gz	QUUMHVCVHMDJCX-VHSXEESVSA-N	1	1	307.354	1.189	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2C[NH+](CC3(O)CCSCC3)C2)cc1	ZINC000594714273	356294012	/nfs/dbraw/zinc/29/40/12/356294012.db2.gz	LRXXEQPNIITDSZ-UHFFFAOYSA-N	1	1	324.402	1.916	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019555	356372963	/nfs/dbraw/zinc/37/29/63/356372963.db2.gz	QXZWBVXBCNAQGA-OLZOCXBDSA-N	1	1	323.393	1.975	20	5		DDBDMO
COCC[N@H+]1CC[C@H](N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019555	356372966	/nfs/dbraw/zinc/37/29/66/356372966.db2.gz	QXZWBVXBCNAQGA-OLZOCXBDSA-N	1	1	323.393	1.975	20	5		DDBDMO
COCCCOC1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1	ZINC000595326577	356449950	/nfs/dbraw/zinc/44/99/50/356449950.db2.gz	MBRVZXVYTRXGBA-UHFFFAOYSA-N	1	1	313.354	1.909	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000595328535	356450696	/nfs/dbraw/zinc/45/06/96/356450696.db2.gz	WMNDGZHOEHCGJF-CYBMUJFWSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000595328535	356450701	/nfs/dbraw/zinc/45/07/01/356450701.db2.gz	WMNDGZHOEHCGJF-CYBMUJFWSA-N	1	1	323.368	1.888	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000595292274	356435506	/nfs/dbraw/zinc/43/55/06/356435506.db2.gz	XYAHCMLRLGTSTM-UHFFFAOYSA-N	1	1	322.365	1.726	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595458659	356500368	/nfs/dbraw/zinc/50/03/68/356500368.db2.gz	JMEZZMRMWRHBBV-CYBMUJFWSA-N	1	1	300.330	1.952	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595458659	356500371	/nfs/dbraw/zinc/50/03/71/356500371.db2.gz	JMEZZMRMWRHBBV-CYBMUJFWSA-N	1	1	300.330	1.952	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](N3CCCC3=O)CC2)c1[N+](=O)[O-]	ZINC000595546730	356543165	/nfs/dbraw/zinc/54/31/65/356543165.db2.gz	QNADSUNLATZVHI-GFCCVEGCSA-N	1	1	322.365	1.868	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](N3CCCC3=O)CC2)c1[N+](=O)[O-]	ZINC000595546730	356543168	/nfs/dbraw/zinc/54/31/68/356543168.db2.gz	QNADSUNLATZVHI-GFCCVEGCSA-N	1	1	322.365	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595742450	356631265	/nfs/dbraw/zinc/63/12/65/356631265.db2.gz	GOZQKZSFLSYNOP-ATCWAGBWSA-N	1	1	321.377	1.790	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595742450	356631268	/nfs/dbraw/zinc/63/12/68/356631268.db2.gz	GOZQKZSFLSYNOP-ATCWAGBWSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1COCCO1	ZINC000595744937	356632252	/nfs/dbraw/zinc/63/22/52/356632252.db2.gz	WJBFRGARQPGQTO-BXUZGUMPSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1COCCO1	ZINC000595744937	356632255	/nfs/dbraw/zinc/63/22/55/356632255.db2.gz	WJBFRGARQPGQTO-BXUZGUMPSA-N	1	1	323.349	1.269	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000595744232	356632728	/nfs/dbraw/zinc/63/27/28/356632728.db2.gz	UUBOYUKBTWJOIP-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595755459	356637413	/nfs/dbraw/zinc/63/74/13/356637413.db2.gz	ARLLWCNSJQONHQ-BFQNTYOBSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760087	356641048	/nfs/dbraw/zinc/64/10/48/356641048.db2.gz	SAAVOGBZDSXQDV-ABAIWWIYSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760087	356641049	/nfs/dbraw/zinc/64/10/49/356641049.db2.gz	SAAVOGBZDSXQDV-ABAIWWIYSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@@H]1COC2(CCCC2)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000595816420	356661841	/nfs/dbraw/zinc/66/18/41/356661841.db2.gz	WZMKQJBKGLOCLA-TZMCWYRMSA-N	1	1	324.381	1.186	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595868889	356684745	/nfs/dbraw/zinc/68/47/45/356684745.db2.gz	BYLHVNQMQXXRLP-OZVIIMIRSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595868889	356684748	/nfs/dbraw/zinc/68/47/48/356684748.db2.gz	BYLHVNQMQXXRLP-OZVIIMIRSA-N	1	1	321.377	1.872	20	5		DDBDMO
CCC[C@@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CC[N@H+]1CCOC	ZINC000596177473	356802744	/nfs/dbraw/zinc/80/27/44/356802744.db2.gz	LWRWWDDXJOWOTF-GFCCVEGCSA-N	1	1	323.397	1.509	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CSc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596285541	356845492	/nfs/dbraw/zinc/84/54/92/356845492.db2.gz	NQZUZOBAMUSGEO-SECBINFHSA-N	1	1	311.363	1.116	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CSc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596285541	356845495	/nfs/dbraw/zinc/84/54/95/356845495.db2.gz	NQZUZOBAMUSGEO-SECBINFHSA-N	1	1	311.363	1.116	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NCC23CC(C2)C[NH2+]3)n1	ZINC000596655748	356944203	/nfs/dbraw/zinc/94/42/03/356944203.db2.gz	YMPOMNMHHOOICJ-DNCHLWJUSA-N	1	1	305.382	1.617	20	5		DDBDMO
CCN(C(=O)NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000596517249	356903477	/nfs/dbraw/zinc/90/34/77/356903477.db2.gz	FYLUBQKUVKETCW-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc([N+](=O)[O-])cn1)C2	ZINC000597716681	357300185	/nfs/dbraw/zinc/30/01/85/357300185.db2.gz	RREHIXCMCPSYTH-HNNXBMFYSA-N	1	1	304.350	1.548	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(CC)[C@@H]2CC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000598043929	357440410	/nfs/dbraw/zinc/44/04/10/357440410.db2.gz	XMIBSJMATBSRNC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC)[C@@H]2CC[N@H+](CC)C2)c1[N+](=O)[O-]	ZINC000598043929	357440413	/nfs/dbraw/zinc/44/04/13/357440413.db2.gz	XMIBSJMATBSRNC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC)[C@@H]2CC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000598043929	357440420	/nfs/dbraw/zinc/44/04/20/357440420.db2.gz	XMIBSJMATBSRNC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1CO	ZINC000598643500	357666357	/nfs/dbraw/zinc/66/63/57/357666357.db2.gz	LMUYIPKAVOKOKM-VNHYZAJKSA-N	1	1	324.377	1.285	20	5		DDBDMO
Cn1c(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000598562522	357633593	/nfs/dbraw/zinc/63/35/93/357633593.db2.gz	VRYZBSYCVJXJEH-CYBMUJFWSA-N	1	1	320.393	1.785	20	5		DDBDMO
O=C1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCN1C1CCC1	ZINC000599020586	357796764	/nfs/dbraw/zinc/79/67/64/357796764.db2.gz	TXJJHQAACAKSSO-CQSZACIVSA-N	1	1	307.325	1.977	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1NCC[N@@H+]1CC[C@@H](O)C1)CCCC2	ZINC000599176743	357840095	/nfs/dbraw/zinc/84/00/95/357840095.db2.gz	WBICNJDUHNCKKS-GFCCVEGCSA-N	1	1	306.366	1.347	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@H](O)C2)c2ncccc12	ZINC000599199413	357847734	/nfs/dbraw/zinc/84/77/34/357847734.db2.gz	JYDFTLPBNNFGCO-NSHDSACASA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(C)COC1	ZINC000599571634	357979529	/nfs/dbraw/zinc/97/95/29/357979529.db2.gz	OKMJQLAWSBIYKR-LLVKDONJSA-N	1	1	307.350	1.890	20	5		DDBDMO
O=C(CN1CC[NH+](CCCF)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000599667678	358016288	/nfs/dbraw/zinc/01/62/88/358016288.db2.gz	IBMKEIWDMVBJII-UHFFFAOYSA-N	1	1	324.356	1.511	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000599673175	358019513	/nfs/dbraw/zinc/01/95/13/358019513.db2.gz	QOIMTLDORXYMSN-VDISTLRHSA-N	1	1	307.350	1.260	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000600193359	358151692	/nfs/dbraw/zinc/15/16/92/358151692.db2.gz	UZPZHZFJHPANIZ-OAHLLOKOSA-N	1	1	308.334	1.667	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000600193359	358151694	/nfs/dbraw/zinc/15/16/94/358151694.db2.gz	UZPZHZFJHPANIZ-OAHLLOKOSA-N	1	1	308.334	1.667	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000600193358	358151967	/nfs/dbraw/zinc/15/19/67/358151967.db2.gz	UZPZHZFJHPANIZ-HNNXBMFYSA-N	1	1	308.334	1.667	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000600193358	358151972	/nfs/dbraw/zinc/15/19/72/358151972.db2.gz	UZPZHZFJHPANIZ-HNNXBMFYSA-N	1	1	308.334	1.667	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCCCC1	ZINC000600228488	358162361	/nfs/dbraw/zinc/16/23/61/358162361.db2.gz	BTAJWUXRCXLZFL-GFCCVEGCSA-N	1	1	321.381	1.465	20	5		DDBDMO
CN(c1cc[nH+]c2ccc([N+](=O)[O-])cc21)[C@H]1CCN(C)C1=O	ZINC000601120656	358410643	/nfs/dbraw/zinc/41/06/43/358410643.db2.gz	JKOGNQHNZCJSNJ-AWEZNQCLSA-N	1	1	300.318	1.810	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601973313	358760326	/nfs/dbraw/zinc/76/03/26/358760326.db2.gz	JVXPQFJQNQMZCG-UTUOFQBUSA-N	1	1	305.334	1.500	20	5		DDBDMO
C[N@@H+]1CCCC[C@H]1C(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602195917	358876776	/nfs/dbraw/zinc/87/67/76/358876776.db2.gz	MSYJFYDMDLIOSR-HOCLYGCPSA-N	1	1	321.377	1.403	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602195917	358876778	/nfs/dbraw/zinc/87/67/78/358876778.db2.gz	MSYJFYDMDLIOSR-HOCLYGCPSA-N	1	1	321.377	1.403	20	5		DDBDMO
C[C@@H](CCN(C)C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000602535646	359032921	/nfs/dbraw/zinc/03/29/21/359032921.db2.gz	WEGILRZNUNYBTH-ZDUSSCGKSA-N	1	1	321.425	1.888	20	5		DDBDMO
CO[C@]1(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCOC1	ZINC000602472615	359002066	/nfs/dbraw/zinc/00/20/66/359002066.db2.gz	JBTCOSOISMCYIR-WFASDCNBSA-N	1	1	322.365	1.282	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602662262	359109329	/nfs/dbraw/zinc/10/93/29/359109329.db2.gz	NKACZYITYMIHOT-GFCCVEGCSA-N	1	1	309.370	1.067	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681231	359122423	/nfs/dbraw/zinc/12/24/23/359122423.db2.gz	MWKSYFYJSHXJTO-APPZFPTMSA-N	1	1	308.260	1.073	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681231	359122425	/nfs/dbraw/zinc/12/24/25/359122425.db2.gz	MWKSYFYJSHXJTO-APPZFPTMSA-N	1	1	308.260	1.073	20	5		DDBDMO
Cc1nn(C)cc1[C@H]1CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602789276	359192952	/nfs/dbraw/zinc/19/29/52/359192952.db2.gz	UAVWXWIIFLQZOG-CQSZACIVSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cn1cc(C[N@H+](C)[C@@H](CO)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602883147	359266492	/nfs/dbraw/zinc/26/64/92/359266492.db2.gz	IGXFKVVMFXOLDX-CQSZACIVSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cn1cc(C[N@@H+](C)[C@@H](CO)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602883147	359266497	/nfs/dbraw/zinc/26/64/97/359266497.db2.gz	IGXFKVVMFXOLDX-CQSZACIVSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)C[C@H]1CCC[N@H+]1C	ZINC000602960195	359322476	/nfs/dbraw/zinc/32/24/76/359322476.db2.gz	KKSFRMKPBKXQSU-LLVKDONJSA-N	1	1	307.354	1.278	20	5		DDBDMO
Cc1c(CN(C)CC(=O)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000602989201	359341195	/nfs/dbraw/zinc/34/11/95/359341195.db2.gz	HFWPDDZKMWHGHF-UHFFFAOYSA-N	1	1	320.393	1.109	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000187362788	200101938	/nfs/dbraw/zinc/10/19/38/200101938.db2.gz	PFUTXEKQZYIIOW-UHFFFAOYSA-N	1	1	317.349	1.892	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@H]3CCC[C@H]32)c1	ZINC000281065384	216055924	/nfs/dbraw/zinc/05/59/24/216055924.db2.gz	KKHRHEBXUSDUAU-BMFZPTHFSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@H]3CCC[C@H]32)c1	ZINC000281065384	216055927	/nfs/dbraw/zinc/05/59/27/216055927.db2.gz	KKHRHEBXUSDUAU-BMFZPTHFSA-N	1	1	322.361	1.588	20	5		DDBDMO
CC1(C)CN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)CC[NH2+]1	ZINC000579375207	422759871	/nfs/dbraw/zinc/75/98/71/422759871.db2.gz	ALWAVVQQTWQRKH-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1	ZINC000609269114	360286049	/nfs/dbraw/zinc/28/60/49/360286049.db2.gz	LFKIQEROWAIKGK-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+](C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000609599861	360331562	/nfs/dbraw/zinc/33/15/62/360331562.db2.gz	NALMANVVWDIVHF-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCc3ccc(O)cc3CC2)c1	ZINC000610447706	360438757	/nfs/dbraw/zinc/43/87/57/360438757.db2.gz	AYHDJQWYARHRNY-UHFFFAOYSA-N	1	1	302.334	1.598	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611088143	360618881	/nfs/dbraw/zinc/61/88/81/360618881.db2.gz	FKWWNQUYKBKUQE-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@H+]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611092116	360621482	/nfs/dbraw/zinc/62/14/82/360621482.db2.gz	JAESPISAXNWFTR-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+](CCO)CC1CC1)OCCO2	ZINC000611265547	360684034	/nfs/dbraw/zinc/68/40/34/360684034.db2.gz	NOYMTJOKMJEQLM-UHFFFAOYSA-N	1	1	308.334	1.570	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(N3CC[N@@H+]4CCOC[C@@H]4C3)c2c1	ZINC000612451064	361021890	/nfs/dbraw/zinc/02/18/90/361021890.db2.gz	AKWJHKDBRHBELA-LBPRGKRZSA-N	1	1	315.333	1.059	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(N3CC[N@H+]4CCOC[C@@H]4C3)c2c1	ZINC000612451064	361021894	/nfs/dbraw/zinc/02/18/94/361021894.db2.gz	AKWJHKDBRHBELA-LBPRGKRZSA-N	1	1	315.333	1.059	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH+]1CC([C@@H]3CCOC3)C1)OCCO2	ZINC000619432130	364006752	/nfs/dbraw/zinc/00/67/52/364006752.db2.gz	CWAGQAMVXFYJCW-LLVKDONJSA-N	1	1	320.345	1.834	20	5		DDBDMO
C[C@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])c(N)n1	ZINC000271813579	209237131	/nfs/dbraw/zinc/23/71/31/209237131.db2.gz	MKEXWSMFUKTXEF-LLVKDONJSA-N	1	1	316.365	1.899	20	5		DDBDMO
C[C@@H](c1ccncc1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000091990462	193138281	/nfs/dbraw/zinc/13/82/81/193138281.db2.gz	HVYPQZMUUUXEHI-LBPRGKRZSA-N	1	1	302.334	1.845	20	5		DDBDMO
COc1cc(C[NH2+]CC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])cc1O	ZINC000271792572	209219786	/nfs/dbraw/zinc/21/97/86/209219786.db2.gz	HAZNHYPPMMAGPN-UHFFFAOYSA-N	1	1	307.350	1.661	20	5		DDBDMO
COc1cc(CNCC2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1O	ZINC000271792572	209219789	/nfs/dbraw/zinc/21/97/89/209219789.db2.gz	HAZNHYPPMMAGPN-UHFFFAOYSA-N	1	1	307.350	1.661	20	5		DDBDMO
COc1cc(CNCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])cc1O	ZINC000271792572	209219792	/nfs/dbraw/zinc/21/97/92/209219792.db2.gz	HAZNHYPPMMAGPN-UHFFFAOYSA-N	1	1	307.350	1.661	20	5		DDBDMO
COc1ccc(CNC(=O)NCC[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000264771335	204144751	/nfs/dbraw/zinc/14/47/51/204144751.db2.gz	AHEXFYQYLMJDAP-UHFFFAOYSA-N	1	1	322.365	1.497	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000282747788	217223500	/nfs/dbraw/zinc/22/35/00/217223500.db2.gz	BTUQGLAJMYNEDE-VIFPVBQESA-N	1	1	310.329	1.388	20	5		DDBDMO
CC[N@H+](Cc1ccccc1C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266444641	205350932	/nfs/dbraw/zinc/35/09/32/205350932.db2.gz	NLRRXMNCEAWPAB-INIZCTEOSA-N	1	1	318.377	1.983	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000267604923	206168828	/nfs/dbraw/zinc/16/88/28/206168828.db2.gz	MMAFDCNTIZQREY-SECBINFHSA-N	1	1	305.290	1.731	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000267604923	206168831	/nfs/dbraw/zinc/16/88/31/206168831.db2.gz	MMAFDCNTIZQREY-SECBINFHSA-N	1	1	305.290	1.731	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000267867247	206311186	/nfs/dbraw/zinc/31/11/86/206311186.db2.gz	ZFLIWQIZMPODAU-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000567468515	304221152	/nfs/dbraw/zinc/22/11/52/304221152.db2.gz	UFCIOCKCDTVVQL-OCCSQVGLSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000567468515	304221154	/nfs/dbraw/zinc/22/11/54/304221154.db2.gz	UFCIOCKCDTVVQL-OCCSQVGLSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@H](O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000340982364	251318128	/nfs/dbraw/zinc/31/81/28/251318128.db2.gz	YTDXEHQHVMOBQV-ZYHUDNBSSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341009069	251333072	/nfs/dbraw/zinc/33/30/72/251333072.db2.gz	AHJGRHFAVIKMMT-WCQYABFASA-N	1	1	306.366	1.877	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CSc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC000567767241	304241190	/nfs/dbraw/zinc/24/11/90/304241190.db2.gz	GIZLLVPFCSXBSU-SNVBAGLBSA-N	1	1	320.374	1.961	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CSc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC000567767241	304241191	/nfs/dbraw/zinc/24/11/91/304241191.db2.gz	GIZLLVPFCSXBSU-SNVBAGLBSA-N	1	1	320.374	1.961	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000425002775	533093767	/nfs/dbraw/zinc/09/37/67/533093767.db2.gz	RDJUORYABRMRMK-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000156765842	197138967	/nfs/dbraw/zinc/13/89/67/197138967.db2.gz	QLIJATHJUDVXAK-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
COCC1(O)CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000352784410	285298868	/nfs/dbraw/zinc/29/88/68/285298868.db2.gz	OWGZQLUFXVRHLG-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
Cc1cc(C(=O)NCCC[NH+]2CCN(C)CC2)cc([N+](=O)[O-])c1	ZINC000121897484	195370994	/nfs/dbraw/zinc/37/09/94/195370994.db2.gz	FOBNYAOVNULNOU-UHFFFAOYSA-N	1	1	320.393	1.271	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CC[N@@H+](C)C1	ZINC000413503517	533490688	/nfs/dbraw/zinc/49/06/88/533490688.db2.gz	SJFOYMIULPJFII-NSHDSACASA-N	1	1	323.349	1.144	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cn1	ZINC000593544567	397388448	/nfs/dbraw/zinc/38/84/48/397388448.db2.gz	IBVWTUOMHBEQFY-UHFFFAOYSA-N	1	1	316.383	1.000	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000069172938	406686048	/nfs/dbraw/zinc/68/60/48/406686048.db2.gz	IZNDMNOAFWXRSP-UHFFFAOYSA-N	1	1	306.771	1.773	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000074104770	406902889	/nfs/dbraw/zinc/90/28/89/406902889.db2.gz	JIHCVMVFPQZHII-ZDUSSCGKSA-N	1	1	321.377	1.364	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000075953152	406946954	/nfs/dbraw/zinc/94/69/54/406946954.db2.gz	QNUFABHOTHLJPT-CQSZACIVSA-N	1	1	324.377	1.959	20	5		DDBDMO
CN(C(=O)C[NH2+][C@H](C(N)=O)C(C)(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000109331814	407397345	/nfs/dbraw/zinc/39/73/45/407397345.db2.gz	OXTDXIMCVAVQJF-CYBMUJFWSA-N	1	1	322.365	1.047	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000178558630	407490007	/nfs/dbraw/zinc/49/00/07/407490007.db2.gz	PIEJMUAPMZUYCT-CYBMUJFWSA-N	1	1	323.397	1.276	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1CCOC1	ZINC000178763741	407589088	/nfs/dbraw/zinc/58/90/88/407589088.db2.gz	MZHMXAORDXUXKO-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000114063337	407536593	/nfs/dbraw/zinc/53/65/93/407536593.db2.gz	XQOHHALUYCLOSM-NSHDSACASA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000114063337	407536597	/nfs/dbraw/zinc/53/65/97/407536597.db2.gz	XQOHHALUYCLOSM-NSHDSACASA-N	1	1	323.349	1.583	20	5		DDBDMO
CC[C@@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000266397149	407538152	/nfs/dbraw/zinc/53/81/52/407538152.db2.gz	OXUDAIOITGXYOQ-CHWSQXEVSA-N	1	1	323.393	1.885	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000115437990	407679573	/nfs/dbraw/zinc/67/95/73/407679573.db2.gz	PEUCKJHWAOFQQQ-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
C[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[NH+]1CCSCC1	ZINC000179155838	407740741	/nfs/dbraw/zinc/74/07/41/407740741.db2.gz	UZWDZCUCYLUSAX-GFCCVEGCSA-N	1	1	323.418	1.991	20	5		DDBDMO
C[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])[NH+]1CCSCC1	ZINC000179155827	407741406	/nfs/dbraw/zinc/74/14/06/407741406.db2.gz	UZWDZCUCYLUSAX-LBPRGKRZSA-N	1	1	323.418	1.991	20	5		DDBDMO
Cc1ccc(CN2CC[C@@H](N3CC[NH2+]CC3)C2)cc1[N+](=O)[O-]	ZINC000262181173	407759441	/nfs/dbraw/zinc/75/94/41/407759441.db2.gz	WRBRRBSBVDKNSR-OAHLLOKOSA-N	1	1	304.394	1.383	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000272125009	407785375	/nfs/dbraw/zinc/78/53/75/407785375.db2.gz	USCZAKFHNHWPDF-UHFFFAOYSA-N	1	1	318.377	1.698	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@H]1C	ZINC000117285745	407823324	/nfs/dbraw/zinc/82/33/24/407823324.db2.gz	QGFGRKWUQVIWJU-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@H]1C	ZINC000117285745	407823331	/nfs/dbraw/zinc/82/33/31/407823331.db2.gz	QGFGRKWUQVIWJU-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000118993930	407973660	/nfs/dbraw/zinc/97/36/60/407973660.db2.gz	CRTZNJCPAXSAND-UHFFFAOYSA-N	1	1	324.381	1.015	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3cccc(O)c3)CC2)c1	ZINC000175071377	408043825	/nfs/dbraw/zinc/04/38/25/408043825.db2.gz	WKZZHPHMAGNVSW-UHFFFAOYSA-N	1	1	317.349	1.319	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]2OCCC[C@H]2C1	ZINC000245571841	408019054	/nfs/dbraw/zinc/01/90/54/408019054.db2.gz	BWRJNKKFBHSNNV-JSGCOSHPSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH2+][C@H](CO)c2c(F)cccc2F)n1	ZINC000273094886	408055196	/nfs/dbraw/zinc/05/51/96/408055196.db2.gz	KKAPTPPXJNALMD-LLVKDONJSA-N	1	1	312.276	1.393	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269284686	408252722	/nfs/dbraw/zinc/25/27/22/408252722.db2.gz	MXPBYTSBNKWDRY-UONOGXRCSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+]2CCCC[C@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284686	408252726	/nfs/dbraw/zinc/25/27/26/408252726.db2.gz	MXPBYTSBNKWDRY-UONOGXRCSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284686	408252733	/nfs/dbraw/zinc/25/27/33/408252733.db2.gz	MXPBYTSBNKWDRY-UONOGXRCSA-N	1	1	305.334	1.657	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000156455135	408260563	/nfs/dbraw/zinc/26/05/63/408260563.db2.gz	HQVGIXBUAWPYII-CQSZACIVSA-N	1	1	321.377	1.774	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000269506952	408332724	/nfs/dbraw/zinc/33/27/24/408332724.db2.gz	GHGOPHHIADWGQF-LBPRGKRZSA-N	1	1	323.397	1.724	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1C[N@@H+](C)CCN1C	ZINC000269547743	408349822	/nfs/dbraw/zinc/34/98/22/408349822.db2.gz	CWUYKHNKAMTHCB-CQSZACIVSA-N	1	1	308.382	1.399	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CN(C)CCN1C	ZINC000269547743	408349826	/nfs/dbraw/zinc/34/98/26/408349826.db2.gz	CWUYKHNKAMTHCB-CQSZACIVSA-N	1	1	308.382	1.399	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269629453	408368883	/nfs/dbraw/zinc/36/88/83/408368883.db2.gz	FAGUJVBMSMTZCX-BBRMVZONSA-N	1	1	307.394	1.902	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)[C@H](C)C1	ZINC000176868032	408461956	/nfs/dbraw/zinc/46/19/56/408461956.db2.gz	PJIQFBCQLYHMJI-YPMHNXCESA-N	1	1	320.393	1.979	20	5		DDBDMO
CC[C@@H](O)[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000269937116	408474064	/nfs/dbraw/zinc/47/40/64/408474064.db2.gz	YQQDXZNBRGGCQF-UONOGXRCSA-N	1	1	309.366	1.382	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC2(C1)CCOCC2	ZINC000270588429	408592702	/nfs/dbraw/zinc/59/27/02/408592702.db2.gz	SPJPWLBARKOJNB-UHFFFAOYSA-N	1	1	307.350	1.259	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1	ZINC000192742816	408639628	/nfs/dbraw/zinc/63/96/28/408639628.db2.gz	OCYDVYZIILYKET-QPJJXVBHSA-N	1	1	319.361	1.399	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000248886874	408653068	/nfs/dbraw/zinc/65/30/68/408653068.db2.gz	AIDGIAZWFVAULW-DDFAGTSDSA-N	1	1	307.350	1.427	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000184857678	408705196	/nfs/dbraw/zinc/70/51/96/408705196.db2.gz	MHPIDPCBYKVJNI-NSHDSACASA-N	1	1	321.381	1.518	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c1[N+](=O)[O-]	ZINC000193279850	408708049	/nfs/dbraw/zinc/70/80/49/408708049.db2.gz	YEOGVLFOGPXMRQ-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270858190	408712324	/nfs/dbraw/zinc/71/23/24/408712324.db2.gz	HTSLTFKLXPPEAY-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270858190	408712326	/nfs/dbraw/zinc/71/23/26/408712326.db2.gz	HTSLTFKLXPPEAY-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH2+]C[C@@H]1C	ZINC000193358666	408714067	/nfs/dbraw/zinc/71/40/67/408714067.db2.gz	SIAOQXNWBVCDNF-JTQLQIEISA-N	1	1	313.379	1.140	20	5		DDBDMO
CCc1ccc([C@H](COC)[NH2+]CCn2cc([N+](=O)[O-])cn2)o1	ZINC000184805123	408693426	/nfs/dbraw/zinc/69/34/26/408693426.db2.gz	XKXXLJHMAVQRBM-ZDUSSCGKSA-N	1	1	308.338	1.924	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421510	408699450	/nfs/dbraw/zinc/69/94/50/408699450.db2.gz	HBCPHFKSCWTAIW-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421510	408699453	/nfs/dbraw/zinc/69/94/53/408699453.db2.gz	HBCPHFKSCWTAIW-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000270840115	408701440	/nfs/dbraw/zinc/70/14/40/408701440.db2.gz	DXEKGTVXRFHTLQ-KYOSRNDESA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](CCN(C)C)CC2)n1	ZINC000178170285	408783414	/nfs/dbraw/zinc/78/34/14/408783414.db2.gz	JKMZVEXMPBJXRT-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@H](C)O)C[C@@H]1C	ZINC000251843403	408787363	/nfs/dbraw/zinc/78/73/63/408787363.db2.gz	OITRLJNFMXHMCS-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@H](C)O)C[C@@H]1C	ZINC000251843403	408787365	/nfs/dbraw/zinc/78/73/65/408787365.db2.gz	OITRLJNFMXHMCS-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1(CO)CC1	ZINC000285660147	408836964	/nfs/dbraw/zinc/83/69/64/408836964.db2.gz	YXYVISUOWUNLFP-UHFFFAOYSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1(CO)CC1	ZINC000285660147	408836965	/nfs/dbraw/zinc/83/69/65/408836965.db2.gz	YXYVISUOWUNLFP-UHFFFAOYSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000285704957	408847489	/nfs/dbraw/zinc/84/74/89/408847489.db2.gz	IYVGSUYMFUFCBY-ZIAGYGMSSA-N	1	1	305.334	1.140	20	5		DDBDMO
COc1cccc(N2CC[C@@H]([NH+]3CCOCC3)[C@H]2C)c1[N+](=O)[O-]	ZINC000291108398	408859245	/nfs/dbraw/zinc/85/92/45/408859245.db2.gz	LEFYFNIOOFYDRC-CHWSQXEVSA-N	1	1	321.377	1.903	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000188772060	163068863	/nfs/dbraw/zinc/06/88/63/163068863.db2.gz	AYZKREJCHTWYGN-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000188772060	163068866	/nfs/dbraw/zinc/06/88/66/163068866.db2.gz	AYZKREJCHTWYGN-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[N@H+]1CCCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC1	ZINC000287110121	409004320	/nfs/dbraw/zinc/00/43/20/409004320.db2.gz	VXFIPRICUXRIBY-UHFFFAOYSA-N	1	1	303.322	1.386	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCC[N@H+](C2CCCC2)CC1	ZINC000286392093	408977001	/nfs/dbraw/zinc/97/70/01/408977001.db2.gz	IXYXBNLIGTXOSM-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
COCC(C)(C)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000292113160	408983476	/nfs/dbraw/zinc/98/34/76/408983476.db2.gz	JFNAXYYMWQSCIF-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000292113160	408983478	/nfs/dbraw/zinc/98/34/78/408983478.db2.gz	JFNAXYYMWQSCIF-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
CCOc1cc(C[N@@H+](CC)CCOCCO)ccc1[N+](=O)[O-]	ZINC000282185875	409007347	/nfs/dbraw/zinc/00/73/47/409007347.db2.gz	WDSBZFIPXGASIR-UHFFFAOYSA-N	1	1	312.366	1.824	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000279125039	409152985	/nfs/dbraw/zinc/15/29/85/409152985.db2.gz	VFTXBLPRROWMNH-MEBBXXQBSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000279125039	409152991	/nfs/dbraw/zinc/15/29/91/409152991.db2.gz	VFTXBLPRROWMNH-MEBBXXQBSA-N	1	1	318.333	1.330	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@@H]2CC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000280410254	409307846	/nfs/dbraw/zinc/30/78/46/409307846.db2.gz	AUNVCCRQXZPVQZ-LBPRGKRZSA-N	1	1	307.350	1.350	20	5		DDBDMO
CN(C)S(=O)(=O)CC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000289443215	409272605	/nfs/dbraw/zinc/27/26/05/409272605.db2.gz	AYIYXAIUDPSNLS-UHFFFAOYSA-N	1	1	321.786	1.229	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3ccc([N+](=O)[O-])c(N)c3F)C[C@@H]21	ZINC000285018801	409394458	/nfs/dbraw/zinc/39/44/58/409394458.db2.gz	MRVRPDUFEFIHCA-RYUDHWBXSA-N	1	1	310.329	1.225	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000280684776	409408126	/nfs/dbraw/zinc/40/81/26/409408126.db2.gz	HALQIVSWMVINKV-OAHLLOKOSA-N	1	1	320.349	1.121	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)C2(CO)CC2)cccc1[N+](=O)[O-]	ZINC000285384092	409421100	/nfs/dbraw/zinc/42/11/00/409421100.db2.gz	CZVJQRXTKXGIEX-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000317235061	164027248	/nfs/dbraw/zinc/02/72/48/164027248.db2.gz	LOVKYIJEMQTMMS-NWDGAFQWSA-N	1	1	304.350	1.534	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)CC[C@H]2C)c([N+](=O)[O-])c1	ZINC000354079115	409636342	/nfs/dbraw/zinc/63/63/42/409636342.db2.gz	CGFQSLWDYSOOCC-LLVKDONJSA-N	1	1	306.366	1.485	20	5		DDBDMO
C[N@@H+](CC[C@H]1CCCO1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000342602194	409757040	/nfs/dbraw/zinc/75/70/40/409757040.db2.gz	LWWGOVZWSFESCM-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000354441807	409858520	/nfs/dbraw/zinc/85/85/20/409858520.db2.gz	WXDPGXVXYTWESE-RYUDHWBXSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCS(=O)(=O)C1	ZINC000354450205	409863563	/nfs/dbraw/zinc/86/35/63/409863563.db2.gz	JXTMVVOUERYFPW-ZDUSSCGKSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346254945	409878032	/nfs/dbraw/zinc/87/80/32/409878032.db2.gz	HSTLVKNXIPQTTC-SRVKXCTJSA-N	1	1	321.381	1.131	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(Cc2noc([C@H]3CC[N@@H+](C)C3)n2)c1	ZINC000350277002	409937034	/nfs/dbraw/zinc/93/70/34/409937034.db2.gz	QSJVBQPPPVXNMJ-JTQLQIEISA-N	1	1	318.333	1.996	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000342938705	410013262	/nfs/dbraw/zinc/01/32/62/410013262.db2.gz	YLCKWYJLAPFHJZ-GHMZBOCLSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000342938705	410013266	/nfs/dbraw/zinc/01/32/66/410013266.db2.gz	YLCKWYJLAPFHJZ-GHMZBOCLSA-N	1	1	322.365	1.614	20	5		DDBDMO
COc1c(C(=O)N2CC[NH+](CC3CC3)CC2)cccc1[N+](=O)[O-]	ZINC000354696005	410022740	/nfs/dbraw/zinc/02/27/40/410022740.db2.gz	ZTZIWIIOQPPVKH-UHFFFAOYSA-N	1	1	319.361	1.771	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c1	ZINC000357457083	410051018	/nfs/dbraw/zinc/05/10/18/410051018.db2.gz	VAALKWLSJYAIDC-KGLIPLIRSA-N	1	1	306.366	1.417	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])n[nH]2)CC1	ZINC000354920200	410172994	/nfs/dbraw/zinc/17/29/94/410172994.db2.gz	XIOAKYIJVPREQO-UHFFFAOYSA-N	1	1	321.381	1.726	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000343161009	410196268	/nfs/dbraw/zinc/19/62/68/410196268.db2.gz	ARDURVMAHMORDV-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
COCCCNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000298504820	410262448	/nfs/dbraw/zinc/26/24/48/410262448.db2.gz	UYGPRLXRAWMBBA-UHFFFAOYSA-N	1	1	309.366	1.572	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCSC[C@@H]2CCO)cc1[N+](=O)[O-]	ZINC000355087772	410304986	/nfs/dbraw/zinc/30/49/86/410304986.db2.gz	NFBQLXOEODEACN-LBPRGKRZSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1ccc(C[N@H+]2CCSC[C@@H]2CCO)cc1[N+](=O)[O-]	ZINC000355087772	410304994	/nfs/dbraw/zinc/30/49/94/410304994.db2.gz	NFBQLXOEODEACN-LBPRGKRZSA-N	1	1	312.391	1.903	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H](NC(=O)NC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000355098126	410314533	/nfs/dbraw/zinc/31/45/33/410314533.db2.gz	KZDRNIFZVIARTB-AWEZNQCLSA-N	1	1	318.377	1.939	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H](NC(=O)NC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000355098126	410314542	/nfs/dbraw/zinc/31/45/42/410314542.db2.gz	KZDRNIFZVIARTB-AWEZNQCLSA-N	1	1	318.377	1.939	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)C1	ZINC000301304598	410696327	/nfs/dbraw/zinc/69/63/27/410696327.db2.gz	TWCAOSZMGJVBRK-CQSZACIVSA-N	1	1	305.382	1.206	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000301507761	410731500	/nfs/dbraw/zinc/73/15/00/410731500.db2.gz	HMLKTWVJQWVXJL-QWHCGFSZSA-N	1	1	323.393	1.885	20	5		DDBDMO
Cc1ccncc1N1CC[NH+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000340108056	410680243	/nfs/dbraw/zinc/68/02/43/410680243.db2.gz	HIFUFJFXEKNRPC-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000355824087	410688291	/nfs/dbraw/zinc/68/82/91/410688291.db2.gz	GSTXLWVEXGRNQB-LLVKDONJSA-N	1	1	323.349	1.054	20	5		DDBDMO
Cc1nn(C)c(N2CCC[C@@H](Cc3[nH+]ccn3C)C2)c1[N+](=O)[O-]	ZINC000301717107	410779370	/nfs/dbraw/zinc/77/93/70/410779370.db2.gz	NRYPJZPGKOBCDI-LBPRGKRZSA-N	1	1	318.381	1.829	20	5		DDBDMO
CNS(=O)(=O)C[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000330618913	410833318	/nfs/dbraw/zinc/83/33/18/410833318.db2.gz	YGZBYZNGGZPGGZ-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNS(=O)(=O)C[C@H]1CCC[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000330618913	410833321	/nfs/dbraw/zinc/83/33/21/410833321.db2.gz	YGZBYZNGGZPGGZ-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000330663765	410858781	/nfs/dbraw/zinc/85/87/81/410858781.db2.gz	UCLVTWYQWLQXTK-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000330663765	410858787	/nfs/dbraw/zinc/85/87/87/410858787.db2.gz	UCLVTWYQWLQXTK-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000330678593	410872320	/nfs/dbraw/zinc/87/23/20/410872320.db2.gz	WOKAKWFLHMQUIE-SNVBAGLBSA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000330678593	410872329	/nfs/dbraw/zinc/87/23/29/410872329.db2.gz	WOKAKWFLHMQUIE-SNVBAGLBSA-N	1	1	323.349	1.388	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344068249	410934266	/nfs/dbraw/zinc/93/42/66/410934266.db2.gz	QIRRRIFZUGCELZ-JLNYLFASSA-N	1	1	322.361	1.037	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000348517845	410994591	/nfs/dbraw/zinc/99/45/91/410994591.db2.gz	YSFNXIDFZDVPPO-LLVKDONJSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000348517845	410994597	/nfs/dbraw/zinc/99/45/97/410994597.db2.gz	YSFNXIDFZDVPPO-LLVKDONJSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000348517845	410994600	/nfs/dbraw/zinc/99/46/00/410994600.db2.gz	YSFNXIDFZDVPPO-LLVKDONJSA-N	1	1	321.381	1.579	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+](CCO)[C@H]1CCCSC1	ZINC000331206592	411018034	/nfs/dbraw/zinc/01/80/34/411018034.db2.gz	UFRSQRNCLQDILH-JTQLQIEISA-N	1	1	300.384	1.018	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+](CCO)[C@H]1CCCSC1	ZINC000331206592	411018039	/nfs/dbraw/zinc/01/80/39/411018039.db2.gz	UFRSQRNCLQDILH-JTQLQIEISA-N	1	1	300.384	1.018	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000361403211	418645904	/nfs/dbraw/zinc/64/59/04/418645904.db2.gz	NFYCZFSURSATDG-OCCSQVGLSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000375501772	418649963	/nfs/dbraw/zinc/64/99/63/418649963.db2.gz	OBACNHVLBCEETH-AWEZNQCLSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@@H](CO)N1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000375501772	418649964	/nfs/dbraw/zinc/64/99/64/418649964.db2.gz	OBACNHVLBCEETH-AWEZNQCLSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@@H](CO)N1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000375501772	418649966	/nfs/dbraw/zinc/64/99/66/418649966.db2.gz	OBACNHVLBCEETH-AWEZNQCLSA-N	1	1	307.394	1.526	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N2CC[N@@H+]3CCOC[C@@H]3C2)s1	ZINC000367799441	418636471	/nfs/dbraw/zinc/63/64/71/418636471.db2.gz	BFXKEVPRTWMVAM-VIFPVBQESA-N	1	1	321.362	1.120	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N2CC[N@H+]3CCOC[C@@H]3C2)s1	ZINC000367799441	418636473	/nfs/dbraw/zinc/63/64/73/418636473.db2.gz	BFXKEVPRTWMVAM-VIFPVBQESA-N	1	1	321.362	1.120	20	5		DDBDMO
CC(C)(C)[C@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000361541721	418674249	/nfs/dbraw/zinc/67/42/49/418674249.db2.gz	SBZNMBKUDJMXJB-GXTWGEPZSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000361575435	418683583	/nfs/dbraw/zinc/68/35/83/418683583.db2.gz	COHIBDCSPLAOBZ-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000361575435	418683585	/nfs/dbraw/zinc/68/35/85/418683585.db2.gz	COHIBDCSPLAOBZ-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583377	418686624	/nfs/dbraw/zinc/68/66/24/418686624.db2.gz	LMAOJIYEEQJBBP-HZMBPMFUSA-N	1	1	320.349	1.443	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361583377	418686625	/nfs/dbraw/zinc/68/66/25/418686625.db2.gz	LMAOJIYEEQJBBP-HZMBPMFUSA-N	1	1	320.349	1.443	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000362055737	418745697	/nfs/dbraw/zinc/74/56/97/418745697.db2.gz	NHJIIEZLYDTUFR-DRZSPHRISA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990175	418754969	/nfs/dbraw/zinc/75/49/69/418754969.db2.gz	BZKUJDSQYWJIFQ-MIGQKNRLSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370990175	418754972	/nfs/dbraw/zinc/75/49/72/418754972.db2.gz	BZKUJDSQYWJIFQ-MIGQKNRLSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990175	418754974	/nfs/dbraw/zinc/75/49/74/418754974.db2.gz	BZKUJDSQYWJIFQ-MIGQKNRLSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)[C@@H](C)C[N@H+]1C	ZINC000408106244	418788804	/nfs/dbraw/zinc/78/88/04/418788804.db2.gz	XBISAYXQOTZOKR-ZJUUUORDSA-N	1	1	317.349	1.772	20	5		DDBDMO
COC(=O)[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)C1	ZINC000411906157	419463929	/nfs/dbraw/zinc/46/39/29/419463929.db2.gz	NMPRTDKMENSEHL-CYBMUJFWSA-N	1	1	307.350	1.131	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc([N+](=O)[O-])cc1F	ZINC000418118630	419545585	/nfs/dbraw/zinc/54/55/85/419545585.db2.gz	TVCCGWBNOQIJHB-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C[N@H+]1CCO	ZINC000418118624	419548030	/nfs/dbraw/zinc/54/80/30/419548030.db2.gz	TVCCGWBNOQIJHB-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000412061856	419608915	/nfs/dbraw/zinc/60/89/15/419608915.db2.gz	AKLXPLBKYVCOIC-HZSPNIEDSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1[C@H](CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000412079904	419631436	/nfs/dbraw/zinc/63/14/36/419631436.db2.gz	LKJRHFUZRYJXID-GWCFXTLKSA-N	1	1	307.350	1.287	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@@H+](CC)C2)n1	ZINC000427468312	419665112	/nfs/dbraw/zinc/66/51/12/419665112.db2.gz	BGVXPIBDPLHFAU-NSHDSACASA-N	1	1	309.370	1.273	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](O)[C@@H](CO)C1	ZINC000412111123	419672689	/nfs/dbraw/zinc/67/26/89/419672689.db2.gz	VQTMZJJUJBKXEK-UKRRQHHQSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](O)[C@@H](CO)C1	ZINC000412111123	419672695	/nfs/dbraw/zinc/67/26/95/419672695.db2.gz	VQTMZJJUJBKXEK-UKRRQHHQSA-N	1	1	324.377	1.557	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC000427708106	419717607	/nfs/dbraw/zinc/71/76/07/419717607.db2.gz	WBYBKPDREIAPCB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000427708106	419717615	/nfs/dbraw/zinc/71/76/15/419717615.db2.gz	WBYBKPDREIAPCB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
CN(C)C[C@@H](O)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000433124558	420248877	/nfs/dbraw/zinc/24/88/77/420248877.db2.gz	DFUFHWRUKBKWQV-WFASDCNBSA-N	1	1	307.394	1.829	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000416301900	420318866	/nfs/dbraw/zinc/31/88/66/420318866.db2.gz	VWAAVNSGLKYPQA-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000416301900	420318869	/nfs/dbraw/zinc/31/88/69/420318869.db2.gz	VWAAVNSGLKYPQA-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000425482002	420395592	/nfs/dbraw/zinc/39/55/92/420395592.db2.gz	QOPBZUXPMDCMDY-CQSZACIVSA-N	1	1	308.382	1.029	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)[C@H](C)O1	ZINC000446082134	230231140	/nfs/dbraw/zinc/23/11/40/230231140.db2.gz	OPSKCYWUFPYRPF-CXTNEJHOSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)[C@H](C)O1	ZINC000446082134	230231142	/nfs/dbraw/zinc/23/11/42/230231142.db2.gz	OPSKCYWUFPYRPF-CXTNEJHOSA-N	1	1	324.377	1.832	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439107429	420480528	/nfs/dbraw/zinc/48/05/28/420480528.db2.gz	LVLIBERHULWRML-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@@H]1CCC[N@@H+](CCCO)C1	ZINC000450619109	420499512	/nfs/dbraw/zinc/49/95/12/420499512.db2.gz	UJAOLWPIBIHIGE-GFCCVEGCSA-N	1	1	311.386	1.378	20	5		DDBDMO
CC1(C[NH+]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)COC1	ZINC000440665886	420595540	/nfs/dbraw/zinc/59/55/40/420595540.db2.gz	GGTMWUINQXXCQQ-UHFFFAOYSA-N	1	1	319.361	1.389	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000454352938	420845060	/nfs/dbraw/zinc/84/50/60/420845060.db2.gz	HVMWGTVISQUOGT-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000454352938	420845064	/nfs/dbraw/zinc/84/50/64/420845064.db2.gz	HVMWGTVISQUOGT-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000454747710	420919135	/nfs/dbraw/zinc/91/91/35/420919135.db2.gz	CAXAUMQMJWENAA-JQWIXIFHSA-N	1	1	319.365	1.388	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2C[C@@H]3C[C@H]2CS3)c1	ZINC000459784535	420872903	/nfs/dbraw/zinc/87/29/03/420872903.db2.gz	ACAXREOGHXPCAM-OBJOEFQTSA-N	1	1	310.375	1.524	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000493586417	420888774	/nfs/dbraw/zinc/88/87/74/420888774.db2.gz	POBLPBXNZIBATG-QMAVJUDZSA-N	1	1	311.288	1.674	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000449696755	421061570	/nfs/dbraw/zinc/06/15/70/421061570.db2.gz	LDYWPVXYQBURSA-LEXSJLIMSA-N	1	1	306.362	1.939	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000455480939	421021666	/nfs/dbraw/zinc/02/16/66/421021666.db2.gz	QNMQDQJNUZWJNU-SNVBAGLBSA-N	1	1	307.354	1.246	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000456211232	421122505	/nfs/dbraw/zinc/12/25/05/421122505.db2.gz	NQEPQEWYMBAMSU-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000456211232	421122508	/nfs/dbraw/zinc/12/25/08/421122508.db2.gz	NQEPQEWYMBAMSU-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000456233669	421130218	/nfs/dbraw/zinc/13/02/18/421130218.db2.gz	YRZMZWQSOUBAJR-TXEJJXNPSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000456233669	421130221	/nfs/dbraw/zinc/13/02/21/421130221.db2.gz	YRZMZWQSOUBAJR-TXEJJXNPSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000456362494	421149539	/nfs/dbraw/zinc/14/95/39/421149539.db2.gz	WPZUVFKJQZKYPL-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000545396209	421256254	/nfs/dbraw/zinc/25/62/54/421256254.db2.gz	BSJYGZDLRXBXRY-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000524775294	421271820	/nfs/dbraw/zinc/27/18/20/421271820.db2.gz	DJGNFEGJRVSCJP-SECBINFHSA-N	1	1	310.329	1.388	20	5		DDBDMO
CNc1nccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000563547529	421520621	/nfs/dbraw/zinc/52/06/21/421520621.db2.gz	VNYFWYKXLQCKLU-MNOVXSKESA-N	1	1	321.381	1.586	20	5		DDBDMO
C[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1(C)C	ZINC000551040238	421526648	/nfs/dbraw/zinc/52/66/48/421526648.db2.gz	CPVGZHLVSLGKFJ-UHFFFAOYSA-N	1	1	306.366	1.220	20	5		DDBDMO
Cn1cc([C@H](CO)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cn1	ZINC000518397982	421651241	/nfs/dbraw/zinc/65/12/41/421651241.db2.gz	SLWUCSNKDYYQIM-KBPBESRZSA-N	1	1	302.334	1.639	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H](C)C[N@@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000518454231	421653250	/nfs/dbraw/zinc/65/32/50/421653250.db2.gz	ZSDIMKXQFQKWIE-GFCCVEGCSA-N	1	1	323.393	1.991	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000565726637	421599503	/nfs/dbraw/zinc/59/95/03/421599503.db2.gz	PXGFYAPSGWAFCG-JTQLQIEISA-N	1	1	309.370	1.422	20	5		DDBDMO
Nc1ccc(NCC[N@H+]2CCc3sccc3C2)nc1[N+](=O)[O-]	ZINC000596086799	422365515	/nfs/dbraw/zinc/36/55/15/422365515.db2.gz	BMVWGJGDXZQPSA-UHFFFAOYSA-N	1	1	319.390	2.104	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)C)n2)C1	ZINC000576767206	422378144	/nfs/dbraw/zinc/37/81/44/422378144.db2.gz	IADUOLKKZAONQL-GFCCVEGCSA-N	1	1	324.381	1.910	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](CCNc2ncc([N+](=O)[O-])cn2)CC1	ZINC000591161786	422325272	/nfs/dbraw/zinc/32/52/72/422325272.db2.gz	GCFHRIBNUJQJJZ-UHFFFAOYSA-N	1	1	305.382	2.475	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2	ZINC000578100575	422498797	/nfs/dbraw/zinc/49/87/97/422498797.db2.gz	SPQQVRIWSJLROJ-QWHCGFSZSA-N	1	1	321.381	1.185	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]([C@H]2CCOC2)C1	ZINC000341682531	271167089	/nfs/dbraw/zinc/16/70/89/271167089.db2.gz	CRDNIDLTWVSBOY-KBPBESRZSA-N	1	1	321.377	1.505	20	5		DDBDMO
CCN1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000344409671	272017878	/nfs/dbraw/zinc/01/78/78/272017878.db2.gz	ABZIDKBACRDFQP-AWEZNQCLSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[C@H](Cc1[nH]cc[nH+]1)OCC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344582144	272065048	/nfs/dbraw/zinc/06/50/48/272065048.db2.gz	OGKWMFGHDVXSRP-LLVKDONJSA-N	1	1	318.333	1.929	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000345933152	272369006	/nfs/dbraw/zinc/36/90/06/272369006.db2.gz	AJOUXZLKUHILBL-VXGBXAGGSA-N	1	1	309.370	1.123	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC1	ZINC000264788961	276165012	/nfs/dbraw/zinc/16/50/12/276165012.db2.gz	RXLOFRPSABKZOX-UHFFFAOYSA-N	1	1	306.366	1.486	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181151825	276181298	/nfs/dbraw/zinc/18/12/98/276181298.db2.gz	KJFQPMGMTFAQBS-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000112926984	276305574	/nfs/dbraw/zinc/30/55/74/276305574.db2.gz	FBELEGJZMGOCDK-UHFFFAOYSA-N	1	1	320.393	1.877	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000299289171	277064384	/nfs/dbraw/zinc/06/43/84/277064384.db2.gz	PDDYQCIPQLDCLJ-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1ccc(N)cc1[N+](=O)[O-]	ZINC000286281625	278017194	/nfs/dbraw/zinc/01/71/94/278017194.db2.gz	IBWNSJVEFAXPOF-YPMHNXCESA-N	1	1	306.366	1.476	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c1	ZINC000450790740	295254391	/nfs/dbraw/zinc/25/43/91/295254391.db2.gz	HAUTWCKEKMGCEL-TXEJJXNPSA-N	1	1	309.366	1.495	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O	ZINC000324328584	298263046	/nfs/dbraw/zinc/26/30/46/298263046.db2.gz	ZUPOSDWQEPGQOV-GFCCVEGCSA-N	1	1	320.349	1.006	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000324470663	298263089	/nfs/dbraw/zinc/26/30/89/298263089.db2.gz	ZULXCEYWTXMRFQ-AWEZNQCLSA-N	1	1	319.365	1.554	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1CO	ZINC000362100561	300005707	/nfs/dbraw/zinc/00/57/07/300005707.db2.gz	XSZMJBSKTGDBPE-CMPLNLGQSA-N	1	1	318.333	1.705	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000362659646	300111442	/nfs/dbraw/zinc/11/14/42/300111442.db2.gz	WTTCJOJSTVKTHB-GFCCVEGCSA-N	1	1	308.382	1.641	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)CC1	ZINC000363379792	300260285	/nfs/dbraw/zinc/26/02/85/300260285.db2.gz	XFZACLHDQBWRRX-UHFFFAOYSA-N	1	1	323.397	1.434	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000363651025	300292755	/nfs/dbraw/zinc/29/27/55/300292755.db2.gz	JNNXLBTWHYODGB-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]21	ZINC000368596851	301062135	/nfs/dbraw/zinc/06/21/35/301062135.db2.gz	WFOKGLZMQIUMCF-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368966167	301112634	/nfs/dbraw/zinc/11/26/34/301112634.db2.gz	NLCHNDLEPWJAMO-XJKSGUPXSA-N	1	1	323.393	1.017	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000531506001	303247738	/nfs/dbraw/zinc/24/77/38/303247738.db2.gz	BBDFBTLFIRGBNT-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000532397552	303284965	/nfs/dbraw/zinc/28/49/65/303284965.db2.gz	ZNQSPVRDGCOHNW-GFCCVEGCSA-N	1	1	306.366	1.698	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000363593317	307032323	/nfs/dbraw/zinc/03/23/23/307032323.db2.gz	XYTZNWXWUQWIMD-UONOGXRCSA-N	1	1	321.381	1.267	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000365078309	307057910	/nfs/dbraw/zinc/05/79/10/307057910.db2.gz	STZDXCWYRUIEIG-GWCFXTLKSA-N	1	1	320.349	1.307	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](c3nnc[nH]3)C2)c1	ZINC000366652340	307078656	/nfs/dbraw/zinc/07/86/56/307078656.db2.gz	KMPDFEYWEMVKTL-TZMCWYRMSA-N	1	1	317.349	1.626	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@]23CCOC3)c([N+](=O)[O-])c1	ZINC000367456782	307094620	/nfs/dbraw/zinc/09/46/20/307094620.db2.gz	CUTNCKHFIMSVJN-OAHLLOKOSA-N	1	1	305.334	1.449	20	5		DDBDMO
CNC(=O)CN1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830505	307110994	/nfs/dbraw/zinc/11/09/94/307110994.db2.gz	QWFYZDPRXKXGQD-CYBMUJFWSA-N	1	1	320.393	1.410	20	5		DDBDMO
CNC(=O)CN1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830505	307110995	/nfs/dbraw/zinc/11/09/95/307110995.db2.gz	QWFYZDPRXKXGQD-CYBMUJFWSA-N	1	1	320.393	1.410	20	5		DDBDMO
CNC(=O)C[N@@H+]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830505	307110996	/nfs/dbraw/zinc/11/09/96/307110996.db2.gz	QWFYZDPRXKXGQD-CYBMUJFWSA-N	1	1	320.393	1.410	20	5		DDBDMO
CNC(=O)C[N@H+]1CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830505	307110997	/nfs/dbraw/zinc/11/09/97/307110997.db2.gz	QWFYZDPRXKXGQD-CYBMUJFWSA-N	1	1	320.393	1.410	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000371109643	307142464	/nfs/dbraw/zinc/14/24/64/307142464.db2.gz	WPNYXUAEQMYION-OAHLLOKOSA-N	1	1	321.377	1.652	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000378489999	307289493	/nfs/dbraw/zinc/28/94/93/307289493.db2.gz	CEJKPQKVTXHWNH-FZMZJTMJSA-N	1	1	304.350	1.464	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488807093	484219876	/nfs/dbraw/zinc/21/98/76/484219876.db2.gz	OFNZCSBCJPLCLI-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488807093	484219883	/nfs/dbraw/zinc/21/98/83/484219883.db2.gz	OFNZCSBCJPLCLI-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000305770323	534055183	/nfs/dbraw/zinc/05/51/83/534055183.db2.gz	XINRGLZAGHATTP-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000305770323	534055194	/nfs/dbraw/zinc/05/51/94/534055194.db2.gz	XINRGLZAGHATTP-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000459581337	526526325	/nfs/dbraw/zinc/52/63/25/526526325.db2.gz	KXWRZPFJMFAOIP-OAHLLOKOSA-N	1	1	324.381	1.845	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000824860828	608197414	/nfs/dbraw/zinc/19/74/14/608197414.db2.gz	YAPUCZCGSRQXSM-VHSXEESVSA-N	1	1	317.353	1.304	20	5		DDBDMO
CCNS(=O)(=O)CC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000068980743	696378610	/nfs/dbraw/zinc/37/86/10/696378610.db2.gz	QOZLRSXVGKFOCM-UHFFFAOYSA-N	1	1	321.786	1.277	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](c3ccccn3)C2)c1	ZINC000799191554	700127721	/nfs/dbraw/zinc/12/77/21/700127721.db2.gz	NAELIFJNSVYBRE-GXTWGEPZSA-N	1	1	317.349	1.037	20	5		DDBDMO
COCC(=O)N1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000985188835	697464946	/nfs/dbraw/zinc/46/49/46/697464946.db2.gz	IXQUHIANRSKNHO-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[N@@H+](Cc1ccsc1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985432939	697510343	/nfs/dbraw/zinc/51/03/43/697510343.db2.gz	HCAMSSOXPLRRKP-ZIAGYGMSSA-N	1	1	323.418	1.836	20	5		DDBDMO
C[N@H+](Cc1ccsc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985432939	697510344	/nfs/dbraw/zinc/51/03/44/697510344.db2.gz	HCAMSSOXPLRRKP-ZIAGYGMSSA-N	1	1	323.418	1.836	20	5		DDBDMO
C[N@@H+](Cc1ccsc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985432939	697510345	/nfs/dbraw/zinc/51/03/45/697510345.db2.gz	HCAMSSOXPLRRKP-ZIAGYGMSSA-N	1	1	323.418	1.836	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000774863244	697936287	/nfs/dbraw/zinc/93/62/87/697936287.db2.gz	LWUZPEYNYVDTKR-NSHDSACASA-N	1	1	322.321	1.733	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776581558	698120920	/nfs/dbraw/zinc/12/09/20/698120920.db2.gz	JZJBJXXZAGHWJI-JSGCOSHPSA-N	1	1	308.334	1.513	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCSC[C@H]2CCO)c1	ZINC000750095184	700203583	/nfs/dbraw/zinc/20/35/83/700203583.db2.gz	WHGSUHRSMZVIKW-ZIAGYGMSSA-N	1	1	312.391	1.428	20	5		DDBDMO
CCOC(=O)CC[N@H+](CC1CC1)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000779859729	698476303	/nfs/dbraw/zinc/47/63/03/698476303.db2.gz	YLJPDBSGIGHMHS-UHFFFAOYSA-N	1	1	310.354	1.722	20	5		DDBDMO
CCOC(=O)CC[N@@H+](CC1CC1)Cn1cc([N+](=O)[O-])c(C)n1	ZINC000779859729	698476304	/nfs/dbraw/zinc/47/63/04/698476304.db2.gz	YLJPDBSGIGHMHS-UHFFFAOYSA-N	1	1	310.354	1.722	20	5		DDBDMO
CCCCC[N@@H+](CC(N)=O)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000780340959	698508251	/nfs/dbraw/zinc/50/82/51/698508251.db2.gz	CGSDTSDVLIHWEM-AWEZNQCLSA-N	1	1	309.366	1.606	20	5		DDBDMO
CCCCC[N@H+](CC(N)=O)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000780340959	698508255	/nfs/dbraw/zinc/50/82/55/698508255.db2.gz	CGSDTSDVLIHWEM-AWEZNQCLSA-N	1	1	309.366	1.606	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@H+]2CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000783922775	698892511	/nfs/dbraw/zinc/89/25/11/698892511.db2.gz	WCZYZGALKKWMBX-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000729285983	699475781	/nfs/dbraw/zinc/47/57/81/699475781.db2.gz	VUCIOSRFKZBLCH-SNVBAGLBSA-N	1	1	304.350	1.452	20	5		DDBDMO
Nc1ccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-]	ZINC000791258846	699618093	/nfs/dbraw/zinc/61/80/93/699618093.db2.gz	LQPJBDUBCAIAIB-AAEUAGOBSA-N	1	1	322.340	1.435	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000792865489	699719788	/nfs/dbraw/zinc/71/97/88/699719788.db2.gz	CALJQEVQJMMQGM-GXSJLCMTSA-N	1	1	322.321	1.589	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000802140572	700372513	/nfs/dbraw/zinc/37/25/13/700372513.db2.gz	KOQVTHRDOPPZEZ-GFCCVEGCSA-N	1	1	311.338	1.199	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H](CO)C3CC3)o2)cc1	ZINC000763065893	700923511	/nfs/dbraw/zinc/92/35/11/700923511.db2.gz	HJZULXFKCIFUNJ-LBPRGKRZSA-N	1	1	304.306	1.505	20	5		DDBDMO
C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@]1(CO)CCOC1	ZINC000763888909	700952070	/nfs/dbraw/zinc/95/20/70/700952070.db2.gz	SXROIFLSPMYZPG-ZDUSSCGKSA-N	1	1	300.742	1.831	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](CC(N)=O)C2)c2cc([N+](=O)[O-])ccc12	ZINC000808229338	701509609	/nfs/dbraw/zinc/50/96/09/701509609.db2.gz	QGKRQZFIDXWJKF-LLVKDONJSA-N	1	1	317.349	1.408	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@H](C)C1	ZINC000868269140	702032675	/nfs/dbraw/zinc/03/26/75/702032675.db2.gz	CPAIYSSDHUWKSK-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@@H]21	ZINC000866208678	706649216	/nfs/dbraw/zinc/64/92/16/706649216.db2.gz	KJNKXKOGPUMAFU-MFKMUULPSA-N	1	1	304.350	1.224	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000866209626	706649775	/nfs/dbraw/zinc/64/97/75/706649775.db2.gz	UOGOAHRHDBXVSX-CMPLNLGQSA-N	1	1	320.349	1.307	20	5		DDBDMO
Nc1ccc(-c2noc(C[NH2+]C[C@@H]3CCCO3)n2)cc1[N+](=O)[O-]	ZINC000843169714	702832162	/nfs/dbraw/zinc/83/21/62/702832162.db2.gz	LSKVYMUSDYRVKB-JTQLQIEISA-N	1	1	319.321	1.496	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000843421202	702877320	/nfs/dbraw/zinc/87/73/20/702877320.db2.gz	DGYRGVRMVTWFQK-CYBMUJFWSA-N	1	1	311.769	1.499	20	5		DDBDMO
CCCN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000843987033	702949298	/nfs/dbraw/zinc/94/92/98/702949298.db2.gz	DLDPBLSKNZATNL-CABCVRRESA-N	1	1	321.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1	ZINC000844435301	703031340	/nfs/dbraw/zinc/03/13/40/703031340.db2.gz	BWQDBZZCPDJUCQ-NEPJUHHUSA-N	1	1	316.308	1.273	20	5		DDBDMO
Cc1nn(CCC(=O)OC[C@@H]2CC[N@@H+](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000845816120	703205895	/nfs/dbraw/zinc/20/58/95/703205895.db2.gz	PYHDKAQZPLRYLM-YPMHNXCESA-N	1	1	324.381	1.682	20	5		DDBDMO
CC(=O)C1CC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000846949063	703355995	/nfs/dbraw/zinc/35/59/95/703355995.db2.gz	GRNGDGQMHWMFBM-UHFFFAOYSA-N	1	1	305.334	1.495	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000869780623	703850943	/nfs/dbraw/zinc/85/09/43/703850943.db2.gz	MRNZYKYZJCXRJB-ZDUSSCGKSA-N	1	1	321.377	1.099	20	5		DDBDMO
O=C1CC[C@H](C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851844326	703868721	/nfs/dbraw/zinc/86/87/21/703868721.db2.gz	VVWGGNHIXBTEKE-CMPLNLGQSA-N	1	1	306.322	1.182	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCc3[nH]cnc3C2)c1	ZINC000819323310	704107418	/nfs/dbraw/zinc/10/74/18/704107418.db2.gz	ZIBAMQBWSVVNRL-IAQYHMDHSA-N	1	1	302.334	1.498	20	5		DDBDMO
CO[C@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870880778	704155447	/nfs/dbraw/zinc/15/54/47/704155447.db2.gz	ONDRRDOGHYQEBH-DZGCQCFKSA-N	1	1	307.350	1.406	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C(=O)N(C)OC	ZINC000858580451	704729894	/nfs/dbraw/zinc/72/98/94/704729894.db2.gz	OWTGEUWCVHQBCD-UWVGGRQHSA-N	1	1	311.338	1.662	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000822237612	704895961	/nfs/dbraw/zinc/89/59/61/704895961.db2.gz	BLSXKQJMFCOXKK-CYBMUJFWSA-N	1	1	315.414	1.295	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825099414	705599423	/nfs/dbraw/zinc/59/94/23/705599423.db2.gz	ZCLTXVLJADWJHE-SWLSCSKDSA-N	1	1	321.377	1.619	20	5		DDBDMO
Cc1ccc(CNC(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000876169152	705647069	/nfs/dbraw/zinc/64/70/69/705647069.db2.gz	NRPBAMPJIPAUKO-UHFFFAOYSA-N	1	1	318.377	1.964	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)CCNC(=O)N(C)C	ZINC000877140086	705994364	/nfs/dbraw/zinc/99/43/64/705994364.db2.gz	MJCHPPLFAOVXRV-UHFFFAOYSA-N	1	1	308.382	1.915	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])n1	ZINC000877140100	705994470	/nfs/dbraw/zinc/99/44/70/705994470.db2.gz	MXULUIOGRGXHFX-OAHLLOKOSA-N	1	1	320.324	1.561	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@](O)(c3ccc(F)cc3)C2)c([N+](=O)[O-])n1	ZINC000877140100	705994472	/nfs/dbraw/zinc/99/44/72/705994472.db2.gz	MXULUIOGRGXHFX-OAHLLOKOSA-N	1	1	320.324	1.561	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000877330672	706066604	/nfs/dbraw/zinc/06/66/04/706066604.db2.gz	GDTRKUSFXUCAFD-AWEZNQCLSA-N	1	1	305.378	1.728	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000877330672	706066606	/nfs/dbraw/zinc/06/66/06/706066606.db2.gz	GDTRKUSFXUCAFD-AWEZNQCLSA-N	1	1	305.378	1.728	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828249342	706146376	/nfs/dbraw/zinc/14/63/76/706146376.db2.gz	ZZZUWWDCXBVOAY-GYSYKLTISA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828249342	706146378	/nfs/dbraw/zinc/14/63/78/706146378.db2.gz	ZZZUWWDCXBVOAY-GYSYKLTISA-N	1	1	307.350	1.179	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC=C[C@@H]2CO)cccc1[N+](=O)[O-]	ZINC000880490158	706993045	/nfs/dbraw/zinc/99/30/45/706993045.db2.gz	MLQWBORTPHWEPB-GFCCVEGCSA-N	1	1	305.334	1.465	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])[C@H]12	ZINC000880528602	707005451	/nfs/dbraw/zinc/00/54/51/707005451.db2.gz	FMNQXOKFKALGIU-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCOc3ccccc3[N+](=O)[O-])[C@H]12	ZINC000880528602	707005454	/nfs/dbraw/zinc/00/54/54/707005454.db2.gz	FMNQXOKFKALGIU-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880529337	707005939	/nfs/dbraw/zinc/00/59/39/707005939.db2.gz	KXXXSLPMKUJTRF-DZGCQCFKSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@H](NCC1(O)CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872037368	707284337	/nfs/dbraw/zinc/28/43/37/707284337.db2.gz	DXKZMSOADNBBLI-NSHDSACASA-N	1	1	311.357	1.841	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]C[C@H]1C[C@H](O)C1)c1cccc([N+](=O)[O-])c1	ZINC000872127709	707298030	/nfs/dbraw/zinc/29/80/30/707298030.db2.gz	WGOHSFDZLSHTNB-CQDKDKBSSA-N	1	1	316.361	1.778	20	5		DDBDMO
CN1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2cccnc21	ZINC000872318671	707380392	/nfs/dbraw/zinc/38/03/92/707380392.db2.gz	NECAHDHYNFJCKU-UHFFFAOYSA-N	1	1	302.338	1.138	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000872778978	707596692	/nfs/dbraw/zinc/59/66/92/707596692.db2.gz	BWLWHGHHTQWBSK-VXGBXAGGSA-N	1	1	304.350	1.367	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000882482575	707653308	/nfs/dbraw/zinc/65/33/08/707653308.db2.gz	RZPZWZJWYIJTRY-GFCCVEGCSA-N	1	1	306.366	1.607	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000882961772	707875045	/nfs/dbraw/zinc/87/50/45/707875045.db2.gz	XGWODFVGPYBEOF-NSHDSACASA-N	1	1	304.350	1.986	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897216829	708255934	/nfs/dbraw/zinc/25/59/34/708255934.db2.gz	VTKMGRUDZGWOLA-OLZOCXBDSA-N	1	1	310.329	1.164	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c1	ZINC000897221123	708258512	/nfs/dbraw/zinc/25/85/12/708258512.db2.gz	HMEGXJYBBURCKT-CHWSQXEVSA-N	1	1	306.366	1.212	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897222770	708260674	/nfs/dbraw/zinc/26/06/74/708260674.db2.gz	XMKVGCYVANMTET-KGLIPLIRSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000897683209	708418568	/nfs/dbraw/zinc/41/85/68/708418568.db2.gz	ATSMIWYWIBSXOU-NHYWBVRUSA-N	1	1	316.361	1.808	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885972819	708673990	/nfs/dbraw/zinc/67/39/90/708673990.db2.gz	LDRULJXSVLYEKJ-CYBMUJFWSA-N	1	1	306.366	1.728	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885972819	708673993	/nfs/dbraw/zinc/67/39/93/708673993.db2.gz	LDRULJXSVLYEKJ-CYBMUJFWSA-N	1	1	306.366	1.728	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CCOCC1	ZINC000887084998	708951076	/nfs/dbraw/zinc/95/10/76/708951076.db2.gz	ZWEDOXAQOCLANL-UHFFFAOYSA-N	1	1	311.313	1.119	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000900403527	709579448	/nfs/dbraw/zinc/57/94/48/709579448.db2.gz	RFHAVMKGCNMNPB-HNNXBMFYSA-N	1	1	307.350	1.058	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc([N+](=O)[O-])c1C	ZINC000928438766	713195796	/nfs/dbraw/zinc/19/57/96/713195796.db2.gz	GVCNLTZQIVFTAR-CMPLNLGQSA-N	1	1	307.350	1.734	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928446192	713199861	/nfs/dbraw/zinc/19/98/61/713199861.db2.gz	VCVPHJQOJPNRSR-RNCFNFMXSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452785	713203822	/nfs/dbraw/zinc/20/38/22/713203822.db2.gz	JKDBAAREQHFQDM-ZWNOBZJWSA-N	1	1	309.391	1.896	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F	ZINC000928556738	713225249	/nfs/dbraw/zinc/22/52/49/713225249.db2.gz	CAOHQTIJYVROGC-LLVKDONJSA-N	1	1	309.341	1.832	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F	ZINC000928556738	713225252	/nfs/dbraw/zinc/22/52/52/713225252.db2.gz	CAOHQTIJYVROGC-LLVKDONJSA-N	1	1	309.341	1.832	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC000894686701	711238377	/nfs/dbraw/zinc/23/83/77/711238377.db2.gz	ARUBDDFGDXGKMP-RYUDHWBXSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])C[C@H]1CO	ZINC000894881681	711306867	/nfs/dbraw/zinc/30/68/67/711306867.db2.gz	OTSUZLLBFPBHOR-LBPRGKRZSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])C[C@H]1CO	ZINC000894881681	711306869	/nfs/dbraw/zinc/30/68/69/711306869.db2.gz	OTSUZLLBFPBHOR-LBPRGKRZSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1CO	ZINC000894884179	711307691	/nfs/dbraw/zinc/30/76/91/711307691.db2.gz	DJHKHAVFDUQZID-JTQLQIEISA-N	1	1	317.292	1.309	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1CO	ZINC000894884179	711307693	/nfs/dbraw/zinc/30/76/93/711307693.db2.gz	DJHKHAVFDUQZID-JTQLQIEISA-N	1	1	317.292	1.309	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@@H]1C	ZINC000895102130	711412892	/nfs/dbraw/zinc/41/28/92/711412892.db2.gz	SDTRSFTXENMWOK-PHIMTYICSA-N	1	1	306.366	1.613	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[N@H+]1C	ZINC000895739552	711591845	/nfs/dbraw/zinc/59/18/45/711591845.db2.gz	GWAMZUUMLUEGIS-BDAKNGLRSA-N	1	1	306.322	1.430	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc(Cl)c(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC000908350608	712749438	/nfs/dbraw/zinc/74/94/38/712749438.db2.gz	ZUTSADOXPZLUGX-PELKAZGASA-N	1	1	324.768	1.607	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000929095230	713544806	/nfs/dbraw/zinc/54/48/06/713544806.db2.gz	SLTSOTZPMVTBPP-PHIMTYICSA-N	1	1	320.349	1.629	20	5		DDBDMO
COC(=O)/C=C(/C)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989012	713729916	/nfs/dbraw/zinc/72/99/16/713729916.db2.gz	POUJFPYDXUQZKY-SEVUFMINSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C=C(/C)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989012	713729918	/nfs/dbraw/zinc/72/99/18/713729918.db2.gz	POUJFPYDXUQZKY-SEVUFMINSA-N	1	1	320.349	1.595	20	5		DDBDMO
CC[C@H]([NH2+]CC[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C	ZINC000930202513	713777224	/nfs/dbraw/zinc/77/72/24/713777224.db2.gz	WTNVJOJQWGVIEH-ZDUSSCGKSA-N	1	1	309.366	1.471	20	5		DDBDMO
C[C@@H]1CCCN(C(=O)OC[C@H]2CCCC[N@@H+]2CC[N+](=O)[O-])C1	ZINC000930471143	713843273	/nfs/dbraw/zinc/84/32/73/713843273.db2.gz	VBELWUKJZFWQQP-ZIAGYGMSSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[C@@H]1CCCN(C(=O)OC[C@H]2CCCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000930471143	713843276	/nfs/dbraw/zinc/84/32/76/713843276.db2.gz	VBELWUKJZFWQQP-ZIAGYGMSSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000931380440	714079358	/nfs/dbraw/zinc/07/93/58/714079358.db2.gz	PLCMLEJVPJXDQH-LLVKDONJSA-N	1	1	323.176	1.942	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000931380440	714079360	/nfs/dbraw/zinc/07/93/60/714079360.db2.gz	PLCMLEJVPJXDQH-LLVKDONJSA-N	1	1	323.176	1.942	20	5		DDBDMO
COC1(OC)CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1O	ZINC000931631374	714143155	/nfs/dbraw/zinc/14/31/55/714143155.db2.gz	DPCXFXYSHJYKNR-AWEZNQCLSA-N	1	1	310.350	1.459	20	5		DDBDMO
COC1(OC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1O	ZINC000931631374	714143157	/nfs/dbraw/zinc/14/31/57/714143157.db2.gz	DPCXFXYSHJYKNR-AWEZNQCLSA-N	1	1	310.350	1.459	20	5		DDBDMO
COC1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@H]1O	ZINC000931632932	714144191	/nfs/dbraw/zinc/14/41/91/714144191.db2.gz	DEQAEMIBSLUKBM-ZDUSSCGKSA-N	1	1	314.313	1.290	20	5		DDBDMO
COC1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@H]1O	ZINC000931632932	714144193	/nfs/dbraw/zinc/14/41/93/714144193.db2.gz	DEQAEMIBSLUKBM-ZDUSSCGKSA-N	1	1	314.313	1.290	20	5		DDBDMO
C[C@@H]1C[C@H](C)N(C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C[NH3+]	ZINC000923379847	714334838	/nfs/dbraw/zinc/33/48/38/714334838.db2.gz	ABGFVIVNJNLOMI-FIRUKDTASA-N	1	1	307.394	1.933	20	5		DDBDMO
[NH3+]CC[C@@H]1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000923481780	714370099	/nfs/dbraw/zinc/37/00/99/714370099.db2.gz	LOPMASGGSAWMTA-IUODEOHRSA-N	1	1	318.377	1.371	20	5		DDBDMO
Cc1ccc(CNC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000923910123	714488231	/nfs/dbraw/zinc/48/82/31/714488231.db2.gz	JLDIKBRDZCQZHY-WCQYABFASA-N	1	1	306.366	1.795	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000933438648	714589325	/nfs/dbraw/zinc/58/93/25/714589325.db2.gz	BGSBDSMFPFMONP-JQWIXIFHSA-N	1	1	309.370	1.041	20	5		DDBDMO
Cc1c(CN2CCN(C)CC[N@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000933995673	714718222	/nfs/dbraw/zinc/71/82/22/714718222.db2.gz	GCBQFPAOBUVMLI-UHFFFAOYSA-N	1	1	306.410	1.582	20	5		DDBDMO
CN1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC[N@@H+](C)CC1	ZINC000933995750	714718241	/nfs/dbraw/zinc/71/82/41/714718241.db2.gz	JVZAQAQPRZCCPG-UHFFFAOYSA-N	1	1	310.373	1.413	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114483	714745195	/nfs/dbraw/zinc/74/51/95/714745195.db2.gz	JCDOJVLCJOUKJX-RRFJBIMHSA-N	1	1	319.361	1.809	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114483	714745197	/nfs/dbraw/zinc/74/51/97/714745197.db2.gz	JCDOJVLCJOUKJX-RRFJBIMHSA-N	1	1	319.361	1.809	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000935693904	715118359	/nfs/dbraw/zinc/11/83/59/715118359.db2.gz	DRRDRDRBMWDWKK-OCVGTWLNSA-N	1	1	315.373	1.718	20	5		DDBDMO
COc1cnc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)c([N+](=O)[O-])c1	ZINC001164773430	721287541	/nfs/dbraw/zinc/28/75/41/721287541.db2.gz	ORUXNORWJISRBF-UHFFFAOYSA-N	1	1	318.377	1.921	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063615	734368218	/nfs/dbraw/zinc/36/82/18/734368218.db2.gz	GBZGEMRSJJVGIA-QVHKTLOISA-N	1	1	321.352	1.270	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001168195511	741800581	/nfs/dbraw/zinc/80/05/81/741800581.db2.gz	CRDKZTQRVAFJRP-GDBMZVCRSA-N	1	1	321.377	1.799	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001168195511	741800584	/nfs/dbraw/zinc/80/05/84/741800584.db2.gz	CRDKZTQRVAFJRP-GDBMZVCRSA-N	1	1	321.377	1.799	20	5		DDBDMO
O=C(NCC[NH2+]CCCc1cccc(F)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936236	742830650	/nfs/dbraw/zinc/83/06/50/742830650.db2.gz	CCRLXNSSCSXZTK-ZIAGYGMSSA-N	1	1	309.341	1.129	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC001184387310	744031358	/nfs/dbraw/zinc/03/13/58/744031358.db2.gz	IVUBZHDSDNQJDB-YNEHKIRRSA-N	1	1	321.377	1.739	20	5		DDBDMO
O=C(NCC1C[NH+](CC2CCCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031663297	747338436	/nfs/dbraw/zinc/33/84/36/747338436.db2.gz	WDGZWYFVDJTBQO-HUUCEWRRSA-N	1	1	309.410	1.670	20	5		DDBDMO
COCCC[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1	ZINC001115530510	751046335	/nfs/dbraw/zinc/04/63/35/751046335.db2.gz	AZJFGDPXJAKAQR-CHWSQXEVSA-N	1	1	313.398	1.097	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCC1	ZINC001039583647	762128768	/nfs/dbraw/zinc/12/87/68/762128768.db2.gz	UDMRMHLXVALUHN-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@H+]2CC1CCC1	ZINC001039583647	762128778	/nfs/dbraw/zinc/12/87/78/762128778.db2.gz	UDMRMHLXVALUHN-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[C@@H](C1)[N@@H+]2CC1CCC1	ZINC001039583647	762128788	/nfs/dbraw/zinc/12/87/88/762128788.db2.gz	UDMRMHLXVALUHN-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
CCOC(=O)[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)C1CCOCC1	ZINC001168977382	762146878	/nfs/dbraw/zinc/14/68/78/762146878.db2.gz	BDBHWWROLXYGIF-FPMFFAJLSA-N	1	1	314.382	1.380	20	5		DDBDMO
C[N@@H+](CCNC(=O)OC(C)(C)C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169006732	762175086	/nfs/dbraw/zinc/17/50/86/762175086.db2.gz	JFUJKXQMEJKKLJ-VXGBXAGGSA-N	1	1	301.387	1.888	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2C	ZINC001169019489	762199885	/nfs/dbraw/zinc/19/98/85/762199885.db2.gz	ISKAINDYZWOEGU-IHRRRGAJSA-N	1	1	322.409	1.801	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169022488	762201200	/nfs/dbraw/zinc/20/12/00/762201200.db2.gz	CEVKWGRZQQAQID-RBSFLKMASA-N	1	1	309.410	1.766	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@@H](N3CCOCC3)[C@@H](F)C2)C1	ZINC001169055294	762209623	/nfs/dbraw/zinc/20/96/23/762209623.db2.gz	PBRGGDSERKFASP-ZQDZILKHSA-N	1	1	315.389	1.176	20	5		DDBDMO
O=[N+]([O-])c1c(Cl)nc(Cl)nc1N1CC[N@@H+]2CC[C@H]2C1	ZINC001158424203	768224086	/nfs/dbraw/zinc/22/40/86/768224086.db2.gz	SIZNAFMFKMHEMZ-LURJTMIESA-N	1	1	304.137	1.586	20	5		DDBDMO
O=[N+]([O-])c1c(Cl)nc(Cl)nc1N1CC[N@H+]2CC[C@H]2C1	ZINC001158424203	768224092	/nfs/dbraw/zinc/22/40/92/768224092.db2.gz	SIZNAFMFKMHEMZ-LURJTMIESA-N	1	1	304.137	1.586	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccc2cnccc2c1[N+](=O)[O-]	ZINC001170343009	766274838	/nfs/dbraw/zinc/27/48/38/766274838.db2.gz	PASIDOYQJZQKKL-UHFFFAOYSA-N	1	1	313.317	1.844	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C[N@H+]1C1CC1	ZINC001137492695	766349939	/nfs/dbraw/zinc/34/99/39/766349939.db2.gz	XKJYELPGUCOFHQ-NKWVEPMBSA-N	1	1	313.745	1.326	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1cc(C)ccc1[N+](=O)[O-]	ZINC001093642243	774919735	/nfs/dbraw/zinc/91/97/35/774919735.db2.gz	RSTQTKZGJLGYQH-UHFFFAOYSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC(=O)N2CCC[C@H]2C1	ZINC001173235335	777064953	/nfs/dbraw/zinc/06/49/53/777064953.db2.gz	WEURANYEBVCLFG-WFASDCNBSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC(=O)N2CCC[C@H]2C1	ZINC001173235335	777064956	/nfs/dbraw/zinc/06/49/56/777064956.db2.gz	WEURANYEBVCLFG-WFASDCNBSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001177044219	778406462	/nfs/dbraw/zinc/40/64/62/778406462.db2.gz	PYRMDUIGBRRLBD-DOMZBBRYSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816079	780904122	/nfs/dbraw/zinc/90/41/22/780904122.db2.gz	QNDUSXVZRVVHMI-OCCSQVGLSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816079	780904126	/nfs/dbraw/zinc/90/41/26/780904126.db2.gz	QNDUSXVZRVVHMI-OCCSQVGLSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC1CC[NH+](CCN(C)C)CC1	ZINC001326359615	861303892	/nfs/dbraw/zinc/30/38/92/861303892.db2.gz	QERUEJLQAUKVQA-UHFFFAOYSA-N	1	1	307.398	1.158	20	5		DDBDMO
CCCCCCC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001149800512	861915667	/nfs/dbraw/zinc/91/56/67/861915667.db2.gz	VUUTXCCKLIXUIW-UHFFFAOYSA-N	1	1	311.386	1.505	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@@H]2CCC(=O)N2)ncc1[N+](=O)[O-]	ZINC001156151711	862754882	/nfs/dbraw/zinc/75/48/82/862754882.db2.gz	ROJYWZVDODRBLA-QRGHLMKCSA-N	1	1	305.338	1.213	20	5		DDBDMO
Cc1[nH]c(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(C)[nH+]1	ZINC001156215025	862829726	/nfs/dbraw/zinc/82/97/26/862829726.db2.gz	ZPAXYERIOQGDQB-UHFFFAOYSA-N	1	1	318.289	1.593	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCC(=O)N2CCCC2)ncc1[N+](=O)[O-]	ZINC001156346837	862954923	/nfs/dbraw/zinc/95/49/23/862954923.db2.gz	PJKWDMJNBFNVMA-VMPITWQZSA-N	1	1	319.365	1.556	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H]2C[N@@H+]3CCN2C[C@H]3C)cc1[N+](=O)[O-]	ZINC001123474146	859251408	/nfs/dbraw/zinc/25/14/08/859251408.db2.gz	YRWUPTCNQVKGHP-RISCZKNCSA-N	1	1	304.350	1.230	20	5		DDBDMO
Cc1cc(NC(=O)[C@H](C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC001124043320	859546613	/nfs/dbraw/zinc/54/66/13/859546613.db2.gz	FRZYIXQDFHMEEB-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
CC(C)CC[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001160090426	865675822	/nfs/dbraw/zinc/67/58/22/865675822.db2.gz	FRDWGGPXWKBBCP-HUUCEWRRSA-N	1	1	309.410	1.836	20	5		DDBDMO
CC(C)CC[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001160090426	865675828	/nfs/dbraw/zinc/67/58/28/865675828.db2.gz	FRDWGGPXWKBBCP-HUUCEWRRSA-N	1	1	309.410	1.836	20	5		DDBDMO
CC(C)CC[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001160090426	865675831	/nfs/dbraw/zinc/67/58/31/865675831.db2.gz	FRDWGGPXWKBBCP-HUUCEWRRSA-N	1	1	309.410	1.836	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](CCO)CC2)c2ccccc21	ZINC001333340834	866650322	/nfs/dbraw/zinc/65/03/22/866650322.db2.gz	CZQDVISQTLCYMP-UHFFFAOYSA-N	1	1	302.334	1.257	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N[C@@H]2CNC(=O)C2(C)C)ncc1[N+](=O)[O-]	ZINC001163010975	867993789	/nfs/dbraw/zinc/99/37/89/867993789.db2.gz	HQVWYABLCDMOJQ-BTDICHCPSA-N	1	1	319.365	1.459	20	5		DDBDMO
CC[N@@H+]1CCCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])CC1	ZINC001163774694	868695725	/nfs/dbraw/zinc/69/57/25/868695725.db2.gz	QAZCHLIYQIEHFO-UHFFFAOYSA-N	1	1	300.746	1.414	20	5		DDBDMO
CC[N@H+]1CCCN(c2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])CC1	ZINC001163774694	868695730	/nfs/dbraw/zinc/69/57/30/868695730.db2.gz	QAZCHLIYQIEHFO-UHFFFAOYSA-N	1	1	300.746	1.414	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)nc2ccccn21	ZINC001164288246	869088977	/nfs/dbraw/zinc/08/89/77/869088977.db2.gz	NHPAFEBLYIUYBC-QWRGUYRKSA-N	1	1	305.313	1.475	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[N@H+]3C[C@@H](F)C[C@H]3C2)nc2ccccn21	ZINC001164288246	869088987	/nfs/dbraw/zinc/08/89/87/869088987.db2.gz	NHPAFEBLYIUYBC-QWRGUYRKSA-N	1	1	305.313	1.475	20	5		DDBDMO
[NH3+][C@@H]1CN(c2cnc3cc([N+](=O)[O-])ccc3n2)CCC1(F)F	ZINC001164320134	869124042	/nfs/dbraw/zinc/12/40/42/869124042.db2.gz	YPZVJKZXLBUIBN-LLVKDONJSA-N	1	1	309.276	1.711	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N[C@@H]1CCC[N@H+]2CCSC[C@@H]12	ZINC001336836580	869174402	/nfs/dbraw/zinc/17/44/02/869174402.db2.gz	IOTRVKKINRNRJA-YPMHNXCESA-N	1	1	308.407	1.712	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC001297359022	870002241	/nfs/dbraw/zinc/00/22/41/870002241.db2.gz	KPMWHRDDXGVVBJ-OCCSQVGLSA-N	1	1	322.340	1.435	20	5		DDBDMO
Cn1c(C[N+](=O)[O-])nnc1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC001339553459	870552526	/nfs/dbraw/zinc/55/25/26/870552526.db2.gz	OKRCWAWNDRWBSE-DGCLKSJQSA-N	1	1	320.397	1.045	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)n1	ZINC001339997511	870830699	/nfs/dbraw/zinc/83/06/99/870830699.db2.gz	CPOXNOCVLVEBJF-GMTAPVOTSA-N	1	1	320.349	1.529	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cccc([N+](=O)[O-])c3N)[C@H]2C1	ZINC001305873756	871307163	/nfs/dbraw/zinc/30/71/63/871307163.db2.gz	KQCIQNDXWBBDPU-DLOVCJGASA-N	1	1	304.350	1.247	20	5		DDBDMO
O=[N+]([O-])c1cccc(Br)c1C[NH2+][C@H]1C[C@@H](O)C1	ZINC001308439813	871502009	/nfs/dbraw/zinc/50/20/09/871502009.db2.gz	WTFIMUGYRHHFLO-OCAPTIKFSA-N	1	1	301.140	1.970	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001347505018	874165555	/nfs/dbraw/zinc/16/55/55/874165555.db2.gz	UOOJJDVBKDPNPE-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])sc2C(=O)OC)C1	ZINC001227541852	883070338	/nfs/dbraw/zinc/07/03/38/883070338.db2.gz	PPPLISHBSWPJGD-MRVPVSSYSA-N	1	1	300.336	1.916	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC001354400839	877953333	/nfs/dbraw/zinc/95/33/33/877953333.db2.gz	LZAATGFZRANWCD-RWMBFGLXSA-N	1	1	318.377	1.707	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC001355313201	878496129	/nfs/dbraw/zinc/49/61/29/878496129.db2.gz	QILVMVUTVYXPOD-CYBMUJFWSA-N	1	1	320.393	1.921	20	5		DDBDMO
COc1ccc(CO[C@@H](C)C[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC001223513784	880988118	/nfs/dbraw/zinc/98/81/18/880988118.db2.gz	HXVYBNHIOYXQLU-LBPRGKRZSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1ccc(COCC[N@@H+]2CC[C@@H](OC)C2)cc1[N+](=O)[O-]	ZINC001223647546	881044034	/nfs/dbraw/zinc/04/40/34/881044034.db2.gz	CYUFTEZVJWTGQK-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1ccc(CO[C@@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC001223651404	881044592	/nfs/dbraw/zinc/04/45/92/881044592.db2.gz	WXZNVYDRWRTFNU-LBPRGKRZSA-N	1	1	310.350	1.841	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CCC[N@H+](C)C2)cc1O	ZINC001228812487	883685152	/nfs/dbraw/zinc/68/51/52/883685152.db2.gz	WRPNASMTPGDRAU-SECBINFHSA-N	1	1	310.306	1.560	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CCC[N@@H+](C)C2)cc1O	ZINC001228812487	883685156	/nfs/dbraw/zinc/68/51/56/883685156.db2.gz	WRPNASMTPGDRAU-SECBINFHSA-N	1	1	310.306	1.560	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@](O)(CN)C1	ZINC001246554963	892693987	/nfs/dbraw/zinc/69/39/87/892693987.db2.gz	AFPPLSKFIXMXIR-CJNGLKHVSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@](O)(CN)C1	ZINC001246554963	892693991	/nfs/dbraw/zinc/69/39/91/892693991.db2.gz	AFPPLSKFIXMXIR-CJNGLKHVSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@](O)(C[NH3+])C1	ZINC001246554963	892693995	/nfs/dbraw/zinc/69/39/95/892693995.db2.gz	AFPPLSKFIXMXIR-CJNGLKHVSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])N1C[C@H]2COC[C@@H](C1)C2[NH3+]	ZINC001246857612	892947797	/nfs/dbraw/zinc/94/77/97/892947797.db2.gz	BNASOOILKPTTIG-ILMGOGQSSA-N	1	1	305.378	1.431	20	5		DDBDMO
CCC[N@H+]1CCCC[C@@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC001252527200	895244088	/nfs/dbraw/zinc/24/40/88/895244088.db2.gz	NJXHKAFZSFNWPL-GFCCVEGCSA-N	1	1	310.354	1.599	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)CCNS(C)(=O)=O	ZINC001254314849	896343617	/nfs/dbraw/zinc/34/36/17/896343617.db2.gz	XMNGBKNQGAHVDJ-LLVKDONJSA-N	1	1	315.395	1.445	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)CCNS(C)(=O)=O	ZINC001254314849	896343628	/nfs/dbraw/zinc/34/36/28/896343628.db2.gz	XMNGBKNQGAHVDJ-LLVKDONJSA-N	1	1	315.395	1.445	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001254559552	896501405	/nfs/dbraw/zinc/50/14/05/896501405.db2.gz	KXDIZPGAHXQMRD-DGCLKSJQSA-N	1	1	305.334	1.662	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001254559552	896501421	/nfs/dbraw/zinc/50/14/21/896501421.db2.gz	KXDIZPGAHXQMRD-DGCLKSJQSA-N	1	1	305.334	1.662	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC(N(C)C2COC2)C1	ZINC001254559173	896501467	/nfs/dbraw/zinc/50/14/67/896501467.db2.gz	JGVVTCJCINSFCH-GFCCVEGCSA-N	1	1	305.378	1.541	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CC(N3CCOCC3)C1)C2	ZINC001254598601	896524413	/nfs/dbraw/zinc/52/44/13/896524413.db2.gz	IEEJYBZFSFTYDE-OAHLLOKOSA-N	1	1	303.362	1.078	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001293327196	914416275	/nfs/dbraw/zinc/41/62/75/914416275.db2.gz	DIWDQXOJEJMNCT-LLVKDONJSA-N	1	1	307.354	1.176	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)[C@H]1C[N@H+](C)CCN1C	ZINC001262705523	900320603	/nfs/dbraw/zinc/32/06/03/900320603.db2.gz	LIMGDEHWRCWJDU-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001262705523	900320615	/nfs/dbraw/zinc/32/06/15/900320615.db2.gz	LIMGDEHWRCWJDU-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248476848	282086680	/nfs/dbraw/zinc/08/66/80/282086680.db2.gz	YJIAXYPPVILBFZ-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248476848	282086687	/nfs/dbraw/zinc/08/66/87/282086687.db2.gz	YJIAXYPPVILBFZ-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C(NCC1CC[NH+](C2CC2)CC1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000278459887	214168103	/nfs/dbraw/zinc/16/81/03/214168103.db2.gz	YAKAAMROVHZFDH-UHFFFAOYSA-N	1	1	319.361	1.905	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@H]1CCO	ZINC000249524703	282166440	/nfs/dbraw/zinc/16/64/40/282166440.db2.gz	RRXQJFBHQZREMB-KBPBESRZSA-N	1	1	324.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@H]1CCO	ZINC000249524706	282166445	/nfs/dbraw/zinc/16/64/45/282166445.db2.gz	RRXQJFBHQZREMB-UONOGXRCSA-N	1	1	324.377	1.571	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)c1cccc([N+](=O)[O-])c1	ZINC000452343751	231353431	/nfs/dbraw/zinc/35/34/31/231353431.db2.gz	BPJNGAHNVUZXLA-CQSZACIVSA-N	1	1	307.350	1.171	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000450823685	529932715	/nfs/dbraw/zinc/93/27/15/529932715.db2.gz	CVJDUTMZJDVWLJ-YOGCLGLASA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](CCO)C[C@H]1C	ZINC000457136982	232000832	/nfs/dbraw/zinc/00/08/32/232000832.db2.gz	VHCVMIUMXNTKDR-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](CCO)C[C@H]1C	ZINC000457136982	232000834	/nfs/dbraw/zinc/00/08/34/232000834.db2.gz	VHCVMIUMXNTKDR-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000458204265	530054634	/nfs/dbraw/zinc/05/46/34/530054634.db2.gz	YUJPZSKCYIOVJJ-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000299536853	530055725	/nfs/dbraw/zinc/05/57/25/530055725.db2.gz	UMPSGJMTUYRJJO-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]([C@H](C)O)C1	ZINC000305640249	282398370	/nfs/dbraw/zinc/39/83/70/282398370.db2.gz	JOFILSGTWBLCKC-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]([C@H](C)O)C1	ZINC000305640249	282398373	/nfs/dbraw/zinc/39/83/73/282398373.db2.gz	JOFILSGTWBLCKC-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000279785215	215143370	/nfs/dbraw/zinc/14/33/70/215143370.db2.gz	UWXOSIBUIBNCBP-XJKSGUPXSA-N	1	1	323.393	1.281	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000149221623	186048571	/nfs/dbraw/zinc/04/85/71/186048571.db2.gz	GWQXEOJATVVJEF-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1nc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000287185896	219366709	/nfs/dbraw/zinc/36/67/09/219366709.db2.gz	ZTZHNFFVWLFDRG-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+](C)C2CC2)cc([N+](=O)[O-])c1OC	ZINC000265984245	186348156	/nfs/dbraw/zinc/34/81/56/186348156.db2.gz	ZVCIUCOKGDOOSH-UHFFFAOYSA-N	1	1	323.349	1.436	20	5		DDBDMO
Cc1nn(C)c(N2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000047330959	352490977	/nfs/dbraw/zinc/49/09/77/352490977.db2.gz	FWVOLGHOLPYISF-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000047633010	352505650	/nfs/dbraw/zinc/50/56/50/352505650.db2.gz	NBJFFDBPROBEAA-LBPRGKRZSA-N	1	1	323.349	1.515	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000072860137	191242247	/nfs/dbraw/zinc/24/22/47/191242247.db2.gz	WSLXWTJMPNKUCC-ZDUSSCGKSA-N	1	1	320.393	1.807	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])cn2)CC1	ZINC000060380146	352869444	/nfs/dbraw/zinc/86/94/44/352869444.db2.gz	MDJQUGRPNNZXJH-CYBMUJFWSA-N	1	1	307.398	1.675	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ccncc2[N+](=O)[O-])CC1	ZINC000060380152	352870037	/nfs/dbraw/zinc/87/00/37/352870037.db2.gz	MMESHNQJVOFVTO-CYBMUJFWSA-N	1	1	307.398	1.675	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000063728188	352922098	/nfs/dbraw/zinc/92/20/98/352922098.db2.gz	BOVGXUJBHNQFPN-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC[N@H+](C)C1CC1	ZINC000067717798	353064146	/nfs/dbraw/zinc/06/41/46/353064146.db2.gz	QAGYCYQQJVQWRE-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
CNC(=O)c1ccc(NC[C@@H](C)[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000068913122	353135975	/nfs/dbraw/zinc/13/59/75/353135975.db2.gz	SLBSGDPENHYJTQ-SNVBAGLBSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1	ZINC000069129501	353147392	/nfs/dbraw/zinc/14/73/92/353147392.db2.gz	BJPWJCGPAOEENQ-JTQLQIEISA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000072714905	353211756	/nfs/dbraw/zinc/21/17/56/353211756.db2.gz	RKUNUYNEDZFNLE-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000072714905	353211759	/nfs/dbraw/zinc/21/17/59/353211759.db2.gz	RKUNUYNEDZFNLE-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2	ZINC000072830761	353219848	/nfs/dbraw/zinc/21/98/48/353219848.db2.gz	UACFNEQOGLDTFM-INIZCTEOSA-N	1	1	319.361	1.576	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000182091130	199385824	/nfs/dbraw/zinc/38/58/24/199385824.db2.gz	NUHDTCQNKPTBHW-CYBMUJFWSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[N@@H+](CCNC(=O)NCCc1ccccc1[N+](=O)[O-])C1CC1	ZINC000074200506	353299964	/nfs/dbraw/zinc/29/99/64/353299964.db2.gz	ZFCPAHZZTKXJPG-UHFFFAOYSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[N@H+](Cc1ccccc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174656049	198366350	/nfs/dbraw/zinc/36/63/50/198366350.db2.gz	GUFHNYOGXLDHRP-ZDUSSCGKSA-N	1	1	324.768	1.938	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCN(CC(F)(F)F)CC2)c1	ZINC000174869830	198394765	/nfs/dbraw/zinc/39/47/65/198394765.db2.gz	QPKVSCBVFLIXSN-UHFFFAOYSA-N	1	1	321.303	1.361	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCN(CC(F)(F)F)CC2)c1	ZINC000174869830	198394767	/nfs/dbraw/zinc/39/47/67/198394767.db2.gz	QPKVSCBVFLIXSN-UHFFFAOYSA-N	1	1	321.303	1.361	20	5		DDBDMO
COC[C@@](C)(CC(=O)OC)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000078661369	353526971	/nfs/dbraw/zinc/52/69/71/353526971.db2.gz	HEKCIOXXIXOMCW-GFCCVEGCSA-N	1	1	302.352	1.714	20	5		DDBDMO
CCCC[N@H+](CCO)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000078665048	353527716	/nfs/dbraw/zinc/52/77/16/353527716.db2.gz	VCYSGKAWSBKNSZ-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CCCC[N@@H+](CCO)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000078665048	353527717	/nfs/dbraw/zinc/52/77/17/353527717.db2.gz	VCYSGKAWSBKNSZ-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC[C@@H]2c2ccccc2F)c1	ZINC000081626463	353685208	/nfs/dbraw/zinc/68/52/08/353685208.db2.gz	VBTOGBUXQVWPTJ-SWLSCSKDSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H]2c2ccccc2F)c1	ZINC000081626463	353685210	/nfs/dbraw/zinc/68/52/10/353685210.db2.gz	VBTOGBUXQVWPTJ-SWLSCSKDSA-N	1	1	320.324	1.738	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000091513458	353828956	/nfs/dbraw/zinc/82/89/56/353828956.db2.gz	IWQSRKSNJMYTIE-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000091513458	353828959	/nfs/dbraw/zinc/82/89/59/353828959.db2.gz	IWQSRKSNJMYTIE-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
Cc1c(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154978872	354210027	/nfs/dbraw/zinc/21/00/27/354210027.db2.gz	RGENMQFYFUQVRX-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1c(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154978872	354210032	/nfs/dbraw/zinc/21/00/32/354210032.db2.gz	RGENMQFYFUQVRX-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1C	ZINC000280781529	354424030	/nfs/dbraw/zinc/42/40/30/354424030.db2.gz	QCVFILIVSWJLPA-MWLCHTKSSA-N	1	1	319.317	1.977	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1C	ZINC000280781529	354424033	/nfs/dbraw/zinc/42/40/33/354424033.db2.gz	QCVFILIVSWJLPA-MWLCHTKSSA-N	1	1	319.317	1.977	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000322570959	354537332	/nfs/dbraw/zinc/53/73/32/354537332.db2.gz	FUMKGRKYHOUMSJ-OLZOCXBDSA-N	1	1	318.377	1.993	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587986645	354888980	/nfs/dbraw/zinc/88/89/80/354888980.db2.gz	FLIKTCIWMYSKKA-ZDUSSCGKSA-N	1	1	322.409	1.980	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCc3c[nH+]cn3C2)n1	ZINC000588067845	354899572	/nfs/dbraw/zinc/89/95/72/354899572.db2.gz	UXCGLLTYVDQNMP-SECBINFHSA-N	1	1	317.305	1.400	20	5		DDBDMO
Cn1c2cc(NCC[N@@H+](C)C3CC3)c([N+](=O)[O-])cc2n(C)c1=O	ZINC000587473004	354882985	/nfs/dbraw/zinc/88/29/85/354882985.db2.gz	FEZNVYVEDONSGH-UHFFFAOYSA-N	1	1	319.365	1.291	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]([N@H+]3CC[C@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000588863061	354944328	/nfs/dbraw/zinc/94/43/28/354944328.db2.gz	OOFINFKFHLTVEX-KGLIPLIRSA-N	1	1	319.361	1.184	20	5		DDBDMO
COc1cc(CN2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1F	ZINC000590011037	355040330	/nfs/dbraw/zinc/04/03/30/355040330.db2.gz	GHOUWWSSBDIVIL-HZMBPMFUSA-N	1	1	309.341	1.878	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590443477	355097358	/nfs/dbraw/zinc/09/73/58/355097358.db2.gz	KMXMLCYFLYROCA-NXEZZACHSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590443477	355097361	/nfs/dbraw/zinc/09/73/61/355097361.db2.gz	KMXMLCYFLYROCA-NXEZZACHSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590443477	355097365	/nfs/dbraw/zinc/09/73/65/355097365.db2.gz	KMXMLCYFLYROCA-NXEZZACHSA-N	1	1	307.354	1.217	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000590443434	355097714	/nfs/dbraw/zinc/09/77/14/355097714.db2.gz	IRCCTHOBQYUGRL-FZMZJTMJSA-N	1	1	305.334	1.136	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC000590445086	355098555	/nfs/dbraw/zinc/09/85/55/355098555.db2.gz	MZZOLIKOZFCJBD-DGCLKSJQSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC000591534393	355324680	/nfs/dbraw/zinc/32/46/80/355324680.db2.gz	AHTTUCVQQBOUDM-SWLSCSKDSA-N	1	1	303.362	1.988	20	5		DDBDMO
Cn1c[nH+]c2cc(NC[C@@H](O)Cn3cc([N+](=O)[O-])cn3)ccc21	ZINC000591774188	355382474	/nfs/dbraw/zinc/38/24/74/355382474.db2.gz	KBQPMELZBRTQFJ-GFCCVEGCSA-N	1	1	316.321	1.151	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)c1[N+](=O)[O-]	ZINC000591893461	355414570	/nfs/dbraw/zinc/41/45/70/355414570.db2.gz	YKEJWFKTCDVTSV-MNOVXSKESA-N	1	1	307.354	1.231	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000592751256	355675115	/nfs/dbraw/zinc/67/51/15/355675115.db2.gz	LACDHLOPJIJRKG-ZYHUDNBSSA-N	1	1	307.350	1.560	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000264724734	283115143	/nfs/dbraw/zinc/11/51/43/283115143.db2.gz	YIZGJJHDQTZMRV-SNVBAGLBSA-N	1	1	321.333	1.048	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593029222	355774513	/nfs/dbraw/zinc/77/45/13/355774513.db2.gz	RPAJQNRKIOGVPE-NSHDSACASA-N	1	1	310.350	1.974	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000593697765	355970745	/nfs/dbraw/zinc/97/07/45/355970745.db2.gz	FBROVNKPKXYXAB-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])c1	ZINC000594067152	356104724	/nfs/dbraw/zinc/10/47/24/356104724.db2.gz	YOLPJMNJNNHWAY-SNVBAGLBSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])c1	ZINC000594067152	356104730	/nfs/dbraw/zinc/10/47/30/356104730.db2.gz	YOLPJMNJNNHWAY-SNVBAGLBSA-N	1	1	323.349	1.387	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000594419172	356204727	/nfs/dbraw/zinc/20/47/27/356204727.db2.gz	OJMRLSQAHZWMIK-QWHCGFSZSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@@H](CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])[NH+](C)C	ZINC000594817380	356326505	/nfs/dbraw/zinc/32/65/05/356326505.db2.gz	QLSSNXZGFXLQKX-VIFPVBQESA-N	1	1	319.358	1.352	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)C(=O)NCCF	ZINC000595040801	356376025	/nfs/dbraw/zinc/37/60/25/356376025.db2.gz	XWBNLDADXVHTAV-NXEZZACHSA-N	1	1	313.329	1.728	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](Cn2ccnn2)C1	ZINC000595608766	356574968	/nfs/dbraw/zinc/57/49/68/356574968.db2.gz	VQSYUPMGLBXCAZ-NSHDSACASA-N	1	1	305.313	1.848	20	5		DDBDMO
C[C@H]1C[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)C1O	ZINC000595742404	356631296	/nfs/dbraw/zinc/63/12/96/356631296.db2.gz	FYZPQKPVSCLEMH-QWRGUYRKSA-N	1	1	307.350	1.482	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000595767179	356644336	/nfs/dbraw/zinc/64/43/36/356644336.db2.gz	WGFUHBJRZXHLJN-ZWNOBZJWSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000595767179	356644337	/nfs/dbraw/zinc/64/43/37/356644337.db2.gz	WGFUHBJRZXHLJN-ZWNOBZJWSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CCC(=O)N(C)CC2)c([N+](=O)[O-])c1	ZINC000595786618	356652231	/nfs/dbraw/zinc/65/22/31/356652231.db2.gz	UURUDWUTAINUIM-UHFFFAOYSA-N	1	1	323.349	1.146	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595828158	356666667	/nfs/dbraw/zinc/66/66/67/356666667.db2.gz	UVRPHTWSXSOHRE-STQMWFEESA-N	1	1	319.361	1.892	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c([N+](=O)[O-])c1	ZINC000595872662	356686764	/nfs/dbraw/zinc/68/67/64/356686764.db2.gz	KLOYHUHEBMQXKW-BLLLJJGKSA-N	1	1	324.377	1.933	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)c1c[nH]nc1[C@H]1CC[NH2+]C1	ZINC000595925115	356706965	/nfs/dbraw/zinc/70/69/65/356706965.db2.gz	VIXAVSMASGUWGK-VIFPVBQESA-N	1	1	301.306	1.647	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596076292	356764303	/nfs/dbraw/zinc/76/43/03/356764303.db2.gz	OULWAEAKJVESDO-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596537534	356910215	/nfs/dbraw/zinc/91/02/15/356910215.db2.gz	HIVYXBZFNYIVTN-AWEZNQCLSA-N	1	1	305.378	1.939	20	5		DDBDMO
CCN(C(=O)c1ccc(NC)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000597943904	357393069	/nfs/dbraw/zinc/39/30/69/357393069.db2.gz	ASTZXXGEDFTUMA-LBPRGKRZSA-N	1	1	306.366	1.803	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](CCC)C2)c1[N+](=O)[O-]	ZINC000598341877	357543804	/nfs/dbraw/zinc/54/38/04/357543804.db2.gz	HOLNBPDFYTWOGA-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598512002	357610448	/nfs/dbraw/zinc/61/04/48/357610448.db2.gz	VVZBCBSPKWHMNE-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598512002	357610454	/nfs/dbraw/zinc/61/04/54/357610454.db2.gz	VVZBCBSPKWHMNE-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CCn3cc[nH+]c3C2)c1[N+](=O)[O-]	ZINC000598618643	357656566	/nfs/dbraw/zinc/65/65/66/357656566.db2.gz	NNSWYXZKIOKITL-VIFPVBQESA-N	1	1	317.305	1.400	20	5		DDBDMO
COCC[NH+]1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1	ZINC000599017951	357795538	/nfs/dbraw/zinc/79/55/38/357795538.db2.gz	RRMIJPDPSIMXQX-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000599142322	357828168	/nfs/dbraw/zinc/82/81/68/357828168.db2.gz	UQCYPHJXQPYMID-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1nn(C)cc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000179534437	199051872	/nfs/dbraw/zinc/05/18/72/199051872.db2.gz	AWMQFFALAPTGSE-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000599567327	357976606	/nfs/dbraw/zinc/97/66/06/357976606.db2.gz	NTFUNVIYEXXJJH-HNNXBMFYSA-N	1	1	308.334	1.667	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C[C@H]2C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000599674128	358019714	/nfs/dbraw/zinc/01/97/14/358019714.db2.gz	YVPVTRXHICGZDZ-TXEJJXNPSA-N	1	1	310.350	1.685	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC1CC([NH+]2CCOCC2)C1	ZINC000600069308	358114664	/nfs/dbraw/zinc/11/46/64/358114664.db2.gz	QQPAFTQKOWFNHO-UHFFFAOYSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1c[nH]nc1[N+](=O)[O-]	ZINC000600228817	358163755	/nfs/dbraw/zinc/16/37/55/358163755.db2.gz	GCFURIBEROCQMH-NSHDSACASA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601127585	358413748	/nfs/dbraw/zinc/41/37/48/358413748.db2.gz	KEZONFAMSSULCA-LLVKDONJSA-N	1	1	307.325	1.948	20	5		DDBDMO
CC(=O)N[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1	ZINC000601175867	358433840	/nfs/dbraw/zinc/43/38/40/358433840.db2.gz	RBNOIJVYUONKRO-LLVKDONJSA-N	1	1	300.318	1.858	20	5		DDBDMO
Cc1nn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000601956663	358752978	/nfs/dbraw/zinc/75/29/78/358752978.db2.gz	GWJCLDUZARHMCY-MRXNPFEDSA-N	1	1	316.361	1.737	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000602099668	358812907	/nfs/dbraw/zinc/81/29/07/358812907.db2.gz	ZALUZIINPTYMBR-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602472766	359001527	/nfs/dbraw/zinc/00/15/27/359001527.db2.gz	PNTHPHGWRCUCJU-CHWSQXEVSA-N	1	1	324.381	1.080	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602831420	359223155	/nfs/dbraw/zinc/22/31/55/359223155.db2.gz	XMCZMSJOYGJBJU-LBPRGKRZSA-N	1	1	309.370	1.209	20	5		DDBDMO
CCC[N@H+](CCN1CCCC1)CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602832142	359223257	/nfs/dbraw/zinc/22/32/57/359223257.db2.gz	RCZSONKQLFXLMI-UHFFFAOYSA-N	1	1	309.414	1.908	20	5		DDBDMO
CCC[N@@H+](CCN1CCCC1)CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602832142	359223264	/nfs/dbraw/zinc/22/32/64/359223264.db2.gz	RCZSONKQLFXLMI-UHFFFAOYSA-N	1	1	309.414	1.908	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@]2(C)C(=O)NC(=O)[C@]2(C)C1	ZINC000602938985	359307559	/nfs/dbraw/zinc/30/75/59/359307559.db2.gz	ZSBZFHCTLPYWRT-CIISACIHSA-N	1	1	317.345	1.640	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](n2ccnn2)CC1	ZINC000602892176	359275407	/nfs/dbraw/zinc/27/54/07/359275407.db2.gz	MLBSMUKRWOIGQQ-CYBMUJFWSA-N	1	1	319.369	1.418	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000618455659	363637493	/nfs/dbraw/zinc/63/74/93/363637493.db2.gz	COYVSBXIRZPIJP-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](OC)C[C@]1(C)CO	ZINC000602964698	359327430	/nfs/dbraw/zinc/32/74/30/359327430.db2.gz	SFVDFVLKXSZJPP-DZGCQCFKSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](OC)C[C@]1(C)CO	ZINC000602964698	359327434	/nfs/dbraw/zinc/32/74/34/359327434.db2.gz	SFVDFVLKXSZJPP-DZGCQCFKSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@@H](OC)C[C@@]2(C)CO)cc1[N+](=O)[O-]	ZINC000602963874	359327813	/nfs/dbraw/zinc/32/78/13/359327813.db2.gz	JLEQPQOAGDOFCA-WFASDCNBSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[C@](CO)([NH2+]CC(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1	ZINC000602965942	359330762	/nfs/dbraw/zinc/33/07/62/359330762.db2.gz	RSSSZBXHLUIMNY-MRXNPFEDSA-N	1	1	321.377	1.404	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141802	359431063	/nfs/dbraw/zinc/43/10/63/359431063.db2.gz	IOQUVGXUTCUYRF-SNVBAGLBSA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141802	359431068	/nfs/dbraw/zinc/43/10/68/359431068.db2.gz	IOQUVGXUTCUYRF-SNVBAGLBSA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141802	359431074	/nfs/dbraw/zinc/43/10/74/359431074.db2.gz	IOQUVGXUTCUYRF-SNVBAGLBSA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141802	359431078	/nfs/dbraw/zinc/43/10/78/359431078.db2.gz	IOQUVGXUTCUYRF-SNVBAGLBSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC1(C)[C@@H](Nc2ccc([N+](=O)[O-])cn2)C[C@@H]1[NH+]1CCOCC1	ZINC000603397054	359614906	/nfs/dbraw/zinc/61/49/06/359614906.db2.gz	JLXYIIWSUFYJGA-STQMWFEESA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](C[C@@H](C)O)CC1	ZINC000186855347	200022615	/nfs/dbraw/zinc/02/26/15/200022615.db2.gz	OFCIXADKQITKDJ-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000186858871	200023053	/nfs/dbraw/zinc/02/30/53/200023053.db2.gz	XQEUANFUPUBRKP-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000187091476	200060220	/nfs/dbraw/zinc/06/02/20/200060220.db2.gz	DXCIILOFYYGNSQ-LBPRGKRZSA-N	1	1	322.365	1.690	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000188324977	200228694	/nfs/dbraw/zinc/22/86/94/200228694.db2.gz	CJZIBOSUASZQNZ-GFCCVEGCSA-N	1	1	320.393	1.885	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+](CCO)CCc2ccccc2)c1	ZINC000610453360	360440867	/nfs/dbraw/zinc/44/08/67/360440867.db2.gz	ZYQXMJJPVMCOBU-UHFFFAOYSA-N	1	1	304.350	1.328	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000610394587	360425174	/nfs/dbraw/zinc/42/51/74/360425174.db2.gz	FNFMFPRJDGIPDU-UHFFFAOYSA-N	1	1	320.393	1.855	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O	ZINC000611287538	360689808	/nfs/dbraw/zinc/68/98/08/360689808.db2.gz	HFCOGYMXJSLJBM-GWCFXTLKSA-N	1	1	308.334	1.569	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000611525984	360748010	/nfs/dbraw/zinc/74/80/10/360748010.db2.gz	WQLDQAXWSHYPJC-NSHDSACASA-N	1	1	308.382	1.447	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]C2CSC2)cc1	ZINC000612592299	361075821	/nfs/dbraw/zinc/07/58/21/361075821.db2.gz	HSHIWSXQQOWZFG-UHFFFAOYSA-N	1	1	302.377	1.074	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000193822781	201129745	/nfs/dbraw/zinc/12/97/45/201129745.db2.gz	MPSIGODNSLCQKD-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000193822781	201129748	/nfs/dbraw/zinc/12/97/48/201129748.db2.gz	MPSIGODNSLCQKD-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000194757358	201284362	/nfs/dbraw/zinc/28/43/62/201284362.db2.gz	RQPBALBOEJAOJL-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113721	212128269	/nfs/dbraw/zinc/12/82/69/212128269.db2.gz	YQSWSUDAAPESPW-IAQYHMDHSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113721	212128271	/nfs/dbraw/zinc/12/82/71/212128271.db2.gz	YQSWSUDAAPESPW-IAQYHMDHSA-N	1	1	319.361	1.857	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000275067546	212101991	/nfs/dbraw/zinc/10/19/91/212101991.db2.gz	AHXMBWQYVPLIHR-ONGXEEELSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000275067546	212101990	/nfs/dbraw/zinc/10/19/90/212101990.db2.gz	AHXMBWQYVPLIHR-ONGXEEELSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000275067546	212101986	/nfs/dbraw/zinc/10/19/86/212101986.db2.gz	AHXMBWQYVPLIHR-ONGXEEELSA-N	1	1	309.370	1.293	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000264941507	204288103	/nfs/dbraw/zinc/28/81/03/204288103.db2.gz	IJLZPCCPXSAWTO-NSHDSACASA-N	1	1	321.381	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000274880642	212004099	/nfs/dbraw/zinc/00/40/99/212004099.db2.gz	IHIYNZCBZHDCGN-SNVBAGLBSA-N	1	1	308.338	1.300	20	5		DDBDMO
C[N@H+](CCOCCO)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000282795907	217256803	/nfs/dbraw/zinc/25/68/03/217256803.db2.gz	ROEAEQNGFDOAFQ-UHFFFAOYSA-N	1	1	320.292	1.637	20	5		DDBDMO
C[N@@H+](CCOCCO)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000282795907	217256806	/nfs/dbraw/zinc/25/68/06/217256806.db2.gz	ROEAEQNGFDOAFQ-UHFFFAOYSA-N	1	1	320.292	1.637	20	5		DDBDMO
CN(CC(=O)NC[C@@H]1CCC[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000266336294	205276976	/nfs/dbraw/zinc/27/69/76/205276976.db2.gz	UCKVFLUBEUGLAV-LBPRGKRZSA-N	1	1	306.366	1.241	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1cccs1	ZINC000158986728	248311192	/nfs/dbraw/zinc/31/11/92/248311192.db2.gz	VOYFWODXDZUECJ-MRVPVSSYSA-N	1	1	309.351	1.412	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](O)C1	ZINC000041886251	183223527	/nfs/dbraw/zinc/22/35/27/183223527.db2.gz	SKILIFDVMAGIDN-LBPRGKRZSA-N	1	1	323.349	1.389	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@@H+]1CC=CCC1	ZINC000338710460	250100499	/nfs/dbraw/zinc/10/04/99/250100499.db2.gz	HWVOKRUWAAQTMM-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000338769348	250128779	/nfs/dbraw/zinc/12/87/79/250128779.db2.gz	WLDLKYLRCBMEPZ-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000106394835	194206677	/nfs/dbraw/zinc/20/66/77/194206677.db2.gz	XBYINHISQRDQHW-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
COCC[N@H+](C)CCNCc1ccc([N+](=O)[O-])cc1Cl	ZINC000061378260	184169810	/nfs/dbraw/zinc/16/98/10/184169810.db2.gz	WNMRUHQSGIXMHA-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
COCC[N@@H+](C)CCNCc1ccc([N+](=O)[O-])cc1Cl	ZINC000061378260	184169811	/nfs/dbraw/zinc/16/98/11/184169811.db2.gz	WNMRUHQSGIXMHA-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
COc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000418996555	532958692	/nfs/dbraw/zinc/95/86/92/532958692.db2.gz	FJSNLTQUGGGNER-VXGBXAGGSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](CCO)CC1CC1	ZINC000352458684	285063970	/nfs/dbraw/zinc/06/39/70/285063970.db2.gz	NSMWTTMUZFJJFM-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@H+]1CCCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000272964683	210349600	/nfs/dbraw/zinc/34/96/00/210349600.db2.gz	UBHVTBYMRUXXHE-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2C[NH2+]C[C@@H]2C1	ZINC000289540716	221052643	/nfs/dbraw/zinc/05/26/43/221052643.db2.gz	BQXURDDJKNKXQN-NXEZZACHSA-N	1	1	315.333	1.153	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000419317799	533220901	/nfs/dbraw/zinc/22/09/01/533220901.db2.gz	APMDUYWKCNIWBP-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
CN(CC[NH+](C)C)C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC000295001701	224371605	/nfs/dbraw/zinc/37/16/05/224371605.db2.gz	CBUXYSKBTNWKEP-UHFFFAOYSA-N	1	1	317.349	1.619	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000569121938	304337954	/nfs/dbraw/zinc/33/79/54/304337954.db2.gz	APGVJMOLRVBMGB-NSHDSACASA-N	1	1	314.292	1.316	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000569162471	304339294	/nfs/dbraw/zinc/33/92/94/304339294.db2.gz	UGNJRLYFKNZICO-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000569162471	304339296	/nfs/dbraw/zinc/33/92/96/304339296.db2.gz	UGNJRLYFKNZICO-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC000579748978	422827338	/nfs/dbraw/zinc/82/73/38/422827338.db2.gz	IRQNMSJGVRAZMA-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC000579748978	422827345	/nfs/dbraw/zinc/82/73/45/422827345.db2.gz	IRQNMSJGVRAZMA-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC000579748978	422827350	/nfs/dbraw/zinc/82/73/50/422827350.db2.gz	IRQNMSJGVRAZMA-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000075953149	406946986	/nfs/dbraw/zinc/94/69/86/406946986.db2.gz	VHEQOXDIMDCIKB-AWEZNQCLSA-N	1	1	324.377	1.959	20	5		DDBDMO
C[NH+]1CCN(c2ncc(Br)cc2[N+](=O)[O-])CC1	ZINC000041511817	407007724	/nfs/dbraw/zinc/00/77/24/407007724.db2.gz	ZKEMRVOTQLCKMS-UHFFFAOYSA-N	1	1	301.144	1.504	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](n2cccn2)C1	ZINC000090524933	407168740	/nfs/dbraw/zinc/16/87/40/407168740.db2.gz	OUDCIMBOEZKJMN-CYBMUJFWSA-N	1	1	317.349	1.290	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000103284066	407336104	/nfs/dbraw/zinc/33/61/04/407336104.db2.gz	ILKCSPUSYCBXHT-NEPJUHHUSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000124632753	407364521	/nfs/dbraw/zinc/36/45/21/407364521.db2.gz	SKFHYYDRQXYOON-GDBMZVCRSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000124632753	407364522	/nfs/dbraw/zinc/36/45/22/407364522.db2.gz	SKFHYYDRQXYOON-GDBMZVCRSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000124772886	407369028	/nfs/dbraw/zinc/36/90/28/407369028.db2.gz	CBPKZDJZEXYWCN-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000124772886	407369030	/nfs/dbraw/zinc/36/90/30/407369030.db2.gz	CBPKZDJZEXYWCN-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000108343036	407384831	/nfs/dbraw/zinc/38/48/31/407384831.db2.gz	NWWYVTHUXKMEJE-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000108343036	407384832	/nfs/dbraw/zinc/38/48/32/407384832.db2.gz	NWWYVTHUXKMEJE-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000108343036	407384834	/nfs/dbraw/zinc/38/48/34/407384834.db2.gz	NWWYVTHUXKMEJE-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000111635721	407413053	/nfs/dbraw/zinc/41/30/53/407413053.db2.gz	ZZFBIHIIUYUCKB-SNVBAGLBSA-N	1	1	308.338	1.300	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000270968071	407442549	/nfs/dbraw/zinc/44/25/49/407442549.db2.gz	VTOGBQOVBXQCDG-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@H]1CN(c2nccc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000115517062	407690213	/nfs/dbraw/zinc/69/02/13/407690213.db2.gz	LHWXDKDBNPZDAD-CHWSQXEVSA-N	1	1	308.382	1.580	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2nccc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000131924625	407759486	/nfs/dbraw/zinc/75/94/86/407759486.db2.gz	JUINSWVWQSQZOM-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000117285333	407823728	/nfs/dbraw/zinc/82/37/28/407823728.db2.gz	DYAHDCAULVLIDC-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000117285333	407823733	/nfs/dbraw/zinc/82/37/33/407823733.db2.gz	DYAHDCAULVLIDC-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2nn(C)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000272467534	407935669	/nfs/dbraw/zinc/93/56/69/407935669.db2.gz	WIABJMJPDXLUSI-GHMZBOCLSA-N	1	1	309.370	1.131	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000272570170	407987870	/nfs/dbraw/zinc/98/78/70/407987870.db2.gz	FTCDKOMRRXAYDK-WFASDCNBSA-N	1	1	319.361	1.526	20	5		DDBDMO
COCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2COC)CC1	ZINC000174968322	408017780	/nfs/dbraw/zinc/01/77/80/408017780.db2.gz	ISKMXEVKISLVMG-UHFFFAOYSA-N	1	1	309.366	1.510	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000119487787	408080835	/nfs/dbraw/zinc/08/08/35/408080835.db2.gz	IQVNTMZNSQLZAO-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CCC[N@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000119487787	408080842	/nfs/dbraw/zinc/08/08/42/408080842.db2.gz	IQVNTMZNSQLZAO-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000136858162	408130497	/nfs/dbraw/zinc/13/04/97/408130497.db2.gz	FWCFWOSESWZJHA-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(CO)CC1	ZINC000190009714	408145720	/nfs/dbraw/zinc/14/57/20/408145720.db2.gz	AHZFOKCVOXAIOA-GFCCVEGCSA-N	1	1	310.350	1.039	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CCCC1	ZINC000269269697	408243670	/nfs/dbraw/zinc/24/36/70/408243670.db2.gz	FPPLAXJCXJETCL-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CCCC1	ZINC000269269697	408243673	/nfs/dbraw/zinc/24/36/73/408243673.db2.gz	FPPLAXJCXJETCL-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000269456560	408314995	/nfs/dbraw/zinc/31/49/95/408314995.db2.gz	HCSVNYUIBCJXFH-ZDUSSCGKSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000269333249	408272551	/nfs/dbraw/zinc/27/25/51/408272551.db2.gz	ATGZKHRKRVHBSG-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000269333249	408272556	/nfs/dbraw/zinc/27/25/56/408272556.db2.gz	ATGZKHRKRVHBSG-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000269333249	408272560	/nfs/dbraw/zinc/27/25/60/408272560.db2.gz	ATGZKHRKRVHBSG-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000183182425	408345683	/nfs/dbraw/zinc/34/56/83/408345683.db2.gz	UVZJBTZZAIWLEJ-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1(CO)CCOCC1	ZINC000191017778	408358803	/nfs/dbraw/zinc/35/88/03/408358803.db2.gz	SFTHUNTZTFFJHN-AWEZNQCLSA-N	1	1	310.350	1.102	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000173466646	162340312	/nfs/dbraw/zinc/34/03/12/162340312.db2.gz	ARMXDQKYESMEPD-GFCCVEGCSA-N	1	1	302.338	1.410	20	5		DDBDMO
COC(=O)[C@H]1[C@H]2CCC[C@@H]2C[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192059	408386293	/nfs/dbraw/zinc/38/62/93/408386293.db2.gz	WVPGHUACUMNUMJ-NTZNESFSSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192059	408386296	/nfs/dbraw/zinc/38/62/96/408386296.db2.gz	WVPGHUACUMNUMJ-NTZNESFSSA-N	1	1	308.338	1.065	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000264544052	408529722	/nfs/dbraw/zinc/52/97/22/408529722.db2.gz	OFBOKHXSEIYRIR-CYBMUJFWSA-N	1	1	307.350	1.354	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000270570519	408583695	/nfs/dbraw/zinc/58/36/95/408583695.db2.gz	VFZFKUCQWUZXRQ-UHFFFAOYSA-N	1	1	306.366	1.484	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000192464469	408591382	/nfs/dbraw/zinc/59/13/82/408591382.db2.gz	PFQUEZNWFWUFMR-OKILXGFUSA-N	1	1	303.362	1.466	20	5		DDBDMO
CC(C)OC(=O)C[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000184498499	408629758	/nfs/dbraw/zinc/62/97/58/408629758.db2.gz	OCSHAEYGQLDDFB-CYBMUJFWSA-N	1	1	324.381	1.845	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC000275857797	408698478	/nfs/dbraw/zinc/69/84/78/408698478.db2.gz	LYYKFNWLFOSRPI-JOCQHMNTSA-N	1	1	307.350	1.429	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000185215778	408781615	/nfs/dbraw/zinc/78/16/15/408781615.db2.gz	UYTKYHJSMOFMBR-JTQLQIEISA-N	1	1	307.354	1.128	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000281322777	408881120	/nfs/dbraw/zinc/88/11/20/408881120.db2.gz	YECQAMMQYQKFMN-OAHLLOKOSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000291730409	408913974	/nfs/dbraw/zinc/91/39/74/408913974.db2.gz	JNQUXPVYRWGIOO-CABCVRRESA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1C	ZINC000277482210	408948772	/nfs/dbraw/zinc/94/87/72/408948772.db2.gz	CPGBAXREHGDQDY-WDEREUQCSA-N	1	1	319.365	1.362	20	5		DDBDMO
COc1cc(N2C[C@@H]([NH+]3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000286288211	408957016	/nfs/dbraw/zinc/95/70/16/408957016.db2.gz	INMOJJBZXSBDOX-OCCSQVGLSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[N@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000281964005	408962006	/nfs/dbraw/zinc/96/20/06/408962006.db2.gz	VGMNONMUPJCWGO-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
C[N@@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000281964005	408962009	/nfs/dbraw/zinc/96/20/09/408962009.db2.gz	VGMNONMUPJCWGO-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCCO1	ZINC000277619718	408978580	/nfs/dbraw/zinc/97/85/80/408978580.db2.gz	QWGAUCABUBPVER-LLVKDONJSA-N	1	1	310.354	1.154	20	5		DDBDMO
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCn1cc([N+](=O)[O-])ccc1=O	ZINC000286435533	408985861	/nfs/dbraw/zinc/98/58/61/408985861.db2.gz	JBFVOYUNKKICJH-XNHOIOAFSA-N	1	1	319.361	1.112	20	5		DDBDMO
Cc1c(C(=O)N2CC[C@@H]([N@@H+](C)CCO)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000293605947	409146304	/nfs/dbraw/zinc/14/63/04/409146304.db2.gz	HELXVIAYJIZCAN-IUODEOHRSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355636	409297948	/nfs/dbraw/zinc/29/79/48/409297948.db2.gz	INBBEKHMKYFMFE-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355636	409297953	/nfs/dbraw/zinc/29/79/53/409297953.db2.gz	INBBEKHMKYFMFE-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
CO[C@H]1COC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000290099549	409300992	/nfs/dbraw/zinc/30/09/92/409300992.db2.gz	IPEOVBCZXJUPLX-ZFWWWQNUSA-N	1	1	310.350	1.885	20	5		DDBDMO
C[C@H](CO)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1CCC1	ZINC000280606606	409377893	/nfs/dbraw/zinc/37/78/93/409377893.db2.gz	VOJRYVKWANPIQF-LLVKDONJSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280507076	409332257	/nfs/dbraw/zinc/33/22/57/409332257.db2.gz	NINIUUHUPPEYNQ-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280507076	409332262	/nfs/dbraw/zinc/33/22/62/409332262.db2.gz	NINIUUHUPPEYNQ-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CN1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C1CC1	ZINC000290493134	409421506	/nfs/dbraw/zinc/42/15/06/409421506.db2.gz	ABHJPSJNCPVFDR-CQSZACIVSA-N	1	1	321.377	1.113	20	5		DDBDMO
CS[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296120948	409437229	/nfs/dbraw/zinc/43/72/29/409437229.db2.gz	FNKLHGLBFALPDJ-CYBMUJFWSA-N	1	1	309.391	1.995	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296120948	409437238	/nfs/dbraw/zinc/43/72/38/409437238.db2.gz	FNKLHGLBFALPDJ-CYBMUJFWSA-N	1	1	309.391	1.995	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F	ZINC000295379009	409456726	/nfs/dbraw/zinc/45/67/26/409456726.db2.gz	XLGZSNQKOKEZQW-UHFFFAOYSA-N	1	1	312.345	1.481	20	5		DDBDMO
C[C@@H](CCC[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000313633754	164010614	/nfs/dbraw/zinc/01/06/14/164010614.db2.gz	HJXPKXZBZKJZHS-QMMMGPOBSA-N	1	1	305.331	1.140	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000317286344	164026965	/nfs/dbraw/zinc/02/69/65/164026965.db2.gz	KMXJZRUAOOBCEG-QWRGUYRKSA-N	1	1	306.366	1.849	20	5		DDBDMO
CN1CC[NH+](CCNc2ccnc3c2cccc3[N+](=O)[O-])CC1	ZINC000322031388	164046299	/nfs/dbraw/zinc/04/62/99/164046299.db2.gz	KWVNEHVLSVFOBR-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000295387692	409462360	/nfs/dbraw/zinc/46/23/60/409462360.db2.gz	BCBKJRAIKRZMMJ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000295387692	409462365	/nfs/dbraw/zinc/46/23/65/409462365.db2.gz	BCBKJRAIKRZMMJ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296233472	409473501	/nfs/dbraw/zinc/47/35/01/409473501.db2.gz	KTIWJEMKZCPREF-NWDGAFQWSA-N	1	1	312.391	1.772	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)n1	ZINC000331452804	409524434	/nfs/dbraw/zinc/52/44/34/409524434.db2.gz	XUBURZRITRORJU-NSHDSACASA-N	1	1	321.381	1.558	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccccc2)c1	ZINC000304339056	409611109	/nfs/dbraw/zinc/61/11/09/409611109.db2.gz	PGALAKOWPHARFT-JKSUJKDBSA-N	1	1	316.361	1.989	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471793	409658624	/nfs/dbraw/zinc/65/86/24/409658624.db2.gz	LMBGWJCXWGIIQI-BXUZGUMPSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471793	409658633	/nfs/dbraw/zinc/65/86/33/409658633.db2.gz	LMBGWJCXWGIIQI-BXUZGUMPSA-N	1	1	307.350	1.493	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@@H]2C1	ZINC000296854760	409669456	/nfs/dbraw/zinc/66/94/56/409669456.db2.gz	UMCMRHATTRNQIO-ZIAGYGMSSA-N	1	1	317.349	1.380	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC000356979644	409763727	/nfs/dbraw/zinc/76/37/27/409763727.db2.gz	DMPQLUPTUSTFHT-STQMWFEESA-N	1	1	320.393	1.866	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)c1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000342788902	409907629	/nfs/dbraw/zinc/90/76/29/409907629.db2.gz	NYJOYXYCWNNUIR-LLVKDONJSA-N	1	1	306.366	1.614	20	5		DDBDMO
Cc1cc(N2CC[NH+](Cc3cnn(C)c3)CC2)ccc1[N+](=O)[O-]	ZINC000338285671	409875717	/nfs/dbraw/zinc/87/57/17/409875717.db2.gz	UXNORULHRRIJDF-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
C[C@@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000357308665	409967842	/nfs/dbraw/zinc/96/78/42/409967842.db2.gz	WQTOKLLVZUTBRL-MNOVXSKESA-N	1	1	321.381	1.764	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000339393606	410153290	/nfs/dbraw/zinc/15/32/90/410153290.db2.gz	KQKNBXFHDKXJQD-CVEARBPZSA-N	1	1	321.377	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000339393606	410153296	/nfs/dbraw/zinc/15/32/96/410153296.db2.gz	KQKNBXFHDKXJQD-CVEARBPZSA-N	1	1	321.377	1.595	20	5		DDBDMO
CCCC[N@@H+](CCO)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000298664502	410336945	/nfs/dbraw/zinc/33/69/45/410336945.db2.gz	GDRARNLCCGADTO-CQSZACIVSA-N	1	1	312.366	1.429	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000351959192	410372538	/nfs/dbraw/zinc/37/25/38/410372538.db2.gz	NVEPXUQRWPCOJR-SKDRFNHKSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000351959192	410372545	/nfs/dbraw/zinc/37/25/45/410372545.db2.gz	NVEPXUQRWPCOJR-SKDRFNHKSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358407959	410461558	/nfs/dbraw/zinc/46/15/58/410461558.db2.gz	GCOLWDDGDUCFRG-MEBBXXQBSA-N	1	1	321.352	1.875	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000343401965	410424532	/nfs/dbraw/zinc/42/45/32/410424532.db2.gz	VZCYOANGYJWCQX-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCSC[C@@H]2CCO)cc1	ZINC000347365396	410498644	/nfs/dbraw/zinc/49/86/44/410498644.db2.gz	HHYXYJZJVPNADN-ZDUSSCGKSA-N	1	1	312.391	1.773	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C(N)=O)O[C@@H](C)C1	ZINC000347358667	410493919	/nfs/dbraw/zinc/49/39/19/410493919.db2.gz	LHFYVTZGTRSOBY-USXITJPFSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C(N)=O)O[C@@H](C)C1	ZINC000347358667	410493927	/nfs/dbraw/zinc/49/39/27/410493927.db2.gz	LHFYVTZGTRSOBY-USXITJPFSA-N	1	1	319.361	1.573	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2cc(F)cc([N+](=O)[O-])c2)CC1	ZINC000352191210	410535865	/nfs/dbraw/zinc/53/58/65/410535865.db2.gz	SQYRFZYWKZHZOP-UHFFFAOYSA-N	1	1	324.356	1.700	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343612222	410571655	/nfs/dbraw/zinc/57/16/55/410571655.db2.gz	VNXXGSLPKKRKBI-BXUZGUMPSA-N	1	1	306.366	1.877	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1OC)C1CC1	ZINC000355631193	410616708	/nfs/dbraw/zinc/61/67/08/410616708.db2.gz	DKWZRWXHBPOJMQ-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1(CCO)CCOCC1	ZINC000352998533	410725397	/nfs/dbraw/zinc/72/53/97/410725397.db2.gz	RSFITBVQCOPNBF-UHFFFAOYSA-N	1	1	324.377	1.837	20	5		DDBDMO
C[C@@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1	ZINC000330560761	410779063	/nfs/dbraw/zinc/77/90/63/410779063.db2.gz	HVPLTSJTTGJUNV-MNOVXSKESA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000330579884	410794375	/nfs/dbraw/zinc/79/43/75/410794375.db2.gz	IIXFFANDUBLSPZ-RYUDHWBXSA-N	1	1	307.350	1.525	20	5		DDBDMO
CC[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)N1CCCCCC1	ZINC000353183227	410835654	/nfs/dbraw/zinc/83/56/54/410835654.db2.gz	PGJXWLXSMUTAPX-UHFFFAOYSA-N	1	1	323.397	1.516	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)N1CCCCCC1	ZINC000353183227	410835661	/nfs/dbraw/zinc/83/56/61/410835661.db2.gz	PGJXWLXSMUTAPX-UHFFFAOYSA-N	1	1	323.397	1.516	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)[C@H](C)C1	ZINC000356284385	410944181	/nfs/dbraw/zinc/94/41/81/410944181.db2.gz	PBYBKJYFDVZRCO-NEPJUHHUSA-N	1	1	308.382	1.736	20	5		DDBDMO
Cn1ccc(N2CC[C@@H]([NH2+]Cc3csc([N+](=O)[O-])c3)C2=O)n1	ZINC000360091407	411040212	/nfs/dbraw/zinc/04/02/12/411040212.db2.gz	CYCVJEIZYCGLCL-SNVBAGLBSA-N	1	1	321.362	1.285	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](CN3CCOCC3)C2)cc1	ZINC000129539778	196056202	/nfs/dbraw/zinc/05/62/02/196056202.db2.gz	WDNFHIONDOKXGO-INIZCTEOSA-N	1	1	319.405	1.791	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)C1	ZINC000488756840	416560752	/nfs/dbraw/zinc/56/07/52/416560752.db2.gz	WXUHWAPJSSCJHP-AXFHLTTASA-N	1	1	306.370	1.134	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000366761188	418514019	/nfs/dbraw/zinc/51/40/19/418514019.db2.gz	RIFXXBQQBDPOCS-LLVKDONJSA-N	1	1	300.322	1.566	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000366761188	418514023	/nfs/dbraw/zinc/51/40/23/418514023.db2.gz	RIFXXBQQBDPOCS-LLVKDONJSA-N	1	1	300.322	1.566	20	5		DDBDMO
O=C([C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1)N1CCCC1	ZINC000360851939	418533402	/nfs/dbraw/zinc/53/34/02/418533402.db2.gz	SPGJPYRQAZWEFV-CQSZACIVSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=C([C@H]1CCCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1)N1CCCC1	ZINC000360851939	418533405	/nfs/dbraw/zinc/53/34/05/418533405.db2.gz	SPGJPYRQAZWEFV-CQSZACIVSA-N	1	1	321.381	1.268	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000374821517	418566127	/nfs/dbraw/zinc/56/61/27/418566127.db2.gz	FRFKWPNRJQVBRI-JTQLQIEISA-N	1	1	322.340	1.626	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)n1	ZINC000191632772	222106466	/nfs/dbraw/zinc/10/64/66/222106466.db2.gz	PDMPXYUYXRYKGZ-WDEREUQCSA-N	1	1	309.370	1.223	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C[N@@H+](C)CC)C2)n1	ZINC000191830405	222109617	/nfs/dbraw/zinc/10/96/17/222109617.db2.gz	WQTYDVDRZAXOKV-LLVKDONJSA-N	1	1	309.370	1.225	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]21	ZINC000375015953	418588912	/nfs/dbraw/zinc/58/89/12/418588912.db2.gz	DHABDNAWXQEBJG-IAQYHMDHSA-N	1	1	318.377	1.220	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]21	ZINC000375052761	418595814	/nfs/dbraw/zinc/59/58/14/418595814.db2.gz	ZLZVUUFUZYGOEC-IINYFYTJSA-N	1	1	304.350	1.224	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNc2cc[nH+]c(N3CCOCC3)n2)cc1	ZINC000352385622	418644736	/nfs/dbraw/zinc/64/47/36/418644736.db2.gz	KITMOLGTVBEIMM-UHFFFAOYSA-N	1	1	315.333	1.834	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+]1C	ZINC000342362607	418627781	/nfs/dbraw/zinc/62/77/81/418627781.db2.gz	QRSDBNNVDMDYND-NXEZZACHSA-N	1	1	317.349	2.138	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3cc(F)ccc3[N+](=O)[O-])CC2)C1	ZINC000365100676	418837556	/nfs/dbraw/zinc/83/75/56/418837556.db2.gz	PPFUCTDQZMEIDH-CQSZACIVSA-N	1	1	322.384	1.950	20	5		DDBDMO
CCN(CC)C(=O)[C@@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280824	418851127	/nfs/dbraw/zinc/85/11/27/418851127.db2.gz	GGUXTZHUNZNGBI-OLZOCXBDSA-N	1	1	323.397	1.685	20	5		DDBDMO
CCN(CC)C(=O)[C@@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280824	418851129	/nfs/dbraw/zinc/85/11/29/418851129.db2.gz	GGUXTZHUNZNGBI-OLZOCXBDSA-N	1	1	323.397	1.685	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421002940	419436639	/nfs/dbraw/zinc/43/66/39/419436639.db2.gz	BYHULHAPJANSOQ-XBFCOCLRSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000421033336	419462006	/nfs/dbraw/zinc/46/20/06/419462006.db2.gz	XPFPGIRYVWCYKZ-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000421033336	419462009	/nfs/dbraw/zinc/46/20/09/419462009.db2.gz	XPFPGIRYVWCYKZ-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+]1CC=C(C)CC1	ZINC000427074819	419590431	/nfs/dbraw/zinc/59/04/31/419590431.db2.gz	QHBMZTFDJSHHTF-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000421771474	419721508	/nfs/dbraw/zinc/72/15/08/419721508.db2.gz	WYWOSGIIOWRLGR-CYBMUJFWSA-N	1	1	320.393	1.187	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCC[N@H+]1C	ZINC000299263966	229016200	/nfs/dbraw/zinc/01/62/00/229016200.db2.gz	WMZWNTVRDGMPQO-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H]1CCCSC1	ZINC000433189202	229169541	/nfs/dbraw/zinc/16/95/41/229169541.db2.gz	DJOVJRQYTUDSDG-GFCCVEGCSA-N	1	1	314.411	1.635	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(N)=O	ZINC000429168398	419980300	/nfs/dbraw/zinc/98/03/00/419980300.db2.gz	PESBKGIIIQBHGU-UHFFFAOYSA-N	1	1	322.365	1.429	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC([NH3+])CC1	ZINC000430671026	420174378	/nfs/dbraw/zinc/17/43/78/420174378.db2.gz	WZMMDBBJGNIIPB-UHFFFAOYSA-N	1	1	322.365	1.355	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1CN	ZINC000420283565	420180762	/nfs/dbraw/zinc/18/07/62/420180762.db2.gz	CDIYZEASHPRQLL-SWLSCSKDSA-N	1	1	320.393	1.983	20	5		DDBDMO
O=C(CC[N@H+]1C[C@H]2CCC[C@@H](C1)N2)Nc1ccc([N+](=O)[O-])cc1	ZINC000420346287	420224716	/nfs/dbraw/zinc/22/47/16/420224716.db2.gz	CQFARUXPSWRLQJ-OKILXGFUSA-N	1	1	318.377	1.750	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2CCC[C@@H](C1)N2)Nc1ccc([N+](=O)[O-])cc1	ZINC000420346287	420224719	/nfs/dbraw/zinc/22/47/19/420224719.db2.gz	CQFARUXPSWRLQJ-OKILXGFUSA-N	1	1	318.377	1.750	20	5		DDBDMO
COCCC[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444686193	230121715	/nfs/dbraw/zinc/12/17/15/230121715.db2.gz	BWJUPBSFCTUHHA-UHFFFAOYSA-N	1	1	308.338	1.302	20	5		DDBDMO
COCCC[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444686193	230121718	/nfs/dbraw/zinc/12/17/18/230121718.db2.gz	BWJUPBSFCTUHHA-UHFFFAOYSA-N	1	1	308.338	1.302	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC000302178432	230144837	/nfs/dbraw/zinc/14/48/37/230144837.db2.gz	YEIRZYQSIOZECM-UHFFFAOYSA-N	1	1	302.338	1.577	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000457093337	420609395	/nfs/dbraw/zinc/60/93/95/420609395.db2.gz	NYPGJWSLKWAJLB-LLVKDONJSA-N	1	1	308.338	1.250	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCCCC1	ZINC000449095514	420948139	/nfs/dbraw/zinc/94/81/39/420948139.db2.gz	ZBGKHKQLOLBYHY-ZBFHGGJFSA-N	1	1	321.421	1.962	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCCC1	ZINC000449093013	420948423	/nfs/dbraw/zinc/94/84/23/420948423.db2.gz	NUYUDQLDHRTGPJ-ZFWWWQNUSA-N	1	1	307.394	1.572	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])NC[C@H](O)C[NH+]1CCCC1	ZINC000449093013	420948427	/nfs/dbraw/zinc/94/84/27/420948427.db2.gz	NUYUDQLDHRTGPJ-ZFWWWQNUSA-N	1	1	307.394	1.572	20	5		DDBDMO
[NH3+]CC[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(F)F	ZINC000449612553	421038467	/nfs/dbraw/zinc/03/84/67/421038467.db2.gz	MXCUSGYKMXGTCJ-VIFPVBQESA-N	1	1	313.264	1.183	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C[C@@H]21	ZINC000456167595	421111974	/nfs/dbraw/zinc/11/19/74/421111974.db2.gz	NFZCZLLVQOBGHK-RISCZKNCSA-N	1	1	323.780	1.953	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488767293	421114441	/nfs/dbraw/zinc/11/44/41/421114441.db2.gz	VTVTVGZCRIXWSI-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488767293	421114444	/nfs/dbraw/zinc/11/44/44/421114444.db2.gz	VTVTVGZCRIXWSI-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COCC[N@@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000490043248	421187404	/nfs/dbraw/zinc/18/74/04/421187404.db2.gz	BFCPJTYOEJVIHJ-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450442790	421198505	/nfs/dbraw/zinc/19/85/05/421198505.db2.gz	YOSLQIFGEUMMFE-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000525670436	421292972	/nfs/dbraw/zinc/29/29/72/421292972.db2.gz	SRLYMIRLCGSBTC-CQSZACIVSA-N	1	1	305.378	1.984	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000547756409	421363394	/nfs/dbraw/zinc/36/33/94/421363394.db2.gz	NXUNFNWRTOLOIB-JTQLQIEISA-N	1	1	309.370	1.558	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)cc1C	ZINC000507300169	421427163	/nfs/dbraw/zinc/42/71/63/421427163.db2.gz	OIBYYFXMYWCXLU-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)cc1C	ZINC000507300169	421427166	/nfs/dbraw/zinc/42/71/66/421427166.db2.gz	OIBYYFXMYWCXLU-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Nc1nccc(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000514610809	421440607	/nfs/dbraw/zinc/44/06/07/421440607.db2.gz	ACZKGXLGTSFFTK-JTQLQIEISA-N	1	1	319.365	1.319	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)C(C)(C)C1	ZINC000550657231	421520901	/nfs/dbraw/zinc/52/09/01/421520901.db2.gz	NUPLIUBDDAHHOH-LBPRGKRZSA-N	1	1	320.393	1.948	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777272	421629669	/nfs/dbraw/zinc/62/96/69/421629669.db2.gz	DWYZWLZQBDZSHE-OCCSQVGLSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](CO)[C@@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777272	421629674	/nfs/dbraw/zinc/62/96/74/421629674.db2.gz	DWYZWLZQBDZSHE-OCCSQVGLSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000554868329	421663938	/nfs/dbraw/zinc/66/39/38/421663938.db2.gz	FBHGZEISKJLLHI-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C2CCOCC2)c([N+](=O)[O-])c1	ZINC000533447841	421674376	/nfs/dbraw/zinc/67/43/76/421674376.db2.gz	ZOTWHIWSDADQMG-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cccc1[N+](=O)[O-]	ZINC000573135729	421927705	/nfs/dbraw/zinc/92/77/05/421927705.db2.gz	DVHVWZOLQDVEBN-NWDGAFQWSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000578587014	422602300	/nfs/dbraw/zinc/60/23/00/422602300.db2.gz	QWSQTLNOEYRZNS-NSHDSACASA-N	1	1	305.334	1.268	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1nc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000342162187	271324920	/nfs/dbraw/zinc/32/49/20/271324920.db2.gz	NTYQWADGWSLFJQ-UHFFFAOYSA-N	1	1	310.354	1.920	20	5		DDBDMO
C[C@@H]1C[NH2+]CC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000262878592	274377212	/nfs/dbraw/zinc/37/72/12/274377212.db2.gz	VRYIFOJOOFWTRW-KCJUWKMLSA-N	1	1	303.322	1.199	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+](CCO)CC2)c([N+](=O)[O-])c1	ZINC000171506810	275035999	/nfs/dbraw/zinc/03/59/99/275035999.db2.gz	NCIXJWJKBJTSEY-UHFFFAOYSA-N	1	1	310.310	1.007	20	5		DDBDMO
CC(C)([NH2+]CC(=O)NC1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000429233149	275552448	/nfs/dbraw/zinc/55/24/48/275552448.db2.gz	VVLWHVDWMABDQX-UHFFFAOYSA-N	1	1	321.377	1.715	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000447685988	278290123	/nfs/dbraw/zinc/29/01/23/278290123.db2.gz	OGRWHYLGZOVMER-NSHDSACASA-N	1	1	319.365	1.364	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000354005116	298336788	/nfs/dbraw/zinc/33/67/88/298336788.db2.gz	FBRLTGKWFHQBBU-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC(C)(C(=O)NCC[NH+]1CCC1)c1ccc([N+](=O)[O-])cc1F	ZINC000357995028	299044288	/nfs/dbraw/zinc/04/42/88/299044288.db2.gz	TVHGQIJSZMKNHV-UHFFFAOYSA-N	1	1	309.341	1.833	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)Nc1ccc([N+](=O)[O-])cc1	ZINC000363094667	300209668	/nfs/dbraw/zinc/20/96/68/300209668.db2.gz	GGYUPMQZFODIRT-ZIAGYGMSSA-N	1	1	320.349	1.580	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000363103383	300211540	/nfs/dbraw/zinc/21/15/40/300211540.db2.gz	HVEBEGFFEYNWLO-ZIAGYGMSSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000363324524	300251826	/nfs/dbraw/zinc/25/18/26/300251826.db2.gz	PQZHIGBGNIIQGF-UONOGXRCSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCOCC3(CCCC3)C2)c1	ZINC000364322097	300376057	/nfs/dbraw/zinc/37/60/57/300376057.db2.gz	DOKOMUQWSWULDN-AWEZNQCLSA-N	1	1	324.381	1.045	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000364325929	300376791	/nfs/dbraw/zinc/37/67/91/300376791.db2.gz	SJTXKJWATKGJJN-CYBMUJFWSA-N	1	1	321.381	1.439	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000364433727	300396107	/nfs/dbraw/zinc/39/61/07/300396107.db2.gz	VLOSITAVPPYYMG-HUUCEWRRSA-N	1	1	319.361	1.266	20	5		DDBDMO
O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000367995014	300929620	/nfs/dbraw/zinc/92/96/20/300929620.db2.gz	XGEZXLKBVLNCAB-JTQLQIEISA-N	1	1	319.695	1.927	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@H]2O1	ZINC000368521639	301047833	/nfs/dbraw/zinc/04/78/33/301047833.db2.gz	HJUXUHPKLRDUOJ-MGPQQGTHSA-N	1	1	324.381	1.184	20	5		DDBDMO
COc1ccc(CN2CCC[N@H+]([C@H](C)CO)CC2)cc1[N+](=O)[O-]	ZINC000368953015	301109648	/nfs/dbraw/zinc/10/96/48/301109648.db2.gz	ZGYQZQFTUINXQY-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000368952731	301109655	/nfs/dbraw/zinc/10/96/55/301109655.db2.gz	XEMHFXPZGJHAJE-CQDKDKBSSA-N	1	1	319.361	1.559	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CC[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369685061	301212778	/nfs/dbraw/zinc/21/27/78/301212778.db2.gz	ZJRIUZJZJFHHPP-ZDUSSCGKSA-N	1	1	307.398	1.913	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369685061	301212781	/nfs/dbraw/zinc/21/27/81/301212781.db2.gz	ZJRIUZJZJFHHPP-ZDUSSCGKSA-N	1	1	307.398	1.913	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369685061	301212783	/nfs/dbraw/zinc/21/27/83/301212783.db2.gz	ZJRIUZJZJFHHPP-ZDUSSCGKSA-N	1	1	307.398	1.913	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3CC[NH2+][C@@H]3C2)c1[N+](=O)[O-]	ZINC000370166707	301287273	/nfs/dbraw/zinc/28/72/73/301287273.db2.gz	ZQLKEXBMJOHHLD-GXSJLCMTSA-N	1	1	307.354	1.094	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1c([N+](=O)[O-])ncn1C	ZINC000376032860	302028022	/nfs/dbraw/zinc/02/80/22/302028022.db2.gz	AKOLYITZDHWXEC-GFCCVEGCSA-N	1	1	323.397	1.013	20	5		DDBDMO
CC(C)(CC[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000397192191	302352552	/nfs/dbraw/zinc/35/25/52/302352552.db2.gz	PLJBPJUJMADEMJ-UHFFFAOYSA-N	1	1	305.331	1.140	20	5		DDBDMO
O=[N+]([O-])c1cnccc1NCC1([NH+]2CCOCC2)CCCCC1	ZINC000357051217	306868273	/nfs/dbraw/zinc/86/82/73/306868273.db2.gz	PALNBRUCRJLFOG-UHFFFAOYSA-N	1	1	320.393	1.859	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000547735110	303550178	/nfs/dbraw/zinc/55/01/78/303550178.db2.gz	OVPHHJPNUIXCGL-UHFFFAOYSA-N	1	1	301.306	1.280	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]12	ZINC000366316045	307070660	/nfs/dbraw/zinc/07/06/60/307070660.db2.gz	TXZBQYXNATVWHL-WDEREUQCSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]12	ZINC000366316045	307070661	/nfs/dbraw/zinc/07/06/61/307070661.db2.gz	TXZBQYXNATVWHL-WDEREUQCSA-N	1	1	323.736	1.343	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000366584302	307076763	/nfs/dbraw/zinc/07/67/63/307076763.db2.gz	FIBVPLVQBQOHHL-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000366584302	307076764	/nfs/dbraw/zinc/07/67/64/307076764.db2.gz	FIBVPLVQBQOHHL-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)[C@@H]2C1	ZINC000378507650	307290570	/nfs/dbraw/zinc/29/05/70/307290570.db2.gz	WPDYHAQXBHKEEU-WDEREUQCSA-N	1	1	302.338	1.168	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000571819529	308203008	/nfs/dbraw/zinc/20/30/08/308203008.db2.gz	CIRSDCTXCJENQD-UHFFFAOYSA-N	1	1	321.377	1.835	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000577101048	308362950	/nfs/dbraw/zinc/36/29/50/308362950.db2.gz	UVGUXUJVGCOSMU-LBPRGKRZSA-N	1	1	316.361	1.687	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000413256315	534792685	/nfs/dbraw/zinc/79/26/85/534792685.db2.gz	CKWMDOKPUULAGR-UHFFFAOYSA-N	1	1	320.328	1.943	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21	ZINC000157291069	527312359	/nfs/dbraw/zinc/31/23/59/527312359.db2.gz	RWEKLBAYMSAYKS-WFASDCNBSA-N	1	1	318.377	1.855	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000445132745	527929892	/nfs/dbraw/zinc/92/98/92/527929892.db2.gz	GYHZMFCAICFXRB-NXEZZACHSA-N	1	1	308.338	1.250	20	5		DDBDMO
C[C@@H](CNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000736024924	598522908	/nfs/dbraw/zinc/52/29/08/598522908.db2.gz	CIPURFGQGBRUNO-VIFPVBQESA-N	1	1	317.353	1.670	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581309	698121230	/nfs/dbraw/zinc/12/12/30/698121230.db2.gz	CIXQDFVVUYMATI-CABCVRRESA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581309	698121231	/nfs/dbraw/zinc/12/12/31/698121231.db2.gz	CIXQDFVVUYMATI-CABCVRRESA-N	1	1	319.361	1.371	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN2CC[NH+]([C@@H]3CCOC3)CC2)cc1	ZINC000776593479	698124151	/nfs/dbraw/zinc/12/41/51/698124151.db2.gz	JVTARQUHJAORIA-CVEARBPZSA-N	1	1	321.377	1.035	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H]1C	ZINC000787187633	699194930	/nfs/dbraw/zinc/19/49/30/699194930.db2.gz	TUFJOXFXHPPYAT-QWRGUYRKSA-N	1	1	306.366	1.732	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](C3OCCO3)C2)cc1[N+](=O)[O-]	ZINC000719003849	699297458	/nfs/dbraw/zinc/29/74/58/699297458.db2.gz	ZFUJIOJXNFAUNP-LBPRGKRZSA-N	1	1	308.334	1.798	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588968	699642119	/nfs/dbraw/zinc/64/21/19/699642119.db2.gz	GZRZZILHJDSDEE-MAZHCROVSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588968	699642120	/nfs/dbraw/zinc/64/21/20/699642120.db2.gz	GZRZZILHJDSDEE-MAZHCROVSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(Cn3ncc4ccc([N+](=O)[O-])cc43)C2)C1	ZINC000793745382	699776243	/nfs/dbraw/zinc/77/62/43/699776243.db2.gz	ODFUBEHFDMJXGN-INIZCTEOSA-N	1	1	315.377	1.930	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(Cn2nccc2[N+](=O)[O-])C1	ZINC000743376181	699909936	/nfs/dbraw/zinc/90/99/36/699909936.db2.gz	JURUDDJACITOQS-OAHLLOKOSA-N	1	1	315.377	1.955	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000744798670	699961304	/nfs/dbraw/zinc/96/13/04/699961304.db2.gz	MRSVODITQNWBTA-SNVBAGLBSA-N	1	1	322.321	1.575	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](C(F)(F)F)C2)c1	ZINC000761056542	700837191	/nfs/dbraw/zinc/83/71/91/700837191.db2.gz	YADKAXYKHMQBIA-PSASIEDQSA-N	1	1	308.260	1.036	20	5		DDBDMO
Cn1cc([C@@H](CO)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cn1	ZINC000761527181	700862711	/nfs/dbraw/zinc/86/27/11/700862711.db2.gz	NUGYAISTMXUUFZ-GFCCVEGCSA-N	1	1	310.741	1.805	20	5		DDBDMO
C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](C)CCO1	ZINC000770237077	701272561	/nfs/dbraw/zinc/27/25/61/701272561.db2.gz	RMXPEBVWAVLZQO-PEVLQBLXSA-N	1	1	319.361	1.443	20	5		DDBDMO
C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCO1	ZINC000770237077	701272562	/nfs/dbraw/zinc/27/25/62/701272562.db2.gz	RMXPEBVWAVLZQO-PEVLQBLXSA-N	1	1	319.361	1.443	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000771407588	701318814	/nfs/dbraw/zinc/31/88/14/701318814.db2.gz	RRVCBVIPLPVKEN-NEPJUHHUSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@@H+]1C	ZINC000771407588	701318815	/nfs/dbraw/zinc/31/88/15/701318815.db2.gz	RRVCBVIPLPVKEN-NEPJUHHUSA-N	1	1	320.393	1.825	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000879133813	706595948	/nfs/dbraw/zinc/59/59/48/706595948.db2.gz	JGSYVNZEKIQZKM-PEYYIBSZSA-N	1	1	322.361	1.759	20	5		DDBDMO
Cc1ccc([C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+]2CCCC2)cc1	ZINC000839605674	701751700	/nfs/dbraw/zinc/75/17/00/701751700.db2.gz	YTLBMLLLEOTEMF-BZUAXINKSA-N	1	1	317.389	1.913	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000839700197	701789664	/nfs/dbraw/zinc/78/96/64/701789664.db2.gz	CUEOTLHVBXFTEC-SPWCGHHHSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000839700197	701789667	/nfs/dbraw/zinc/78/96/67/701789667.db2.gz	CUEOTLHVBXFTEC-SPWCGHHHSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000839700197	701789671	/nfs/dbraw/zinc/78/96/71/701789671.db2.gz	CUEOTLHVBXFTEC-SPWCGHHHSA-N	1	1	303.362	1.431	20	5		DDBDMO
CC[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCOC1	ZINC000812298261	702141994	/nfs/dbraw/zinc/14/19/94/702141994.db2.gz	KMYLTXABZFKXBB-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCOC1	ZINC000812298261	702141995	/nfs/dbraw/zinc/14/19/95/702141995.db2.gz	KMYLTXABZFKXBB-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CN1CC[NH+](C2CCN(c3ncc([N+](=O)[O-])s3)CC2)CC1	ZINC000866212047	706650442	/nfs/dbraw/zinc/65/04/42/706650442.db2.gz	BWZWKGVDRNCXTG-UHFFFAOYSA-N	1	1	311.411	1.268	20	5		DDBDMO
Cn1ccnc1[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000846835477	703339364	/nfs/dbraw/zinc/33/93/64/703339364.db2.gz	BNPNHWSHEGRTGA-UKRRQHHQSA-N	1	1	316.361	1.851	20	5		DDBDMO
C[C@@H](C(=O)OCc1cn(C)nc1[N+](=O)[O-])[NH+]1CCCCCC1	ZINC000847783916	703466194	/nfs/dbraw/zinc/46/61/94/703466194.db2.gz	IRVSLOAVKMYQJI-NSHDSACASA-N	1	1	310.354	1.636	20	5		DDBDMO
O=C1NCCO[C@@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000879717938	706768755	/nfs/dbraw/zinc/76/87/55/706768755.db2.gz	IPMYMPSAVXJLSN-CABCVRRESA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C1NCCO[C@@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000879717938	706768758	/nfs/dbraw/zinc/76/87/58/706768758.db2.gz	IPMYMPSAVXJLSN-CABCVRRESA-N	1	1	319.361	1.117	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2CCc3[nH]cnc3C2)c1	ZINC000819323311	704107300	/nfs/dbraw/zinc/10/73/00/704107300.db2.gz	ZIBAMQBWSVVNRL-NHYWBVRUSA-N	1	1	302.334	1.498	20	5		DDBDMO
C[C@@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000870786399	704132070	/nfs/dbraw/zinc/13/20/70/704132070.db2.gz	WHMOJTVPMRIXPL-QWRGUYRKSA-N	1	1	310.354	1.748	20	5		DDBDMO
C[C@@H](C[C@H]1CCCC[N@H+]1C)OC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000870789516	704132566	/nfs/dbraw/zinc/13/25/66/704132566.db2.gz	HFZLOLUEBLJUSD-QWHCGFSZSA-N	1	1	324.381	1.988	20	5		DDBDMO
CC[N@@H+]1CCCC[C@@H]1C(=O)OC1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000870828431	704137881	/nfs/dbraw/zinc/13/78/81/704137881.db2.gz	QRQPRUWLHZBPDX-UXUKBGGZSA-N	1	1	322.365	1.912	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1C(=O)OC1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000870828431	704137883	/nfs/dbraw/zinc/13/78/83/704137883.db2.gz	QRQPRUWLHZBPDX-UXUKBGGZSA-N	1	1	322.365	1.912	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCN(C2CC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000870875063	704153644	/nfs/dbraw/zinc/15/36/44/704153644.db2.gz	UUHQYJKQFHGTPP-INIZCTEOSA-N	1	1	318.377	1.075	20	5		DDBDMO
COC[C@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870892153	704159213	/nfs/dbraw/zinc/15/92/13/704159213.db2.gz	NUYCNQAQOCTLRN-NHYWBVRUSA-N	1	1	307.350	1.264	20	5		DDBDMO
CN(CC1=CCCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870953783	704180377	/nfs/dbraw/zinc/18/03/77/704180377.db2.gz	NBLLJZZITYGDCV-INIZCTEOSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CCC1(C)C	ZINC000871155475	704233188	/nfs/dbraw/zinc/23/31/88/704233188.db2.gz	RNVLVMSVMWIXIK-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000855165882	704471773	/nfs/dbraw/zinc/47/17/73/704471773.db2.gz	ZRWHDRQNQODKHJ-SECBINFHSA-N	1	1	307.354	1.175	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000855284602	704477291	/nfs/dbraw/zinc/47/72/91/704477291.db2.gz	WDBKTWSLNQZIFM-TZMCWYRMSA-N	1	1	321.377	1.617	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000856281498	704521417	/nfs/dbraw/zinc/52/14/17/704521417.db2.gz	DUBHUKORXSFAHV-CQSZACIVSA-N	1	1	323.393	1.865	20	5		DDBDMO
Cc1ccc(O[C@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)nc1	ZINC000858035952	704660680	/nfs/dbraw/zinc/66/06/80/704660680.db2.gz	MPTUIGCQDTTXOF-ZDUSSCGKSA-N	1	1	317.349	1.648	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)C[C@@H]21	ZINC000834315306	707028567	/nfs/dbraw/zinc/02/85/67/707028567.db2.gz	YQPGRBNZXNVGTP-RNCFNFMXSA-N	1	1	320.305	1.279	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179372	705163388	/nfs/dbraw/zinc/16/33/88/705163388.db2.gz	MMGGOYZBLMYHMD-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179372	705163389	/nfs/dbraw/zinc/16/33/89/705163389.db2.gz	MMGGOYZBLMYHMD-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179372	705163390	/nfs/dbraw/zinc/16/33/90/705163390.db2.gz	MMGGOYZBLMYHMD-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874830374	705189336	/nfs/dbraw/zinc/18/93/36/705189336.db2.gz	RGOXYZHZWPMWFB-CHWSQXEVSA-N	1	1	319.361	1.912	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000826128927	705775258	/nfs/dbraw/zinc/77/52/58/705775258.db2.gz	WOJMARZIEYJPRE-GJZGRUSLSA-N	1	1	321.377	1.427	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000827329454	705977061	/nfs/dbraw/zinc/97/70/61/705977061.db2.gz	GPTJISULARIDQJ-OLZOCXBDSA-N	1	1	319.361	1.770	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827375175	705989291	/nfs/dbraw/zinc/98/92/91/705989291.db2.gz	TYKVNXYNKGPWBD-QWHCGFSZSA-N	1	1	319.361	1.770	20	5		DDBDMO
CCOC(=O)[C@H](C)C1C[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000871993203	707272720	/nfs/dbraw/zinc/27/27/20/707272720.db2.gz	MQTQIZYNXVNXQL-ABAIWWIYSA-N	1	1	322.361	1.759	20	5		DDBDMO
CN(CC[NH+]1CC2(C1)CCOCC2)C(=O)c1ccc([N+](=O)[O-])o1	ZINC000829299363	706315842	/nfs/dbraw/zinc/31/58/42/706315842.db2.gz	UXKWXKKJEQWLQK-UHFFFAOYSA-N	1	1	323.349	1.372	20	5		DDBDMO
C[C@](O)(C[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303409	706352252	/nfs/dbraw/zinc/35/22/52/706352252.db2.gz	PYUXGDIMAGHWMI-PBHICJAKSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@](O)(C[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303409	706352253	/nfs/dbraw/zinc/35/22/53/706352253.db2.gz	PYUXGDIMAGHWMI-PBHICJAKSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000830015880	706437980	/nfs/dbraw/zinc/43/79/80/706437980.db2.gz	GFDYBIMLQOTUNX-YMTOWFKASA-N	1	1	307.325	1.946	20	5		DDBDMO
COC(=O)CC[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000880039119	706860297	/nfs/dbraw/zinc/86/02/97/706860297.db2.gz	FSCFBCYKAPIKCZ-LBPRGKRZSA-N	1	1	310.354	1.457	20	5		DDBDMO
COC(=O)CC[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000880042639	706861899	/nfs/dbraw/zinc/86/18/99/706861899.db2.gz	FOEFXJZKMMDECH-CYBMUJFWSA-N	1	1	324.381	1.765	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@@H]2CCC[N@H+]2C[C@@H]1CO	ZINC000880072652	706870997	/nfs/dbraw/zinc/87/09/97/706870997.db2.gz	GDLCPRYKSIGVEM-LSDHHAIUSA-N	1	1	321.377	1.244	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)cc1F	ZINC000880071915	706871154	/nfs/dbraw/zinc/87/11/54/706871154.db2.gz	QEIAMTGIXSQGRB-QWHCGFSZSA-N	1	1	309.341	1.375	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]C[C@H]1C[C@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000872126480	707297809	/nfs/dbraw/zinc/29/78/09/707297809.db2.gz	KQSCMFBJTVJIGU-KCPJHIHWSA-N	1	1	316.361	1.778	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000882317526	707581240	/nfs/dbraw/zinc/58/12/40/707581240.db2.gz	ICFJSYGICDJPGT-GFCCVEGCSA-N	1	1	324.356	1.678	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3C[C@@H]4CCC[N@@H+]4C[C@@H]3CO)nc2c1	ZINC000872757604	707586739	/nfs/dbraw/zinc/58/67/39/707586739.db2.gz	GVBVSNHGCLCONV-NWDGAFQWSA-N	1	1	317.349	1.116	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N1CCc2cc(C)c([N+](=O)[O-])cc21	ZINC000837511972	707669719	/nfs/dbraw/zinc/66/97/19/707669719.db2.gz	XQLXZIJHHFTYDK-UHFFFAOYSA-N	1	1	300.318	1.997	20	5		DDBDMO
CON1CCC([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000839131965	708028710	/nfs/dbraw/zinc/02/87/10/708028710.db2.gz	SDERXQQMHXIZHO-OAHLLOKOSA-N	1	1	309.366	1.586	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896914341	708181296	/nfs/dbraw/zinc/18/12/96/708181296.db2.gz	AUXRYRYCAGCLTM-ABAIWWIYSA-N	1	1	304.350	1.082	20	5		DDBDMO
COc1cc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221297	708259343	/nfs/dbraw/zinc/25/93/43/708259343.db2.gz	KYGCWZGFLOFPIZ-UONOGXRCSA-N	1	1	321.377	1.639	20	5		DDBDMO
C[C@](O)(C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(F)F	ZINC000885937584	708666626	/nfs/dbraw/zinc/66/66/26/708666626.db2.gz	DFZXYNPUAMLZTA-ZDUSSCGKSA-N	1	1	316.308	1.128	20	5		DDBDMO
O=C1CCCN1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000885988859	708676807	/nfs/dbraw/zinc/67/68/07/708676807.db2.gz	QARRBLSOQOPDID-UHFFFAOYSA-N	1	1	304.350	1.577	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2CSC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000886564338	708777612	/nfs/dbraw/zinc/77/76/12/708777612.db2.gz	TVMWWVOBDNJOHV-TXEJJXNPSA-N	1	1	321.402	1.852	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@](CO)(C(F)(F)F)C2)c1	ZINC000886799100	708847128	/nfs/dbraw/zinc/84/71/28/708847128.db2.gz	MNCIPYHHMWJSHF-JTQLQIEISA-N	1	1	308.260	1.038	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887924530	709164770	/nfs/dbraw/zinc/16/47/70/709164770.db2.gz	OSNCCZIYIKOEGD-INWMFGNUSA-N	1	1	319.361	1.038	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103544	713131754	/nfs/dbraw/zinc/13/17/54/713131754.db2.gz	RGHPDJVSVAXOQP-KBPBESRZSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103544	713131755	/nfs/dbraw/zinc/13/17/55/713131755.db2.gz	RGHPDJVSVAXOQP-KBPBESRZSA-N	1	1	321.402	1.904	20	5		DDBDMO
CN(CC(C)(C)C[NH+](C)C)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000890881784	710019430	/nfs/dbraw/zinc/01/94/30/710019430.db2.gz	IKJPOUGPFBNDBU-UHFFFAOYSA-N	1	1	309.366	1.960	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@@H+](CC(C)C)CCO1	ZINC000891572209	710238605	/nfs/dbraw/zinc/23/86/05/710238605.db2.gz	RLTGVEJXPWKFAX-ZDUSSCGKSA-N	1	1	324.381	1.767	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc3nonc3c2[N+](=O)[O-])C1	ZINC000892730836	710489306	/nfs/dbraw/zinc/48/93/06/710489306.db2.gz	KBINOXDTZGLVPR-SNVBAGLBSA-N	1	1	305.338	1.909	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3ccc([N+](=O)[O-])cn3)C[C@@]2(C)C1	ZINC000913285496	713191772	/nfs/dbraw/zinc/19/17/72/713191772.db2.gz	YFLHFAKEXCOMIP-GASCZTMLSA-N	1	1	304.350	1.404	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C	ZINC000928440062	713197013	/nfs/dbraw/zinc/19/70/13/713197013.db2.gz	AMGROLIEJPFZIE-NOZJJQNGSA-N	1	1	311.769	2.000	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@H+]1C	ZINC000928450120	713202264	/nfs/dbraw/zinc/20/22/64/713202264.db2.gz	SHNDEZSYVZZIEP-BXKDBHETSA-N	1	1	321.333	1.188	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1	ZINC000893743758	710803359	/nfs/dbraw/zinc/80/33/59/710803359.db2.gz	IOQHOZZKSVJOSO-AWEZNQCLSA-N	1	1	315.377	1.691	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000893941813	710894823	/nfs/dbraw/zinc/89/48/23/710894823.db2.gz	WWXPVMKHDVDUOZ-JQWIXIFHSA-N	1	1	320.349	1.307	20	5		DDBDMO
[NH3+]CC1([C@H]2CCCCN2CCn2cc([N+](=O)[O-])cn2)CCC1	ZINC000903813192	711288713	/nfs/dbraw/zinc/28/87/13/711288713.db2.gz	YOGVGNFOWXDUAV-CQSZACIVSA-N	1	1	307.398	1.775	20	5		DDBDMO
C[N@@H+](CCO)CCNc1c2cc(F)ccc2ncc1[N+](=O)[O-]	ZINC000895240943	711462218	/nfs/dbraw/zinc/46/22/18/711462218.db2.gz	PLDUGUWGYGSOBH-UHFFFAOYSA-N	1	1	308.313	1.040	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCC[N@@H+]1CCC2(C1)OCCO2	ZINC000895254581	711467983	/nfs/dbraw/zinc/46/79/83/711467983.db2.gz	VMKISRIHMKCXDI-UHFFFAOYSA-N	1	1	308.338	1.159	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCC[N@H+]1CCC2(C1)OCCO2	ZINC000895254581	711467985	/nfs/dbraw/zinc/46/79/85/711467985.db2.gz	VMKISRIHMKCXDI-UHFFFAOYSA-N	1	1	308.338	1.159	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1	ZINC000895703734	711583010	/nfs/dbraw/zinc/58/30/10/711583010.db2.gz	ONLYQPWFAWEBAX-IYCSXQJISA-N	1	1	320.345	1.608	20	5		DDBDMO
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC000896570055	711755142	/nfs/dbraw/zinc/75/51/42/711755142.db2.gz	XCFKTFONGULAJX-HZMBPMFUSA-N	1	1	324.356	1.098	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+][C@@H]2CNOC2)ccc1N1CCCCC1	ZINC000904424121	711856231	/nfs/dbraw/zinc/85/62/31/711856231.db2.gz	MULPJRQIEVQZFS-CYBMUJFWSA-N	1	1	306.366	1.578	20	5		DDBDMO
COc1ccc(-c2ccc(C[NH2+][C@H]3CNOC3)o2)c([N+](=O)[O-])c1	ZINC000904425817	711856662	/nfs/dbraw/zinc/85/66/62/711856662.db2.gz	ZCJLNGMCNSDALI-JTQLQIEISA-N	1	1	319.317	1.856	20	5		DDBDMO
O=C1C[C@H]([NH2+]CC[N+](=O)[O-])CN1c1cccc(C(F)(F)F)c1	ZINC000905155669	711954381	/nfs/dbraw/zinc/95/43/81/711954381.db2.gz	QHHYKGDZYYZPGF-JTQLQIEISA-N	1	1	317.267	1.677	20	5		DDBDMO
COCC(COC)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929988949	713730084	/nfs/dbraw/zinc/73/00/84/713730084.db2.gz	PAMZKIPXVYTZKU-NSHDSACASA-N	1	1	310.354	1.137	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@@H]2COC[C@@H]2O1	ZINC000930441078	713836040	/nfs/dbraw/zinc/83/60/40/713836040.db2.gz	QXWKVHMGTLHOKI-YCPHGPKFSA-N	1	1	306.362	1.873	20	5		DDBDMO
CC1CCN(C(=O)OC[C@H]2CCCC[N@@H+]2CC[N+](=O)[O-])CC1	ZINC000930468080	713842643	/nfs/dbraw/zinc/84/26/43/713842643.db2.gz	WJPBJKLOJCWIRO-CQSZACIVSA-N	1	1	313.398	1.986	20	5		DDBDMO
CC1CCN(C(=O)OC[C@H]2CCCC[N@H+]2CC[N+](=O)[O-])CC1	ZINC000930468080	713842646	/nfs/dbraw/zinc/84/26/46/713842646.db2.gz	WJPBJKLOJCWIRO-CQSZACIVSA-N	1	1	313.398	1.986	20	5		DDBDMO
CON1CC[C@@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000930636366	713883818	/nfs/dbraw/zinc/88/38/18/713883818.db2.gz	GAKYIBRVBFDQKW-UKRRQHHQSA-N	1	1	319.361	1.937	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000930651590	713887735	/nfs/dbraw/zinc/88/77/35/713887735.db2.gz	YVXJTMNOYPWJIS-LSDHHAIUSA-N	1	1	303.362	1.909	20	5		DDBDMO
Cn1cc(-c2ccnc(C3CC[NH+](CC[N+](=O)[O-])CC3)n2)cn1	ZINC000931089208	713999300	/nfs/dbraw/zinc/99/93/00/713999300.db2.gz	RJCVVPFQJUMJDW-UHFFFAOYSA-N	1	1	316.365	1.333	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000932647282	714374596	/nfs/dbraw/zinc/37/45/96/714374596.db2.gz	NWCGGTHXNAOPSQ-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000932647282	714374600	/nfs/dbraw/zinc/37/46/00/714374600.db2.gz	NWCGGTHXNAOPSQ-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCn1cnc2c1CC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C2	ZINC000933252852	714547677	/nfs/dbraw/zinc/54/76/77/714547677.db2.gz	IBCUYMDRFDMBJM-UHFFFAOYSA-N	1	1	304.354	1.374	20	5		DDBDMO
CCn1cnc2c1CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C2	ZINC000933252852	714547679	/nfs/dbraw/zinc/54/76/79/714547679.db2.gz	IBCUYMDRFDMBJM-UHFFFAOYSA-N	1	1	304.354	1.374	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]([C@H]3CCOC3)C2)c1	ZINC000934832310	714912689	/nfs/dbraw/zinc/91/26/89/714912689.db2.gz	AXMPUKYQDCYDRH-KBPBESRZSA-N	1	1	308.382	1.930	20	5		DDBDMO
CCCC[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589309	718844341	/nfs/dbraw/zinc/84/43/41/718844341.db2.gz	RESZYICNQIRDSN-LXTVHRRPSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCCC[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589309	718844344	/nfs/dbraw/zinc/84/43/44/718844344.db2.gz	RESZYICNQIRDSN-LXTVHRRPSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCCC[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589309	718844346	/nfs/dbraw/zinc/84/43/46/718844346.db2.gz	RESZYICNQIRDSN-LXTVHRRPSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCC[C@@H]1CN(c2cc(N)c([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC001120913541	782230832	/nfs/dbraw/zinc/23/08/32/782230832.db2.gz	RMVCOPPSEZGDGI-GFCCVEGCSA-N	1	1	323.397	1.509	20	5		DDBDMO
CC(C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C)=C1CCCC1	ZINC001125519757	733729943	/nfs/dbraw/zinc/72/99/43/733729943.db2.gz	ODVGXCVRHIXWDC-UHFFFAOYSA-N	1	1	321.381	1.425	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(C(F)F)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936453	742840574	/nfs/dbraw/zinc/84/05/74/742840574.db2.gz	IQSCIKRWZJIVIB-VXGBXAGGSA-N	1	1	313.304	1.495	20	5		DDBDMO
C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+]1C1CCCC1	ZINC001197798467	747268010	/nfs/dbraw/zinc/26/80/10/747268010.db2.gz	MRXIVLYEKUMLCD-CYBMUJFWSA-N	1	1	307.398	1.740	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NC/C=C\CNc1ncccc1[N+](=O)[O-]	ZINC001107232698	749661891	/nfs/dbraw/zinc/66/18/91/749661891.db2.gz	GBHNXZNCGKAPSW-PLNGDYQASA-N	1	1	321.381	1.414	20	5		DDBDMO
O=C(NCC1([NH2+]C/C=C\Cl)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001115530741	751045759	/nfs/dbraw/zinc/04/57/59/751045759.db2.gz	OMBLSZZFJROUQF-MGNMTHHWSA-N	1	1	315.801	1.813	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCOC[C@](O)(C(F)(F)F)C2)C1	ZINC001169014421	762178882	/nfs/dbraw/zinc/17/88/82/762178882.db2.gz	ZLZOUOGVAZSCLT-VWYCJHECSA-N	1	1	312.288	1.057	20	5		DDBDMO
CCn1ncc2c1[C@H](COC)C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169025072	762202211	/nfs/dbraw/zinc/20/22/11/762202211.db2.gz	XNEIHPOAOMUOIM-SNPRPXQTSA-N	1	1	322.409	1.894	20	5		DDBDMO
O=[N+]([O-])c1c(Cl)nc(Cl)nc1N1CC[N@@H+]2CC[C@@H]2C1	ZINC001158424206	768224701	/nfs/dbraw/zinc/22/47/01/768224701.db2.gz	SIZNAFMFKMHEMZ-ZCFIWIBFSA-N	1	1	304.137	1.586	20	5		DDBDMO
O=[N+]([O-])c1c(Cl)nc(Cl)nc1N1CC[N@H+]2CC[C@@H]2C1	ZINC001158424206	768224705	/nfs/dbraw/zinc/22/47/05/768224705.db2.gz	SIZNAFMFKMHEMZ-ZCFIWIBFSA-N	1	1	304.137	1.586	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](O)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC001170334411	766256921	/nfs/dbraw/zinc/25/69/21/766256921.db2.gz	DGUXSSZQEXHVRR-RBOXIYTFSA-N	1	1	324.377	1.210	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C[N@H+](C)C(C)C)n1	ZINC001093674450	774989203	/nfs/dbraw/zinc/98/92/03/774989203.db2.gz	XVWYAFLFGJEFCH-UHFFFAOYSA-N	1	1	309.370	1.167	20	5		DDBDMO
Cc1ccnc(N(C)CCNC(=O)C[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC001100149752	775735716	/nfs/dbraw/zinc/73/57/16/775735716.db2.gz	OXALVMOZLQHFJL-UHFFFAOYSA-N	1	1	323.397	1.191	20	5		DDBDMO
C[N@@H+](CC(=O)NCCCNc1ncccc1[N+](=O)[O-])C1CCC1	ZINC001094853295	776502468	/nfs/dbraw/zinc/50/24/68/776502468.db2.gz	JFYDPGVKWRPNIP-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
NC(=O)[C@@H]1CC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1	ZINC001172914846	776929334	/nfs/dbraw/zinc/92/93/34/776929334.db2.gz	KJMHWUHIHLIMFU-ZIAGYGMSSA-N	1	1	303.362	1.649	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(N2CCOCC2)C1	ZINC001173226007	777061423	/nfs/dbraw/zinc/06/14/23/777061423.db2.gz	HANDUNPKAHJSIX-CYBMUJFWSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101756608	777479145	/nfs/dbraw/zinc/47/91/45/777479145.db2.gz	FZBPKXIZNHYDQZ-UHFFFAOYSA-N	1	1	309.370	1.202	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101829475	777575921	/nfs/dbraw/zinc/57/59/21/777575921.db2.gz	NHECTEQEHALQAG-UHFFFAOYSA-N	1	1	323.397	1.590	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816077	780904025	/nfs/dbraw/zinc/90/40/25/780904025.db2.gz	QNDUSXVZRVVHMI-GXTWGEPZSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816077	780904032	/nfs/dbraw/zinc/90/40/32/780904032.db2.gz	QNDUSXVZRVVHMI-GXTWGEPZSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)c1C	ZINC001119403813	781439055	/nfs/dbraw/zinc/43/90/55/781439055.db2.gz	NPMWQPVKZJZAHO-OCCSQVGLSA-N	1	1	303.362	1.988	20	5		DDBDMO
CN(C(=O)c1cc(C[NH+](C)C)on1)c1ccc([N+](=O)[O-])cc1	ZINC001120354335	781890751	/nfs/dbraw/zinc/89/07/51/781890751.db2.gz	WHRPWXIFBLTJSV-UHFFFAOYSA-N	1	1	304.306	1.921	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001326429965	861362457	/nfs/dbraw/zinc/36/24/57/861362457.db2.gz	AZUXISFBAVJVBR-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001326429965	861362465	/nfs/dbraw/zinc/36/24/65/861362465.db2.gz	AZUXISFBAVJVBR-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](OCCOc3ccc([N+](=O)[O-])cc3)[C@H]1CC(=O)C2	ZINC001224777296	881529352	/nfs/dbraw/zinc/52/93/52/881529352.db2.gz	RGBKRGZQSWYYDY-APHBMKBZSA-N	1	1	320.345	1.794	20	5		DDBDMO
CC[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(=O)OC)C(C)(C)C1	ZINC001158561102	864728679	/nfs/dbraw/zinc/72/86/79/864728679.db2.gz	HVUSGBYZTUDFIV-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
Nc1cc(N[C@H]2CCC[C@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160724730	866073592	/nfs/dbraw/zinc/07/35/92/866073592.db2.gz	MPNNEKLYBHRDQP-NWDGAFQWSA-N	1	1	307.354	1.237	20	5		DDBDMO
C[NH+]1CCN(CCCNc2ccc3ncc([N+](=O)[O-])n3c2)CC1	ZINC001161708453	866919794	/nfs/dbraw/zinc/91/97/94/866919794.db2.gz	KPDKDRMIRXVNSM-UHFFFAOYSA-N	1	1	318.381	1.292	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(NC2C[NH+](C(C)(C)C)C2)n1	ZINC001162225053	867358312	/nfs/dbraw/zinc/35/83/12/867358312.db2.gz	CCYOQWIALUJSHB-UHFFFAOYSA-N	1	1	322.369	1.546	20	5		DDBDMO
Cc1c(Cl)nc(-c2ccc([N+](=O)[O-])cc2)nc1NOCC[NH3+]	ZINC001164423912	869187128	/nfs/dbraw/zinc/18/71/28/869187128.db2.gz	NFHJWUAKIZSIHT-UHFFFAOYSA-N	1	1	323.740	1.738	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3nc(Cl)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226364890	882386421	/nfs/dbraw/zinc/38/64/21/882386421.db2.gz	VIEQEDHSLGNBCN-XROYCOCOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nc(Cl)ccc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226364890	882386442	/nfs/dbraw/zinc/38/64/42/882386442.db2.gz	VIEQEDHSLGNBCN-XROYCOCOSA-N	1	1	311.725	1.826	20	5		DDBDMO
COc1cccc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC001339177416	870387725	/nfs/dbraw/zinc/38/77/25/870387725.db2.gz	YXOIZOKHOHPASY-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1[N+](=O)[O-]	ZINC001339998977	870830450	/nfs/dbraw/zinc/83/04/50/870830450.db2.gz	LEMQLKCQLXUNRB-YUSALJHKSA-N	1	1	320.349	1.529	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)[C@H]1C[N@H+](C)CCN1C	ZINC001308948984	871536522	/nfs/dbraw/zinc/53/65/22/871536522.db2.gz	UWLVGWGTOVMINN-RHSMWYFYSA-N	1	1	320.437	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001308948984	871536536	/nfs/dbraw/zinc/53/65/36/871536536.db2.gz	UWLVGWGTOVMINN-RHSMWYFYSA-N	1	1	320.437	1.936	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCCCn1cc[nH+]c1C	ZINC001317912060	871623239	/nfs/dbraw/zinc/62/32/39/871623239.db2.gz	RTLMGLZABMIUJT-UHFFFAOYSA-N	1	1	317.349	1.962	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](COc2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC001227222197	882916720	/nfs/dbraw/zinc/91/67/20/882916720.db2.gz	XRIRPHHZLDNJIV-LLVKDONJSA-N	1	1	319.317	1.558	20	5		DDBDMO
C[N@H+]1CCO[C@@H](COc2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC001227222197	882916728	/nfs/dbraw/zinc/91/67/28/882916728.db2.gz	XRIRPHHZLDNJIV-LLVKDONJSA-N	1	1	319.317	1.558	20	5		DDBDMO
CO[C@@H]1CCOC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC001473828257	880991166	/nfs/dbraw/zinc/99/11/66/880991166.db2.gz	XPUCTVJJZAWISH-DGCLKSJQSA-N	1	1	311.294	1.397	20	5		DDBDMO
CCC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccnc1	ZINC001230763170	884846398	/nfs/dbraw/zinc/84/63/98/884846398.db2.gz	SRISCYGWKOBDGW-HUUCEWRRSA-N	1	1	320.393	1.465	20	5		DDBDMO
CCC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001230763170	884846413	/nfs/dbraw/zinc/84/64/13/884846413.db2.gz	SRISCYGWKOBDGW-HUUCEWRRSA-N	1	1	320.393	1.465	20	5		DDBDMO
CCC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001230763170	884846427	/nfs/dbraw/zinc/84/64/27/884846427.db2.gz	SRISCYGWKOBDGW-HUUCEWRRSA-N	1	1	320.393	1.465	20	5		DDBDMO
CC[C@H](N)C[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC001246315700	892535709	/nfs/dbraw/zinc/53/57/09/892535709.db2.gz	VHWLCRYFXKFMTR-LBPRGKRZSA-N	1	1	322.409	1.899	20	5		DDBDMO
CC[C@@H](N)C[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC001246315698	892536337	/nfs/dbraw/zinc/53/63/37/892536337.db2.gz	VHWLCRYFXKFMTR-GFCCVEGCSA-N	1	1	322.409	1.899	20	5		DDBDMO
CN1CCN(CC[N@H+](C)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254603806	896528337	/nfs/dbraw/zinc/52/83/37/896528337.db2.gz	QWQCKQJQQNHMRK-QGZVFWFLSA-N	1	1	318.421	1.241	20	5		DDBDMO
CN1CCN(CC[N@@H+](C)[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254603806	896528346	/nfs/dbraw/zinc/52/83/46/896528346.db2.gz	QWQCKQJQQNHMRK-QGZVFWFLSA-N	1	1	318.421	1.241	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@H+](CCO)CC2)c2ccccc21	ZINC001262060370	899922850	/nfs/dbraw/zinc/92/28/50/899922850.db2.gz	YSMSVFIENOZYHJ-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
O=C(C[NH+]1CCC(CO)CC1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC001262609354	900272229	/nfs/dbraw/zinc/27/22/29/900272229.db2.gz	LDMFZTTWJHRXKR-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000495209185	529442238	/nfs/dbraw/zinc/44/22/38/529442238.db2.gz	APFPIHFKAFOCKW-WFASDCNBSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC(C)[N@H+](C)C[C@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000358133232	299085298	/nfs/dbraw/zinc/08/52/98/299085298.db2.gz	PZYMWISOBPTRID-NSHDSACASA-N	1	1	311.386	1.371	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000457168358	529882964	/nfs/dbraw/zinc/88/29/64/529882964.db2.gz	DSRZEYJSQPAFLW-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1c(N)cccc1[N+](=O)[O-])C1CC1	ZINC000457175416	529883418	/nfs/dbraw/zinc/88/34/18/529883418.db2.gz	XWJJOYGPKCYKDJ-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000103062307	185430800	/nfs/dbraw/zinc/43/08/00/185430800.db2.gz	KMGOAFGADSZRQI-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000299354234	530057303	/nfs/dbraw/zinc/05/73/03/530057303.db2.gz	AOZNWOHJBHBWPG-SNVBAGLBSA-N	1	1	311.313	1.323	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000616136137	362557713	/nfs/dbraw/zinc/55/77/13/362557713.db2.gz	KYQAKZOMJBIPEK-UHFFFAOYSA-N	1	1	306.318	1.909	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000616136137	362557716	/nfs/dbraw/zinc/55/77/16/362557716.db2.gz	KYQAKZOMJBIPEK-UHFFFAOYSA-N	1	1	306.318	1.909	20	5		DDBDMO
C[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612910	210014784	/nfs/dbraw/zinc/01/47/84/210014784.db2.gz	ZPOUCBKJMFAFRX-PWSUYJOCSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612910	210014788	/nfs/dbraw/zinc/01/47/88/210014788.db2.gz	ZPOUCBKJMFAFRX-PWSUYJOCSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000026711245	352210803	/nfs/dbraw/zinc/21/08/03/352210803.db2.gz	RNABSOVOMPQBII-BZPMIXESSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCn3cccn3)C2)nc1	ZINC000072665273	191211464	/nfs/dbraw/zinc/21/14/64/191211464.db2.gz	PRXSNYSNMXZKBT-GFCCVEGCSA-N	1	1	302.338	1.373	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000058274231	352841221	/nfs/dbraw/zinc/84/12/21/352841221.db2.gz	SIHCLXMCGFJCCX-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
CC(C)[C@@H](CNc1ccncc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000064620260	352940544	/nfs/dbraw/zinc/94/05/44/352940544.db2.gz	ZFZJIULWDLHROF-CQSZACIVSA-N	1	1	307.398	1.674	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000069137814	353147442	/nfs/dbraw/zinc/14/74/42/353147442.db2.gz	VXMYXAHCMPQJNL-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2	ZINC000072829658	353218592	/nfs/dbraw/zinc/21/85/92/353218592.db2.gz	CSMAPWHZDNIVAB-MRXNPFEDSA-N	1	1	319.361	1.576	20	5		DDBDMO
C[N@H+](Cc1ccccc1Cl)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174656068	198366609	/nfs/dbraw/zinc/36/66/09/198366609.db2.gz	GUFHNYOGXLDHRP-CYBMUJFWSA-N	1	1	324.768	1.938	20	5		DDBDMO
Cc1sc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833369	354222417	/nfs/dbraw/zinc/22/24/17/354222417.db2.gz	WIAREDSNPPBDEK-GZMMTYOYSA-N	1	1	313.379	1.414	20	5		DDBDMO
Cc1sc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833369	354222423	/nfs/dbraw/zinc/22/24/23/354222423.db2.gz	WIAREDSNPPBDEK-GZMMTYOYSA-N	1	1	313.379	1.414	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423077	354225272	/nfs/dbraw/zinc/22/52/72/354225272.db2.gz	QHMBDNCOKOSXEB-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423077	354225276	/nfs/dbraw/zinc/22/52/76/354225276.db2.gz	QHMBDNCOKOSXEB-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1	ZINC000323787884	354541747	/nfs/dbraw/zinc/54/17/47/354541747.db2.gz	CKJYBQODNNIXBW-QWHCGFSZSA-N	1	1	319.361	1.769	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000319518173	354521631	/nfs/dbraw/zinc/52/16/31/354521631.db2.gz	JGLLNJUTMKWCOV-CYBMUJFWSA-N	1	1	305.338	1.166	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])cc1C	ZINC000320040905	354524601	/nfs/dbraw/zinc/52/46/01/354524601.db2.gz	CNRKKNFNISJMAG-GFCCVEGCSA-N	1	1	308.382	1.570	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCC[C@](CO)(OC)C2)cc1[N+](=O)[O-]	ZINC000401782127	354667142	/nfs/dbraw/zinc/66/71/42/354667142.db2.gz	QVPHZXVFRPZQFM-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@](CO)(OC)C2)cc1[N+](=O)[O-]	ZINC000401782127	354667143	/nfs/dbraw/zinc/66/71/43/354667143.db2.gz	QVPHZXVFRPZQFM-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000587974347	354888003	/nfs/dbraw/zinc/88/80/03/354888003.db2.gz	XQNLRKCFLKJRFU-SNVBAGLBSA-N	1	1	308.338	1.225	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000587974347	354888005	/nfs/dbraw/zinc/88/80/05/354888005.db2.gz	XQNLRKCFLKJRFU-SNVBAGLBSA-N	1	1	308.338	1.225	20	5		DDBDMO
CC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])CC(C)(C)O	ZINC000589500108	354996726	/nfs/dbraw/zinc/99/67/26/354996726.db2.gz	XFFWMYGEGFLHOR-UHFFFAOYSA-N	1	1	310.350	1.974	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000590444720	355098197	/nfs/dbraw/zinc/09/81/97/355098197.db2.gz	KEKZHHWPPQVFME-BONVTDFDSA-N	1	1	314.345	1.852	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000593061324	355783697	/nfs/dbraw/zinc/78/36/97/355783697.db2.gz	IOOPWKWXSNSPQH-MELADBBJSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000593061324	355783698	/nfs/dbraw/zinc/78/36/98/355783698.db2.gz	IOOPWKWXSNSPQH-MELADBBJSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000593108101	355800903	/nfs/dbraw/zinc/80/09/03/355800903.db2.gz	MZZHQWYAIUEPIB-LLVKDONJSA-N	1	1	323.349	1.596	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000593186968	355819879	/nfs/dbraw/zinc/81/98/79/355819879.db2.gz	BMIJCOFGDXPBLU-UPJWGTAASA-N	1	1	321.377	1.913	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000593187543	355820104	/nfs/dbraw/zinc/82/01/04/355820104.db2.gz	LQYORTDHMSBWMH-JHJVBQTASA-N	1	1	321.377	1.913	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C(C)(C)C1	ZINC000593338992	355857573	/nfs/dbraw/zinc/85/75/73/355857573.db2.gz	MEFBOCYIBFVVEA-UHFFFAOYSA-N	1	1	311.338	1.371	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C(C)(C)C1	ZINC000593338992	355857578	/nfs/dbraw/zinc/85/75/78/355857578.db2.gz	MEFBOCYIBFVVEA-UHFFFAOYSA-N	1	1	311.338	1.371	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000593731626	355978933	/nfs/dbraw/zinc/97/89/33/355978933.db2.gz	FQDGPWCLFZFIJT-PHIMTYICSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CS1(=O)=O	ZINC000594976964	356366398	/nfs/dbraw/zinc/36/63/98/356366398.db2.gz	RGECIYWDELVJQY-KOLCDFICSA-N	1	1	316.354	1.789	20	5		DDBDMO
CCN(C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000595102947	356382619	/nfs/dbraw/zinc/38/26/19/356382619.db2.gz	KSLSSVLEDBGOJJ-CYBMUJFWSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@@H](CO)[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595679068	356607092	/nfs/dbraw/zinc/60/70/92/356607092.db2.gz	UTICLVPURXOESR-JSGCOSHPSA-N	1	1	309.366	1.239	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595835872	356671401	/nfs/dbraw/zinc/67/14/01/356671401.db2.gz	WKBHXUJLEKVTOH-JHJVBQTASA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595835872	356671402	/nfs/dbraw/zinc/67/14/02/356671402.db2.gz	WKBHXUJLEKVTOH-JHJVBQTASA-N	1	1	319.361	1.890	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595828152	356666748	/nfs/dbraw/zinc/66/67/48/356666748.db2.gz	UVRPHTWSXSOHRE-OLZOCXBDSA-N	1	1	319.361	1.892	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595869415	356686103	/nfs/dbraw/zinc/68/61/03/356686103.db2.gz	CWGFIAOHWNAVAQ-XHBSWPGZSA-N	1	1	321.377	1.872	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNc1c(Cl)cncc1[N+](=O)[O-]	ZINC000596110549	356775234	/nfs/dbraw/zinc/77/52/34/356775234.db2.gz	OXHSCCJOCOIMOL-SNVBAGLBSA-N	1	1	314.773	1.588	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])CCCO1	ZINC000596207349	356814385	/nfs/dbraw/zinc/81/43/85/356814385.db2.gz	DGYLAORCNIALFP-NSHDSACASA-N	1	1	310.354	1.608	20	5		DDBDMO
Cc1cnc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000596538617	356911040	/nfs/dbraw/zinc/91/10/40/356911040.db2.gz	MVFIBNKFMPAREO-ZDUSSCGKSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000597858480	357361510	/nfs/dbraw/zinc/36/15/10/357361510.db2.gz	LZKQSOBDPCJBGC-GFCCVEGCSA-N	1	1	321.377	1.963	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000597925917	357385356	/nfs/dbraw/zinc/38/53/56/357385356.db2.gz	YEQHDPLILCGKNW-SNVBAGLBSA-N	1	1	308.338	1.298	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1nccc(C(=O)OC)c1[N+](=O)[O-]	ZINC000598588080	357642171	/nfs/dbraw/zinc/64/21/71/357642171.db2.gz	YWWYDNQTDWJAFD-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@@H+](CC3CC3)C2)n1	ZINC000598563067	357634393	/nfs/dbraw/zinc/63/43/93/357634393.db2.gz	ZXLLAWLYSUKOFZ-GFCCVEGCSA-N	1	1	321.381	1.180	20	5		DDBDMO
NC(=O)NC(=O)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000179521605	283301463	/nfs/dbraw/zinc/30/14/63/283301463.db2.gz	HWOAWTKQBOBLHJ-UHFFFAOYSA-N	1	1	320.349	1.534	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c2c(c1)COCO2	ZINC000599680513	358022632	/nfs/dbraw/zinc/02/26/32/358022632.db2.gz	DMAGHPZHXICSHS-COLVAYQJSA-N	1	1	320.345	1.807	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600310387	358192060	/nfs/dbraw/zinc/19/20/60/358192060.db2.gz	IOJHNJWVRZFUPI-LLVKDONJSA-N	1	1	309.370	1.098	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)n1	ZINC000600315272	358194218	/nfs/dbraw/zinc/19/42/18/358194218.db2.gz	QVWDRXAJJYEMJL-NSHDSACASA-N	1	1	309.370	1.273	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000298729424	283367953	/nfs/dbraw/zinc/36/79/53/283367953.db2.gz	SEKVNJQCBGUXCF-NEPJUHHUSA-N	1	1	305.338	1.127	20	5		DDBDMO
CN(c1c([N+](=O)[O-])c(C(F)(F)F)nn1C)[C@H]1CCC[N@@H+](C)C1	ZINC000601119850	358409891	/nfs/dbraw/zinc/40/98/91/358409891.db2.gz	XQYMOFLRNWMYCT-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@@H](CO)[C@H](CO)C3)c2c1	ZINC000601200453	358445287	/nfs/dbraw/zinc/44/52/87/358445287.db2.gz	ATZQEERHMLKPEM-QWRGUYRKSA-N	1	1	303.318	1.180	20	5		DDBDMO
C[C@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@H+](C)CCO1	ZINC000601130822	358415658	/nfs/dbraw/zinc/41/56/58/358415658.db2.gz	CHCBZVWZOUYXHE-MEDUHNTESA-N	1	1	316.361	1.696	20	5		DDBDMO
C[C@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@@H+](C)CCO1	ZINC000601130822	358415663	/nfs/dbraw/zinc/41/56/63/358415663.db2.gz	CHCBZVWZOUYXHE-MEDUHNTESA-N	1	1	316.361	1.696	20	5		DDBDMO
O=C1CC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CCN12	ZINC000601136732	358416792	/nfs/dbraw/zinc/41/67/92/358416792.db2.gz	WNCDJDQERPKUDS-LBPRGKRZSA-N	1	1	312.329	1.954	20	5		DDBDMO
CNC(=O)[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1	ZINC000601175950	358433917	/nfs/dbraw/zinc/43/39/17/358433917.db2.gz	RWGQYNULBCXKCP-SNVBAGLBSA-N	1	1	300.318	1.715	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000601540526	358594138	/nfs/dbraw/zinc/59/41/38/358594138.db2.gz	TWYFOMHWZFQZIV-UHFFFAOYSA-N	1	1	319.296	1.419	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000601774748	358690043	/nfs/dbraw/zinc/69/00/43/358690043.db2.gz	DJZOKPUHORONQY-DJSGYFEHSA-N	1	1	321.377	1.259	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601777815	358691412	/nfs/dbraw/zinc/69/14/12/358691412.db2.gz	LMZMPZYIYWHGGL-HIFRSBDPSA-N	1	1	307.350	1.013	20	5		DDBDMO
CN(CC[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-])c1ccccc1	ZINC000602477832	359004677	/nfs/dbraw/zinc/00/46/77/359004677.db2.gz	XINGUZQRNYEQSZ-UHFFFAOYSA-N	1	1	303.366	1.897	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-])c1ccccc1	ZINC000602477832	359004681	/nfs/dbraw/zinc/00/46/81/359004681.db2.gz	XINGUZQRNYEQSZ-UHFFFAOYSA-N	1	1	303.366	1.897	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681234	359121488	/nfs/dbraw/zinc/12/14/88/359121488.db2.gz	MWKSYFYJSHXJTO-VXNVDRBHSA-N	1	1	308.260	1.073	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681234	359121492	/nfs/dbraw/zinc/12/14/92/359121492.db2.gz	MWKSYFYJSHXJTO-VXNVDRBHSA-N	1	1	308.260	1.073	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602767113	359177011	/nfs/dbraw/zinc/17/70/11/359177011.db2.gz	VZCKVANTSDTRQW-ZDUSSCGKSA-N	1	1	323.397	1.338	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1	ZINC000602801072	359201173	/nfs/dbraw/zinc/20/11/73/359201173.db2.gz	LFFDODLLVLXTAS-OLZOCXBDSA-N	1	1	310.398	1.829	20	5		DDBDMO
COCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccccn1	ZINC000602825482	359220171	/nfs/dbraw/zinc/22/01/71/359220171.db2.gz	BMUFKLWNZQSUCV-UHFFFAOYSA-N	1	1	319.365	1.643	20	5		DDBDMO
COCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccccn1	ZINC000602825482	359220177	/nfs/dbraw/zinc/22/01/77/359220177.db2.gz	BMUFKLWNZQSUCV-UHFFFAOYSA-N	1	1	319.365	1.643	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000602959329	359323051	/nfs/dbraw/zinc/32/30/51/359323051.db2.gz	SUJPMPJAUBQYMH-VXGBXAGGSA-N	1	1	321.381	1.667	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccncc1)c1ncc([N+](=O)[O-])cn1	ZINC000603399575	359616709	/nfs/dbraw/zinc/61/67/09/359616709.db2.gz	GSKAOSFFXWHWIP-UHFFFAOYSA-N	1	1	316.365	1.738	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccc([N+](=O)[O-])cc1	ZINC000189406241	200396089	/nfs/dbraw/zinc/39/60/89/200396089.db2.gz	QIEIOELOTMEHPY-ZDUSSCGKSA-N	1	1	307.394	1.872	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000609283850	360286519	/nfs/dbraw/zinc/28/65/19/360286519.db2.gz	FREMKTLZMUTXFV-UKRRQHHQSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000609450186	360307938	/nfs/dbraw/zinc/30/79/38/360307938.db2.gz	HFCHPKKWYYBAGU-NSHDSACASA-N	1	1	318.377	1.945	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000609450186	360307941	/nfs/dbraw/zinc/30/79/41/360307941.db2.gz	HFCHPKKWYYBAGU-NSHDSACASA-N	1	1	318.377	1.945	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3cccnc3[N+](=O)[O-])C2)CC1	ZINC000609571064	360326228	/nfs/dbraw/zinc/32/62/28/360326228.db2.gz	MPRYIBUDMAUPJL-LBPRGKRZSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@H](Nc3cccnc3[N+](=O)[O-])C2)CC1	ZINC000609571064	360326232	/nfs/dbraw/zinc/32/62/32/360326232.db2.gz	MPRYIBUDMAUPJL-LBPRGKRZSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN(C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CCC[N@@H+](C)C1	ZINC000610187912	360389517	/nfs/dbraw/zinc/38/95/17/360389517.db2.gz	XBMCJZUORWAQMV-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[N@H+]1C1CC1	ZINC000610654056	360492643	/nfs/dbraw/zinc/49/26/43/360492643.db2.gz	GVVMHBIWPJJXLJ-MNOVXSKESA-N	1	1	321.381	1.268	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000611166003	360642582	/nfs/dbraw/zinc/64/25/82/360642582.db2.gz	VWDDRDNFQUXWOG-UHFFFAOYSA-N	1	1	321.377	1.052	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000611088490	360619579	/nfs/dbraw/zinc/61/95/79/360619579.db2.gz	ZGJLAAPFXSAASL-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000611088490	360619585	/nfs/dbraw/zinc/61/95/85/360619585.db2.gz	ZGJLAAPFXSAASL-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611100473	360623070	/nfs/dbraw/zinc/62/30/70/360623070.db2.gz	GLFCHJPYLPDAFV-NSHDSACASA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611100473	360623080	/nfs/dbraw/zinc/62/30/80/360623080.db2.gz	GLFCHJPYLPDAFV-NSHDSACASA-N	1	1	320.349	1.086	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@@H]3CCOC3)CC2)c1	ZINC000611104209	360624276	/nfs/dbraw/zinc/62/42/76/360624276.db2.gz	NFWQKBISIRSGSA-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)c(F)c1	ZINC000611349075	360703330	/nfs/dbraw/zinc/70/33/30/360703330.db2.gz	VFWVWZNAQOYFHO-CQSZACIVSA-N	1	1	309.341	1.640	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000611528148	360749151	/nfs/dbraw/zinc/74/91/51/360749151.db2.gz	HSKNWXBCPKTFMS-LLVKDONJSA-N	1	1	322.365	1.018	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cc([O-])cc([N+](=O)[O-])c2)C1	ZINC000611556116	360759221	/nfs/dbraw/zinc/75/92/21/360759221.db2.gz	IEUMILWRLSRWIU-LBPRGKRZSA-N	1	1	323.349	1.141	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000611556116	360759226	/nfs/dbraw/zinc/75/92/26/360759226.db2.gz	IEUMILWRLSRWIU-LBPRGKRZSA-N	1	1	323.349	1.141	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H](C(F)F)C1	ZINC000612110346	360922964	/nfs/dbraw/zinc/92/29/64/360922964.db2.gz	DLVXILPDBGJFGS-WDEREUQCSA-N	1	1	316.304	1.922	20	5		DDBDMO
COc1c(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440430	364009938	/nfs/dbraw/zinc/00/99/38/364009938.db2.gz	GRFLTXONQVHRKC-GWCFXTLKSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440430	364009942	/nfs/dbraw/zinc/00/99/42/364009942.db2.gz	GRFLTXONQVHRKC-GWCFXTLKSA-N	1	1	323.349	1.052	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000275487481	212367088	/nfs/dbraw/zinc/36/70/88/212367088.db2.gz	PFAXJPDBKVLGFW-AWEZNQCLSA-N	1	1	321.377	1.650	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000275487481	212367089	/nfs/dbraw/zinc/36/70/89/212367089.db2.gz	PFAXJPDBKVLGFW-AWEZNQCLSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCc2ccccc21	ZINC000266419209	205332814	/nfs/dbraw/zinc/33/28/14/205332814.db2.gz	IKDZKBBSJWMWAF-ZBFHGGJFSA-N	1	1	316.361	1.772	20	5		DDBDMO
C[NH+]1CCN(CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000023991025	182371539	/nfs/dbraw/zinc/37/15/39/182371539.db2.gz	BGVPZYUGARUIBC-UHFFFAOYSA-N	1	1	312.757	1.434	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1	ZINC000566970901	304190633	/nfs/dbraw/zinc/19/06/33/304190633.db2.gz	FTBPAXBKLFNIOO-UKRRQHHQSA-N	1	1	321.377	1.648	20	5		DDBDMO
C[C@H](NCC1([NH+](C)C)CCOCC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000283884244	217796746	/nfs/dbraw/zinc/79/67/46/217796746.db2.gz	CFNAEXQJGOIBRD-LBPRGKRZSA-N	1	1	322.409	1.938	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000104747414	194034097	/nfs/dbraw/zinc/03/40/97/194034097.db2.gz	UXYNTEYXEOSPTL-LLVKDONJSA-N	1	1	313.379	1.167	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000106384470	194203918	/nfs/dbraw/zinc/20/39/18/194203918.db2.gz	LEUUGHXPFCNKDJ-AWEZNQCLSA-N	1	1	307.350	1.124	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@H]2CC[N@H+](C)C[C@H]21	ZINC000285326943	218383104	/nfs/dbraw/zinc/38/31/04/218383104.db2.gz	RWOZACUMANJVNN-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000109627640	194278824	/nfs/dbraw/zinc/27/88/24/194278824.db2.gz	CEFPXMCMPQNQFO-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000109992238	194302668	/nfs/dbraw/zinc/30/26/68/194302668.db2.gz	YGICHSORFYNEOZ-SNVBAGLBSA-N	1	1	323.349	1.294	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938472	251290513	/nfs/dbraw/zinc/29/05/13/251290513.db2.gz	WHOZVUHOZSRWBW-JOYOIKCWSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938472	251290518	/nfs/dbraw/zinc/29/05/18/251290518.db2.gz	WHOZVUHOZSRWBW-JOYOIKCWSA-N	1	1	304.306	1.600	20	5		DDBDMO
COCC[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000430223593	532966736	/nfs/dbraw/zinc/96/67/36/532966736.db2.gz	XTJDSNGCTXMBIO-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000424105035	533092794	/nfs/dbraw/zinc/09/27/94/533092794.db2.gz	IMVAZYNEWOVCAV-UHFFFAOYSA-N	1	1	310.354	1.106	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@H]1CCC[C@@H]1O	ZINC000352659459	285203830	/nfs/dbraw/zinc/20/38/30/285203830.db2.gz	JQPMKXHCGYSHGD-SWHYSGLUSA-N	1	1	307.350	1.767	20	5		DDBDMO
C[C@@H](O)C[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000156338795	197105350	/nfs/dbraw/zinc/10/53/50/197105350.db2.gz	PIKKIWQMXUIJEW-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000156338795	197105351	/nfs/dbraw/zinc/10/53/51/197105351.db2.gz	PIKKIWQMXUIJEW-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](O)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000156328587	197104488	/nfs/dbraw/zinc/10/44/88/197104488.db2.gz	OXNUTDWMENWLEY-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000156328587	197104489	/nfs/dbraw/zinc/10/44/89/197104489.db2.gz	OXNUTDWMENWLEY-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)C[C@@H](C)O	ZINC000289772951	221215407	/nfs/dbraw/zinc/21/54/07/221215407.db2.gz	LKEMCJFDVSCCDO-GFCCVEGCSA-N	1	1	312.366	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)C[C@@H](C)O	ZINC000289772951	221215409	/nfs/dbraw/zinc/21/54/09/221215409.db2.gz	LKEMCJFDVSCCDO-GFCCVEGCSA-N	1	1	312.366	1.557	20	5		DDBDMO
O=C1NCCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000295030204	224391134	/nfs/dbraw/zinc/39/11/34/224391134.db2.gz	LNNCZWULEDRILV-JTQLQIEISA-N	1	1	315.276	1.564	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330915845	533603541	/nfs/dbraw/zinc/60/35/41/533603541.db2.gz	URUDUWLRVLFSNW-NEPJUHHUSA-N	1	1	306.366	1.606	20	5		DDBDMO
Cc1c(CC(=O)N2CC[NH2+]C[C@@H]2C(F)F)cccc1[N+](=O)[O-]	ZINC000568856994	304315946	/nfs/dbraw/zinc/31/59/46/304315946.db2.gz	JDIAPHCBGGXWIN-GFCCVEGCSA-N	1	1	313.304	1.511	20	5		DDBDMO
Cc1ccnc([C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)c1	ZINC000569739210	304376220	/nfs/dbraw/zinc/37/62/20/304376220.db2.gz	LHQSCHXQXSSHPZ-ZDUSSCGKSA-N	1	1	301.350	1.984	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)CNc1ccccc1[N+](=O)[O-])C2	ZINC000073992363	406899538	/nfs/dbraw/zinc/89/95/38/406899538.db2.gz	FSLITHSRTDWSPD-QWHCGFSZSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCC[C@@H](C)C1	ZINC000068084339	407294535	/nfs/dbraw/zinc/29/45/35/407294535.db2.gz	STEKDNZZAHAXKO-NEPJUHHUSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000107894248	407381129	/nfs/dbraw/zinc/38/11/29/407381129.db2.gz	BDRMFZCXPUSGFH-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
O=C(CC[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2)Nc1ccccc1[N+](=O)[O-]	ZINC000111319339	407407479	/nfs/dbraw/zinc/40/74/79/407407479.db2.gz	PNRBYEPIAVRGDN-FUNVUKJBSA-N	1	1	319.361	1.911	20	5		DDBDMO
CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2	ZINC000126328553	407410680	/nfs/dbraw/zinc/41/06/80/407410680.db2.gz	MRKAKARDLYILJQ-WDEREUQCSA-N	1	1	307.354	1.405	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000112364059	407427692	/nfs/dbraw/zinc/42/76/92/407427692.db2.gz	VIUUMVXFHZZCTI-UHFFFAOYSA-N	1	1	315.395	1.605	20	5		DDBDMO
C[C@H]([C@@H](C)S(C)(=O)=O)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000113257610	407481142	/nfs/dbraw/zinc/48/11/42/407481142.db2.gz	KXEYFDPZQHLKTI-VXGBXAGGSA-N	1	1	314.407	1.891	20	5		DDBDMO
C[C@H]([C@@H](C)S(C)(=O)=O)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000113257610	407481147	/nfs/dbraw/zinc/48/11/47/407481147.db2.gz	KXEYFDPZQHLKTI-VXGBXAGGSA-N	1	1	314.407	1.891	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000171062722	407584187	/nfs/dbraw/zinc/58/41/87/407584187.db2.gz	QZJOFKZFTHZQKH-GFCCVEGCSA-N	1	1	321.333	1.079	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000171062722	407584193	/nfs/dbraw/zinc/58/41/93/407584193.db2.gz	QZJOFKZFTHZQKH-GFCCVEGCSA-N	1	1	321.333	1.079	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+]C[C@H]2c2cccnc2)ccc1[N+](=O)[O-]	ZINC000261718221	407589168	/nfs/dbraw/zinc/58/91/68/407589168.db2.gz	KYFGEWIISAVGNM-ZDUSSCGKSA-N	1	1	315.333	1.115	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000262034280	407719924	/nfs/dbraw/zinc/71/99/24/407719924.db2.gz	SRTSVAJICJNNOC-CYBMUJFWSA-N	1	1	301.306	1.105	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CCO)c1ccccc1	ZINC000267043198	407727254	/nfs/dbraw/zinc/72/72/54/407727254.db2.gz	DMIYLMLUYPJDOX-AWEZNQCLSA-N	1	1	304.350	1.847	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)CC[N@@H+](C)C1CC1	ZINC000186726374	407758864	/nfs/dbraw/zinc/75/88/64/407758864.db2.gz	HXBOZKPDGGJZCE-UHFFFAOYSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000245854044	408080806	/nfs/dbraw/zinc/08/08/06/408080806.db2.gz	DHDIXYGCFMVVKX-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000150103523	408193356	/nfs/dbraw/zinc/19/33/56/408193356.db2.gz	SOJYVZZJYDSPMG-UHFFFAOYSA-N	1	1	306.366	1.243	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000190345699	408225060	/nfs/dbraw/zinc/22/50/60/408225060.db2.gz	QPTVSRPXTLNHJM-YGRLFVJLSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000190345699	408225061	/nfs/dbraw/zinc/22/50/61/408225061.db2.gz	QPTVSRPXTLNHJM-YGRLFVJLSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000190365696	408228809	/nfs/dbraw/zinc/22/88/09/408228809.db2.gz	IXZDEASTPPHPHQ-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
Cn1cc[nH+]c1Cn1c(=O)onc1-c1ccc([N+](=O)[O-])cc1	ZINC000132289223	162033844	/nfs/dbraw/zinc/03/38/44/162033844.db2.gz	GOQPPAMRJHBMRG-UHFFFAOYSA-N	1	1	301.262	1.193	20	5		DDBDMO
CCOCC[NH+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000173657314	162352793	/nfs/dbraw/zinc/35/27/93/162352793.db2.gz	KPBFWPWMOHZGJW-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000247369727	408459319	/nfs/dbraw/zinc/45/93/19/408459319.db2.gz	KRXSLTVHWKYVIE-QWHCGFSZSA-N	1	1	321.377	1.772	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177033686	408503198	/nfs/dbraw/zinc/50/31/98/408503198.db2.gz	SMCLSNVZAAOGAC-VXGBXAGGSA-N	1	1	318.377	1.748	20	5		DDBDMO
CC[C@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000247392448	408462930	/nfs/dbraw/zinc/46/29/30/408462930.db2.gz	XGLYJJYLFLZQPJ-ZFWWWQNUSA-N	1	1	307.394	1.872	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000161297884	408584020	/nfs/dbraw/zinc/58/40/20/408584020.db2.gz	DGQAWKPSBNGHOA-JQWIXIFHSA-N	1	1	306.366	1.636	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000161403914	408600659	/nfs/dbraw/zinc/60/06/59/408600659.db2.gz	MIJYZYZAUUQHTQ-ONGXEEELSA-N	1	1	309.370	1.095	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000270872993	408719203	/nfs/dbraw/zinc/71/92/03/408719203.db2.gz	JLEMJKCGSARHGN-CYBMUJFWSA-N	1	1	319.361	1.670	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000177842800	408728648	/nfs/dbraw/zinc/72/86/48/408728648.db2.gz	QBSBOWGDUCLFAG-SWLSCSKDSA-N	1	1	321.377	1.801	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000177842800	408728654	/nfs/dbraw/zinc/72/86/54/408728654.db2.gz	QBSBOWGDUCLFAG-SWLSCSKDSA-N	1	1	321.377	1.801	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)[C@@H](C)C1	ZINC000249536715	408738359	/nfs/dbraw/zinc/73/83/59/408738359.db2.gz	CQJOBKLCANJOJP-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@](C)(O)C1	ZINC000177980402	408750107	/nfs/dbraw/zinc/75/01/07/408750107.db2.gz	IDWPOWZMNKULKY-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000290839172	408841246	/nfs/dbraw/zinc/84/12/46/408841246.db2.gz	VQPLXSDNOHAHHA-GXSJLCMTSA-N	1	1	304.350	1.731	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1	ZINC000285767960	408860191	/nfs/dbraw/zinc/86/01/91/408860191.db2.gz	ZWVCYQSYRKDWIE-LLVKDONJSA-N	1	1	322.287	1.571	20	5		DDBDMO
COC(=O)c1cnc(N2CC[NH+](C(C)C)CC2)c([N+](=O)[O-])c1	ZINC000276636018	408894152	/nfs/dbraw/zinc/89/41/52/408894152.db2.gz	WXRYMTRYMAPWQD-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC(F)(F)[C@H](CO)C2)c1	ZINC000291749675	408916603	/nfs/dbraw/zinc/91/66/03/408916603.db2.gz	KLEZNGPASRVKMM-WCQYABFASA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC(F)(F)[C@H](CO)C2)c1	ZINC000291749675	408916606	/nfs/dbraw/zinc/91/66/06/408916606.db2.gz	KLEZNGPASRVKMM-WCQYABFASA-N	1	1	316.304	1.578	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190860858	163162295	/nfs/dbraw/zinc/16/22/95/163162295.db2.gz	XNAXAFUMIYSNRX-NEPJUHHUSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190860858	163162296	/nfs/dbraw/zinc/16/22/96/163162296.db2.gz	XNAXAFUMIYSNRX-NEPJUHHUSA-N	1	1	307.350	1.402	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](OCc3ccncc3)C2)c1	ZINC000287726290	409083315	/nfs/dbraw/zinc/08/33/15/409083315.db2.gz	KJHLIVVVWZCAFS-HNNXBMFYSA-N	1	1	317.349	1.477	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000321723613	164045340	/nfs/dbraw/zinc/04/53/40/164045340.db2.gz	ZXTUUSQAZQLYMG-CHWSQXEVSA-N	1	1	318.377	1.993	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000331536068	409611034	/nfs/dbraw/zinc/61/10/34/409611034.db2.gz	PWWSKSKGHUIPHR-JTQLQIEISA-N	1	1	305.334	1.570	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(c3nc(C)cc(C)c3[N+](=O)[O-])[C@H]2C1	ZINC000338734768	410033344	/nfs/dbraw/zinc/03/33/44/410033344.db2.gz	SZHZXKIUGRLADI-UONOGXRCSA-N	1	1	320.393	1.906	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000354664320	410003073	/nfs/dbraw/zinc/00/30/73/410003073.db2.gz	QLWMGJWPHVGUCC-NXEZZACHSA-N	1	1	309.370	1.619	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@H](C)C1	ZINC000332351229	410086686	/nfs/dbraw/zinc/08/66/86/410086686.db2.gz	PJTGIVKPGZMIMR-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@@H](C)C1	ZINC000332351229	410086692	/nfs/dbraw/zinc/08/66/92/410086692.db2.gz	PJTGIVKPGZMIMR-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCN(CCO)CC1	ZINC000357643743	410157263	/nfs/dbraw/zinc/15/72/63/410157263.db2.gz	BIFQVUKBLQGNKA-UHFFFAOYSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000351774895	410225177	/nfs/dbraw/zinc/22/51/77/410225177.db2.gz	PGFPHEDEWSVUPT-MFKMUULPSA-N	1	1	321.333	1.205	20	5		DDBDMO
C[C@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)[NH+]1C	ZINC000343482767	410486180	/nfs/dbraw/zinc/48/61/80/410486180.db2.gz	VVKWNKJSUZFKKC-QWRGUYRKSA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CCC[N@H+]1C	ZINC000343427198	410440862	/nfs/dbraw/zinc/44/08/62/410440862.db2.gz	DQVDDGJGHLUTHY-ZYHUDNBSSA-N	1	1	309.370	1.125	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000299079969	410511712	/nfs/dbraw/zinc/51/17/12/410511712.db2.gz	HAPSXFFRIPEXDP-GHMZBOCLSA-N	1	1	321.381	1.621	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000330492131	410725167	/nfs/dbraw/zinc/72/51/67/410725167.db2.gz	PEFMTWDGYOOPNH-UHFFFAOYSA-N	1	1	311.338	1.107	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[C@H]1C[N@@H+]1CCC[C@H]1CO	ZINC000301530277	410739244	/nfs/dbraw/zinc/73/92/44/410739244.db2.gz	KWBFAPNDMVVBMY-STQMWFEESA-N	1	1	306.366	1.415	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc([N+](=O)[O-])cnc2C)[N@@H+](C)C1	ZINC000330515443	410743519	/nfs/dbraw/zinc/74/35/19/410743519.db2.gz	FKGTWVYANKUJCM-STQMWFEESA-N	1	1	322.365	1.089	20	5		DDBDMO
CC[C@]1(C)COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762176	410677281	/nfs/dbraw/zinc/67/72/81/410677281.db2.gz	KUQLDNKEIYNLCT-CZUORRHYSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762176	410677290	/nfs/dbraw/zinc/67/72/90/410677290.db2.gz	KUQLDNKEIYNLCT-CZUORRHYSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1ccc([C@@H](CCO)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1	ZINC000341229084	410953933	/nfs/dbraw/zinc/95/39/33/410953933.db2.gz	OIZKZJSQXCNCGB-CYBMUJFWSA-N	1	1	320.349	1.550	20	5		DDBDMO
NC(=O)c1cccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000341722580	411052841	/nfs/dbraw/zinc/05/28/41/411052841.db2.gz	OLOKNUXTFQUVRJ-GHMZBOCLSA-N	1	1	304.350	1.732	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C)[C@@H]1CO	ZINC000133026708	196306392	/nfs/dbraw/zinc/30/63/92/196306392.db2.gz	DFIMTDQAFADQER-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@@H]1CO	ZINC000133026708	196306394	/nfs/dbraw/zinc/30/63/94/196306394.db2.gz	DFIMTDQAFADQER-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000188302372	222010679	/nfs/dbraw/zinc/01/06/79/222010679.db2.gz	KKMWWQPWJMKGPQ-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000188302372	222010682	/nfs/dbraw/zinc/01/06/82/222010682.db2.gz	KKMWWQPWJMKGPQ-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(C(=O)N2CCC[N@H+]([C@@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000364937291	418824654	/nfs/dbraw/zinc/82/46/54/418824654.db2.gz	QHHFNVAXVFZYLV-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1nc([C@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365725783	418900197	/nfs/dbraw/zinc/90/01/97/418900197.db2.gz	UWQHXAFYLJYYLO-NSHDSACASA-N	1	1	306.326	1.362	20	5		DDBDMO
Cc1nc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365725783	418900199	/nfs/dbraw/zinc/90/01/99/418900199.db2.gz	UWQHXAFYLJYYLO-NSHDSACASA-N	1	1	306.326	1.362	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000426240297	419417449	/nfs/dbraw/zinc/41/74/49/419417449.db2.gz	TZPCOTOLOVBEIR-LLVKDONJSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000426240297	419417453	/nfs/dbraw/zinc/41/74/53/419417453.db2.gz	TZPCOTOLOVBEIR-LLVKDONJSA-N	1	1	323.349	1.389	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@H]2CCO)c1	ZINC000426254576	419423546	/nfs/dbraw/zinc/42/35/46/419423546.db2.gz	DZLRASKILOYYJZ-JSGCOSHPSA-N	1	1	310.350	1.181	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C(C)C)CC2)n1	ZINC000427448149	419661714	/nfs/dbraw/zinc/66/17/14/419661714.db2.gz	FLTHHCVNGUQSHS-UHFFFAOYSA-N	1	1	309.370	1.368	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000421699027	419685179	/nfs/dbraw/zinc/68/51/79/419685179.db2.gz	ABSJOZTUKWHEMM-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1cccc(NCCNc2ccc(C(N)=O)cc2[N+](=O)[O-])[nH+]1	ZINC000427417220	419654842	/nfs/dbraw/zinc/65/48/42/419654842.db2.gz	ZEXINJHKKIJXSH-UHFFFAOYSA-N	1	1	315.333	1.921	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000299470089	229137233	/nfs/dbraw/zinc/13/72/33/229137233.db2.gz	BHEQUHMMTZGVCE-CHWSQXEVSA-N	1	1	321.381	1.233	20	5		DDBDMO
CC(C)[C@@H]([NH3+])CN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268591	419999412	/nfs/dbraw/zinc/99/94/12/419999412.db2.gz	GPSPLAYWGIKICB-FZMZJTMJSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@@H](N)C[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268591	419999415	/nfs/dbraw/zinc/99/94/15/419999415.db2.gz	GPSPLAYWGIKICB-FZMZJTMJSA-N	1	1	308.382	1.885	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000430220352	420091927	/nfs/dbraw/zinc/09/19/27/420091927.db2.gz	PONVLIBKROVKEB-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]([NH3+])[C@H](C)C1	ZINC000430919279	420204328	/nfs/dbraw/zinc/20/43/28/420204328.db2.gz	PVUPFVBIAPJKON-TZMCWYRMSA-N	1	1	320.393	1.901	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000416296424	420312558	/nfs/dbraw/zinc/31/25/58/420312558.db2.gz	NVKSLGUSTQTOLW-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000420802936	420396567	/nfs/dbraw/zinc/39/65/67/420396567.db2.gz	SMTSJETYNHFPAC-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000416498437	420396595	/nfs/dbraw/zinc/39/65/95/420396595.db2.gz	XHHJLIYHAAYOQX-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ncnc2sc([N+](=O)[O-])cc21	ZINC000450950243	420569022	/nfs/dbraw/zinc/56/90/22/420569022.db2.gz	CHNONMDLMHPDDN-VIFPVBQESA-N	1	1	323.378	1.102	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@]2(CCSC2)C1	ZINC000451986023	420618973	/nfs/dbraw/zinc/61/89/73/420618973.db2.gz	XDPNTZHYTRKKNM-HNNXBMFYSA-N	1	1	323.418	1.976	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000457120163	420621522	/nfs/dbraw/zinc/62/15/22/420621522.db2.gz	NTUJWDPMLKJMSV-LLVKDONJSA-N	1	1	324.356	1.871	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000442309765	420678492	/nfs/dbraw/zinc/67/84/92/420678492.db2.gz	UDOXXMQARJQSRQ-GHMZBOCLSA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000442309765	420678495	/nfs/dbraw/zinc/67/84/95/420678495.db2.gz	UDOXXMQARJQSRQ-GHMZBOCLSA-N	1	1	320.349	1.084	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000448058398	420835288	/nfs/dbraw/zinc/83/52/88/420835288.db2.gz	NECSRGCREKQWFY-WCQYABFASA-N	1	1	305.382	1.781	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000454735380	420917218	/nfs/dbraw/zinc/91/72/18/420917218.db2.gz	KHAWYYBNRWHFIJ-NSHDSACASA-N	1	1	321.381	1.636	20	5		DDBDMO
C[C@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000487740064	421047702	/nfs/dbraw/zinc/04/77/02/421047702.db2.gz	OISMXIVUYPDMPC-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455657472	421050347	/nfs/dbraw/zinc/05/03/47/421050347.db2.gz	MFEZJUZEXLUVAZ-GHMZBOCLSA-N	1	1	319.365	1.340	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000487494259	421030962	/nfs/dbraw/zinc/03/09/62/421030962.db2.gz	DDJFZZMCEULKSW-KOLCDFICSA-N	1	1	317.349	1.285	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000455996170	421086008	/nfs/dbraw/zinc/08/60/08/421086008.db2.gz	OZMSABPLEXPVTN-GXFFZTMASA-N	1	1	319.365	1.198	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000456039694	421092170	/nfs/dbraw/zinc/09/21/70/421092170.db2.gz	MVBYDWHFLRVSQS-ZDUSSCGKSA-N	1	1	321.381	1.444	20	5		DDBDMO
Cc1nc(NC[C@H](CC(C)C)[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000450245930	421170658	/nfs/dbraw/zinc/17/06/58/421170658.db2.gz	SHNXOOCWDVMLMV-ZDUSSCGKSA-N	1	1	323.397	1.852	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+]2CCCO)n1	ZINC000450598852	421215334	/nfs/dbraw/zinc/21/53/34/421215334.db2.gz	RSCVMKZHEPBCOW-ZDUSSCGKSA-N	1	1	308.382	1.865	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C	ZINC000548403849	421433710	/nfs/dbraw/zinc/43/37/10/421433710.db2.gz	HDWYBMFEWHFEPW-ZDUSSCGKSA-N	1	1	308.382	1.784	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]nc1[N+](=O)[O-]	ZINC000549370670	421500360	/nfs/dbraw/zinc/50/03/60/421500360.db2.gz	ZYFYAQRZTCAJNI-LBPRGKRZSA-N	1	1	321.381	1.845	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000549638908	421504330	/nfs/dbraw/zinc/50/43/30/421504330.db2.gz	DGQTZCHJUUJBLG-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1c1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000549638908	421504331	/nfs/dbraw/zinc/50/43/31/421504331.db2.gz	DGQTZCHJUUJBLG-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000516853153	421570232	/nfs/dbraw/zinc/57/02/32/421570232.db2.gz	BFLVUUHPTDZSST-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000516853153	421570235	/nfs/dbraw/zinc/57/02/35/421570235.db2.gz	BFLVUUHPTDZSST-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000553785426	421625917	/nfs/dbraw/zinc/62/59/17/421625917.db2.gz	ZEFLTRVISQPIRV-SLEUVZQESA-N	1	1	318.377	1.792	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)C(C)(C)C1	ZINC000556084582	421700245	/nfs/dbraw/zinc/70/02/45/421700245.db2.gz	GIGQFUGPQATWFN-LBPRGKRZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[C@@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000519643618	421712873	/nfs/dbraw/zinc/71/28/73/421712873.db2.gz	WSUGYLISVYPOJL-STQMWFEESA-N	1	1	320.393	1.996	20	5		DDBDMO
COC(=O)c1cnc(NC[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000572090481	421764026	/nfs/dbraw/zinc/76/40/26/421764026.db2.gz	LEQJCYNAQOXHNM-SNVBAGLBSA-N	1	1	320.349	1.673	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000572185640	421768665	/nfs/dbraw/zinc/76/86/65/421768665.db2.gz	VEGHCHGOZMSKAC-LLVKDONJSA-N	1	1	304.354	1.780	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000521884217	421805067	/nfs/dbraw/zinc/80/50/67/421805067.db2.gz	GPNFUUKHNFTCNT-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H](N3CCOCC3)C2)cc1	ZINC000584239709	422291521	/nfs/dbraw/zinc/29/15/21/422291521.db2.gz	JPPKYBMCJRXAON-INIZCTEOSA-N	1	1	305.378	1.891	20	5		DDBDMO
CCCN(C(=O)c1ccnc(NC)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000594373842	422347677	/nfs/dbraw/zinc/34/76/77/422347677.db2.gz	INSAVPVLOLSJBK-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
COC(=O)c1ccnc(NCC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000598629751	422398068	/nfs/dbraw/zinc/39/80/68/422398068.db2.gz	PGKAKMFMFBLYJS-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@]1(O)CC[N@@H+](C)C1	ZINC000344869431	272132473	/nfs/dbraw/zinc/13/24/73/272132473.db2.gz	RSIKXSZJQXYRFY-WDBUWWRISA-N	1	1	305.378	1.654	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@]1(O)CC[N@H+](C)C1	ZINC000344869431	272132475	/nfs/dbraw/zinc/13/24/75/272132475.db2.gz	RSIKXSZJQXYRFY-WDBUWWRISA-N	1	1	305.378	1.654	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000345282721	272208288	/nfs/dbraw/zinc/20/82/88/272208288.db2.gz	GQZPHLHXPBGOES-UWVGGRQHSA-N	1	1	309.370	1.483	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000285989939	274004484	/nfs/dbraw/zinc/00/44/84/274004484.db2.gz	CPFDUMKQNWKDJJ-SNVBAGLBSA-N	1	1	306.322	1.061	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCNC1=O	ZINC000411692357	276121993	/nfs/dbraw/zinc/12/19/93/276121993.db2.gz	JZVUSVAGNACHDM-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073128	300000583	/nfs/dbraw/zinc/00/05/83/300000583.db2.gz	UHYUGJWVKWSEHX-GHMZBOCLSA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073128	300000584	/nfs/dbraw/zinc/00/05/84/300000584.db2.gz	UHYUGJWVKWSEHX-GHMZBOCLSA-N	1	1	323.349	1.102	20	5		DDBDMO
O=C1C[NH2+]CCN1[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1	ZINC000362699971	300118016	/nfs/dbraw/zinc/11/80/16/300118016.db2.gz	XFEUHDOGPQCDLV-GFCCVEGCSA-N	1	1	324.406	1.053	20	5		DDBDMO
O=[N+]([O-])c1ccn(C2CCN(c3[nH+]cnc4[nH]ccc43)CC2)n1	ZINC000368467468	301034785	/nfs/dbraw/zinc/03/47/85/301034785.db2.gz	AULIUEZJCLQSOQ-UHFFFAOYSA-N	1	1	313.321	1.904	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000368557878	301051851	/nfs/dbraw/zinc/05/18/51/301051851.db2.gz	RHPNRQCZJDPMFF-NSHDSACASA-N	1	1	315.276	1.039	20	5		DDBDMO
CN1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C[C@@H]1c1ccccc1Cl	ZINC000377123228	302146055	/nfs/dbraw/zinc/14/60/55/302146055.db2.gz	OPKBEFNHOBRNLD-KWCYVHTRSA-N	1	1	323.780	1.820	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc32)C1	ZINC000378270551	302306220	/nfs/dbraw/zinc/30/62/20/302306220.db2.gz	SCLIXEJKNKOHKL-SECBINFHSA-N	1	1	314.305	1.858	20	5		DDBDMO
Cc1sc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)cc1[N+](=O)[O-]	ZINC000547734215	303550066	/nfs/dbraw/zinc/55/00/66/303550066.db2.gz	ROPOFWLDZPXKRM-UHFFFAOYSA-N	1	1	321.362	1.650	20	5		DDBDMO
COc1cccc(N2CCC[N@H+]([C@H](C)CO)CC2)c1[N+](=O)[O-]	ZINC000364976288	307055751	/nfs/dbraw/zinc/05/57/51/307055751.db2.gz	DNDLKTBZEIFXGP-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365115561	307059054	/nfs/dbraw/zinc/05/90/54/307059054.db2.gz	ZTSFIBGLJOAREM-ZBEGNZNMSA-N	1	1	319.361	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365115561	307059055	/nfs/dbraw/zinc/05/90/55/307059055.db2.gz	ZTSFIBGLJOAREM-ZBEGNZNMSA-N	1	1	319.361	1.769	20	5		DDBDMO
CN(C(=O)[C@H]1CC1[N+](=O)[O-])C1CCN(c2cc[nH+]cc2)CC1	ZINC000368929735	307112987	/nfs/dbraw/zinc/11/29/87/307112987.db2.gz	IUUBTYVEHXKFDL-KBPBESRZSA-N	1	1	304.350	1.174	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](O)C2(CC2)C1	ZINC000373514605	307189670	/nfs/dbraw/zinc/18/96/70/307189670.db2.gz	UYZVHVCRXBTXFZ-MFKMUULPSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](O)C2(CC2)C1	ZINC000373514605	307189671	/nfs/dbraw/zinc/18/96/71/307189671.db2.gz	UYZVHVCRXBTXFZ-MFKMUULPSA-N	1	1	305.334	1.379	20	5		DDBDMO
COc1ccc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cc1[N+](=O)[O-]	ZINC000567718523	308092228	/nfs/dbraw/zinc/09/22/28/308092228.db2.gz	DJVZJGAIECRGOF-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000571263526	308192810	/nfs/dbraw/zinc/19/28/10/308192810.db2.gz	FLZDGTPQOAMEIC-MFKMUULPSA-N	1	1	319.365	1.407	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488805474	484218381	/nfs/dbraw/zinc/21/83/81/484218381.db2.gz	SUJWOHPLVDOQEA-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595875515	490372153	/nfs/dbraw/zinc/37/21/53/490372153.db2.gz	QIPYMBLZMCVMNE-XHDPSFHLSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595875515	490372157	/nfs/dbraw/zinc/37/21/57/490372157.db2.gz	QIPYMBLZMCVMNE-XHDPSFHLSA-N	1	1	307.350	1.484	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000451522228	528060783	/nfs/dbraw/zinc/06/07/83/528060783.db2.gz	AWNKHJSKUMDDHU-JSGCOSHPSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000330956730	528934090	/nfs/dbraw/zinc/93/40/90/528934090.db2.gz	HTCGXLBRVDLEHQ-UHFFFAOYSA-N	1	1	309.370	1.030	20	5		DDBDMO
CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]2COC[C@@H]21	ZINC000452108769	529124009	/nfs/dbraw/zinc/12/40/09/529124009.db2.gz	FQMRDIDIBHIODA-GXTWGEPZSA-N	1	1	319.361	1.551	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]2COC[C@@H]21	ZINC000452108769	529124012	/nfs/dbraw/zinc/12/40/12/529124012.db2.gz	FQMRDIDIBHIODA-GXTWGEPZSA-N	1	1	319.361	1.551	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820664756	599589641	/nfs/dbraw/zinc/58/96/41/599589641.db2.gz	BQDHMOSQSCXTNL-UWVGGRQHSA-N	1	1	317.353	1.670	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000746001444	700001912	/nfs/dbraw/zinc/00/19/12/700001912.db2.gz	FQEUAKVMIAODCJ-NSHDSACASA-N	1	1	318.377	1.945	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000746001444	700001915	/nfs/dbraw/zinc/00/19/15/700001915.db2.gz	FQEUAKVMIAODCJ-NSHDSACASA-N	1	1	318.377	1.945	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@@H]2CCCCNC2=O)cc1[N+](=O)[O-]	ZINC000105613015	696624053	/nfs/dbraw/zinc/62/40/53/696624053.db2.gz	HAYSAKDHCRWCPX-GFCCVEGCSA-N	1	1	307.350	1.704	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H]2CCCCNC2=O)cc1[N+](=O)[O-]	ZINC000105613015	696624054	/nfs/dbraw/zinc/62/40/54/696624054.db2.gz	HAYSAKDHCRWCPX-GFCCVEGCSA-N	1	1	307.350	1.704	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776590913	698123629	/nfs/dbraw/zinc/12/36/29/698123629.db2.gz	MFRSJDQBNAWYMN-UONOGXRCSA-N	1	1	308.334	1.656	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000776590436	698123830	/nfs/dbraw/zinc/12/38/30/698123830.db2.gz	DNNCWUIJMPFJST-LERXQTSPSA-N	1	1	308.334	1.369	20	5		DDBDMO
COCCO[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594004	698124372	/nfs/dbraw/zinc/12/43/72/698124372.db2.gz	QQMCHLJJVMRAAH-JKSUJKDBSA-N	1	1	324.377	1.756	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676951	699237950	/nfs/dbraw/zinc/23/79/50/699237950.db2.gz	BLUNENGNZDEQNR-GWCFXTLKSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676951	699237953	/nfs/dbraw/zinc/23/79/53/699237953.db2.gz	BLUNENGNZDEQNR-GWCFXTLKSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000705390348	699240757	/nfs/dbraw/zinc/24/07/57/699240757.db2.gz	YGXTYNPPNQVBGE-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000705390348	699240759	/nfs/dbraw/zinc/24/07/59/699240759.db2.gz	YGXTYNPPNQVBGE-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000753949279	700470543	/nfs/dbraw/zinc/47/05/43/700470543.db2.gz	HVXKXYCJZOZDOU-GFCCVEGCSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000753949279	700470544	/nfs/dbraw/zinc/47/05/44/700470544.db2.gz	HVXKXYCJZOZDOU-GFCCVEGCSA-N	1	1	308.334	1.861	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758286002	700696530	/nfs/dbraw/zinc/69/65/30/700696530.db2.gz	RBFCQABBVYGADP-WDEREUQCSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758286002	700696531	/nfs/dbraw/zinc/69/65/31/700696531.db2.gz	RBFCQABBVYGADP-WDEREUQCSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@@H+]1C	ZINC000761073767	700838917	/nfs/dbraw/zinc/83/89/17/700838917.db2.gz	HKADHOBNYVEKEN-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@H+]1C	ZINC000761073767	700838921	/nfs/dbraw/zinc/83/89/21/700838921.db2.gz	HKADHOBNYVEKEN-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@@H+](C)[C@@H](C)C1	ZINC000761076617	700840171	/nfs/dbraw/zinc/84/01/71/700840171.db2.gz	HXNGGVZQCFUJEI-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)[C@@H](C)C1	ZINC000761076617	700840175	/nfs/dbraw/zinc/84/01/75/700840175.db2.gz	HXNGGVZQCFUJEI-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C)[C@@H](C)C1	ZINC000761076617	700840177	/nfs/dbraw/zinc/84/01/77/700840177.db2.gz	HXNGGVZQCFUJEI-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@H](C(=O)OCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000763400826	700936894	/nfs/dbraw/zinc/93/68/94/700936894.db2.gz	BBKVUNWNULRBAW-ZDUSSCGKSA-N	1	1	322.361	1.964	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[NH+](CCCO)CC1	ZINC000804399268	701186983	/nfs/dbraw/zinc/18/69/83/701186983.db2.gz	KKKKJDNBHUHZBE-UHFFFAOYSA-N	1	1	310.310	1.007	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771920243	701336984	/nfs/dbraw/zinc/33/69/84/701336984.db2.gz	XDLSFRIAGAYGAT-UHFFFAOYSA-N	1	1	320.261	1.865	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000808207286	701507641	/nfs/dbraw/zinc/50/76/41/701507641.db2.gz	PKUZNPRDPRRCFG-LBPRGKRZSA-N	1	1	307.354	1.002	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000808207286	701507642	/nfs/dbraw/zinc/50/76/42/701507642.db2.gz	PKUZNPRDPRRCFG-LBPRGKRZSA-N	1	1	307.354	1.002	20	5		DDBDMO
COCCOCC[N@H+](C)Cn1nc(C)c2ccc([N+](=O)[O-])cc21	ZINC000808237596	701510321	/nfs/dbraw/zinc/51/03/21/701510321.db2.gz	XSTMCLVBGGQKSF-UHFFFAOYSA-N	1	1	322.365	1.805	20	5		DDBDMO
COCCOCC[N@@H+](C)Cn1nc(C)c2ccc([N+](=O)[O-])cc21	ZINC000808237596	701510322	/nfs/dbraw/zinc/51/03/22/701510322.db2.gz	XSTMCLVBGGQKSF-UHFFFAOYSA-N	1	1	322.365	1.805	20	5		DDBDMO
C[C@@H](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000839695428	701787968	/nfs/dbraw/zinc/78/79/68/701787968.db2.gz	GJWILUUPBGGFFF-NWANDNLSSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[C@@H](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@H+](C)Cc1ccccc1	ZINC000839695428	701787972	/nfs/dbraw/zinc/78/79/72/701787972.db2.gz	GJWILUUPBGGFFF-NWANDNLSSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[C@@H](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000839695428	701787975	/nfs/dbraw/zinc/78/79/75/701787975.db2.gz	GJWILUUPBGGFFF-NWANDNLSSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[C@H](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000839695426	701788032	/nfs/dbraw/zinc/78/80/32/701788032.db2.gz	GJWILUUPBGGFFF-BPLDGKMQSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[C@H](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@H+](C)Cc1ccccc1	ZINC000839695426	701788035	/nfs/dbraw/zinc/78/80/35/701788035.db2.gz	GJWILUUPBGGFFF-BPLDGKMQSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[C@H](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000839695426	701788037	/nfs/dbraw/zinc/78/80/37/701788037.db2.gz	GJWILUUPBGGFFF-BPLDGKMQSA-N	1	1	305.378	1.678	20	5		DDBDMO
CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839703453	701790462	/nfs/dbraw/zinc/79/04/62/701790462.db2.gz	DLTNIGJPYKEMCF-RRFJBIMHSA-N	1	1	303.362	1.385	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000839703453	701790466	/nfs/dbraw/zinc/79/04/66/701790466.db2.gz	DLTNIGJPYKEMCF-RRFJBIMHSA-N	1	1	303.362	1.385	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839703453	701790471	/nfs/dbraw/zinc/79/04/71/701790471.db2.gz	DLTNIGJPYKEMCF-RRFJBIMHSA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1	ZINC000839728003	701799689	/nfs/dbraw/zinc/79/96/89/701799689.db2.gz	GPRRFFZZKPYYDM-OAGGEKHMSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1	ZINC000839728003	701799692	/nfs/dbraw/zinc/79/96/92/701799692.db2.gz	GPRRFFZZKPYYDM-OAGGEKHMSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1	ZINC000839728003	701799695	/nfs/dbraw/zinc/79/96/95/701799695.db2.gz	GPRRFFZZKPYYDM-OAGGEKHMSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000867945021	701846841	/nfs/dbraw/zinc/84/68/41/701846841.db2.gz	OHMZJSURKUKOKP-FIXISWKDSA-N	1	1	307.350	1.405	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000840104485	701970095	/nfs/dbraw/zinc/97/00/95/701970095.db2.gz	MXELWQHNTFIAFV-OAHLLOKOSA-N	1	1	319.365	1.964	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@@H+]1CCC[C@@H]2CC3(CC[C@@H]21)OCCO3	ZINC000840138943	701991164	/nfs/dbraw/zinc/99/11/64/701991164.db2.gz	VBLATLADOWXMGO-OLZOCXBDSA-N	1	1	322.365	1.756	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@H+]1CCC[C@@H]2CC3(CC[C@@H]21)OCCO3	ZINC000840138943	701991167	/nfs/dbraw/zinc/99/11/67/701991167.db2.gz	VBLATLADOWXMGO-OLZOCXBDSA-N	1	1	322.365	1.756	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000817492517	702391146	/nfs/dbraw/zinc/39/11/46/702391146.db2.gz	XTECNXXHWMGKQT-ZDUSSCGKSA-N	1	1	320.393	1.827	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c2nonc21	ZINC000842046639	702663429	/nfs/dbraw/zinc/66/34/29/702663429.db2.gz	FTNOBBLOPYTYCA-UWVGGRQHSA-N	1	1	321.337	1.022	20	5		DDBDMO
O=[N+]([O-])c1ccccc1Cc1noc(C[NH2+]C[C@H]2CCCO2)n1	ZINC000843170616	702832558	/nfs/dbraw/zinc/83/25/58/702832558.db2.gz	HXEHWLXFSIXWEE-GFCCVEGCSA-N	1	1	318.333	1.837	20	5		DDBDMO
C[N@H+]1CCN(Cn2cc([N+](=O)[O-])cn2)[C@@H](Cc2ccccc2)C1	ZINC000844740157	703066599	/nfs/dbraw/zinc/06/65/99/703066599.db2.gz	INNXDEZEDNUMSC-HNNXBMFYSA-N	1	1	315.377	1.608	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000848350703	703541844	/nfs/dbraw/zinc/54/18/44/703541844.db2.gz	SJYDPIRJNICHTI-KBPBESRZSA-N	1	1	318.377	1.924	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000848350707	703541858	/nfs/dbraw/zinc/54/18/58/703541858.db2.gz	SJYDPIRJNICHTI-UONOGXRCSA-N	1	1	318.377	1.924	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000848353159	703542305	/nfs/dbraw/zinc/54/23/05/703542305.db2.gz	YIITWRMBONOIPY-CHWSQXEVSA-N	1	1	319.365	1.319	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccnn2C)c1	ZINC000879687719	706759432	/nfs/dbraw/zinc/75/94/32/706759432.db2.gz	VPAUFDKACNHCCQ-SNVBAGLBSA-N	1	1	318.333	1.966	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC	ZINC000850431470	703730778	/nfs/dbraw/zinc/73/07/78/703730778.db2.gz	DSEFCCRQCQXWGS-SNVBAGLBSA-N	1	1	316.379	1.689	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972941	704039195	/nfs/dbraw/zinc/03/91/95/704039195.db2.gz	PHWLLUZTRRYJAF-LRDDRELGSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC[N@@H+](C3CC3)C2)c1	ZINC000818972941	704039196	/nfs/dbraw/zinc/03/91/96/704039196.db2.gz	PHWLLUZTRRYJAF-LRDDRELGSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972941	704039197	/nfs/dbraw/zinc/03/91/97/704039197.db2.gz	PHWLLUZTRRYJAF-LRDDRELGSA-N	1	1	305.378	1.702	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853501844	704251747	/nfs/dbraw/zinc/25/17/47/704251747.db2.gz	LOFQJDJTPMISRR-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])[C@H](C)CO1	ZINC000853799558	704316982	/nfs/dbraw/zinc/31/69/82/704316982.db2.gz	MGYRYBZROIGGRQ-VXGBXAGGSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])[C@H](C)CO1	ZINC000853799558	704316984	/nfs/dbraw/zinc/31/69/84/704316984.db2.gz	MGYRYBZROIGGRQ-VXGBXAGGSA-N	1	1	319.365	1.764	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cn[nH]n3)CC2)cc1	ZINC000821343760	704394364	/nfs/dbraw/zinc/39/43/64/704394364.db2.gz	ZTKVARFNSUOSAN-UHFFFAOYSA-N	1	1	302.338	1.078	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000854643237	704431911	/nfs/dbraw/zinc/43/19/11/704431911.db2.gz	SEOIQYUICYJEOH-STQMWFEESA-N	1	1	313.398	1.144	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1	ZINC000822722623	705020120	/nfs/dbraw/zinc/02/01/20/705020120.db2.gz	IJRAEUPLYPRAJK-JTQLQIEISA-N	1	1	320.305	1.906	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000860162489	705120292	/nfs/dbraw/zinc/12/02/92/705120292.db2.gz	ZLBSPXZDPYIECW-ZWNOBZJWSA-N	1	1	319.317	1.028	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000860176336	705123348	/nfs/dbraw/zinc/12/33/48/705123348.db2.gz	CWPPCGXTUCIRBD-JKSUJKDBSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000874843456	705198643	/nfs/dbraw/zinc/19/86/43/705198643.db2.gz	NMZLDTOULMOHFI-CABCVRRESA-N	1	1	318.377	1.702	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823994003	705350650	/nfs/dbraw/zinc/35/06/50/705350650.db2.gz	MXFJQKBJVQPSCA-NSHDSACASA-N	1	1	321.381	1.983	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000825338834	705649487	/nfs/dbraw/zinc/64/94/87/705649487.db2.gz	VEKDLSISGNKVHT-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000825526993	705687874	/nfs/dbraw/zinc/68/78/74/705687874.db2.gz	KVCMCOYSMUXBHL-GJZGRUSLSA-N	1	1	321.377	1.081	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000825648460	705708964	/nfs/dbraw/zinc/70/89/64/705708964.db2.gz	SEXVJLHSIGNKOA-CQSZACIVSA-N	1	1	307.350	1.240	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000825648460	705708965	/nfs/dbraw/zinc/70/89/65/705708965.db2.gz	SEXVJLHSIGNKOA-CQSZACIVSA-N	1	1	307.350	1.240	20	5		DDBDMO
C[N@@H+]1CC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827302699	705972160	/nfs/dbraw/zinc/97/21/60/705972160.db2.gz	XCFPPVGHDJGRLB-IINYFYTJSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827302699	705972162	/nfs/dbraw/zinc/97/21/62/705972162.db2.gz	XCFPPVGHDJGRLB-IINYFYTJSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@@H]21	ZINC000827313254	705973341	/nfs/dbraw/zinc/97/33/41/705973341.db2.gz	YVPSQBRDAZHKJP-PWSUYJOCSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827320515	705974985	/nfs/dbraw/zinc/97/49/85/705974985.db2.gz	RZBLQYDYIYZJMY-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC[C@@H]21	ZINC000827338033	705979540	/nfs/dbraw/zinc/97/95/40/705979540.db2.gz	NADCRRXYAWFPCD-CABZTGNLSA-N	1	1	322.340	1.482	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](O)C2)o1	ZINC000877748515	706197737	/nfs/dbraw/zinc/19/77/37/706197737.db2.gz	DHTBBFVJWPXXHM-CABCVRRESA-N	1	1	318.329	1.782	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC[NH+]1CCC(O)CC1	ZINC000829283801	706313713	/nfs/dbraw/zinc/31/37/13/706313713.db2.gz	WAWBFLXXDDZPTL-UHFFFAOYSA-N	1	1	310.310	1.372	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)[C@H](CO)C1	ZINC000872605003	707508850	/nfs/dbraw/zinc/50/88/50/707508850.db2.gz	BMLWGKUDGYNNPR-JTQLQIEISA-N	1	1	308.363	1.317	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)[C@H](CO)C1	ZINC000872605003	707508852	/nfs/dbraw/zinc/50/88/52/707508852.db2.gz	BMLWGKUDGYNNPR-JTQLQIEISA-N	1	1	308.363	1.317	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H]2CN(C(C)=O)C[C@H]2C1	ZINC000880312618	706937948	/nfs/dbraw/zinc/93/79/48/706937948.db2.gz	RLSRURLQPFRQII-OKILXGFUSA-N	1	1	319.361	1.514	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@H]2CCOC[C@@H]2OC)cc1[N+](=O)[O-]	ZINC000880425587	706970305	/nfs/dbraw/zinc/97/03/05/706970305.db2.gz	GHAWSLYHBHVUPG-WFASDCNBSA-N	1	1	310.350	1.839	20	5		DDBDMO
CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CO)c1ccccc1	ZINC000880461949	706982471	/nfs/dbraw/zinc/98/24/71/706982471.db2.gz	NXQWNTOQBIQXIC-AWEZNQCLSA-N	1	1	304.350	1.847	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000836948106	707553135	/nfs/dbraw/zinc/55/31/35/707553135.db2.gz	XYOZIVQWMZZCNK-GFCCVEGCSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1nc2sccn2c1[N+](=O)[O-]	ZINC000872779840	707597083	/nfs/dbraw/zinc/59/70/83/707597083.db2.gz	IWZUHWKZZBEOFM-UWVGGRQHSA-N	1	1	307.379	1.977	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000882484578	707655244	/nfs/dbraw/zinc/65/52/44/707655244.db2.gz	HLJRZXVTMUKJNQ-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000873360995	707824613	/nfs/dbraw/zinc/82/46/13/707824613.db2.gz	QOXJUIKWSRMXKM-TUAOUCFPSA-N	1	1	324.381	1.904	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000897219639	708257232	/nfs/dbraw/zinc/25/72/32/708257232.db2.gz	MFOKNTLWPWLAEH-MNOVXSKESA-N	1	1	310.329	1.164	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000889783126	709634361	/nfs/dbraw/zinc/63/43/61/709634361.db2.gz	VLWISJJKFTVIRV-CABCVRRESA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@]2(C)C[C@@H](O)C[N@H+]2C)cc1[N+](=O)[O-]	ZINC000900968695	709854536	/nfs/dbraw/zinc/85/45/36/709854536.db2.gz	WRMDPUMODKBGAS-GHJWDPDVSA-N	1	1	321.377	1.536	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928430894	713192427	/nfs/dbraw/zinc/19/24/27/713192427.db2.gz	JUQJTQLZXFDYKF-KAOXEZKKSA-N	1	1	303.362	1.907	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000928570073	713233084	/nfs/dbraw/zinc/23/30/84/713233084.db2.gz	REDWJBNSYPHWKK-GFCCVEGCSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000928570073	713233085	/nfs/dbraw/zinc/23/30/85/713233085.db2.gz	REDWJBNSYPHWKK-GFCCVEGCSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2	ZINC000928574391	713234528	/nfs/dbraw/zinc/23/45/28/713234528.db2.gz	VDYNTXUSBPYCPZ-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc2c(c1[N+](=O)[O-])OCCCO2	ZINC000928574391	713234530	/nfs/dbraw/zinc/23/45/30/713234530.db2.gz	VDYNTXUSBPYCPZ-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@H+]1CCN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@@H]1CO	ZINC000894884680	711307669	/nfs/dbraw/zinc/30/76/69/711307669.db2.gz	ILWHZOSWLIMZQZ-CYBMUJFWSA-N	1	1	302.334	1.256	20	5		DDBDMO
Cc1cnc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c([N+](=O)[O-])c1	ZINC000896524598	711738214	/nfs/dbraw/zinc/73/82/14/711738214.db2.gz	XIJIHDNOJCLHGN-ZDUSSCGKSA-N	1	1	306.366	1.963	20	5		DDBDMO
C[C@@]1(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)CCC[NH2+]C1	ZINC000904343606	711843820	/nfs/dbraw/zinc/84/38/20/711843820.db2.gz	WECBBEZFANWSCT-OAHLLOKOSA-N	1	1	307.398	1.818	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2[C@H](C)CCC[C@@H]2CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000914444060	713396303	/nfs/dbraw/zinc/39/63/03/713396303.db2.gz	OVIGKETXHXVVDD-ZYHUDNBSSA-N	1	1	323.397	1.961	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000919801727	713635750	/nfs/dbraw/zinc/63/57/50/713635750.db2.gz	GOVQGUVSABXBIU-HNNXBMFYSA-N	1	1	320.393	1.921	20	5		DDBDMO
CCO[C@@H]1C[N@H+](CC[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C	ZINC000930852728	713937630	/nfs/dbraw/zinc/93/76/30/713937630.db2.gz	MLQAPDHJHXQGEX-VXGBXAGGSA-N	1	1	317.386	1.125	20	5		DDBDMO
CCO[C@@H]1C[N@@H+](CC[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C	ZINC000930852728	713937633	/nfs/dbraw/zinc/93/76/33/713937633.db2.gz	MLQAPDHJHXQGEX-VXGBXAGGSA-N	1	1	317.386	1.125	20	5		DDBDMO
COC1(OC)CCOC[C@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1	ZINC000931677686	714158648	/nfs/dbraw/zinc/15/86/48/714158648.db2.gz	WHLWVOYKAOGNNM-CQSZACIVSA-N	1	1	310.350	1.771	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000932348336	714315879	/nfs/dbraw/zinc/31/58/79/714315879.db2.gz	MVJBYCKZTWJVDC-GXTWGEPZSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](c1ncccn1)C1CC1	ZINC000932351649	714316778	/nfs/dbraw/zinc/31/67/78/714316778.db2.gz	CFLFOTSEDWCKOM-CYBMUJFWSA-N	1	1	302.338	1.631	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@H]1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923368372	714330062	/nfs/dbraw/zinc/33/00/62/714330062.db2.gz	BHEBWAGJXUODRC-DZGCQCFKSA-N	1	1	323.393	1.312	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115519	714745275	/nfs/dbraw/zinc/74/52/75/714745275.db2.gz	ATJKKNOKBRBEEN-DZGCQCFKSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115519	714745276	/nfs/dbraw/zinc/74/52/76/714745276.db2.gz	ATJKKNOKBRBEEN-DZGCQCFKSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120305	714747080	/nfs/dbraw/zinc/74/70/80/714747080.db2.gz	SXFWWODOEKMBNS-KGLIPLIRSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120305	714747082	/nfs/dbraw/zinc/74/70/82/714747082.db2.gz	SXFWWODOEKMBNS-KGLIPLIRSA-N	1	1	307.350	1.667	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)n1	ZINC000934438828	714822237	/nfs/dbraw/zinc/82/22/37/714822237.db2.gz	SORYPBWDPRNWKG-HUUCEWRRSA-N	1	1	316.361	1.327	20	5		DDBDMO
CCC(=O)N1CCC(C[N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001029922655	741591042	/nfs/dbraw/zinc/59/10/42/741591042.db2.gz	WXLVNJLNTAJMBK-UHFFFAOYSA-N	1	1	323.397	1.409	20	5		DDBDMO
CCC(=O)N1CCC(C[N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001029922655	741591045	/nfs/dbraw/zinc/59/10/45/741591045.db2.gz	WXLVNJLNTAJMBK-UHFFFAOYSA-N	1	1	323.397	1.409	20	5		DDBDMO
Cc1cc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)sn1	ZINC000996439025	749574235	/nfs/dbraw/zinc/57/42/35/749574235.db2.gz	AEEMXEXFMJNGPO-CHWSQXEVSA-N	1	1	324.406	1.197	20	5		DDBDMO
O=C1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038656	762193611	/nfs/dbraw/zinc/19/36/11/762193611.db2.gz	JXKLKTISFAUVFU-JKSUJKDBSA-N	1	1	317.389	1.776	20	5		DDBDMO
O=C1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038656	762193613	/nfs/dbraw/zinc/19/36/13/762193613.db2.gz	JXKLKTISFAUVFU-JKSUJKDBSA-N	1	1	317.389	1.776	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018274	762199515	/nfs/dbraw/zinc/19/95/15/762199515.db2.gz	ALHFUMMMBAYKHI-FRRDWIJNSA-N	1	1	323.397	1.196	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018274	762199516	/nfs/dbraw/zinc/19/95/16/762199516.db2.gz	ALHFUMMMBAYKHI-FRRDWIJNSA-N	1	1	323.397	1.196	20	5		DDBDMO
CCN1CC[C@]2(CCC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1=O	ZINC001169019201	762199521	/nfs/dbraw/zinc/19/95/21/762199521.db2.gz	FNZDXYVVUCRQKA-FMKPAKJESA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C1[C@H]2C[N@@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2CN1CC1CC1	ZINC001169025220	762203113	/nfs/dbraw/zinc/20/31/13/762203113.db2.gz	YDZUWGPWPFHOBM-QPSCCSFWSA-N	1	1	307.394	1.232	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169057455	762210660	/nfs/dbraw/zinc/21/06/60/762210660.db2.gz	VKUNMPJXBZNVAU-JHJVBQTASA-N	1	1	322.365	1.384	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000829037761	759863389	/nfs/dbraw/zinc/86/33/89/759863389.db2.gz	JFKOHHXKLXJHJS-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1F	ZINC001020140015	760613771	/nfs/dbraw/zinc/61/37/71/760613771.db2.gz	UPTUODPBIMLATB-RGCMKSIDSA-N	1	1	321.352	1.536	20	5		DDBDMO
Cc1cccc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001086082382	760940800	/nfs/dbraw/zinc/94/08/00/760940800.db2.gz	MATZITRMXOLEOR-QKPAOTATSA-N	1	1	317.389	1.645	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]Cc2ccsc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363357	761493181	/nfs/dbraw/zinc/49/31/81/761493181.db2.gz	PLQBNRGMWGWLGR-FDYHWXHSSA-N	1	1	309.391	1.398	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C[N@H+]1C1CC1	ZINC001137492697	766350289	/nfs/dbraw/zinc/35/02/89/766350289.db2.gz	XKJYELPGUCOFHQ-RQJHMYQMSA-N	1	1	313.745	1.326	20	5		DDBDMO
COC(=O)[C@H](Nc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2)C(F)(F)F	ZINC001171014267	772099938	/nfs/dbraw/zinc/09/99/38/772099938.db2.gz	CKYPIIAZIJOJHF-JTQLQIEISA-N	1	1	319.239	1.714	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC001094008041	775324982	/nfs/dbraw/zinc/32/49/82/775324982.db2.gz	DDSHTDAUDVKEHU-UHFFFAOYSA-N	1	1	321.312	1.467	20	5		DDBDMO
CCN(CCNC(=O)CC[N@@H+](C)CC)c1ccc([N+](=O)[O-])cc1	ZINC001100607382	776359518	/nfs/dbraw/zinc/35/95/18/776359518.db2.gz	YICCQIXPGWBBKW-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2C[C@H](O)[C@@H](C)C2)c1F	ZINC001173181330	777035318	/nfs/dbraw/zinc/03/53/18/777035318.db2.gz	OQGPBRHMPRPQTN-KWBADKCTSA-N	1	1	312.341	1.986	20	5		DDBDMO
O=C(CN1CCCC1)NCCC[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC001176096720	778024480	/nfs/dbraw/zinc/02/44/80/778024480.db2.gz	YDGBZQAONMIGNW-UHFFFAOYSA-N	1	1	320.393	1.287	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(CCC[NH2+]CCF)CC1CCCC1	ZINC001177314063	778534630	/nfs/dbraw/zinc/53/46/30/778534630.db2.gz	YVYGJPITFWVNIF-ZIAGYGMSSA-N	1	1	315.389	1.620	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC001119630960	781542805	/nfs/dbraw/zinc/54/28/05/781542805.db2.gz	LMLDAPXQSBCHST-CYBMUJFWSA-N	1	1	306.366	1.833	20	5		DDBDMO
O=C(CCCF)N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC001266903730	837034673	/nfs/dbraw/zinc/03/46/73/837034673.db2.gz	UDVYRFXTDMVAQD-FOLVSLTJSA-N	1	1	321.352	1.891	20	5		DDBDMO
COCCC(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001268228718	839861992	/nfs/dbraw/zinc/86/19/92/839861992.db2.gz	GIVJMVPPAIYLPP-UHFFFAOYSA-N	1	1	309.366	1.522	20	5		DDBDMO
COCCC(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001268228718	839861999	/nfs/dbraw/zinc/86/19/99/839861999.db2.gz	GIVJMVPPAIYLPP-UHFFFAOYSA-N	1	1	309.366	1.522	20	5		DDBDMO
CCc1nc(C)c(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001268792048	840813104	/nfs/dbraw/zinc/81/31/04/840813104.db2.gz	UTLAXFJEMGPBSI-VXGBXAGGSA-N	1	1	324.381	1.149	20	5		DDBDMO
CNc1c(C(=O)NCc2c[nH+]c3n2CCC3)cccc1[N+](=O)[O-]	ZINC001154937455	861584492	/nfs/dbraw/zinc/58/44/92/861584492.db2.gz	OLMQENCOQYSDNB-UHFFFAOYSA-N	1	1	315.333	1.709	20	5		DDBDMO
C[C@@H](NC(=O)C[NH+]1CCC(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC001120693120	858574411	/nfs/dbraw/zinc/57/44/11/858574411.db2.gz	LDNPFPSOSZATOG-GFCCVEGCSA-N	1	1	321.377	1.476	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CCC1CCCC1	ZINC001122878623	858993554	/nfs/dbraw/zinc/99/35/54/858993554.db2.gz	BKQKZOUGCNVLOM-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
Cc1cc(-n2cnc(C[NH3+])cc2=N)nc2ccc([N+](=O)[O-])cc12	ZINC001156620440	863197768	/nfs/dbraw/zinc/19/77/68/863197768.db2.gz	OFJGXMWNRQPOIX-UHFFFAOYSA-N	1	1	310.317	1.575	20	5		DDBDMO
CC[N@H+]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C(C)(C)C1	ZINC001158561424	864728339	/nfs/dbraw/zinc/72/83/39/864728339.db2.gz	DEKXZMZEAFXQQR-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOc1nc(N2CC([N@@H+](C)[C@H]3CCOC3)C2)ccc1[N+](=O)[O-]	ZINC001158735427	864871059	/nfs/dbraw/zinc/87/10/59/864871059.db2.gz	DEPJQLUSCRCXQX-NSHDSACASA-N	1	1	322.365	1.298	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC001161493721	866711455	/nfs/dbraw/zinc/71/14/55/866711455.db2.gz	GSLBVFDWIMHFDD-LLVKDONJSA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC001161493721	866711460	/nfs/dbraw/zinc/71/14/60/866711460.db2.gz	GSLBVFDWIMHFDD-LLVKDONJSA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1	ZINC001333710519	866955770	/nfs/dbraw/zinc/95/57/70/866955770.db2.gz	LHTNYPBFYRVNIE-AAEUAGOBSA-N	1	1	306.366	1.919	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@H]1C	ZINC001320704251	866963349	/nfs/dbraw/zinc/96/33/49/866963349.db2.gz	YLMDGTYJFGHKCM-LLVKDONJSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[NH+]1CCN(Cc2cc(-c3ccccc3[N+](=O)[O-])no2)CC1	ZINC001334006470	867228220	/nfs/dbraw/zinc/22/82/20/867228220.db2.gz	WWEQVUSZCIBMAV-UHFFFAOYSA-N	1	1	302.334	1.997	20	5		DDBDMO
C[C@H]([NH2+]C1CC[NH+](CC(=O)[O-])CC1)c1cccc([N+](=O)[O-])c1	ZINC001334027200	867246482	/nfs/dbraw/zinc/24/64/82/867246482.db2.gz	YUTWTAVRGABIKY-NSHDSACASA-N	1	1	307.350	1.794	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])c(NCC[C@@H]2CC[NH2+]CC2(F)F)n1	ZINC001162811452	867847985	/nfs/dbraw/zinc/84/79/85/867847985.db2.gz	ZHDDLYDXJUEMFA-VIFPVBQESA-N	1	1	301.297	1.740	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC001336711721	869104073	/nfs/dbraw/zinc/10/40/73/869104073.db2.gz	RXNBDUDQSSHCNI-UHFFFAOYSA-N	1	1	322.409	1.909	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])cc1NCC[C@H]1CCC[N@@H+](C)C1	ZINC001165300382	869506594	/nfs/dbraw/zinc/50/65/94/869506594.db2.gz	NECLSNOBVCLYKB-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
COC(=O)c1ccnc(N2CCn3c(C)[nH+]cc3C2)c1[N+](=O)[O-]	ZINC001165385903	869559296	/nfs/dbraw/zinc/55/92/96/869559296.db2.gz	SBJGVPHBJJRTRE-UHFFFAOYSA-N	1	1	317.305	1.302	20	5		DDBDMO
CN(CCC1OCCO1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001167027359	870484720	/nfs/dbraw/zinc/48/47/20/870484720.db2.gz	XUIXHLQJEQDGEU-GQCTYLIASA-N	1	1	322.365	1.721	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)n1	ZINC001339997514	870829506	/nfs/dbraw/zinc/82/95/06/870829506.db2.gz	CPOXNOCVLVEBJF-HBNTYKKESA-N	1	1	320.349	1.529	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001303986542	871172930	/nfs/dbraw/zinc/17/29/30/871172930.db2.gz	XJEMBVQTSPZNIW-ZDUSSCGKSA-N	1	1	307.350	1.430	20	5		DDBDMO
C[N@@H+]1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@H]1CO	ZINC001353203913	877183760	/nfs/dbraw/zinc/18/37/60/877183760.db2.gz	RSFCVDZKRZIVRX-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[C@H]1CO	ZINC001353203913	877183772	/nfs/dbraw/zinc/18/37/72/877183772.db2.gz	RSFCVDZKRZIVRX-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
Cc1[nH+]c(N2CCOCC2)ccc1Nc1c([N+](=O)[O-])cnn1C	ZINC001355254228	878476669	/nfs/dbraw/zinc/47/66/69/878476669.db2.gz	GSSVUSKOWDNUFL-UHFFFAOYSA-N	1	1	318.337	1.612	20	5		DDBDMO
C[C@H]([NH2+]CC[N+](=O)[O-])C(=O)Nc1cccc(N2CCCC2)c1	ZINC001356582385	879111502	/nfs/dbraw/zinc/11/15/02/879111502.db2.gz	FIZWNNFVGBYETP-LBPRGKRZSA-N	1	1	306.366	1.480	20	5		DDBDMO
CC[N@H+]1CC[C@@H](O[C@H](C(=O)OC)c2ccccc2[N+](=O)[O-])C1	ZINC001223641645	881037896	/nfs/dbraw/zinc/03/78/96/881037896.db2.gz	BWAWFJWQFFSOLE-RISCZKNCSA-N	1	1	308.334	1.920	20	5		DDBDMO
CSCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001233631055	887172669	/nfs/dbraw/zinc/17/26/69/887172669.db2.gz	ZWHPSRMUGFENNG-UHFFFAOYSA-N	1	1	311.407	1.896	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCC[NH2+]CC3)CC2)cc1	ZINC001246525439	892678481	/nfs/dbraw/zinc/67/84/81/892678481.db2.gz	PTSVTJFMRKGNQR-UHFFFAOYSA-N	1	1	304.394	1.859	20	5		DDBDMO
[NH3+]C[C@]1(O)CCCCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001246564307	892700687	/nfs/dbraw/zinc/70/06/87/892700687.db2.gz	XHKYEOACEBKMRH-JKSUJKDBSA-N	1	1	305.378	1.238	20	5		DDBDMO
C[C@]([NH3+])(CO)c1nc(-c2ccc3ccc4cccnc4c3n2)no1	ZINC001247618660	893252636	/nfs/dbraw/zinc/25/26/36/893252636.db2.gz	OHIVPLMINJQFKN-KRWDZBQOSA-N	1	1	321.340	1.999	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](CO)C3)CC2)cc1	ZINC001254479295	896455662	/nfs/dbraw/zinc/45/56/62/896455662.db2.gz	WVTMAJSJBWWWSU-ZDUSSCGKSA-N	1	1	305.378	1.878	20	5		DDBDMO
CS(=O)(=O)[C@H]1CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601271	896524129	/nfs/dbraw/zinc/52/41/29/896524129.db2.gz	XGZGQMQVTBZCOU-KGLIPLIRSA-N	1	1	310.375	1.181	20	5		DDBDMO
CS(=O)(=O)[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601271	896524136	/nfs/dbraw/zinc/52/41/36/896524136.db2.gz	XGZGQMQVTBZCOU-KGLIPLIRSA-N	1	1	310.375	1.181	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1C[C@@H]2CSC[C@@H]2C1	ZINC001262055928	899920532	/nfs/dbraw/zinc/92/05/32/899920532.db2.gz	YYKMTYLPNWMFBT-AOOOYVTPSA-N	1	1	321.358	1.755	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1C[C@@H]2CSC[C@@H]2C1	ZINC001262055928	899920545	/nfs/dbraw/zinc/92/05/45/899920545.db2.gz	YYKMTYLPNWMFBT-AOOOYVTPSA-N	1	1	321.358	1.755	20	5		DDBDMO
CCCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC001265709854	902330004	/nfs/dbraw/zinc/33/00/04/902330004.db2.gz	LORURNYOVXANLC-FOLVSLTJSA-N	1	1	303.362	1.941	20	5		DDBDMO
CC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1	ZINC001279363794	903236425	/nfs/dbraw/zinc/23/64/25/903236425.db2.gz	WJYMGNMLWXXJKS-HIHDZCPBSA-N	1	1	307.394	1.398	20	5		DDBDMO
CC/C=C/CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001279363794	903236439	/nfs/dbraw/zinc/23/64/39/903236439.db2.gz	WJYMGNMLWXXJKS-HIHDZCPBSA-N	1	1	307.394	1.398	20	5		DDBDMO
CC/C=C/CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001279363794	903236451	/nfs/dbraw/zinc/23/64/51/903236451.db2.gz	WJYMGNMLWXXJKS-HIHDZCPBSA-N	1	1	307.394	1.398	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1O	ZINC000614661516	361968500	/nfs/dbraw/zinc/96/85/00/361968500.db2.gz	KLGVOJKKCKPLNO-GXFFZTMASA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1O	ZINC000614661516	361968505	/nfs/dbraw/zinc/96/85/05/361968505.db2.gz	KLGVOJKKCKPLNO-GXFFZTMASA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cc2)CCCO1	ZINC000278770458	214388687	/nfs/dbraw/zinc/38/86/87/214388687.db2.gz	XVMYURDGSUSPBS-CYBMUJFWSA-N	1	1	321.377	1.826	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CCO)c1ccccc1[N+](=O)[O-]	ZINC000452391453	231375189	/nfs/dbraw/zinc/37/51/89/231375189.db2.gz	QBKHTUIDYDBQRK-LBPRGKRZSA-N	1	1	307.350	1.171	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COCC(F)(F)F	ZINC000292578925	530004641	/nfs/dbraw/zinc/00/46/41/530004641.db2.gz	ZINUWOFZKQWCRU-NSHDSACASA-N	1	1	322.283	1.966	20	5		DDBDMO
C[N@H+](Cc1cccnc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000299352071	530006298	/nfs/dbraw/zinc/00/62/98/530006298.db2.gz	AHLWKJXPERRNTK-HNNXBMFYSA-N	1	1	317.345	1.862	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000280018156	215315999	/nfs/dbraw/zinc/31/59/99/215315999.db2.gz	KGJLCEAQBQMINA-CJNGLKHVSA-N	1	1	324.377	1.571	20	5		DDBDMO
COCC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccco1	ZINC000159742520	186138969	/nfs/dbraw/zinc/13/89/69/186138969.db2.gz	HJZNZYXQOWYJHS-UHFFFAOYSA-N	1	1	321.333	1.498	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccco1	ZINC000159742520	186138971	/nfs/dbraw/zinc/13/89/71/186138971.db2.gz	HJZNZYXQOWYJHS-UHFFFAOYSA-N	1	1	321.333	1.498	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046992557	352474828	/nfs/dbraw/zinc/47/48/28/352474828.db2.gz	HYJWIIMMGVFQRA-UKRRQHHQSA-N	1	1	303.362	1.880	20	5		DDBDMO
CSCC[C@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000072665978	191212137	/nfs/dbraw/zinc/21/21/37/191212137.db2.gz	OZRLKRWEXGKIDH-JQWIXIFHSA-N	1	1	302.400	1.226	20	5		DDBDMO
CCn1cnnc1[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331807972	234144161	/nfs/dbraw/zinc/14/41/61/234144161.db2.gz	KTDDYGRSNVDSBJ-LLVKDONJSA-N	1	1	319.369	1.319	20	5		DDBDMO
CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331807972	234144166	/nfs/dbraw/zinc/14/41/66/234144166.db2.gz	KTDDYGRSNVDSBJ-LLVKDONJSA-N	1	1	319.369	1.319	20	5		DDBDMO
CCN1CC[NH+](C[C@H](C)CNc2ncccc2[N+](=O)[O-])CC1	ZINC000060380156	352869473	/nfs/dbraw/zinc/86/94/73/352869473.db2.gz	QZPMGUFITOETSL-CYBMUJFWSA-N	1	1	307.398	1.675	20	5		DDBDMO
COC(=O)c1cc(C(=O)NCC[N@@H+](C)C2CC2)cc([N+](=O)[O-])c1	ZINC000067701828	353062569	/nfs/dbraw/zinc/06/25/69/353062569.db2.gz	IOKCSYNTYBIFQQ-UHFFFAOYSA-N	1	1	321.333	1.205	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000067703545	353063671	/nfs/dbraw/zinc/06/36/71/353063671.db2.gz	LFLATDWQKVCQAT-LVDDQXARSA-N	1	1	301.346	1.961	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2ccccc2[N+](=O)[O-])n1C	ZINC000074095048	353290681	/nfs/dbraw/zinc/29/06/81/353290681.db2.gz	GNFVXBQBKGQVFY-UHFFFAOYSA-N	1	1	303.322	1.324	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1	ZINC000074326553	353307325	/nfs/dbraw/zinc/30/73/25/353307325.db2.gz	YYKDLXVOEFZACD-LBPRGKRZSA-N	1	1	307.350	1.992	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000174530672	198347609	/nfs/dbraw/zinc/34/76/09/198347609.db2.gz	DVLPVZRDZMXOQH-JTQLQIEISA-N	1	1	324.356	1.730	20	5		DDBDMO
C[N@H+](Cc1ccccc1F)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174655799	198365266	/nfs/dbraw/zinc/36/52/66/198365266.db2.gz	ASKIYJOPALFYLA-CYBMUJFWSA-N	1	1	308.313	1.423	20	5		DDBDMO
C[N@@H+](CCCc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174732929	198377561	/nfs/dbraw/zinc/37/75/61/198377561.db2.gz	LYTPRIKMITZHMW-MRXNPFEDSA-N	1	1	318.377	1.717	20	5		DDBDMO
CCOc1cc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000405744744	354679203	/nfs/dbraw/zinc/67/92/03/354679203.db2.gz	ZXKFHATWCXWXTK-QWHCGFSZSA-N	1	1	307.350	1.249	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)[C@H]2C1	ZINC000590010673	355040039	/nfs/dbraw/zinc/04/00/39/355040039.db2.gz	OSRDJTJXTLYSJK-ABAIWWIYSA-N	1	1	319.361	1.597	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC(C[NH+]2CCOCC2)C1	ZINC000590392170	355084177	/nfs/dbraw/zinc/08/41/77/355084177.db2.gz	BVEIHAWJIBMFSP-UHFFFAOYSA-N	1	1	311.363	1.061	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000590573553	355117352	/nfs/dbraw/zinc/11/73/52/355117352.db2.gz	BPHVGQOIJOKFTG-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](O)[C@H]1C	ZINC000590762147	355170115	/nfs/dbraw/zinc/17/01/15/355170115.db2.gz	HYUMIZBGACTLRZ-ZWNOBZJWSA-N	1	1	323.349	1.387	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-]	ZINC000591464148	355317363	/nfs/dbraw/zinc/31/73/63/355317363.db2.gz	AVSXBHWGDRRQFX-SNVBAGLBSA-N	1	1	317.349	1.774	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CCNC1CC1	ZINC000591577325	355330141	/nfs/dbraw/zinc/33/01/41/355330141.db2.gz	PYJGXWIMAUFJFJ-NSHDSACASA-N	1	1	306.366	1.654	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])c1	ZINC000594067151	356104683	/nfs/dbraw/zinc/10/46/83/356104683.db2.gz	YOLPJMNJNNHWAY-JTQLQIEISA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])c1	ZINC000594067151	356104687	/nfs/dbraw/zinc/10/46/87/356104687.db2.gz	YOLPJMNJNNHWAY-JTQLQIEISA-N	1	1	323.349	1.387	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000594204725	356139164	/nfs/dbraw/zinc/13/91/64/356139164.db2.gz	XSYHNFBNPQEGOI-NEPJUHHUSA-N	1	1	306.366	1.680	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594613780	356266183	/nfs/dbraw/zinc/26/61/83/356266183.db2.gz	UORWFRXNXYLKQP-QIDGOZRWSA-N	1	1	317.389	1.749	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)c1[N+](=O)[O-]	ZINC000595339545	356454727	/nfs/dbraw/zinc/45/47/27/356454727.db2.gz	YHLPEDCALJQYKN-NSHDSACASA-N	1	1	305.338	1.689	20	5		DDBDMO
CCO[C@H]1C[C@](CO)([NH2+]Cc2onc(C)c2[N+](=O)[O-])C1(C)C	ZINC000595447080	356496851	/nfs/dbraw/zinc/49/68/51/356496851.db2.gz	FTBFXJHVHYOBAN-SMDDNHRTSA-N	1	1	313.354	1.547	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1CCO	ZINC000595706886	356616824	/nfs/dbraw/zinc/61/68/24/356616824.db2.gz	YEYWJSSLLYJQPZ-JSGCOSHPSA-N	1	1	309.366	1.239	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2NC(=O)CC[C@@H]2C1	ZINC000595728810	356624937	/nfs/dbraw/zinc/62/49/37/356624937.db2.gz	PGGNRDWJKMDCQK-BXUZGUMPSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C2	ZINC000595758427	356640126	/nfs/dbraw/zinc/64/01/26/356640126.db2.gz	MYBJAFYYLDLOPZ-WWGRRREGSA-N	1	1	322.361	1.303	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c1	ZINC000595860918	356681319	/nfs/dbraw/zinc/68/13/19/356681319.db2.gz	NBEQAVFLSDIWMR-BZNIZROVSA-N	1	1	322.361	1.832	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1	ZINC000595867570	356684927	/nfs/dbraw/zinc/68/49/27/356684927.db2.gz	OUZSTERCCBGRBX-QGZVFWFLSA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1NC[C@H]1CCC[N@@H+]1CCCO	ZINC000596257490	356834933	/nfs/dbraw/zinc/83/49/33/356834933.db2.gz	LFEYKXUUZSAYNM-SNVBAGLBSA-N	1	1	314.773	1.324	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000596308412	356852670	/nfs/dbraw/zinc/85/26/70/356852670.db2.gz	RUHOIJJSXNYRRL-GFCCVEGCSA-N	1	1	308.382	1.954	20	5		DDBDMO
Cn1ncc2c1CC(C)(C)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000596598799	356930039	/nfs/dbraw/zinc/93/00/39/356930039.db2.gz	KSBBCAZKMKCOTJ-UHFFFAOYSA-N	1	1	318.381	1.609	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000597792849	357331389	/nfs/dbraw/zinc/33/13/89/357331389.db2.gz	BPAHLLCWJBFZRN-NSHDSACASA-N	1	1	323.349	1.141	20	5		DDBDMO
COCCN1CCC[C@H](NC(=O)c2cccc([O-])c2[N+](=O)[O-])C1	ZINC000597792849	357331392	/nfs/dbraw/zinc/33/13/92/357331392.db2.gz	BPAHLLCWJBFZRN-NSHDSACASA-N	1	1	323.349	1.141	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000597857376	357360480	/nfs/dbraw/zinc/36/04/80/357360480.db2.gz	FRVXFSMESXVEAB-SNVBAGLBSA-N	1	1	306.366	1.780	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000597924423	357383433	/nfs/dbraw/zinc/38/34/33/357383433.db2.gz	REYRUZZVKXTJLI-JTQLQIEISA-N	1	1	306.366	1.780	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000598342912	357545021	/nfs/dbraw/zinc/54/50/21/357545021.db2.gz	OUHWMDXRELPQTR-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000598747072	357713895	/nfs/dbraw/zinc/71/38/95/357713895.db2.gz	VLLRTFUFDZCMRX-SECBINFHSA-N	1	1	308.338	1.298	20	5		DDBDMO
O=C1[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCN1C1CCC1	ZINC000599020584	357796359	/nfs/dbraw/zinc/79/63/59/357796359.db2.gz	TXJJHQAACAKSSO-AWEZNQCLSA-N	1	1	307.325	1.977	20	5		DDBDMO
CCOc1ccc([C@@H](C)NC[C@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000600710236	358290782	/nfs/dbraw/zinc/29/07/82/358290782.db2.gz	MUAJAHXTJXTOAZ-YPMHNXCESA-N	1	1	309.366	1.633	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000600809432	358320880	/nfs/dbraw/zinc/32/08/80/358320880.db2.gz	YKIXVSXAOKRTAY-LBPRGKRZSA-N	1	1	307.350	1.008	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000276627920	213009882	/nfs/dbraw/zinc/00/98/82/213009882.db2.gz	VRYGDUKREGRVPS-NEPJUHHUSA-N	1	1	320.349	1.815	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc3ncc([N+](=O)[O-])n3n2)C[C@H]1C	ZINC000348109422	283372847	/nfs/dbraw/zinc/37/28/47/283372847.db2.gz	VLXMWIGSXGNZTM-MNOVXSKESA-N	1	1	304.354	1.556	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000180953243	199232758	/nfs/dbraw/zinc/23/27/58/199232758.db2.gz	NJLQXKIIBHPWMC-JTQLQIEISA-N	1	1	317.349	1.748	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601170141	358431355	/nfs/dbraw/zinc/43/13/55/358431355.db2.gz	XFNKJUPXSGQBDI-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601170141	358431359	/nfs/dbraw/zinc/43/13/59/358431359.db2.gz	XFNKJUPXSGQBDI-QMMMGPOBSA-N	1	1	321.303	1.878	20	5		DDBDMO
CN(C[C@H]1COCCO1)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601195015	358442334	/nfs/dbraw/zinc/44/23/34/358442334.db2.gz	ZTHLFYBLSVYEBH-LBPRGKRZSA-N	1	1	303.318	1.995	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)C[C@](C)(O)C1CC1	ZINC000601956532	358752811	/nfs/dbraw/zinc/75/28/11/358752811.db2.gz	RUNLZTJFGASDIC-HOCLYGCPSA-N	1	1	308.378	1.939	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)C[C@](C)(O)C1CC1	ZINC000601956532	358752814	/nfs/dbraw/zinc/75/28/14/358752814.db2.gz	RUNLZTJFGASDIC-HOCLYGCPSA-N	1	1	308.378	1.939	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c2c(c1)COCO2	ZINC000601976983	358762748	/nfs/dbraw/zinc/76/27/48/358762748.db2.gz	SFQHIDJEFSUMJK-BETUJISGSA-N	1	1	306.318	1.540	20	5		DDBDMO
COc1ccc(CNC(=O)C[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000602080587	358804064	/nfs/dbraw/zinc/80/40/64/358804064.db2.gz	PYFUYWQILCYTSC-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(N3CCCCC3=O)CC2)c([N+](=O)[O-])n1	ZINC000602483873	359008921	/nfs/dbraw/zinc/00/89/21/359008921.db2.gz	JIBCWSIDEGHPHY-UHFFFAOYSA-N	1	1	321.381	1.305	20	5		DDBDMO
CC(=O)NC1CCC([N@H+](C)Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602606192	359069566	/nfs/dbraw/zinc/06/95/66/359069566.db2.gz	BRJXBLPVZFWQQG-UHFFFAOYSA-N	1	1	309.370	1.207	20	5		DDBDMO
Cn1cc(C[N@H+](C)C[C@@H](O)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602672280	359116719	/nfs/dbraw/zinc/11/67/19/359116719.db2.gz	YFCDZFMKQWRNSF-AWEZNQCLSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@@H](O)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602672280	359116726	/nfs/dbraw/zinc/11/67/26/359116726.db2.gz	YFCDZFMKQWRNSF-AWEZNQCLSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](CO)c1ccccc1	ZINC000602772816	359179732	/nfs/dbraw/zinc/17/97/32/359179732.db2.gz	KTPUANCEKGVTNH-CQSZACIVSA-N	1	1	304.350	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CCN(Cc3nnc[nH]3)CC2)cc1	ZINC000602866212	359250024	/nfs/dbraw/zinc/25/00/24/359250024.db2.gz	NJJKSQKVQDDNGH-UHFFFAOYSA-N	1	1	316.365	1.073	20	5		DDBDMO
CCOC(=O)CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C(C)C	ZINC000602873896	359257220	/nfs/dbraw/zinc/25/72/20/359257220.db2.gz	TXKQMCQMMCLAIG-UHFFFAOYSA-N	1	1	312.370	1.763	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C[C@@]1(C)C(=O)NC2=O	ZINC000602933462	359303487	/nfs/dbraw/zinc/30/34/87/359303487.db2.gz	DGUOCFJVLKOXMI-GASCZTMLSA-N	1	1	321.308	1.219	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@](C)(CO)C1	ZINC000602964530	359327883	/nfs/dbraw/zinc/32/78/83/359327883.db2.gz	QZKMVBBUWMCDFW-GJZGRUSLSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](OC)C[C@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964945	359328835	/nfs/dbraw/zinc/32/88/35/359328835.db2.gz	WNRYUACUJOVMMJ-CZUORRHYSA-N	1	1	324.377	1.965	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000602997599	359345850	/nfs/dbraw/zinc/34/58/50/359345850.db2.gz	NKDLRMNACFFHFG-MCIONIFRSA-N	1	1	308.382	1.725	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000603401263	359617883	/nfs/dbraw/zinc/61/78/83/359617883.db2.gz	KPMNSPJOJHQTOA-NSHDSACASA-N	1	1	324.356	1.818	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1	ZINC000603417408	359627014	/nfs/dbraw/zinc/62/70/14/359627014.db2.gz	YWZCXFVUXJBQHM-KBPBESRZSA-N	1	1	313.361	1.791	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000186963124	200038886	/nfs/dbraw/zinc/03/88/86/200038886.db2.gz	UGLQOHGLRDBMOI-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609399723	360304516	/nfs/dbraw/zinc/30/45/16/360304516.db2.gz	LPUNLAYTAOWHFE-AWEZNQCLSA-N	1	1	318.377	1.878	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CCCOCC1	ZINC000609766439	360349701	/nfs/dbraw/zinc/34/97/01/360349701.db2.gz	YPWOTSABSGARNR-UHFFFAOYSA-N	1	1	321.333	1.615	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C[C@@H]1C	ZINC000359020301	299308334	/nfs/dbraw/zinc/30/83/34/299308334.db2.gz	PUAGKZAOZTWVGH-NWDGAFQWSA-N	1	1	321.381	1.748	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000610240094	360395362	/nfs/dbraw/zinc/39/53/62/360395362.db2.gz	VJKUAIPGGHSDKO-CQSZACIVSA-N	1	1	303.362	1.738	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CCCO)C3CC3)n2)cc1	ZINC000609846142	360355439	/nfs/dbraw/zinc/35/54/39/360355439.db2.gz	GPYOKIBBFQIEBI-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+](CCCO)C3CC3)n2)cc1	ZINC000609846142	360355446	/nfs/dbraw/zinc/35/54/46/360355446.db2.gz	GPYOKIBBFQIEBI-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H](C(F)F)C2)c1	ZINC000611180227	360652174	/nfs/dbraw/zinc/65/21/74/360652174.db2.gz	VGILWVDWTVSJCA-CMPLNLGQSA-N	1	1	316.304	1.922	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611087626	360618633	/nfs/dbraw/zinc/61/86/33/360618633.db2.gz	ZIBMCHZCLUYAHO-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1C1CCN(c2ccsc2[N+](=O)[O-])CC1	ZINC000611242539	360676859	/nfs/dbraw/zinc/67/68/59/360676859.db2.gz	SJOZWHXHZDQLTC-LLVKDONJSA-N	1	1	324.406	1.575	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000611515544	360743230	/nfs/dbraw/zinc/74/32/30/360743230.db2.gz	DMYOAYTVTBFZNO-UHFFFAOYSA-N	1	1	313.379	1.185	20	5		DDBDMO
Cc1cc(C(=O)NCC2=CC[N@@H+](C)CC2)c(N)c([N+](=O)[O-])c1	ZINC000272021038	209391824	/nfs/dbraw/zinc/39/18/24/209391824.db2.gz	VFZFEAOEQBGEPW-UHFFFAOYSA-N	1	1	304.350	1.477	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000612672347	361103082	/nfs/dbraw/zinc/10/30/82/361103082.db2.gz	LHKKGOVDHHPYEF-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000612672347	361103085	/nfs/dbraw/zinc/10/30/85/361103085.db2.gz	LHKKGOVDHHPYEF-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000193574215	201078253	/nfs/dbraw/zinc/07/82/53/201078253.db2.gz	QMGNXXBZDBUEON-LLVKDONJSA-N	1	1	308.338	1.300	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CCC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000281577050	216394869	/nfs/dbraw/zinc/39/48/69/216394869.db2.gz	BGJXDBRLCVATFV-UHFFFAOYSA-N	1	1	323.397	1.828	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000566004708	304109716	/nfs/dbraw/zinc/10/97/16/304109716.db2.gz	ZLZDNVUVOHTBSX-GFCCVEGCSA-N	1	1	313.304	1.891	20	5		DDBDMO
O=C(CCN1C[C@@H]2C[NH2+]C[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000359305287	299405772	/nfs/dbraw/zinc/40/57/72/299405772.db2.gz	KTBHMENRKKTCNT-RYUDHWBXSA-N	1	1	304.350	1.075	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288285867	220063067	/nfs/dbraw/zinc/06/30/67/220063067.db2.gz	GOGRYCBOZDYJQB-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000288496021	220180530	/nfs/dbraw/zinc/18/05/30/220180530.db2.gz	QAFYQCBWQHZQEH-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000267998218	206384886	/nfs/dbraw/zinc/38/48/86/206384886.db2.gz	ULCWXUVLZJZGPS-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000106395774	194206474	/nfs/dbraw/zinc/20/64/74/194206474.db2.gz	XNPRSZQIXZGPRD-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
CN(C)[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000109805556	194287883	/nfs/dbraw/zinc/28/78/83/194287883.db2.gz	IIJQUVHRQCYENK-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(C)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000109805556	194287885	/nfs/dbraw/zinc/28/78/85/194287885.db2.gz	IIJQUVHRQCYENK-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)CCCO	ZINC000109798664	194286974	/nfs/dbraw/zinc/28/69/74/194286974.db2.gz	XWAHVHCTTCMLHH-UHFFFAOYSA-N	1	1	312.366	1.559	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)CCCO	ZINC000109798664	194286975	/nfs/dbraw/zinc/28/69/75/194286975.db2.gz	XWAHVHCTTCMLHH-UHFFFAOYSA-N	1	1	312.366	1.559	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N(C)CCC[N@H+](C)CCN(C)C)n1	ZINC000341043012	251352205	/nfs/dbraw/zinc/35/22/05/251352205.db2.gz	IABZHJKXOQTEAW-UHFFFAOYSA-N	1	1	323.441	1.926	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N(C)CCCN(C)CC[NH+](C)C)n1	ZINC000341043012	251352206	/nfs/dbraw/zinc/35/22/06/251352206.db2.gz	IABZHJKXOQTEAW-UHFFFAOYSA-N	1	1	323.441	1.926	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269181810	207302334	/nfs/dbraw/zinc/30/23/34/207302334.db2.gz	LMIFSYJITFLXRJ-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269181810	207302337	/nfs/dbraw/zinc/30/23/37/207302337.db2.gz	LMIFSYJITFLXRJ-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@H]1n1ccnc1	ZINC000120202156	195118575	/nfs/dbraw/zinc/11/85/75/195118575.db2.gz	XHRZIOTYENHYSJ-JSGCOSHPSA-N	1	1	304.354	1.571	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCC[C@H]1CCC[NH2+]1	ZINC000261601220	285156544	/nfs/dbraw/zinc/15/65/44/285156544.db2.gz	BQYOGVNNWLRYGZ-SECBINFHSA-N	1	1	317.342	1.154	20	5		DDBDMO
CCOCCO[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000157625651	197202499	/nfs/dbraw/zinc/20/24/99/197202499.db2.gz	FYOWEKCVPFTZSZ-HOTGVXAUSA-N	1	1	324.377	1.756	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000419350880	533137360	/nfs/dbraw/zinc/13/73/60/533137360.db2.gz	ZYWFAGMMRKAWIR-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000419317803	533221337	/nfs/dbraw/zinc/22/13/37/533221337.db2.gz	APMDUYWKCNIWBP-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000451578802	533414686	/nfs/dbraw/zinc/41/46/86/533414686.db2.gz	XRDYSKLTIYLPEE-GZBFAFLISA-N	1	1	324.377	1.691	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2ccc([N+](=O)[O-])c(C)c2)CC[N@@H+](C)C1	ZINC000413511425	533491316	/nfs/dbraw/zinc/49/13/16/533491316.db2.gz	ZPPXCCZZAOLRPI-LBPRGKRZSA-N	1	1	307.350	1.444	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000330897375	533603998	/nfs/dbraw/zinc/60/39/98/533603998.db2.gz	HLLLYKIXJRLJSP-NEPJUHHUSA-N	1	1	307.350	1.573	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c1[N+](=O)[O-]	ZINC000193248246	292086567	/nfs/dbraw/zinc/08/65/67/292086567.db2.gz	XCTHZPAETDCFRZ-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCOCC3)C2)n1	ZINC000125591342	292286476	/nfs/dbraw/zinc/28/64/76/292286476.db2.gz	KIPGIZZTYXCTJP-CQSZACIVSA-N	1	1	320.393	1.847	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000073995422	406899202	/nfs/dbraw/zinc/89/92/02/406899202.db2.gz	ACIMKQBBZOCNOL-OLZOCXBDSA-N	1	1	321.381	1.185	20	5		DDBDMO
CO[C@@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000076345962	406965406	/nfs/dbraw/zinc/96/54/06/406965406.db2.gz	SRGIAYKIRHBLMQ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000076345962	406965408	/nfs/dbraw/zinc/96/54/08/406965408.db2.gz	SRGIAYKIRHBLMQ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2cccs2)C2CC2)c1	ZINC000075597180	406935753	/nfs/dbraw/zinc/93/57/53/406935753.db2.gz	VWJMOCYLQUUBMO-CYBMUJFWSA-N	1	1	322.390	1.878	20	5		DDBDMO
C[C@H]1c2cccn2CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075612008	406937396	/nfs/dbraw/zinc/93/73/96/406937396.db2.gz	QQTRBHWTYFGOKQ-AAEUAGOBSA-N	1	1	305.338	1.031	20	5		DDBDMO
C[C@H]1c2cccn2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075612008	406937398	/nfs/dbraw/zinc/93/73/98/406937398.db2.gz	QQTRBHWTYFGOKQ-AAEUAGOBSA-N	1	1	305.338	1.031	20	5		DDBDMO
CNC(=O)c1ccc(NCC[N@@H+](C)CCCOC)c([N+](=O)[O-])c1	ZINC000078372757	407026044	/nfs/dbraw/zinc/02/60/44/407026044.db2.gz	TYFVNIAAQDCIDY-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@@H](C)C1	ZINC000046952149	407067252	/nfs/dbraw/zinc/06/72/52/407067252.db2.gz	WKGPRRHWSMEWIA-NEPJUHHUSA-N	1	1	309.370	1.028	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000066832296	407260461	/nfs/dbraw/zinc/26/04/61/407260461.db2.gz	DWCNBGDYVBCNCA-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H]3CO)n2)cc1	ZINC000101546651	407310631	/nfs/dbraw/zinc/31/06/31/407310631.db2.gz	KNONQHCFXOBTEJ-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3CO)n2)cc1	ZINC000101546651	407310633	/nfs/dbraw/zinc/31/06/33/407310633.db2.gz	KNONQHCFXOBTEJ-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000125323735	407385350	/nfs/dbraw/zinc/38/53/50/407385350.db2.gz	ANQPYLWKAOELEE-NSHDSACASA-N	1	1	309.370	1.132	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000125224100	407381883	/nfs/dbraw/zinc/38/18/83/407381883.db2.gz	IUDPJRCCILMRBC-KBPBESRZSA-N	1	1	319.409	1.960	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000185820261	407512395	/nfs/dbraw/zinc/51/23/95/407512395.db2.gz	QTDXWVQKRDJVPU-WCBMZHEXSA-N	1	1	306.322	1.050	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000114063712	407539919	/nfs/dbraw/zinc/53/99/19/407539919.db2.gz	JVBSHHDAPHXZRD-NSHDSACASA-N	1	1	323.349	1.299	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000114063712	407539923	/nfs/dbraw/zinc/53/99/23/407539923.db2.gz	JVBSHHDAPHXZRD-NSHDSACASA-N	1	1	323.349	1.299	20	5		DDBDMO
CC(C)COC[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000132588054	407792943	/nfs/dbraw/zinc/79/29/43/407792943.db2.gz	CVLDVYXBMWXZNX-INIZCTEOSA-N	1	1	308.378	1.986	20	5		DDBDMO
CC(C)COC[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000132588054	407792947	/nfs/dbraw/zinc/79/29/47/407792947.db2.gz	CVLDVYXBMWXZNX-INIZCTEOSA-N	1	1	308.378	1.986	20	5		DDBDMO
CC[C@H](C)NC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173473363	407882385	/nfs/dbraw/zinc/88/23/85/407882385.db2.gz	BROSCZJIYGSURI-RYUDHWBXSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[C@H](C)NC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173473363	407882389	/nfs/dbraw/zinc/88/23/89/407882389.db2.gz	BROSCZJIYGSURI-RYUDHWBXSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000118826162	407950686	/nfs/dbraw/zinc/95/06/86/407950686.db2.gz	FDAKXGZFGYJZFM-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CCCCNC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866835	407959560	/nfs/dbraw/zinc/95/95/60/407959560.db2.gz	KUJVCEGPNNCLGJ-GFCCVEGCSA-N	1	1	321.381	1.392	20	5		DDBDMO
CCCCNC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866835	407959566	/nfs/dbraw/zinc/95/95/66/407959566.db2.gz	KUJVCEGPNNCLGJ-GFCCVEGCSA-N	1	1	321.381	1.392	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000268162941	407923532	/nfs/dbraw/zinc/92/35/32/407923532.db2.gz	ILSBHFSSDNCDSJ-ZWNOBZJWSA-N	1	1	319.361	1.816	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000154218847	407996666	/nfs/dbraw/zinc/99/66/66/407996666.db2.gz	UOCAXOXNHFMONH-JSGCOSHPSA-N	1	1	307.350	1.086	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC[N@H+](C)C(C)C	ZINC000155588014	408182871	/nfs/dbraw/zinc/18/28/71/408182871.db2.gz	QKPAAGLLYACPRG-UHFFFAOYSA-N	1	1	315.395	1.522	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@@H+](C)CC2)cc([N+](=O)[O-])c1C	ZINC000190428057	408242174	/nfs/dbraw/zinc/24/21/74/408242174.db2.gz	SCVZYNANTSOCBN-UHFFFAOYSA-N	1	1	307.350	1.690	20	5		DDBDMO
CSCC[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000151155711	408266372	/nfs/dbraw/zinc/26/63/72/408266372.db2.gz	VGJZMZOSDGGPAH-LBPRGKRZSA-N	1	1	300.380	1.629	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000263711205	408217992	/nfs/dbraw/zinc/21/79/92/408217992.db2.gz	NECWVKLFSBMANW-SECBINFHSA-N	1	1	307.306	1.604	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000263711205	408217994	/nfs/dbraw/zinc/21/79/94/408217994.db2.gz	NECWVKLFSBMANW-SECBINFHSA-N	1	1	307.306	1.604	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1	ZINC000264037778	408351964	/nfs/dbraw/zinc/35/19/64/408351964.db2.gz	BFYGFRZCPLXPQT-UHFFFAOYSA-N	1	1	316.361	1.714	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[NH+]2CCOCC2)c1	ZINC000172922443	162312716	/nfs/dbraw/zinc/31/27/16/162312716.db2.gz	DRCQEFZHQBDPRW-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cn1cncc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000177083837	408514861	/nfs/dbraw/zinc/51/48/61/408514861.db2.gz	BATSCCLIMIDISV-NSHDSACASA-N	1	1	302.338	1.410	20	5		DDBDMO
Cn1cncc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000177083837	408514864	/nfs/dbraw/zinc/51/48/64/408514864.db2.gz	BATSCCLIMIDISV-NSHDSACASA-N	1	1	302.338	1.410	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000248344808	408550130	/nfs/dbraw/zinc/55/01/30/408550130.db2.gz	MASKDINFEUFIKL-BMIGLBTASA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000248344808	408550136	/nfs/dbraw/zinc/55/01/36/408550136.db2.gz	MASKDINFEUFIKL-BMIGLBTASA-N	1	1	323.349	1.387	20	5		DDBDMO
Cc1cc(S(=O)(=O)NCC[N@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000265186355	408573645	/nfs/dbraw/zinc/57/36/45/408573645.db2.gz	GBDPJRBPPBUQKH-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCOC1	ZINC000248462285	408573924	/nfs/dbraw/zinc/57/39/24/408573924.db2.gz	PTSJNEOHNTWFTD-UONOGXRCSA-N	1	1	324.377	1.693	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@H+](CCCO)CC3)nc2c1	ZINC000274797946	408535188	/nfs/dbraw/zinc/53/51/88/408535188.db2.gz	DPTQOSTVNDJNLS-UHFFFAOYSA-N	1	1	319.365	1.366	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000192795138	408649884	/nfs/dbraw/zinc/64/98/84/408649884.db2.gz	OHIPZHYPJABUSW-NWDGAFQWSA-N	1	1	309.366	1.495	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1O	ZINC000270900181	408731703	/nfs/dbraw/zinc/73/17/03/408731703.db2.gz	MKEAOHQIRUNWSD-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
CN1CC[NH+](CCCNc2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC000265505784	408674867	/nfs/dbraw/zinc/67/48/67/408674867.db2.gz	JISRLFJHXDZYBD-UHFFFAOYSA-N	1	1	313.789	1.693	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000177980367	408750385	/nfs/dbraw/zinc/75/03/85/408750385.db2.gz	GQFVRRIOOBUKTL-OAHLLOKOSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@H]1C(=O)NCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000189288571	163093022	/nfs/dbraw/zinc/09/30/22/163093022.db2.gz	WTVBNGWAVQMUIL-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1CO	ZINC000190926518	163164598	/nfs/dbraw/zinc/16/45/98/163164598.db2.gz	AWVJWLBRHGXFAU-TYNCELHUSA-N	1	1	319.361	1.260	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC(F)(F)[C@@H](CO)C1	ZINC000292029949	408966672	/nfs/dbraw/zinc/96/66/72/408966672.db2.gz	YXOYRLFQRUVPPV-LLVKDONJSA-N	1	1	316.304	1.923	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC(F)(F)[C@@H](CO)C1	ZINC000292029949	408966673	/nfs/dbraw/zinc/96/66/73/408966673.db2.gz	YXOYRLFQRUVPPV-LLVKDONJSA-N	1	1	316.304	1.923	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1(CO)CCC1	ZINC000292081881	408977476	/nfs/dbraw/zinc/97/74/76/408977476.db2.gz	FWJGLIOOHGKMMN-UHFFFAOYSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@@H]1Cc2[nH+]cn(C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)c2C[C@H]1C	ZINC000295067197	409312296	/nfs/dbraw/zinc/31/22/96/409312296.db2.gz	CGWUPRPRYITLLO-NQBHXWOUSA-N	1	1	319.365	1.420	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000296094282	409426638	/nfs/dbraw/zinc/42/66/38/409426638.db2.gz	DEEQKEVEFOYANT-MRXNPFEDSA-N	1	1	322.361	1.649	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)C1CC1	ZINC000290537588	409436095	/nfs/dbraw/zinc/43/60/95/409436095.db2.gz	DTQIQFVJXBSAIV-MRXNPFEDSA-N	1	1	316.361	1.913	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CCN1C(=O)CCC1=O	ZINC000285449341	409449991	/nfs/dbraw/zinc/44/99/91/409449991.db2.gz	YJNIOMNYZAZTML-UHFFFAOYSA-N	1	1	305.334	1.218	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000354080688	409635327	/nfs/dbraw/zinc/63/53/27/409635327.db2.gz	WVVQOHZKOIOJKM-CYBMUJFWSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H](c2ccccc2)C1	ZINC000354521308	409915012	/nfs/dbraw/zinc/91/50/12/409915012.db2.gz	NHZDAZDFWUSWHK-DGCLKSJQSA-N	1	1	315.333	1.146	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000338419293	409971900	/nfs/dbraw/zinc/97/19/00/409971900.db2.gz	LTUBMUNATQXNQT-UHFFFAOYSA-N	1	1	308.382	1.853	20	5		DDBDMO
C[C@H]1CCNC(=O)[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332215415	409987302	/nfs/dbraw/zinc/98/73/02/409987302.db2.gz	WPRQSTJYAHDYLW-SDBXPKJASA-N	1	1	303.322	1.085	20	5		DDBDMO
CCC[C@@H]1CN(c2c([N+](=O)[O-])ncn2C)CC[N@H+]1CCOC	ZINC000346659759	410065022	/nfs/dbraw/zinc/06/50/22/410065022.db2.gz	RILQGZCMTBFTIG-GFCCVEGCSA-N	1	1	311.386	1.265	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687670	410084006	/nfs/dbraw/zinc/08/40/06/410084006.db2.gz	MIAQHRZRLVQGLS-YWPYICTPSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687670	410084009	/nfs/dbraw/zinc/08/40/09/410084009.db2.gz	MIAQHRZRLVQGLS-YWPYICTPSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cn1cc(CC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cn1	ZINC000298046117	410090947	/nfs/dbraw/zinc/09/09/47/410090947.db2.gz	IAHKAJSTHLJKKH-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000351774283	410224409	/nfs/dbraw/zinc/22/44/09/410224409.db2.gz	LHMUFKMPQXOKHC-BFVZDQMLSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000351774283	410224415	/nfs/dbraw/zinc/22/44/15/410224415.db2.gz	LHMUFKMPQXOKHC-BFVZDQMLSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)[C@H](O)C1	ZINC000351945778	410356124	/nfs/dbraw/zinc/35/61/24/410356124.db2.gz	ULEJACICEDUGJC-ZWNOBZJWSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)CC[N@@H+](C)C1CC1	ZINC000351962455	410376095	/nfs/dbraw/zinc/37/60/95/410376095.db2.gz	WYLMOBUAXRUMGH-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000299069159	410505643	/nfs/dbraw/zinc/50/56/43/410505643.db2.gz	OISGJUWUXRNRDP-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H](C)O	ZINC000352228776	410562232	/nfs/dbraw/zinc/56/22/32/410562232.db2.gz	AMZOYGGQZDGMSG-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H](C)O	ZINC000352228776	410562238	/nfs/dbraw/zinc/56/22/38/410562238.db2.gz	AMZOYGGQZDGMSG-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ncccc3[N+](=O)[O-])CC2)CCO1	ZINC000301117294	410657850	/nfs/dbraw/zinc/65/78/50/410657850.db2.gz	WWHHFCPAILHPDO-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1CC(C)(C)O	ZINC000330449418	410700334	/nfs/dbraw/zinc/70/03/34/410700334.db2.gz	HMMUDEHGXFNEKA-GFCCVEGCSA-N	1	1	323.393	1.577	20	5		DDBDMO
C[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000330449418	410700339	/nfs/dbraw/zinc/70/03/39/410700339.db2.gz	HMMUDEHGXFNEKA-GFCCVEGCSA-N	1	1	323.393	1.577	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)NCC[NH+]2CCCC2)c(F)c1	ZINC000340167638	410722069	/nfs/dbraw/zinc/72/20/69/410722069.db2.gz	YEIMIXXAUPVWLF-UHFFFAOYSA-N	1	1	317.342	1.108	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000301507759	410733222	/nfs/dbraw/zinc/73/32/22/410733222.db2.gz	HMLKTWVJQWVXJL-CHWSQXEVSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000337476469	410815302	/nfs/dbraw/zinc/81/53/02/410815302.db2.gz	SJWHAPYXTZMOCF-RYUDHWBXSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cc1nc(N2CCC[C@H]2C[N@H+]2CCC[C@@H]2CO)ccc1[N+](=O)[O-]	ZINC000301662801	410765603	/nfs/dbraw/zinc/76/56/03/410765603.db2.gz	NDSWHYVPUMRNEH-UONOGXRCSA-N	1	1	320.393	1.724	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000330647658	410847287	/nfs/dbraw/zinc/84/72/87/410847287.db2.gz	ZRWQHQLOOIBENL-VXGBXAGGSA-N	1	1	307.350	1.525	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)C[C@H]1C	ZINC000330664888	410858487	/nfs/dbraw/zinc/85/84/87/410858487.db2.gz	GSBIUPYNXNFQJF-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H](C)[NH+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000302778193	410864103	/nfs/dbraw/zinc/86/41/03/410864103.db2.gz	PWKIKCVIFNWDOR-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000330673182	410867099	/nfs/dbraw/zinc/86/70/99/410867099.db2.gz	OZALNYGVSJDJGQ-NSHDSACASA-N	1	1	323.349	1.145	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000330673182	410867106	/nfs/dbraw/zinc/86/71/06/410867106.db2.gz	OZALNYGVSJDJGQ-NSHDSACASA-N	1	1	323.349	1.145	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)nc2c1	ZINC000344041291	410914645	/nfs/dbraw/zinc/91/46/45/410914645.db2.gz	IEIFVKSIBZPONF-UFGOTCBOSA-N	1	1	303.318	1.939	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000344133175	410978975	/nfs/dbraw/zinc/97/89/75/410978975.db2.gz	PVXWHSINWAOKJG-HZSPNIEDSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CO)C[C@@H]1C	ZINC000344143397	410987611	/nfs/dbraw/zinc/98/76/11/410987611.db2.gz	BQBAGPBVVZNXQB-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](CO)C[C@@H]1C	ZINC000344143397	410987619	/nfs/dbraw/zinc/98/76/19/410987619.db2.gz	BQBAGPBVVZNXQB-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356464312	411042898	/nfs/dbraw/zinc/04/28/98/411042898.db2.gz	JQELRXYHYOSWSK-LLVKDONJSA-N	1	1	309.370	1.323	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000134118046	196363933	/nfs/dbraw/zinc/36/39/33/196363933.db2.gz	PYYZBSGCPCZVKS-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@@H+]2CCCOc1ccc([N+](=O)[O-])cc1	ZINC000366908553	418534768	/nfs/dbraw/zinc/53/47/68/418534768.db2.gz	DKOHKXVIYFDQCA-HUUCEWRRSA-N	1	1	319.361	1.574	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360937555	418550785	/nfs/dbraw/zinc/55/07/85/418550785.db2.gz	LPROCLPFMDMKRS-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360937555	418550788	/nfs/dbraw/zinc/55/07/88/418550788.db2.gz	LPROCLPFMDMKRS-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CC(C)C[N@@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])s2)C1	ZINC000195506416	222203921	/nfs/dbraw/zinc/20/39/21/222203921.db2.gz	DVYBRKMCUOAFOQ-SNVBAGLBSA-N	1	1	300.384	1.820	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])s2)C1	ZINC000195506416	222203922	/nfs/dbraw/zinc/20/39/22/222203922.db2.gz	DVYBRKMCUOAFOQ-SNVBAGLBSA-N	1	1	300.384	1.820	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000291190123	222208142	/nfs/dbraw/zinc/20/81/42/222208142.db2.gz	SRLAKKSUEBRMHP-SNVBAGLBSA-N	1	1	309.370	1.621	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000375053031	418596226	/nfs/dbraw/zinc/59/62/26/418596226.db2.gz	DWUBOMYXJFZFGQ-ZFWWWQNUSA-N	1	1	303.362	1.690	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000361414272	418648502	/nfs/dbraw/zinc/64/85/02/418648502.db2.gz	ILSFYHKNTIMSRU-SMDDNHRTSA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](n3cncn3)C2)cc1	ZINC000375316547	418627559	/nfs/dbraw/zinc/62/75/59/418627559.db2.gz	DRSMKMMDGJHUDN-ZDUSSCGKSA-N	1	1	303.322	1.512	20	5		DDBDMO
CCn1cc(CC[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000375726087	418677412	/nfs/dbraw/zinc/67/74/12/418677412.db2.gz	GMYGQDAHZAFVSA-AWEZNQCLSA-N	1	1	318.381	1.887	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCOC1	ZINC000361580000	418684711	/nfs/dbraw/zinc/68/47/11/418684711.db2.gz	YYCPUOZZICZWPF-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCOC1	ZINC000361580000	418684714	/nfs/dbraw/zinc/68/47/14/418684714.db2.gz	YYCPUOZZICZWPF-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)CCOc1ccc([N+](=O)[O-])cc1	ZINC000361583631	418686659	/nfs/dbraw/zinc/68/66/59/418686659.db2.gz	LPGOJQURIIQLMF-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OC	ZINC000361662031	418697034	/nfs/dbraw/zinc/69/70/34/418697034.db2.gz	PFSWXKMPMJJOFV-JQWIXIFHSA-N	1	1	310.350	1.672	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000361707615	418699679	/nfs/dbraw/zinc/69/96/79/418699679.db2.gz	WMAVSOZLDNEYQR-RYUDHWBXSA-N	1	1	306.366	1.490	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1CO	ZINC000362061350	418746250	/nfs/dbraw/zinc/74/62/50/418746250.db2.gz	AWVJWLBRHGXFAU-JMSVASOKSA-N	1	1	319.361	1.260	20	5		DDBDMO
Cc1cc(C(=O)N2CCC[N@H+]([C@@H](C)CO)CC2)cc([N+](=O)[O-])c1	ZINC000364922268	418823065	/nfs/dbraw/zinc/82/30/65/418823065.db2.gz	MQEUVYRMDRSAOZ-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC(C)CNC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290151	418852224	/nfs/dbraw/zinc/85/22/24/418852224.db2.gz	VRYMMDBOGHEVIL-CHWSQXEVSA-N	1	1	323.397	1.589	20	5		DDBDMO
CC(C)CNC(=O)[C@@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290151	418852226	/nfs/dbraw/zinc/85/22/26/418852226.db2.gz	VRYMMDBOGHEVIL-CHWSQXEVSA-N	1	1	323.397	1.589	20	5		DDBDMO
NC(=O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411153224	418874119	/nfs/dbraw/zinc/87/41/19/418874119.db2.gz	IESOLRNITRKAHF-CYBMUJFWSA-N	1	1	320.349	1.263	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(CCC[C@@H]3[NH3+])C2)c1[N+](=O)[O-]	ZINC000372788097	418902476	/nfs/dbraw/zinc/90/24/76/418902476.db2.gz	TXJCABZQDQUKNR-XHDPSFHLSA-N	1	1	321.381	1.614	20	5		DDBDMO
COCC(COC)[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000411859319	419441682	/nfs/dbraw/zinc/44/16/82/419441682.db2.gz	KELKEWFUCPQDAB-UHFFFAOYSA-N	1	1	323.393	1.374	20	5		DDBDMO
CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCC[N@H+]1C	ZINC000421011088	419449327	/nfs/dbraw/zinc/44/93/27/419449327.db2.gz	RSQCCCUXZSVORW-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011088	419449338	/nfs/dbraw/zinc/44/93/38/419449338.db2.gz	RSQCCCUXZSVORW-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011088	419449347	/nfs/dbraw/zinc/44/93/47/419449347.db2.gz	RSQCCCUXZSVORW-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1	ZINC000299293157	229033083	/nfs/dbraw/zinc/03/30/83/229033083.db2.gz	KVLSOTTXTCJKNJ-NEPJUHHUSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[C@H]([NH3+])C1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000430922429	420206697	/nfs/dbraw/zinc/20/66/97/420206697.db2.gz	AGVAOLMMIBAMFG-RYUDHWBXSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000416303858	420320651	/nfs/dbraw/zinc/32/06/51/420320651.db2.gz	HMXGOVLBYDOHJA-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000420740718	420374683	/nfs/dbraw/zinc/37/46/83/420374683.db2.gz	RVLJXDFMYDXACA-GFCCVEGCSA-N	1	1	313.379	1.310	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@H]2CC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000416496927	420395581	/nfs/dbraw/zinc/39/55/81/420395581.db2.gz	RJGVDSLQRXMUDW-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)CC[NH+]1CCOCC1	ZINC000446048742	230220176	/nfs/dbraw/zinc/22/01/76/230220176.db2.gz	VXWPDXRZHYJRLF-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000457092333	420609276	/nfs/dbraw/zinc/60/92/76/420609276.db2.gz	XIGCBLCKNDSHMI-ZDUSSCGKSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1nccc2cc([N+](=O)[O-])ccc21	ZINC000450953399	420569296	/nfs/dbraw/zinc/56/92/96/420569296.db2.gz	KSILNOSYEAUHGU-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000492626801	420610496	/nfs/dbraw/zinc/61/04/96/420610496.db2.gz	ZPGWGILPUQLABY-FPLPWBNLSA-N	1	1	307.350	1.038	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000442309770	420678896	/nfs/dbraw/zinc/67/88/96/420678896.db2.gz	UDOXXMQARJQSRQ-QWRGUYRKSA-N	1	1	320.349	1.084	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000442309770	420678901	/nfs/dbraw/zinc/67/89/01/420678901.db2.gz	UDOXXMQARJQSRQ-QWRGUYRKSA-N	1	1	320.349	1.084	20	5		DDBDMO
CCOC[C@@H]1CCCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000459706767	420852696	/nfs/dbraw/zinc/85/26/96/420852696.db2.gz	JEAHJLPCSPMOSU-JSGCOSHPSA-N	1	1	312.370	1.043	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C/c3ccc(F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000493524282	420872915	/nfs/dbraw/zinc/87/29/15/420872915.db2.gz	OYGBROONABWOPQ-MOEUOMFESA-N	1	1	319.336	1.910	20	5		DDBDMO
C[C@H](C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)C(=O)OC(C)(C)C	ZINC000459810178	420879950	/nfs/dbraw/zinc/87/99/50/420879950.db2.gz	PZORAKJDBIUKFV-LLVKDONJSA-N	1	1	312.370	1.701	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCCc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000454570944	420884866	/nfs/dbraw/zinc/88/48/66/420884866.db2.gz	DYKDRLVYYJBRJR-HIFRSBDPSA-N	1	1	318.377	1.483	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000454790630	420925177	/nfs/dbraw/zinc/92/51/77/420925177.db2.gz	CSQSASTUJPHKQR-MNOVXSKESA-N	1	1	319.365	1.388	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456026296	421091056	/nfs/dbraw/zinc/09/10/56/421091056.db2.gz	WZIYGHJULSACPS-UWVGGRQHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456026296	421091058	/nfs/dbraw/zinc/09/10/58/421091058.db2.gz	WZIYGHJULSACPS-UWVGGRQHSA-N	1	1	307.354	1.196	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000488717126	421107335	/nfs/dbraw/zinc/10/73/35/421107335.db2.gz	KGBTXMSTHOJIKE-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450305626	421179576	/nfs/dbraw/zinc/17/95/76/421179576.db2.gz	AXQOTBOCMYUPKD-GFCCVEGCSA-N	1	1	319.365	1.416	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000560452886	421266849	/nfs/dbraw/zinc/26/68/49/421266849.db2.gz	NCDPRYZFZFRTIE-UHFFFAOYSA-N	1	1	318.377	1.938	20	5		DDBDMO
CCOC(=O)COCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000562036749	421340512	/nfs/dbraw/zinc/34/05/12/421340512.db2.gz	NMWSLOHKRIKPTF-UHFFFAOYSA-N	1	1	308.334	1.533	20	5		DDBDMO
CCOC(=O)COCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000562036749	421340514	/nfs/dbraw/zinc/34/05/14/421340514.db2.gz	NMWSLOHKRIKPTF-UHFFFAOYSA-N	1	1	308.334	1.533	20	5		DDBDMO
O=C1OCCN1C[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000497293697	421402783	/nfs/dbraw/zinc/40/27/83/421402783.db2.gz	AMIBHPJJIUYUTH-GFCCVEGCSA-N	1	1	305.334	1.869	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000548714448	421466018	/nfs/dbraw/zinc/46/60/18/421466018.db2.gz	JUGKHPHISIVVFY-LLVKDONJSA-N	1	1	321.381	1.280	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000577076014	422381075	/nfs/dbraw/zinc/38/10/75/422381075.db2.gz	AUGBPNDDGOJNLL-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000577076014	422381082	/nfs/dbraw/zinc/38/10/82/422381082.db2.gz	AUGBPNDDGOJNLL-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000341847520	271221242	/nfs/dbraw/zinc/22/12/42/271221242.db2.gz	XYORYLQZPCGIJR-JTQLQIEISA-N	1	1	320.349	1.733	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000345933149	272369165	/nfs/dbraw/zinc/36/91/65/272369165.db2.gz	AJOUXZLKUHILBL-RYUDHWBXSA-N	1	1	309.370	1.123	20	5		DDBDMO
COCC[NH+]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])CC1	ZINC000121345169	274030540	/nfs/dbraw/zinc/03/05/40/274030540.db2.gz	DCKJJOAAFQEEIB-UHFFFAOYSA-N	1	1	313.329	1.511	20	5		DDBDMO
CCC[N@H+]1CCCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000302791605	276006126	/nfs/dbraw/zinc/00/61/26/276006126.db2.gz	YVKRSYVHGKEBJY-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@@H]21	ZINC000408404817	277131028	/nfs/dbraw/zinc/13/10/28/277131028.db2.gz	JWRRITFUDABSQC-KBPBESRZSA-N	1	1	304.350	1.082	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C2)C1	ZINC000294031677	290187306	/nfs/dbraw/zinc/18/73/06/290187306.db2.gz	ZWHBSYHXYCVVBH-OAHLLOKOSA-N	1	1	304.350	1.345	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124900	300215438	/nfs/dbraw/zinc/21/54/38/300215438.db2.gz	DHMOEQNNMWIJQT-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000363124900	300215440	/nfs/dbraw/zinc/21/54/40/300215440.db2.gz	DHMOEQNNMWIJQT-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124900	300215442	/nfs/dbraw/zinc/21/54/42/300215442.db2.gz	DHMOEQNNMWIJQT-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)[nH]n1	ZINC000363171561	300225996	/nfs/dbraw/zinc/22/59/96/300225996.db2.gz	ZSEVUGJGSZWQSE-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)n[nH]1	ZINC000363171561	300225999	/nfs/dbraw/zinc/22/59/99/300225999.db2.gz	ZSEVUGJGSZWQSE-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n[nH]1	ZINC000363171561	300226001	/nfs/dbraw/zinc/22/60/01/300226001.db2.gz	ZSEVUGJGSZWQSE-GFCCVEGCSA-N	1	1	304.354	1.702	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000363304924	300248035	/nfs/dbraw/zinc/24/80/35/300248035.db2.gz	MBOLJWVVDLJXAC-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363304924	300248036	/nfs/dbraw/zinc/24/80/36/300248036.db2.gz	MBOLJWVVDLJXAC-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363304924	300248039	/nfs/dbraw/zinc/24/80/39/300248039.db2.gz	MBOLJWVVDLJXAC-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000364020017	300335415	/nfs/dbraw/zinc/33/54/15/300335415.db2.gz	XKXIWJXPHMZODY-VXGBXAGGSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccco2)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000364457668	300399850	/nfs/dbraw/zinc/39/98/50/300399850.db2.gz	ORULYDCSLJEWTM-KGLIPLIRSA-N	1	1	307.350	1.368	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CC[N@H+](C)C2)C1	ZINC000368349415	301008187	/nfs/dbraw/zinc/00/81/87/301008187.db2.gz	RPMWBJHMAZTQPZ-HNNXBMFYSA-N	1	1	304.350	1.466	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@H]2C[C@H]2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497262	301040985	/nfs/dbraw/zinc/04/09/85/301040985.db2.gz	XBSQUIIMJXFIBB-QKPAOTATSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497262	301040986	/nfs/dbraw/zinc/04/09/86/301040986.db2.gz	XBSQUIIMJXFIBB-QKPAOTATSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497262	301040988	/nfs/dbraw/zinc/04/09/88/301040988.db2.gz	XBSQUIIMJXFIBB-QKPAOTATSA-N	1	1	317.389	1.851	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368587547	301058675	/nfs/dbraw/zinc/05/86/75/301058675.db2.gz	DACMUPGTYLDVJN-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368587547	301058676	/nfs/dbraw/zinc/05/86/76/301058676.db2.gz	DACMUPGTYLDVJN-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000368587547	301058677	/nfs/dbraw/zinc/05/86/77/301058677.db2.gz	DACMUPGTYLDVJN-MWLCHTKSSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1nc([C@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370029642	301261726	/nfs/dbraw/zinc/26/17/26/301261726.db2.gz	SZGUAIKBYDWTAG-NSHDSACASA-N	1	1	320.353	1.616	20	5		DDBDMO
CCc1nc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370029642	301261728	/nfs/dbraw/zinc/26/17/28/301261728.db2.gz	SZGUAIKBYDWTAG-NSHDSACASA-N	1	1	320.353	1.616	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](Cc3ccncc3)C2)n1	ZINC000368632496	307106745	/nfs/dbraw/zinc/10/67/45/307106745.db2.gz	NHEJXEFCZAXYGV-AWEZNQCLSA-N	1	1	301.350	1.751	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034073	307114777	/nfs/dbraw/zinc/11/47/77/307114777.db2.gz	CIDVDKFTDUXVSS-ZFWWWQNUSA-N	1	1	321.333	1.203	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034073	307114778	/nfs/dbraw/zinc/11/47/78/307114778.db2.gz	CIDVDKFTDUXVSS-ZFWWWQNUSA-N	1	1	321.333	1.203	20	5		DDBDMO
Cc1nn(C)cc1[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000372737044	307174110	/nfs/dbraw/zinc/17/41/10/307174110.db2.gz	CTUOIWSJGGSPOE-CYBMUJFWSA-N	1	1	304.354	1.670	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000584300310	332230170	/nfs/dbraw/zinc/23/01/70/332230170.db2.gz	NMOZXNXUBJFUFD-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCC[C@@H]1C	ZINC000487986704	484212306	/nfs/dbraw/zinc/21/23/06/484212306.db2.gz	JZFOEXLZWYEGIN-DZGCQCFKSA-N	1	1	323.393	1.894	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000488736787	484217337	/nfs/dbraw/zinc/21/73/37/484217337.db2.gz	QYWDMGOFQQFENW-UPJWGTAASA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000562999885	484330034	/nfs/dbraw/zinc/33/00/34/484330034.db2.gz	PBKWMRLMNOMGSE-UHFFFAOYSA-N	1	1	300.318	1.685	20	5		DDBDMO
COc1cc(CN2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000419344559	533826889	/nfs/dbraw/zinc/82/68/89/533826889.db2.gz	SAOSHEOHHYWYNH-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc2ncccn2n1	ZINC000414259989	534254228	/nfs/dbraw/zinc/25/42/28/534254228.db2.gz	AOZZRSFDESFNTM-NSHDSACASA-N	1	1	312.333	1.753	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)[C@H](C)C1	ZINC000330832858	527750590	/nfs/dbraw/zinc/75/05/90/527750590.db2.gz	VKJCIBVOVSVOEE-ZWNOBZJWSA-N	1	1	321.381	1.374	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000331744403	528549661	/nfs/dbraw/zinc/54/96/61/528549661.db2.gz	YFZFDLCICWNKPK-CMPLNLGQSA-N	1	1	321.381	1.627	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262257	529339018	/nfs/dbraw/zinc/33/90/18/529339018.db2.gz	XDLNEBYOZMHOHR-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262257	529339019	/nfs/dbraw/zinc/33/90/19/529339019.db2.gz	XDLNEBYOZMHOHR-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000824860759	608197295	/nfs/dbraw/zinc/19/72/95/608197295.db2.gz	XSOQJIDPFURYPR-NXEZZACHSA-N	1	1	317.353	1.304	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000824994181	608554789	/nfs/dbraw/zinc/55/47/89/608554789.db2.gz	UBYRWGVADQRACN-UWVGGRQHSA-N	1	1	317.353	1.304	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122592403	696723606	/nfs/dbraw/zinc/72/36/06/696723606.db2.gz	QXUHNIGBYNJVIV-CHWSQXEVSA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122592403	696723607	/nfs/dbraw/zinc/72/36/07/696723607.db2.gz	QXUHNIGBYNJVIV-CHWSQXEVSA-N	1	1	323.397	1.766	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CCN(c3[nH]cc[nH+]3)CC2)c1	ZINC000798214824	700050573	/nfs/dbraw/zinc/05/05/73/700050573.db2.gz	NYENSXXZIXODLQ-UHFFFAOYSA-N	1	1	321.312	1.792	20	5		DDBDMO
C[N@H+](C[C@H]1CCCOC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000107672345	696631604	/nfs/dbraw/zinc/63/16/04/696631604.db2.gz	DBIMZUJLVLFSJQ-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
C[N@@H+](C[C@H]1CCCOC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000107672345	696631606	/nfs/dbraw/zinc/63/16/06/696631606.db2.gz	DBIMZUJLVLFSJQ-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCO)CC2)c(C(F)F)c1	ZINC000111291768	696643322	/nfs/dbraw/zinc/64/33/22/696643322.db2.gz	VTHWJUHZRPIMGF-UHFFFAOYSA-N	1	1	301.293	1.647	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@@H+]1C	ZINC000748351299	700112729	/nfs/dbraw/zinc/11/27/29/700112729.db2.gz	SUJBOSKCRRXZQX-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000748351299	700112732	/nfs/dbraw/zinc/11/27/32/700112732.db2.gz	SUJBOSKCRRXZQX-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
Cc1c(CC(=O)OCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000748474094	700120555	/nfs/dbraw/zinc/12/05/55/700120555.db2.gz	KZCCUEZBRGAUDI-UHFFFAOYSA-N	1	1	322.361	1.711	20	5		DDBDMO
CC(C)CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278807	697082304	/nfs/dbraw/zinc/08/23/04/697082304.db2.gz	RQGVWKXCTQXFTL-SRABZTEZSA-N	1	1	323.437	1.868	20	5		DDBDMO
CC(C)CC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278807	697082305	/nfs/dbraw/zinc/08/23/05/697082305.db2.gz	RQGVWKXCTQXFTL-SRABZTEZSA-N	1	1	323.437	1.868	20	5		DDBDMO
CC(C)CC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000982278807	697082307	/nfs/dbraw/zinc/08/23/07/697082307.db2.gz	RQGVWKXCTQXFTL-SRABZTEZSA-N	1	1	323.437	1.868	20	5		DDBDMO
Cc1ccc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC000983649822	697286524	/nfs/dbraw/zinc/28/65/24/697286524.db2.gz	SIWBVNSPXLLBFA-KLHDSHLOSA-N	1	1	317.389	1.645	20	5		DDBDMO
CCn1cc(C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000749691071	700177808	/nfs/dbraw/zinc/17/78/08/700177808.db2.gz	PCELMWDULYIJQR-OAHLLOKOSA-N	1	1	304.350	1.977	20	5		DDBDMO
CN1CCC[C@@H]([NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1=O	ZINC000778931832	698383757	/nfs/dbraw/zinc/38/37/57/698383757.db2.gz	FMUUALWEBLHSFW-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])[C@H](C)C1	ZINC000779708790	698455114	/nfs/dbraw/zinc/45/51/14/698455114.db2.gz	XYWHYOGIKJSHCV-VXGBXAGGSA-N	1	1	319.365	1.134	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H]2C[C@]2(CO)C1	ZINC000782614831	698751082	/nfs/dbraw/zinc/75/10/82/698751082.db2.gz	GLIRPRSPKXWYMV-BLLLJJGKSA-N	1	1	319.361	1.546	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CCC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000783918779	698892764	/nfs/dbraw/zinc/89/27/64/698892764.db2.gz	LVVCVCXTKRQZSF-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CO[C@@H]1C[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@@H]1C	ZINC000783969073	698896279	/nfs/dbraw/zinc/89/62/79/698896279.db2.gz	RYPGQAHNVPSBMJ-IINYFYTJSA-N	1	1	319.365	1.962	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@@H]1C	ZINC000783969073	698896284	/nfs/dbraw/zinc/89/62/84/698896284.db2.gz	RYPGQAHNVPSBMJ-IINYFYTJSA-N	1	1	319.365	1.962	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000787329726	699206056	/nfs/dbraw/zinc/20/60/56/699206056.db2.gz	DEYFIXNZNRPAFU-NGFQHRJXSA-N	1	1	319.361	1.214	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C2)CN1	ZINC000788381824	699310352	/nfs/dbraw/zinc/31/03/52/699310352.db2.gz	IFTHJMYXEBRBSU-OAHLLOKOSA-N	1	1	315.333	1.114	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(Cn3ncc4cc([N+](=O)[O-])ccc43)C2)C1	ZINC000793769385	699778183	/nfs/dbraw/zinc/77/81/83/699778183.db2.gz	UQYIOSDELHWCJZ-MRXNPFEDSA-N	1	1	315.377	1.930	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H](C)CO	ZINC000794693900	699824787	/nfs/dbraw/zinc/82/47/87/699824787.db2.gz	XDUWAXZOVHTFBD-SNVBAGLBSA-N	1	1	313.329	1.765	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801854263	700346331	/nfs/dbraw/zinc/34/63/31/700346331.db2.gz	GBPGYDDJDXILGI-JTQLQIEISA-N	1	1	324.356	1.776	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@@H]1C	ZINC000801934918	700357322	/nfs/dbraw/zinc/35/73/22/700357322.db2.gz	SSQPQBGYBXLIFK-UWVGGRQHSA-N	1	1	324.356	1.871	20	5		DDBDMO
O=C1OCC[C@@H]1CC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000753842972	700461603	/nfs/dbraw/zinc/46/16/03/700461603.db2.gz	OIGDRSULLQYKKY-LBPRGKRZSA-N	1	1	320.349	1.065	20	5		DDBDMO
CC(=O)[C@@](C)(O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000809570844	701670490	/nfs/dbraw/zinc/67/04/90/701670490.db2.gz	CARMAPRRGRHETE-HNNXBMFYSA-N	1	1	307.350	1.057	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000762816614	700908321	/nfs/dbraw/zinc/90/83/21/700908321.db2.gz	RUNVJAVKSHJRHW-CYBMUJFWSA-N	1	1	308.363	1.683	20	5		DDBDMO
C[N@H+](CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC000840013923	701912458	/nfs/dbraw/zinc/91/24/58/701912458.db2.gz	VXPJRCVZIAXQED-OAHLLOKOSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[N@@H+](CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC000840013923	701912461	/nfs/dbraw/zinc/91/24/61/701912461.db2.gz	VXPJRCVZIAXQED-OAHLLOKOSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000868075531	701927348	/nfs/dbraw/zinc/92/73/48/701927348.db2.gz	KXLFDLNUDGUOPQ-HIFRSBDPSA-N	1	1	318.377	1.830	20	5		DDBDMO
CC[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCOC1	ZINC000812298262	702141817	/nfs/dbraw/zinc/14/18/17/702141817.db2.gz	KMYLTXABZFKXBB-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCOC1	ZINC000812298262	702141821	/nfs/dbraw/zinc/14/18/21/702141821.db2.gz	KMYLTXABZFKXBB-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3nc4ccccn4c3[N+](=O)[O-])CC[C@@H]21	ZINC000866206015	706648603	/nfs/dbraw/zinc/64/86/03/706648603.db2.gz	ICIDIQGBTCXJBY-RYUDHWBXSA-N	1	1	301.350	1.773	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@H](CO)[C@H]2CO)cc1[N+](=O)[O-]	ZINC000879361337	706660589	/nfs/dbraw/zinc/66/05/89/706660589.db2.gz	CXJFVVPOFUINLM-GXTWGEPZSA-N	1	1	310.350	1.169	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](CO)[C@H]2CO)ccc1Cl	ZINC000879364385	706662471	/nfs/dbraw/zinc/66/24/71/706662471.db2.gz	WJYLBERAWCRILM-SMDDNHRTSA-N	1	1	314.769	1.813	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](CO)[C@H]2CO)ccc1Cl	ZINC000879364385	706662475	/nfs/dbraw/zinc/66/24/75/706662475.db2.gz	WJYLBERAWCRILM-SMDDNHRTSA-N	1	1	314.769	1.813	20	5		DDBDMO
CSCC[C@H]([NH3+])c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000843169914	702832630	/nfs/dbraw/zinc/83/26/30/702832630.db2.gz	WBPQFYJLJBJSFQ-VIFPVBQESA-N	1	1	309.351	1.980	20	5		DDBDMO
CC1(C)OC[C@@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)O1	ZINC000852150840	703946207	/nfs/dbraw/zinc/94/62/07/703946207.db2.gz	AKGMPAJUHDFKLT-GFCCVEGCSA-N	1	1	322.365	1.263	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC[NH+](C3CC3)CC2)c1	ZINC000818945631	704031302	/nfs/dbraw/zinc/03/13/02/704031302.db2.gz	MRTZXUVISOYHOA-INIZCTEOSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852437436	704048251	/nfs/dbraw/zinc/04/82/51/704048251.db2.gz	YCCMXDFGUWEPCD-UONOGXRCSA-N	1	1	321.333	1.155	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@@H]2C1	ZINC000819719204	704164440	/nfs/dbraw/zinc/16/44/40/704164440.db2.gz	PCGPZBZOUGTDOW-LKFCYVNXSA-N	1	1	322.340	1.482	20	5		DDBDMO
CCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1	ZINC000855489990	704487577	/nfs/dbraw/zinc/48/75/77/704487577.db2.gz	FGRNCESYXZIEMV-GFCCVEGCSA-N	1	1	306.366	1.733	20	5		DDBDMO
C/C(=C/C(=O)NCC[N@H+]1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000863319834	705900179	/nfs/dbraw/zinc/90/01/79/705900179.db2.gz	PIANAICXVPDSEJ-KUGGDMIFSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827310043	705972692	/nfs/dbraw/zinc/97/26/92/705972692.db2.gz	JJKDZNCTCYJWRH-UKRRQHHQSA-N	1	1	303.362	1.690	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827366710	705986589	/nfs/dbraw/zinc/98/65/89/705986589.db2.gz	OHOYIEYVMKANON-JSGCOSHPSA-N	1	1	318.377	1.803	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@]2(CNC(=O)C2)C1	ZINC000877485244	706120342	/nfs/dbraw/zinc/12/03/42/706120342.db2.gz	NNQOUNWGBJULCG-INIZCTEOSA-N	1	1	303.362	1.924	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000828544880	706197035	/nfs/dbraw/zinc/19/70/35/706197035.db2.gz	IEXSMBSTXJTECC-AWEZNQCLSA-N	1	1	305.334	1.006	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000877875787	706230562	/nfs/dbraw/zinc/23/05/62/706230562.db2.gz	RQLYKLFSRBTRLW-IUODEOHRSA-N	1	1	318.333	1.066	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000882478846	707649849	/nfs/dbraw/zinc/64/98/49/707649849.db2.gz	GXFJHHPTFRUOPC-CYBMUJFWSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000882486133	707656814	/nfs/dbraw/zinc/65/68/14/707656814.db2.gz	ZHQWWFOHLHOBCH-AWEZNQCLSA-N	1	1	316.361	1.760	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F	ZINC000882492288	707662919	/nfs/dbraw/zinc/66/29/19/707662919.db2.gz	PETMYVCDQZIWBC-JTQLQIEISA-N	1	1	324.356	1.624	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1NC[C@@]1(CO)COCC[NH2+]1	ZINC000882730912	707764333	/nfs/dbraw/zinc/76/43/33/707764333.db2.gz	PVZYUWMJNHMUQN-GFCCVEGCSA-N	1	1	301.730	1.011	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897219484	708257487	/nfs/dbraw/zinc/25/74/87/708257487.db2.gz	LDJGUJPJMUMFSS-OLZOCXBDSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000885953833	708670488	/nfs/dbraw/zinc/67/04/88/708670488.db2.gz	GXGJSLYWTGMXSY-OAHLLOKOSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H](CN2CCOCC2)C1	ZINC000886190169	708711862	/nfs/dbraw/zinc/71/18/62/708711862.db2.gz	DIAAXUMHCBEPEN-AWEZNQCLSA-N	1	1	320.393	1.534	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](CN2CCOCC2)C1	ZINC000886190169	708711864	/nfs/dbraw/zinc/71/18/64/708711864.db2.gz	DIAAXUMHCBEPEN-AWEZNQCLSA-N	1	1	320.393	1.534	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000912611533	713049680	/nfs/dbraw/zinc/04/96/80/713049680.db2.gz	DZSGBZSKQYYLJD-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
CN(C)S(=O)(=O)C1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CC1	ZINC000886322171	708742604	/nfs/dbraw/zinc/74/26/04/708742604.db2.gz	QLZLRRSOLKFTNJ-UHFFFAOYSA-N	1	1	319.408	1.170	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@H](C)C1	ZINC000910289182	709869014	/nfs/dbraw/zinc/86/90/14/709869014.db2.gz	QFHRXHJMZUCYSU-LLVKDONJSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000913281467	713190632	/nfs/dbraw/zinc/19/06/32/713190632.db2.gz	QQLLHTBEJQXZAF-GASCZTMLSA-N	1	1	320.349	1.109	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C	ZINC000928438670	713196020	/nfs/dbraw/zinc/19/60/20/713196020.db2.gz	GVYAKOOSOLDLNT-ZWNOBZJWSA-N	1	1	314.345	1.965	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1C	ZINC000928444035	713198493	/nfs/dbraw/zinc/19/84/93/713198493.db2.gz	IJXRACWCVXEBRK-JOYOIKCWSA-N	1	1	311.313	1.322	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000928448252	713200923	/nfs/dbraw/zinc/20/09/23/713200923.db2.gz	NDLDEHRKIAFMMD-ZYHUDNBSSA-N	1	1	309.370	1.007	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000928448250	713201053	/nfs/dbraw/zinc/20/10/53/713201053.db2.gz	NDLDEHRKIAFMMD-JQWIXIFHSA-N	1	1	309.370	1.007	20	5		DDBDMO
Cn1c[nH+]cc1CCOc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000902902273	710951315	/nfs/dbraw/zinc/95/13/15/710951315.db2.gz	OUHJOJYSHRJJSF-UHFFFAOYSA-N	1	1	305.290	1.721	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc4nonc4c3[N+](=O)[O-])CC[C@H]21	ZINC000895021671	711372661	/nfs/dbraw/zinc/37/26/61/711372661.db2.gz	HUOXPPDSBAEUGC-GXSJLCMTSA-N	1	1	303.322	1.661	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1	ZINC000907066049	712478703	/nfs/dbraw/zinc/47/87/03/712478703.db2.gz	SVJUWFDOOKEETD-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[N@H+](CC)CCO1	ZINC000908278939	712727031	/nfs/dbraw/zinc/72/70/31/712727031.db2.gz	IBQOEAOYVDFRHR-CQSZACIVSA-N	1	1	323.349	1.653	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[N@@H+](CC)CCO1	ZINC000908278939	712727032	/nfs/dbraw/zinc/72/70/32/712727032.db2.gz	IBQOEAOYVDFRHR-CQSZACIVSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1C[C@@H]3COC[C@H]3O1)C2	ZINC000930100361	713756023	/nfs/dbraw/zinc/75/60/23/713756023.db2.gz	SVKMPGIGTSXUDK-DVOMOZLQSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1C[C@@H]3COC[C@H]3O1)C2	ZINC000930100361	713756026	/nfs/dbraw/zinc/75/60/26/713756026.db2.gz	SVKMPGIGTSXUDK-DVOMOZLQSA-N	1	1	304.346	1.757	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](C)C1	ZINC000930362850	713814073	/nfs/dbraw/zinc/81/40/73/713814073.db2.gz	RDLFLNVSNMZAIS-SNVBAGLBSA-N	1	1	309.391	1.998	20	5		DDBDMO
COc1ccc(NC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000930770390	713916133	/nfs/dbraw/zinc/91/61/33/713916133.db2.gz	WOJZUFSSDSCPJA-ONGXEEELSA-N	1	1	308.338	1.818	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@H]1CCC[N@@H+](C)C1	ZINC000930877567	713947925	/nfs/dbraw/zinc/94/79/25/713947925.db2.gz	VOARABLXKHBRDW-NSHDSACASA-N	1	1	307.354	1.278	20	5		DDBDMO
COC1(OC)CCOC[C@@H]1[NH2+]Cc1cccc([N+](=O)[O-])c1C	ZINC000931669027	714156165	/nfs/dbraw/zinc/15/61/65/714156165.db2.gz	WRJZLLXOZRMCET-AWEZNQCLSA-N	1	1	310.350	1.771	20	5		DDBDMO
COC1(OC)CCOC[C@@H]1[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1	ZINC000931677685	714158776	/nfs/dbraw/zinc/15/87/76/714158776.db2.gz	WHLWVOYKAOGNNM-AWEZNQCLSA-N	1	1	310.350	1.771	20	5		DDBDMO
C[C@@H](NCC(=O)NC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000932176461	714279512	/nfs/dbraw/zinc/27/95/12/714279512.db2.gz	FREYNCURPIQUHT-GFCCVEGCSA-N	1	1	320.393	1.456	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@@H]1C[C@@H]1CCOC1	ZINC000933675766	714645375	/nfs/dbraw/zinc/64/53/75/714645375.db2.gz	OFIKESHARHOTQV-KBPBESRZSA-N	1	1	324.381	1.227	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@@H]1C[C@@H]1CCOC1	ZINC000933675766	714645379	/nfs/dbraw/zinc/64/53/79/714645379.db2.gz	OFIKESHARHOTQV-KBPBESRZSA-N	1	1	324.381	1.227	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCCCNC(=O)CC1	ZINC000934153420	714755729	/nfs/dbraw/zinc/75/57/29/714755729.db2.gz	GIZKRRJFMQDVTC-UHFFFAOYSA-N	1	1	309.370	1.092	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934275912	714784193	/nfs/dbraw/zinc/78/41/93/714784193.db2.gz	RXEXAESRAXJRFJ-KBPBESRZSA-N	1	1	306.366	1.021	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21	ZINC000934951503	714937005	/nfs/dbraw/zinc/93/70/05/714937005.db2.gz	OUSWEQNSECMHQU-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1ccc2c(ccnc2-n2cnc(C[NH3+])cc2=N)c1[N+](=O)[O-]	ZINC001167351171	733271422	/nfs/dbraw/zinc/27/14/22/733271422.db2.gz	GJDSJBGWPRAVMT-UHFFFAOYSA-N	1	1	310.317	1.575	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12	ZINC001121197458	782403848	/nfs/dbraw/zinc/40/38/48/782403848.db2.gz	ASSVUBAEDOONDS-DDTOSNHZSA-N	1	1	319.361	1.673	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cccc2cccnc21)[C@@H]1CC1[N+](=O)[O-]	ZINC001126943660	742940007	/nfs/dbraw/zinc/94/00/07/742940007.db2.gz	REBVFRRIMKGESQ-ZIAGYGMSSA-N	1	1	314.345	1.106	20	5		DDBDMO
CCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)C(=O)OCC	ZINC001169932941	762758232	/nfs/dbraw/zinc/75/82/32/762758232.db2.gz	FCXYPSVNZZUORZ-NSHDSACASA-N	1	1	312.370	1.763	20	5		DDBDMO
CCC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)C(=O)OCC	ZINC001169932941	762758233	/nfs/dbraw/zinc/75/82/33/762758233.db2.gz	FCXYPSVNZZUORZ-NSHDSACASA-N	1	1	312.370	1.763	20	5		DDBDMO
C=C/C(C)=C\CC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001132516431	768944835	/nfs/dbraw/zinc/94/48/35/768944835.db2.gz	ZLHINGACFRUNIB-WZUFQYTHSA-N	1	1	307.354	1.057	20	5		DDBDMO
Cc1ccnc(NCCNC(=O)C[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC001093674044	774988322	/nfs/dbraw/zinc/98/83/22/774988322.db2.gz	LKVPFTLVMBPCAG-UHFFFAOYSA-N	1	1	309.370	1.167	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCNc2ccc([N+](=O)[O-])cn2)C1	ZINC001094140687	775474830	/nfs/dbraw/zinc/47/48/30/775474830.db2.gz	RMXHMYOJUQNSFB-UHFFFAOYSA-N	1	1	321.381	1.250	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC[C@@H]21	ZINC001171815429	776482665	/nfs/dbraw/zinc/48/26/65/776482665.db2.gz	VUEBVRQGQAEVSM-YGRLFVJLSA-N	1	1	304.350	1.343	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](O)[C@@H](CO)C1)CC2	ZINC001172903301	776915730	/nfs/dbraw/zinc/91/57/30/776915730.db2.gz	GNVMATFAQXNDJV-INMHGKMJSA-N	1	1	320.389	1.517	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2CCOC[C@@H]2C1	ZINC001173221727	777054350	/nfs/dbraw/zinc/05/43/50/777054350.db2.gz	LIXCXCXNMVUHFH-CJNGLKHVSA-N	1	1	305.378	1.542	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCN(CCCO)CC1	ZINC001173221941	777054992	/nfs/dbraw/zinc/05/49/92/777054992.db2.gz	NOYHUXCRNYOVNZ-CQSZACIVSA-N	1	1	307.394	1.526	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CC1	ZINC001110227732	779264957	/nfs/dbraw/zinc/26/49/57/779264957.db2.gz	KBMWWFBQHFRQKT-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
CC1(C(=O)NCC2C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC001268828974	840875759	/nfs/dbraw/zinc/87/57/59/840875759.db2.gz	RZCICDDDRSYQLR-UHFFFAOYSA-N	1	1	303.362	1.943	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2ccccc2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001273084110	847885641	/nfs/dbraw/zinc/88/56/41/847885641.db2.gz	BPJBHDSTQPNYSN-ZIAGYGMSSA-N	1	1	303.362	1.480	20	5		DDBDMO
CCC1([NH2+]CCCF)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001327449907	862184175	/nfs/dbraw/zinc/18/41/75/862184175.db2.gz	UYKCMNHHQLXBKU-VXGBXAGGSA-N	1	1	301.362	1.372	20	5		DDBDMO
CN(C)C1(CNc2ccc([N+](=O)[O-])c(N)n2)CC[NH+](C)CC1	ZINC001156184813	862785834	/nfs/dbraw/zinc/78/58/34/862785834.db2.gz	DKZGNRYAKMJHNM-UHFFFAOYSA-N	1	1	308.386	1.010	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001325875291	860910281	/nfs/dbraw/zinc/91/02/81/860910281.db2.gz	UILNHUPTGUHFSQ-HOTGVXAUSA-N	1	1	308.378	1.969	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)n1	ZINC001152578248	863441915	/nfs/dbraw/zinc/44/19/15/863441915.db2.gz	UDQOIRIWWATDSS-UHFFFAOYSA-N	1	1	318.377	1.999	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001154022539	864328009	/nfs/dbraw/zinc/32/80/09/864328009.db2.gz	LBJNKABUFLTMNJ-JGVFFNPUSA-N	1	1	313.745	1.280	20	5		DDBDMO
CCC[N@@H+]1CCCC[C@@H]1C(=O)OCc1cn(C)nc1[N+](=O)[O-]	ZINC001330850715	864654161	/nfs/dbraw/zinc/65/41/61/864654161.db2.gz	QOHGLLCQWXLUSP-GFCCVEGCSA-N	1	1	310.354	1.636	20	5		DDBDMO
CCC[N@H+]1CCCC[C@@H]1C(=O)OCc1cn(C)nc1[N+](=O)[O-]	ZINC001330850715	864654166	/nfs/dbraw/zinc/65/41/66/864654166.db2.gz	QOHGLLCQWXLUSP-GFCCVEGCSA-N	1	1	310.354	1.636	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](C/C=C/Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001160090790	865675451	/nfs/dbraw/zinc/67/54/51/865675451.db2.gz	PMWAANBWUGSHNT-RFJNLHAASA-N	1	1	313.785	1.543	20	5		DDBDMO
COc1cc(N[C@H]2CCC[C@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160722165	866068133	/nfs/dbraw/zinc/06/81/33/866068133.db2.gz	FKVHXZISEQSIFB-NWDGAFQWSA-N	1	1	322.365	1.664	20	5		DDBDMO
C[NH+](C)C=Cc1cc(NC2=CC(=O)NCC2)ncc1[N+](=O)[O-]	ZINC001162648348	867701389	/nfs/dbraw/zinc/70/13/89/867701389.db2.gz	GJDYGAPQVRACFZ-GQCTYLIASA-N	1	1	303.322	1.338	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1NCC[C@@H]1CC[NH2+]CC1(F)F	ZINC001162811580	867847965	/nfs/dbraw/zinc/84/79/65/867847965.db2.gz	BYKHWXAUPPZRTE-QMMMGPOBSA-N	1	1	301.297	1.619	20	5		DDBDMO
O=C(CC[N@@H+]1C2CCC1(CO)CC2)Nc1ccccc1[N+](=O)[O-]	ZINC001335132057	868085954	/nfs/dbraw/zinc/08/59/54/868085954.db2.gz	SSXCNESLOZTQOB-UHFFFAOYSA-N	1	1	319.361	1.913	20	5		DDBDMO
COc1nc(N[C@H]2CC[N@H+](C(C)C)C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC001163357055	868390295	/nfs/dbraw/zinc/39/02/95/868390295.db2.gz	ITRMAYHJJDYVSA-QWRGUYRKSA-N	1	1	309.370	1.924	20	5		DDBDMO
COc1nc(N[C@@H]2CC[N@H+](C(C)C)C[C@H]2C)ncc1[N+](=O)[O-]	ZINC001163357052	868391297	/nfs/dbraw/zinc/39/12/97/868391297.db2.gz	ITRMAYHJJDYVSA-GHMZBOCLSA-N	1	1	309.370	1.924	20	5		DDBDMO
CO[C@@H]1CN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C[C@@H]1OC	ZINC001163999120	868864365	/nfs/dbraw/zinc/86/43/65/868864365.db2.gz	PSCBKFYCFAIRJF-DLPZHFSESA-N	1	1	322.365	1.372	20	5		DDBDMO
[NH3+][C@H]1CN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])CCC1(F)F	ZINC001164320059	869124179	/nfs/dbraw/zinc/12/41/79/869124179.db2.gz	XABAFSZZAAAQBN-QMMMGPOBSA-N	1	1	303.225	1.071	20	5		DDBDMO
CCC(CC)C[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494392	869231823	/nfs/dbraw/zinc/23/18/23/869231823.db2.gz	ICUPPVMRTFEXAJ-ZIAGYGMSSA-N	1	1	311.426	1.964	20	5		DDBDMO
O=C(NCCC1(C[NH2+]CCCCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494398	869232960	/nfs/dbraw/zinc/23/29/60/869232960.db2.gz	ILIBHQWPSUFCGY-CHWSQXEVSA-N	1	1	315.389	1.668	20	5		DDBDMO
COC(=O)c1ccnc(NCCc2[nH+]ccn2C)c1[N+](=O)[O-]	ZINC001337727386	869608810	/nfs/dbraw/zinc/60/88/10/869608810.db2.gz	ZPGNZFCNQQRYBH-UHFFFAOYSA-N	1	1	305.294	1.165	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Nc3ccc(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC001310993118	871667387	/nfs/dbraw/zinc/66/73/87/871667387.db2.gz	WWHAWJNIEZZPSV-GAFUQQFSSA-N	1	1	319.365	1.639	20	5		DDBDMO
Nc1cc(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)nc[nH+]1	ZINC001318520318	872129241	/nfs/dbraw/zinc/12/92/41/872129241.db2.gz	ZOOIFQSERUUAMG-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC001353285490	877228685	/nfs/dbraw/zinc/22/86/85/877228685.db2.gz	NQVUXIRYFZSNKY-WCFLWFBJSA-N	1	1	319.361	1.673	20	5		DDBDMO
COC(=O)[C@H](OC[C@@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647078	881043421	/nfs/dbraw/zinc/04/34/21/881043421.db2.gz	IXRPVYXXCFOALR-SMDDNHRTSA-N	1	1	324.333	1.156	20	5		DDBDMO
COC(=O)[C@H](OC[C@@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC001223647078	881043432	/nfs/dbraw/zinc/04/34/32/881043432.db2.gz	IXRPVYXXCFOALR-SMDDNHRTSA-N	1	1	324.333	1.156	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ncc([N+](=O)[O-])c3nc[nH]c31)C2	ZINC001227692959	883135225	/nfs/dbraw/zinc/13/52/25/883135225.db2.gz	HLHDHJXAVAEUKP-MYJAWHEDSA-N	1	1	303.322	1.870	20	5		DDBDMO
CCOC(=O)Cc1ccc([N+](=O)[O-])c(O[C@@H]2CC[N@@H+](C)C2)c1	ZINC001234408463	887946744	/nfs/dbraw/zinc/94/67/44/887946744.db2.gz	MSBUGPKDTXEPGK-GFCCVEGCSA-N	1	1	308.334	1.783	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CCCO1	ZINC001254563641	896502979	/nfs/dbraw/zinc/50/29/79/896502979.db2.gz	ABAOWLRLQWYDOQ-IUODEOHRSA-N	1	1	322.361	1.790	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+](C)CCN1[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569253	896505745	/nfs/dbraw/zinc/50/57/45/896505745.db2.gz	JEQQCRNZZCGRBS-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](C)CCN1[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569253	896505752	/nfs/dbraw/zinc/50/57/52/896505752.db2.gz	JEQQCRNZZCGRBS-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254597369	896524306	/nfs/dbraw/zinc/52/43/06/896524306.db2.gz	CTQRIKUNHMFCLN-XJKSGUPXSA-N	1	1	317.389	1.862	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2nnc(C[N+](=O)[O-])n2CC2CC2)C[C@H]1C	ZINC001263676064	900667611	/nfs/dbraw/zinc/66/76/11/900667611.db2.gz	FYMXXAPGPJEQQC-VXGBXAGGSA-N	1	1	322.413	1.384	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000495197631	529444567	/nfs/dbraw/zinc/44/45/67/529444567.db2.gz	YJPOVWAXXCQHNF-ZBFHGGJFSA-N	1	1	319.361	1.547	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2CCCC[N@H+]2CCO)cccc1[N+](=O)[O-]	ZINC000452391798	231375364	/nfs/dbraw/zinc/37/53/64/231375364.db2.gz	QKEFCNSDQXJTLT-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[N@H+](CCc1cccs1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090550982	185302390	/nfs/dbraw/zinc/30/23/90/185302390.db2.gz	KHQMWRROOJTPNL-UHFFFAOYSA-N	1	1	307.375	1.993	20	5		DDBDMO
CS[C@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090564468	185303988	/nfs/dbraw/zinc/30/39/88/185303988.db2.gz	AUBHMNFJFBKWOJ-ZDUSSCGKSA-N	1	1	311.407	1.974	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000286603600	219077046	/nfs/dbraw/zinc/07/70/46/219077046.db2.gz	WSOYJRHYSVGXPD-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000330860127	232119265	/nfs/dbraw/zinc/11/92/65/232119265.db2.gz	VWMOXXFDSLBUBO-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CN1C	ZINC000330860127	232119268	/nfs/dbraw/zinc/11/92/68/232119268.db2.gz	VWMOXXFDSLBUBO-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CN1C	ZINC000330860127	232119271	/nfs/dbraw/zinc/11/92/71/232119271.db2.gz	VWMOXXFDSLBUBO-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000330909831	232155178	/nfs/dbraw/zinc/15/51/78/232155178.db2.gz	PCAOEXHMXVKKFG-JQWIXIFHSA-N	1	1	309.370	1.089	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C	ZINC000358391865	299140419	/nfs/dbraw/zinc/14/04/19/299140419.db2.gz	ITIQALUXLALPCD-PWSUYJOCSA-N	1	1	309.341	1.875	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)CN(C)C	ZINC000459543062	233297935	/nfs/dbraw/zinc/29/79/35/233297935.db2.gz	BKQAYUJHYDKSOA-UHFFFAOYSA-N	1	1	308.382	1.772	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000140016647	186025529	/nfs/dbraw/zinc/02/55/29/186025529.db2.gz	FJANDAFARPFFFA-JTQLQIEISA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000140016647	186025531	/nfs/dbraw/zinc/02/55/31/186025531.db2.gz	FJANDAFARPFFFA-JTQLQIEISA-N	1	1	313.379	1.504	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CCC[NH3+])Cc2ccccc2)c1[N+](=O)[O-]	ZINC000280110753	215384346	/nfs/dbraw/zinc/38/43/46/215384346.db2.gz	NPCPUKIOVLRZKD-UHFFFAOYSA-N	1	1	317.349	1.618	20	5		DDBDMO
CC(C)[C@H](CNc1c([N+](=O)[O-])ncn1C)N1CC[NH+](C)CC1	ZINC000046551958	352456023	/nfs/dbraw/zinc/45/60/23/352456023.db2.gz	SODDSCDXGBUEKV-LBPRGKRZSA-N	1	1	310.402	1.012	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000046858786	352465451	/nfs/dbraw/zinc/46/54/51/352465451.db2.gz	YZUAWMVPFIWOMA-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000172833237	198155125	/nfs/dbraw/zinc/15/51/25/198155125.db2.gz	FJEFHUUCFVKWQD-UHFFFAOYSA-N	1	1	311.294	1.888	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000172833237	198155126	/nfs/dbraw/zinc/15/51/26/198155126.db2.gz	FJEFHUUCFVKWQD-UHFFFAOYSA-N	1	1	311.294	1.888	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CCC[C@H](C)C1	ZINC000068575518	353121352	/nfs/dbraw/zinc/12/13/52/353121352.db2.gz	LBKDMAXGXIILGW-LBPRGKRZSA-N	1	1	323.397	1.338	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1csc([N+](=O)[O-])c1	ZINC000074104919	353292863	/nfs/dbraw/zinc/29/28/63/353292863.db2.gz	MBCNUFNQORKJOM-JTQLQIEISA-N	1	1	313.379	1.497	20	5		DDBDMO
Cn1cc(N2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)cn1	ZINC000174901034	198399489	/nfs/dbraw/zinc/39/94/89/198399489.db2.gz	NXUICRAIXBIIOR-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCO)CC2)cc1C(F)(F)F	ZINC000078254374	353507186	/nfs/dbraw/zinc/50/71/86/353507186.db2.gz	JHJQOHVCDJLCBC-UHFFFAOYSA-N	1	1	319.283	1.728	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c2cccnc21	ZINC000077963130	353498448	/nfs/dbraw/zinc/49/84/48/353498448.db2.gz	YLTPBRGHSBWHPV-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083169809	353706418	/nfs/dbraw/zinc/70/64/18/353706418.db2.gz	POKNSRRWZDGIAX-JTQLQIEISA-N	1	1	318.333	1.966	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000093343811	353897863	/nfs/dbraw/zinc/89/78/63/353897863.db2.gz	KLMZZELQQXHDAC-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](C)CCO1	ZINC000129904450	354087497	/nfs/dbraw/zinc/08/74/97/354087497.db2.gz	ITJFZHNJHZWWOT-ZWNOBZJWSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCO1	ZINC000129904450	354087498	/nfs/dbraw/zinc/08/74/98/354087498.db2.gz	ITJFZHNJHZWWOT-ZWNOBZJWSA-N	1	1	308.338	1.435	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C[C@H]1C(C)C	ZINC000154096193	354204241	/nfs/dbraw/zinc/20/42/41/354204241.db2.gz	JRFRQYNEBRWGSR-AWEZNQCLSA-N	1	1	306.366	1.710	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C[C@H]1C(C)C	ZINC000154096193	354204243	/nfs/dbraw/zinc/20/42/43/354204243.db2.gz	JRFRQYNEBRWGSR-AWEZNQCLSA-N	1	1	306.366	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@@H](O)C1CC1	ZINC000156601022	354220048	/nfs/dbraw/zinc/22/00/48/354220048.db2.gz	ZCZYNHCFKYJDMU-OAHLLOKOSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCNC1=O	ZINC000281637672	354426730	/nfs/dbraw/zinc/42/67/30/354426730.db2.gz	IKFUQXXBJXCVJS-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@@H](CO)CC1	ZINC000293056323	354453442	/nfs/dbraw/zinc/45/34/42/354453442.db2.gz	IFHQJXOLRKTUPR-KGLIPLIRSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@@H]2CCc3c[nH+]cn3C2)nc2sccn21	ZINC000588067745	354898805	/nfs/dbraw/zinc/89/88/05/354898805.db2.gz	MQKSPJHTQQCINO-MRVPVSSYSA-N	1	1	304.335	1.927	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H]2OCC[N@@H+](C)[C@H]2C1	ZINC000588838645	354941242	/nfs/dbraw/zinc/94/12/42/354941242.db2.gz	XHSOQWCGNKXCOZ-RYUDHWBXSA-N	1	1	309.370	1.029	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CC2(CO)CC2)c1	ZINC000589513676	354997917	/nfs/dbraw/zinc/99/79/17/354997917.db2.gz	PUPBXIKIBPZBNS-UHFFFAOYSA-N	1	1	308.334	1.586	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CC2(CO)CC2)c1	ZINC000589513676	354997919	/nfs/dbraw/zinc/99/79/19/354997919.db2.gz	PUPBXIKIBPZBNS-UHFFFAOYSA-N	1	1	308.334	1.586	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000589941439	355033844	/nfs/dbraw/zinc/03/38/44/355033844.db2.gz	INYUWYGNPWEOTJ-RNCFNFMXSA-N	1	1	308.313	1.902	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590045568	355043964	/nfs/dbraw/zinc/04/39/64/355043964.db2.gz	RZCDKFQHFUJLNX-OCCSQVGLSA-N	1	1	319.361	1.770	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc([N+](=O)[O-])c1C	ZINC000590047189	355044795	/nfs/dbraw/zinc/04/47/95/355044795.db2.gz	XDJJTURWRTUFNN-FZMZJTMJSA-N	1	1	319.361	1.688	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H]1CCOC1	ZINC000494946034	235105882	/nfs/dbraw/zinc/10/58/82/235105882.db2.gz	HFSZKYQSPVZLLK-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@@H]2CC[N@@H+](CC)C[C@@H]21	ZINC000590141610	355053358	/nfs/dbraw/zinc/05/33/58/355053358.db2.gz	RMGPBZMPKQHRNW-QWHCGFSZSA-N	1	1	323.397	1.419	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000590561797	355115076	/nfs/dbraw/zinc/11/50/76/355115076.db2.gz	GVVWGHBUWDPENZ-GHMZBOCLSA-N	1	1	309.322	1.123	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+]([C@@H]3CCC[C@H]3O)CC2)c(F)c1	ZINC000591144260	355254015	/nfs/dbraw/zinc/25/40/15/355254015.db2.gz	BVWRVCXXLKFITN-CHWSQXEVSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]3OCC[C@@H]3C1)OCCO2	ZINC000592520435	355611082	/nfs/dbraw/zinc/61/10/82/355611082.db2.gz	MWCITIGWQHCEGE-RISCZKNCSA-N	1	1	320.345	1.977	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000593108705	355801068	/nfs/dbraw/zinc/80/10/68/355801068.db2.gz	ZBELWQPSFRALIX-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000593108705	355801071	/nfs/dbraw/zinc/80/10/71/355801071.db2.gz	ZBELWQPSFRALIX-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000593338362	355857643	/nfs/dbraw/zinc/85/76/43/355857643.db2.gz	HYDVNZXLBKNPEG-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000593338362	355857646	/nfs/dbraw/zinc/85/76/46/355857646.db2.gz	HYDVNZXLBKNPEG-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000593720277	355976249	/nfs/dbraw/zinc/97/62/49/355976249.db2.gz	JPMZGUOOVYVVRN-BXUZGUMPSA-N	1	1	307.325	1.439	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C1CC1	ZINC000594732464	356300630	/nfs/dbraw/zinc/30/06/30/356300630.db2.gz	LDWPHHRFYIJBHA-LBPRGKRZSA-N	1	1	317.349	1.308	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](C)S(C)(=O)=O	ZINC000595033061	356375109	/nfs/dbraw/zinc/37/51/09/356375109.db2.gz	AJLZHVHTAXNYFS-UWVGGRQHSA-N	1	1	316.379	1.687	20	5		DDBDMO
C[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1CCO	ZINC000595695907	356612231	/nfs/dbraw/zinc/61/22/31/356612231.db2.gz	JBFUFRFUZJUKGA-SMDDNHRTSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@]1(C)CO	ZINC000595868947	356684725	/nfs/dbraw/zinc/68/47/25/356684725.db2.gz	CNXFAHGXXPBUCR-BLLLJJGKSA-N	1	1	321.377	1.874	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000596118908	356780191	/nfs/dbraw/zinc/78/01/91/356780191.db2.gz	GHBNKOQQOLPNDN-GFCCVEGCSA-N	1	1	304.350	1.590	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1	ZINC000596539343	356911435	/nfs/dbraw/zinc/91/14/35/356911435.db2.gz	OWZYBHRZVFBSHM-AWEZNQCLSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cn1c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-]	ZINC000597855012	357358672	/nfs/dbraw/zinc/35/86/72/357358672.db2.gz	OXIYLKXZGDFKGS-NSHDSACASA-N	1	1	308.382	1.784	20	5		DDBDMO
CNS(=O)(=O)CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000598585977	357641017	/nfs/dbraw/zinc/64/10/17/357641017.db2.gz	BTGHROPDADNLME-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
CNS(=O)(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000598585977	357641019	/nfs/dbraw/zinc/64/10/19/357641019.db2.gz	BTGHROPDADNLME-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000598592661	357644706	/nfs/dbraw/zinc/64/47/06/357644706.db2.gz	LHCKTVBCJOSSDF-SECBINFHSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[C@H]1CC[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[NH2+]1	ZINC000599104017	357816491	/nfs/dbraw/zinc/81/64/91/357816491.db2.gz	KWXRKXMUODMBIB-IUCAKERBSA-N	1	1	317.342	1.153	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(NCC[N@@H+]3CC[C@H](O)C3)c2c1	ZINC000599199381	357847500	/nfs/dbraw/zinc/84/75/00/357847500.db2.gz	IZONVQPXFMCKKW-ZDUSSCGKSA-N	1	1	302.334	1.622	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(C)COC1	ZINC000599571636	357979699	/nfs/dbraw/zinc/97/96/99/357979699.db2.gz	OPWMLODUKZZCPQ-UHFFFAOYSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(C)COC1	ZINC000599571636	357979702	/nfs/dbraw/zinc/97/97/02/357979702.db2.gz	OPWMLODUKZZCPQ-UHFFFAOYSA-N	1	1	307.350	1.810	20	5		DDBDMO
C[C@H]1CC(F)(F)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000599621811	357995398	/nfs/dbraw/zinc/99/53/98/357995398.db2.gz	GMMIYEWWQGWWLA-JTQLQIEISA-N	1	1	301.293	1.876	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)cc1	ZINC000599632451	357999346	/nfs/dbraw/zinc/99/93/46/357999346.db2.gz	ONPCRWOVEQCUCL-ZCCHDVMBSA-N	1	1	324.402	1.959	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599645749	358004465	/nfs/dbraw/zinc/00/44/65/358004465.db2.gz	WDNXEIBRWATCRT-PHIMTYICSA-N	1	1	320.349	1.037	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599645749	358004468	/nfs/dbraw/zinc/00/44/68/358004468.db2.gz	WDNXEIBRWATCRT-PHIMTYICSA-N	1	1	320.349	1.037	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1C[C@@H](O)C1	ZINC000599672350	358019101	/nfs/dbraw/zinc/01/91/01/358019101.db2.gz	MCFNKVBWYRBUMR-GSJFWJNXSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cc(C(=O)NC2CC([NH+]3CCOCC3)C2)cc([N+](=O)[O-])c1	ZINC000600070249	358114750	/nfs/dbraw/zinc/11/47/50/358114750.db2.gz	YMMZQJBCJIMLNO-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
CC(C)n1ncnc1C[NH2+]CCOc1ccc([N+](=O)[O-])cc1	ZINC000601106841	358404416	/nfs/dbraw/zinc/40/44/16/358404416.db2.gz	YOIAGWBEJGKPSC-UHFFFAOYSA-N	1	1	305.338	1.936	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](O)C3CCOCC3)c2c1	ZINC000601118107	358408942	/nfs/dbraw/zinc/40/89/42/358408942.db2.gz	HFCHNMMNBNSRCI-INIZCTEOSA-N	1	1	317.345	1.764	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3c(F)cccc3[N+](=O)[O-])C2)C1	ZINC000601596468	358617732	/nfs/dbraw/zinc/61/77/32/358617732.db2.gz	ONZFQMSWXOKCIQ-OAHLLOKOSA-N	1	1	307.325	1.902	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@@H](C(F)F)CC1	ZINC000601973722	358761390	/nfs/dbraw/zinc/76/13/90/358761390.db2.gz	JEGJAQTVKIUKNW-SNVBAGLBSA-N	1	1	304.297	1.456	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@@H](C(F)F)CC1	ZINC000601973722	358761395	/nfs/dbraw/zinc/76/13/95/358761395.db2.gz	JEGJAQTVKIUKNW-SNVBAGLBSA-N	1	1	304.297	1.456	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000602195466	358876291	/nfs/dbraw/zinc/87/62/91/358876291.db2.gz	LSUJJTKVKJUDQE-WBMJQRKESA-N	1	1	321.377	1.260	20	5		DDBDMO
C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1	ZINC000602577936	359052287	/nfs/dbraw/zinc/05/22/87/359052287.db2.gz	RLQBZOARTZJLIO-MGUXCZDKSA-N	1	1	322.390	1.917	20	5		DDBDMO
Cc1cnn([C@@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)c1	ZINC000602836780	359227937	/nfs/dbraw/zinc/22/79/37/359227937.db2.gz	ISGUJEIBPDHLCZ-CYBMUJFWSA-N	1	1	304.354	1.552	20	5		DDBDMO
CC[NH+]1CC[C@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796231	359197570	/nfs/dbraw/zinc/19/75/70/359197570.db2.gz	WOHWKNOSUCWOKD-OCCSQVGLSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[NH+]1CC[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796231	359197575	/nfs/dbraw/zinc/19/75/75/359197575.db2.gz	WOHWKNOSUCWOKD-OCCSQVGLSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796231	359197578	/nfs/dbraw/zinc/19/75/78/359197578.db2.gz	WOHWKNOSUCWOKD-OCCSQVGLSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796231	359197585	/nfs/dbraw/zinc/19/75/85/359197585.db2.gz	WOHWKNOSUCWOKD-OCCSQVGLSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@@H+]1CC[C@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796231	359197588	/nfs/dbraw/zinc/19/75/88/359197588.db2.gz	WOHWKNOSUCWOKD-OCCSQVGLSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796231	359197590	/nfs/dbraw/zinc/19/75/90/359197590.db2.gz	WOHWKNOSUCWOKD-OCCSQVGLSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@]2(C1)CCC[N@H+](C)C2	ZINC000602830352	359222709	/nfs/dbraw/zinc/22/27/09/359222709.db2.gz	DEIURDBUBAQLQJ-HNNXBMFYSA-N	1	1	307.398	1.517	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](n3ccnn3)CC2)c1	ZINC000602888611	359272449	/nfs/dbraw/zinc/27/24/49/359272449.db2.gz	OVNARVNHWWNYAF-LBPRGKRZSA-N	1	1	305.342	1.110	20	5		DDBDMO
COc1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000602962510	359325438	/nfs/dbraw/zinc/32/54/38/359325438.db2.gz	LCGTWSNVCHDHTN-MRXNPFEDSA-N	1	1	317.345	1.996	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602963068	359326674	/nfs/dbraw/zinc/32/66/74/359326674.db2.gz	SUXQZCXHFSPJPB-GOEBONIOSA-N	1	1	307.394	1.876	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(CO)CC1	ZINC000186803697	200013557	/nfs/dbraw/zinc/01/35/57/200013557.db2.gz	IWNDJGNSFCVDBK-ZDUSSCGKSA-N	1	1	310.350	1.039	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CCCC[NH+]2CCCCC2)c1[N+](=O)[O-]	ZINC000603406225	359620708	/nfs/dbraw/zinc/62/07/08/359620708.db2.gz	IMJVDGYEVVWTAO-UHFFFAOYSA-N	1	1	323.397	1.964	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000187405736	200107915	/nfs/dbraw/zinc/10/79/15/200107915.db2.gz	HEXQXBPDAJHPGZ-UHFFFAOYSA-N	1	1	308.338	1.439	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000604546959	359763928	/nfs/dbraw/zinc/76/39/28/359763928.db2.gz	NQVAYVQBWIFMED-JTQLQIEISA-N	1	1	302.334	1.900	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCN1CCCC1=O	ZINC000609578216	360327273	/nfs/dbraw/zinc/32/72/73/360327273.db2.gz	ZEAUYFFQCVDHMX-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cn(C)nn1	ZINC000611973488	360877448	/nfs/dbraw/zinc/87/74/48/360877448.db2.gz	JEWCBOLBDMQVIL-JTQLQIEISA-N	1	1	318.337	1.230	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@@H](CCO)C1	ZINC000612070173	360908856	/nfs/dbraw/zinc/90/88/56/360908856.db2.gz	DAYJUXDTKYMMGY-KBPBESRZSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)C1	ZINC000281389977	216266655	/nfs/dbraw/zinc/26/66/55/216266655.db2.gz	GGBLTGDWLZNXDJ-WDEREUQCSA-N	1	1	319.365	1.362	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCC[N@@H+](CCOC)CC1	ZINC000619476678	364028134	/nfs/dbraw/zinc/02/81/34/364028134.db2.gz	ZLLQIEOOBTUUAZ-UHFFFAOYSA-N	1	1	311.386	1.278	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000619759467	364143428	/nfs/dbraw/zinc/14/34/28/364143428.db2.gz	MPAXTROGFFDLEH-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3C[NH2+]C[C@H]3CC2)c1[N+](=O)[O-]	ZINC000261751922	203110768	/nfs/dbraw/zinc/11/07/68/203110768.db2.gz	JADWUZQNCRGLJO-PHIMTYICSA-N	1	1	321.381	1.342	20	5		DDBDMO
C[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)NCc1ccccc1	ZINC000350119515	284152115	/nfs/dbraw/zinc/15/21/15/284152115.db2.gz	CDEMQSIJWSNRON-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)NCc1ccccc1	ZINC000350119515	284152116	/nfs/dbraw/zinc/15/21/16/284152116.db2.gz	CDEMQSIJWSNRON-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000264757886	204134215	/nfs/dbraw/zinc/13/42/15/204134215.db2.gz	TYWZJGXZSHAIFF-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCC(F)(F)F	ZINC000282495839	217039778	/nfs/dbraw/zinc/03/97/78/217039778.db2.gz	QHTMNFDAOQFPCQ-UHFFFAOYSA-N	1	1	319.283	1.748	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCC(F)(F)F	ZINC000282495839	217039780	/nfs/dbraw/zinc/03/97/80/217039780.db2.gz	QHTMNFDAOQFPCQ-UHFFFAOYSA-N	1	1	319.283	1.748	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)[C@H](C)C1	ZINC000288380844	220120309	/nfs/dbraw/zinc/12/03/09/220120309.db2.gz	KGSLTQCMLSUTCD-GFCCVEGCSA-N	1	1	305.378	1.998	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1NC[C@H](C)C[NH+]1CCOCC1	ZINC000579494627	422781717	/nfs/dbraw/zinc/78/17/17/422781717.db2.gz	UVLJZGCCZXKMKM-LBPRGKRZSA-N	1	1	309.366	1.984	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C	ZINC000267798272	206289344	/nfs/dbraw/zinc/28/93/44/206289344.db2.gz	KNGGUMPOSJYHHJ-AOOOYVTPSA-N	1	1	321.333	1.850	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C	ZINC000267798272	206289349	/nfs/dbraw/zinc/28/93/49/206289349.db2.gz	KNGGUMPOSJYHHJ-AOOOYVTPSA-N	1	1	321.333	1.850	20	5		DDBDMO
C[C@H](c1ccco1)[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1	ZINC000267947291	206353916	/nfs/dbraw/zinc/35/39/16/206353916.db2.gz	SLEXFAUXMWGPQQ-RISCZKNCSA-N	1	1	320.349	1.971	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1O	ZINC000270839073	248691073	/nfs/dbraw/zinc/69/10/73/248691073.db2.gz	DUBCZFTUOQZMBS-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337193872	249383368	/nfs/dbraw/zinc/38/33/68/249383368.db2.gz	YMVZCMNTSQGRSA-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337193872	249383371	/nfs/dbraw/zinc/38/33/71/249383371.db2.gz	YMVZCMNTSQGRSA-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337193872	249383376	/nfs/dbraw/zinc/38/33/76/249383376.db2.gz	YMVZCMNTSQGRSA-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](C[C@@H](C)O)CC1	ZINC000284418520	218019288	/nfs/dbraw/zinc/01/92/88/218019288.db2.gz	CEAPLLBBHBGJPT-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[N@@H+](CCNC(=O)COc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000104571573	194016295	/nfs/dbraw/zinc/01/62/95/194016295.db2.gz	XNHIBNFYSWVJIW-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1cc(C2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)n[nH]1	ZINC000271664258	209106882	/nfs/dbraw/zinc/10/68/82/209106882.db2.gz	VTUBTOSDDQNUJJ-UHFFFAOYSA-N	1	1	304.354	1.702	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269181797	207301772	/nfs/dbraw/zinc/30/17/72/207301772.db2.gz	LMIFSYJITFLXRJ-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269181797	207301774	/nfs/dbraw/zinc/30/17/74/207301774.db2.gz	LMIFSYJITFLXRJ-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000491559441	532975858	/nfs/dbraw/zinc/97/58/58/532975858.db2.gz	ALRYNXZWEOXSGJ-LMVHVUTASA-N	1	1	319.361	1.445	20	5		DDBDMO
C[C@H](C[N@H+](C)CCc1ccccc1[N+](=O)[O-])CS(C)(=O)=O	ZINC000352551373	285134719	/nfs/dbraw/zinc/13/47/19/285134719.db2.gz	XEDOHODEWAGPEN-GFCCVEGCSA-N	1	1	314.407	1.750	20	5		DDBDMO
C[C@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])CS(C)(=O)=O	ZINC000352551373	285134720	/nfs/dbraw/zinc/13/47/20/285134720.db2.gz	XEDOHODEWAGPEN-GFCCVEGCSA-N	1	1	314.407	1.750	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@]2(C)CO)c([N+](=O)[O-])c1	ZINC000567971135	304256962	/nfs/dbraw/zinc/25/69/62/304256962.db2.gz	URLGPLUNBSFDTR-OAHLLOKOSA-N	1	1	310.350	1.829	20	5		DDBDMO
C[N@H+](CCc1nccs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000157580983	197199242	/nfs/dbraw/zinc/19/92/42/197199242.db2.gz	CLUMJWPLCRFYAH-UHFFFAOYSA-N	1	1	320.374	1.825	20	5		DDBDMO
C[N@@H+](CCc1nccs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000157580983	197199243	/nfs/dbraw/zinc/19/92/43/197199243.db2.gz	CLUMJWPLCRFYAH-UHFFFAOYSA-N	1	1	320.374	1.825	20	5		DDBDMO
C[C@@H]1OCC[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000156561796	197123564	/nfs/dbraw/zinc/12/35/64/197123564.db2.gz	JQJBSKOPJPPVAD-OBJOEFQTSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1OCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000156561796	197123566	/nfs/dbraw/zinc/12/35/66/197123566.db2.gz	JQJBSKOPJPPVAD-OBJOEFQTSA-N	1	1	310.350	1.444	20	5		DDBDMO
COCCCNC(=O)[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000271646967	209092708	/nfs/dbraw/zinc/09/27/08/209092708.db2.gz	TYLHWYRXVLBWPM-VXGBXAGGSA-N	1	1	309.366	1.787	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000294997041	533218167	/nfs/dbraw/zinc/21/81/67/533218167.db2.gz	ICPANZFRHYLRRN-INIZCTEOSA-N	1	1	322.361	1.915	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](c2nc(=O)[nH][nH]2)C1	ZINC000289482050	221006664	/nfs/dbraw/zinc/00/66/64/221006664.db2.gz	RVDLJZZBSPQZCO-JQWIXIFHSA-N	1	1	317.349	1.947	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@H+](CCCO)C2)c(Cl)c1	ZINC000294871082	224276639	/nfs/dbraw/zinc/27/66/39/224276639.db2.gz	DFSOBMKSQLIENO-SNVBAGLBSA-N	1	1	314.773	1.902	20	5		DDBDMO
O=C1NCCN1CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000290015862	221380352	/nfs/dbraw/zinc/38/03/52/221380352.db2.gz	SNDKBJDBOKLQDX-UHFFFAOYSA-N	1	1	304.350	1.584	20	5		DDBDMO
C[N@@H+](CCc1ccncc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000121609868	195315871	/nfs/dbraw/zinc/31/58/71/195315871.db2.gz	JAELRMGOTMXGIS-UHFFFAOYSA-N	1	1	314.345	1.763	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1CCOC1	ZINC000494957216	533327751	/nfs/dbraw/zinc/32/77/51/533327751.db2.gz	NSWXHYMFZIQFRE-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
CCC[N@H+]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000074290023	406908164	/nfs/dbraw/zinc/90/81/64/406908164.db2.gz	MJYOTEUKDHDRFE-UHFFFAOYSA-N	1	1	320.393	1.611	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000075781454	406942110	/nfs/dbraw/zinc/94/21/10/406942110.db2.gz	LBDYZNUIQOUJTD-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000075781454	406942111	/nfs/dbraw/zinc/94/21/11/406942111.db2.gz	LBDYZNUIQOUJTD-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000046132934	407055610	/nfs/dbraw/zinc/05/56/10/407055610.db2.gz	WECJUHNPQVOIPM-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
COc1ccc(C[NH+]2CCC3(CC2)OCCO3)cc1[N+](=O)[O-]	ZINC000047496594	407075041	/nfs/dbraw/zinc/07/50/41/407075041.db2.gz	IGDCWIZEKUOLJF-UHFFFAOYSA-N	1	1	308.334	1.942	20	5		DDBDMO
C[N@@H+](CCC(=O)N1CCOCC1)Cc1ccccc1[N+](=O)[O-]	ZINC000051383331	407139766	/nfs/dbraw/zinc/13/97/66/407139766.db2.gz	PEPRWWLZKPOXEC-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@](C)(O)C1	ZINC000124109962	407348273	/nfs/dbraw/zinc/34/82/73/407348273.db2.gz	NNRSDIUZLRWUQW-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@](C)(O)C1	ZINC000124109962	407348275	/nfs/dbraw/zinc/34/82/75/407348275.db2.gz	NNRSDIUZLRWUQW-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[NH+]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1	ZINC000124852016	407371577	/nfs/dbraw/zinc/37/15/77/407371577.db2.gz	MQYWFNSYEKHBES-UHFFFAOYSA-N	1	1	303.322	1.392	20	5		DDBDMO
COC[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806941	407463947	/nfs/dbraw/zinc/46/39/47/407463947.db2.gz	OZBGLTRGPAWGJB-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806941	407463957	/nfs/dbraw/zinc/46/39/57/407463957.db2.gz	OZBGLTRGPAWGJB-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
NC(=O)CC[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000170731154	407483510	/nfs/dbraw/zinc/48/35/10/407483510.db2.gz	JLQIOGVKYFKFOT-CYBMUJFWSA-N	1	1	321.377	1.951	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000178558079	407491820	/nfs/dbraw/zinc/49/18/20/407491820.db2.gz	YZRLKGAEFPCNCX-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000178558079	407491826	/nfs/dbraw/zinc/49/18/26/407491826.db2.gz	YZRLKGAEFPCNCX-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000170782845	407502212	/nfs/dbraw/zinc/50/22/12/407502212.db2.gz	SMJDWJYNUCIBBU-LLVKDONJSA-N	1	1	322.365	1.298	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CNc1ccccc1[N+](=O)[O-])C(C)C	ZINC000112928324	407448604	/nfs/dbraw/zinc/44/86/04/407448604.db2.gz	CCXQATCFCDMCLE-UHFFFAOYSA-N	1	1	308.382	1.853	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](O)C1	ZINC000114204107	407551642	/nfs/dbraw/zinc/55/16/42/407551642.db2.gz	DXLGYMVEXQHDKS-JOYOIKCWSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@H](O)C1	ZINC000114204107	407551648	/nfs/dbraw/zinc/55/16/48/407551648.db2.gz	DXLGYMVEXQHDKS-JOYOIKCWSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000266555539	407556893	/nfs/dbraw/zinc/55/68/93/407556893.db2.gz	VVLGYKRKLZBDPH-GHMZBOCLSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000266555539	407556898	/nfs/dbraw/zinc/55/68/98/407556898.db2.gz	VVLGYKRKLZBDPH-GHMZBOCLSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178859375	407630782	/nfs/dbraw/zinc/63/07/82/407630782.db2.gz	MTPDTPFZIALKRA-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178859375	407630786	/nfs/dbraw/zinc/63/07/86/407630786.db2.gz	MTPDTPFZIALKRA-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000261984778	407702487	/nfs/dbraw/zinc/70/24/87/407702487.db2.gz	AVGVVOVSORCOSH-BBRMVZONSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000261984778	407702492	/nfs/dbraw/zinc/70/24/92/407702492.db2.gz	AVGVVOVSORCOSH-BBRMVZONSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000152879306	407710711	/nfs/dbraw/zinc/71/07/11/407710711.db2.gz	PTXFMOQIANTXKX-YDHLFZDLSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCc3c(F)cccc3C2)c1	ZINC000152912732	407712621	/nfs/dbraw/zinc/71/26/21/407712621.db2.gz	DBQKFHXHLXHPHO-ZDUSSCGKSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3c(F)cccc3C2)c1	ZINC000152912732	407712622	/nfs/dbraw/zinc/71/26/22/407712622.db2.gz	DBQKFHXHLXHPHO-ZDUSSCGKSA-N	1	1	320.324	1.350	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CCO)c1ccccc1	ZINC000267043202	407727837	/nfs/dbraw/zinc/72/78/37/407727837.db2.gz	DMIYLMLUYPJDOX-CQSZACIVSA-N	1	1	304.350	1.847	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000179183975	407748262	/nfs/dbraw/zinc/74/82/62/407748262.db2.gz	OTZHERSBGAPZKQ-UHFFFAOYSA-N	1	1	318.333	1.818	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000179183975	407748265	/nfs/dbraw/zinc/74/82/65/407748265.db2.gz	OTZHERSBGAPZKQ-UHFFFAOYSA-N	1	1	318.333	1.818	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C	ZINC000117293493	407822759	/nfs/dbraw/zinc/82/27/59/407822759.db2.gz	WMEYFXIUJNNAIQ-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C	ZINC000117293493	407822766	/nfs/dbraw/zinc/82/27/66/407822766.db2.gz	WMEYFXIUJNNAIQ-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C[N@H+]1C1CC1	ZINC000133592208	407863335	/nfs/dbraw/zinc/86/33/35/407863335.db2.gz	BIXNSZRZIVMUNB-IUCAKERBSA-N	1	1	306.322	1.050	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])c(C)n2)CC1	ZINC000268431893	408042234	/nfs/dbraw/zinc/04/22/34/408042234.db2.gz	BGJRRIPLDLQPCI-ZDUSSCGKSA-N	1	1	321.425	1.984	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000175267692	408091822	/nfs/dbraw/zinc/09/18/22/408091822.db2.gz	GKAKQQJNMYBILV-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@H]1CCC[C@](CNC(=O)c2n[nH]cc2[N+](=O)[O-])([NH+](C)C)C1	ZINC000137899265	408161943	/nfs/dbraw/zinc/16/19/43/408161943.db2.gz	DDEKFQDNLRUUOJ-HZMBPMFUSA-N	1	1	309.370	1.558	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[N@H+]2CCCC[C@@H]2C1	ZINC000151012934	408239433	/nfs/dbraw/zinc/23/94/33/408239433.db2.gz	OBHTUIMKLSEFMG-CQSZACIVSA-N	1	1	321.352	1.973	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269524545	408340839	/nfs/dbraw/zinc/34/08/39/408340839.db2.gz	QVNXSTAZZIUDBJ-UHFFFAOYSA-N	1	1	311.386	1.903	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000274231997	408335192	/nfs/dbraw/zinc/33/51/92/408335192.db2.gz	DZKLVZRVGDPJBX-VIFPVBQESA-N	1	1	312.297	1.737	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000274231997	408335196	/nfs/dbraw/zinc/33/51/96/408335196.db2.gz	DZKLVZRVGDPJBX-VIFPVBQESA-N	1	1	312.297	1.737	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000269547492	408349358	/nfs/dbraw/zinc/34/93/58/408349358.db2.gz	XGDZTEFHWIJXDI-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000246876056	408359330	/nfs/dbraw/zinc/35/93/30/408359330.db2.gz	WJEZXFKEUYGRMU-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000246876056	408359333	/nfs/dbraw/zinc/35/93/33/408359333.db2.gz	WJEZXFKEUYGRMU-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC3(C2)CCCCC3)c1	ZINC000173803680	162366701	/nfs/dbraw/zinc/36/67/01/162366701.db2.gz	BUUVMMPNHJUKBP-CQSZACIVSA-N	1	1	308.382	1.808	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1	ZINC000247302575	408446141	/nfs/dbraw/zinc/44/61/41/408446141.db2.gz	LMICUORNKNXPPL-HZPDHXFCSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@@H]([C@H]3CCCO3)C2)cc1	ZINC000247302575	408446145	/nfs/dbraw/zinc/44/61/45/408446145.db2.gz	LMICUORNKNXPPL-HZPDHXFCSA-N	1	1	322.361	1.853	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000274472958	408420001	/nfs/dbraw/zinc/42/00/01/408420001.db2.gz	LMBIUZJERMMEHH-ZDUSSCGKSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000264286478	408426665	/nfs/dbraw/zinc/42/66/65/408426665.db2.gz	KTPNOWVTIIACPO-GFCCVEGCSA-N	1	1	314.345	1.996	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000176943941	408481876	/nfs/dbraw/zinc/48/18/76/408481876.db2.gz	OYOLABUSISJQGD-LLVKDONJSA-N	1	1	323.397	1.588	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000192029880	408531056	/nfs/dbraw/zinc/53/10/56/408531056.db2.gz	AHOPVGYJAVIQDY-VXGBXAGGSA-N	1	1	322.365	1.514	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@H+](C)C[C@H]1C	ZINC000247382259	408461482	/nfs/dbraw/zinc/46/14/82/408461482.db2.gz	LMOXTLVGWZTGPC-YGRLFVJLSA-N	1	1	306.366	1.710	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[C@@H]1O	ZINC000162490735	408708076	/nfs/dbraw/zinc/70/80/76/408708076.db2.gz	IIQRPQSOFIXUDC-NOLJZWGESA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1CN(c2cc(N)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000193522084	408725615	/nfs/dbraw/zinc/72/56/15/408725615.db2.gz	YGXFCQYJZABWQZ-NSHDSACASA-N	1	1	308.382	1.458	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CC[N@H+](CC(C)C)C1	ZINC000162188322	408676919	/nfs/dbraw/zinc/67/69/19/408676919.db2.gz	XPSONIUHPPLVKG-CYBMUJFWSA-N	1	1	323.397	1.194	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000251714141	408785673	/nfs/dbraw/zinc/78/56/73/408785673.db2.gz	KVAYODZSJMPBNN-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000251714141	408785674	/nfs/dbraw/zinc/78/56/74/408785674.db2.gz	KVAYODZSJMPBNN-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CCC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000281621460	408898588	/nfs/dbraw/zinc/89/85/88/408898588.db2.gz	FUYDCMVLINWAFK-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000286166584	408935676	/nfs/dbraw/zinc/93/56/76/408935676.db2.gz	WOIPALXJXAUSHJ-KBPBESRZSA-N	1	1	323.393	1.772	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000286174133	408936874	/nfs/dbraw/zinc/93/68/74/408936874.db2.gz	WXNUBHGNSABBKV-YOEHRIQHSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000291991089	408957892	/nfs/dbraw/zinc/95/78/92/408957892.db2.gz	QNWIQZFCGPSMDA-MRXNPFEDSA-N	1	1	318.377	1.832	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000281952719	408960717	/nfs/dbraw/zinc/96/07/17/408960717.db2.gz	FQKFDWBHJKQAIU-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000282094579	408989761	/nfs/dbraw/zinc/98/97/61/408989761.db2.gz	OWOJEYKSQXETGV-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
Cc1nc(N2CC[N@@H+](C3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000278682204	409086136	/nfs/dbraw/zinc/08/61/36/409086136.db2.gz	DKSIJIXMLYTYAB-GFCCVEGCSA-N	1	1	320.393	1.988	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000287821943	409098693	/nfs/dbraw/zinc/09/86/93/409098693.db2.gz	KGLCXQVXCABPHW-JTQLQIEISA-N	1	1	308.338	1.448	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000293967864	409217051	/nfs/dbraw/zinc/21/70/51/409217051.db2.gz	ULJOLMVAHWISJQ-LSDHHAIUSA-N	1	1	319.361	1.530	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](C2CC2)O1	ZINC000279453521	409217867	/nfs/dbraw/zinc/21/78/67/409217867.db2.gz	ZQIHUAFFVWWTJW-SMDDNHRTSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](C2CC2)O1	ZINC000279453521	409217870	/nfs/dbraw/zinc/21/78/70/409217870.db2.gz	ZQIHUAFFVWWTJW-SMDDNHRTSA-N	1	1	307.350	1.256	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@](C)(C(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000280278896	409284612	/nfs/dbraw/zinc/28/46/12/409284612.db2.gz	NDXFOGUXZVXWEV-HNNXBMFYSA-N	1	1	323.349	1.309	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc([N+](=O)[O-])c2ncccc12	ZINC000320812491	164042715	/nfs/dbraw/zinc/04/27/15/164042715.db2.gz	LEFNVMALUGXGOS-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000320812491	164042718	/nfs/dbraw/zinc/04/27/18/164042718.db2.gz	LEFNVMALUGXGOS-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000320812491	164042719	/nfs/dbraw/zinc/04/27/19/164042719.db2.gz	LEFNVMALUGXGOS-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[C@H]1CCOCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000373280178	164169333	/nfs/dbraw/zinc/16/93/33/164169333.db2.gz	JMGOGFHUOUVIAQ-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[N@H+]2CCC[C@H]2C1	ZINC000408024753	164201868	/nfs/dbraw/zinc/20/18/68/164201868.db2.gz	GTRPCSFAZFIBLZ-NSHDSACASA-N	1	1	314.345	1.996	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000356835186	409646732	/nfs/dbraw/zinc/64/67/32/409646732.db2.gz	CILRDVXOIWPNKM-MNOVXSKESA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@@H+]1C	ZINC000356835186	409646739	/nfs/dbraw/zinc/64/67/39/409646739.db2.gz	CILRDVXOIWPNKM-MNOVXSKESA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1CCC2)c1ccccc1[N+](=O)[O-]	ZINC000342475251	409663997	/nfs/dbraw/zinc/66/39/97/409663997.db2.gz	RNUSOYXKEITLHJ-SWLSCSKDSA-N	1	1	318.377	1.162	20	5		DDBDMO
NC(=O)c1cccc(N[C@H]2CCn3cc[nH+]c3C2)c1[N+](=O)[O-]	ZINC000343056655	410110959	/nfs/dbraw/zinc/11/09/59/410110959.db2.gz	VPIAWAPKEXGBOO-VIFPVBQESA-N	1	1	301.306	1.317	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000339399026	410161914	/nfs/dbraw/zinc/16/19/14/410161914.db2.gz	YNBATDFBURBILB-HOTGVXAUSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000332695030	410218872	/nfs/dbraw/zinc/21/88/72/410218872.db2.gz	RJERJTBNEAAPTB-KOLCDFICSA-N	1	1	321.333	1.536	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000351774285	410223740	/nfs/dbraw/zinc/22/37/40/410223740.db2.gz	LHMUFKMPQXOKHC-ISTVAULSSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000351774285	410223744	/nfs/dbraw/zinc/22/37/44/410223744.db2.gz	LHMUFKMPQXOKHC-ISTVAULSSA-N	1	1	323.349	1.243	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H](CO)C3)o2)cc1	ZINC000298654196	410330724	/nfs/dbraw/zinc/33/07/24/410330724.db2.gz	FLBJJEZWMJFFSF-NSHDSACASA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](CO)C3)o2)cc1	ZINC000298654196	410330730	/nfs/dbraw/zinc/33/07/30/410330730.db2.gz	FLBJJEZWMJFFSF-NSHDSACASA-N	1	1	318.333	1.849	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC1=CC[N@@H+](C)CC1	ZINC000343265537	410291881	/nfs/dbraw/zinc/29/18/81/410291881.db2.gz	OEBDJCUHHZGPAZ-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000343444153	410459267	/nfs/dbraw/zinc/45/92/67/410459267.db2.gz	BACASZCRRBFRGP-PWSUYJOCSA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000343459881	410471364	/nfs/dbraw/zinc/47/13/64/410471364.db2.gz	WTJNRUXNCSIALK-DGCLKSJQSA-N	1	1	323.397	1.397	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000343462143	410471690	/nfs/dbraw/zinc/47/16/90/410471690.db2.gz	SVSKYJSTVGPQLM-PWSUYJOCSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@]12CCC[N@H+]1C[C@@H](c1noc(-c3cc([N+](=O)[O-])c[nH]3)n1)OC2	ZINC000347332783	410478681	/nfs/dbraw/zinc/47/86/81/410478681.db2.gz	IGYRQWBFOHNGPN-SMDDNHRTSA-N	1	1	319.321	1.899	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)[NH+]1C	ZINC000343482765	410486680	/nfs/dbraw/zinc/48/66/80/410486680.db2.gz	VVKWNKJSUZFKKC-GHMZBOCLSA-N	1	1	320.349	1.084	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c1	ZINC000343511887	410502959	/nfs/dbraw/zinc/50/29/59/410502959.db2.gz	JGHXPOMPNDTBTQ-ZWNOBZJWSA-N	1	1	307.350	1.816	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000299101131	410521650	/nfs/dbraw/zinc/52/16/50/410521650.db2.gz	ZPXWNKGSSDBAKB-KBPBESRZSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC[N@@H+](CCOC)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000343641436	410589629	/nfs/dbraw/zinc/58/96/29/410589629.db2.gz	CCWUCCCKJAWLOG-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2C[NH2+]C[C@@H]2C1	ZINC000359308993	410596035	/nfs/dbraw/zinc/59/60/35/410596035.db2.gz	OSVPQFNWOGKSNK-CHWSQXEVSA-N	1	1	318.377	1.383	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc(C)c(C)cc1[N+](=O)[O-]	ZINC000299653694	410601432	/nfs/dbraw/zinc/60/14/32/410601432.db2.gz	TZZZJDXHZLSLBH-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+](C)CC2CC2)cc1[N+](=O)[O-]	ZINC000355603343	410603746	/nfs/dbraw/zinc/60/37/46/410603746.db2.gz	XQRWPYRAHKESBU-UHFFFAOYSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC[C@H]1CC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000352228065	410563295	/nfs/dbraw/zinc/56/32/95/410563295.db2.gz	VBZJAZSRRGRBSQ-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000352228065	410563300	/nfs/dbraw/zinc/56/33/00/410563300.db2.gz	VBZJAZSRRGRBSQ-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](CCCNc2ccccc2[N+](=O)[O-])C1	ZINC000301150818	410667158	/nfs/dbraw/zinc/66/71/58/410667158.db2.gz	MWZFBDRWHZCUPS-LBPRGKRZSA-N	1	1	306.366	1.594	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC)C1	ZINC000301539796	410742441	/nfs/dbraw/zinc/74/24/41/410742441.db2.gz	NOGWPNLHSPYBIG-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000337375113	410745451	/nfs/dbraw/zinc/74/54/51/410745451.db2.gz	ZVPPBUKJRAWFPF-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H]2Cc2ccccc2)c1	ZINC000353040146	410751877	/nfs/dbraw/zinc/75/18/77/410751877.db2.gz	NIBAZDMKTGMDLQ-ZBFHGGJFSA-N	1	1	316.361	1.469	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000330602658	410817026	/nfs/dbraw/zinc/81/70/26/410817026.db2.gz	WUJUJFGIEFRVGN-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000330602658	410817033	/nfs/dbraw/zinc/81/70/33/410817033.db2.gz	WUJUJFGIEFRVGN-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000359809571	410894999	/nfs/dbraw/zinc/89/49/99/410894999.db2.gz	QLVCZUSGVSTSNL-JTQLQIEISA-N	1	1	309.370	1.422	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000353351825	410934243	/nfs/dbraw/zinc/93/42/43/410934243.db2.gz	NPWGYNHMXZYNTH-UHFFFAOYSA-N	1	1	314.345	1.879	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCOC2)O1	ZINC000373805510	418461908	/nfs/dbraw/zinc/46/19/08/418461908.db2.gz	ODQZJDFEPCJMAA-KGLIPLIRSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCOC2)O1	ZINC000373805510	418461909	/nfs/dbraw/zinc/46/19/09/418461909.db2.gz	ODQZJDFEPCJMAA-KGLIPLIRSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000366953777	418542420	/nfs/dbraw/zinc/54/24/20/418542420.db2.gz	GTUHCMIFSDNHGS-AWEZNQCLSA-N	1	1	309.341	1.640	20	5		DDBDMO
CN(C)c1nc(NCCNc2ccc([N+](=O)[O-])cc2)cc[nH+]1	ZINC000354311168	418646840	/nfs/dbraw/zinc/64/68/40/418646840.db2.gz	JSIFKHZEKOONNO-UHFFFAOYSA-N	1	1	302.338	1.975	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000368133901	418694253	/nfs/dbraw/zinc/69/42/53/418694253.db2.gz	IDLDZDDNNXPULU-UQOMUDLDSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000368133901	418694256	/nfs/dbraw/zinc/69/42/56/418694256.db2.gz	IDLDZDDNNXPULU-UQOMUDLDSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000368133901	418694257	/nfs/dbraw/zinc/69/42/57/418694257.db2.gz	IDLDZDDNNXPULU-UQOMUDLDSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1CO	ZINC000362061353	418746393	/nfs/dbraw/zinc/74/63/93/418746393.db2.gz	AWVJWLBRHGXFAU-LALPHHSUSA-N	1	1	319.361	1.260	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3[nH]cnc3C2)c([N+](=O)[O-])c1	ZINC000365614259	418882907	/nfs/dbraw/zinc/88/29/07/418882907.db2.gz	SFDGPOYPMCZMPE-SNVBAGLBSA-N	1	1	317.305	1.873	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411656131	419372659	/nfs/dbraw/zinc/37/26/59/419372659.db2.gz	PJPSQIHSGCPQHB-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954654	419386003	/nfs/dbraw/zinc/38/60/03/419386003.db2.gz	ZPLPEHVUYXORML-MNOVXSKESA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954654	419386010	/nfs/dbraw/zinc/38/60/10/419386010.db2.gz	ZPLPEHVUYXORML-MNOVXSKESA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc([N+](=O)[O-])cc1F	ZINC000418118627	419547672	/nfs/dbraw/zinc/54/76/72/419547672.db2.gz	TVCCGWBNOQIJHB-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000412061857	419611483	/nfs/dbraw/zinc/61/14/83/419611483.db2.gz	AKLXPLBKYVCOIC-MCIONIFRSA-N	1	1	324.377	1.427	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000421706855	419691717	/nfs/dbraw/zinc/69/17/17/419691717.db2.gz	VYWZMLRPSXHEID-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CNCC[C@H]1C	ZINC000414932425	419879364	/nfs/dbraw/zinc/87/93/64/419879364.db2.gz	RBXQHEKUBICHDF-JMSVASOKSA-N	1	1	320.393	1.900	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000431832376	229061460	/nfs/dbraw/zinc/06/14/60/229061460.db2.gz	GASWBTRWRKLIQC-LBPRGKRZSA-N	1	1	319.361	1.635	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000418997860	420042317	/nfs/dbraw/zinc/04/23/17/420042317.db2.gz	LNTZLNZTSGAUNV-QWRGUYRKSA-N	1	1	311.386	1.011	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+](C)[C@@H](C)CN)c([N+](=O)[O-])c1	ZINC000420293663	420187504	/nfs/dbraw/zinc/18/75/04/420187504.db2.gz	ROGZOCVIYXAGRO-JTQLQIEISA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)[C@@H](C)CN)c([N+](=O)[O-])c1	ZINC000420293663	420187509	/nfs/dbraw/zinc/18/75/09/420187509.db2.gz	ROGZOCVIYXAGRO-JTQLQIEISA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H](C)CN	ZINC000430929559	420211326	/nfs/dbraw/zinc/21/13/26/420211326.db2.gz	PEHPXTFTACBPTN-SNVBAGLBSA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](C)CN	ZINC000430929559	420211327	/nfs/dbraw/zinc/21/13/27/420211327.db2.gz	PEHPXTFTACBPTN-SNVBAGLBSA-N	1	1	310.354	1.211	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000416298478	420314727	/nfs/dbraw/zinc/31/47/27/420314727.db2.gz	QXAOPILEGCUHOQ-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000416298478	420314730	/nfs/dbraw/zinc/31/47/30/420314730.db2.gz	QXAOPILEGCUHOQ-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](c3nnc[nH]3)C2)ccc1[N+](=O)[O-]	ZINC000425545569	420412562	/nfs/dbraw/zinc/41/25/62/420412562.db2.gz	KDJUHQYINAFYPN-NSHDSACASA-N	1	1	303.322	1.711	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4CC[C@@H](O)[C@H]4C3)nc2c1	ZINC000444689730	230121542	/nfs/dbraw/zinc/12/15/42/230121542.db2.gz	OQTYTQARUOFPNU-NURSFMCSSA-N	1	1	302.334	1.674	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@H]4C3)nc2c1	ZINC000444689730	230121544	/nfs/dbraw/zinc/12/15/44/230121544.db2.gz	OQTYTQARUOFPNU-NURSFMCSSA-N	1	1	302.334	1.674	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCC[C@H](C)C2)n1	ZINC000439102215	420479230	/nfs/dbraw/zinc/47/92/30/420479230.db2.gz	SLOOTAAGRDMNBY-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000492592903	420600576	/nfs/dbraw/zinc/60/05/76/420600576.db2.gz	JCDCBLURZXKSJR-YVMONPNESA-N	1	1	307.350	1.038	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CCO)Nc1cccc([N+](=O)[O-])c1	ZINC000454139319	420805783	/nfs/dbraw/zinc/80/57/83/420805783.db2.gz	DQGFJQJNTNLXHH-CQSZACIVSA-N	1	1	322.365	1.563	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1	ZINC000493929864	420969056	/nfs/dbraw/zinc/96/90/56/420969056.db2.gz	GSUQORKTYHWQFK-YPMHNXCESA-N	1	1	321.333	1.534	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1	ZINC000493929864	420969058	/nfs/dbraw/zinc/96/90/58/420969058.db2.gz	GSUQORKTYHWQFK-YPMHNXCESA-N	1	1	321.333	1.534	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000524790867	421272440	/nfs/dbraw/zinc/27/24/40/421272440.db2.gz	WRLFAJGOGRHBOQ-LLVKDONJSA-N	1	1	313.379	1.215	20	5		DDBDMO
COCC[NH+]1CCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC1	ZINC000515641443	421511529	/nfs/dbraw/zinc/51/15/29/421511529.db2.gz	RZMDLKOUWJQVNO-UHFFFAOYSA-N	1	1	320.393	1.637	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000516225689	421535069	/nfs/dbraw/zinc/53/50/69/421535069.db2.gz	ATCQPMDXXIVKGQ-JSGCOSHPSA-N	1	1	321.377	1.535	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCC[C@H](C)C1	ZINC000518772205	421666476	/nfs/dbraw/zinc/66/64/76/421666476.db2.gz	ZYNLXLMVKZXSSG-RYUDHWBXSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000571118408	421690010	/nfs/dbraw/zinc/69/00/10/421690010.db2.gz	NUUCVMQRZSRSHH-NSHDSACASA-N	1	1	309.370	1.560	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000571223240	421698560	/nfs/dbraw/zinc/69/85/60/421698560.db2.gz	BLAPEJBFKITMJD-UHFFFAOYSA-N	1	1	321.377	1.699	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000542652056	421826160	/nfs/dbraw/zinc/82/61/60/421826160.db2.gz	UXGAFUVQZIOMTL-NSHDSACASA-N	1	1	323.397	1.903	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565848	422350157	/nfs/dbraw/zinc/35/01/57/422350157.db2.gz	ISIVTQRRTQGGBC-AAEUAGOBSA-N	1	1	324.381	1.908	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565848	422350163	/nfs/dbraw/zinc/35/01/63/422350163.db2.gz	ISIVTQRRTQGGBC-AAEUAGOBSA-N	1	1	324.381	1.908	20	5		DDBDMO
Nc1ccc(NC[C@@H]2CC[N@H+]2C2CCCCC2)nc1[N+](=O)[O-]	ZINC000599126993	422402611	/nfs/dbraw/zinc/40/26/11/422402611.db2.gz	KUXAFLKRKZNFMN-LBPRGKRZSA-N	1	1	305.382	2.391	20	5		DDBDMO
Cc1ccnc(NCCCN2CCC[N@H+](C)CC2)c1[N+](=O)[O-]	ZINC000609669781	422464569	/nfs/dbraw/zinc/46/45/69/422464569.db2.gz	BEESEJDLDCNETP-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1ccnc(NCCC[N@H+]2CCCN(C)CC2)c1[N+](=O)[O-]	ZINC000609669781	422464574	/nfs/dbraw/zinc/46/45/74/422464574.db2.gz	BEESEJDLDCNETP-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1ccnc(NCCC[N@@H+]2CCCN(C)CC2)c1[N+](=O)[O-]	ZINC000609669781	422464584	/nfs/dbraw/zinc/46/45/84/422464584.db2.gz	BEESEJDLDCNETP-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@H]1C	ZINC000345962905	272377141	/nfs/dbraw/zinc/37/71/41/272377141.db2.gz	PTDVYNBGDNIVOT-MNOVXSKESA-N	1	1	306.366	1.732	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1c1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450959207	274348739	/nfs/dbraw/zinc/34/87/39/274348739.db2.gz	XTZNQWDTXQNFGK-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450959207	274348740	/nfs/dbraw/zinc/34/87/40/274348740.db2.gz	XTZNQWDTXQNFGK-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c3ncccc23)CC[N@H+]1CCO	ZINC000413254912	274364290	/nfs/dbraw/zinc/36/42/90/274364290.db2.gz	ZVSUSFHVUSGVAJ-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N2CCC[N@H+](CCO)CC2)s1	ZINC000287853726	275034080	/nfs/dbraw/zinc/03/40/80/275034080.db2.gz	LSGQJTRJSUBEKF-UHFFFAOYSA-N	1	1	323.378	1.104	20	5		DDBDMO
C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1c1cc(N)ccc1[N+](=O)[O-]	ZINC000291108432	279118567	/nfs/dbraw/zinc/11/85/67/279118567.db2.gz	LETYKKNXGJDLOR-DGCLKSJQSA-N	1	1	306.366	1.476	20	5		DDBDMO
CC[N@@H+]1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000264065881	279291208	/nfs/dbraw/zinc/29/12/08/279291208.db2.gz	ALYCSATYXPUTEO-UHFFFAOYSA-N	1	1	313.379	1.311	20	5		DDBDMO
CC[N@H+]1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000264065881	279291209	/nfs/dbraw/zinc/29/12/09/279291209.db2.gz	ALYCSATYXPUTEO-UHFFFAOYSA-N	1	1	313.379	1.311	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C[C@H](C)[NH2+]1	ZINC000123881886	288242558	/nfs/dbraw/zinc/24/25/58/288242558.db2.gz	LHMWSEKAIDAYNM-DTORHVGOSA-N	1	1	317.342	1.105	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC([NH+](C)C)C1	ZINC000272121504	280655871	/nfs/dbraw/zinc/65/58/71/280655871.db2.gz	PWKCWIPREQCERT-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C(C)(C)C(=O)N(C)C	ZINC000114458018	281073968	/nfs/dbraw/zinc/07/39/68/281073968.db2.gz	UWMQNHDEJMEXEB-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
CN1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C(C)(C)C1=O	ZINC000129858481	281359765	/nfs/dbraw/zinc/35/97/65/281359765.db2.gz	PSXWLAHKZBBEAT-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C(C)(C)C1=O	ZINC000129858481	281359766	/nfs/dbraw/zinc/35/97/66/281359766.db2.gz	PSXWLAHKZBBEAT-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H](c1ccccc1F)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246725786	282010426	/nfs/dbraw/zinc/01/04/26/282010426.db2.gz	MHADJYQXKOJFQJ-DGCLKSJQSA-N	1	1	322.340	1.984	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[C@H](C)[NH2+]1	ZINC000123963808	297061588	/nfs/dbraw/zinc/06/15/88/297061588.db2.gz	FZGLJLNHCFQXAB-DTORHVGOSA-N	1	1	317.342	1.105	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000357933504	299024853	/nfs/dbraw/zinc/02/48/53/299024853.db2.gz	JFCQDHXWHVBZKG-GFCCVEGCSA-N	1	1	323.397	1.569	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000364272391	300366523	/nfs/dbraw/zinc/36/65/23/300366523.db2.gz	UYYHJIVZLAAHBZ-UHFFFAOYSA-N	1	1	307.394	1.873	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1	ZINC000368349416	301008282	/nfs/dbraw/zinc/00/82/82/301008282.db2.gz	RPMWBJHMAZTQPZ-OAHLLOKOSA-N	1	1	304.350	1.466	20	5		DDBDMO
Cc1cnn(C)c1C[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368578584	301056896	/nfs/dbraw/zinc/05/68/96/301056896.db2.gz	OLLLWGZKDLVFBD-GFCCVEGCSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1cnn(C)c1C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368578584	301056897	/nfs/dbraw/zinc/05/68/97/301056897.db2.gz	OLLLWGZKDLVFBD-GFCCVEGCSA-N	1	1	304.354	1.670	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@](O)(C3CC3)C2)c2c(c1)COCO2	ZINC000370084983	301273226	/nfs/dbraw/zinc/27/32/26/301273226.db2.gz	QNLUVWAHOREORB-INIZCTEOSA-N	1	1	320.345	1.808	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532140706	303276567	/nfs/dbraw/zinc/27/65/67/303276567.db2.gz	RZPWBCMYSSKWNN-NWDGAFQWSA-N	1	1	306.366	1.840	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(CCO)CC1	ZINC000532960894	303303164	/nfs/dbraw/zinc/30/31/64/303303164.db2.gz	LSCZWADLNHUUCM-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000534338943	303331939	/nfs/dbraw/zinc/33/19/39/303331939.db2.gz	GVUNNXQILANMBS-NEPJUHHUSA-N	1	1	321.377	1.697	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000538918458	303392274	/nfs/dbraw/zinc/39/22/74/303392274.db2.gz	CKZAEYUCECPRGQ-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000538918458	303392275	/nfs/dbraw/zinc/39/22/75/303392275.db2.gz	CKZAEYUCECPRGQ-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1CO	ZINC000362075627	307013040	/nfs/dbraw/zinc/01/30/40/307013040.db2.gz	ISMIGBUSOBAZOO-AAEUAGOBSA-N	1	1	319.361	1.044	20	5		DDBDMO
CC1CCC([NH+]2CCC(NC(=O)[C@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000363673368	307032917	/nfs/dbraw/zinc/03/29/17/307032917.db2.gz	CBDKHKHILKBMRE-MOQPVCNJSA-N	1	1	309.410	1.811	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[NH2+]CC1	ZINC000364643457	307049326	/nfs/dbraw/zinc/04/93/26/307049326.db2.gz	VWMWPULNOURMIP-JTQLQIEISA-N	1	1	317.349	1.685	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]([C@H]2CCOC2)C1	ZINC000367142502	307087042	/nfs/dbraw/zinc/08/70/42/307087042.db2.gz	XKUSYUFGUVJORP-OLZOCXBDSA-N	1	1	307.350	1.115	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@@]3(CNC(=O)O3)C2)cc1[N+](=O)[O-]	ZINC000372747321	307174607	/nfs/dbraw/zinc/17/46/07/307174607.db2.gz	XVKUTRLIRWYKEN-OAHLLOKOSA-N	1	1	305.334	1.978	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@@]3(CNC(=O)O3)C2)cc1[N+](=O)[O-]	ZINC000372747321	307174608	/nfs/dbraw/zinc/17/46/08/307174608.db2.gz	XVKUTRLIRWYKEN-OAHLLOKOSA-N	1	1	305.334	1.978	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000373767354	307194842	/nfs/dbraw/zinc/19/48/42/307194842.db2.gz	BQBBDLPINAPTCP-AWEZNQCLSA-N	1	1	307.350	1.120	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000373767354	307194843	/nfs/dbraw/zinc/19/48/43/307194843.db2.gz	BQBBDLPINAPTCP-AWEZNQCLSA-N	1	1	307.350	1.120	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000567302117	308077395	/nfs/dbraw/zinc/07/73/95/308077395.db2.gz	CMERLAUOJYZDDP-LLVKDONJSA-N	1	1	309.370	1.573	20	5		DDBDMO
CCN(C[C@H]1CCC[N@@H+]1CC)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000567302117	308077396	/nfs/dbraw/zinc/07/73/96/308077396.db2.gz	CMERLAUOJYZDDP-LLVKDONJSA-N	1	1	309.370	1.573	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000567302117	308077397	/nfs/dbraw/zinc/07/73/97/308077397.db2.gz	CMERLAUOJYZDDP-LLVKDONJSA-N	1	1	309.370	1.573	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2nc3c(cc2[N+](=O)[O-])CCCC3)C1	ZINC000567607892	308086627	/nfs/dbraw/zinc/08/66/27/308086627.db2.gz	IHXIBKHIUSHURJ-OAHLLOKOSA-N	1	1	306.366	1.347	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCCC2	ZINC000583826832	337337333	/nfs/dbraw/zinc/33/73/33/337337333.db2.gz	CMYMSZLRRDDMIJ-UHFFFAOYSA-N	1	1	303.322	1.396	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000584662969	337378562	/nfs/dbraw/zinc/37/85/62/337378562.db2.gz	QCNCZJIOUFOQMK-HNNXBMFYSA-N	1	1	305.334	1.458	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000584662969	337378563	/nfs/dbraw/zinc/37/85/63/337378563.db2.gz	QCNCZJIOUFOQMK-HNNXBMFYSA-N	1	1	305.334	1.458	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1c(F)cccc1[N+](=O)[O-]	ZINC000419338959	533949252	/nfs/dbraw/zinc/94/92/52/533949252.db2.gz	ZPGZCUBKBBVYRX-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@@H]([N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)O	ZINC000451357595	534284930	/nfs/dbraw/zinc/28/49/30/534284930.db2.gz	DPHARPFYCGAPOD-YPMHNXCESA-N	1	1	312.366	1.426	20	5		DDBDMO
Cc1cn2c([nH+]1)CC[C@H](Nc1ccc3ncc([N+](=O)[O-])n3n1)C2	ZINC000302607993	534505481	/nfs/dbraw/zinc/50/54/81/534505481.db2.gz	BBWPRLXXJQINGK-JTQLQIEISA-N	1	1	313.321	1.569	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000458170297	528545740	/nfs/dbraw/zinc/54/57/40/528545740.db2.gz	OYNHISMMELOEER-LLVKDONJSA-N	1	1	323.397	1.732	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000336859134	536434802	/nfs/dbraw/zinc/43/48/02/536434802.db2.gz	FIZDEHBJZDGWGA-ZYHUDNBSSA-N	1	1	306.366	1.849	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000174700852	536801273	/nfs/dbraw/zinc/80/12/73/536801273.db2.gz	WQYCPTPBACKFJC-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000174700852	536801276	/nfs/dbraw/zinc/80/12/76/536801276.db2.gz	WQYCPTPBACKFJC-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000736857421	598503854	/nfs/dbraw/zinc/50/38/54/598503854.db2.gz	NKLATWDFVYFBAW-SNVBAGLBSA-N	1	1	317.353	1.529	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000820877007	606706027	/nfs/dbraw/zinc/70/60/27/606706027.db2.gz	XZXURUGLDJSLBQ-VIFPVBQESA-N	1	1	320.357	1.312	20	5		DDBDMO
C[C@@H]1[C@H](C)N(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@@H+]1C	ZINC000824860766	608196942	/nfs/dbraw/zinc/19/69/42/608196942.db2.gz	XSOQJIDPFURYPR-ZJUUUORDSA-N	1	1	317.353	1.304	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC1	ZINC000050696484	696233789	/nfs/dbraw/zinc/23/37/89/696233789.db2.gz	HHTHOOYOBXMTEY-UHFFFAOYSA-N	1	1	312.757	1.608	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@@H](C)[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964248	696378698	/nfs/dbraw/zinc/37/86/98/696378698.db2.gz	UJZCOFAZXRSHMP-OLZOCXBDSA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000068964248	696378701	/nfs/dbraw/zinc/37/87/01/696378701.db2.gz	UJZCOFAZXRSHMP-OLZOCXBDSA-N	1	1	323.397	1.766	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000748348851	700112009	/nfs/dbraw/zinc/11/20/09/700112009.db2.gz	LGLJULVIDNMLQN-LLVKDONJSA-N	1	1	307.350	1.308	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000748348851	700112010	/nfs/dbraw/zinc/11/20/10/700112010.db2.gz	LGLJULVIDNMLQN-LLVKDONJSA-N	1	1	307.350	1.308	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@@H]2CCCO2)c2ncc([N+](=O)[O-])cc12	ZINC000749954356	700194282	/nfs/dbraw/zinc/19/42/82/700194282.db2.gz	KIVLYRNQEFPWLJ-LBPRGKRZSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@H]2CCCO2)c2ncc([N+](=O)[O-])cc12	ZINC000749954356	700194284	/nfs/dbraw/zinc/19/42/84/700194284.db2.gz	KIVLYRNQEFPWLJ-LBPRGKRZSA-N	1	1	305.338	1.716	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCSC[C@@H]2CCO)cc1	ZINC000776585903	698122137	/nfs/dbraw/zinc/12/21/37/698122137.db2.gz	CTBGIDVLTUBFEA-KBPBESRZSA-N	1	1	312.391	1.428	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000719624983	699302832	/nfs/dbraw/zinc/30/28/32/699302832.db2.gz	NLCCIGVLSLZIMT-APPZFPTMSA-N	1	1	315.171	1.679	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000719624983	699302834	/nfs/dbraw/zinc/30/28/34/699302834.db2.gz	NLCCIGVLSLZIMT-APPZFPTMSA-N	1	1	315.171	1.679	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C2)CN1	ZINC000788385346	699310573	/nfs/dbraw/zinc/31/05/73/699310573.db2.gz	YZLDFMJUXSNOPB-HNNXBMFYSA-N	1	1	315.333	1.114	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1(CO)CCOCC1	ZINC000792409828	699695842	/nfs/dbraw/zinc/69/58/42/699695842.db2.gz	QRHZVSKVOJLVKB-AWEZNQCLSA-N	1	1	310.350	1.102	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000739873055	699781537	/nfs/dbraw/zinc/78/15/37/699781537.db2.gz	ROSULBUHVMKFBW-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@]3(CCOC3)C2)c2ncc([N+](=O)[O-])cc12	ZINC000756861340	700646219	/nfs/dbraw/zinc/64/62/19/700646219.db2.gz	CDYMXTXKMQGXLA-OAHLLOKOSA-N	1	1	317.349	1.718	20	5		DDBDMO
Nc1c(C(=O)OCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000758964900	700731297	/nfs/dbraw/zinc/73/12/97/700731297.db2.gz	OEKGRCLPZVZUFR-UHFFFAOYSA-N	1	1	309.322	1.056	20	5		DDBDMO
C[C@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@@H+]1C	ZINC000761073770	700839196	/nfs/dbraw/zinc/83/91/96/700839196.db2.gz	HKADHOBNYVEKEN-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@H]1CN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[N@H+]1C	ZINC000761073770	700839199	/nfs/dbraw/zinc/83/91/99/700839199.db2.gz	HKADHOBNYVEKEN-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[nH+]1	ZINC000770513705	701281263	/nfs/dbraw/zinc/28/12/63/701281263.db2.gz	WYCDRCPLWSYLBA-UHFFFAOYSA-N	1	1	317.305	1.241	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771404460	701318630	/nfs/dbraw/zinc/31/86/30/701318630.db2.gz	JCWZYHCBJGRYQF-VHSXEESVSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771404460	701318631	/nfs/dbraw/zinc/31/86/31/701318631.db2.gz	JCWZYHCBJGRYQF-VHSXEESVSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839724438	701797976	/nfs/dbraw/zinc/79/79/76/701797976.db2.gz	IDLDZDDNNXPULU-PMOUVXMZSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839724438	701797984	/nfs/dbraw/zinc/79/79/84/701797984.db2.gz	IDLDZDDNNXPULU-PMOUVXMZSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839724438	701797988	/nfs/dbraw/zinc/79/79/88/701797988.db2.gz	IDLDZDDNNXPULU-PMOUVXMZSA-N	1	1	303.362	1.288	20	5		DDBDMO
CN(CCOCC1CC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867956750	701852841	/nfs/dbraw/zinc/85/28/41/701852841.db2.gz	SUFZDMUUTXCIFI-INIZCTEOSA-N	1	1	321.377	1.654	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000810839422	701859807	/nfs/dbraw/zinc/85/98/07/701859807.db2.gz	AYZLUZILNCPNHH-STQMWFEESA-N	1	1	322.365	1.660	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4ccccn4c3[N+](=O)[O-])CC[C@H]21	ZINC000866206016	706648439	/nfs/dbraw/zinc/64/84/39/706648439.db2.gz	ICIDIQGBTCXJBY-VXGBXAGGSA-N	1	1	301.350	1.773	20	5		DDBDMO
CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CO	ZINC000817290056	702331311	/nfs/dbraw/zinc/33/13/11/702331311.db2.gz	AXJYKBXQRRDMNR-LBPRGKRZSA-N	1	1	302.758	1.812	20	5		DDBDMO
CC(C)[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)CO	ZINC000817290056	702331319	/nfs/dbraw/zinc/33/13/19/702331319.db2.gz	AXJYKBXQRRDMNR-LBPRGKRZSA-N	1	1	302.758	1.812	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CNCCC[NH+]2CCC(O)CC2)cc1	ZINC000843062798	702811294	/nfs/dbraw/zinc/81/12/94/702811294.db2.gz	SHTBRKSEGNNHND-INIZCTEOSA-N	1	1	323.393	1.065	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000844446793	703032425	/nfs/dbraw/zinc/03/24/25/703032425.db2.gz	JDEVZDYEWOZXNR-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000844446793	703032426	/nfs/dbraw/zinc/03/24/26/703032426.db2.gz	JDEVZDYEWOZXNR-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000879571937	706722119	/nfs/dbraw/zinc/72/21/19/706722119.db2.gz	USADZQFHIBHPLU-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000879574458	706723728	/nfs/dbraw/zinc/72/37/28/706723728.db2.gz	AAQVEZOWIHEPMO-KBPBESRZSA-N	1	1	318.377	1.220	20	5		DDBDMO
CCON(C)C(=O)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000846064004	703232962	/nfs/dbraw/zinc/23/29/62/703232962.db2.gz	ZFUYHYWFGVNGDZ-UHFFFAOYSA-N	1	1	301.730	1.748	20	5		DDBDMO
COCC[NH+]1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000818974931	704039693	/nfs/dbraw/zinc/03/96/93/704039693.db2.gz	ICUFDBVSYKDCOW-MRXNPFEDSA-N	1	1	323.393	1.329	20	5		DDBDMO
CN(C[C@@H]1CCCCO1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870871635	704152063	/nfs/dbraw/zinc/15/20/63/704152063.db2.gz	IXGPRTFMIMCAFM-GOEBONIOSA-N	1	1	321.377	1.796	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)C(C)(C)CC1	ZINC000871153140	704232480	/nfs/dbraw/zinc/23/24/80/704232480.db2.gz	HZIFMDOWJRLKQJ-UHFFFAOYSA-N	1	1	323.397	1.433	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000855733404	704499739	/nfs/dbraw/zinc/49/97/39/704499739.db2.gz	SANVXIRGHJJKMT-ARFHVFGLSA-N	1	1	317.389	1.427	20	5		DDBDMO
C[N@H+](CCc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000855733404	704499740	/nfs/dbraw/zinc/49/97/40/704499740.db2.gz	SANVXIRGHJJKMT-ARFHVFGLSA-N	1	1	317.389	1.427	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000855733404	704499741	/nfs/dbraw/zinc/49/97/41/704499741.db2.gz	SANVXIRGHJJKMT-ARFHVFGLSA-N	1	1	317.389	1.427	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000880302215	706933743	/nfs/dbraw/zinc/93/37/43/706933743.db2.gz	DPUPHITYDDAWMX-JTQLQIEISA-N	1	1	308.260	1.445	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000880302215	706933745	/nfs/dbraw/zinc/93/37/45/706933745.db2.gz	DPUPHITYDDAWMX-JTQLQIEISA-N	1	1	308.260	1.445	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000821782350	704806237	/nfs/dbraw/zinc/80/62/37/704806237.db2.gz	XIOQGUOYTKPXFP-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)n1	ZINC000874827016	705185540	/nfs/dbraw/zinc/18/55/40/705185540.db2.gz	AGNBGIWHFWJHRN-QWRGUYRKSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000823973431	705348416	/nfs/dbraw/zinc/34/84/16/705348416.db2.gz	HXDKATVXWYGRJV-ZANVPECISA-N	1	1	323.353	1.018	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000823973431	705348418	/nfs/dbraw/zinc/34/84/18/705348418.db2.gz	HXDKATVXWYGRJV-ZANVPECISA-N	1	1	323.353	1.018	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1	ZINC000827330866	705977274	/nfs/dbraw/zinc/97/72/74/705977274.db2.gz	SKINIXDAJLKNPX-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000827490929	706013251	/nfs/dbraw/zinc/01/32/51/706013251.db2.gz	JHPDJJNHUFAHQB-HUUCEWRRSA-N	1	1	321.377	1.427	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2nccn2C)C1	ZINC000878518886	706414394	/nfs/dbraw/zinc/41/43/94/706414394.db2.gz	VBSMKYTXPBZVOR-ZDUSSCGKSA-N	1	1	318.381	1.713	20	5		DDBDMO
CCc1nn(C)c(N[C@H]2CC[N@@H+](CC(C)(C)O)C2)c1[N+](=O)[O-]	ZINC000865998261	706589381	/nfs/dbraw/zinc/58/93/81/706589381.db2.gz	AKNLEVFUKWVFIT-JTQLQIEISA-N	1	1	311.386	1.148	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136794	706887915	/nfs/dbraw/zinc/88/79/15/706887915.db2.gz	SGDINAJZXIAXOI-ARFHVFGLSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136794	706887917	/nfs/dbraw/zinc/88/79/17/706887917.db2.gz	SGDINAJZXIAXOI-ARFHVFGLSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@@H]1CC[N@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136794	706887921	/nfs/dbraw/zinc/88/79/21/706887921.db2.gz	SGDINAJZXIAXOI-ARFHVFGLSA-N	1	1	305.378	1.797	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1	ZINC000880169331	706899449	/nfs/dbraw/zinc/89/94/49/706899449.db2.gz	QVCSXPIJVQBBTG-AWEZNQCLSA-N	1	1	319.361	1.373	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000880614811	707042756	/nfs/dbraw/zinc/04/27/56/707042756.db2.gz	ZWFUFXPFYOBTCX-LBPRGKRZSA-N	1	1	323.397	1.288	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897219483	708257360	/nfs/dbraw/zinc/25/73/60/708257360.db2.gz	LDJGUJPJMUMFSS-CHWSQXEVSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000885857333	708640880	/nfs/dbraw/zinc/64/08/80/708640880.db2.gz	AYCWYMOOHKFWBY-CYBMUJFWSA-N	1	1	319.361	1.578	20	5		DDBDMO
CON(C)C(=O)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886213230	708716237	/nfs/dbraw/zinc/71/62/37/708716237.db2.gz	OHRSCZBVHVCCRG-UHFFFAOYSA-N	1	1	308.338	1.222	20	5		DDBDMO
Cc1ccccc1[C@@H](CO)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000886433767	708760335	/nfs/dbraw/zinc/76/03/35/708760335.db2.gz	UBURAXQXCCBFIJ-CQSZACIVSA-N	1	1	304.350	1.765	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](c2ncccn2)C1	ZINC000886689775	708814479	/nfs/dbraw/zinc/81/44/79/708814479.db2.gz	HNFJTXSIDPWHQV-ZDUSSCGKSA-N	1	1	316.365	1.769	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000890081680	709740429	/nfs/dbraw/zinc/74/04/29/709740429.db2.gz	KMPZNMOYTMYZBC-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000892418318	710434074	/nfs/dbraw/zinc/43/40/74/710434074.db2.gz	OSNFMOFLKVKIJN-LBPRGKRZSA-N	1	1	306.366	1.736	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000893266689	710583042	/nfs/dbraw/zinc/58/30/42/710583042.db2.gz	SQKMOQGANXGWNB-UKRRQHHQSA-N	1	1	318.377	1.483	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000893267419	710583074	/nfs/dbraw/zinc/58/30/74/710583074.db2.gz	YWGHRFYNGJDSBJ-ZDUSSCGKSA-N	1	1	320.393	1.921	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc([N+](=O)[O-])c1C	ZINC000928438768	713195831	/nfs/dbraw/zinc/19/58/31/713195831.db2.gz	GVCNLTZQIVFTAR-PWSUYJOCSA-N	1	1	307.350	1.734	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C	ZINC000928438583	713195873	/nfs/dbraw/zinc/19/58/73/713195873.db2.gz	GIDSEGYKKFEHRN-BXKDBHETSA-N	1	1	324.356	1.622	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000928445236	713199503	/nfs/dbraw/zinc/19/95/03/713199503.db2.gz	PQLCXAPPUCZAIA-FZMZJTMJSA-N	1	1	316.361	1.758	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640405	710835308	/nfs/dbraw/zinc/83/53/08/710835308.db2.gz	YNQFIRYNLAILAR-JSGCOSHPSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640405	710835312	/nfs/dbraw/zinc/83/53/12/710835312.db2.gz	YNQFIRYNLAILAR-JSGCOSHPSA-N	1	1	317.349	1.920	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CC[N@@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928569266	713232277	/nfs/dbraw/zinc/23/22/77/713232277.db2.gz	XVYOJIUORHSZDY-VIFPVBQESA-N	1	1	309.322	1.046	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928569266	713232279	/nfs/dbraw/zinc/23/22/79/713232279.db2.gz	XVYOJIUORHSZDY-VIFPVBQESA-N	1	1	309.322	1.046	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1nccc2ccc([N+](=O)[O-])cc21	ZINC000894590333	711198454	/nfs/dbraw/zinc/19/84/54/711198454.db2.gz	DDUBPOFKJDHRHH-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
C[C@@H]1[C@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737553	711590756	/nfs/dbraw/zinc/59/07/56/711590756.db2.gz	BJCXSFDWTZCKML-ZYHUDNBSSA-N	1	1	316.361	1.951	20	5		DDBDMO
C[N@@H+](CC(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000913660237	713276798	/nfs/dbraw/zinc/27/67/98/713276798.db2.gz	SAQZRWNBKYIWDX-INIZCTEOSA-N	1	1	321.377	1.403	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c1	ZINC000896558122	711751664	/nfs/dbraw/zinc/75/16/64/711751664.db2.gz	YDZHAUNCFOVBHJ-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1cccc(N2CC[NH+](CCCNCC[N+](=O)[O-])CC2)c1	ZINC000905034365	711914689	/nfs/dbraw/zinc/91/46/89/711914689.db2.gz	KPGIIMMPLUVABS-UHFFFAOYSA-N	1	1	306.410	1.373	20	5		DDBDMO
CC(=O)Nc1ccc(C[NH+]2CCC(NCC[N+](=O)[O-])CC2)cc1	ZINC000905277595	711989669	/nfs/dbraw/zinc/98/96/69/711989669.db2.gz	BLGHDTNXHJUGTL-UHFFFAOYSA-N	1	1	320.393	1.476	20	5		DDBDMO
C[C@H]1[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000922556754	714088027	/nfs/dbraw/zinc/08/80/27/714088027.db2.gz	JKTKCGRYKMGLSF-JQWIXIFHSA-N	1	1	307.350	1.548	20	5		DDBDMO
C[C@H]1[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000922556754	714088030	/nfs/dbraw/zinc/08/80/30/714088030.db2.gz	JKTKCGRYKMGLSF-JQWIXIFHSA-N	1	1	307.350	1.548	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCC[N@H+](C)C1CCCC1	ZINC000932046867	714245683	/nfs/dbraw/zinc/24/56/83/714245683.db2.gz	RQLMURXGHKVIFY-UHFFFAOYSA-N	1	1	309.370	1.090	20	5		DDBDMO
Cc1ccc(CN2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)cc1[N+](=O)[O-]	ZINC000934271837	714782371	/nfs/dbraw/zinc/78/23/71/714782371.db2.gz	HFENQDOAEIMLST-HZPDHXFCSA-N	1	1	319.405	1.934	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3cnc4cc([N+](=O)[O-])ccc4n3)C[C@H]21	ZINC001164669125	719379303	/nfs/dbraw/zinc/37/93/03/719379303.db2.gz	QBKCUQXSDZXWPF-KGLIPLIRSA-N	1	1	315.333	1.057	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2cc(N)c([N+](=O)[O-])cn2)CC1	ZINC001120901377	782221374	/nfs/dbraw/zinc/22/13/74/782221374.db2.gz	MXBCKQIBNYYPRP-UHFFFAOYSA-N	1	1	309.370	1.119	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccccc1C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936424	742832414	/nfs/dbraw/zinc/83/24/14/742832414.db2.gz	HAYXVRXGCRYTEJ-HUUCEWRRSA-N	1	1	303.362	1.435	20	5		DDBDMO
O=C(NCC1C[NH+](CC2CC3(CCC3)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031662763	747337128	/nfs/dbraw/zinc/33/71/28/747337128.db2.gz	LOQGMIAVLGMTBG-ZIAGYGMSSA-N	1	1	307.394	1.280	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC001198362458	747464513	/nfs/dbraw/zinc/46/45/13/747464513.db2.gz	GATRMTNVZVDJGO-LLVKDONJSA-N	1	1	322.365	1.380	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001095574670	750050836	/nfs/dbraw/zinc/05/08/36/750050836.db2.gz	IGMXLGUHRWMHCL-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1)N1CCCC1	ZINC001169022489	762200941	/nfs/dbraw/zinc/20/09/41/762200941.db2.gz	CEVKWGRZQQAQID-RRFJBIMHSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCC(CC)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001017544484	758011791	/nfs/dbraw/zinc/01/17/91/758011791.db2.gz	UILYABSQUWHERR-LXTVHRRPSA-N	1	1	309.410	1.763	20	5		DDBDMO
CCC(CC)C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001017544484	758011806	/nfs/dbraw/zinc/01/18/06/758011806.db2.gz	UILYABSQUWHERR-LXTVHRRPSA-N	1	1	309.410	1.763	20	5		DDBDMO
CCC(CC)C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001017544484	758011815	/nfs/dbraw/zinc/01/18/15/758011815.db2.gz	UILYABSQUWHERR-LXTVHRRPSA-N	1	1	309.410	1.763	20	5		DDBDMO
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1F)[C@H]1C[N@@H+](C)CCN1C	ZINC000829037764	759864825	/nfs/dbraw/zinc/86/48/25/759864825.db2.gz	MIXZTHJYWZHKFB-IINYFYTJSA-N	1	1	324.356	1.098	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CCC2CCCCC2)C1	ZINC001042704947	764373097	/nfs/dbraw/zinc/37/30/97/764373097.db2.gz	CTVQQJOOTJHPLU-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
CCC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1	ZINC001051291494	764719220	/nfs/dbraw/zinc/71/92/20/764719220.db2.gz	RPXWXGRXIQZDCO-HZPDHXFCSA-N	1	1	317.389	1.736	20	5		DDBDMO
CCC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1	ZINC001051291494	764719225	/nfs/dbraw/zinc/71/92/25/764719225.db2.gz	RPXWXGRXIQZDCO-HZPDHXFCSA-N	1	1	317.389	1.736	20	5		DDBDMO
CCC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1	ZINC001051291494	764719235	/nfs/dbraw/zinc/71/92/35/764719235.db2.gz	RPXWXGRXIQZDCO-HZPDHXFCSA-N	1	1	317.389	1.736	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334314	766256827	/nfs/dbraw/zinc/25/68/27/766256827.db2.gz	CAJBUYDAPHSDCN-RBOXIYTFSA-N	1	1	324.377	1.210	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001048525498	769492636	/nfs/dbraw/zinc/49/26/36/769492636.db2.gz	XJYNOKISQGBGIL-YIDVYQOGSA-N	1	1	321.421	1.811	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048525498	769492640	/nfs/dbraw/zinc/49/26/40/769492640.db2.gz	XJYNOKISQGBGIL-YIDVYQOGSA-N	1	1	321.421	1.811	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048525498	769492647	/nfs/dbraw/zinc/49/26/47/769492647.db2.gz	XJYNOKISQGBGIL-YIDVYQOGSA-N	1	1	321.421	1.811	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])cc1F	ZINC001136342058	771942665	/nfs/dbraw/zinc/94/26/65/771942665.db2.gz	BPLGQPXBJKAXBL-SECBINFHSA-N	1	1	311.313	1.424	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCCNC(=O)C[N@H+](C)C(C)C	ZINC001094456730	775894689	/nfs/dbraw/zinc/89/46/89/775894689.db2.gz	PJGREBYEXITNDC-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
NC(=O)[C@@H]1C[C@H](F)C[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172912885	776942975	/nfs/dbraw/zinc/94/29/75/776942975.db2.gz	CGPXEKBKCLDTLO-GUTXKFCHSA-N	1	1	321.352	1.740	20	5		DDBDMO
NC(=O)[C@@H]1C[C@H](F)C[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172912885	776942976	/nfs/dbraw/zinc/94/29/76/776942976.db2.gz	CGPXEKBKCLDTLO-GUTXKFCHSA-N	1	1	321.352	1.740	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(CCNC2=O)C1	ZINC001173221010	777053150	/nfs/dbraw/zinc/05/31/50/777053150.db2.gz	FGARWIVFGRAKBR-BLLLJJGKSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@](CO)([NH2+]Cc1cc(=O)c(O)co1)c1cccc([N+](=O)[O-])c1	ZINC001175322339	777751173	/nfs/dbraw/zinc/75/11/73/777751173.db2.gz	BEFKLGCAZLOPFZ-OAHLLOKOSA-N	1	1	320.301	1.251	20	5		DDBDMO
CNS(=O)(=O)c1ccc(Nc2[nH]cc(C)[nH+]2)c([N+](=O)[O-])c1	ZINC001116319047	780496326	/nfs/dbraw/zinc/49/63/26/780496326.db2.gz	IWYFXVUMTQKKKQ-UHFFFAOYSA-N	1	1	311.323	1.278	20	5		DDBDMO
C[C@@](O)(C[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307064	781400876	/nfs/dbraw/zinc/40/08/76/781400876.db2.gz	ZOSCEALOKGQACL-DLBZAZTESA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@@](O)(C[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307064	781400878	/nfs/dbraw/zinc/40/08/78/781400878.db2.gz	ZOSCEALOKGQACL-DLBZAZTESA-N	1	1	320.389	1.865	20	5		DDBDMO
CCc1ccc(C[N@@H+](C)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC001267194776	837511897	/nfs/dbraw/zinc/51/18/97/837511897.db2.gz	XYIRKRURHOKGOJ-HUUCEWRRSA-N	1	1	305.378	1.462	20	5		DDBDMO
CCc1ccc(C[N@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001267194776	837511905	/nfs/dbraw/zinc/51/19/05/837511905.db2.gz	XYIRKRURHOKGOJ-HUUCEWRRSA-N	1	1	305.378	1.462	20	5		DDBDMO
CCc1ccc(C[N@@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001267194776	837511917	/nfs/dbraw/zinc/51/19/17/837511917.db2.gz	XYIRKRURHOKGOJ-HUUCEWRRSA-N	1	1	305.378	1.462	20	5		DDBDMO
CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)C)CC1	ZINC001121794116	858597970	/nfs/dbraw/zinc/59/79/70/858597970.db2.gz	WMZWWXYOIOLOHX-GFCCVEGCSA-N	1	1	310.402	1.556	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)n1	ZINC001157263706	863691505	/nfs/dbraw/zinc/69/15/05/863691505.db2.gz	BLGDZVAIBDNVEI-GHMZBOCLSA-N	1	1	307.354	1.232	20	5		DDBDMO
COc1cc(NCC2([NH+]3CCCC3)COC2)ncc1[N+](=O)[O-]	ZINC001157655330	864020032	/nfs/dbraw/zinc/02/00/32/864020032.db2.gz	PEAGPOOIIJDSLE-UHFFFAOYSA-N	1	1	308.338	1.275	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1cc2ccccc2o1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761598	864110684	/nfs/dbraw/zinc/11/06/84/864110684.db2.gz	SUIGWNLBLYOIJV-ZIAGYGMSSA-N	1	1	317.345	1.694	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc(C2CC2)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767040	864118044	/nfs/dbraw/zinc/11/80/44/864118044.db2.gz	DWVUGRSSCQYQDG-HZPDHXFCSA-N	1	1	317.389	1.825	20	5		DDBDMO
C[N@@H+](C1CN(c2ccc3[nH]cc([N+](=O)[O-])c3n2)C1)[C@H]1CCOC1	ZINC001158736465	864871010	/nfs/dbraw/zinc/87/10/10/864871010.db2.gz	NBWQIINVNBNXDG-JTQLQIEISA-N	1	1	317.349	1.380	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCC[N@H+]2C	ZINC001332401690	865814330	/nfs/dbraw/zinc/81/43/30/865814330.db2.gz	KHYRDRSRDPNIIW-GJZGRUSLSA-N	1	1	318.377	1.945	20	5		DDBDMO
CC(=O)NC[C@@H](C)CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001160656802	865999996	/nfs/dbraw/zinc/99/99/96/865999996.db2.gz	SAWIFQMJWOAERM-MVIFTORASA-N	1	1	321.381	1.706	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC001333721525	866962418	/nfs/dbraw/zinc/96/24/18/866962418.db2.gz	IKMANHXZMYLWKT-ABAIWWIYSA-N	1	1	317.349	1.574	20	5		DDBDMO
Cn1nccc1CNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001161875917	867063978	/nfs/dbraw/zinc/06/39/78/867063978.db2.gz	KHKHAQFCWGKPOT-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
Cn1nccc1CNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001161875917	867063994	/nfs/dbraw/zinc/06/39/94/867063994.db2.gz	KHKHAQFCWGKPOT-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001333874568	867101784	/nfs/dbraw/zinc/10/17/84/867101784.db2.gz	BCYJXLWQOYJSRJ-GFCCVEGCSA-N	1	1	318.377	1.962	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)C[C@]1(O)CCC[N@@H+](C)C1	ZINC001163063115	868048464	/nfs/dbraw/zinc/04/84/64/868048464.db2.gz	YFDYYDWDWYESQF-OAHLLOKOSA-N	1	1	322.365	1.422	20	5		DDBDMO
COc1ccc([N+](=O)[O-])nc1NCC1(N(C)C)CC[NH+](C)CC1	ZINC001164212003	869017955	/nfs/dbraw/zinc/01/79/55/869017955.db2.gz	VDKNDEFCWPNRJW-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC([NH2+]C2COC2)C1	ZINC001164220786	869030059	/nfs/dbraw/zinc/03/00/59/869030059.db2.gz	NDHZRKCFAOZXQB-UHFFFAOYSA-N	1	1	300.318	1.320	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H](C)[C@@H]1C[N@H+](C)CCN1C	ZINC001338083935	869791020	/nfs/dbraw/zinc/79/10/20/869791020.db2.gz	LTUGOHOVOAPTHT-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001338083935	869791026	/nfs/dbraw/zinc/79/10/26/869791026.db2.gz	LTUGOHOVOAPTHT-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
NC(=O)[C@@H]1CN(c2ccc3ccc4cccnc4c3n2)CC[NH2+]1	ZINC001166723921	870193364	/nfs/dbraw/zinc/19/33/64/870193364.db2.gz	NQHPTGPOIZTHPZ-ZDUSSCGKSA-N	1	1	307.357	1.047	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2cc([N+](=O)[O-])c(C(=O)OC)cc2OC)C1	ZINC001226431668	882426508	/nfs/dbraw/zinc/42/65/08/882426508.db2.gz	QAKZBNILOSUARI-SNVBAGLBSA-N	1	1	324.333	1.863	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc([N+](=O)[O-])c4nonc43)[C@@H]2C1	ZINC001339997588	870830823	/nfs/dbraw/zinc/83/08/23/870830823.db2.gz	DRMXPZKIRXRUST-AEJSXWLSSA-N	1	1	303.322	1.883	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@]23CCCOC3)c1	ZINC001308171581	871478283	/nfs/dbraw/zinc/47/82/83/871478283.db2.gz	VKCLWKIADIORFB-CABCVRRESA-N	1	1	324.381	1.187	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CCC(CC(N)=O)CC2)c1[N+](=O)[O-]	ZINC001308624829	871517013	/nfs/dbraw/zinc/51/70/13/871517013.db2.gz	DHMMZIFLVPNQPV-UHFFFAOYSA-N	1	1	323.349	1.396	20	5		DDBDMO
NC(=O)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccn1	ZINC001308779490	871529339	/nfs/dbraw/zinc/52/93/39/871529339.db2.gz	AUVYSGSPFUEQHC-AWEZNQCLSA-N	1	1	300.318	1.349	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1N(C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC001345464655	873412638	/nfs/dbraw/zinc/41/26/38/873412638.db2.gz	AJSKPXZKMPDTEP-GUTXKFCHSA-N	1	1	307.350	1.405	20	5		DDBDMO
CC(C)(CCC(=O)OC[C@H]1CC[N@H+]1C1CCOCC1)[N+](=O)[O-]	ZINC001345667587	873470265	/nfs/dbraw/zinc/47/02/65/873470265.db2.gz	ZNGWXXBCZRJNRW-CYBMUJFWSA-N	1	1	314.382	1.618	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC001348998645	874915169	/nfs/dbraw/zinc/91/51/69/874915169.db2.gz	MLTKTYAHMOTCFZ-NEPJUHHUSA-N	1	1	322.340	1.625	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])c(Cl)n3)[C@H]1CC(=O)C2	ZINC001228934448	883736286	/nfs/dbraw/zinc/73/62/86/883736286.db2.gz	PNPULZODFKTVKZ-WHGOUJPWSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])c(Cl)n3)[C@H]1CC(=O)C2	ZINC001228934448	883736300	/nfs/dbraw/zinc/73/63/00/883736300.db2.gz	PNPULZODFKTVKZ-WHGOUJPWSA-N	1	1	311.725	1.826	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCC[N@H+]1C1CC1	ZINC000278361394	214115906	/nfs/dbraw/zinc/11/59/06/214115906.db2.gz	AWAZFSUSKFNMHZ-CQSZACIVSA-N	1	1	319.361	1.846	20	5		DDBDMO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000081904032	192336166	/nfs/dbraw/zinc/33/61/66/192336166.db2.gz	FKEKIYQUUDLSOX-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000083171492	185215694	/nfs/dbraw/zinc/21/56/94/185215694.db2.gz	RPTCWWAGXLJOFU-SNVBAGLBSA-N	1	1	318.333	1.694	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000083171492	185215695	/nfs/dbraw/zinc/21/56/95/185215695.db2.gz	RPTCWWAGXLJOFU-SNVBAGLBSA-N	1	1	318.333	1.694	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CCO)c1ccccc1[N+](=O)[O-]	ZINC000452391451	231375617	/nfs/dbraw/zinc/37/56/17/231375617.db2.gz	QBKHTUIDYDBQRK-GFCCVEGCSA-N	1	1	307.350	1.171	20	5		DDBDMO
CC[C@H](C)[NH+]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000296743035	529699959	/nfs/dbraw/zinc/69/99/59/529699959.db2.gz	ASLMAOBBQQQPLH-JTQLQIEISA-N	1	1	309.370	1.193	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cc[nH+]1	ZINC000445000845	529774235	/nfs/dbraw/zinc/77/42/35/529774235.db2.gz	PQRHPNHENSVUNS-UHFFFAOYSA-N	1	1	303.278	1.409	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000181562071	199317459	/nfs/dbraw/zinc/31/74/59/199317459.db2.gz	ZGOFVNJCMWRHLN-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000491745139	529792323	/nfs/dbraw/zinc/79/23/23/529792323.db2.gz	NTIKCVAUNSIPHG-TZNOJPMFSA-N	1	1	307.325	1.815	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000457203335	529882896	/nfs/dbraw/zinc/88/28/96/529882896.db2.gz	OLWOPFMMUGWSKS-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000491874426	530053178	/nfs/dbraw/zinc/05/31/78/530053178.db2.gz	VODGKKADEZEMHZ-XQRVVYSFSA-N	1	1	307.325	1.911	20	5		DDBDMO
C[NH+]1CCN(CCC(C)(C)Nc2ncccc2[N+](=O)[O-])CC1	ZINC000302265131	530072210	/nfs/dbraw/zinc/07/22/10/530072210.db2.gz	QODOCUDEQVIYQL-UHFFFAOYSA-N	1	1	307.398	1.818	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330915848	232160996	/nfs/dbraw/zinc/16/09/96/232160996.db2.gz	URUDUWLRVLFSNW-VXGBXAGGSA-N	1	1	306.366	1.606	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286770072	219157121	/nfs/dbraw/zinc/15/71/21/219157121.db2.gz	ZUBHWUABKQBPCV-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cn1cncc1CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000459379233	233147272	/nfs/dbraw/zinc/14/72/72/233147272.db2.gz	PDLGEGNAELSWTK-GFCCVEGCSA-N	1	1	316.365	1.452	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000181883895	186214849	/nfs/dbraw/zinc/21/48/49/186214849.db2.gz	HQTWBPQFXXAAQZ-JTQLQIEISA-N	1	1	307.306	1.148	20	5		DDBDMO
CCn1cnnc1C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000564845228	304018990	/nfs/dbraw/zinc/01/89/90/304018990.db2.gz	SBZVJJCAGVLOCO-UHFFFAOYSA-N	1	1	318.337	1.325	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000041423263	352307325	/nfs/dbraw/zinc/30/73/25/352307325.db2.gz	ZWTYRUDJNXFZED-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@@H]1C	ZINC000043085834	352360272	/nfs/dbraw/zinc/36/02/72/352360272.db2.gz	FKWORRPFEYYIDH-RYUDHWBXSA-N	1	1	309.370	1.170	20	5		DDBDMO
O=C(NCC1([NH+]2CCSCC2)CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000044521418	352387497	/nfs/dbraw/zinc/38/74/97/352387497.db2.gz	FNIXITJXMUASFJ-NEPJUHHUSA-N	1	1	313.423	1.129	20	5		DDBDMO
Cc1cccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000053506618	352659237	/nfs/dbraw/zinc/65/92/37/352659237.db2.gz	DXIBHCWGSSQEQO-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)/C=C/c1ccc(F)cc1[N+](=O)[O-]	ZINC000491577356	234207358	/nfs/dbraw/zinc/20/73/58/234207358.db2.gz	VRKSHLLSOWRYBQ-MALLOTDXSA-N	1	1	307.325	1.910	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)nc2sccn21	ZINC000064337432	352934273	/nfs/dbraw/zinc/93/42/73/352934273.db2.gz	XYHZFJRXEWLBRM-UWVGGRQHSA-N	1	1	323.378	1.579	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000067703310	353063757	/nfs/dbraw/zinc/06/37/57/353063757.db2.gz	DPLVMRLCLLUMMM-GFCCVEGCSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000072714981	353211812	/nfs/dbraw/zinc/21/18/12/353211812.db2.gz	MEMFOFRWFRKOFZ-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000072714981	353211815	/nfs/dbraw/zinc/21/18/15/353211815.db2.gz	MEMFOFRWFRKOFZ-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000332012028	234386676	/nfs/dbraw/zinc/38/66/76/234386676.db2.gz	SGHRPCRYVRAJPQ-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
NS(=O)(=O)C[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000074288475	353304984	/nfs/dbraw/zinc/30/49/84/353304984.db2.gz	LXODERJXTFFJAO-LBPRGKRZSA-N	1	1	313.379	1.095	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC2	ZINC000078618993	353525412	/nfs/dbraw/zinc/52/54/12/353525412.db2.gz	FFKVHUJUFHILRW-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])CC2	ZINC000078618993	353525415	/nfs/dbraw/zinc/52/54/15/353525415.db2.gz	FFKVHUJUFHILRW-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(C(=O)c3cc([N+](=O)[O-])c[nH]3)CC2)CCO1	ZINC000079427309	353560629	/nfs/dbraw/zinc/56/06/29/353560629.db2.gz	DRTZLMWKWCLPDI-LLVKDONJSA-N	1	1	322.365	1.248	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[C@@H]1O	ZINC000080466981	353609513	/nfs/dbraw/zinc/60/95/13/353609513.db2.gz	MJJOEPKTTUQPIO-HIFRSBDPSA-N	1	1	319.361	1.329	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000175171686	198438930	/nfs/dbraw/zinc/43/89/30/198438930.db2.gz	NQEDNZDSGCMDOJ-UHFFFAOYSA-N	1	1	324.381	1.362	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000081527122	353680826	/nfs/dbraw/zinc/68/08/26/353680826.db2.gz	DTHDGSSOUOGRJG-NSHDSACASA-N	1	1	322.365	1.156	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000081527122	353680828	/nfs/dbraw/zinc/68/08/28/353680828.db2.gz	DTHDGSSOUOGRJG-NSHDSACASA-N	1	1	322.365	1.156	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H](O)C1CC1	ZINC000305730642	354471195	/nfs/dbraw/zinc/47/11/95/354471195.db2.gz	KIYQMCRENGQLKC-HZMBPMFUSA-N	1	1	307.350	1.625	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)c2nc(C)cc(C)c2[N+](=O)[O-])[N@@H+](C)C1	ZINC000585783472	354842277	/nfs/dbraw/zinc/84/22/77/354842277.db2.gz	CXDXLTLPIXUHOA-STQMWFEESA-N	1	1	308.382	1.762	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588862578	354944010	/nfs/dbraw/zinc/94/40/10/354944010.db2.gz	GNUWJJLRWMGECZ-KBPBESRZSA-N	1	1	319.361	1.184	20	5		DDBDMO
CN(CC(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21)c1ccccc1[N+](=O)[O-]	ZINC000590046410	355043245	/nfs/dbraw/zinc/04/32/45/355043245.db2.gz	CKRSECMEWLYSPC-SWLSCSKDSA-N	1	1	318.377	1.194	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000590046692	355043898	/nfs/dbraw/zinc/04/38/98/355043898.db2.gz	MMNCGAYGBVSGDE-HIFRSBDPSA-N	1	1	303.362	1.608	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC000590444457	355098119	/nfs/dbraw/zinc/09/81/19/355098119.db2.gz	LZJTWHXXBUCMKJ-QPUJVOFHSA-N	1	1	308.313	1.092	20	5		DDBDMO
O=C(CC[N@H+](CCCO)C1CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000591014561	355232348	/nfs/dbraw/zinc/23/23/48/355232348.db2.gz	QNLUWORAVHPQRK-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000591281843	355277488	/nfs/dbraw/zinc/27/74/88/355277488.db2.gz	OOSVPOFGYQWBHW-GVXVVHGQSA-N	1	1	324.356	1.602	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1	ZINC000593019056	355771478	/nfs/dbraw/zinc/77/14/78/355771478.db2.gz	DGQLKQOJIFOPFB-NEPJUHHUSA-N	1	1	321.377	1.906	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593032353	355775183	/nfs/dbraw/zinc/77/51/83/355775183.db2.gz	YVZCVTSPRQAEBC-AWEZNQCLSA-N	1	1	321.377	1.907	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000593065153	355784699	/nfs/dbraw/zinc/78/46/99/355784699.db2.gz	YAVSHMWGQFVLHK-VHDGCEQUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000593065153	355784704	/nfs/dbraw/zinc/78/47/04/355784704.db2.gz	YAVSHMWGQFVLHK-VHDGCEQUSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000593187718	355820073	/nfs/dbraw/zinc/82/00/73/355820073.db2.gz	OIVRHKYZESLSSV-JHJVBQTASA-N	1	1	321.377	1.913	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccnc2cc([N+](=O)[O-])ccc21	ZINC000593483545	355899764	/nfs/dbraw/zinc/89/97/64/355899764.db2.gz	ZWHRDRQQQKASHO-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594108049	356115406	/nfs/dbraw/zinc/11/54/06/356115406.db2.gz	PHOHVBGMMQJNRU-SDDRHHMPSA-N	1	1	324.381	1.161	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594108049	356115413	/nfs/dbraw/zinc/11/54/13/356115413.db2.gz	PHOHVBGMMQJNRU-SDDRHHMPSA-N	1	1	324.381	1.161	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCC(=O)N(C)C1	ZINC000593994749	356082172	/nfs/dbraw/zinc/08/21/72/356082172.db2.gz	JBIHBEHEJQTNAQ-ZDUSSCGKSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H]1CCC(=O)N(C)C1	ZINC000593994749	356082176	/nfs/dbraw/zinc/08/21/76/356082176.db2.gz	JBIHBEHEJQTNAQ-ZDUSSCGKSA-N	1	1	307.350	1.656	20	5		DDBDMO
CC(C)CNC(=O)CCC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000595423286	356486902	/nfs/dbraw/zinc/48/69/02/356486902.db2.gz	LIGGHILXMBBKFW-UHFFFAOYSA-N	1	1	320.393	1.900	20	5		DDBDMO
CC(C)CNC(=O)CCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000595423286	356486906	/nfs/dbraw/zinc/48/69/06/356486906.db2.gz	LIGGHILXMBBKFW-UHFFFAOYSA-N	1	1	320.393	1.900	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)CN1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000595425005	356487592	/nfs/dbraw/zinc/48/75/92/356487592.db2.gz	QUUPAXKJVJIZLP-AWEZNQCLSA-N	1	1	308.382	1.049	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000081555455	192291068	/nfs/dbraw/zinc/29/10/68/192291068.db2.gz	UDQQFZHOAYQJST-NSHDSACASA-N	1	1	322.365	1.156	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H]1C	ZINC000595553971	356548150	/nfs/dbraw/zinc/54/81/50/356548150.db2.gz	CCCADMYHOMOIBQ-YNEHKIRRSA-N	1	1	324.381	1.843	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595741349	356630487	/nfs/dbraw/zinc/63/04/87/356630487.db2.gz	MXSGOSBVTLBLFC-GWCFXTLKSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595741349	356630490	/nfs/dbraw/zinc/63/04/90/356630490.db2.gz	MXSGOSBVTLBLFC-GWCFXTLKSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000595744233	356632263	/nfs/dbraw/zinc/63/22/63/356632263.db2.gz	UUBOYUKBTWJOIP-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@H]1COCCO1	ZINC000595738480	356629493	/nfs/dbraw/zinc/62/94/93/356629493.db2.gz	JDHDEEUXBNLMOU-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595767449	356644658	/nfs/dbraw/zinc/64/46/58/356644658.db2.gz	XKZTXERIGOUDCY-YNEHKIRRSA-N	1	1	310.350	1.180	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000595823896	356664885	/nfs/dbraw/zinc/66/48/85/356664885.db2.gz	SYMVQVISVGYNDO-ZDUSSCGKSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C)C(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000595823896	356664888	/nfs/dbraw/zinc/66/48/88/356664888.db2.gz	SYMVQVISVGYNDO-ZDUSSCGKSA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595876239	356688606	/nfs/dbraw/zinc/68/86/06/356688606.db2.gz	RCSWIXFKNAAHQK-WBMJQRKESA-N	1	1	321.377	1.874	20	5		DDBDMO
CC(C)[C@@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000596066580	356759542	/nfs/dbraw/zinc/75/95/42/356759542.db2.gz	GNFIFLIJFYVVGO-GFCCVEGCSA-N	1	1	310.354	1.464	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000596268993	356838682	/nfs/dbraw/zinc/83/86/82/356838682.db2.gz	PRGRALJEKOAPHZ-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
CCOc1cc(C[NH+]2CCC(NC(N)=O)CC2)ccc1[N+](=O)[O-]	ZINC000276874682	213146647	/nfs/dbraw/zinc/14/66/47/213146647.db2.gz	HZUADOYKLRKGMY-UHFFFAOYSA-N	1	1	322.365	1.626	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000597858578	357361172	/nfs/dbraw/zinc/36/11/72/357361172.db2.gz	NOXNVAOGPGTAPD-LBPRGKRZSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597923778	357383764	/nfs/dbraw/zinc/38/37/64/357383764.db2.gz	POQMNVMFRCGDEP-NSHDSACASA-N	1	1	309.370	1.089	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000598342229	357545039	/nfs/dbraw/zinc/54/50/39/357545039.db2.gz	KVKWQOOGZHPOQW-CYBMUJFWSA-N	1	1	321.377	1.746	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000598343341	357545677	/nfs/dbraw/zinc/54/56/77/357545677.db2.gz	VEHOFCURLGNCHU-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CCC[N@@H+](CC2CC2)C1	ZINC000598561308	357633077	/nfs/dbraw/zinc/63/30/77/357633077.db2.gz	PQCAJDRDFZKVKD-CYBMUJFWSA-N	1	1	321.381	1.030	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599644994	358005109	/nfs/dbraw/zinc/00/51/09/358005109.db2.gz	OGAVPRUOVCDADS-WVSHTKLVSA-N	1	1	321.333	1.157	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@H]2CCC[C@H]21	ZINC000599659046	358012825	/nfs/dbraw/zinc/01/28/25/358012825.db2.gz	OAXNDBFFFKBLNB-MJBXVCDLSA-N	1	1	322.365	1.455	20	5		DDBDMO
COC(=O)c1cnc(N(C)C[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000276712126	213061475	/nfs/dbraw/zinc/06/14/75/213061475.db2.gz	JJYVVRSKWQBJCY-NSHDSACASA-N	1	1	322.365	1.554	20	5		DDBDMO
Cc1cc(NC(=O)NCC[N@H+]2CC[C@H](O)C2)ccc1[N+](=O)[O-]	ZINC000599772475	358054172	/nfs/dbraw/zinc/05/41/72/358054172.db2.gz	RCANJDFDSYHLSC-LBPRGKRZSA-N	1	1	308.338	1.091	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600313105	358193330	/nfs/dbraw/zinc/19/33/30/358193330.db2.gz	HSYQTXBGBBZRPR-NSHDSACASA-N	1	1	323.397	1.732	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ccccc1[N+](=O)[O-])C1CCC1	ZINC000600814435	358322799	/nfs/dbraw/zinc/32/27/99/358322799.db2.gz	GLCZPDHNOLXLSG-UHFFFAOYSA-N	1	1	306.366	1.607	20	5		DDBDMO
COc1ccc(CNC(=O)C[N@@H+](C)C2CCC2)cc1[N+](=O)[O-]	ZINC000600816787	358323610	/nfs/dbraw/zinc/32/36/10/358323610.db2.gz	SEEOZOVVDLCQIJ-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCC3(CO)CCOCC3)c2c1	ZINC000601132265	358415720	/nfs/dbraw/zinc/41/57/20/358415720.db2.gz	DCKGSKWIHRPGGR-UHFFFAOYSA-N	1	1	317.345	1.766	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3COC[C@H]3O)cs2)c1	ZINC000601140176	358418074	/nfs/dbraw/zinc/41/80/74/358418074.db2.gz	VCHGGIJFCHFFNR-QWHCGFSZSA-N	1	1	321.358	1.568	20	5		DDBDMO
C[C@](CO)([NH2+]Cc1cnc2n1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000601148429	358422668	/nfs/dbraw/zinc/42/26/68/358422668.db2.gz	BOUVTFJBKLWGFB-MRXNPFEDSA-N	1	1	316.361	1.735	20	5		DDBDMO
Cn1nnc2c1CC[C@@H](Nc1cc[nH+]c3ccc([N+](=O)[O-])cc13)C2	ZINC000601186830	358439422	/nfs/dbraw/zinc/43/94/22/358439422.db2.gz	CBCVQADFACTVAP-SNVBAGLBSA-N	1	1	324.344	1.663	20	5		DDBDMO
CN(C[C@@H]1COCCO1)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601195014	358442318	/nfs/dbraw/zinc/44/23/18/358442318.db2.gz	ZTHLFYBLSVYEBH-GFCCVEGCSA-N	1	1	303.318	1.995	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1=O	ZINC000601970241	358758908	/nfs/dbraw/zinc/75/89/08/358758908.db2.gz	NFMIIZAHHPQZOI-CQSZACIVSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@@H]1n1ccnc1	ZINC000602482361	359008771	/nfs/dbraw/zinc/00/87/71/359008771.db2.gz	FNZOCNGWIYKYMU-YPMHNXCESA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@@H]1n1ccnc1	ZINC000602482361	359008772	/nfs/dbraw/zinc/00/87/72/359008772.db2.gz	FNZOCNGWIYKYMU-YPMHNXCESA-N	1	1	304.354	1.608	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](CO)c1ccccc1	ZINC000602772813	359179208	/nfs/dbraw/zinc/17/92/08/359179208.db2.gz	KTPUANCEKGVTNH-AWEZNQCLSA-N	1	1	304.350	1.765	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCC[C@@H]1[N@@H+]1CC[C@@H](O)C1	ZINC000602733360	359155243	/nfs/dbraw/zinc/15/52/43/359155243.db2.gz	BGKQDYINYQPCSE-ZACQAIPSSA-N	1	1	319.405	1.981	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN[C@@H]1CCC[C@@H]1[N@H+]1CC[C@@H](O)C1	ZINC000602733360	359155245	/nfs/dbraw/zinc/15/52/45/359155245.db2.gz	BGKQDYINYQPCSE-ZACQAIPSSA-N	1	1	319.405	1.981	20	5		DDBDMO
CC[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1c(C)nn(C)c1C	ZINC000602807565	359204066	/nfs/dbraw/zinc/20/40/66/359204066.db2.gz	BFUYQXNDTZXPIJ-LBPRGKRZSA-N	1	1	306.370	1.920	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@]2(CCOC2)O1	ZINC000602823128	359216852	/nfs/dbraw/zinc/21/68/52/359216852.db2.gz	YUGJCAGSRPPTMG-DZGCQCFKSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1nn(CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603322098	359568196	/nfs/dbraw/zinc/56/81/96/359568196.db2.gz	SVGDLFHDHVMAKA-PHIMTYICSA-N	1	1	319.365	1.757	20	5		DDBDMO
Cc1nn(CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603322098	359568203	/nfs/dbraw/zinc/56/82/03/359568203.db2.gz	SVGDLFHDHVMAKA-PHIMTYICSA-N	1	1	319.365	1.757	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@@H]1O	ZINC000186915321	200030256	/nfs/dbraw/zinc/03/02/56/200030256.db2.gz	NTUAGCVDPLSWLR-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@@H]1O	ZINC000186915321	200030258	/nfs/dbraw/zinc/03/02/58/200030258.db2.gz	NTUAGCVDPLSWLR-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000186879206	200025709	/nfs/dbraw/zinc/02/57/09/200025709.db2.gz	FJBBQDJVHUNRMA-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+]1CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000603428534	359633879	/nfs/dbraw/zinc/63/38/79/359633879.db2.gz	OKMCDSNOJNYIQG-UHFFFAOYSA-N	1	1	306.366	1.830	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000604266912	359731208	/nfs/dbraw/zinc/73/12/08/359731208.db2.gz	NQDZZGWHHYJEFP-UHFFFAOYSA-N	1	1	323.397	1.370	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000188524330	200261865	/nfs/dbraw/zinc/26/18/65/200261865.db2.gz	FKZITVRSUYUZRD-UHFFFAOYSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@]1(O)CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000189071995	200344194	/nfs/dbraw/zinc/34/41/94/200344194.db2.gz	ZOATZZNGEBCZKP-AWEZNQCLSA-N	1	1	311.313	1.519	20	5		DDBDMO
C[C@@H]1C[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000610271196	360404868	/nfs/dbraw/zinc/40/48/68/360404868.db2.gz	JWMXABVBMAZRSW-DGCLKSJQSA-N	1	1	321.377	1.938	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)CN2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000610636252	360487796	/nfs/dbraw/zinc/48/77/96/360487796.db2.gz	CQCXGVGNVCRSIH-CYBMUJFWSA-N	1	1	320.393	1.328	20	5		DDBDMO
Cc1nc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC000610754537	360528104	/nfs/dbraw/zinc/52/81/04/360528104.db2.gz	YEBMANHUYWRSSV-CQSZACIVSA-N	1	1	320.393	1.989	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000619578934	364070796	/nfs/dbraw/zinc/07/07/96/364070796.db2.gz	UZDOEUORQHKZIL-GFCCVEGCSA-N	1	1	306.366	1.855	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000619567162	364063218	/nfs/dbraw/zinc/06/32/18/364063218.db2.gz	XVGGKCDPTSOELF-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000264659467	204060320	/nfs/dbraw/zinc/06/03/20/204060320.db2.gz	QTCDPDQYCHITMO-UHFFFAOYSA-N	1	1	322.365	1.226	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000264731179	204112285	/nfs/dbraw/zinc/11/22/85/204112285.db2.gz	IYRXYMWVFITABX-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000264731179	204112291	/nfs/dbraw/zinc/11/22/91/204112291.db2.gz	IYRXYMWVFITABX-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000264731179	204112295	/nfs/dbraw/zinc/11/22/95/204112295.db2.gz	IYRXYMWVFITABX-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
COc1ccc(C(=O)N2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-]	ZINC000264977015	204319425	/nfs/dbraw/zinc/31/94/25/204319425.db2.gz	ORKVNPWSOUHIMV-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000266105824	205101876	/nfs/dbraw/zinc/10/18/76/205101876.db2.gz	GQLVYCFXFFJJFY-CYBMUJFWSA-N	1	1	323.397	1.514	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[NH+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000338795228	284525945	/nfs/dbraw/zinc/52/59/45/284525945.db2.gz	OMAQOXAJINQAAC-GHMZBOCLSA-N	1	1	322.365	1.614	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000270848150	248693631	/nfs/dbraw/zinc/69/36/31/248693631.db2.gz	GGODDCBHAVZKGY-JMSVASOKSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000270848150	248693636	/nfs/dbraw/zinc/69/36/36/248693636.db2.gz	GGODDCBHAVZKGY-JMSVASOKSA-N	1	1	321.377	1.933	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1c[nH+]ccc1-n1cccn1	ZINC000337633329	249599845	/nfs/dbraw/zinc/59/98/45/249599845.db2.gz	OKBXIVPKZSNNJB-UHFFFAOYSA-N	1	1	313.277	1.011	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C1CCCC1	ZINC000104927948	194053556	/nfs/dbraw/zinc/05/35/56/194053556.db2.gz	HQYIZPWOUBOBJG-UHFFFAOYSA-N	1	1	308.338	1.300	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000338564707	250032753	/nfs/dbraw/zinc/03/27/53/250032753.db2.gz	JMYVMABBGFMYJF-NSHDSACASA-N	1	1	305.334	1.834	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000338564707	250032755	/nfs/dbraw/zinc/03/27/55/250032755.db2.gz	JMYVMABBGFMYJF-NSHDSACASA-N	1	1	305.334	1.834	20	5		DDBDMO
C[C@@H]1CCNC(=O)[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000284739774	218155474	/nfs/dbraw/zinc/15/54/74/218155474.db2.gz	KUCWSWWEFRROMB-PRHODGIISA-N	1	1	308.294	1.117	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000338675399	250085965	/nfs/dbraw/zinc/08/59/65/250085965.db2.gz	DKCBUDMNOYBBCC-UHFFFAOYSA-N	1	1	311.386	1.373	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000284864694	218212703	/nfs/dbraw/zinc/21/27/03/218212703.db2.gz	SHEDHWYPUGOGLT-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285007078	218253602	/nfs/dbraw/zinc/25/36/02/218253602.db2.gz	CUQFTWPTKMWMAR-SNVBAGLBSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000285242592	218348301	/nfs/dbraw/zinc/34/83/01/218348301.db2.gz	YTCZNHNAMAGKDY-OUAUKWLOSA-N	1	1	309.370	1.414	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H]2C[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC000285348371	218391060	/nfs/dbraw/zinc/39/10/60/218391060.db2.gz	LBKNYCZJUHOOAB-KLPPZKSPSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@H]2C[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC000285348371	218391063	/nfs/dbraw/zinc/39/10/63/218391063.db2.gz	LBKNYCZJUHOOAB-KLPPZKSPSA-N	1	1	323.349	1.651	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000109429002	194262854	/nfs/dbraw/zinc/26/28/54/194262854.db2.gz	LIKPIUCJYGJAEN-JTQLQIEISA-N	1	1	321.381	1.485	20	5		DDBDMO
CC[N@H+](CCO)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000120008796	195079551	/nfs/dbraw/zinc/07/95/51/195079551.db2.gz	XQMIFWATMIDKPB-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CCO)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000120008796	195079553	/nfs/dbraw/zinc/07/95/53/195079553.db2.gz	XQMIFWATMIDKPB-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1	ZINC000273000415	210380032	/nfs/dbraw/zinc/38/00/32/210380032.db2.gz	REUVRNAYUIJANC-LBPRGKRZSA-N	1	1	303.362	1.904	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000272994084	210373811	/nfs/dbraw/zinc/37/38/11/210373811.db2.gz	QJPWEGMZMBLCHK-JTQLQIEISA-N	1	1	321.381	1.651	20	5		DDBDMO
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000286510309	219028177	/nfs/dbraw/zinc/02/81/77/219028177.db2.gz	MUPSXNNOVVJIHE-CFAIKTRFSA-N	1	1	318.373	1.983	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1	ZINC000413484308	533100673	/nfs/dbraw/zinc/10/06/73/533100673.db2.gz	ZMFGYOSPRIMQBY-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000352802447	285311195	/nfs/dbraw/zinc/31/11/95/285311195.db2.gz	DVDCZMFZFCWYNN-NHYWBVRUSA-N	1	1	321.352	1.829	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000289883279	221290090	/nfs/dbraw/zinc/29/00/90/221290090.db2.gz	WWLUOOFPPSIGFJ-NSHDSACASA-N	1	1	311.386	1.336	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C[C@H](C)O)C(C)C	ZINC000107043110	407368298	/nfs/dbraw/zinc/36/82/98/407368298.db2.gz	RWWHFUCXUNISPY-LBPRGKRZSA-N	1	1	309.366	1.933	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC000112926043	407448237	/nfs/dbraw/zinc/44/82/37/407448237.db2.gz	DFCRFQKHCCEZLN-UHFFFAOYSA-N	1	1	310.310	1.493	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)CC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000114139110	407545077	/nfs/dbraw/zinc/54/50/77/407545077.db2.gz	GLSYVHXNUDCYSB-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000186841414	407782542	/nfs/dbraw/zinc/78/25/42/407782542.db2.gz	DYUJJIFQGZJDCS-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000267248821	407806797	/nfs/dbraw/zinc/80/67/97/407806797.db2.gz	GFBSVEKXBJOHPB-NEPJUHHUSA-N	1	1	304.350	1.534	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CCN1CC(F)F	ZINC000153588715	407857751	/nfs/dbraw/zinc/85/77/51/407857751.db2.gz	ICTNTRPPDPOREL-LLVKDONJSA-N	1	1	317.340	1.453	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CCN1CC(F)F	ZINC000153588715	407857755	/nfs/dbraw/zinc/85/77/55/407857755.db2.gz	ICTNTRPPDPOREL-LLVKDONJSA-N	1	1	317.340	1.453	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000174534931	407960165	/nfs/dbraw/zinc/96/01/65/407960165.db2.gz	IEHDCIOWMCGJID-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3CC[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000272520983	407962196	/nfs/dbraw/zinc/96/21/96/407962196.db2.gz	PWWGFRJQIGPQFO-CJNGLKHVSA-N	1	1	317.389	1.998	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272534060	407968248	/nfs/dbraw/zinc/96/82/48/407968248.db2.gz	ISKRCRQNZQATHP-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272534060	407968256	/nfs/dbraw/zinc/96/82/56/407968256.db2.gz	ISKRCRQNZQATHP-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000174672430	407975165	/nfs/dbraw/zinc/97/51/65/407975165.db2.gz	NWMDFRFEOYCTFL-NEPJUHHUSA-N	1	1	304.350	1.607	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1ccncc1	ZINC000153906060	407928598	/nfs/dbraw/zinc/92/85/98/407928598.db2.gz	ODUWTTADMDCGNE-HNNXBMFYSA-N	1	1	314.345	1.989	20	5		DDBDMO
C[C@@H](CO)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272476164	407942168	/nfs/dbraw/zinc/94/21/68/407942168.db2.gz	BJBUIBIZNLUJJS-BXUZGUMPSA-N	1	1	304.350	1.636	20	5		DDBDMO
Cn1cc([C@H]2C[NH2+]CCN2C(=O)c2ccc([N+](=O)[O-])cc2)cn1	ZINC000181357471	407985084	/nfs/dbraw/zinc/98/50/84/407985084.db2.gz	QZFHTEZWKOPOEZ-CQSZACIVSA-N	1	1	315.333	1.115	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000175267671	408091455	/nfs/dbraw/zinc/09/14/55/408091455.db2.gz	GKAKQQJNMYBILV-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000136253829	408093317	/nfs/dbraw/zinc/09/33/17/408093317.db2.gz	NLYGOXXKLVNOLB-ZFWWWQNUSA-N	1	1	324.377	1.570	20	5		DDBDMO
CO[C@H]1CCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000246039189	408125940	/nfs/dbraw/zinc/12/59/40/408125940.db2.gz	QTDCVUWOSYGQTH-GJZGRUSLSA-N	1	1	319.361	1.811	20	5		DDBDMO
CO[C@H]1CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000246039189	408125944	/nfs/dbraw/zinc/12/59/44/408125944.db2.gz	QTDCVUWOSYGQTH-GJZGRUSLSA-N	1	1	319.361	1.811	20	5		DDBDMO
CCC[C@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182266324	408111133	/nfs/dbraw/zinc/11/11/33/408111133.db2.gz	QFWBTHHABKBDED-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182266324	408111138	/nfs/dbraw/zinc/11/11/38/408111138.db2.gz	QFWBTHHABKBDED-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1nnc2ccccn21	ZINC000182679398	306706296	/nfs/dbraw/zinc/70/62/96/306706296.db2.gz	OCJYPVFKBDGIFW-SNVBAGLBSA-N	1	1	301.310	1.185	20	5		DDBDMO
CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@@H+](C)C1	ZINC000151105476	408257142	/nfs/dbraw/zinc/25/71/42/408257142.db2.gz	AKIAJQADTDQWAD-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[N@@H+](C)C1	ZINC000151105476	408257152	/nfs/dbraw/zinc/25/71/52/408257152.db2.gz	AKIAJQADTDQWAD-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246311437	408215894	/nfs/dbraw/zinc/21/58/94/408215894.db2.gz	GPYKWJJWLXWZFD-BJJXKVORSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[N@@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@@H](c2ccccc2)C1	ZINC000263934021	408319030	/nfs/dbraw/zinc/31/90/30/408319030.db2.gz	BIXTXNHPBQSVDV-CYBMUJFWSA-N	1	1	314.349	1.460	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@@H](c2ccccc2)C1	ZINC000263934021	408319036	/nfs/dbraw/zinc/31/90/36/408319036.db2.gz	BIXTXNHPBQSVDV-CYBMUJFWSA-N	1	1	314.349	1.460	20	5		DDBDMO
CCC(CC)[C@@H](CNc1ncc([N+](=O)[O-])cn1)[NH+]1CCOCC1	ZINC000273644836	408275628	/nfs/dbraw/zinc/27/56/28/408275628.db2.gz	SVKXTEZOMOQCCI-CQSZACIVSA-N	1	1	323.397	1.934	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)n1	ZINC000134893601	162089800	/nfs/dbraw/zinc/08/98/00/162089800.db2.gz	IPUKQCNMPHFQGS-UKRRQHHQSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)n1	ZINC000134893601	162089813	/nfs/dbraw/zinc/08/98/13/162089813.db2.gz	IPUKQCNMPHFQGS-UKRRQHHQSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H]3[C@H](CCCN3C3CC3)C2)n1	ZINC000134893601	162089817	/nfs/dbraw/zinc/08/98/17/162089817.db2.gz	IPUKQCNMPHFQGS-UKRRQHHQSA-N	1	1	319.409	1.740	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000183202377	408352850	/nfs/dbraw/zinc/35/28/50/408352850.db2.gz	UVHSEDUHHAFEIX-MNOVXSKESA-N	1	1	308.334	1.664	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@H](C)O	ZINC000246824872	408346649	/nfs/dbraw/zinc/34/66/49/408346649.db2.gz	LNEYDDZGKZERDH-GXTWGEPZSA-N	1	1	321.377	1.512	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000246907625	408364261	/nfs/dbraw/zinc/36/42/61/408364261.db2.gz	ROTUHNCMSRZPLI-SWLSCSKDSA-N	1	1	321.377	1.650	20	5		DDBDMO
Nc1cc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)ccn1	ZINC000191421968	408421404	/nfs/dbraw/zinc/42/14/04/408421404.db2.gz	IIWNDNLWXVIBRB-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
C[N@@H+](CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000264823087	408547510	/nfs/dbraw/zinc/54/75/10/408547510.db2.gz	HRKHUMNYGPVTJM-UHFFFAOYSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177198746	408549056	/nfs/dbraw/zinc/54/90/56/408549056.db2.gz	SKEKEJPYNHMTPE-NWDGAFQWSA-N	1	1	319.361	1.715	20	5		DDBDMO
CCOCC[N@@H+](CC)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000264579254	408539808	/nfs/dbraw/zinc/53/98/08/408539808.db2.gz	JFEHPWVBFJPQJM-CQSZACIVSA-N	1	1	312.366	1.693	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)n1	ZINC000161501042	408610039	/nfs/dbraw/zinc/61/00/39/408610039.db2.gz	JNAMRLORYDKJSZ-LLVKDONJSA-N	1	1	322.287	1.427	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000248662445	408611291	/nfs/dbraw/zinc/61/12/91/408611291.db2.gz	GWUPJDYTQFRAKD-QWRGUYRKSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000248662445	408611297	/nfs/dbraw/zinc/61/12/97/408611297.db2.gz	GWUPJDYTQFRAKD-QWRGUYRKSA-N	1	1	311.386	1.011	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)[C@H]1CO	ZINC000248919311	408661040	/nfs/dbraw/zinc/66/10/40/408661040.db2.gz	KMNGYYFUMPTGDA-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)C(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000270913439	408739576	/nfs/dbraw/zinc/73/95/76/408739576.db2.gz	HRZFPSPFSRRXKL-LBPRGKRZSA-N	1	1	319.361	1.452	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCO)C3CCC3)o2)cc1	ZINC000275788917	408677851	/nfs/dbraw/zinc/67/78/51/408677851.db2.gz	DLCPCVQPFXPHRO-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CCO)C3CCC3)o2)cc1	ZINC000275788917	408677856	/nfs/dbraw/zinc/67/78/56/408677856.db2.gz	DLCPCVQPFXPHRO-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=C(C[N@@H+](CCO)C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000275834519	408692119	/nfs/dbraw/zinc/69/21/19/408692119.db2.gz	MPWLDHGQQAWKTA-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@H+](CCO)C1CCC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000275834519	408692122	/nfs/dbraw/zinc/69/21/22/408692122.db2.gz	MPWLDHGQQAWKTA-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)[C@H]2C1	ZINC000276337650	408838107	/nfs/dbraw/zinc/83/81/07/408838107.db2.gz	HOPWYXVSVWSKNP-HZMBPMFUSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H](C)OC	ZINC000291361921	408864814	/nfs/dbraw/zinc/86/48/14/408864814.db2.gz	YXONXBDZDRNTPH-GFCCVEGCSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H](C)OC	ZINC000291361921	408864817	/nfs/dbraw/zinc/86/48/17/408864817.db2.gz	YXONXBDZDRNTPH-GFCCVEGCSA-N	1	1	321.377	1.841	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000286012231	408906953	/nfs/dbraw/zinc/90/69/53/408906953.db2.gz	QLWVXVHIEUYGGF-HONMWMINSA-N	1	1	304.350	1.754	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000286012231	408906956	/nfs/dbraw/zinc/90/69/56/408906956.db2.gz	QLWVXVHIEUYGGF-HONMWMINSA-N	1	1	304.350	1.754	20	5		DDBDMO
C[C@@H]1C[N@@H+](C2CCN(c3ncc([N+](=O)[O-])s3)CC2)CCO1	ZINC000190319531	163135766	/nfs/dbraw/zinc/13/57/66/163135766.db2.gz	KEWPAASJZNEZGU-SNVBAGLBSA-N	1	1	312.395	1.741	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])s3)CC2)CCO1	ZINC000190319531	163135768	/nfs/dbraw/zinc/13/57/68/163135768.db2.gz	KEWPAASJZNEZGU-SNVBAGLBSA-N	1	1	312.395	1.741	20	5		DDBDMO
C[N@H+]1CCN(CCNC(=O)c2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000281872231	408944917	/nfs/dbraw/zinc/94/49/17/408944917.db2.gz	WJOGMIQPKBERTI-UHFFFAOYSA-N	1	1	320.393	1.351	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)c1c([N+](=O)[O-])ncn1C	ZINC000286256912	408950915	/nfs/dbraw/zinc/95/09/15/408950915.db2.gz	DVHSDNKEQLQEGB-UHFFFAOYSA-N	1	1	307.354	1.880	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1c2ccccc2ncc1[N+](=O)[O-]	ZINC000292005910	408962137	/nfs/dbraw/zinc/96/21/37/408962137.db2.gz	RSKOLPSAYMEGEH-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H](O)CC2)c1	ZINC000293288059	409083298	/nfs/dbraw/zinc/08/32/98/409083298.db2.gz	VURYUIXGWSLYMN-UONOGXRCSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000283084310	409084499	/nfs/dbraw/zinc/08/44/99/409084499.db2.gz	KXSMVAUZRHYZNT-LBPRGKRZSA-N	1	1	307.325	1.931	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000283084310	409084502	/nfs/dbraw/zinc/08/45/02/409084502.db2.gz	KXSMVAUZRHYZNT-LBPRGKRZSA-N	1	1	307.325	1.931	20	5		DDBDMO
C[C@@H]1[C@@H](O)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106478	409323293	/nfs/dbraw/zinc/32/32/93/409323293.db2.gz	VODZDWMWYRMMNU-YGRLFVJLSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H]1[C@@H](O)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106478	409323298	/nfs/dbraw/zinc/32/32/98/409323298.db2.gz	VODZDWMWYRMMNU-YGRLFVJLSA-N	1	1	308.334	1.807	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[NH+](C3CC3)CC2)ccc1[N+](=O)[O-]	ZINC000280591115	409370993	/nfs/dbraw/zinc/37/09/93/409370993.db2.gz	QHRRNKKZGRQPCR-UHFFFAOYSA-N	1	1	319.361	1.589	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000295216440	409381028	/nfs/dbraw/zinc/38/10/28/409381028.db2.gz	MEGOFCDELPGWQX-OAHLLOKOSA-N	1	1	309.341	1.687	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000285380475	409421671	/nfs/dbraw/zinc/42/16/71/409421671.db2.gz	WLXVHSFMWGBZFQ-UONOGXRCSA-N	1	1	305.334	1.140	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCO)CC1	ZINC000317680376	164029054	/nfs/dbraw/zinc/02/90/54/164029054.db2.gz	HKFYDOOEERMTQD-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3csc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000285592920	409502937	/nfs/dbraw/zinc/50/29/37/409502937.db2.gz	CALDFNMWFSPXNF-GHMZBOCLSA-N	1	1	311.363	1.201	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000354008303	409596198	/nfs/dbraw/zinc/59/61/98/409596198.db2.gz	SCCRHAYUKZANOH-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000345167195	409652263	/nfs/dbraw/zinc/65/22/63/409652263.db2.gz	XVMKPUBDQJDZCV-NWDGAFQWSA-N	1	1	320.393	1.873	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000354117691	409671896	/nfs/dbraw/zinc/67/18/96/409671896.db2.gz	HJPSVXRXXCGWQL-LLVKDONJSA-N	1	1	320.349	1.263	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000354117691	409671907	/nfs/dbraw/zinc/67/19/07/409671907.db2.gz	HJPSVXRXXCGWQL-LLVKDONJSA-N	1	1	320.349	1.263	20	5		DDBDMO
COc1cc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)ccc1[N+](=O)[O-]	ZINC000297142115	409822737	/nfs/dbraw/zinc/82/27/37/409822737.db2.gz	UVRSKHGFGXEAPP-YHWZYXNKSA-N	1	1	319.361	1.958	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000354441787	409860366	/nfs/dbraw/zinc/86/03/66/409860366.db2.gz	WXDPGXVXYTWESE-NEPJUHHUSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)C1	ZINC000346229196	409871233	/nfs/dbraw/zinc/87/12/33/409871233.db2.gz	ROXQSCVDGWXFEA-TUAOUCFPSA-N	1	1	307.350	1.990	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1(C)C	ZINC000319041393	409885235	/nfs/dbraw/zinc/88/52/35/409885235.db2.gz	IBXNNQPLFFYWAN-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1(C)C	ZINC000319041393	409885240	/nfs/dbraw/zinc/88/52/40/409885240.db2.gz	IBXNNQPLFFYWAN-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)CCN12	ZINC000346490416	409988861	/nfs/dbraw/zinc/98/88/61/409988861.db2.gz	PKAULCXZMRVPSE-CYBMUJFWSA-N	1	1	305.334	1.280	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CCN12	ZINC000346490416	409988866	/nfs/dbraw/zinc/98/88/66/409988866.db2.gz	PKAULCXZMRVPSE-CYBMUJFWSA-N	1	1	305.334	1.280	20	5		DDBDMO
C[C@H]1[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@@H+]1C	ZINC000354548072	409929925	/nfs/dbraw/zinc/92/99/25/409929925.db2.gz	RRUWPZCROHOOCK-GXFFZTMASA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000354548072	409929931	/nfs/dbraw/zinc/92/99/31/409929931.db2.gz	RRUWPZCROHOOCK-GXFFZTMASA-N	1	1	313.379	1.356	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C	ZINC000298038396	410087825	/nfs/dbraw/zinc/08/78/25/410087825.db2.gz	GMIGIUUWSBORGX-UHFFFAOYSA-N	1	1	322.365	1.218	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC[C@@H](C)C1	ZINC000332355524	410087876	/nfs/dbraw/zinc/08/78/76/410087876.db2.gz	PVAOXFIMSDRNFB-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCOC[C@@H](C)C1	ZINC000332355524	410087881	/nfs/dbraw/zinc/08/78/81/410087881.db2.gz	PVAOXFIMSDRNFB-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
COc1cc(C[N@@H+](C)C2(CCO)CCOCC2)ccc1[N+](=O)[O-]	ZINC000355012546	410239049	/nfs/dbraw/zinc/23/90/49/410239049.db2.gz	MVKQWOIJJVVIQE-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)[C@@H](O)C1	ZINC000351776428	410225944	/nfs/dbraw/zinc/22/59/44/410225944.db2.gz	BAXXJDIMACJHPG-MFKMUULPSA-N	1	1	323.349	1.245	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2cccnc2)c1	ZINC000346999103	410298633	/nfs/dbraw/zinc/29/86/33/410298633.db2.gz	PCXYUSDBCOKDFI-HUUCEWRRSA-N	1	1	317.349	1.384	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CCC[N@H+]1C	ZINC000343437272	410452349	/nfs/dbraw/zinc/45/23/49/410452349.db2.gz	KYKOCKJMZVDLRB-HZMBPMFUSA-N	1	1	309.341	1.875	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000298882099	410436047	/nfs/dbraw/zinc/43/60/47/410436047.db2.gz	QEPKVCXGBSXHEK-UHFFFAOYSA-N	1	1	314.345	1.711	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2ccccc2C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000298882099	410436053	/nfs/dbraw/zinc/43/60/53/410436053.db2.gz	QEPKVCXGBSXHEK-UHFFFAOYSA-N	1	1	314.345	1.711	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])n[nH]1)CCC(F)(F)F	ZINC000355322049	410442073	/nfs/dbraw/zinc/44/20/73/410442073.db2.gz	UYFLUGDQRHWEAL-UHFFFAOYSA-N	1	1	323.275	1.322	20	5		DDBDMO
CS(=O)(=O)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCC1	ZINC000355415454	410501745	/nfs/dbraw/zinc/50/17/45/410501745.db2.gz	PWWOUTCBHNDGML-UHFFFAOYSA-N	1	1	316.354	1.791	20	5		DDBDMO
Cc1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)cn2cc[nH+]c12	ZINC000355422538	410505797	/nfs/dbraw/zinc/50/57/97/410505797.db2.gz	AQNBGFFXAKKMKT-UHFFFAOYSA-N	1	1	300.278	1.386	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2N)CC1	ZINC000355547726	410573337	/nfs/dbraw/zinc/57/33/37/410573337.db2.gz	QCGANYGEESEOIU-UHFFFAOYSA-N	1	1	304.350	1.559	20	5		DDBDMO
O=C(CC[N@@H+]1CCn2ncnc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000352272423	410591210	/nfs/dbraw/zinc/59/12/10/410591210.db2.gz	DSSOISYBRDONGR-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(CC[N@H+]1CCn2ncnc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000352272423	410591213	/nfs/dbraw/zinc/59/12/13/410591213.db2.gz	DSSOISYBRDONGR-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CCC[C@@H]2CO)cc1[N+](=O)[O-]	ZINC000355595389	410598872	/nfs/dbraw/zinc/59/88/72/410598872.db2.gz	HAKOXHIFFBCXNF-GFCCVEGCSA-N	1	1	324.333	1.103	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H](C)O	ZINC000352224155	410562799	/nfs/dbraw/zinc/56/27/99/410562799.db2.gz	ZGONITMWYMWADH-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
O=C(CC[N@@H+]1CCn2ncnc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000337303231	410701252	/nfs/dbraw/zinc/70/12/52/410701252.db2.gz	QIXXKAVKQFSVAK-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(CC[N@H+]1CCn2ncnc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000337303231	410701258	/nfs/dbraw/zinc/70/12/58/410701258.db2.gz	QIXXKAVKQFSVAK-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
C[C@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1	ZINC000330560763	410777605	/nfs/dbraw/zinc/77/76/05/410777605.db2.gz	HVPLTSJTTGJUNV-WDEREUQCSA-N	1	1	309.370	1.179	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330581324	410796620	/nfs/dbraw/zinc/79/66/20/410796620.db2.gz	JBGSCRZQYMPNPB-VXGBXAGGSA-N	1	1	305.378	1.997	20	5		DDBDMO
C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1(CO)CC1	ZINC000353143352	410807064	/nfs/dbraw/zinc/80/70/64/410807064.db2.gz	HMSQHUJWRHOGJJ-UHFFFAOYSA-N	1	1	321.333	1.350	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000330612441	410825987	/nfs/dbraw/zinc/82/59/87/410825987.db2.gz	QVYINUJPTYCPJK-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000330647655	410847155	/nfs/dbraw/zinc/84/71/55/410847155.db2.gz	ZRWQHQLOOIBENL-NEPJUHHUSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000330659110	410857069	/nfs/dbraw/zinc/85/70/69/410857069.db2.gz	AEWXKEWCSPLNEZ-LLVKDONJSA-N	1	1	309.391	1.849	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000330659110	410857077	/nfs/dbraw/zinc/85/70/77/410857077.db2.gz	AEWXKEWCSPLNEZ-LLVKDONJSA-N	1	1	309.391	1.849	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@@H+]1CCOC	ZINC000330851341	410900598	/nfs/dbraw/zinc/90/05/98/410900598.db2.gz	QCILZEPHOVAINV-LLVKDONJSA-N	1	1	310.354	1.106	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1CCOC	ZINC000330851341	410900603	/nfs/dbraw/zinc/90/06/03/410900603.db2.gz	QCILZEPHOVAINV-LLVKDONJSA-N	1	1	310.354	1.106	20	5		DDBDMO
C[C@@H]1C[C@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000353580633	411073037	/nfs/dbraw/zinc/07/30/37/411073037.db2.gz	IQFZFLPGDNRFQS-CHWSQXEVSA-N	1	1	320.393	1.853	20	5		DDBDMO
NC(=O)[C@H]1CN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC[NH2+]1	ZINC000341416832	411042317	/nfs/dbraw/zinc/04/23/17/411042317.db2.gz	IZFBNNMUIDIYRB-MRVPVSSYSA-N	1	1	319.148	1.165	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356654411	411117628	/nfs/dbraw/zinc/11/76/28/411117628.db2.gz	LNOGJJCWYFLLEN-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356654411	411117630	/nfs/dbraw/zinc/11/76/30/411117630.db2.gz	LNOGJJCWYFLLEN-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cnn1C	ZINC000353727400	411118558	/nfs/dbraw/zinc/11/85/58/411118558.db2.gz	ZNSGQIXYOJSAFM-ZDUSSCGKSA-N	1	1	316.365	1.718	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000516314132	416721685	/nfs/dbraw/zinc/72/16/85/416721685.db2.gz	XHVVEDRPFPUWRR-ZJUUUORDSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000516314132	416721689	/nfs/dbraw/zinc/72/16/89/416721689.db2.gz	XHVVEDRPFPUWRR-ZJUUUORDSA-N	1	1	307.354	1.196	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@@H](c3[nH+]ccn3C)C2)c1[N+](=O)[O-]	ZINC000360808681	418523540	/nfs/dbraw/zinc/52/35/40/418523540.db2.gz	AZAQPKCYALBNGW-SNVBAGLBSA-N	1	1	304.354	1.618	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C[C@H](C)O)C[C@H]1C	ZINC000361006285	418563861	/nfs/dbraw/zinc/56/38/61/418563861.db2.gz	CHBKAXGVKDLERS-MNOVXSKESA-N	1	1	311.386	1.011	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@H](O)c3ccccc3C2)c1	ZINC000368224470	418706489	/nfs/dbraw/zinc/70/64/89/418706489.db2.gz	UHJFAIAKTIKXIE-OAHLLOKOSA-N	1	1	302.334	1.731	20	5		DDBDMO
Cc1ccc2c(c1)CC[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000361848651	418718431	/nfs/dbraw/zinc/71/84/31/418718431.db2.gz	AZLXRUAORUQNAY-MRXNPFEDSA-N	1	1	316.361	1.519	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1CO	ZINC000362067898	418747505	/nfs/dbraw/zinc/74/75/05/418747505.db2.gz	RHVBBMQRZZTPEB-ZYHUDNBSSA-N	1	1	318.333	1.705	20	5		DDBDMO
C[C@@H](CO)[N@@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000364934836	418825120	/nfs/dbraw/zinc/82/51/20/418825120.db2.gz	OTILEFRGRGKQOD-JTQLQIEISA-N	1	1	313.379	1.185	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000364934836	418825121	/nfs/dbraw/zinc/82/51/21/418825121.db2.gz	OTILEFRGRGKQOD-JTQLQIEISA-N	1	1	313.379	1.185	20	5		DDBDMO
CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])C[NH+](Cc2ccccc2)C1	ZINC000365564746	418876608	/nfs/dbraw/zinc/87/66/08/418876608.db2.gz	NQUKJWWCAIJFKQ-KGLIPLIRSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C1CCCN1C[C@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000365833394	418914392	/nfs/dbraw/zinc/91/43/92/418914392.db2.gz	FSSZVOCZGFZNQM-CYBMUJFWSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@H+]1C1CC1	ZINC000426996320	419577718	/nfs/dbraw/zinc/57/77/18/419577718.db2.gz	ZHQCRMQLSDOWCQ-OAHLLOKOSA-N	1	1	303.362	1.880	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](CC)[C@@H](C)C2)n1	ZINC000427844432	419751565	/nfs/dbraw/zinc/75/15/65/419751565.db2.gz	CUKBEFAKMNOQFE-NWDGAFQWSA-N	1	1	323.397	1.756	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C)C1	ZINC000429027299	419963012	/nfs/dbraw/zinc/96/30/12/419963012.db2.gz	DRMGBCUDPQHEQX-MGPQQGTHSA-N	1	1	307.398	1.453	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420588026	420324486	/nfs/dbraw/zinc/32/44/86/420324486.db2.gz	QSOFGUKUWKYUSG-UHFFFAOYSA-N	1	1	310.354	1.074	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CCC[N@@H+](CCCO)C1	ZINC000450619110	420499619	/nfs/dbraw/zinc/49/96/19/420499619.db2.gz	UJAOLWPIBIHIGE-LBPRGKRZSA-N	1	1	311.386	1.378	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000457052135	420596966	/nfs/dbraw/zinc/59/69/66/420596966.db2.gz	ILXRGGVRTLOKSZ-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000457054865	420597799	/nfs/dbraw/zinc/59/77/99/420597799.db2.gz	MBWJLSCROORSOK-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@H](CC[NH3+])C1	ZINC000443078019	420743410	/nfs/dbraw/zinc/74/34/10/420743410.db2.gz	VVVDAVACYRRMRL-CHWSQXEVSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000493153806	420772108	/nfs/dbraw/zinc/77/21/08/420772108.db2.gz	LMGYJRCGKBGZQI-XHPSBEMXSA-N	1	1	307.325	1.768	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H](C[NH3+])C[C@H]2C)c([N+](=O)[O-])c1	ZINC000442762641	420710092	/nfs/dbraw/zinc/71/00/92/420710092.db2.gz	CHMFMQNCAHBPMN-VXGBXAGGSA-N	1	1	309.366	1.651	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C\c3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000493514359	420869726	/nfs/dbraw/zinc/86/97/26/420869726.db2.gz	HIUKNSOIEMBULV-YOQOKRQFSA-N	1	1	301.346	1.628	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCCCC1	ZINC000449095512	420947955	/nfs/dbraw/zinc/94/79/55/420947955.db2.gz	ZBGKHKQLOLBYHY-GOEBONIOSA-N	1	1	321.421	1.962	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000456342928	421145656	/nfs/dbraw/zinc/14/56/56/421145656.db2.gz	GFBRLGPRYXDJKX-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000496973502	421345098	/nfs/dbraw/zinc/34/50/98/421345098.db2.gz	JQVMYKXLTXAPDV-GFCCVEGCSA-N	1	1	323.349	1.876	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000496973502	421345102	/nfs/dbraw/zinc/34/51/02/421345102.db2.gz	JQVMYKXLTXAPDV-GFCCVEGCSA-N	1	1	323.349	1.876	20	5		DDBDMO
COc1c(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000527245581	421369480	/nfs/dbraw/zinc/36/94/80/421369480.db2.gz	VHMZTUXBQIELQR-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CCC(=O)N1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000515745923	421515520	/nfs/dbraw/zinc/51/55/20/421515520.db2.gz	YLKSKCWIQZMVNO-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000515745923	421515521	/nfs/dbraw/zinc/51/55/21/421515521.db2.gz	YLKSKCWIQZMVNO-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
CNc1nccc(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000566923425	421610087	/nfs/dbraw/zinc/61/00/87/421610087.db2.gz	IAPSDPPAUXJFHE-NSHDSACASA-N	1	1	321.381	1.634	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H](C)C[N@@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000519041593	421677129	/nfs/dbraw/zinc/67/71/29/421677129.db2.gz	ZSDIMKXQFQKWIE-LBPRGKRZSA-N	1	1	323.393	1.991	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)C1CCCCC1	ZINC000519068934	421678338	/nfs/dbraw/zinc/67/83/38/421678338.db2.gz	HXLZIOWEANQNOY-UHFFFAOYSA-N	1	1	308.382	1.928	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@H](C)C1	ZINC000557526597	421774401	/nfs/dbraw/zinc/77/44/01/421774401.db2.gz	DQISNBKQKLVHFG-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@H](C)C1	ZINC000557526597	421774405	/nfs/dbraw/zinc/77/44/05/421774405.db2.gz	DQISNBKQKLVHFG-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000583908102	422214810	/nfs/dbraw/zinc/21/48/10/422214810.db2.gz	PQPNPDDMFYFZAG-SNVBAGLBSA-N	1	1	323.349	1.782	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C	ZINC000341577687	271126668	/nfs/dbraw/zinc/12/66/68/271126668.db2.gz	RYVFUWJXDHBKGM-KGLIPLIRSA-N	1	1	322.409	1.561	20	5		DDBDMO
CC(=O)[C@@H](NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000342283348	271366175	/nfs/dbraw/zinc/36/61/75/271366175.db2.gz	QVXIHJKLOCDFST-BZNIZROVSA-N	1	1	321.377	1.975	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000345308426	272215878	/nfs/dbraw/zinc/21/58/78/272215878.db2.gz	WZBOILMMRLHXGD-ZJUUUORDSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000346053867	272399953	/nfs/dbraw/zinc/39/99/53/272399953.db2.gz	UJAWROYQPHOHLL-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3c(C(N)=O)cccc3[N+](=O)[O-])C2)C1	ZINC000420645861	277072529	/nfs/dbraw/zinc/07/25/29/277072529.db2.gz	ZMHJPEYGBHLERZ-MRXNPFEDSA-N	1	1	318.377	1.616	20	5		DDBDMO
C[C@H]1C[NH2+]CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000054371058	279908478	/nfs/dbraw/zinc/90/84/78/279908478.db2.gz	BWBFMPPQXFCXJI-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CC3(O)CCOCC3)C2)nc1	ZINC000122284013	281153795	/nfs/dbraw/zinc/15/37/95/281153795.db2.gz	KDAXKWINGSMUPZ-GFCCVEGCSA-N	1	1	322.365	1.018	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246745549	282011947	/nfs/dbraw/zinc/01/19/47/282011947.db2.gz	PTXFMOQIANTXKX-KCQAQPDRSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362096547	300004181	/nfs/dbraw/zinc/00/41/81/300004181.db2.gz	MWQTVAKGOCOSDS-IJLUTSLNSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C[C@@H]21	ZINC000362290459	300045100	/nfs/dbraw/zinc/04/51/00/300045100.db2.gz	RVCCBSIBDURWLK-MFKMUULPSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000362444039	300064619	/nfs/dbraw/zinc/06/46/19/300064619.db2.gz	BRXQEAZRXZLQIJ-FZMZJTMJSA-N	1	1	306.366	1.321	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363616938	300288095	/nfs/dbraw/zinc/28/80/95/300288095.db2.gz	YRKJPJBDRCESJV-CABCVRRESA-N	1	1	321.352	1.572	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])cn1	ZINC000363874436	300319712	/nfs/dbraw/zinc/31/97/12/300319712.db2.gz	JESNGQPTZPVPSG-LLVKDONJSA-N	1	1	304.350	1.737	20	5		DDBDMO
O=C(CC[NH+]1CC(O)(C2CC2)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000365711913	300565804	/nfs/dbraw/zinc/56/58/04/300565804.db2.gz	LYVHOUYFFQZGAI-UHFFFAOYSA-N	1	1	323.324	1.519	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000368579787	301056467	/nfs/dbraw/zinc/05/64/67/301056467.db2.gz	UIIKPGDLXUFWMH-MNOVXSKESA-N	1	1	320.349	1.119	20	5		DDBDMO
COc1ccc(CN2CCC[N@H+]([C@@H](C)CO)CC2)cc1[N+](=O)[O-]	ZINC000368953016	301109342	/nfs/dbraw/zinc/10/93/42/301109342.db2.gz	ZGYQZQFTUINXQY-ZDUSSCGKSA-N	1	1	323.393	1.492	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000368957645	301109981	/nfs/dbraw/zinc/10/99/81/301109981.db2.gz	FAFWREAWUAHILJ-DFBGVHRSSA-N	1	1	319.361	1.559	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCO[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])c1	ZINC000369473837	301189529	/nfs/dbraw/zinc/18/95/29/301189529.db2.gz	UFPJXCZFQYOQHD-DZGCQCFKSA-N	1	1	319.361	1.837	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H]3OCC[N@H+](C)[C@@H]3C2)n1	ZINC000408025349	301204831	/nfs/dbraw/zinc/20/48/31/301204831.db2.gz	BCEFJGYNIBODNU-OLZOCXBDSA-N	1	1	306.366	1.516	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1c(N)cccc1[N+](=O)[O-])CC2	ZINC000376829089	302109665	/nfs/dbraw/zinc/10/96/65/302109665.db2.gz	RPKPEZVSFQFNRQ-UHFFFAOYSA-N	1	1	318.377	1.877	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000377362857	302172744	/nfs/dbraw/zinc/17/27/44/302172744.db2.gz	QSSHTEFZDMSRPO-NXEZZACHSA-N	1	1	305.338	1.127	20	5		DDBDMO
Cc1cnc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000266213274	302363537	/nfs/dbraw/zinc/36/35/37/302363537.db2.gz	NOYSATCSJBRHAJ-HNNXBMFYSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367785151	307104232	/nfs/dbraw/zinc/10/42/32/307104232.db2.gz	WGLWHWVAZDVHBT-OLRMPSLUSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367785151	307104233	/nfs/dbraw/zinc/10/42/33/307104233.db2.gz	WGLWHWVAZDVHBT-OLRMPSLUSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000371440808	307149769	/nfs/dbraw/zinc/14/97/69/307149769.db2.gz	UIFZCKVGGOWFDQ-GXTWGEPZSA-N	1	1	308.382	1.664	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000371659989	307155572	/nfs/dbraw/zinc/15/55/72/307155572.db2.gz	KIQXWXCHRLSYGX-UNQGMJICSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000371659989	307155573	/nfs/dbraw/zinc/15/55/73/307155573.db2.gz	KIQXWXCHRLSYGX-UNQGMJICSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000371659989	307155574	/nfs/dbraw/zinc/15/55/74/307155574.db2.gz	KIQXWXCHRLSYGX-UNQGMJICSA-N	1	1	318.377	1.073	20	5		DDBDMO
Cc1ccc(CNC(=O)C[NH+]2CCC(CO)CC2)cc1[N+](=O)[O-]	ZINC001120686451	782093578	/nfs/dbraw/zinc/09/35/78/782093578.db2.gz	SPFUPLXLCJQMDK-UHFFFAOYSA-N	1	1	321.377	1.224	20	5		DDBDMO
C[C@H]1COCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000331926358	534024654	/nfs/dbraw/zinc/02/46/54/534024654.db2.gz	CUZOQUDSTBRKHI-TZMCWYRMSA-N	1	1	310.350	1.303	20	5		DDBDMO
COc1cc(C(=O)N2CC[NH+](C(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000159889925	522081803	/nfs/dbraw/zinc/08/18/03/522081803.db2.gz	NIQNIKQPWRYGDI-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ccc([N+](=O)[O-])nc2)CC1	ZINC000450475974	534792210	/nfs/dbraw/zinc/79/22/10/534792210.db2.gz	LXGYBSGLTSBRSR-UHFFFAOYSA-N	1	1	302.338	1.804	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000459478307	527930447	/nfs/dbraw/zinc/93/04/47/527930447.db2.gz	MZXGJZARRJVXGU-BETUJISGSA-N	1	1	308.382	1.171	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000458182401	527999705	/nfs/dbraw/zinc/99/97/05/527999705.db2.gz	DWBJNCARIAEUDQ-NSHDSACASA-N	1	1	323.397	1.903	20	5		DDBDMO
CC1(C)CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000302555002	529129012	/nfs/dbraw/zinc/12/90/12/529129012.db2.gz	ROFPMEMCQMOIBH-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
CC1(C)CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302555002	529129015	/nfs/dbraw/zinc/12/90/15/529129015.db2.gz	ROFPMEMCQMOIBH-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000121798539	696716053	/nfs/dbraw/zinc/71/60/53/696716053.db2.gz	IAZKDCPELGKGNY-BETUJISGSA-N	1	1	321.377	1.776	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000121798539	696716055	/nfs/dbraw/zinc/71/60/55/696716055.db2.gz	IAZKDCPELGKGNY-BETUJISGSA-N	1	1	321.377	1.776	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119720565	696684495	/nfs/dbraw/zinc/68/44/95/696684495.db2.gz	PPRQOBCDFANQAY-VIFPVBQESA-N	1	1	321.424	1.665	20	5		DDBDMO
CCC1(O)CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1	ZINC000749958635	700194840	/nfs/dbraw/zinc/19/48/40/700194840.db2.gz	FHVDBXHSRMTMJM-UHFFFAOYSA-N	1	1	319.365	1.842	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776590326	698123857	/nfs/dbraw/zinc/12/38/57/698123857.db2.gz	ZNRKORDBTXXAMA-CZUORRHYSA-N	1	1	324.377	1.613	20	5		DDBDMO
O=C1OCC[C@@H]1CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246983624	698359005	/nfs/dbraw/zinc/35/90/05/698359005.db2.gz	QAGWSUMBXJLCBW-RYUDHWBXSA-N	1	1	320.349	1.429	20	5		DDBDMO
Cn1ccnc1[C@H](N[C@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000780764749	698558458	/nfs/dbraw/zinc/55/84/58/698558458.db2.gz	PVXHBMAJFBIZAR-DZGCQCFKSA-N	1	1	315.377	1.711	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1C[C@@H](CO)[C@H](CO)C1	ZINC000705390351	699241046	/nfs/dbraw/zinc/24/10/46/699241046.db2.gz	YGXTYNPPNQVBGE-QWRGUYRKSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1	ZINC000787886485	699251364	/nfs/dbraw/zinc/25/13/64/699251364.db2.gz	NPPSVXIKBBKFRK-UHFFFAOYSA-N	1	1	318.293	1.553	20	5		DDBDMO
COc1cc(C[NH2+]C[C@H](OC)C(F)(F)F)c([N+](=O)[O-])cc1O	ZINC000733330429	699588920	/nfs/dbraw/zinc/58/89/20/699588920.db2.gz	ZDQDPNOOQRATDP-NSHDSACASA-N	1	1	324.255	1.976	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000757643439	700667261	/nfs/dbraw/zinc/66/72/61/700667261.db2.gz	RLQRXNODJSVCMK-OAHLLOKOSA-N	1	1	303.362	1.964	20	5		DDBDMO
O=[N+]([O-])c1cc(S(=O)(=O)N[C@H]2CC[N@@H+](C3CC3)C2)cs1	ZINC000768810764	701205075	/nfs/dbraw/zinc/20/50/75/701205075.db2.gz	MMGXRGIYPOKGPI-QMMMGPOBSA-N	1	1	317.392	1.171	20	5		DDBDMO
O=[N+]([O-])c1cc(S(=O)(=O)N[C@H]2CC[N@H+](C3CC3)C2)cs1	ZINC000768810764	701205079	/nfs/dbraw/zinc/20/50/79/701205079.db2.gz	MMGXRGIYPOKGPI-QMMMGPOBSA-N	1	1	317.392	1.171	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000770474573	701279562	/nfs/dbraw/zinc/27/95/62/701279562.db2.gz	BOTKENIWKLUAQB-GHMZBOCLSA-N	1	1	305.338	1.374	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000770474573	701279563	/nfs/dbraw/zinc/27/95/63/701279563.db2.gz	BOTKENIWKLUAQB-GHMZBOCLSA-N	1	1	305.338	1.374	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]2[C@@H](O)c2ccccc2)n1	ZINC000879244226	706627198	/nfs/dbraw/zinc/62/71/98/706627198.db2.gz	PHSWNPLSDZTMLH-ZBFHGGJFSA-N	1	1	316.361	1.989	20	5		DDBDMO
CC(C)(C[NH+]1CCOCC1)Nc1nc2ccccn2c1[N+](=O)[O-]	ZINC000840373794	702088450	/nfs/dbraw/zinc/08/84/50/702088450.db2.gz	ZKLUFMARMNYIBF-UHFFFAOYSA-N	1	1	319.365	1.765	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)CC1	ZINC000866213802	706650981	/nfs/dbraw/zinc/65/09/81/706650981.db2.gz	YWBCMMZBURHZDI-UHFFFAOYSA-N	1	1	323.372	1.345	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000816953610	702237265	/nfs/dbraw/zinc/23/72/65/702237265.db2.gz	KJWUOKUPMYUVMQ-GWCFXTLKSA-N	1	1	307.325	1.818	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000840993622	702305331	/nfs/dbraw/zinc/30/53/31/702305331.db2.gz	GZDHDIFORNCUCZ-JTQLQIEISA-N	1	1	306.278	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879362916	706662005	/nfs/dbraw/zinc/66/20/05/706662005.db2.gz	KALGZHZQYRFYTQ-IINYFYTJSA-N	1	1	314.769	1.813	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879362916	706662009	/nfs/dbraw/zinc/66/20/09/706662009.db2.gz	KALGZHZQYRFYTQ-IINYFYTJSA-N	1	1	314.769	1.813	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)N(CC)OC	ZINC000842768073	702770339	/nfs/dbraw/zinc/77/03/39/702770339.db2.gz	GQWPAIBRPVLLSS-UHFFFAOYSA-N	1	1	311.338	1.493	20	5		DDBDMO
CC[NH2+]Cc1noc(-c2cc(C(=O)OCC)cc([N+](=O)[O-])c2)n1	ZINC000843142518	702827615	/nfs/dbraw/zinc/82/76/15/702827615.db2.gz	HDMDQBQHEVHRHM-UHFFFAOYSA-N	1	1	320.305	1.931	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C[C@@H]2C1	ZINC000846190385	703248855	/nfs/dbraw/zinc/24/88/55/703248855.db2.gz	XOJDAHSSVIYFIU-OLZOCXBDSA-N	1	1	321.352	1.687	20	5		DDBDMO
COCC[N@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848475249	703554572	/nfs/dbraw/zinc/55/45/72/703554572.db2.gz	NSEBBBFSEUROCQ-CQSZACIVSA-N	1	1	307.350	1.446	20	5		DDBDMO
COCC[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848475249	703554574	/nfs/dbraw/zinc/55/45/74/703554574.db2.gz	NSEBBBFSEUROCQ-CQSZACIVSA-N	1	1	307.350	1.446	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000852651393	704092412	/nfs/dbraw/zinc/09/24/12/704092412.db2.gz	BDZORCBHIRHVRE-NILFDRSVSA-N	1	1	322.361	1.759	20	5		DDBDMO
COC(=O)NC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000852771414	704120213	/nfs/dbraw/zinc/12/02/13/704120213.db2.gz	OBSBMOKQGRBFMM-UHFFFAOYSA-N	1	1	323.349	1.924	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000870853592	704145440	/nfs/dbraw/zinc/14/54/40/704145440.db2.gz	UMCKNHOBRUUSNY-RWSFTLGLSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCc3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000820264839	704248725	/nfs/dbraw/zinc/24/87/25/704248725.db2.gz	SNGZPRRJUHAGET-IUODEOHRSA-N	1	1	321.352	1.829	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000860176333	705123520	/nfs/dbraw/zinc/12/35/20/705123520.db2.gz	CWPPCGXTUCIRBD-CVEARBPZSA-N	1	1	321.377	1.619	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000861338953	705433173	/nfs/dbraw/zinc/43/31/73/705433173.db2.gz	KMKMRHBCANVRCQ-ZFWWWQNUSA-N	1	1	308.334	1.861	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(OC[C@H]3CCCO3)CC2)c([N+](=O)[O-])n1	ZINC000876650408	705802199	/nfs/dbraw/zinc/80/21/99/705802199.db2.gz	RKKJJYZREOBJRR-CQSZACIVSA-N	1	1	324.381	1.488	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827278611	705967144	/nfs/dbraw/zinc/96/71/44/705967144.db2.gz	XLANGEAKKQFEIA-DGCLKSJQSA-N	1	1	318.377	1.803	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328914	705976255	/nfs/dbraw/zinc/97/62/55/705976255.db2.gz	FTMIGKANZPNMFK-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328914	705976258	/nfs/dbraw/zinc/97/62/58/705976258.db2.gz	FTMIGKANZPNMFK-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328914	705976260	/nfs/dbraw/zinc/97/62/60/705976260.db2.gz	FTMIGKANZPNMFK-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827374767	705988872	/nfs/dbraw/zinc/98/88/72/705988872.db2.gz	PUIPHAFKSICHDQ-OLZOCXBDSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828338624	706163116	/nfs/dbraw/zinc/16/31/16/706163116.db2.gz	PQGFHSAWHXGOOQ-JTNHKYCSSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828338624	706163120	/nfs/dbraw/zinc/16/31/20/706163120.db2.gz	PQGFHSAWHXGOOQ-JTNHKYCSSA-N	1	1	307.350	1.179	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000865006259	706323848	/nfs/dbraw/zinc/32/38/48/706323848.db2.gz	HGPWXLSHZCGZIP-LLVKDONJSA-N	1	1	307.325	1.629	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2nccs2)C1	ZINC000880320732	706939810	/nfs/dbraw/zinc/93/98/10/706939810.db2.gz	XKZZAWVFFHOCTR-LLVKDONJSA-N	1	1	320.374	1.703	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000880442927	706978011	/nfs/dbraw/zinc/97/80/11/706978011.db2.gz	YGCZCILROIFFOZ-BNOWGMLFSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000835158558	707185354	/nfs/dbraw/zinc/18/53/54/707185354.db2.gz	HXYIFZXVUJOUEI-ZDUSSCGKSA-N	1	1	316.398	1.722	20	5		DDBDMO
C[C@@H]1CN(c2ccnc(F)c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000882232816	707550967	/nfs/dbraw/zinc/55/09/67/707550967.db2.gz	AVKLDDQLKJYEPD-SNVBAGLBSA-N	1	1	312.345	1.410	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1C	ZINC000883598518	708034601	/nfs/dbraw/zinc/03/46/01/708034601.db2.gz	JNDRGSAELUHLSG-CYBMUJFWSA-N	1	1	306.366	1.797	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCC(C)(C)C2)n1	ZINC000897249654	708268508	/nfs/dbraw/zinc/26/85/08/708268508.db2.gz	YNPKDLJBANSSHQ-UHFFFAOYSA-N	1	1	322.365	1.920	20	5		DDBDMO
CC1([C@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)OCCO1	ZINC000886125270	708702200	/nfs/dbraw/zinc/70/22/00/708702200.db2.gz	MUXMJKGTYSRWGA-ZDUSSCGKSA-N	1	1	307.350	1.965	20	5		DDBDMO
Cc1ccccc1[C@H](CO)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000886433799	708760413	/nfs/dbraw/zinc/76/04/13/708760413.db2.gz	UXPBEQRZQBPZRZ-HNNXBMFYSA-N	1	1	304.350	1.765	20	5		DDBDMO
Cc1ccc(NC(=O)C[C@]2(O)CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000899911122	709235247	/nfs/dbraw/zinc/23/52/47/709235247.db2.gz	OAXNEZWABKTOKH-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([NH+]2CCC2)CC1	ZINC000912876599	713112921	/nfs/dbraw/zinc/11/29/21/713112921.db2.gz	KMBCLVYJIDRXPF-UHFFFAOYSA-N	1	1	305.334	1.611	20	5		DDBDMO
CC(C)[C@@H](CNc1c([N+](=O)[O-])cnn1C)N1CC[NH+](C)CC1	ZINC000891681525	710265049	/nfs/dbraw/zinc/26/50/49/710265049.db2.gz	VYXNXLMCRPVRRD-GFCCVEGCSA-N	1	1	310.402	1.012	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1=O	ZINC000892319591	710416024	/nfs/dbraw/zinc/41/60/24/710416024.db2.gz	MNCIJCGEFCJRDV-NSHDSACASA-N	1	1	316.361	1.810	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000893668092	710770065	/nfs/dbraw/zinc/77/00/65/710770065.db2.gz	CXBDJEYSERJQBN-MNOVXSKESA-N	1	1	309.366	1.833	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000928564231	713229208	/nfs/dbraw/zinc/22/92/08/713229208.db2.gz	VOBQATULNRAPTI-ZDUSSCGKSA-N	1	1	302.334	1.370	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C[C@@H]1C(C)(C)C	ZINC000912034025	711136485	/nfs/dbraw/zinc/13/64/85/711136485.db2.gz	RAHVAADGSPBHHV-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C[C@@H]1C(C)(C)C	ZINC000912034025	711136488	/nfs/dbraw/zinc/13/64/88/711136488.db2.gz	RAHVAADGSPBHHV-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000913537963	713249315	/nfs/dbraw/zinc/24/93/15/713249315.db2.gz	TWHQQTOKYJFTAF-BETUJISGSA-N	1	1	319.361	1.669	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC000896523832	711738087	/nfs/dbraw/zinc/73/80/87/711738087.db2.gz	QYPQENCWBGYVEF-ZDUSSCGKSA-N	1	1	323.397	1.785	20	5		DDBDMO
O=[N+]([O-])CC[NH2+]Cc1ccc(OCCOc2ccccc2)nc1	ZINC000905056370	711922297	/nfs/dbraw/zinc/92/22/97/711922297.db2.gz	YMXHTYUYDLSLDP-UHFFFAOYSA-N	1	1	317.345	1.906	20	5		DDBDMO
C[C@@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807201	713303430	/nfs/dbraw/zinc/30/34/30/713303430.db2.gz	XTCOLYBPDLLWJQ-HFAKWTLXSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807201	713303432	/nfs/dbraw/zinc/30/34/32/713303432.db2.gz	XTCOLYBPDLLWJQ-HFAKWTLXSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000913933881	713321862	/nfs/dbraw/zinc/32/18/62/713321862.db2.gz	USZZDXSDUPAFSR-NWDGAFQWSA-N	1	1	321.381	1.399	20	5		DDBDMO
C[NH+](C)CC1(O)CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000931483177	714108454	/nfs/dbraw/zinc/10/84/54/714108454.db2.gz	XHVWILNDQNQABE-OAHLLOKOSA-N	1	1	323.393	1.017	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C2OCCO2)C1	ZINC000932000208	714229273	/nfs/dbraw/zinc/22/92/73/714229273.db2.gz	AMOUFJXVZRMOCT-GFCCVEGCSA-N	1	1	308.334	1.798	20	5		DDBDMO
[NH3+]CC[C@H]1CCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000923486959	714373268	/nfs/dbraw/zinc/37/32/68/714373268.db2.gz	VXZNRJZMCIIWOF-LBPRGKRZSA-N	1	1	318.377	1.155	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000933220741	714539759	/nfs/dbraw/zinc/53/97/59/714539759.db2.gz	JMFNDMSMCYKMTC-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000933220741	714539762	/nfs/dbraw/zinc/53/97/62/714539762.db2.gz	JMFNDMSMCYKMTC-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
COC[C@H]1COCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000933330004	714563597	/nfs/dbraw/zinc/56/35/97/714563597.db2.gz	FJKNDDDLGBPOCW-AWEZNQCLSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@H]1COCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000933330004	714563599	/nfs/dbraw/zinc/56/35/99/714563599.db2.gz	FJKNDDDLGBPOCW-AWEZNQCLSA-N	1	1	323.349	1.271	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000933440020	714589699	/nfs/dbraw/zinc/58/96/99/714589699.db2.gz	XDMBIQLHULEGAH-DGCLKSJQSA-N	1	1	323.397	1.288	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])c(F)c1)C2	ZINC000933762184	714667366	/nfs/dbraw/zinc/66/73/66/714667366.db2.gz	RUYBYDUMFSHRLF-NHYWBVRUSA-N	1	1	307.325	1.821	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c1[N+](=O)[O-]	ZINC000934433199	714820686	/nfs/dbraw/zinc/82/06/86/714820686.db2.gz	DJIOYTSYZUGVDS-ZIAGYGMSSA-N	1	1	317.345	1.927	20	5		DDBDMO
Cc1noc(C[N@@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c1[N+](=O)[O-]	ZINC000934433199	714820687	/nfs/dbraw/zinc/82/06/87/714820687.db2.gz	DJIOYTSYZUGVDS-ZIAGYGMSSA-N	1	1	317.345	1.927	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](C[C@H]3CCCO3)CC2)n1	ZINC000611615649	721911675	/nfs/dbraw/zinc/91/16/75/721911675.db2.gz	SKSNYYPQYRUWGW-CQSZACIVSA-N	1	1	320.393	1.908	20	5		DDBDMO
Cc1nc(Cl)nc(N2CCc3[nH+]ccn3CC2)c1[N+](=O)[O-]	ZINC001167178265	732806359	/nfs/dbraw/zinc/80/63/59/732806359.db2.gz	QHBPUDHYAMRREH-UHFFFAOYSA-N	1	1	308.729	1.606	20	5		DDBDMO
CCc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001022063428	734368684	/nfs/dbraw/zinc/36/86/84/734368684.db2.gz	BKXSLBWOTFKFFI-QKPAOTATSA-N	1	1	317.389	1.651	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](CO)[C@@H](CCO)C1	ZINC001184364204	744019718	/nfs/dbraw/zinc/01/97/18/744019718.db2.gz	OOJSGTIPHGIZPV-NVSXCDJOSA-N	1	1	320.389	1.921	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)c1nn(C)cc1[N+](=O)[O-]	ZINC001186380806	744394617	/nfs/dbraw/zinc/39/46/17/744394617.db2.gz	NJFSGRSPUBOINO-UHFFFAOYSA-N	1	1	307.354	1.880	20	5		DDBDMO
COc1cccc(NCCC[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC001161708634	745601388	/nfs/dbraw/zinc/60/13/88/745601388.db2.gz	PBAVJKYRDHGLRD-UHFFFAOYSA-N	1	1	308.382	1.653	20	5		DDBDMO
CC(C)(C)C(=O)C(=O)NCC[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC001124976560	748741686	/nfs/dbraw/zinc/74/16/86/748741686.db2.gz	DAOYSAJWMAWWEU-UHFFFAOYSA-N	1	1	313.379	1.477	20	5		DDBDMO
[NH3+]Cc1ncn(-c2nc3cc([N+](=O)[O-])ccc3nc2Cl)n1	ZINC001168750356	749055852	/nfs/dbraw/zinc/05/58/52/749055852.db2.gz	MHLKZGDRPFQUEV-UHFFFAOYSA-N	1	1	305.685	1.231	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CC2=CCCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000673700	762077284	/nfs/dbraw/zinc/07/72/84/762077284.db2.gz	JKUPDYGEVDRIMS-HZPDHXFCSA-N	1	1	319.405	1.900	20	5		DDBDMO
O=C(NCC1=CC[N@H+](CC2=CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000673700	762077294	/nfs/dbraw/zinc/07/72/94/762077294.db2.gz	JKUPDYGEVDRIMS-HZPDHXFCSA-N	1	1	319.405	1.900	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CC2=CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000673700	762077303	/nfs/dbraw/zinc/07/73/03/762077303.db2.gz	JKUPDYGEVDRIMS-HZPDHXFCSA-N	1	1	319.405	1.900	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007603	762176079	/nfs/dbraw/zinc/17/60/79/762176079.db2.gz	OMIMZTMCAYEEAZ-DBIOUOCHSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007603	762176084	/nfs/dbraw/zinc/17/60/84/762176084.db2.gz	OMIMZTMCAYEEAZ-DBIOUOCHSA-N	1	1	314.279	1.769	20	5		DDBDMO
COc1cnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054639	762209710	/nfs/dbraw/zinc/20/97/10/762209710.db2.gz	NBNGEQKJJFLVTF-YNEHKIRRSA-N	1	1	322.365	1.384	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139013	760612835	/nfs/dbraw/zinc/61/28/35/760612835.db2.gz	MJSXMQJWAVVYHF-HKUMRIAESA-N	1	1	307.325	1.228	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2C[C@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328986	766253913	/nfs/dbraw/zinc/25/39/13/766253913.db2.gz	MRXPYYZXZXWRNB-UHTWSYAYSA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2C[C@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328986	766253920	/nfs/dbraw/zinc/25/39/20/766253920.db2.gz	MRXPYYZXZXWRNB-UHTWSYAYSA-N	1	1	312.341	1.939	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)cc1C	ZINC001267240882	837587105	/nfs/dbraw/zinc/58/71/05/837587105.db2.gz	BKXTWDDBPSLULB-HZPDHXFCSA-N	1	1	319.405	1.907	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1C	ZINC001267240882	837587117	/nfs/dbraw/zinc/58/71/17/837587117.db2.gz	BKXTWDDBPSLULB-HZPDHXFCSA-N	1	1	319.405	1.907	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1C	ZINC001267240882	837587123	/nfs/dbraw/zinc/58/71/23/837587123.db2.gz	BKXTWDDBPSLULB-HZPDHXFCSA-N	1	1	319.405	1.907	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1ccc([N+](=O)[O-])cc1	ZINC001266298721	836076432	/nfs/dbraw/zinc/07/64/32/836076432.db2.gz	NOKDJSOEJSBIFA-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
CN(CC[NH2+]Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001266696340	836683895	/nfs/dbraw/zinc/68/38/95/836683895.db2.gz	FPFYFGKJDHBECE-ZIAGYGMSSA-N	1	1	317.345	1.646	20	5		DDBDMO
CCOCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC001266898497	837023884	/nfs/dbraw/zinc/02/38/84/837023884.db2.gz	MYVOXTQGTMOSAZ-FOLVSLTJSA-N	1	1	319.361	1.178	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCN1C	ZINC001123318756	859173118	/nfs/dbraw/zinc/17/31/18/859173118.db2.gz	SGLIXIFVRFAHAZ-FZMZJTMJSA-N	1	1	321.381	1.351	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CO[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1	ZINC001224828359	881549745	/nfs/dbraw/zinc/54/97/45/881549745.db2.gz	CRRDUYBXVDAKHN-KBPBESRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC001335116693	868075365	/nfs/dbraw/zinc/07/53/65/868075365.db2.gz	JMWMXWUYEKKRKK-OLZOCXBDSA-N	1	1	309.341	1.769	20	5		DDBDMO
Cc1cccc(N2CCN(c3ccc([N+](=O)[O-])c(N)n3)CC2)[nH+]1	ZINC001163666449	868610031	/nfs/dbraw/zinc/61/00/31/868610031.db2.gz	RYZMGMMYHUNNBI-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C[NH+](C)C	ZINC001336779625	869136175	/nfs/dbraw/zinc/13/61/75/869136175.db2.gz	VQNCFAMUSVNLNR-JSGCOSHPSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@@H](C[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1)CN(C)C	ZINC001336779625	869136182	/nfs/dbraw/zinc/13/61/82/869136182.db2.gz	VQNCFAMUSVNLNR-JSGCOSHPSA-N	1	1	311.382	1.122	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@H](CO)[C@H](CCO)C3)c2c1	ZINC001336870503	869192313	/nfs/dbraw/zinc/19/23/13/869192313.db2.gz	VJABJNMPJXLLOD-VXGBXAGGSA-N	1	1	317.345	1.570	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3c(F)cccc3[N+](=O)[O-])[C@@H]2C1	ZINC001338463878	869993241	/nfs/dbraw/zinc/99/32/41/869993241.db2.gz	NPNWPZZTTRJZBA-HOSYDEDBSA-N	1	1	307.325	1.804	20	5		DDBDMO
C[N@H+](CCNC(=O)c1ccccn1)Cc1ccccc1[N+](=O)[O-]	ZINC001317435916	870828633	/nfs/dbraw/zinc/82/86/33/870828633.db2.gz	BOBGDKBWUCXQCG-UHFFFAOYSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccccn1)Cc1ccccc1[N+](=O)[O-]	ZINC001317435916	870828642	/nfs/dbraw/zinc/82/86/42/870828642.db2.gz	BOBGDKBWUCXQCG-UHFFFAOYSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cnon1)Cc1ccccc1[N+](=O)[O-]	ZINC001316856037	871356301	/nfs/dbraw/zinc/35/63/01/871356301.db2.gz	YTUPVGANODEGRE-UHFFFAOYSA-N	1	1	319.321	1.230	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC001343630182	872693631	/nfs/dbraw/zinc/69/36/31/872693631.db2.gz	ILMRVLKOMZTDBB-CYBMUJFWSA-N	1	1	324.429	1.487	20	5		DDBDMO
O=[N+]([O-])c1cnc(OC2CC[NH+](CCF)CC2)c([N+](=O)[O-])c1	ZINC001227107791	882837659	/nfs/dbraw/zinc/83/76/59/882837659.db2.gz	HEHSGKPKFMUWMU-UHFFFAOYSA-N	1	1	314.273	1.711	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC001349920773	875457446	/nfs/dbraw/zinc/45/74/46/875457446.db2.gz	KODXTBOHCLHUTD-JTQLQIEISA-N	1	1	308.338	1.819	20	5		DDBDMO
COC(=O)c1c(COC2C[NH+](C(C)C)C2)cccc1[N+](=O)[O-]	ZINC001223292821	880908354	/nfs/dbraw/zinc/90/83/54/880908354.db2.gz	AGLZSBZIDPNCKT-UHFFFAOYSA-N	1	1	308.334	1.991	20	5		DDBDMO
CCOCC(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001231406482	885620785	/nfs/dbraw/zinc/62/07/85/885620785.db2.gz	JFTXEWPOOMCGQW-UHFFFAOYSA-N	1	1	315.395	1.631	20	5		DDBDMO
CCOCC(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001231406482	885620791	/nfs/dbraw/zinc/62/07/91/885620791.db2.gz	JFTXEWPOOMCGQW-UHFFFAOYSA-N	1	1	315.395	1.631	20	5		DDBDMO
N[C@@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC[C@H]1O	ZINC001246570257	892703980	/nfs/dbraw/zinc/70/39/80/892703980.db2.gz	FODGUVSEYDJIPZ-NUEKZKHPSA-N	1	1	305.378	1.236	20	5		DDBDMO
N[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC[C@H]1O	ZINC001246570257	892703994	/nfs/dbraw/zinc/70/39/94/892703994.db2.gz	FODGUVSEYDJIPZ-NUEKZKHPSA-N	1	1	305.378	1.236	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CCCO1	ZINC001254563640	896501527	/nfs/dbraw/zinc/50/15/27/896501527.db2.gz	ABAOWLRLQWYDOQ-DOMZBBRYSA-N	1	1	322.361	1.790	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@H]1CO	ZINC000248900362	282116557	/nfs/dbraw/zinc/11/65/57/282116557.db2.gz	HFPRSXBPTVQTSU-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000248996244	282125551	/nfs/dbraw/zinc/12/55/51/282125551.db2.gz	YBIRJTVNFNXFHY-HZMBPMFUSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@H](C)[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000248996244	282125555	/nfs/dbraw/zinc/12/55/55/282125555.db2.gz	YBIRJTVNFNXFHY-HZMBPMFUSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000614529947	361909638	/nfs/dbraw/zinc/90/96/38/361909638.db2.gz	CVKUUXSOYXPAOS-NSHDSACASA-N	1	1	317.349	1.041	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@H+]1CCCO	ZINC000452348653	231355878	/nfs/dbraw/zinc/35/58/78/231355878.db2.gz	LIZUDGYTNRJYCZ-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000251499129	282201458	/nfs/dbraw/zinc/20/14/58/282201458.db2.gz	BLJGYCRDLPDMAZ-CJNGLKHVSA-N	1	1	324.377	1.571	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000251434517	282201002	/nfs/dbraw/zinc/20/10/02/282201002.db2.gz	ASHYMNOAKIYZHY-WFASDCNBSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000251434517	282201003	/nfs/dbraw/zinc/20/10/03/282201003.db2.gz	ASHYMNOAKIYZHY-WFASDCNBSA-N	1	1	310.350	1.709	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000491745123	529803289	/nfs/dbraw/zinc/80/32/89/529803289.db2.gz	NTIKCVAUNSIPHG-JOAKQRRISA-N	1	1	307.325	1.815	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCCCC[N@H+](C)C1CC1	ZINC000457212802	232015029	/nfs/dbraw/zinc/01/50/29/232015029.db2.gz	XZGITOILEUTDNS-UHFFFAOYSA-N	1	1	306.366	1.902	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000294909803	530063076	/nfs/dbraw/zinc/06/30/76/530063076.db2.gz	ISZNDJHFPILPBG-AWEZNQCLSA-N	1	1	319.361	1.768	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)[C@H]2C1	ZINC000272616696	210015707	/nfs/dbraw/zinc/01/57/07/210015707.db2.gz	LHZIWVGJOXKKOY-MFKMUULPSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H]1C[C@H](C)C[NH+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138208871	186015324	/nfs/dbraw/zinc/01/53/24/186015324.db2.gz	KZAPWKHISZXBMY-QWRGUYRKSA-N	1	1	323.397	1.804	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)C[NH+]1CCOCC1	ZINC000150726848	186060447	/nfs/dbraw/zinc/06/04/47/186060447.db2.gz	PYXIQNHBHHSKTL-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H](C)C[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000150730676	186060546	/nfs/dbraw/zinc/06/05/46/186060546.db2.gz	QOUMYLCGEFQBTB-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
CCCNC(=O)C[NH+]1CCC(Nc2ccccc2[N+](=O)[O-])CC1	ZINC000029622293	352242490	/nfs/dbraw/zinc/24/24/90/352242490.db2.gz	IHMGTYKSYRWVRA-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000331719397	234042492	/nfs/dbraw/zinc/04/24/92/234042492.db2.gz	QXIRWGVNCCZTAQ-CABCVRRESA-N	1	1	319.361	1.717	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000051124156	352578196	/nfs/dbraw/zinc/57/81/96/352578196.db2.gz	IXTQUTHAYZCQEP-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000051124156	352578198	/nfs/dbraw/zinc/57/81/98/352578198.db2.gz	IXTQUTHAYZCQEP-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
CC1(C)COCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000064247553	352932363	/nfs/dbraw/zinc/93/23/63/352932363.db2.gz	TUXCCICEPLRFAE-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)COCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000064247553	352932365	/nfs/dbraw/zinc/93/23/65/352932365.db2.gz	TUXCCICEPLRFAE-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC(C)C[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000065962278	352972861	/nfs/dbraw/zinc/97/28/61/352972861.db2.gz	DFGWXAWSBTTXJM-UHFFFAOYSA-N	1	1	309.322	1.850	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000066138046	352979453	/nfs/dbraw/zinc/97/94/53/352979453.db2.gz	GUHNYHOFIIZCHO-GFCCVEGCSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC1(C)COCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000066423662	352996465	/nfs/dbraw/zinc/99/64/65/352996465.db2.gz	TUXCCICEPLRFAE-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)COCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000066423662	352996467	/nfs/dbraw/zinc/99/64/67/352996467.db2.gz	TUXCCICEPLRFAE-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](CN1CCN(C)CC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000173399858	198210766	/nfs/dbraw/zinc/21/07/66/198210766.db2.gz	VAEBQHUEWHQDFD-KBPBESRZSA-N	1	1	306.410	1.881	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000067412504	353047529	/nfs/dbraw/zinc/04/75/29/353047529.db2.gz	SANZDKMMPVOXTM-AWEZNQCLSA-N	1	1	321.377	1.822	20	5		DDBDMO
O=[N+]([O-])c1cnccc1N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000069797654	353173986	/nfs/dbraw/zinc/17/39/86/353173986.db2.gz	NRBWGYTYOLLMML-ZDUSSCGKSA-N	1	1	306.366	1.538	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000069575847	353168544	/nfs/dbraw/zinc/16/85/44/353168544.db2.gz	YKANNILNMTTXLV-UHFFFAOYSA-N	1	1	321.377	1.700	20	5		DDBDMO
CCOC(=O)c1ccnc(NC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000077965669	353498177	/nfs/dbraw/zinc/49/81/77/353498177.db2.gz	DVFNYKCSQLALLL-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]([C@@H](C)O)C1	ZINC000089928375	353783693	/nfs/dbraw/zinc/78/36/93/353783693.db2.gz	JOFILSGTWBLCKC-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]([C@@H](C)O)C1	ZINC000089928375	353783695	/nfs/dbraw/zinc/78/36/95/353783695.db2.gz	JOFILSGTWBLCKC-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H](O)C1CC1	ZINC000156634059	354220288	/nfs/dbraw/zinc/22/02/88/354220288.db2.gz	CJOCKKKRIWFPJB-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H](O)C1CC1	ZINC000156634059	354220295	/nfs/dbraw/zinc/22/02/95/354220295.db2.gz	CJOCKKKRIWFPJB-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
COCC[C@@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293040631	354453410	/nfs/dbraw/zinc/45/34/10/354453410.db2.gz	GZWFRCSHRSPTJT-CYBMUJFWSA-N	1	1	321.377	1.778	20	5		DDBDMO
Cc1nn(C[C@@H](O)C[N@H+](C)Cc2ccccc2)c(C)c1[N+](=O)[O-]	ZINC000303369520	354462154	/nfs/dbraw/zinc/46/21/54/354462154.db2.gz	JTWTWUWOEDDCMG-HNNXBMFYSA-N	1	1	318.377	1.901	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]([C@@H](C)O)C2)c1	ZINC000589510903	354997906	/nfs/dbraw/zinc/99/79/06/354997906.db2.gz	UNJXPNISUIDLIX-ZYHUDNBSSA-N	1	1	308.334	1.584	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000590045782	355043338	/nfs/dbraw/zinc/04/33/38/355043338.db2.gz	WDLCLIMWJLGGEL-IUODEOHRSA-N	1	1	319.361	1.445	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC000590445085	355098783	/nfs/dbraw/zinc/09/87/83/355098783.db2.gz	MZZOLIKOZFCJBD-AAEUAGOBSA-N	1	1	319.361	1.770	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@](C)(C(N)=O)C(C)C)c1	ZINC000593027960	355774149	/nfs/dbraw/zinc/77/41/49/355774149.db2.gz	HJOHIALSXIFFSZ-OAHLLOKOSA-N	1	1	323.349	1.371	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+](C2CC2)C2(CO)CCC2)c([N+](=O)[O-])c1	ZINC000595533895	356536858	/nfs/dbraw/zinc/53/68/58/356536858.db2.gz	PPHJLETVCDFYPZ-UHFFFAOYSA-N	1	1	319.361	1.573	20	5		DDBDMO
CC[N@H+]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000595536899	356538704	/nfs/dbraw/zinc/53/87/04/356538704.db2.gz	XAMZZABQUBYAQY-LBPRGKRZSA-N	1	1	320.393	1.610	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C2	ZINC000595758438	356639917	/nfs/dbraw/zinc/63/99/17/356639917.db2.gz	MYBJAFYYLDLOPZ-XEZPLFJOSA-N	1	1	322.361	1.303	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000595761675	356642294	/nfs/dbraw/zinc/64/22/94/356642294.db2.gz	ZBHXHELHKJDLTN-IUODEOHRSA-N	1	1	305.334	1.162	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@@H]1C	ZINC000347202616	283207056	/nfs/dbraw/zinc/20/70/56/283207056.db2.gz	KTMUWLZPDKJMIW-ZYHUDNBSSA-N	1	1	308.334	1.987	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595870480	356686145	/nfs/dbraw/zinc/68/61/45/356686145.db2.gz	GOPXMXZZUOLHPO-MLGOLLRUSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595870480	356686149	/nfs/dbraw/zinc/68/61/49/356686149.db2.gz	GOPXMXZZUOLHPO-MLGOLLRUSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596076294	356764057	/nfs/dbraw/zinc/76/40/57/356764057.db2.gz	OULWAEAKJVESDO-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
C[NH+](C)CCN1CCC(Nc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596078317	356765237	/nfs/dbraw/zinc/76/52/37/356765237.db2.gz	WGWBZPVCNPCISO-UHFFFAOYSA-N	1	1	309.370	1.133	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596094036	356769952	/nfs/dbraw/zinc/76/99/52/356769952.db2.gz	HFGMNVJPRANCOI-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000596308734	356852750	/nfs/dbraw/zinc/85/27/50/356852750.db2.gz	MKOOVOQOIUEZDU-JTQLQIEISA-N	1	1	306.366	1.978	20	5		DDBDMO
Cc1ccnc(N[C@@H](C)C[N@H+](C)CCCN(C)C)c1[N+](=O)[O-]	ZINC000596362397	356864473	/nfs/dbraw/zinc/86/44/73/356864473.db2.gz	ZWXIMVVZCQNTCI-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1ccnc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1[N+](=O)[O-]	ZINC000596362397	356864477	/nfs/dbraw/zinc/86/44/77/356864477.db2.gz	ZWXIMVVZCQNTCI-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3COC[C@@H]3C1)OCCO2	ZINC000597231768	357103589	/nfs/dbraw/zinc/10/35/89/357103589.db2.gz	QPCOVUIOGUDPJM-AAEUAGOBSA-N	1	1	320.345	1.834	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](C(=O)OC)C2)ccc1[N+](=O)[O-]	ZINC000276854796	213135621	/nfs/dbraw/zinc/13/56/21/213135621.db2.gz	FIEIYECCZRHPFC-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597858575	357360726	/nfs/dbraw/zinc/36/07/26/357360726.db2.gz	NMNLIYCAWSXPGD-SECBINFHSA-N	1	1	309.370	1.483	20	5		DDBDMO
CCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000598040929	357438822	/nfs/dbraw/zinc/43/88/22/357438822.db2.gz	JKFYCCIUYZAVBY-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000598042567	357439601	/nfs/dbraw/zinc/43/96/01/357439601.db2.gz	PSFJWMCSRNONPV-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598218999	357497280	/nfs/dbraw/zinc/49/72/80/357497280.db2.gz	KKOYTSMLHQAABP-SNVBAGLBSA-N	1	1	307.354	1.455	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598647062	357668533	/nfs/dbraw/zinc/66/85/33/357668533.db2.gz	BPUSHZBFEBCPKL-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598647062	357668535	/nfs/dbraw/zinc/66/85/35/357668535.db2.gz	BPUSHZBFEBCPKL-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000598647127	357669290	/nfs/dbraw/zinc/66/92/90/357669290.db2.gz	BUTVSAKFMWVEFV-QWHCGFSZSA-N	1	1	324.377	1.933	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000599141813	357828050	/nfs/dbraw/zinc/82/80/50/357828050.db2.gz	RLWFQJQDZDEQIY-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000599569533	357978415	/nfs/dbraw/zinc/97/84/15/357978415.db2.gz	NRFYFIRRAQNNLE-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000599569533	357978420	/nfs/dbraw/zinc/97/84/20/357978420.db2.gz	NRFYFIRRAQNNLE-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1ncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1	ZINC000600115356	358127593	/nfs/dbraw/zinc/12/75/93/358127593.db2.gz	FXPCLPSHIXZPRN-LLVKDONJSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)o1	ZINC000600115356	358127595	/nfs/dbraw/zinc/12/75/95/358127595.db2.gz	FXPCLPSHIXZPRN-LLVKDONJSA-N	1	1	303.322	1.973	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)C[C@@]1(C)C(=O)NC2=O	ZINC000602723865	359150571	/nfs/dbraw/zinc/15/05/71/359150571.db2.gz	HQZFBZJCIZSPEC-GASCZTMLSA-N	1	1	321.308	1.219	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@@H](O)C[C@H]1c1ccccc1	ZINC000602839809	359228355	/nfs/dbraw/zinc/22/83/55/359228355.db2.gz	IVAMJXIHFUMBNX-GJZGRUSLSA-N	1	1	316.361	1.908	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](C)[N@H+](CCn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602915309	359291948	/nfs/dbraw/zinc/29/19/48/359291948.db2.gz	AIFPATSDKNWKKY-PTEHBNRSSA-N	1	1	324.381	1.762	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)C[C@H]1C(C)C	ZINC000602953292	359318276	/nfs/dbraw/zinc/31/82/76/359318276.db2.gz	RYHVPARUNMUBBW-ZDUSSCGKSA-N	1	1	321.381	1.524	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@](C)(CO)C1	ZINC000602964532	359327799	/nfs/dbraw/zinc/32/77/99/359327799.db2.gz	QZKMVBBUWMCDFW-LSDHHAIUSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](OC)C[C@@]1(C)CO	ZINC000602965140	359329266	/nfs/dbraw/zinc/32/92/66/359329266.db2.gz	ZRSBCKOQALTQTI-ZFWWWQNUSA-N	1	1	310.350	1.575	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000602997845	359346755	/nfs/dbraw/zinc/34/67/55/359346755.db2.gz	RXEPSEKECZRDHI-ZNMIVQPWSA-N	1	1	321.377	1.382	20	5		DDBDMO
Cc1[nH+]ccn1Cc1cn(CCc2ccc([N+](=O)[O-])cc2)nn1	ZINC000603199222	359474974	/nfs/dbraw/zinc/47/49/74/359474974.db2.gz	WOYMYJXLEJKWEI-UHFFFAOYSA-N	1	1	312.333	1.982	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](O)[C@H](C)C1	ZINC000186796832	200012265	/nfs/dbraw/zinc/01/22/65/200012265.db2.gz	YNTVMQWAUQGVFC-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](O)[C@H](C)C1	ZINC000186796832	200012267	/nfs/dbraw/zinc/01/22/67/200012267.db2.gz	YNTVMQWAUQGVFC-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1O	ZINC000186900510	200028778	/nfs/dbraw/zinc/02/87/78/200028778.db2.gz	HPDTXANIZJCYTP-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@]2(CO)COCC[NH2+]2)c(Cl)c1	ZINC000603418186	359628739	/nfs/dbraw/zinc/62/87/39/359628739.db2.gz	CPKVHJSDKOMHFC-GFCCVEGCSA-N	1	1	301.730	1.011	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000186947034	200037090	/nfs/dbraw/zinc/03/70/90/200037090.db2.gz	IRBPJCRBIVCFJP-NWDGAFQWSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000186947034	200037092	/nfs/dbraw/zinc/03/70/92/200037092.db2.gz	IRBPJCRBIVCFJP-NWDGAFQWSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)NCC[N@@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000189383838	200390707	/nfs/dbraw/zinc/39/07/07/200390707.db2.gz	QSURWXVOHRSTIM-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1c(C(=O)NCC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000189383838	200390708	/nfs/dbraw/zinc/39/07/08/200390708.db2.gz	QSURWXVOHRSTIM-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000189335973	200383771	/nfs/dbraw/zinc/38/37/71/200383771.db2.gz	DQHRYCUTOCWIAT-UHFFFAOYSA-N	1	1	310.354	1.920	20	5		DDBDMO
COC[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000189420980	200398988	/nfs/dbraw/zinc/39/89/88/200398988.db2.gz	ASHYMNOAKIYZHY-SWLSCSKDSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000189420980	200398989	/nfs/dbraw/zinc/39/89/89/200398989.db2.gz	ASHYMNOAKIYZHY-SWLSCSKDSA-N	1	1	310.350	1.709	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000609269713	360286125	/nfs/dbraw/zinc/28/61/25/360286125.db2.gz	VXNSBHDCOFPKOV-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
COc1ccc(CNC(=O)[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000609547383	360323017	/nfs/dbraw/zinc/32/30/17/360323017.db2.gz	BNJDYCAMEJLDJG-GFCCVEGCSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CCCO)C3CC3)n2)c1	ZINC000609846185	360355623	/nfs/dbraw/zinc/35/56/23/360355623.db2.gz	UQLYXGWMQYMXAU-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CCCO)C3CC3)n2)c1	ZINC000609846185	360355626	/nfs/dbraw/zinc/35/56/26/360355626.db2.gz	UQLYXGWMQYMXAU-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610395585	360425043	/nfs/dbraw/zinc/42/50/43/360425043.db2.gz	JTBJGWDGXNKHMQ-LBPRGKRZSA-N	1	1	321.377	1.797	20	5		DDBDMO
C[C@H]1CCN(CC[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610395585	360425049	/nfs/dbraw/zinc/42/50/49/360425049.db2.gz	JTBJGWDGXNKHMQ-LBPRGKRZSA-N	1	1	321.377	1.797	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)CN2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000610636253	360487905	/nfs/dbraw/zinc/48/79/05/360487905.db2.gz	CQCXGVGNVCRSIH-ZDUSSCGKSA-N	1	1	320.393	1.328	20	5		DDBDMO
Cc1nc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC000610754536	360527805	/nfs/dbraw/zinc/52/78/05/360527805.db2.gz	YEBMANHUYWRSSV-AWEZNQCLSA-N	1	1	320.393	1.989	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(O)cc2)CC1	ZINC000611526212	360748028	/nfs/dbraw/zinc/74/80/28/360748028.db2.gz	DFAOFYGUIMMPDM-UHFFFAOYSA-N	1	1	317.349	1.356	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@]3(C2)NC(=O)NC3=O)cc1[N+](=O)[O-]	ZINC000193470332	201057453	/nfs/dbraw/zinc/05/74/53/201057453.db2.gz	ZMOKORLBYKWWAX-OAHLLOKOSA-N	1	1	318.333	1.077	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@]3(C2)NC(=O)NC3=O)cc1[N+](=O)[O-]	ZINC000193470332	201057456	/nfs/dbraw/zinc/05/74/56/201057456.db2.gz	ZMOKORLBYKWWAX-OAHLLOKOSA-N	1	1	318.333	1.077	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000281462144	216316378	/nfs/dbraw/zinc/31/63/78/216316378.db2.gz	RHFRMQZCMFXGOA-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000281462144	216316382	/nfs/dbraw/zinc/31/63/82/216316382.db2.gz	RHFRMQZCMFXGOA-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000619536091	364051430	/nfs/dbraw/zinc/05/14/30/364051430.db2.gz	IQOMHTJAJVKRLU-LBPRGKRZSA-N	1	1	307.350	1.492	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000619868429	364167478	/nfs/dbraw/zinc/16/74/78/364167478.db2.gz	CUEOGIOYYZPKSQ-UHFFFAOYSA-N	1	1	321.381	1.126	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000359223197	299363449	/nfs/dbraw/zinc/36/34/49/299363449.db2.gz	HRHVIYOEYKUGJY-GFCCVEGCSA-N	1	1	304.350	1.631	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000275173314	212171699	/nfs/dbraw/zinc/17/16/99/212171699.db2.gz	AXQCBPGPGPDBJA-UHFFFAOYSA-N	1	1	303.322	1.294	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](O)C1	ZINC000265001611	204335921	/nfs/dbraw/zinc/33/59/21/204335921.db2.gz	DXLGYMVEXQHDKS-CABZTGNLSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@H](O)C1	ZINC000265001611	204335925	/nfs/dbraw/zinc/33/59/25/204335925.db2.gz	DXLGYMVEXQHDKS-CABZTGNLSA-N	1	1	304.306	1.772	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)NCC(F)(F)F)c1ccccc1[N+](=O)[O-]	ZINC000266421460	205334159	/nfs/dbraw/zinc/33/41/59/205334159.db2.gz	ARLODDCNTPJGML-QMMMGPOBSA-N	1	1	305.256	1.924	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2CC[C@H](OC)C2)c([N+](=O)[O-])c1	ZINC000267767609	206268639	/nfs/dbraw/zinc/26/86/39/206268639.db2.gz	GBAIXFMVJSLITO-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000038533615	183001862	/nfs/dbraw/zinc/00/18/62/183001862.db2.gz	USGZOWDDVDCOKJ-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCS2(=O)=O)c(F)c1	ZINC000336838881	249246354	/nfs/dbraw/zinc/24/63/54/249246354.db2.gz	NRGYGDASTDDBMK-LLVKDONJSA-N	1	1	302.327	1.401	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(CCOc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000284740397	218157782	/nfs/dbraw/zinc/15/77/82/218157782.db2.gz	DJIMXOKRVHQONB-CVEARBPZSA-N	1	1	321.377	1.379	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CC(C)(C)O)CC1	ZINC000106400143	194208335	/nfs/dbraw/zinc/20/83/35/194208335.db2.gz	XKWBHUDJNQVXIQ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000110815578	194360569	/nfs/dbraw/zinc/36/05/69/194360569.db2.gz	VOXFRBIDUQPLND-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)[N@@H+](C)C1CC1	ZINC000057716083	184049792	/nfs/dbraw/zinc/04/97/92/184049792.db2.gz	DJPKKWJZXHLVKP-LLVKDONJSA-N	1	1	320.393	1.873	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCC[N@@H+](C)CCN(C)C	ZINC000341089953	251375092	/nfs/dbraw/zinc/37/50/92/251375092.db2.gz	QYLUIKDUUNTLON-UHFFFAOYSA-N	1	1	312.418	1.415	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCCN(C)CC[NH+](C)C	ZINC000341089953	251375095	/nfs/dbraw/zinc/37/50/95/251375095.db2.gz	QYLUIKDUUNTLON-UHFFFAOYSA-N	1	1	312.418	1.415	20	5		DDBDMO
Cc1c(C(=O)NCC[NH+]2CCSCC2)cccc1[N+](=O)[O-]	ZINC000352395914	285021138	/nfs/dbraw/zinc/02/11/38/285021138.db2.gz	UFHWRVQNITTZJA-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1	ZINC000567796241	304242923	/nfs/dbraw/zinc/24/29/23/304242923.db2.gz	MDQJISUIVLKWBF-XPKDYRNWSA-N	1	1	322.361	1.445	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCO)CC1CC1	ZINC000352467070	285071623	/nfs/dbraw/zinc/07/16/23/285071623.db2.gz	IEHZFRSHZASNFS-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[C@H]1O	ZINC000352657691	285201825	/nfs/dbraw/zinc/20/18/25/285201825.db2.gz	BYTRMFTTXVUSFK-UONOGXRCSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000294923312	224313706	/nfs/dbraw/zinc/31/37/06/224313706.db2.gz	BBTMVMZGDDWETL-OAHLLOKOSA-N	1	1	308.334	1.606	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000299565069	533665662	/nfs/dbraw/zinc/66/56/62/533665662.db2.gz	USMLODAVLKIVJP-JTQLQIEISA-N	1	1	309.370	1.621	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNCc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000084440146	407088799	/nfs/dbraw/zinc/08/87/99/407088799.db2.gz	RSLZBGNXMYPYJE-CYBMUJFWSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CCN(C)[C@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000084440146	407088803	/nfs/dbraw/zinc/08/88/03/407088803.db2.gz	RSLZBGNXMYPYJE-CYBMUJFWSA-N	1	1	312.801	1.584	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2CO)c2c(c1)COCO2	ZINC000052870880	407158546	/nfs/dbraw/zinc/15/85/46/407158546.db2.gz	FJMPRXQOSZFDRF-CYBMUJFWSA-N	1	1	308.334	1.808	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2CO)c2c(c1)COCO2	ZINC000052870880	407158549	/nfs/dbraw/zinc/15/85/49/407158549.db2.gz	FJMPRXQOSZFDRF-CYBMUJFWSA-N	1	1	308.334	1.808	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H](C)[N@@H+](C)C1CC1	ZINC000057700545	407217254	/nfs/dbraw/zinc/21/72/54/407217254.db2.gz	HCZBRRPWHKGVRK-JTQLQIEISA-N	1	1	309.370	1.089	20	5		DDBDMO
CC[NH+](CC)[C@H](C)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000068080097	407294323	/nfs/dbraw/zinc/29/43/23/407294323.db2.gz	WXTYRLFGAHKYBI-SNVBAGLBSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[C@@H]1CN(c2nc(C)ccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000124696605	407366276	/nfs/dbraw/zinc/36/62/76/407366276.db2.gz	BQBKKBGKQQEUEE-CHWSQXEVSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCOC1	ZINC000107691356	407378450	/nfs/dbraw/zinc/37/84/50/407378450.db2.gz	SHGDFBZQJXMXSR-NSHDSACASA-N	1	1	307.350	1.552	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000107895221	407381247	/nfs/dbraw/zinc/38/12/47/407381247.db2.gz	PSFMFOGZAHXEII-SECBINFHSA-N	1	1	310.329	1.388	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111316490	407407489	/nfs/dbraw/zinc/40/74/89/407407489.db2.gz	PSHSSEUPGDEBAK-ACJTYDJDSA-N	1	1	319.361	1.910	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111316490	407407490	/nfs/dbraw/zinc/40/74/90/407407490.db2.gz	PSHSSEUPGDEBAK-ACJTYDJDSA-N	1	1	319.361	1.910	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000112309914	407425913	/nfs/dbraw/zinc/42/59/13/407425913.db2.gz	BYARJJALHKYELY-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
C[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C(C)(C)C1	ZINC000271010062	407467751	/nfs/dbraw/zinc/46/77/51/407467751.db2.gz	HRPAKSSVAWNYND-UHFFFAOYSA-N	1	1	306.366	1.220	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265802579	407460980	/nfs/dbraw/zinc/46/09/80/407460980.db2.gz	OGFHGEREPAZNLK-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
CSCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000178977254	407680413	/nfs/dbraw/zinc/68/04/13/407680413.db2.gz	HZGXSYAAWWUZEI-UHFFFAOYSA-N	1	1	309.391	1.716	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117292043	407824053	/nfs/dbraw/zinc/82/40/53/407824053.db2.gz	ASLBAUYKPXHBIM-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117292043	407824054	/nfs/dbraw/zinc/82/40/54/407824054.db2.gz	ASLBAUYKPXHBIM-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
Cn1cc[nH+]c1Cn1cc(Br)cc([N+](=O)[O-])c1=O	ZINC000153439644	407824998	/nfs/dbraw/zinc/82/49/98/407824998.db2.gz	PVQPOXAEYCJZAJ-UHFFFAOYSA-N	1	1	313.111	1.301	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000245442852	407981634	/nfs/dbraw/zinc/98/16/34/407981634.db2.gz	WQYCPTPBACKFJC-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000245442852	407981640	/nfs/dbraw/zinc/98/16/40/407981640.db2.gz	WQYCPTPBACKFJC-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000272426292	407914884	/nfs/dbraw/zinc/91/48/84/407914884.db2.gz	YHJWFARBMPTXDI-UHFFFAOYSA-N	1	1	301.293	1.755	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000268151144	407916648	/nfs/dbraw/zinc/91/66/48/407916648.db2.gz	UQUPASLZXMTSEW-ABAIWWIYSA-N	1	1	318.377	1.877	20	5		DDBDMO
Cn1ncc2c1CCC[C@H]2[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000135560702	408030642	/nfs/dbraw/zinc/03/06/42/408030642.db2.gz	WFJNOHUDNMQRMV-CYBMUJFWSA-N	1	1	304.354	1.534	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCOc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000189553189	408050122	/nfs/dbraw/zinc/05/01/22/408050122.db2.gz	CFVYQIUFZHGWTD-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cn1cc([C@@H]2C[NH2+]CCN2C(=O)c2ccc([N+](=O)[O-])s2)cn1	ZINC000181379465	407990081	/nfs/dbraw/zinc/99/00/81/407990081.db2.gz	CMVNGFPTOZSTKN-JTQLQIEISA-N	1	1	321.362	1.177	20	5		DDBDMO
CC[C@@H](CSC)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245592724	408023050	/nfs/dbraw/zinc/02/30/50/408023050.db2.gz	LXXCGKVFGDGFLH-CMPLNLGQSA-N	1	1	302.400	1.226	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCOC[C@H]2C2CC2)c1	ZINC000245856140	408080443	/nfs/dbraw/zinc/08/04/43/408080443.db2.gz	KBSJGODASNMMGR-HOCLYGCPSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOC[C@H]2C2CC2)c1	ZINC000245856140	408080448	/nfs/dbraw/zinc/08/04/48/408080448.db2.gz	KBSJGODASNMMGR-HOCLYGCPSA-N	1	1	322.361	1.445	20	5		DDBDMO
COc1ccc(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000155075979	408124319	/nfs/dbraw/zinc/12/43/19/408124319.db2.gz	QEYZWTYELLIKIS-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1sc(S(=O)(=O)NCC[N@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000155611625	408187729	/nfs/dbraw/zinc/18/77/29/408187729.db2.gz	BGNYHJOITJAGGS-UHFFFAOYSA-N	1	1	321.424	1.583	20	5		DDBDMO
CCOC(=O)C[C@@H](C)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000182671669	408217398	/nfs/dbraw/zinc/21/73/98/408217398.db2.gz	SLBYCEBCTTZCBM-SNVBAGLBSA-N	1	1	323.349	1.467	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])s2)C[C@H](C)O1	ZINC000190312620	408220373	/nfs/dbraw/zinc/22/03/73/408220373.db2.gz	DFGLEORXZWKCOC-AOOOYVTPSA-N	1	1	300.384	1.963	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNc2ncc([N+](=O)[O-])s2)C[C@H](C)O1	ZINC000190312620	408220381	/nfs/dbraw/zinc/22/03/81/408220381.db2.gz	DFGLEORXZWKCOC-AOOOYVTPSA-N	1	1	300.384	1.963	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000263820622	408274587	/nfs/dbraw/zinc/27/45/87/408274587.db2.gz	ZWUMBIIVXOLVSI-UHFFFAOYSA-N	1	1	324.381	1.091	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000151263306	408286836	/nfs/dbraw/zinc/28/68/36/408286836.db2.gz	YKOPIYRYUANKRR-HNNXBMFYSA-N	1	1	320.393	1.805	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190884724	408335102	/nfs/dbraw/zinc/33/51/02/408335102.db2.gz	YGRBIKKXWWFXOJ-OLZOCXBDSA-N	1	1	321.377	1.792	20	5		DDBDMO
CSCC[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000138252798	162129640	/nfs/dbraw/zinc/12/96/40/162129640.db2.gz	IHEMWLOQXHNZIT-ZDUSSCGKSA-N	1	1	309.391	1.995	20	5		DDBDMO
CSCC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000138252798	162129641	/nfs/dbraw/zinc/12/96/41/162129641.db2.gz	IHEMWLOQXHNZIT-ZDUSSCGKSA-N	1	1	309.391	1.995	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183221019	408357519	/nfs/dbraw/zinc/35/75/19/408357519.db2.gz	RSAYSIBWSYZCBR-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183221019	408357522	/nfs/dbraw/zinc/35/75/22/408357522.db2.gz	RSAYSIBWSYZCBR-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000246875980	408358185	/nfs/dbraw/zinc/35/81/85/408358185.db2.gz	WJDZJRWWWCUWAE-NEPJUHHUSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000246875980	408358189	/nfs/dbraw/zinc/35/81/89/408358189.db2.gz	WJDZJRWWWCUWAE-NEPJUHHUSA-N	1	1	321.377	1.430	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000264429799	408486743	/nfs/dbraw/zinc/48/67/43/408486743.db2.gz	ALRYNXZWEOXSGJ-UZYOAWRESA-N	1	1	319.361	1.445	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](CCO)C(C)C)cccc1[N+](=O)[O-]	ZINC000177032803	408502301	/nfs/dbraw/zinc/50/23/01/408502301.db2.gz	MJUZPIIYSFVBAG-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cn1cncc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000177083854	408513813	/nfs/dbraw/zinc/51/38/13/408513813.db2.gz	BATSCCLIMIDISV-LLVKDONJSA-N	1	1	302.338	1.410	20	5		DDBDMO
Cn1cncc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000177083854	408513821	/nfs/dbraw/zinc/51/38/21/408513821.db2.gz	BATSCCLIMIDISV-LLVKDONJSA-N	1	1	302.338	1.410	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177081882	408514141	/nfs/dbraw/zinc/51/41/41/408514141.db2.gz	XZISOKHRSOTQCL-SCZZXKLOSA-N	1	1	322.340	1.671	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177088008	408516665	/nfs/dbraw/zinc/51/66/65/408516665.db2.gz	LOLMANGLGOBSRZ-VXGBXAGGSA-N	1	1	319.361	1.715	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1O	ZINC000177215241	408555618	/nfs/dbraw/zinc/55/56/18/408555618.db2.gz	JFCZYNDWRPGUJD-UHFFFAOYSA-N	1	1	306.322	1.638	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N1CCC[N@H+](C)CC1	ZINC000162084155	408669765	/nfs/dbraw/zinc/66/97/65/408669765.db2.gz	XQRACQGORZGOBV-UHFFFAOYSA-N	1	1	320.349	1.006	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@H]1O	ZINC000249569046	408743573	/nfs/dbraw/zinc/74/35/73/408743573.db2.gz	NTUAGCVDPLSWLR-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@H]1O	ZINC000249569046	408743577	/nfs/dbraw/zinc/74/35/77/408743577.db2.gz	NTUAGCVDPLSWLR-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1	ZINC000193709929	408740793	/nfs/dbraw/zinc/74/07/93/408740793.db2.gz	HOLFWBJAPVQVAC-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000185126357	408765150	/nfs/dbraw/zinc/76/51/50/408765150.db2.gz	NDDLCHFPWBEEST-GIPWTMENSA-N	1	1	300.380	1.672	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000276134217	408822178	/nfs/dbraw/zinc/82/21/78/408822178.db2.gz	BQFQEEXKUPHLOA-JTQLQIEISA-N	1	1	313.379	1.362	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@](C)(C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000280832182	408843180	/nfs/dbraw/zinc/84/31/80/408843180.db2.gz	WCHXAFPVEILBNA-OAHLLOKOSA-N	1	1	323.349	1.180	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)CCCCO)cccc1[N+](=O)[O-]	ZINC000276460247	408863226	/nfs/dbraw/zinc/86/32/26/408863226.db2.gz	XINHBMSGMLQHOB-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000188742014	163065386	/nfs/dbraw/zinc/06/53/86/163065386.db2.gz	XLSTUWRODIBOIX-LBPRGKRZSA-N	1	1	321.377	1.296	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000188742014	163065390	/nfs/dbraw/zinc/06/53/90/163065390.db2.gz	XLSTUWRODIBOIX-LBPRGKRZSA-N	1	1	321.377	1.296	20	5		DDBDMO
COc1cc(C[NH2+]CC2(C)OCCCO2)c([N+](=O)[O-])cc1O	ZINC000277474107	408947092	/nfs/dbraw/zinc/94/70/92/408947092.db2.gz	RUCXDNQZRAYNMI-UHFFFAOYSA-N	1	1	312.322	1.552	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C	ZINC000277482158	408948821	/nfs/dbraw/zinc/94/88/21/408948821.db2.gz	CPGBAXREHGDQDY-GHMZBOCLSA-N	1	1	319.365	1.362	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000281952718	408959845	/nfs/dbraw/zinc/95/98/45/408959845.db2.gz	FQKFDWBHJKQAIU-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)n1	ZINC000277598568	408974457	/nfs/dbraw/zinc/97/44/57/408974457.db2.gz	TYSQBFBYEIGVPS-LLVKDONJSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000286428182	408982906	/nfs/dbraw/zinc/98/29/06/408982906.db2.gz	IRGUNVOBFGSNHB-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
CCC[C@]1(CO)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000277755322	409005515	/nfs/dbraw/zinc/00/55/15/409005515.db2.gz	LULBGMZOUHTLOJ-OAHLLOKOSA-N	1	1	309.366	1.384	20	5		DDBDMO
C[C@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000287306796	409016639	/nfs/dbraw/zinc/01/66/39/409016639.db2.gz	UNXZXRSNFZCFKW-XHDPSFHLSA-N	1	1	319.361	1.999	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C2)C1	ZINC000293584202	409142818	/nfs/dbraw/zinc/14/28/18/409142818.db2.gz	ANVNIKKECDORLQ-HNNXBMFYSA-N	1	1	307.325	1.902	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000290164629	409312310	/nfs/dbraw/zinc/31/23/10/409312310.db2.gz	PRIYBDUWNMHPCV-UHFFFAOYSA-N	1	1	322.409	1.550	20	5		DDBDMO
CN(CCCN(C)C(=O)c1cccc([N+](=O)[O-])c1)CC[NH+](C)C	ZINC000290164629	409312313	/nfs/dbraw/zinc/31/23/13/409312313.db2.gz	PRIYBDUWNMHPCV-UHFFFAOYSA-N	1	1	322.409	1.550	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000280463449	409315496	/nfs/dbraw/zinc/31/54/96/409315496.db2.gz	FUVYPUHMVFLARJ-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000280518736	409338540	/nfs/dbraw/zinc/33/85/40/409338540.db2.gz	CEZIJUVUBXTCQB-OAHLLOKOSA-N	1	1	307.350	1.561	20	5		DDBDMO
COc1cc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)ccc1[N+](=O)[O-]	ZINC000295161153	409351010	/nfs/dbraw/zinc/35/10/10/409351010.db2.gz	DVGPOEMCHDZZQZ-AWEZNQCLSA-N	1	1	311.313	1.377	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285176786	409402953	/nfs/dbraw/zinc/40/29/53/409402953.db2.gz	BLASBPBJJFAWBI-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCN2CCO[C@H]1C2	ZINC000295379977	409455989	/nfs/dbraw/zinc/45/59/89/409455989.db2.gz	KJENQXSYSJNPIO-CJNGLKHVSA-N	1	1	321.377	1.379	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000317417110	164027070	/nfs/dbraw/zinc/02/70/70/164027070.db2.gz	YIWQBNGOTMTALC-GHMZBOCLSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccc([N+](=O)[O-])c2ncccc12)C1CC1	ZINC000324467570	164051188	/nfs/dbraw/zinc/05/11/88/164051188.db2.gz	ZFTVOBTWXUSMDM-GFCCVEGCSA-N	1	1	317.345	1.977	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000408130120	164237335	/nfs/dbraw/zinc/23/73/35/164237335.db2.gz	SVISMLNEOMLWSX-KOLCDFICSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@@H+](CCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000304230910	409580139	/nfs/dbraw/zinc/58/01/39/409580139.db2.gz	NKTYONTXSMKXNX-UHFFFAOYSA-N	1	1	309.322	1.207	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000354008343	409596782	/nfs/dbraw/zinc/59/67/82/409596782.db2.gz	SINDALPGBYZFNW-NSHDSACASA-N	1	1	309.370	1.079	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000354139156	409689829	/nfs/dbraw/zinc/68/98/29/409689829.db2.gz	PKAFJUXRTVJWJH-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412987	409829523	/nfs/dbraw/zinc/82/95/23/409829523.db2.gz	ZMTAPUSKLHXABR-MFKMUULPSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412987	409829527	/nfs/dbraw/zinc/82/95/27/409829527.db2.gz	ZMTAPUSKLHXABR-MFKMUULPSA-N	1	1	310.350	1.815	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000354374214	409806943	/nfs/dbraw/zinc/80/69/43/409806943.db2.gz	YUWDZAUKWJWKTG-GFCCVEGCSA-N	1	1	308.382	1.928	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000346244103	409869668	/nfs/dbraw/zinc/86/96/68/409869668.db2.gz	UNHIFFSBEGBRHS-JBLDHEPKSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000346244103	409869679	/nfs/dbraw/zinc/86/96/79/409869679.db2.gz	UNHIFFSBEGBRHS-JBLDHEPKSA-N	1	1	321.381	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000346244103	409869689	/nfs/dbraw/zinc/86/96/89/409869689.db2.gz	UNHIFFSBEGBRHS-JBLDHEPKSA-N	1	1	321.381	1.429	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000332309870	410056738	/nfs/dbraw/zinc/05/67/38/410056738.db2.gz	XCILZTUMELFCTK-OLZOCXBDSA-N	1	1	319.361	1.960	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000357701778	410194901	/nfs/dbraw/zinc/19/49/01/410194901.db2.gz	XSIILHYNWIWGGS-MWLCHTKSSA-N	1	1	308.338	1.671	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000298461487	410238869	/nfs/dbraw/zinc/23/88/69/410238869.db2.gz	WRACWMVSJASPBO-UHFFFAOYSA-N	1	1	324.337	1.963	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000351774284	410222941	/nfs/dbraw/zinc/22/29/41/410222941.db2.gz	LHMUFKMPQXOKHC-BHDSKKPTSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2C[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000351774284	410222946	/nfs/dbraw/zinc/22/29/46/410222946.db2.gz	LHMUFKMPQXOKHC-BHDSKKPTSA-N	1	1	323.349	1.243	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H](O)C1	ZINC000351787264	410235264	/nfs/dbraw/zinc/23/52/64/410235264.db2.gz	YTGXOEZMEGSNIZ-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000343538594	410516138	/nfs/dbraw/zinc/51/61/38/410516138.db2.gz	CHXKJNGNBQDXCA-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
CC[N@@H+](C[C@H](C)O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000352187446	410532510	/nfs/dbraw/zinc/53/25/10/410532510.db2.gz	RVSQBMIKZPBOPA-FZMZJTMJSA-N	1	1	307.350	1.403	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291219	410602058	/nfs/dbraw/zinc/60/20/58/410602058.db2.gz	XIRJIPVROBSPNP-DOMZBBRYSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291219	410602064	/nfs/dbraw/zinc/60/20/64/410602064.db2.gz	XIRJIPVROBSPNP-DOMZBBRYSA-N	1	1	321.377	1.881	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000353175782	410831334	/nfs/dbraw/zinc/83/13/34/410831334.db2.gz	YOZLGXIDXXKJTJ-LLVKDONJSA-N	1	1	309.370	1.209	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000353175782	410831343	/nfs/dbraw/zinc/83/13/43/410831343.db2.gz	YOZLGXIDXXKJTJ-LLVKDONJSA-N	1	1	309.370	1.209	20	5		DDBDMO
C[C@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@@H+]1C	ZINC000343962756	410853688	/nfs/dbraw/zinc/85/36/88/410853688.db2.gz	CNBDLTGLTFYFNN-QWRGUYRKSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343962756	410853693	/nfs/dbraw/zinc/85/36/93/410853693.db2.gz	CNBDLTGLTFYFNN-QWRGUYRKSA-N	1	1	313.379	1.356	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCC[N@H+](C)C2	ZINC000356293979	410949621	/nfs/dbraw/zinc/94/96/21/410949621.db2.gz	ITYNTFMXJRTQDJ-MRXNPFEDSA-N	1	1	318.377	1.856	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000344117198	410968141	/nfs/dbraw/zinc/96/81/41/410968141.db2.gz	BLLUILYXXDOUDF-IPYPFGDCSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC1(O)CCC1	ZINC000353480851	411021357	/nfs/dbraw/zinc/02/13/57/411021357.db2.gz	JLJKAWZFHVOMAS-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)Nc1c[nH+]ccc1-n1cccn1	ZINC000356459608	411041111	/nfs/dbraw/zinc/04/11/11/411041111.db2.gz	BXLIDFWZOUYSSB-UHFFFAOYSA-N	1	1	313.277	1.161	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c1C	ZINC000360180856	411091688	/nfs/dbraw/zinc/09/16/88/411091688.db2.gz	NVQPFMGRHHPTFR-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c1C	ZINC000360180856	411091692	/nfs/dbraw/zinc/09/16/92/411091692.db2.gz	NVQPFMGRHHPTFR-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000419010341	226004023	/nfs/dbraw/zinc/00/40/23/226004023.db2.gz	XSEZIOCNOCUCNK-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000419010341	226004028	/nfs/dbraw/zinc/00/40/28/226004028.db2.gz	XSEZIOCNOCUCNK-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H](c2[nH+]ccn2C)C1	ZINC000361043149	418571710	/nfs/dbraw/zinc/57/17/10/418571710.db2.gz	NZWFHIHSAZNJKI-LLVKDONJSA-N	1	1	304.354	1.847	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000191814554	222110572	/nfs/dbraw/zinc/11/05/72/222110572.db2.gz	TXVVSNCAUGSNFM-LBPRGKRZSA-N	1	1	323.397	1.806	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(NCC[N@@H+]3CC=CCC3)n2)cc1	ZINC000338711414	418620177	/nfs/dbraw/zinc/62/01/77/418620177.db2.gz	KNMXFMMAZKGAOR-UHFFFAOYSA-N	1	1	315.333	2.319	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000361293308	418620530	/nfs/dbraw/zinc/62/05/30/418620530.db2.gz	WNBCFRFCADELGR-FZMZJTMJSA-N	1	1	304.350	1.546	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000367825321	418639626	/nfs/dbraw/zinc/63/96/26/418639626.db2.gz	JJGLHMIUEKDREC-LBPRGKRZSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC(C)(C)OC(=O)[C@](C)(O)C[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000361463927	418657064	/nfs/dbraw/zinc/65/70/64/418657064.db2.gz	HRZLKUZCMRIETO-CYBMUJFWSA-N	1	1	316.379	1.839	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@@H]1n1ccnc1	ZINC000371324960	418779974	/nfs/dbraw/zinc/77/99/74/418779974.db2.gz	BLOWXHVWFZAVOA-NEPJUHHUSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@@H]1n1ccnc1	ZINC000371324960	418779975	/nfs/dbraw/zinc/77/99/75/418779975.db2.gz	BLOWXHVWFZAVOA-NEPJUHHUSA-N	1	1	304.354	1.608	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ccc([N+](=O)[O-])cn2)CC1	ZINC000364602768	418792323	/nfs/dbraw/zinc/79/23/23/418792323.db2.gz	HMYYIFKXQPLFBN-UHFFFAOYSA-N	1	1	302.338	1.804	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@H](Cc2ccncc2)C1	ZINC000364762702	418809785	/nfs/dbraw/zinc/80/97/85/418809785.db2.gz	RXIOGFKFZNGYIS-CYBMUJFWSA-N	1	1	301.350	1.788	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])cn1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000372604712	418886614	/nfs/dbraw/zinc/88/66/14/418886614.db2.gz	CLCJHQLCKBNRMP-OAHLLOKOSA-N	1	1	319.409	1.595	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])cn1)[C@@H]1CCN(C2CC[NH+](C)CC2)C1	ZINC000372604712	418886617	/nfs/dbraw/zinc/88/66/17/418886617.db2.gz	CLCJHQLCKBNRMP-OAHLLOKOSA-N	1	1	319.409	1.595	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1	ZINC000372155908	418840581	/nfs/dbraw/zinc/84/05/81/418840581.db2.gz	HVBCRMVCOPUPMB-JSGCOSHPSA-N	1	1	319.361	1.552	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000420930637	419362268	/nfs/dbraw/zinc/36/22/68/419362268.db2.gz	CRRPVFNDTKNSIB-OLZOCXBDSA-N	1	1	321.377	1.874	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000411622367	419362536	/nfs/dbraw/zinc/36/25/36/419362536.db2.gz	SSPCSOVGJBWALQ-SOUVJXGZSA-N	1	1	303.362	1.909	20	5		DDBDMO
COC(=O)[C@H]1CN(Cc2cccc([N+](=O)[O-])c2C)CC[N@@H+](C)C1	ZINC000411915464	419486069	/nfs/dbraw/zinc/48/60/69/419486069.db2.gz	ZHDQRJLCOIWNPI-CQSZACIVSA-N	1	1	321.377	1.440	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CO)[C@H]1C	ZINC000412063462	419609829	/nfs/dbraw/zinc/60/98/29/419609829.db2.gz	BBSACGKTVXDMOM-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CO)[C@H]1C	ZINC000412063462	419609834	/nfs/dbraw/zinc/60/98/34/419609834.db2.gz	BBSACGKTVXDMOM-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000421700062	419682988	/nfs/dbraw/zinc/68/29/88/419682988.db2.gz	CXXJNMBQJPLKPC-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nccc4c3cccc4[N+](=O)[O-])C[C@@H]21	ZINC000413468571	419786208	/nfs/dbraw/zinc/78/62/08/419786208.db2.gz	HUHDAXRSLLDTNV-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000299338843	229060218	/nfs/dbraw/zinc/06/02/18/229060218.db2.gz	JVUGCNOVZJHAMH-UHFFFAOYSA-N	1	1	305.334	1.280	20	5		DDBDMO
CC(C)(C)[C@H](C[NH3+])NCCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420360306	420235082	/nfs/dbraw/zinc/23/50/82/420235082.db2.gz	LACLCCRHBGYHNP-ZDUSSCGKSA-N	1	1	308.382	1.886	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000423974078	420288756	/nfs/dbraw/zinc/28/87/56/420288756.db2.gz	RQCJMDXLTSYKGV-NSHDSACASA-N	1	1	318.358	1.838	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000430947494	420220241	/nfs/dbraw/zinc/22/02/41/420220241.db2.gz	BHDWQTNXGYSWRK-NEPJUHHUSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444688244	230121429	/nfs/dbraw/zinc/12/14/29/230121429.db2.gz	IXNNWQYUAJKGKC-GHMZBOCLSA-N	1	1	303.366	1.996	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@H+]2CCCC2(C)C)c1[N+](=O)[O-]	ZINC000457080687	420604233	/nfs/dbraw/zinc/60/42/33/420604233.db2.gz	URPUAIUUIPFCJE-UHFFFAOYSA-N	1	1	309.370	1.485	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1c2ccccc2ncc1[N+](=O)[O-]	ZINC000487933134	421058338	/nfs/dbraw/zinc/05/83/38/421058338.db2.gz	SYMCNWSXKCGOBG-UHFFFAOYSA-N	1	1	318.377	1.945	20	5		DDBDMO
COC(=O)C1(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000450557147	421210112	/nfs/dbraw/zinc/21/01/12/421210112.db2.gz	BMMNJAXMSMMXJE-NSHDSACASA-N	1	1	320.349	1.429	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000514750070	421451186	/nfs/dbraw/zinc/45/11/86/421451186.db2.gz	KJGBNWAJACZZEB-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000514750070	421451188	/nfs/dbraw/zinc/45/11/88/421451188.db2.gz	KJGBNWAJACZZEB-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548059750	421394173	/nfs/dbraw/zinc/39/41/73/421394173.db2.gz	XDWMFJIXXWSKNJ-SNVBAGLBSA-N	1	1	307.354	1.176	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548714398	421465412	/nfs/dbraw/zinc/46/54/12/421465412.db2.gz	WCSAKWJXGXBNQQ-NSHDSACASA-N	1	1	321.381	1.566	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1ccccn1	ZINC000551270342	421529710	/nfs/dbraw/zinc/52/97/10/421529710.db2.gz	GVGSPAKFHOQYOC-OAHLLOKOSA-N	1	1	314.345	1.989	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])cn1	ZINC000517484688	421614561	/nfs/dbraw/zinc/61/45/61/421614561.db2.gz	VGKKCMJFIPZISG-LBPRGKRZSA-N	1	1	304.350	1.737	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000531634630	421641604	/nfs/dbraw/zinc/64/16/04/421641604.db2.gz	BSILMQBNOYCVHL-FZMZJTMJSA-N	1	1	306.366	1.792	20	5		DDBDMO
O=C(N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])[nH]1	ZINC000531665066	421642921	/nfs/dbraw/zinc/64/29/21/421642921.db2.gz	PIVDEXDLUCWNTJ-YPMHNXCESA-N	1	1	322.365	1.296	20	5		DDBDMO
[NH3+]CC(F)(F)CC(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000583448316	422168793	/nfs/dbraw/zinc/16/87/93/422168793.db2.gz	XKXVYIVMUPVYHA-UHFFFAOYSA-N	1	1	307.684	1.849	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2ccc(N)c([N+](=O)[O-])n2)[C@H]1c1ccccc1	ZINC000590582371	422319746	/nfs/dbraw/zinc/31/97/46/422319746.db2.gz	QUYRIZTUSIZDHK-DZGCQCFKSA-N	1	1	313.361	2.429	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000597860252	422391870	/nfs/dbraw/zinc/39/18/70/422391870.db2.gz	MPLWMPYVUURLNL-SNVBAGLBSA-N	1	1	321.381	1.422	20	5		DDBDMO
COC(=O)c1ccnc(NCCCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000598630887	422397756	/nfs/dbraw/zinc/39/77/56/422397756.db2.gz	IFLPBDJGUOXIDJ-UHFFFAOYSA-N	1	1	322.365	2.063	20	5		DDBDMO
Cc1cc(NCCCN2CCC[N@H+](C)CC2)ncc1[N+](=O)[O-]	ZINC000610430875	422466724	/nfs/dbraw/zinc/46/67/24/422466724.db2.gz	SBVPORAMDYBERG-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCCN(C)CC2)ncc1[N+](=O)[O-]	ZINC000610430875	422466729	/nfs/dbraw/zinc/46/67/29/422466729.db2.gz	SBVPORAMDYBERG-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cc(NCCC[N@@H+]2CCCN(C)CC2)ncc1[N+](=O)[O-]	ZINC000610430875	422466732	/nfs/dbraw/zinc/46/67/32/422466732.db2.gz	SBVPORAMDYBERG-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]2COCC[C@H]21	ZINC000341583123	271128028	/nfs/dbraw/zinc/12/80/28/271128028.db2.gz	UISULLXAWUIHOU-TZMCWYRMSA-N	1	1	307.350	1.257	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])ccc2=O)on1	ZINC000341609218	271138521	/nfs/dbraw/zinc/13/85/21/271138521.db2.gz	SBVDFSCDBOMGRX-CYBMUJFWSA-N	1	1	318.333	1.890	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)on1	ZINC000341609218	271138525	/nfs/dbraw/zinc/13/85/25/271138525.db2.gz	SBVDFSCDBOMGRX-CYBMUJFWSA-N	1	1	318.333	1.890	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CC[NH3+])Cc2ccccc2)c1[N+](=O)[O-]	ZINC000343790710	271872159	/nfs/dbraw/zinc/87/21/59/271872159.db2.gz	WKKANZHQXWNJDP-UHFFFAOYSA-N	1	1	303.322	1.227	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+](C2CCC2)C1	ZINC000344730678	272102591	/nfs/dbraw/zinc/10/25/91/272102591.db2.gz	PHXNXZCKVRYQAQ-LLVKDONJSA-N	1	1	306.366	1.869	20	5		DDBDMO
CC(C)NC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000345629825	272293739	/nfs/dbraw/zinc/29/37/39/272293739.db2.gz	FAVVDZLPVSCSAW-NSHDSACASA-N	1	1	307.354	1.001	20	5		DDBDMO
CC(C)NC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000345629825	272293740	/nfs/dbraw/zinc/29/37/40/272293740.db2.gz	FAVVDZLPVSCSAW-NSHDSACASA-N	1	1	307.354	1.001	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2C)C[C@H]1C	ZINC000345924844	272366474	/nfs/dbraw/zinc/36/64/74/272366474.db2.gz	SAIMDUFOGUAZRS-MNOVXSKESA-N	1	1	306.366	1.853	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000345962907	272376969	/nfs/dbraw/zinc/37/69/69/272376969.db2.gz	PTDVYNBGDNIVOT-QWRGUYRKSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000264892474	276070863	/nfs/dbraw/zinc/07/08/63/276070863.db2.gz	KAAZGGWJJHKLIY-UHFFFAOYSA-N	1	1	320.393	1.877	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)C[C@H]1CCC[N@H+]1C	ZINC000420993406	279236216	/nfs/dbraw/zinc/23/62/16/279236216.db2.gz	ATBYJVMNQOVPLL-IUODEOHRSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC000449122703	298618608	/nfs/dbraw/zinc/61/86/08/298618608.db2.gz	MKUYDOOLXQNXFS-LSDHHAIUSA-N	1	1	320.437	1.751	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@@H](C3CC3)C2)c1	ZINC000362579771	300101434	/nfs/dbraw/zinc/10/14/34/300101434.db2.gz	XRVFWAOSSOQKTB-GDBMZVCRSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@@H](C3CC3)C2)c1	ZINC000362579771	300101435	/nfs/dbraw/zinc/10/14/35/300101435.db2.gz	XRVFWAOSSOQKTB-GDBMZVCRSA-N	1	1	322.361	1.445	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000364452439	300399086	/nfs/dbraw/zinc/39/90/86/300399086.db2.gz	FFKIFNHVHFXAQD-NSHDSACASA-N	1	1	318.377	1.924	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CC[NH2+]C[C@H]1C(F)F	ZINC000367288421	300822588	/nfs/dbraw/zinc/82/25/88/300822588.db2.gz	XEYYPJGDGITHAP-JTQLQIEISA-N	1	1	319.695	1.927	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000368007800	300932133	/nfs/dbraw/zinc/93/21/33/300932133.db2.gz	RKVPVNNLSWOUKY-NSHDSACASA-N	1	1	315.276	1.039	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2CC[N@H+](C)[C@@H]2C1	ZINC000368595211	301061178	/nfs/dbraw/zinc/06/11/78/301061178.db2.gz	SIERBSLNASWEIP-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCOC2)O1	ZINC000369546953	301196551	/nfs/dbraw/zinc/19/65/51/301196551.db2.gz	RCXPJEHGLQOKPW-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC3(CCOCC3)CC2)c1	ZINC000377276722	302163618	/nfs/dbraw/zinc/16/36/18/302163618.db2.gz	IIFYLFLEPSKFCN-UHFFFAOYSA-N	1	1	310.354	1.063	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000377481814	302184062	/nfs/dbraw/zinc/18/40/62/302184062.db2.gz	OPIPQXOXQITNGV-HUUCEWRRSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377656188	302205733	/nfs/dbraw/zinc/20/57/33/302205733.db2.gz	RCVKYVSHQWBVNC-ZYHUDNBSSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377656188	302205735	/nfs/dbraw/zinc/20/57/35/302205735.db2.gz	RCVKYVSHQWBVNC-ZYHUDNBSSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C(NCC[N@H+]1CC=CCC1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000530304851	303191876	/nfs/dbraw/zinc/19/18/76/303191876.db2.gz	DPWIDDIAMPDGAS-UHFFFAOYSA-N	1	1	319.317	1.315	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000530304851	303191878	/nfs/dbraw/zinc/19/18/78/303191878.db2.gz	DPWIDDIAMPDGAS-UHFFFAOYSA-N	1	1	319.317	1.315	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000531804459	303257769	/nfs/dbraw/zinc/25/77/69/303257769.db2.gz	ZPGCKLGGYGKRCB-XHDPSFHLSA-N	1	1	318.377	1.877	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@@H]1C	ZINC000532134479	303276223	/nfs/dbraw/zinc/27/62/23/303276223.db2.gz	ZCMFMQXNBZBRBK-RYUDHWBXSA-N	1	1	306.366	1.983	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000533230221	303314338	/nfs/dbraw/zinc/31/43/38/303314338.db2.gz	YNSCCJALPQTSGY-JTQLQIEISA-N	1	1	309.370	1.513	20	5		DDBDMO
CN1CCC[C@@H]([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000538712079	303389889	/nfs/dbraw/zinc/38/98/89/303389889.db2.gz	PLRAFLFAFQYICM-DGCLKSJQSA-N	1	1	319.365	1.097	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](O)(C2CC2)C1	ZINC000365115560	307059119	/nfs/dbraw/zinc/05/91/19/307059119.db2.gz	ZTSFIBGLJOAREM-MEDUHNTESA-N	1	1	319.361	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365115560	307059120	/nfs/dbraw/zinc/05/91/20/307059120.db2.gz	ZTSFIBGLJOAREM-MEDUHNTESA-N	1	1	319.361	1.769	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@H](c3nnc[nH]3)C2)c1	ZINC000366652337	307078786	/nfs/dbraw/zinc/07/87/86/307078786.db2.gz	KMPDFEYWEMVKTL-GXTWGEPZSA-N	1	1	317.349	1.626	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@]2(C1)CCCOC2	ZINC000367075220	307084752	/nfs/dbraw/zinc/08/47/52/307084752.db2.gz	SZKFUXDBSCDRJF-HNNXBMFYSA-N	1	1	307.350	1.259	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000371664637	307155744	/nfs/dbraw/zinc/15/57/44/307155744.db2.gz	WJSVTCAFOVYNQP-CHWSQXEVSA-N	1	1	309.391	1.494	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)nc1	ZINC000371892911	307159658	/nfs/dbraw/zinc/15/96/58/307159658.db2.gz	BOZOJJHHZZXAGI-OLZOCXBDSA-N	1	1	307.354	1.440	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000376758803	307256028	/nfs/dbraw/zinc/25/60/28/307256028.db2.gz	RDCMYEFBKLYAIQ-HNNXBMFYSA-N	1	1	321.377	1.316	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000376758803	307256029	/nfs/dbraw/zinc/25/60/29/307256029.db2.gz	RDCMYEFBKLYAIQ-HNNXBMFYSA-N	1	1	321.377	1.316	20	5		DDBDMO
[NH3+][C@@H]1CCCC[C@H]1NCCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000424335872	307301345	/nfs/dbraw/zinc/30/13/45/307301345.db2.gz	POXFOIJGKXSTIL-ZIAGYGMSSA-N	1	1	306.366	1.783	20	5		DDBDMO
N[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000424335872	307301346	/nfs/dbraw/zinc/30/13/46/307301346.db2.gz	POXFOIJGKXSTIL-ZIAGYGMSSA-N	1	1	306.366	1.783	20	5		DDBDMO
[NH3+]C[C@H]1CC[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000382486480	325745674	/nfs/dbraw/zinc/74/56/74/325745674.db2.gz	GTGOHOPRRAUTAQ-DTWKUNHWSA-N	1	1	317.342	1.140	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000584308593	332236402	/nfs/dbraw/zinc/23/64/02/332236402.db2.gz	OXUGFTWVLFOXSY-MNOVXSKESA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000584308593	332236403	/nfs/dbraw/zinc/23/64/03/332236403.db2.gz	OXUGFTWVLFOXSY-MNOVXSKESA-N	1	1	322.365	1.614	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]2C[NH2+]C[C@H]21	ZINC000582706658	337127054	/nfs/dbraw/zinc/12/70/54/337127054.db2.gz	QUAGSZNPGUAKCI-TVQRCGJNSA-N	1	1	315.333	1.295	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C[C@H](O)C(F)(F)F)nc2c1	ZINC000563003300	484331427	/nfs/dbraw/zinc/33/14/27/484331427.db2.gz	QLQZBMUZSRWCRY-VIFPVBQESA-N	1	1	304.228	1.484	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)c([N+](=O)[O-])c1	ZINC000292587739	534481641	/nfs/dbraw/zinc/48/16/41/534481641.db2.gz	CSOCDEPWPDQTHH-CQSZACIVSA-N	1	1	319.361	1.573	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21	ZINC000157291218	527312187	/nfs/dbraw/zinc/31/21/87/527312187.db2.gz	RWEKLBAYMSAYKS-DOMZBBRYSA-N	1	1	318.377	1.855	20	5		DDBDMO
CN(c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000736859242	599119678	/nfs/dbraw/zinc/11/96/78/599119678.db2.gz	XVELZNCXMDJXKQ-LLVKDONJSA-N	1	1	317.353	1.305	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000820717103	606713721	/nfs/dbraw/zinc/71/37/21/606713721.db2.gz	NWDGKZDQGZWYJG-VIFPVBQESA-N	1	1	318.341	1.066	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000824860763	608196965	/nfs/dbraw/zinc/19/69/65/608196965.db2.gz	XSOQJIDPFURYPR-VHSXEESVSA-N	1	1	317.353	1.304	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C(C)C	ZINC000102481180	696610776	/nfs/dbraw/zinc/61/07/76/696610776.db2.gz	URTAIDKUQYNRJR-UHFFFAOYSA-N	1	1	324.337	1.963	20	5		DDBDMO
CCC[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000159791557	697312341	/nfs/dbraw/zinc/31/23/41/697312341.db2.gz	NZUSGTMLNJSVBV-ZDUSSCGKSA-N	1	1	311.386	1.182	20	5		DDBDMO
Cc1nocc1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985431710	697510150	/nfs/dbraw/zinc/51/01/50/697510150.db2.gz	SGJWIIJBAYPTAU-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1nocc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985431710	697510152	/nfs/dbraw/zinc/51/01/52/697510152.db2.gz	SGJWIIJBAYPTAU-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1nocc1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985431710	697510153	/nfs/dbraw/zinc/51/01/53/697510153.db2.gz	SGJWIIJBAYPTAU-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN2CC[NH+]([C@H]3CCOC3)CC2)cc1	ZINC000776593480	698124135	/nfs/dbraw/zinc/12/41/35/698124135.db2.gz	JVTARQUHJAORIA-HOTGVXAUSA-N	1	1	321.377	1.035	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854193	698143905	/nfs/dbraw/zinc/14/39/05/698143905.db2.gz	PZKWPPHBZIBTOB-RISCZKNCSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854193	698143910	/nfs/dbraw/zinc/14/39/10/698143910.db2.gz	PZKWPPHBZIBTOB-RISCZKNCSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000789334031	699378038	/nfs/dbraw/zinc/37/80/38/699378038.db2.gz	FUTRFFVAIWCMTP-BBRMVZONSA-N	1	1	323.393	1.281	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000741720101	699849093	/nfs/dbraw/zinc/84/90/93/699849093.db2.gz	DZIJVNBNCURBSR-GXSJLCMTSA-N	1	1	322.321	1.716	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c1	ZINC000742058397	699858839	/nfs/dbraw/zinc/85/88/39/699858839.db2.gz	BDMDYHXZBOONGU-QWHCGFSZSA-N	1	1	319.361	1.496	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000742197009	699865923	/nfs/dbraw/zinc/86/59/23/699865923.db2.gz	OQHUUQRUAQDOAE-JTQLQIEISA-N	1	1	321.333	1.158	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000742197009	699865925	/nfs/dbraw/zinc/86/59/25/699865925.db2.gz	OQHUUQRUAQDOAE-JTQLQIEISA-N	1	1	321.333	1.158	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@@H+]1C	ZINC000742199005	699866367	/nfs/dbraw/zinc/86/63/67/699866367.db2.gz	OUKGRLZEOLHKIL-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1C	ZINC000742199005	699866370	/nfs/dbraw/zinc/86/63/70/699866370.db2.gz	OUKGRLZEOLHKIL-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OCCCCn2cc[nH+]c2C)n1	ZINC000755573509	700571584	/nfs/dbraw/zinc/57/15/84/700571584.db2.gz	NKEVQJRDOMEENT-UHFFFAOYSA-N	1	1	321.337	1.953	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](c3nccn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000755790996	700584566	/nfs/dbraw/zinc/58/45/66/700584566.db2.gz	URMFEBXEPAADFZ-LBPRGKRZSA-N	1	1	304.354	1.589	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@H](c3nccn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000755790996	700584568	/nfs/dbraw/zinc/58/45/68/700584568.db2.gz	URMFEBXEPAADFZ-LBPRGKRZSA-N	1	1	304.354	1.589	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)N2CC[N@@H+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761076319	700840360	/nfs/dbraw/zinc/84/03/60/700840360.db2.gz	NRRLOSOLCXRHFT-DGCLKSJQSA-N	1	1	320.393	1.866	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000879133289	706595869	/nfs/dbraw/zinc/59/58/69/706595869.db2.gz	CVQMMJVAEOFLSY-PEYYIBSZSA-N	1	1	322.361	1.759	20	5		DDBDMO
Cc1cc2c(cc1[N+](=O)[O-])N(C[C@H](O)C[N@H+](C)C1CC1)CC2	ZINC000809970535	701707709	/nfs/dbraw/zinc/70/77/09/701707709.db2.gz	CBKZUOAUHXFUFF-CQSZACIVSA-N	1	1	305.378	1.721	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839636458	701761405	/nfs/dbraw/zinc/76/14/05/701761405.db2.gz	SJTBTCKHEMACLK-OCCSQVGLSA-N	1	1	307.350	1.038	20	5		DDBDMO
O=C1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CCCCCCN1	ZINC000879254424	706630104	/nfs/dbraw/zinc/63/01/04/706630104.db2.gz	ZZXUQMGHMUTAEC-UHFFFAOYSA-N	1	1	309.370	1.174	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000840133829	701989480	/nfs/dbraw/zinc/98/94/80/701989480.db2.gz	UHRIWYQOIAGHOC-DOMZBBRYSA-N	1	1	301.350	1.538	20	5		DDBDMO
COC(=O)[C@H]1CN(c2cccc(F)c2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000840357418	702082246	/nfs/dbraw/zinc/08/22/46/702082246.db2.gz	DSRUGQIBLKGFCK-SNVBAGLBSA-N	1	1	311.313	1.275	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@](O)(C(F)F)C2)cc1	ZINC000831175543	706650624	/nfs/dbraw/zinc/65/06/24/706650624.db2.gz	LMYQXBGVAGAOLT-DGCLKSJQSA-N	1	1	302.277	1.330	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](n3cccn3)C2)cc1	ZINC000812876675	702256726	/nfs/dbraw/zinc/25/67/26/702256726.db2.gz	OGRVMWVDKNDWRN-LSDHHAIUSA-N	1	1	302.334	1.772	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](COC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000842829380	702781113	/nfs/dbraw/zinc/78/11/13/702781113.db2.gz	HNSAFYVJSPCOQQ-LLVKDONJSA-N	1	1	310.354	1.606	20	5		DDBDMO
CCCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000843992219	702950288	/nfs/dbraw/zinc/95/02/88/702950288.db2.gz	BEAPHMVULYXMGV-LBPRGKRZSA-N	1	1	306.366	1.733	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485941	703556085	/nfs/dbraw/zinc/55/60/85/703556085.db2.gz	BEDOXGMMEVRBFL-IUODEOHRSA-N	1	1	321.377	1.835	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485941	703556086	/nfs/dbraw/zinc/55/60/86/703556086.db2.gz	BEDOXGMMEVRBFL-IUODEOHRSA-N	1	1	321.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CC[N@H+](CC3CC3)C2)cc1	ZINC000819039576	704056575	/nfs/dbraw/zinc/05/65/75/704056575.db2.gz	RWDVJMDVCPPHRG-ZBFHGGJFSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CC[N@@H+](CC3CC3)C2)cc1	ZINC000819039576	704056580	/nfs/dbraw/zinc/05/65/80/704056580.db2.gz	RWDVJMDVCPPHRG-ZBFHGGJFSA-N	1	1	305.378	1.702	20	5		DDBDMO
CCn1nc(C)c(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819378919	704116683	/nfs/dbraw/zinc/11/66/83/704116683.db2.gz	ABLFCZIJOUOKML-CQSZACIVSA-N	1	1	305.338	1.338	20	5		DDBDMO
CCOC1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000870948057	704178883	/nfs/dbraw/zinc/17/88/83/704178883.db2.gz	CGJGGBHMXBWDIG-MRXNPFEDSA-N	1	1	321.377	1.796	20	5		DDBDMO
O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@@H+]1CC[C@@H]2C[C@@H]2C1	ZINC000853576540	704273974	/nfs/dbraw/zinc/27/39/74/704273974.db2.gz	PKHWYIUOQXZAQB-GHMZBOCLSA-N	1	1	316.317	1.711	20	5		DDBDMO
O=c1oc(-c2ccccc2[N+](=O)[O-])nn1C[N@H+]1CC[C@@H]2C[C@@H]2C1	ZINC000853576540	704273975	/nfs/dbraw/zinc/27/39/75/704273975.db2.gz	PKHWYIUOQXZAQB-GHMZBOCLSA-N	1	1	316.317	1.711	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC000853587165	704276877	/nfs/dbraw/zinc/27/68/77/704276877.db2.gz	FZHUKHOJHPWXHH-RYUDHWBXSA-N	1	1	317.349	1.574	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([NH+]3CCOCC3)CC2)n1	ZINC000858633309	704737849	/nfs/dbraw/zinc/73/78/49/704737849.db2.gz	ZDWCQHYYCPJFAG-UHFFFAOYSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000874834295	705192342	/nfs/dbraw/zinc/19/23/42/705192342.db2.gz	QWBCFIGOYMITMK-UONOGXRCSA-N	1	1	304.350	1.486	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842035	705196604	/nfs/dbraw/zinc/19/66/04/705196604.db2.gz	ZNFYMKGSWSYDER-GHMZBOCLSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874842035	705196606	/nfs/dbraw/zinc/19/66/06/705196606.db2.gz	ZNFYMKGSWSYDER-GHMZBOCLSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842035	705196610	/nfs/dbraw/zinc/19/66/10/705196610.db2.gz	ZNFYMKGSWSYDER-GHMZBOCLSA-N	1	1	307.354	1.189	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000823975091	705348219	/nfs/dbraw/zinc/34/82/19/705348219.db2.gz	ZTUHSIBGFWBXCX-SNVBAGLBSA-N	1	1	307.354	1.735	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000861352435	705441291	/nfs/dbraw/zinc/44/12/91/705441291.db2.gz	JDISQSIEPGTBPT-BXUZGUMPSA-N	1	1	302.371	1.474	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)NCCc3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000893877379	710871004	/nfs/dbraw/zinc/87/10/04/710871004.db2.gz	VWLHGKYBDLIYBU-OKILXGFUSA-N	1	1	318.377	1.340	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	ZINC000861387312	705453731	/nfs/dbraw/zinc/45/37/31/705453731.db2.gz	HJNMABJXSFFWCZ-UHFFFAOYSA-N	1	1	317.305	1.038	20	5		DDBDMO
CN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000825844528	705736149	/nfs/dbraw/zinc/73/61/49/705736149.db2.gz	MCYCXIWNSHGNLL-CABCVRRESA-N	1	1	319.361	1.323	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000862793314	705799799	/nfs/dbraw/zinc/79/97/99/705799799.db2.gz	MONQSOJZCPMAPL-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC[C@H]21	ZINC000827331138	705977606	/nfs/dbraw/zinc/97/76/06/705977606.db2.gz	WSHUUTLNZSDACW-GXFFZTMASA-N	1	1	307.325	1.900	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827366714	705986475	/nfs/dbraw/zinc/98/64/75/705986475.db2.gz	OHOYIEYVMKANON-TZMCWYRMSA-N	1	1	318.377	1.803	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000877608178	706158221	/nfs/dbraw/zinc/15/82/21/706158221.db2.gz	ODRSQNPIKDUHAW-CHWSQXEVSA-N	1	1	322.361	1.567	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832845619	706996013	/nfs/dbraw/zinc/99/60/13/706996013.db2.gz	PCUXPUDCXYGGFE-WFASDCNBSA-N	1	1	323.393	1.865	20	5		DDBDMO
CC(C)C[C@@H](C(N)=O)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000880587590	707029018	/nfs/dbraw/zinc/02/90/18/707029018.db2.gz	HXMJFPZWTZJSBX-ZDUSSCGKSA-N	1	1	309.366	1.805	20	5		DDBDMO
CCO[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CN(C)C	ZINC000926964187	712923266	/nfs/dbraw/zinc/92/32/66/712923266.db2.gz	WKIYALGJDGAGJN-YPMHNXCESA-N	1	1	310.398	1.794	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000837445771	707650088	/nfs/dbraw/zinc/65/00/88/707650088.db2.gz	GHHMUSAUABOYMT-LBPRGKRZSA-N	1	1	310.354	1.597	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@H](CO)C[C@H]3CCCO3)c2c1	ZINC000884614248	708339183	/nfs/dbraw/zinc/33/91/83/708339183.db2.gz	IITSMZHKAPYOBM-WCQYABFASA-N	1	1	317.345	1.907	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H]1CN1CCOCC1	ZINC000886020472	708682640	/nfs/dbraw/zinc/68/26/40/708682640.db2.gz	AHORHOSPSFISKR-CQSZACIVSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H]1CN1CCOCC1	ZINC000886020472	708682641	/nfs/dbraw/zinc/68/26/41/708682641.db2.gz	AHORHOSPSFISKR-CQSZACIVSA-N	1	1	306.366	1.286	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000886593528	708785751	/nfs/dbraw/zinc/78/57/51/708785751.db2.gz	SPGWJKXLOOJURP-CYBMUJFWSA-N	1	1	323.397	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@](CO)(C(F)(F)F)C1	ZINC000886813631	708851015	/nfs/dbraw/zinc/85/10/15/708851015.db2.gz	QREWFXOKTHSEIB-NSHDSACASA-N	1	1	322.287	1.346	20	5		DDBDMO
C[N@H+](CCc1ccc2c(c1)OCO2)CCn1cc([N+](=O)[O-])cn1	ZINC000887095361	708953990	/nfs/dbraw/zinc/95/39/90/708953990.db2.gz	JGKPMDJHMBMKSU-UHFFFAOYSA-N	1	1	318.333	1.695	20	5		DDBDMO
Cc1sc(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cc1[N+](=O)[O-]	ZINC000887936737	709172343	/nfs/dbraw/zinc/17/23/43/709172343.db2.gz	VTTZXKGUIDPKKJ-YGRLFVJLSA-N	1	1	309.391	1.988	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC(C)(C)C2)n1	ZINC000890072220	709733513	/nfs/dbraw/zinc/73/35/13/709733513.db2.gz	KCAOGCOIUVXVHD-UHFFFAOYSA-N	1	1	309.370	1.273	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000910279573	709861496	/nfs/dbraw/zinc/86/14/96/709861496.db2.gz	BPCCTTVZPLDKQV-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@@H+]1CCCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000910279573	709861499	/nfs/dbraw/zinc/86/14/99/709861499.db2.gz	BPCCTTVZPLDKQV-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000910279573	709861504	/nfs/dbraw/zinc/86/15/04/709861504.db2.gz	BPCCTTVZPLDKQV-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C	ZINC000928440065	713196954	/nfs/dbraw/zinc/19/69/54/713196954.db2.gz	AMGROLIEJPFZIE-ZANVPECISA-N	1	1	311.769	2.000	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1cccc(C(F)(F)F)c1[N+](=O)[O-]	ZINC000894590743	711198402	/nfs/dbraw/zinc/19/84/02/711198402.db2.gz	HAVDIDOTLJEKSY-UHFFFAOYSA-N	1	1	321.299	1.974	20	5		DDBDMO
CC(=O)c1ccc(N[C@@H](C)[C@@H]2C[N@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246145	711463928	/nfs/dbraw/zinc/46/39/28/711463928.db2.gz	LVWVGFMQPQAHIM-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246145	711463929	/nfs/dbraw/zinc/46/39/29/711463929.db2.gz	LVWVGFMQPQAHIM-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1	ZINC000895703737	711582592	/nfs/dbraw/zinc/58/25/92/711582592.db2.gz	ONLYQPWFAWEBAX-RCLKMUNOSA-N	1	1	320.345	1.608	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000896568495	711754730	/nfs/dbraw/zinc/75/47/30/711754730.db2.gz	NLSJDHOVGYFGJI-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
CCO[C@@H](C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CN(C)C	ZINC000905581903	712085603	/nfs/dbraw/zinc/08/56/03/712085603.db2.gz	ZPCMKYYWNGWQMR-LSDHHAIUSA-N	1	1	311.382	1.185	20	5		DDBDMO
CCC[N@H+]1CCC[C@H](C(=O)NCCn2cc([N+](=O)[O-])cn2)C1	ZINC000907066050	712478750	/nfs/dbraw/zinc/47/87/50/712478750.db2.gz	SVJUWFDOOKEETD-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C	ZINC000929778920	713688695	/nfs/dbraw/zinc/68/86/95/713688695.db2.gz	KSNRRSVNOIAULF-NWDGAFQWSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C	ZINC000929778920	713688696	/nfs/dbraw/zinc/68/86/96/713688696.db2.gz	KSNRRSVNOIAULF-NWDGAFQWSA-N	1	1	301.387	1.888	20	5		DDBDMO
O=[N+]([O-])CC[NH+]1CCC([C@@H](O)c2cc(F)ccc2F)CC1	ZINC000930696878	713898581	/nfs/dbraw/zinc/89/85/81/713898581.db2.gz	UYLFKGJWTDKPBS-CQSZACIVSA-N	1	1	300.305	1.987	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000931627343	714142070	/nfs/dbraw/zinc/14/20/70/714142070.db2.gz	NVLMIROGUDLLCA-HUUCEWRRSA-N	1	1	321.377	1.393	20	5		DDBDMO
C[C@@]1([C@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)COC(=O)N1	ZINC000932016809	714235915	/nfs/dbraw/zinc/23/59/15/714235915.db2.gz	PLDAUXNTJOCUFG-WFASDCNBSA-N	1	1	320.349	1.700	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000923311944	714307623	/nfs/dbraw/zinc/30/76/23/714307623.db2.gz	CHSSYZCQOOIWAV-GXTWGEPZSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@H]1[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923370496	714331186	/nfs/dbraw/zinc/33/11/86/714331186.db2.gz	PHLSTBNHCOKJCQ-NCZKRNLISA-N	1	1	323.393	1.311	20	5		DDBDMO
CC(C)(CCc1noc([C@H]2C[N@H+]3CCC[C@H]3CO2)n1)[N+](=O)[O-]	ZINC000924079310	714522230	/nfs/dbraw/zinc/52/22/30/714522230.db2.gz	UPRLWAYAHFVBOW-WDEREUQCSA-N	1	1	310.354	1.593	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC000933734332	714658367	/nfs/dbraw/zinc/65/83/67/714658367.db2.gz	OATGXUPMTANCDT-XJKSGUPXSA-N	1	1	305.378	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934260299	714778173	/nfs/dbraw/zinc/77/81/73/714778173.db2.gz	WDBIAULKMYMJLT-JKSUJKDBSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOC[C@H]2CC2CCOCC2)n1	ZINC000934640932	714868621	/nfs/dbraw/zinc/86/86/21/714868621.db2.gz	JLJPLGBFLJGHSJ-CQSZACIVSA-N	1	1	324.381	1.309	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC[C@H]2CC2CCOCC2)n1	ZINC000934640932	714868623	/nfs/dbraw/zinc/86/86/23/714868623.db2.gz	JLJPLGBFLJGHSJ-CQSZACIVSA-N	1	1	324.381	1.309	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC2(CCC[N@@H+]2C)CC1	ZINC000935219266	715006338	/nfs/dbraw/zinc/00/63/38/715006338.db2.gz	CXGKESKHOMXLED-UHFFFAOYSA-N	1	1	321.381	1.187	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC001164637379	719160332	/nfs/dbraw/zinc/16/03/32/719160332.db2.gz	OKGXOHOZYHVQBG-ZJUUUORDSA-N	1	1	308.338	1.305	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001164638895	719217072	/nfs/dbraw/zinc/21/70/72/719217072.db2.gz	PSXUZRQZNFFMPY-RKDXNWHRSA-N	1	1	300.746	1.410	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001164638895	719217076	/nfs/dbraw/zinc/21/70/76/719217076.db2.gz	PSXUZRQZNFFMPY-RKDXNWHRSA-N	1	1	300.746	1.410	20	5		DDBDMO
Cc1cnc(N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922019	721849555	/nfs/dbraw/zinc/84/95/55/721849555.db2.gz	PQLPXMCEHCNYNH-KBPBESRZSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1cnc(N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922019	721849556	/nfs/dbraw/zinc/84/95/56/721849556.db2.gz	PQLPXMCEHCNYNH-KBPBESRZSA-N	1	1	319.409	1.513	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC001167778648	738256491	/nfs/dbraw/zinc/25/64/91/738256491.db2.gz	JZEUDNPHWHDTPD-LBPRGKRZSA-N	1	1	319.365	1.002	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](O)C1CC1	ZINC001191487274	745520374	/nfs/dbraw/zinc/52/03/74/745520374.db2.gz	YZKZTXMSSYBIAI-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@H](O)C1CC1	ZINC001191487274	745520377	/nfs/dbraw/zinc/52/03/77/745520377.db2.gz	YZKZTXMSSYBIAI-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC001198872669	747642242	/nfs/dbraw/zinc/64/22/42/747642242.db2.gz	QYVFUANWQYDFHN-CQSZACIVSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000823785269	758362017	/nfs/dbraw/zinc/36/20/17/758362017.db2.gz	ZZQIEMZNCHWRON-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
COCC(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC001048630699	769594198	/nfs/dbraw/zinc/59/41/98/769594198.db2.gz	ORFVPSZKGGKHFI-OKILXGFUSA-N	1	1	319.361	1.131	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)n1	ZINC001136342799	771942358	/nfs/dbraw/zinc/94/23/58/771942358.db2.gz	DAPVWLKVVPPWIA-NSHDSACASA-N	1	1	304.350	1.512	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CC1	ZINC001110158734	775951655	/nfs/dbraw/zinc/95/16/55/775951655.db2.gz	OUAUMZYNCCGQGV-UHFFFAOYSA-N	1	1	321.381	1.391	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](N2CCOCC2)C1	ZINC001173227586	777062718	/nfs/dbraw/zinc/06/27/18/777062718.db2.gz	RCKIUXRDKGIMCO-PBHICJAKSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2COC[C@H](C1)C2=O	ZINC001173235933	777065129	/nfs/dbraw/zinc/06/51/29/777065129.db2.gz	COELCGJQMNHIAM-FPMFFAJLSA-N	1	1	304.346	1.673	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC[C@H](C1)C2=O	ZINC001173235933	777065132	/nfs/dbraw/zinc/06/51/32/777065132.db2.gz	COELCGJQMNHIAM-FPMFFAJLSA-N	1	1	304.346	1.673	20	5		DDBDMO
CN(CCNc1ccccc1[N+](=O)[O-])C(=O)C[N@@H+](C)C1CCC1	ZINC001102017188	777798629	/nfs/dbraw/zinc/79/86/29/777798629.db2.gz	JWMBVQJVAHOMRW-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2cn(C)nn2)C1	ZINC001176886048	778294340	/nfs/dbraw/zinc/29/43/40/778294340.db2.gz	FHGFJXPNTVLDOL-GFCCVEGCSA-N	1	1	319.369	1.108	20	5		DDBDMO
CS[C@@H]1CC[C@@H]([N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC001116150367	780477927	/nfs/dbraw/zinc/47/79/27/780477927.db2.gz	NSIRQVHNMORPOP-KGYLQXTDSA-N	1	1	314.411	1.368	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001117797908	780901911	/nfs/dbraw/zinc/90/19/11/780901911.db2.gz	MZAQQTIFSNKMQN-QKCSRTOESA-N	1	1	307.350	1.227	20	5		DDBDMO
Nc1ccc[nH+]c1N1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC001154782038	861447478	/nfs/dbraw/zinc/44/74/78/861447478.db2.gz	CJJGTPWRSHFPRO-UHFFFAOYSA-N	1	1	318.312	1.433	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H]2CC[N@@H+](C)[C@H]2C1	ZINC001273359636	849662489	/nfs/dbraw/zinc/66/24/89/849662489.db2.gz	KXDCVNZLQHSTJW-MFKMUULPSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[C@H]([NH2+][C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cnccn1	ZINC000766026427	881352362	/nfs/dbraw/zinc/35/23/62/881352362.db2.gz	HZRITMNALHDCGI-COLVAYQJSA-N	1	1	318.333	1.130	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1C[C@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975898	859506551	/nfs/dbraw/zinc/50/65/51/859506551.db2.gz	GUSQVLAMRAVGBN-TYNCELHUSA-N	1	1	318.377	1.160	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC001141747791	860927917	/nfs/dbraw/zinc/92/79/17/860927917.db2.gz	IWQQCAPIFBBLQD-GHMZBOCLSA-N	1	1	306.322	1.052	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]([N@@H+](C)C(C)C)C2)n1	ZINC001157022495	863522761	/nfs/dbraw/zinc/52/27/61/863522761.db2.gz	YBOWPDKBMJIRFC-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC001157266084	863695575	/nfs/dbraw/zinc/69/55/75/863695575.db2.gz	NQEOHOJJWFQXQE-MFKMUULPSA-N	1	1	320.349	1.307	20	5		DDBDMO
Cc1ccc(F)cc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767290	864117984	/nfs/dbraw/zinc/11/79/84/864117984.db2.gz	KVSNPBRBRFWHEU-ZIAGYGMSSA-N	1	1	309.341	1.395	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC001160152396	865702922	/nfs/dbraw/zinc/70/29/22/865702922.db2.gz	ASIIMWCMJMYALW-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@H+](C)[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC001160152396	865702929	/nfs/dbraw/zinc/70/29/29/865702929.db2.gz	ASIIMWCMJMYALW-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC001160152396	865702936	/nfs/dbraw/zinc/70/29/36/865702936.db2.gz	ASIIMWCMJMYALW-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CCN(CC[NH2+]Cc1ccc(C)c(F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001320734744	866992575	/nfs/dbraw/zinc/99/25/75/866992575.db2.gz	NBKPWNXAPMGWCX-UKRRQHHQSA-N	1	1	323.368	1.737	20	5		DDBDMO
Nc1ccc(NC(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC001333885848	867116523	/nfs/dbraw/zinc/11/65/23/867116523.db2.gz	QWQFOYYBYDPHQN-LBPRGKRZSA-N	1	1	319.365	1.879	20	5		DDBDMO
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[NH+](C)C	ZINC001336779624	869135564	/nfs/dbraw/zinc/13/55/64/869135564.db2.gz	VQNCFAMUSVNLNR-GXTWGEPZSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@@H](C[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CN(C)C	ZINC001336779624	869135573	/nfs/dbraw/zinc/13/55/73/869135573.db2.gz	VQNCFAMUSVNLNR-GXTWGEPZSA-N	1	1	311.382	1.122	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC001164401247	869179665	/nfs/dbraw/zinc/17/96/65/869179665.db2.gz	WSEYNHTZIAUDPS-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC001297359018	870002516	/nfs/dbraw/zinc/00/25/16/870002516.db2.gz	KPMWHRDDXGVVBJ-GXTWGEPZSA-N	1	1	322.340	1.435	20	5		DDBDMO
Cc1c(CNC(=O)C[NH+]2CCC(CO)CC2)cccc1[N+](=O)[O-]	ZINC001338965336	870266807	/nfs/dbraw/zinc/26/68/07/870266807.db2.gz	YQCVPNUPUQUBTG-UHFFFAOYSA-N	1	1	321.377	1.224	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)cc1[N+](=O)[O-]	ZINC001339318228	870444461	/nfs/dbraw/zinc/44/44/61/870444461.db2.gz	SPVRSVWKEFGSQB-JHJVBQTASA-N	1	1	319.361	1.673	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1C[C@H](CO)[C@@H](CCO)C1	ZINC001308982661	871543971	/nfs/dbraw/zinc/54/39/71/871543971.db2.gz	FVLIVSWWJKWIIW-UONOGXRCSA-N	1	1	308.378	1.634	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC001310448821	871633228	/nfs/dbraw/zinc/63/32/28/871633228.db2.gz	ABZPQKGXYAFWGK-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
CCOC(=O)c1ccnc(NCC[NH+]2CC=CC2)c1[N+](=O)[O-]	ZINC001319339583	872588260	/nfs/dbraw/zinc/58/82/60/872588260.db2.gz	YMJLLBBZIQUJPG-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3nc4ccc([N+](=O)[O-])cc4o3)[C@H]1CC(=O)C2	ZINC001227233720	882925145	/nfs/dbraw/zinc/92/51/45/882925145.db2.gz	FPQSQWUODVJFJX-BHYNMZESSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nc4ccc([N+](=O)[O-])cc4o3)[C@H]1CC(=O)C2	ZINC001227233720	882925160	/nfs/dbraw/zinc/92/51/60/882925160.db2.gz	FPQSQWUODVJFJX-BHYNMZESSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1CCO[C@H](COCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC001223487762	880982764	/nfs/dbraw/zinc/98/27/64/880982764.db2.gz	JQKUYIVPBGUQLV-ZDUSSCGKSA-N	1	1	311.294	1.350	20	5		DDBDMO
C[N@@H+]1CCO[C@H](COCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC001223487762	880982756	/nfs/dbraw/zinc/98/27/56/880982756.db2.gz	JQKUYIVPBGUQLV-ZDUSSCGKSA-N	1	1	311.294	1.350	20	5		DDBDMO
CC[NH+]1CCC(Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001228604567	883567883	/nfs/dbraw/zinc/56/78/83/883567883.db2.gz	UWWSZKCXIMQFEF-UHFFFAOYSA-N	1	1	308.338	1.831	20	5		DDBDMO
COC(=O)c1cc(O[C@H]2CCc3[nH+]ccn3C2)cc([N+](=O)[O-])c1	ZINC001228772815	883663051	/nfs/dbraw/zinc/66/30/51/883663051.db2.gz	ZMZZSOOQFQVXGD-LBPRGKRZSA-N	1	1	317.301	1.972	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CCC[N@H+](C)CC2)cc1O	ZINC001228811500	883682013	/nfs/dbraw/zinc/68/20/13/883682013.db2.gz	QAHDCGCARYHPBJ-SNVBAGLBSA-N	1	1	324.333	1.950	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CCC[N@@H+](C)CC2)cc1O	ZINC001228811500	883682018	/nfs/dbraw/zinc/68/20/18/883682018.db2.gz	QAHDCGCARYHPBJ-SNVBAGLBSA-N	1	1	324.333	1.950	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc(Cl)nc2[N+](=O)[O-])C1	ZINC001230879468	884999568	/nfs/dbraw/zinc/99/95/68/884999568.db2.gz	OSORDPMYSBSNGC-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3cc(Cl)cnc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233714014	887245648	/nfs/dbraw/zinc/24/56/48/887245648.db2.gz	YEGADFVFUXYTTI-GDPRMGEGSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3cc(Cl)cnc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001233714014	887245674	/nfs/dbraw/zinc/24/56/74/887245674.db2.gz	YEGADFVFUXYTTI-GDPRMGEGSA-N	1	1	311.725	1.826	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O[C@H]2CCC[N@H+](C)CC2)n1	ZINC001234908167	888244582	/nfs/dbraw/zinc/24/45/82/888244582.db2.gz	DHZBPFKPWQMDKB-NSHDSACASA-N	1	1	323.353	1.515	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CC(N3CC[C@H](F)C3)C1)C2	ZINC001254603503	896526661	/nfs/dbraw/zinc/52/66/61/896526661.db2.gz	NVMOEQDMTCQGRQ-DZGCQCFKSA-N	1	1	305.353	1.790	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC001262359576	900130803	/nfs/dbraw/zinc/13/08/03/900130803.db2.gz	CUYOPGVTPKBBQU-NSHDSACASA-N	1	1	307.350	1.635	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC001262359576	900130814	/nfs/dbraw/zinc/13/08/14/900130814.db2.gz	CUYOPGVTPKBBQU-NSHDSACASA-N	1	1	307.350	1.635	20	5		DDBDMO
Cc1c(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)cccc1[N+](=O)[O-]	ZINC001263980535	900854251	/nfs/dbraw/zinc/85/42/51/900854251.db2.gz	YCHIWWFHESJOCV-MRVWCRGKSA-N	1	1	303.362	1.973	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)n1	ZINC000248664418	282097533	/nfs/dbraw/zinc/09/75/33/282097533.db2.gz	KYURIMWZMSHPGJ-GHMZBOCLSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000305857356	231075999	/nfs/dbraw/zinc/07/59/99/231075999.db2.gz	KZGIXOGBDIVWGV-ZOWXZIJZSA-N	1	1	319.361	1.403	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@](O)(C(F)F)C1	ZINC000451433788	231093433	/nfs/dbraw/zinc/09/34/33/231093433.db2.gz	PGHHBMQSLSLVPN-ZDUSSCGKSA-N	1	1	302.277	1.805	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@](O)(C(F)F)C1	ZINC000451433788	231093437	/nfs/dbraw/zinc/09/34/37/231093437.db2.gz	PGHHBMQSLSLVPN-ZDUSSCGKSA-N	1	1	302.277	1.805	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H]2CC[N@H+](C)[C@H]2C1	ZINC000451637652	231147023	/nfs/dbraw/zinc/14/70/23/231147023.db2.gz	YAQZZZUKLTVANR-DOMZBBRYSA-N	1	1	318.377	1.478	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249548871	282170406	/nfs/dbraw/zinc/17/04/06/282170406.db2.gz	HDCBNFZNMDSCTB-ITDIGPHOSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249548871	282170410	/nfs/dbraw/zinc/17/04/10/282170410.db2.gz	HDCBNFZNMDSCTB-ITDIGPHOSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000451253360	529485902	/nfs/dbraw/zinc/48/59/02/529485902.db2.gz	JNZSTJUTPAXASJ-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C2CC2)C[C@H](C)C1	ZINC000452171779	231323411	/nfs/dbraw/zinc/32/34/11/231323411.db2.gz	RZZGRKJRRNSSSN-NSHDSACASA-N	1	1	318.377	1.855	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)ccc1[N+](=O)[O-]	ZINC000452347629	231355045	/nfs/dbraw/zinc/35/50/45/231355045.db2.gz	JEQHZWIZBCMJOL-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2CCC[N@H+]2CCCO)cccc1[N+](=O)[O-]	ZINC000452353502	231358202	/nfs/dbraw/zinc/35/82/02/231358202.db2.gz	UPSHHOQMHJLESM-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC1(C)CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000614894446	362066427	/nfs/dbraw/zinc/06/64/27/362066427.db2.gz	CYCCSNHQKNPKTQ-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC1(C)CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000614894446	362066429	/nfs/dbraw/zinc/06/64/29/362066429.db2.gz	CYCCSNHQKNPKTQ-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000458176620	530054288	/nfs/dbraw/zinc/05/42/88/530054288.db2.gz	UONDAZAHOVQLQT-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000181730093	199344132	/nfs/dbraw/zinc/34/41/32/199344132.db2.gz	NNXLKUZEMWOHGU-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000172461570	198100530	/nfs/dbraw/zinc/10/05/30/198100530.db2.gz	WGMBSWDNGKEHGB-SNVBAGLBSA-N	1	1	313.379	1.354	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2CCO[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000026342628	352208005	/nfs/dbraw/zinc/20/80/05/352208005.db2.gz	ZMSLPPVIJASQBJ-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCO[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000026342628	352208008	/nfs/dbraw/zinc/20/80/08/352208008.db2.gz	ZMSLPPVIJASQBJ-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
CCN1CC[NH+](CCCNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000041443489	352308270	/nfs/dbraw/zinc/30/82/70/352308270.db2.gz	KBWHNLXSARMRHR-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCCC[C@@H]3CO)n2)c1	ZINC000047496300	352498889	/nfs/dbraw/zinc/49/88/89/352498889.db2.gz	CFZCWCOOOVJZPP-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@@H]3CO)n2)c1	ZINC000047496300	352498890	/nfs/dbraw/zinc/49/88/90/352498890.db2.gz	CFZCWCOOOVJZPP-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@H](CNC(=O)NCCc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000074099412	353291550	/nfs/dbraw/zinc/29/15/50/353291550.db2.gz	BXVXZPYAQLGVKQ-LBPRGKRZSA-N	1	1	320.393	1.919	20	5		DDBDMO
CNc1ccc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000075578237	353368581	/nfs/dbraw/zinc/36/85/81/353368581.db2.gz	CSAMOGBXVWTENF-JTQLQIEISA-N	1	1	306.366	1.849	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000125915474	354048876	/nfs/dbraw/zinc/04/88/76/354048876.db2.gz	GWKGJMSOBHQBBF-NSHDSACASA-N	1	1	318.337	1.138	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154685973	354207745	/nfs/dbraw/zinc/20/77/45/354207745.db2.gz	HTJOYPOEBNDORL-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154685973	354207750	/nfs/dbraw/zinc/20/77/50/354207750.db2.gz	HTJOYPOEBNDORL-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000156795976	354221090	/nfs/dbraw/zinc/22/10/90/354221090.db2.gz	UBEZHSDJULELLZ-SWLSCSKDSA-N	1	1	321.377	1.363	20	5		DDBDMO
C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000156795976	354221094	/nfs/dbraw/zinc/22/10/94/354221094.db2.gz	UBEZHSDJULELLZ-SWLSCSKDSA-N	1	1	321.377	1.363	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@H](O)C1CC1	ZINC000305233212	354469835	/nfs/dbraw/zinc/46/98/35/354469835.db2.gz	MQDMZYPZIPOCBJ-HNNXBMFYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)C1CC1	ZINC000305729963	354471266	/nfs/dbraw/zinc/47/12/66/354471266.db2.gz	KFAPPIXVFAAEFK-YGRLFVJLSA-N	1	1	307.350	1.625	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000584787603	354769649	/nfs/dbraw/zinc/76/96/49/354769649.db2.gz	GCSDLYHWRCYLRO-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706848	354831122	/nfs/dbraw/zinc/83/11/22/354831122.db2.gz	SKBFFHFHMQBQGB-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000585706848	354831126	/nfs/dbraw/zinc/83/11/26/354831126.db2.gz	SKBFFHFHMQBQGB-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
Cc1cc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)n(C)n1	ZINC000585743341	354835900	/nfs/dbraw/zinc/83/59/00/354835900.db2.gz	KHHGFSXVRPVQJF-UHFFFAOYSA-N	1	1	318.333	1.698	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000589574572	355002240	/nfs/dbraw/zinc/00/22/40/355002240.db2.gz	BNBTUNTVSHIXCL-GHMZBOCLSA-N	1	1	319.365	1.152	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2C[C@@H](OC)C2)c1	ZINC000589516693	354998688	/nfs/dbraw/zinc/99/86/88/354998688.db2.gz	QNSBSSZFGJAEBA-BETUJISGSA-N	1	1	308.334	1.991	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2C[C@@H](OC)C2)c1	ZINC000589516693	354998692	/nfs/dbraw/zinc/99/86/92/354998692.db2.gz	QNSBSSZFGJAEBA-BETUJISGSA-N	1	1	308.334	1.991	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000287449645	219531633	/nfs/dbraw/zinc/53/16/33/219531633.db2.gz	VPIHIZZALMAQPN-LBPRGKRZSA-N	1	1	309.341	1.892	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000590402432	355085723	/nfs/dbraw/zinc/08/57/23/355085723.db2.gz	UDGVNVRIDJSCJA-HUUCEWRRSA-N	1	1	319.361	1.530	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1	ZINC000590442946	355097263	/nfs/dbraw/zinc/09/72/63/355097263.db2.gz	IGLRAPYLOKYOIF-HZMBPMFUSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1cc(NC(=O)C(=O)N[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000591011449	355231744	/nfs/dbraw/zinc/23/17/44/355231744.db2.gz	UYQRKNWOBLISKE-LBPRGKRZSA-N	1	1	320.349	1.052	20	5		DDBDMO
CCCN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592247155	355546831	/nfs/dbraw/zinc/54/68/31/355546831.db2.gz	SJQGRYPDKDTFAQ-NSHDSACASA-N	1	1	307.354	1.360	20	5		DDBDMO
CCOc1ccc(C(=O)NCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000346543733	283119037	/nfs/dbraw/zinc/11/90/37/283119037.db2.gz	CFIGZQVDMUTUTJ-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593165858	355815720	/nfs/dbraw/zinc/81/57/20/355815720.db2.gz	WTWAQKDXYUUNKS-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000594195394	356136191	/nfs/dbraw/zinc/13/61/91/356136191.db2.gz	GKRZYTBDVXILAL-OCCSQVGLSA-N	1	1	304.350	1.737	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCCC[C@@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000594418785	356203800	/nfs/dbraw/zinc/20/38/00/356203800.db2.gz	LAWMUTVBSARCJC-RYUDHWBXSA-N	1	1	320.349	1.442	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000594419169	356204587	/nfs/dbraw/zinc/20/45/87/356204587.db2.gz	OJMRLSQAHZWMIK-CHWSQXEVSA-N	1	1	318.377	1.924	20	5		DDBDMO
CC(C)(C)n1nnc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)n1	ZINC000594918534	356354423	/nfs/dbraw/zinc/35/44/23/356354423.db2.gz	BONUTOCZMHTHBY-UHFFFAOYSA-N	1	1	304.354	1.669	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(=O)NCC(F)F	ZINC000595054370	356377380	/nfs/dbraw/zinc/37/73/80/356377380.db2.gz	MGRYNMQBXDSHEG-MRVPVSSYSA-N	1	1	317.292	1.635	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ncccn1	ZINC000595097696	356381858	/nfs/dbraw/zinc/38/18/58/356381858.db2.gz	CMJRSFRZLCTYCY-LLVKDONJSA-N	1	1	315.333	1.892	20	5		DDBDMO
C[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1nnc2n1CCCCC2	ZINC000595433327	356490617	/nfs/dbraw/zinc/49/06/17/356490617.db2.gz	MGKMLVGVWHXDAP-LLVKDONJSA-N	1	1	319.369	1.460	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000618210177	363513051	/nfs/dbraw/zinc/51/30/51/363513051.db2.gz	SGKBATBAXXJYOA-GFCCVEGCSA-N	1	1	319.361	1.818	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000595745441	356632079	/nfs/dbraw/zinc/63/20/79/356632079.db2.gz	TYLNYHFXEJEEMN-MSRIBSCDSA-N	1	1	307.350	1.142	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000595780370	356649977	/nfs/dbraw/zinc/64/99/77/356649977.db2.gz	JMBAMDRQYWRXEN-RDBSUJKOSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595836994	356672685	/nfs/dbraw/zinc/67/26/85/356672685.db2.gz	ZQIPEGFZQVMEAB-BFHYXJOUSA-N	1	1	322.361	1.303	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C2)C1	ZINC000596242837	356829736	/nfs/dbraw/zinc/82/97/36/356829736.db2.gz	ARNHOWRHHKRLGP-INIZCTEOSA-N	1	1	318.377	1.616	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596134001	356785508	/nfs/dbraw/zinc/78/55/08/356785508.db2.gz	BSUIZJBFIPJYAB-CQSZACIVSA-N	1	1	306.366	1.470	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC([N@H+]3CCCOCC3)CC2)c(F)c1	ZINC000596268438	356839020	/nfs/dbraw/zinc/83/90/20/356839020.db2.gz	KKTZFWVCPFXQDL-UHFFFAOYSA-N	1	1	324.356	1.820	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](Nc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000596517345	356903112	/nfs/dbraw/zinc/90/31/12/356903112.db2.gz	NQNOLCCVRDPQSX-LLVKDONJSA-N	1	1	308.338	1.673	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000597925376	357384972	/nfs/dbraw/zinc/38/49/72/357384972.db2.gz	NXYYDEWXWOKXEJ-LBPRGKRZSA-N	1	1	321.377	1.963	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000597920398	357381381	/nfs/dbraw/zinc/38/13/81/357381381.db2.gz	BEPWIOJUEBWBCR-NSHDSACASA-N	1	1	323.397	1.515	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000598342081	357543794	/nfs/dbraw/zinc/54/37/94/357543794.db2.gz	DKUPRFKMUXLSFR-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000598465686	357593352	/nfs/dbraw/zinc/59/33/52/357593352.db2.gz	IHONGSGCKPZZRE-UHFFFAOYSA-N	1	1	311.386	1.487	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCC([NH+]3CCOCC3)CC2)n1	ZINC000599106527	357817600	/nfs/dbraw/zinc/81/76/00/357817600.db2.gz	UJGXFYSQQQNAOH-UHFFFAOYSA-N	1	1	320.393	1.908	20	5		DDBDMO
C[NH+](C)Cc1ccccc1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000179272033	199008016	/nfs/dbraw/zinc/00/80/16/199008016.db2.gz	NWJGSVZAYKQJOT-UHFFFAOYSA-N	1	1	303.322	1.310	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000599564202	357974702	/nfs/dbraw/zinc/97/47/02/357974702.db2.gz	QKSDMZUNEGBPCA-OAHLLOKOSA-N	1	1	324.333	1.238	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599694162	358028803	/nfs/dbraw/zinc/02/88/03/358028803.db2.gz	DVTVBAUDVMXYLP-GFCCVEGCSA-N	1	1	308.338	1.091	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)Nc1ccncc1[N+](=O)[O-]	ZINC000599766051	358052978	/nfs/dbraw/zinc/05/29/78/358052978.db2.gz	IJLOXWIFIPVZJX-LBPRGKRZSA-N	1	1	319.365	1.550	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000600311726	358192242	/nfs/dbraw/zinc/19/22/42/358192242.db2.gz	QRPZFZFSNXHGLP-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCC1	ZINC000600819485	358325031	/nfs/dbraw/zinc/32/50/31/358325031.db2.gz	HBMXNGVBRWKOKC-UHFFFAOYSA-N	1	1	303.322	1.894	20	5		DDBDMO
Cc1nc2n(n1)C[C@@H](Nc1cc[nH+]c3ccc([N+](=O)[O-])cc13)CC2	ZINC000601110253	358405596	/nfs/dbraw/zinc/40/55/96/358405596.db2.gz	AXWDVMMAEJGCLJ-NSHDSACASA-N	1	1	324.344	1.892	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCC3(O)CCOCC3)c2c1	ZINC000601114520	358407357	/nfs/dbraw/zinc/40/73/57/358407357.db2.gz	QHBUJNFRRKOFNZ-UHFFFAOYSA-N	1	1	303.318	1.518	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCCS(=O)(=O)CC3)c2c1	ZINC000601117930	358409396	/nfs/dbraw/zinc/40/93/96/358409396.db2.gz	APTXPLRQXAXOIG-UHFFFAOYSA-N	1	1	321.358	1.768	20	5		DDBDMO
COC[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601118243	358410388	/nfs/dbraw/zinc/41/03/88/358410388.db2.gz	AXRNDMRJLXDSHX-GFCCVEGCSA-N	1	1	303.318	1.995	20	5		DDBDMO
CCCn1ccnc1CCC[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602661863	359108142	/nfs/dbraw/zinc/10/81/42/359108142.db2.gz	HHVJIYNZHVDLKE-UHFFFAOYSA-N	1	1	320.397	1.999	20	5		DDBDMO
Cn1cc(C[N@@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839128	359229251	/nfs/dbraw/zinc/22/92/51/359229251.db2.gz	HIYUBLTVPDNQLB-KBPBESRZSA-N	1	1	302.334	1.636	20	5		DDBDMO
Cn1cc(C[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839128	359229255	/nfs/dbraw/zinc/22/92/55/359229255.db2.gz	HIYUBLTVPDNQLB-KBPBESRZSA-N	1	1	302.334	1.636	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[C@H](C)[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H]1C	ZINC000602857947	359244077	/nfs/dbraw/zinc/24/40/77/359244077.db2.gz	YXCJRAABFLCGPE-DMDPSCGWSA-N	1	1	324.381	1.880	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H]1C	ZINC000602857947	359244081	/nfs/dbraw/zinc/24/40/81/359244081.db2.gz	YXCJRAABFLCGPE-DMDPSCGWSA-N	1	1	324.381	1.880	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](C(=O)N2CCCC2)C1	ZINC000602829157	359220891	/nfs/dbraw/zinc/22/08/91/359220891.db2.gz	QCJWTOODIWIUTP-ZDUSSCGKSA-N	1	1	321.381	1.044	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCOCC1	ZINC000187407000	200107952	/nfs/dbraw/zinc/10/79/52/200107952.db2.gz	XTYFDAKTVMXVLA-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C1CCCC1	ZINC000188424279	200244100	/nfs/dbraw/zinc/24/41/00/200244100.db2.gz	YZWUJQAUIWEGFR-UHFFFAOYSA-N	1	1	308.338	1.300	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000609450143	360307857	/nfs/dbraw/zinc/30/78/57/360307857.db2.gz	CFZMONVWBKBZTI-LLVKDONJSA-N	1	1	307.350	1.308	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000609450143	360307859	/nfs/dbraw/zinc/30/78/59/360307859.db2.gz	CFZMONVWBKBZTI-LLVKDONJSA-N	1	1	307.350	1.308	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610605356	360481095	/nfs/dbraw/zinc/48/10/95/360481095.db2.gz	ZMHUPJLJGJBCGV-ZIAGYGMSSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@H+]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611092115	360621057	/nfs/dbraw/zinc/62/10/57/360621057.db2.gz	JAESPISAXNWFTR-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000292524301	223124022	/nfs/dbraw/zinc/12/40/22/223124022.db2.gz	WNRKCZDRUPIDEW-FZMZJTMJSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000292524301	223124025	/nfs/dbraw/zinc/12/40/25/223124025.db2.gz	WNRKCZDRUPIDEW-FZMZJTMJSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000271896107	209305362	/nfs/dbraw/zinc/30/53/62/209305362.db2.gz	FVSUGOFXKJUOIR-UHFFFAOYSA-N	1	1	323.324	1.491	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000193021614	200978445	/nfs/dbraw/zinc/97/84/45/200978445.db2.gz	HVGSUDQNMQLZCE-NSHDSACASA-N	1	1	304.350	1.512	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619251941	363945953	/nfs/dbraw/zinc/94/59/53/363945953.db2.gz	CBQXYTQMULKXNZ-KGLIPLIRSA-N	1	1	307.325	1.853	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000619789707	364151353	/nfs/dbraw/zinc/15/13/53/364151353.db2.gz	OICQXMJEBNBNDX-LBPRGKRZSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000619789707	364151356	/nfs/dbraw/zinc/15/13/56/364151356.db2.gz	OICQXMJEBNBNDX-LBPRGKRZSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[NH+](C)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000288187996	220006400	/nfs/dbraw/zinc/00/64/00/220006400.db2.gz	NIDYBWUPSAVZGM-LLVKDONJSA-N	1	1	321.312	1.490	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000264903888	204255947	/nfs/dbraw/zinc/25/59/47/204255947.db2.gz	ZYTALZPIXCWUSI-UHFFFAOYSA-N	1	1	310.379	1.765	20	5		DDBDMO
Cc1c(C(=O)NCc2c[nH+]c(N(C)C)n2C)cccc1[N+](=O)[O-]	ZINC000265081086	204383617	/nfs/dbraw/zinc/38/36/17/204383617.db2.gz	XEZWMOQKCMELAH-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000288343449	220095871	/nfs/dbraw/zinc/09/58/71/220095871.db2.gz	JXMCWJSRBAIJOQ-BXUZGUMPSA-N	1	1	319.361	1.999	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000266204802	205181371	/nfs/dbraw/zinc/18/13/71/205181371.db2.gz	WTDJVJQJKRHEOX-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1	ZINC000041873581	183223596	/nfs/dbraw/zinc/22/35/96/183223596.db2.gz	JMIKWEQIACILKG-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)C[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344354	223839649	/nfs/dbraw/zinc/83/96/49/223839649.db2.gz	JDFDCYLZUQBWII-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344354	223839651	/nfs/dbraw/zinc/83/96/51/223839651.db2.gz	JDFDCYLZUQBWII-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000159787324	197364449	/nfs/dbraw/zinc/36/44/49/197364449.db2.gz	ROTUHNCMSRZPLI-DOMZBBRYSA-N	1	1	321.377	1.650	20	5		DDBDMO
COc1ccc(NC(=O)C[NH2+][C@@H](C)c2cn[nH]c2)c([N+](=O)[O-])c1	ZINC000273963264	211218959	/nfs/dbraw/zinc/21/89/59/211218959.db2.gz	FYJHETUZECATMP-VIFPVBQESA-N	1	1	319.321	1.616	20	5		DDBDMO
Cn1nccc1CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000338546993	250024544	/nfs/dbraw/zinc/02/45/44/250024544.db2.gz	PXUKNRUXCKGBFZ-LBPRGKRZSA-N	1	1	316.365	1.452	20	5		DDBDMO
Cc1cccc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000285350947	218392674	/nfs/dbraw/zinc/39/26/74/218392674.db2.gz	ULYQQCFHADZPFB-UONOGXRCSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[C@H](CNC(=O)CCOc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000057707203	184048169	/nfs/dbraw/zinc/04/81/69/184048169.db2.gz	HQHWSDGEAUWCDK-GFCCVEGCSA-N	1	1	321.377	1.963	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNc1ncc(Cl)cc1[N+](=O)[O-]	ZINC000341048160	251353671	/nfs/dbraw/zinc/35/36/71/251353671.db2.gz	SILZHFLOGZNOID-UHFFFAOYSA-N	1	1	315.805	1.939	20	5		DDBDMO
CN(CCCNc1ncc(Cl)cc1[N+](=O)[O-])CC[NH+](C)C	ZINC000341048160	251353674	/nfs/dbraw/zinc/35/36/74/251353674.db2.gz	SILZHFLOGZNOID-UHFFFAOYSA-N	1	1	315.805	1.939	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2NC[C@@H]2C[NH2+]CCCO2)n1	ZINC000423493211	285168878	/nfs/dbraw/zinc/16/88/78/285168878.db2.gz	PPHYMRREQARMEF-BFHYXJOUSA-N	1	1	323.397	1.243	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@]3(C2)OCc2ccccc23)n1	ZINC000186710263	285168523	/nfs/dbraw/zinc/16/85/23/285168523.db2.gz	NQLIWFXVMFZZMB-MRXNPFEDSA-N	1	1	314.345	1.923	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C2	ZINC000352617609	285176545	/nfs/dbraw/zinc/17/65/45/285176545.db2.gz	GCIIOGMIHHLDDP-HNNXBMFYSA-N	1	1	307.325	1.836	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C2	ZINC000352617609	285176549	/nfs/dbraw/zinc/17/65/49/285176549.db2.gz	GCIIOGMIHHLDDP-HNNXBMFYSA-N	1	1	307.325	1.836	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@@H]1O	ZINC000352669323	285212388	/nfs/dbraw/zinc/21/23/88/285212388.db2.gz	YUXSYXPHUOUBRE-KGLIPLIRSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000120713243	195221872	/nfs/dbraw/zinc/22/18/72/195221872.db2.gz	NQBLQGRGUXLDFF-LBPRGKRZSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000352798023	285307865	/nfs/dbraw/zinc/30/78/65/285307865.db2.gz	WYQUJYBNQKUMCP-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC1(F)F	ZINC000289783077	221222300	/nfs/dbraw/zinc/22/23/00/221222300.db2.gz	LVOHORSOVGMZFO-GXSJLCMTSA-N	1	1	304.297	1.129	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)C[NH+]1CCOCC1	ZINC000579714563	422820667	/nfs/dbraw/zinc/82/06/67/422820667.db2.gz	YCVKDXZUZMZMGE-NSHDSACASA-N	1	1	322.365	1.543	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2C(N)=O)cccc1[N+](=O)[O-]	ZINC000068369201	406637800	/nfs/dbraw/zinc/63/78/00/406637800.db2.gz	PAINXGIISWQYDO-CYBMUJFWSA-N	1	1	320.349	1.182	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1CN1CCOCC1	ZINC000075890423	406945785	/nfs/dbraw/zinc/94/57/85/406945785.db2.gz	HSFBBJLAPZRLPG-HNNXBMFYSA-N	1	1	305.378	1.891	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCC[C@H]1C	ZINC000046859979	407065435	/nfs/dbraw/zinc/06/54/35/407065435.db2.gz	LXXZMRROCPLQCD-LLVKDONJSA-N	1	1	306.366	1.902	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000123689777	407336636	/nfs/dbraw/zinc/33/66/36/407336636.db2.gz	XGHWPKDJYVCAMC-NSHDSACASA-N	1	1	323.397	1.631	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+](CC(C)C)CC2)c1[N+](=O)[O-]	ZINC000109231911	407396247	/nfs/dbraw/zinc/39/62/47/407396247.db2.gz	WTZDYLZVYGGMHL-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@H](C)C[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000126103634	407405670	/nfs/dbraw/zinc/40/56/70/407405670.db2.gz	GQJZUEIPCGIYDZ-SBKAZYGRSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H](C)C[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000126103634	407405672	/nfs/dbraw/zinc/40/56/72/407405672.db2.gz	GQJZUEIPCGIYDZ-SBKAZYGRSA-N	1	1	300.380	1.802	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCS2(=O)=O)c(Cl)c1	ZINC000127016056	407426074	/nfs/dbraw/zinc/42/60/74/407426074.db2.gz	TYMHWJJCVDNCEN-LLVKDONJSA-N	1	1	318.782	1.915	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)n1	ZINC000151793063	407498502	/nfs/dbraw/zinc/49/85/02/407498502.db2.gz	OGPODFUSTUFHKG-OLZOCXBDSA-N	1	1	320.349	1.972	20	5		DDBDMO
C[C@H]1C[C@@H](C[NH3+])CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000261695182	407581157	/nfs/dbraw/zinc/58/11/57/407581157.db2.gz	IUGYHNRMWCWOSX-IUCAKERBSA-N	1	1	303.322	1.280	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H]1CCOC1	ZINC000178778208	407599298	/nfs/dbraw/zinc/59/92/98/407599298.db2.gz	CFNWXVIPWOQQDO-GFCCVEGCSA-N	1	1	319.361	1.452	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+](CCO)Cc2cccnc2)c1	ZINC000152330770	407612521	/nfs/dbraw/zinc/61/25/21/407612521.db2.gz	ZHEXFYRGJTXZTK-UHFFFAOYSA-N	1	1	317.345	1.863	20	5		DDBDMO
C[NH+](C)[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000178837251	407619953	/nfs/dbraw/zinc/61/99/53/407619953.db2.gz	OKLWPYPYEDSKEJ-AWEZNQCLSA-N	1	1	317.349	1.210	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNc1c(F)cc([N+](=O)[O-])cc1F	ZINC000227890166	407638628	/nfs/dbraw/zinc/63/86/28/407638628.db2.gz	XJVLLUXMGXTCGN-JTQLQIEISA-N	1	1	300.309	1.531	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1c(F)cc([N+](=O)[O-])cc1F	ZINC000227890166	407638633	/nfs/dbraw/zinc/63/86/33/407638633.db2.gz	XJVLLUXMGXTCGN-JTQLQIEISA-N	1	1	300.309	1.531	20	5		DDBDMO
COC(=O)C1(O)CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000271369538	407655539	/nfs/dbraw/zinc/65/55/39/407655539.db2.gz	JAYGEIUGMUPLDK-NSHDSACASA-N	1	1	308.334	1.656	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+](C[C@@H](O)Cn1cccn1)C1CC1	ZINC000179241507	407762646	/nfs/dbraw/zinc/76/26/46/407762646.db2.gz	SXTLWBTXCUOJAA-OAHLLOKOSA-N	1	1	316.361	1.817	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1C[N@@H+](C2CC2)C[C@H]1C	ZINC000268278945	407981574	/nfs/dbraw/zinc/98/15/74/407981574.db2.gz	WUSBWOKCUIEELZ-ZWNOBZJWSA-N	1	1	321.381	1.089	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000272428625	407915019	/nfs/dbraw/zinc/91/50/19/407915019.db2.gz	HJCOHNICAFFRFT-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCCC[C@H]2C[NH+](C)C)c1[N+](=O)[O-]	ZINC000188411537	407940432	/nfs/dbraw/zinc/94/04/32/407940432.db2.gz	UPJAPNGNJONBDC-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@]2(CCOC2)C1	ZINC000181992883	408062444	/nfs/dbraw/zinc/06/24/44/408062444.db2.gz	SEJHFPFMMJRKGZ-BBRMVZONSA-N	1	1	322.361	1.447	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000182325378	408126229	/nfs/dbraw/zinc/12/62/29/408126229.db2.gz	VCZWPRXSMCASAO-SWLSCSKDSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C2(CCCCC2)C1	ZINC000176247560	408321710	/nfs/dbraw/zinc/32/17/10/408321710.db2.gz	NOPCIIIVLUQLOQ-UHFFFAOYSA-N	1	1	321.381	1.268	20	5		DDBDMO
COc1ccc2c(c1)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2	ZINC000176217625	408311589	/nfs/dbraw/zinc/31/15/89/408311589.db2.gz	UOEZBUXRFXQQQA-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc2c(c1)C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC2	ZINC000176217625	408311592	/nfs/dbraw/zinc/31/15/92/408311592.db2.gz	UOEZBUXRFXQQQA-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000165302595	162160202	/nfs/dbraw/zinc/16/02/02/162160202.db2.gz	QCKNEVVWNOROHP-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000176935072	408480487	/nfs/dbraw/zinc/48/04/87/408480487.db2.gz	WLBDONHHXDRCQM-GXSJLCMTSA-N	1	1	309.370	1.339	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000264472603	408503976	/nfs/dbraw/zinc/50/39/76/408503976.db2.gz	GPGXIZHKFAEZRL-NSHDSACASA-N	1	1	311.313	1.184	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H](O)C1CC1	ZINC000160834636	408529584	/nfs/dbraw/zinc/52/95/84/408529584.db2.gz	QVYJPWWUFGRZFH-AWEZNQCLSA-N	1	1	307.350	1.626	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000177205401	408551127	/nfs/dbraw/zinc/55/11/27/408551127.db2.gz	YFHHWYWDYAIPOT-MNOVXSKESA-N	1	1	319.361	1.958	20	5		DDBDMO
COc1ccc(OCC[N@H+](C)Cc2cnccn2)c([N+](=O)[O-])c1	ZINC000177254576	408565870	/nfs/dbraw/zinc/56/58/70/408565870.db2.gz	ITZFASJQZHDJAF-UHFFFAOYSA-N	1	1	318.333	1.904	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)Cc2cnccn2)c([N+](=O)[O-])c1	ZINC000177254576	408565875	/nfs/dbraw/zinc/56/58/75/408565875.db2.gz	ITZFASJQZHDJAF-UHFFFAOYSA-N	1	1	318.333	1.904	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C)(O)CC1	ZINC000177341930	408584893	/nfs/dbraw/zinc/58/48/93/408584893.db2.gz	PXUZJAKBXPRKOG-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000161338301	408589004	/nfs/dbraw/zinc/58/90/04/408589004.db2.gz	SLOBQXYPNJDLHK-CMPLNLGQSA-N	1	1	323.397	1.729	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000192660809	408626263	/nfs/dbraw/zinc/62/62/63/408626263.db2.gz	VVUVFHFFIKGMSZ-LBPRGKRZSA-N	1	1	313.379	1.357	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000161979292	408658353	/nfs/dbraw/zinc/65/83/53/408658353.db2.gz	UEKXWSFNNVYELS-ZDUSSCGKSA-N	1	1	323.397	1.562	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270761447	408670012	/nfs/dbraw/zinc/67/00/12/408670012.db2.gz	MTKAFFZOLWEBHW-WDEREUQCSA-N	1	1	309.370	1.179	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)CC2(C)C)ccc1[N+](=O)[O-]	ZINC000270917405	408738990	/nfs/dbraw/zinc/73/89/90/408738990.db2.gz	MWKYUKLJQVFLPI-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)CC2(C)C)ccc1[N+](=O)[O-]	ZINC000270917405	408738993	/nfs/dbraw/zinc/73/89/93/408738993.db2.gz	MWKYUKLJQVFLPI-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)C1CCC1	ZINC000275829735	408689464	/nfs/dbraw/zinc/68/94/64/408689464.db2.gz	LPUQRLJIGWTLNB-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)C1CCC1	ZINC000275829735	408689471	/nfs/dbraw/zinc/68/94/71/408689471.db2.gz	LPUQRLJIGWTLNB-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000251950772	408791226	/nfs/dbraw/zinc/79/12/26/408791226.db2.gz	VCEOYVBCGKHQMJ-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21	ZINC000164563645	408801149	/nfs/dbraw/zinc/80/11/49/408801149.db2.gz	DWCUXHPOLMRTLQ-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@@H]21	ZINC000178004455	408754378	/nfs/dbraw/zinc/75/43/78/408754378.db2.gz	TZQOQAHNUPGAFP-ABAIWWIYSA-N	1	1	318.377	1.733	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@](C)(C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000280832179	408843002	/nfs/dbraw/zinc/84/30/02/408843002.db2.gz	WCHXAFPVEILBNA-HNNXBMFYSA-N	1	1	323.349	1.180	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C[C@H](C)O)CC1	ZINC000189735416	163113110	/nfs/dbraw/zinc/11/31/10/163113110.db2.gz	KJGZWYMISLWOAC-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292149106	408990045	/nfs/dbraw/zinc/99/00/45/408990045.db2.gz	IKAJFCQOXIRWOH-INIZCTEOSA-N	1	1	319.361	1.528	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@H](C)C1	ZINC000288418031	409165100	/nfs/dbraw/zinc/16/51/00/409165100.db2.gz	MAAZIVJKWZGUCN-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)[C@H](C)C1	ZINC000288418031	409165102	/nfs/dbraw/zinc/16/51/02/409165102.db2.gz	MAAZIVJKWZGUCN-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
COc1c(C)c[nH+]c(CN(C)CCn2cc([N+](=O)[O-])cn2)c1C	ZINC000295256057	409398620	/nfs/dbraw/zinc/39/86/20/409398620.db2.gz	ZSPBJZCNPMHSGP-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
COc1c(C)cnc(C[N@H+](C)CCn2cc([N+](=O)[O-])cn2)c1C	ZINC000295256057	409398626	/nfs/dbraw/zinc/39/86/26/409398626.db2.gz	ZSPBJZCNPMHSGP-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
COc1c(C)cnc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)c1C	ZINC000295256057	409398630	/nfs/dbraw/zinc/39/86/30/409398630.db2.gz	ZSPBJZCNPMHSGP-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
C[C@H]1[C@@H](O)CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000296064332	409417521	/nfs/dbraw/zinc/41/75/21/409417521.db2.gz	GIXSIFZOVZCAEL-FZMZJTMJSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@H]1[C@@H](O)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000296064332	409417527	/nfs/dbraw/zinc/41/75/27/409417527.db2.gz	GIXSIFZOVZCAEL-FZMZJTMJSA-N	1	1	307.350	1.403	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000317235065	164027423	/nfs/dbraw/zinc/02/74/23/164027423.db2.gz	LOVKYIJEMQTMMS-VXGBXAGGSA-N	1	1	304.350	1.534	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000321979921	164046258	/nfs/dbraw/zinc/04/62/58/164046258.db2.gz	OZBQQPQKLNAFRU-VXGBXAGGSA-N	1	1	323.324	1.327	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000347020224	164098252	/nfs/dbraw/zinc/09/82/52/164098252.db2.gz	SXRZVVPNQMEPHY-LBPRGKRZSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000357033735	164136864	/nfs/dbraw/zinc/13/68/64/164136864.db2.gz	IAPOWWFQHOFVHW-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000408113027	164232099	/nfs/dbraw/zinc/23/20/99/164232099.db2.gz	PTELMGFNEXKVKT-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000408113027	164232101	/nfs/dbraw/zinc/23/21/01/164232101.db2.gz	PTELMGFNEXKVKT-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000345170678	409656349	/nfs/dbraw/zinc/65/63/49/409656349.db2.gz	IVKJNMOZGWWJKW-WDEREUQCSA-N	1	1	306.366	1.613	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000331596389	409673560	/nfs/dbraw/zinc/67/35/60/409673560.db2.gz	UCNSFDSJZCGBFG-KGLIPLIRSA-N	1	1	312.370	1.043	20	5		DDBDMO
NC(=O)[C@]1(O)CCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000314841877	409831264	/nfs/dbraw/zinc/83/12/64/409831264.db2.gz	UKBCLNXSZNBWSO-ZDUSSCGKSA-N	1	1	313.741	1.060	20	5		DDBDMO
NC(=O)[C@]1(O)CCC[N@@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000314841877	409831268	/nfs/dbraw/zinc/83/12/68/409831268.db2.gz	UKBCLNXSZNBWSO-ZDUSSCGKSA-N	1	1	313.741	1.060	20	5		DDBDMO
CC(C)[N@H+](CCOCCO)Cc1c(F)cccc1[N+](=O)[O-]	ZINC000338592043	410032234	/nfs/dbraw/zinc/03/22/34/410032234.db2.gz	XQQNRGNJHKDJLQ-UHFFFAOYSA-N	1	1	300.330	1.953	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)Cc1c(F)cccc1[N+](=O)[O-]	ZINC000338592043	410032238	/nfs/dbraw/zinc/03/22/38/410032238.db2.gz	XQQNRGNJHKDJLQ-UHFFFAOYSA-N	1	1	300.330	1.953	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000332278946	410035867	/nfs/dbraw/zinc/03/58/67/410035867.db2.gz	HTRUPCMJPVLYHG-UHFFFAOYSA-N	1	1	313.304	1.580	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@H]32)c1	ZINC000332336395	410077750	/nfs/dbraw/zinc/07/77/50/410077750.db2.gz	VYAMZIJWPVXMIO-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
CC[N@@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])[C@H](C)C1	ZINC000343274610	410298121	/nfs/dbraw/zinc/29/81/21/410298121.db2.gz	RXHODGYHIYKQOH-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])[C@H](C)C1	ZINC000343274610	410298125	/nfs/dbraw/zinc/29/81/25/410298125.db2.gz	RXHODGYHIYKQOH-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
COc1ccc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000347011792	410311671	/nfs/dbraw/zinc/31/16/71/410311671.db2.gz	MLGILANBLTWHOU-ZDUSSCGKSA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000343459882	410471677	/nfs/dbraw/zinc/47/16/77/410471677.db2.gz	WTJNRUXNCSIALK-WCQYABFASA-N	1	1	323.397	1.397	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCCOC1	ZINC000352213519	410550746	/nfs/dbraw/zinc/55/07/46/410550746.db2.gz	VLDKBLMWHVLCCR-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCCOC1	ZINC000352213519	410550751	/nfs/dbraw/zinc/55/07/51/410550751.db2.gz	VLDKBLMWHVLCCR-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC(C)C[C@H](CNc1ncc([N+](=O)[O-])c(N)n1)[NH+]1CCOCC1	ZINC000301124061	410660664	/nfs/dbraw/zinc/66/06/64/410660664.db2.gz	VDTKCSOLLJFGJV-LLVKDONJSA-N	1	1	324.385	1.126	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)NCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000343715717	410644355	/nfs/dbraw/zinc/64/43/55/410644355.db2.gz	MTPURSZGIMUFMY-UHFFFAOYSA-N	1	1	318.377	1.698	20	5		DDBDMO
C[C@@H]1CC[C@]2(CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)C1	ZINC000359555599	410726416	/nfs/dbraw/zinc/72/64/16/410726416.db2.gz	KRSMRNGVPDYUGD-YUELXQCFSA-N	1	1	308.382	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1(CO)CC1	ZINC000353009595	410732231	/nfs/dbraw/zinc/73/22/31/410732231.db2.gz	QYLFEVFGRIGELH-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccnc(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)c1[N+](=O)[O-]	ZINC000301250331	410685370	/nfs/dbraw/zinc/68/53/70/410685370.db2.gz	BVLXVJYAUHBORM-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[N@@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000337427435	410778255	/nfs/dbraw/zinc/77/82/55/410778255.db2.gz	SWWNABANKIRICT-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000359624972	410778379	/nfs/dbraw/zinc/77/83/79/410778379.db2.gz	OSVBKCFUNAYEEZ-UHFFFAOYSA-N	1	1	319.361	1.800	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000330575854	410791032	/nfs/dbraw/zinc/79/10/32/410791032.db2.gz	GEEHLZVIRMOIPO-STQMWFEESA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330579870	410795162	/nfs/dbraw/zinc/79/51/62/410795162.db2.gz	IHOMCXCZHJJCMT-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000330647657	410847211	/nfs/dbraw/zinc/84/72/11/410847211.db2.gz	ZRWQHQLOOIBENL-RYUDHWBXSA-N	1	1	307.350	1.525	20	5		DDBDMO
Cc1cc(OCC(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000331208984	411020553	/nfs/dbraw/zinc/02/05/53/411020553.db2.gz	WHJBVOMOGOBAQI-OLZOCXBDSA-N	1	1	321.377	1.833	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331241397	411035341	/nfs/dbraw/zinc/03/53/41/411035341.db2.gz	NGEDMVUONDYAIN-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000331241397	411035347	/nfs/dbraw/zinc/03/53/47/411035347.db2.gz	NGEDMVUONDYAIN-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331241397	411035353	/nfs/dbraw/zinc/03/53/53/411035353.db2.gz	NGEDMVUONDYAIN-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
COc1c(C(=O)NCC2=CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000356672487	411120423	/nfs/dbraw/zinc/12/04/23/411120423.db2.gz	KEGYBOKDXZMJIC-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCc3ccccc3[C@@H]2CO)n1	ZINC000130866360	196117243	/nfs/dbraw/zinc/11/72/43/196117243.db2.gz	SOMAIPSBEVAFIL-AWEZNQCLSA-N	1	1	302.334	1.383	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000580328857	422921104	/nfs/dbraw/zinc/92/11/04/422921104.db2.gz	GDZLLQMNNDNOMO-UHFFFAOYSA-N	1	1	303.322	1.653	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CSc1ccc([N+](=O)[O-])cn1	ZINC000580660279	422947495	/nfs/dbraw/zinc/94/74/95/422947495.db2.gz	YZHRIAPBYPRZAN-LLVKDONJSA-N	1	1	301.368	1.021	20	5		DDBDMO
Cc1nc(NC[C@H](C(C)C)[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000296586868	226022024	/nfs/dbraw/zinc/02/20/24/226022024.db2.gz	RODVWLSNXJOBLW-GFCCVEGCSA-N	1	1	309.370	1.462	20	5		DDBDMO
COc1cc(C[N@@H+]2CCc3n[nH]c(=O)cc3C2)ccc1[N+](=O)[O-]	ZINC000360444397	418436705	/nfs/dbraw/zinc/43/67/05/418436705.db2.gz	OOWLFSHAMQRVFX-UHFFFAOYSA-N	1	1	316.317	1.657	20	5		DDBDMO
COc1cc(C[N@H+]2CCc3n[nH]c(=O)cc3C2)ccc1[N+](=O)[O-]	ZINC000360444397	418436706	/nfs/dbraw/zinc/43/67/06/418436706.db2.gz	OOWLFSHAMQRVFX-UHFFFAOYSA-N	1	1	316.317	1.657	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360945990	418552217	/nfs/dbraw/zinc/55/22/17/418552217.db2.gz	SUXNAGYZENRUNZ-ZWNOBZJWSA-N	1	1	318.377	1.849	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)n1	ZINC000191840314	222109574	/nfs/dbraw/zinc/10/95/74/222109574.db2.gz	YTMOVQFBUWUNFR-ZJUUUORDSA-N	1	1	307.354	1.166	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1	ZINC000375011468	418587954	/nfs/dbraw/zinc/58/79/54/418587954.db2.gz	FZGIKRQOISLMBE-ZIAGYGMSSA-N	1	1	308.382	1.930	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)C[C@@H]21	ZINC000375050720	418596667	/nfs/dbraw/zinc/59/66/67/418596667.db2.gz	SFDVBJDHPQAUOU-CABZTGNLSA-N	1	1	303.322	1.661	20	5		DDBDMO
CN(CC(=O)N[C@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-]	ZINC000361353926	418633247	/nfs/dbraw/zinc/63/32/47/418633247.db2.gz	JGDGPGWREBSERO-LBPRGKRZSA-N	1	1	318.377	1.384	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000357772219	418651907	/nfs/dbraw/zinc/65/19/07/418651907.db2.gz	AFSTYQCYLFNDKH-LLVKDONJSA-N	1	1	306.370	2.170	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H]3C(=O)NC[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000368067869	418684379	/nfs/dbraw/zinc/68/43/79/418684379.db2.gz	BSONQEBLQMMIQP-WDEREUQCSA-N	1	1	323.324	1.310	20	5		DDBDMO
C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000372125446	418838664	/nfs/dbraw/zinc/83/86/64/418838664.db2.gz	KBCVMYVNGCFKNW-BYCMXARLSA-N	1	1	318.377	1.388	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420936459	419370314	/nfs/dbraw/zinc/37/03/14/419370314.db2.gz	INMBHEOIVQFOFP-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420936459	419370318	/nfs/dbraw/zinc/37/03/18/419370318.db2.gz	INMBHEOIVQFOFP-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000420948120	419375678	/nfs/dbraw/zinc/37/56/78/419375678.db2.gz	VJWNIIKPZQWSPE-VNHYZAJKSA-N	1	1	324.377	1.285	20	5		DDBDMO
COC(=O)[C@@H](C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411687830	419380733	/nfs/dbraw/zinc/38/07/33/419380733.db2.gz	ZFPSHRPGWNUWFP-SNVBAGLBSA-N	1	1	309.322	1.417	20	5		DDBDMO
COC(=O)[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411687830	419380736	/nfs/dbraw/zinc/38/07/36/419380736.db2.gz	ZFPSHRPGWNUWFP-SNVBAGLBSA-N	1	1	309.322	1.417	20	5		DDBDMO
Nc1c([N+](=O)[O-])cnn1Cc1cccc(C[NH+]2CCOCC2)c1	ZINC000421220048	419526493	/nfs/dbraw/zinc/52/64/93/419526493.db2.gz	VUZADUBFFYGLCP-UHFFFAOYSA-N	1	1	317.349	1.254	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](CO)[C@@H]1C	ZINC000412067522	419616683	/nfs/dbraw/zinc/61/66/83/419616683.db2.gz	DTNIRYVEFAANPZ-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](CO)[C@@H]1C	ZINC000412067522	419616690	/nfs/dbraw/zinc/61/66/90/419616690.db2.gz	DTNIRYVEFAANPZ-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](O)[C@H](CO)C1	ZINC000412108265	419669861	/nfs/dbraw/zinc/66/98/61/419669861.db2.gz	SAXOHZSAIZXSPY-GXTWGEPZSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](O)[C@H](CO)C1	ZINC000412108265	419669870	/nfs/dbraw/zinc/66/98/70/419669870.db2.gz	SAXOHZSAIZXSPY-GXTWGEPZSA-N	1	1	310.350	1.169	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000427968836	419778118	/nfs/dbraw/zinc/77/81/18/419778118.db2.gz	VHDAEBSRGVCDHV-RISCZKNCSA-N	1	1	319.361	1.514	20	5		DDBDMO
COCC[N@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H]1CCCSC1	ZINC000433187813	229169805	/nfs/dbraw/zinc/16/98/05/229169805.db2.gz	BKDXTMGVPQYCFE-NSHDSACASA-N	1	1	314.411	1.672	20	5		DDBDMO
COCC[N@@H+](Cc1c([N+](=O)[O-])ncn1C)[C@H]1CCCSC1	ZINC000433187813	229169809	/nfs/dbraw/zinc/16/98/09/229169809.db2.gz	BKDXTMGVPQYCFE-NSHDSACASA-N	1	1	314.411	1.672	20	5		DDBDMO
COC(=O)CCNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000429262185	419993804	/nfs/dbraw/zinc/99/38/04/419993804.db2.gz	DTVHVJXDGIMSIQ-UHFFFAOYSA-N	1	1	323.349	1.099	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000429881828	420057069	/nfs/dbraw/zinc/05/70/69/420057069.db2.gz	DMRUDBQORPFEMZ-GFCCVEGCSA-N	1	1	305.378	1.940	20	5		DDBDMO
CCOCC[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000430230562	420092414	/nfs/dbraw/zinc/09/24/14/420092414.db2.gz	WPOKNZDEBWBAEK-UHFFFAOYSA-N	1	1	323.393	1.758	20	5		DDBDMO
[NH3+]CC[C@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(F)F	ZINC000420270069	420175974	/nfs/dbraw/zinc/17/59/74/420175974.db2.gz	UMLFQMXGOVOVIC-VIFPVBQESA-N	1	1	313.264	2.039	20	5		DDBDMO
COc1ccc(OCCN[C@@H]2CC[NH2+]CC2(C)C)c([N+](=O)[O-])c1	ZINC000420359694	420233261	/nfs/dbraw/zinc/23/32/61/420233261.db2.gz	KCIBSYUEHQMUFX-OAHLLOKOSA-N	1	1	323.393	1.960	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@H](CN)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000420356300	420234516	/nfs/dbraw/zinc/23/45/16/420234516.db2.gz	GAGPKJQBAVOEBT-AWEZNQCLSA-N	1	1	311.382	1.945	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1ccc(Br)cc1[N+](=O)[O-]	ZINC000425459532	420390689	/nfs/dbraw/zinc/39/06/89/420390689.db2.gz	PUSIYAZKWBLKIL-UHFFFAOYSA-N	1	1	316.155	1.665	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C	ZINC000444700024	230123605	/nfs/dbraw/zinc/12/36/05/230123605.db2.gz	FOSHXCNRDUJYOA-GXSJLCMTSA-N	1	1	318.333	1.855	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C	ZINC000444700024	230123610	/nfs/dbraw/zinc/12/36/10/230123610.db2.gz	FOSHXCNRDUJYOA-GXSJLCMTSA-N	1	1	318.333	1.855	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CC1(CO)CC1	ZINC000446065625	230226737	/nfs/dbraw/zinc/22/67/37/230226737.db2.gz	AQZOZDKXLIZFQT-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CC1(CO)CC1	ZINC000446065625	230226743	/nfs/dbraw/zinc/22/67/43/230226743.db2.gz	AQZOZDKXLIZFQT-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000457072538	420603292	/nfs/dbraw/zinc/60/32/92/420603292.db2.gz	JETQJRHTHHVCGP-UHFFFAOYSA-N	1	1	324.356	1.920	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457115277	420619542	/nfs/dbraw/zinc/61/95/42/420619542.db2.gz	KWSBUMIMKVJRGB-JTQLQIEISA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457115277	420619546	/nfs/dbraw/zinc/61/95/46/420619546.db2.gz	KWSBUMIMKVJRGB-JTQLQIEISA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457115277	420619558	/nfs/dbraw/zinc/61/95/58/420619558.db2.gz	KWSBUMIMKVJRGB-JTQLQIEISA-N	1	1	309.370	1.435	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](C)C[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000452069489	420620705	/nfs/dbraw/zinc/62/07/05/420620705.db2.gz	PZPKGFHNALMULA-RYUDHWBXSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000452068540	420620834	/nfs/dbraw/zinc/62/08/34/420620834.db2.gz	OSUXFJMZOKOXFF-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000492665021	420621822	/nfs/dbraw/zinc/62/18/22/420621822.db2.gz	YWVTZMFIBSKNPA-IRBQFCFKSA-N	1	1	319.361	1.133	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@](O)(CO)C1	ZINC000459654247	420841444	/nfs/dbraw/zinc/84/14/44/420841444.db2.gz	YXTDVRKJQCTBOK-OAHLLOKOSA-N	1	1	310.350	1.313	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@](O)(CO)C1	ZINC000459654247	420841449	/nfs/dbraw/zinc/84/14/49/420841449.db2.gz	YXTDVRKJQCTBOK-OAHLLOKOSA-N	1	1	310.350	1.313	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CNC[C@H]1CCC[N@@H+]1CCCO	ZINC000449388184	421003122	/nfs/dbraw/zinc/00/31/22/421003122.db2.gz	OKTJBKFWSJBDPO-MRXNPFEDSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CNC[C@H]1CCC[N@H+]1CCCO	ZINC000449388184	421003126	/nfs/dbraw/zinc/00/31/26/421003126.db2.gz	OKTJBKFWSJBDPO-MRXNPFEDSA-N	1	1	307.394	1.840	20	5		DDBDMO
CN1CC[NH+](CCNc2nccc3c2cccc3[N+](=O)[O-])CC1	ZINC000450233735	421167930	/nfs/dbraw/zinc/16/79/30/421167930.db2.gz	ONHJMGYEKDAOFG-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000560978311	421301385	/nfs/dbraw/zinc/30/13/85/421301385.db2.gz	AEILUQFFTQCNMB-LLVKDONJSA-N	1	1	309.370	1.558	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000525803886	421303057	/nfs/dbraw/zinc/30/30/57/421303057.db2.gz	XYXAXFMQIPQLIY-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000546810967	421312070	/nfs/dbraw/zinc/31/20/70/421312070.db2.gz	DRBANJHDLSYPCQ-IUODEOHRSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[N@H+](Cc1ccc(C)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000524753473	421269601	/nfs/dbraw/zinc/26/96/01/421269601.db2.gz	JDNNQPZMJDOJPX-INIZCTEOSA-N	1	1	318.377	1.983	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000516904003	421576969	/nfs/dbraw/zinc/57/69/69/421576969.db2.gz	BFYAJTZEOLLNLS-ZDUSSCGKSA-N	1	1	321.377	1.489	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])nc1	ZINC000517005731	421586349	/nfs/dbraw/zinc/58/63/49/421586349.db2.gz	JWZOTTMKVKLWLF-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000536639861	421723423	/nfs/dbraw/zinc/72/34/23/421723423.db2.gz	APQSADAIZHZYTN-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000536639861	421723426	/nfs/dbraw/zinc/72/34/26/421723426.db2.gz	APQSADAIZHZYTN-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000558759147	421824851	/nfs/dbraw/zinc/82/48/51/421824851.db2.gz	WCTDGAGSFYNOBD-NSHDSACASA-N	1	1	307.354	1.122	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000540951070	421778269	/nfs/dbraw/zinc/77/82/69/421778269.db2.gz	XMRPBUMPUZGQOR-NSHDSACASA-N	1	1	307.350	1.761	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000540951070	421778270	/nfs/dbraw/zinc/77/82/70/421778270.db2.gz	XMRPBUMPUZGQOR-NSHDSACASA-N	1	1	307.350	1.761	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)n1	ZINC000344645092	272078027	/nfs/dbraw/zinc/07/80/27/272078027.db2.gz	CNYCURFUMVGPOU-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000345916002	272364904	/nfs/dbraw/zinc/36/49/04/272364904.db2.gz	YZAZCAXIQRZOND-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000345995708	272385178	/nfs/dbraw/zinc/38/51/78/272385178.db2.gz	UKJCQTJZEKFKLP-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000330559660	274218364	/nfs/dbraw/zinc/21/83/64/274218364.db2.gz	HJIUFEVWOKUZIO-RYUDHWBXSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000277929620	274220586	/nfs/dbraw/zinc/22/05/86/274220586.db2.gz	UEXBVVYLMBBCLP-JTQLQIEISA-N	1	1	305.338	1.604	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2C[C@@H]3C(=O)NC(=O)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000449522044	276053242	/nfs/dbraw/zinc/05/32/42/276053242.db2.gz	KHEWXTGHOVOEPZ-BETUJISGSA-N	1	1	317.345	1.423	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000110993430	276157178	/nfs/dbraw/zinc/15/71/78/276157178.db2.gz	KWNCOHGVIKBLFU-LLVKDONJSA-N	1	1	309.370	1.241	20	5		DDBDMO
CCOC[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000459711061	276333975	/nfs/dbraw/zinc/33/39/75/276333975.db2.gz	LVONBXMSGVPNAT-CQSZACIVSA-N	1	1	309.366	1.648	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193658123	278215079	/nfs/dbraw/zinc/21/50/79/278215079.db2.gz	SKQXGCOXMZUCIL-RWMBFGLXSA-N	1	1	318.377	1.415	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)n1	ZINC000186813418	281012211	/nfs/dbraw/zinc/01/22/11/281012211.db2.gz	YFDBCFIEXUHSBK-GFCCVEGCSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)[NH+]1CCSCC1	ZINC000151784130	281702236	/nfs/dbraw/zinc/70/22/36/281702236.db2.gz	FSJVKZHXWPCJKR-LLVKDONJSA-N	1	1	309.391	1.648	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1CO	ZINC000305429848	533693788	/nfs/dbraw/zinc/69/37/88/533693788.db2.gz	DLDTWSBNFQCPSW-QMTHXVAHSA-N	1	1	307.350	1.287	20	5		DDBDMO
NC(=O)C[N@@H+](CCC1CCCCC1)CCn1ccc([N+](=O)[O-])n1	ZINC000357924852	299022047	/nfs/dbraw/zinc/02/20/47/299022047.db2.gz	GBGVEXFFORFLNZ-UHFFFAOYSA-N	1	1	323.397	1.549	20	5		DDBDMO
COC(=O)CN1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000363329125	300252275	/nfs/dbraw/zinc/25/22/75/300252275.db2.gz	AFXOABMMRLWAAZ-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COC(=O)CN1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000363329125	300252277	/nfs/dbraw/zinc/25/22/77/300252277.db2.gz	AFXOABMMRLWAAZ-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000363439882	300267821	/nfs/dbraw/zinc/26/78/21/300267821.db2.gz	OQXXLTKQQNAXAS-SNVBAGLBSA-N	1	1	306.322	1.006	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCC[C@H]2c2nccs2)c1	ZINC000368404316	301020185	/nfs/dbraw/zinc/02/01/85/301020185.db2.gz	LIHNCFGZVNSCLG-NEPJUHHUSA-N	1	1	323.378	1.446	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2nccs2)c1	ZINC000368404316	301020187	/nfs/dbraw/zinc/02/01/87/301020187.db2.gz	LIHNCFGZVNSCLG-NEPJUHHUSA-N	1	1	323.378	1.446	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3CC[N@H+](C)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000368587738	301058682	/nfs/dbraw/zinc/05/86/82/301058682.db2.gz	DRYJEIJFSCZHAM-CJNGLKHVSA-N	1	1	317.389	1.998	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)C1	ZINC000369359358	301171390	/nfs/dbraw/zinc/17/13/90/301171390.db2.gz	QQASQGKDBBISRB-MRXNPFEDSA-N	1	1	318.421	1.807	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@H]2OCC[C@H]2C1	ZINC000376048123	302031155	/nfs/dbraw/zinc/03/11/55/302031155.db2.gz	PYFBGFASRWGYQX-KCQAQPDRSA-N	1	1	322.361	1.445	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CCN(c2cc[nH+]cc2)CC1	ZINC000368929741	307112994	/nfs/dbraw/zinc/11/29/94/307112994.db2.gz	IUUBTYVEHXKFDL-ZIAGYGMSSA-N	1	1	304.350	1.174	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@@H](O)C3(CC3)C2)c2c(c1)COCO2	ZINC000373512578	307189577	/nfs/dbraw/zinc/18/95/77/307189577.db2.gz	LSCRDMDUAMECCQ-CYBMUJFWSA-N	1	1	306.318	1.418	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H](O)C3(CC3)C2)c2c(c1)COCO2	ZINC000373512578	307189578	/nfs/dbraw/zinc/18/95/78/307189578.db2.gz	LSCRDMDUAMECCQ-CYBMUJFWSA-N	1	1	306.318	1.418	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C[C@@H]21	ZINC000375047435	307217880	/nfs/dbraw/zinc/21/78/80/307217880.db2.gz	DDQQTRDWIAFFNO-QWRGUYRKSA-N	1	1	302.338	1.168	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)O1	ZINC000375573268	307228452	/nfs/dbraw/zinc/22/84/52/307228452.db2.gz	VEZDRAZOVWTJDW-HNNXBMFYSA-N	1	1	321.333	1.548	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)[C@H]3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000376663593	307252422	/nfs/dbraw/zinc/25/24/22/307252422.db2.gz	LJGVZJBHDXMSEJ-JQWIXIFHSA-N	1	1	320.349	1.170	20	5		DDBDMO
O=C1OCCN1C[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000497296033	307389246	/nfs/dbraw/zinc/38/92/46/307389246.db2.gz	HKBZDPJBVIVITF-ZDUSSCGKSA-N	1	1	305.334	1.869	20	5		DDBDMO
O=C(N[C@H]1CCCC[C@H]1[NH+]1CCOCC1)c1ccc([N+](=O)[O-])[nH]1	ZINC000531665065	307621694	/nfs/dbraw/zinc/62/16/94/307621694.db2.gz	PIVDEXDLUCWNTJ-WCQYABFASA-N	1	1	322.365	1.296	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000567178777	308075181	/nfs/dbraw/zinc/07/51/81/308075181.db2.gz	PSIHNVINLIDZSW-ZDUSSCGKSA-N	1	1	305.378	1.938	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488801831	484218360	/nfs/dbraw/zinc/21/83/60/484218360.db2.gz	NHVIXJIZBKDJLO-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488805476	484220454	/nfs/dbraw/zinc/22/04/54/484220454.db2.gz	SUJWOHPLVDOQEA-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000361591241	484521104	/nfs/dbraw/zinc/52/11/04/484521104.db2.gz	YPNRDUHHDYWNKI-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC(=O)Cc1ccc(N(C)CC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000294858570	533751338	/nfs/dbraw/zinc/75/13/38/533751338.db2.gz	CVUKPBKLBWRTJB-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
COc1cc(C[N@@H+](C)CC2(O)CCOCC2)ccc1[N+](=O)[O-]	ZINC000444753513	533782119	/nfs/dbraw/zinc/78/21/19/533782119.db2.gz	NYHFEKQEPWZVIK-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000416994090	534354981	/nfs/dbraw/zinc/35/49/81/534354981.db2.gz	JIJLEUREDYTDBI-VXGBXAGGSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000416994090	534354983	/nfs/dbraw/zinc/35/49/83/534354983.db2.gz	JIJLEUREDYTDBI-VXGBXAGGSA-N	1	1	322.365	1.514	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]([C@@H](C)[NH3+])C2)c1[N+](=O)[O-]	ZINC000156444174	521326215	/nfs/dbraw/zinc/32/62/15/521326215.db2.gz	COPPJLYFHGEBFH-ZJUUUORDSA-N	1	1	309.370	1.470	20	5		DDBDMO
CCC[C@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)CC[N@H+]1CCOC	ZINC000297400131	528402911	/nfs/dbraw/zinc/40/29/11/528402911.db2.gz	FSYMEAUFNUHXDP-ZDUSSCGKSA-N	1	1	323.397	1.630	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000330890005	528547694	/nfs/dbraw/zinc/54/76/94/528547694.db2.gz	BPXYYFSFWDHXDO-NXEZZACHSA-N	1	1	309.370	1.483	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452185428	529049219	/nfs/dbraw/zinc/04/92/19/529049219.db2.gz	NBUIFTVNQIRBAI-SWLSCSKDSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452185428	529049225	/nfs/dbraw/zinc/04/92/25/529049225.db2.gz	NBUIFTVNQIRBAI-SWLSCSKDSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000736846954	598810263	/nfs/dbraw/zinc/81/02/63/598810263.db2.gz	DFFLGBVPQQDTQU-VIFPVBQESA-N	1	1	303.326	1.139	20	5		DDBDMO
CC[N@H+]1C[C@H](C)[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000821242875	606732041	/nfs/dbraw/zinc/73/20/41/606732041.db2.gz	XGIKUCLABASLQB-TVQRCGJNSA-N	1	1	317.353	1.527	20	5		DDBDMO
CC(C)[C@H](C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)[NH+](C)C	ZINC000798824935	700099569	/nfs/dbraw/zinc/09/95/69/700099569.db2.gz	GPSQYFFFBYOIRY-CQSZACIVSA-N	1	1	323.349	1.663	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000118400680	696673342	/nfs/dbraw/zinc/67/33/42/696673342.db2.gz	FKHMMIFIJYBMTO-JTQLQIEISA-N	1	1	313.741	1.643	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H]1CO)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000118400680	696673343	/nfs/dbraw/zinc/67/33/43/696673343.db2.gz	FKHMMIFIJYBMTO-JTQLQIEISA-N	1	1	313.741	1.643	20	5		DDBDMO
Cc1ccc(C(=O)OCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000748491992	700121678	/nfs/dbraw/zinc/12/16/78/700121678.db2.gz	NKRJHATUTPVAQK-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
C[NH+]1CCN(C(=O)CNc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000749320383	700156454	/nfs/dbraw/zinc/15/64/54/700156454.db2.gz	RTTKHJKORWOIEV-UHFFFAOYSA-N	1	1	314.292	1.059	20	5		DDBDMO
NC(=O)CC[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776583014	698121753	/nfs/dbraw/zinc/12/17/53/698121753.db2.gz	YNVFMJQMUPIYEW-DOMZBBRYSA-N	1	1	321.377	1.606	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854185	698144024	/nfs/dbraw/zinc/14/40/24/698144024.db2.gz	PZKWPPHBZIBTOB-BXUZGUMPSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854185	698144028	/nfs/dbraw/zinc/14/40/28/698144028.db2.gz	PZKWPPHBZIBTOB-BXUZGUMPSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637417	699820529	/nfs/dbraw/zinc/82/05/29/699820529.db2.gz	WINGXHOGAYGTTE-WDEREUQCSA-N	1	1	321.333	1.696	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637417	699820532	/nfs/dbraw/zinc/82/05/32/699820532.db2.gz	WINGXHOGAYGTTE-WDEREUQCSA-N	1	1	321.333	1.696	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000743978818	699931698	/nfs/dbraw/zinc/93/16/98/699931698.db2.gz	PDLWCHKFWKHUDL-NSHDSACASA-N	1	1	320.349	1.134	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000758332462	700699158	/nfs/dbraw/zinc/69/91/58/700699158.db2.gz	BJFDNSBOFSVNLQ-RNCFNFMXSA-N	1	1	307.325	1.946	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](C(F)(F)F)C1	ZINC000761711013	700867766	/nfs/dbraw/zinc/86/77/66/700867766.db2.gz	IVKRFSOUHDXMDC-VIFPVBQESA-N	1	1	305.256	1.641	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804416745	701187945	/nfs/dbraw/zinc/18/79/45/701187945.db2.gz	RKMBKQSPUPJNAD-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000771941409	701337630	/nfs/dbraw/zinc/33/76/30/701337630.db2.gz	URQCVCNYESLEAZ-UHFFFAOYSA-N	1	1	323.280	1.861	20	5		DDBDMO
COC(=O)[C@]1(C)CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839668352	701773840	/nfs/dbraw/zinc/77/38/40/701773840.db2.gz	ZRGXFQMRYHLJCZ-GOEBONIOSA-N	1	1	322.361	1.903	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000810839419	701859961	/nfs/dbraw/zinc/85/99/61/701859961.db2.gz	AYZLUZILNCPNHH-CHWSQXEVSA-N	1	1	322.365	1.660	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000868075530	701927144	/nfs/dbraw/zinc/92/71/44/701927144.db2.gz	KXLFDLNUDGUOPQ-DZGCQCFKSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C2)C1	ZINC000868535305	702183143	/nfs/dbraw/zinc/18/31/43/702183143.db2.gz	REFVXADOGIATRI-MRXNPFEDSA-N	1	1	321.352	1.831	20	5		DDBDMO
O=[N+]([O-])c1ccccc1Cc1noc(C[NH2+]C[C@@H]2CCCO2)n1	ZINC000843170617	702832427	/nfs/dbraw/zinc/83/24/27/702832427.db2.gz	HXEHWLXFSIXWEE-LBPRGKRZSA-N	1	1	318.333	1.837	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OC[C@H]2CC[N@H+]2C(C)(C)C)n1	ZINC000845735918	703195008	/nfs/dbraw/zinc/19/50/08/703195008.db2.gz	MZWRWFVBVVNPRN-SNVBAGLBSA-N	1	1	310.354	1.841	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)N(C)OCC	ZINC000846062267	703232389	/nfs/dbraw/zinc/23/23/89/703232389.db2.gz	AYZQOVBPFOLSRT-UHFFFAOYSA-N	1	1	311.338	1.493	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481550	703555577	/nfs/dbraw/zinc/55/55/77/703555577.db2.gz	ZZZVOGHIYCQCMF-HUUCEWRRSA-N	1	1	319.361	1.589	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481550	703555579	/nfs/dbraw/zinc/55/55/79/703555579.db2.gz	ZZZVOGHIYCQCMF-HUUCEWRRSA-N	1	1	319.361	1.589	20	5		DDBDMO
O=C1CC[C@H](C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851844329	703868882	/nfs/dbraw/zinc/86/88/82/703868882.db2.gz	VVWGGNHIXBTEKE-ZYHUDNBSSA-N	1	1	306.322	1.182	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@](O)(C3CC3)C2)cc1	ZINC000852500766	704063859	/nfs/dbraw/zinc/06/38/59/704063859.db2.gz	DKDYKZIVGDFEFH-HZPDHXFCSA-N	1	1	306.362	1.865	20	5		DDBDMO
CCO[C@@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870873483	704152925	/nfs/dbraw/zinc/15/29/25/704152925.db2.gz	CUDKDDWXHPKDOJ-ZBFHGGJFSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000870874382	704153309	/nfs/dbraw/zinc/15/33/09/704153309.db2.gz	IVGVBGLNBOHXBP-MEDUHNTESA-N	1	1	321.377	1.795	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])nc1Br	ZINC000853064144	704191340	/nfs/dbraw/zinc/19/13/40/704191340.db2.gz	FDTCNIAXLLGCNM-MRVPVSSYSA-N	1	1	321.175	1.255	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853500388	704251308	/nfs/dbraw/zinc/25/13/08/704251308.db2.gz	JNOASLJTOYDDEE-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853500388	704251310	/nfs/dbraw/zinc/25/13/10/704251310.db2.gz	JNOASLJTOYDDEE-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cn1ncc3ccc([N+](=O)[O-])cc31)C2	ZINC000853565927	704271858	/nfs/dbraw/zinc/27/18/58/704271858.db2.gz	KQZQQFKFJRNRFM-IUODEOHRSA-N	1	1	302.334	1.870	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1CO	ZINC000856795793	704539042	/nfs/dbraw/zinc/53/90/42/704539042.db2.gz	JZYGBHQKMXLJGP-JQWIXIFHSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H]1CO	ZINC000856795793	704539043	/nfs/dbraw/zinc/53/90/43/704539043.db2.gz	JZYGBHQKMXLJGP-JQWIXIFHSA-N	1	1	309.322	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000821955462	704847789	/nfs/dbraw/zinc/84/77/89/704847789.db2.gz	RFDCLAXUZKKRFA-OAHLLOKOSA-N	1	1	307.350	1.008	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000822635020	704993541	/nfs/dbraw/zinc/99/35/41/704993541.db2.gz	NIHXJYUIZDOBAQ-VIFPVBQESA-N	1	1	321.293	1.180	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823970664	705347451	/nfs/dbraw/zinc/34/74/51/705347451.db2.gz	GTSFGJNGYMAYJE-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000862788448	705798144	/nfs/dbraw/zinc/79/81/44/705798144.db2.gz	CVSGDGAAHYKAMU-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000862794749	705800322	/nfs/dbraw/zinc/80/03/22/705800322.db2.gz	HARPOQYTXYZJGK-SWLSCSKDSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000827137219	705937818	/nfs/dbraw/zinc/93/78/18/705937818.db2.gz	VHAHOYQPYMMQOU-ILXRZTDVSA-N	1	1	303.362	1.909	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321177	705974928	/nfs/dbraw/zinc/97/49/28/705974928.db2.gz	USKDPSJOXSECDK-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321177	705974930	/nfs/dbraw/zinc/97/49/30/705974930.db2.gz	USKDPSJOXSECDK-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321177	705974932	/nfs/dbraw/zinc/97/49/32/705974932.db2.gz	USKDPSJOXSECDK-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@]2(CNC(=O)C2)C1	ZINC000877485245	706120176	/nfs/dbraw/zinc/12/01/76/706120176.db2.gz	NNQOUNWGBJULCG-MRXNPFEDSA-N	1	1	303.362	1.924	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC000829455185	706336463	/nfs/dbraw/zinc/33/64/63/706336463.db2.gz	LCKGZXLVLWIIND-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
CN(C)C(=O)OCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865940413	706571181	/nfs/dbraw/zinc/57/11/81/706571181.db2.gz	CGDSVEUCRLSNAL-UHFFFAOYSA-N	1	1	304.306	1.675	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3nccs3)C2)c1	ZINC000880318445	706939347	/nfs/dbraw/zinc/93/93/47/706939347.db2.gz	ZEQFUSSTOJCZJY-JQWIXIFHSA-N	1	1	323.378	1.098	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880433022	706974453	/nfs/dbraw/zinc/97/44/53/706974453.db2.gz	SSEABQYWVCCHAV-RRFJBIMHSA-N	1	1	310.350	1.364	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1	ZINC000881996101	707459425	/nfs/dbraw/zinc/45/94/25/707459425.db2.gz	IMBBMMZDTQLEBL-UHFFFAOYSA-N	1	1	306.301	1.189	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000882485343	707655954	/nfs/dbraw/zinc/65/59/54/707655954.db2.gz	HNSZBBPQTVHMKM-LLVKDONJSA-N	1	1	302.334	1.900	20	5		DDBDMO
Cc1c(CNC[C@@H]2CCC[N@@H+]2CCCO)cccc1[N+](=O)[O-]	ZINC000873128783	707742248	/nfs/dbraw/zinc/74/22/48/707742248.db2.gz	DJOLSMUDWAVFMC-HNNXBMFYSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1c(CNC[C@@H]2CCC[N@H+]2CCCO)cccc1[N+](=O)[O-]	ZINC000873128783	707742253	/nfs/dbraw/zinc/74/22/53/707742253.db2.gz	DJOLSMUDWAVFMC-HNNXBMFYSA-N	1	1	307.394	1.840	20	5		DDBDMO
COC(=O)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000886012462	708681626	/nfs/dbraw/zinc/68/16/26/708681626.db2.gz	ILTNJUOTHNWZBC-CYBMUJFWSA-N	1	1	323.349	1.534	20	5		DDBDMO
COC(=O)CC[N@H+](Cc1cccnc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000886012462	708681629	/nfs/dbraw/zinc/68/16/29/708681629.db2.gz	ILTNJUOTHNWZBC-CYBMUJFWSA-N	1	1	323.349	1.534	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000912608367	713047678	/nfs/dbraw/zinc/04/76/78/713047678.db2.gz	TYPZPTSIRZYHRM-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)Cc2cccnc2[N+](=O)[O-])C[C@H](C)O1	ZINC000886176626	708710642	/nfs/dbraw/zinc/71/06/42/708710642.db2.gz	HIKNVCGBDBDDDN-BETUJISGSA-N	1	1	308.382	1.531	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)Cc2cccnc2[N+](=O)[O-])C[C@H](C)O1	ZINC000886176626	708710644	/nfs/dbraw/zinc/71/06/44/708710644.db2.gz	HIKNVCGBDBDDDN-BETUJISGSA-N	1	1	308.382	1.531	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])C[C@H]1C1CC1	ZINC000886268939	708733288	/nfs/dbraw/zinc/73/32/88/708733288.db2.gz	GBWBUAYDQRMJJW-QWHCGFSZSA-N	1	1	305.334	1.621	20	5		DDBDMO
CN1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC[N@H+](C)CC1	ZINC000888989530	709424389	/nfs/dbraw/zinc/42/43/89/709424389.db2.gz	PPBZNUQLNPFRFQ-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CN1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000888989530	709424390	/nfs/dbraw/zinc/42/43/90/709424390.db2.gz	PPBZNUQLNPFRFQ-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928444671	713199168	/nfs/dbraw/zinc/19/91/68/713199168.db2.gz	LQNYSNGWTNEZQQ-NEPJUHHUSA-N	1	1	307.350	1.573	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCCN1CC[N@@H+](C)C(C)(C)C1	ZINC000893685461	710777096	/nfs/dbraw/zinc/77/70/96/710777096.db2.gz	NYDPIBKBZFFHBN-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+]2C)cc1OC	ZINC000928566292	713230875	/nfs/dbraw/zinc/23/08/75/713230875.db2.gz	FBBMLUVUDNBELW-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C)cc1OC	ZINC000928566292	713230876	/nfs/dbraw/zinc/23/08/76/713230876.db2.gz	FBBMLUVUDNBELW-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC000928571268	713233618	/nfs/dbraw/zinc/23/36/18/713233618.db2.gz	KPZFJCIUAZOXRP-MRVPVSSYSA-N	1	1	301.705	1.821	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC000928571268	713233621	/nfs/dbraw/zinc/23/36/21/713233621.db2.gz	KPZFJCIUAZOXRP-MRVPVSSYSA-N	1	1	301.705	1.821	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000928569207	713232656	/nfs/dbraw/zinc/23/26/56/713232656.db2.gz	LGPGDUFKVBASMC-CQSZACIVSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000928569207	713232657	/nfs/dbraw/zinc/23/26/57/713232657.db2.gz	LGPGDUFKVBASMC-CQSZACIVSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[C@@H](CNC[C@H](O)C[NH+]1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643915	712104998	/nfs/dbraw/zinc/10/49/98/712104998.db2.gz	OLJQCUOLNWWVKV-KBPBESRZSA-N	1	1	307.394	1.745	20	5		DDBDMO
C[C@@H](C[NH2+]C[C@H](O)CN1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643915	712105001	/nfs/dbraw/zinc/10/50/01/712105001.db2.gz	OLJQCUOLNWWVKV-KBPBESRZSA-N	1	1	307.394	1.745	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000929119528	713550579	/nfs/dbraw/zinc/55/05/79/713550579.db2.gz	NSWQEECPHOLZLZ-TXEJJXNPSA-N	1	1	304.350	1.929	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](C)[C@H](CO)C2)ccc1[N+](=O)[O-]	ZINC000931402702	714086349	/nfs/dbraw/zinc/08/63/49/714086349.db2.gz	XGKPRDMFWMPCAI-ZDUSSCGKSA-N	1	1	309.366	1.102	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000931639134	714146486	/nfs/dbraw/zinc/14/64/86/714146486.db2.gz	HRXSNKGRYHOMBD-SMDDNHRTSA-N	1	1	310.350	1.712	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000932099098	714258011	/nfs/dbraw/zinc/25/80/11/714258011.db2.gz	JIBFGPUCWDCDLX-ZYHUDNBSSA-N	1	1	310.354	1.231	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000932348343	714315680	/nfs/dbraw/zinc/31/56/80/714315680.db2.gz	MVJBYCKZTWJVDC-OCCSQVGLSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000933560409	714617355	/nfs/dbraw/zinc/61/73/55/714617355.db2.gz	UWINTAAYUBDXEA-DFBGVHRSSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000933560409	714617357	/nfs/dbraw/zinc/61/73/57/714617357.db2.gz	UWINTAAYUBDXEA-DFBGVHRSSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925343009	714820600	/nfs/dbraw/zinc/82/06/00/714820600.db2.gz	KVTHVQZDCIDNMQ-JSGCOSHPSA-N	1	1	320.393	1.871	20	5		DDBDMO
Cc1cnc(N2CC[C@H]3[C@H]2CC[N@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922021	721849558	/nfs/dbraw/zinc/84/95/58/721849558.db2.gz	PQLPXMCEHCNYNH-UONOGXRCSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1cnc(N2CC[C@H]3[C@H]2CC[N@@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922021	721849559	/nfs/dbraw/zinc/84/95/59/721849559.db2.gz	PQLPXMCEHCNYNH-UONOGXRCSA-N	1	1	319.409	1.513	20	5		DDBDMO
CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccccc4[N+](=O)[O-])C[C@H]32)CC1	ZINC001025799451	736859609	/nfs/dbraw/zinc/85/96/09/736859609.db2.gz	OVFXJSWCWZKPHF-NHAGDIPZSA-N	1	1	315.373	1.941	20	5		DDBDMO
COc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001022063676	734368207	/nfs/dbraw/zinc/36/82/07/734368207.db2.gz	GNULRKCVNQEIFE-AYRXBEOTSA-N	1	1	319.361	1.097	20	5		DDBDMO
Cc1[nH+]c(N)ccc1CNc1c[n+]([O-])c(Cl)cc1[N+](=O)[O-]	ZINC001167782203	738351276	/nfs/dbraw/zinc/35/12/76/738351276.db2.gz	RYVMVZPVKGVAPP-UHFFFAOYSA-N	1	1	309.713	1.779	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+](CCO)CCn1ccc([N+](=O)[O-])n1	ZINC001168307732	742173481	/nfs/dbraw/zinc/17/34/81/742173481.db2.gz	FCNAZJANKUYLEA-ZDUSSCGKSA-N	1	1	304.350	1.847	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC001183658329	743888505	/nfs/dbraw/zinc/88/85/05/743888505.db2.gz	GTFRAAOPXYYTLB-UHFFFAOYSA-N	1	1	309.370	1.241	20	5		DDBDMO
O=C1OCC[C@]12CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2	ZINC001198810255	747619838	/nfs/dbraw/zinc/61/98/38/747619838.db2.gz	MIHWBCPFLRBZEH-HNNXBMFYSA-N	1	1	306.318	1.613	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018270	762199257	/nfs/dbraw/zinc/19/92/57/762199257.db2.gz	ALHFUMMMBAYKHI-AGIUHOORSA-N	1	1	323.397	1.196	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018270	762199264	/nfs/dbraw/zinc/19/92/64/762199264.db2.gz	ALHFUMMMBAYKHI-AGIUHOORSA-N	1	1	323.397	1.196	20	5		DDBDMO
CCn1cc2c(n1)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2COC	ZINC001169019273	762199362	/nfs/dbraw/zinc/19/93/62/762199362.db2.gz	HCZSONFZAQHBIR-HZSPNIEDSA-N	1	1	322.409	1.894	20	5		DDBDMO
CCn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@H]2COC	ZINC001169019273	762199366	/nfs/dbraw/zinc/19/93/66/762199366.db2.gz	HCZSONFZAQHBIR-HZSPNIEDSA-N	1	1	322.409	1.894	20	5		DDBDMO
Cc1cccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001020139367	760613682	/nfs/dbraw/zinc/61/36/82/760613682.db2.gz	ZJUNEQVMXPERPY-KBUPBQIOSA-N	1	1	303.362	1.397	20	5		DDBDMO
CC1(C)CC(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001086084242	760945223	/nfs/dbraw/zinc/94/52/23/760945223.db2.gz	JEBHUHAPTRBUGP-YXCITZCRSA-N	1	1	309.410	1.572	20	5		DDBDMO
O=C(NCC1CC[NH+](C/C=C\Cl)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001399240	762825253	/nfs/dbraw/zinc/82/52/53/762825253.db2.gz	KIFRCXRWFWYWDP-QBEVBOACSA-N	1	1	301.774	1.232	20	5		DDBDMO
C=C/C(C)=C/CC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001132516430	768945123	/nfs/dbraw/zinc/94/51/23/768945123.db2.gz	ZLHINGACFRUNIB-VZUCSPMQSA-N	1	1	307.354	1.057	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ccc([N+](=O)[O-])c(C)n2)CC[NH2+]C1	ZINC001159453404	771434991	/nfs/dbraw/zinc/43/49/91/771434991.db2.gz	PDLQIIHJMWSXFD-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001136922230	772211063	/nfs/dbraw/zinc/21/10/63/772211063.db2.gz	AMYYMIPUZRVKFL-YGRLFVJLSA-N	1	1	306.366	1.589	20	5		DDBDMO
NC(=O)[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1	ZINC001172918316	776931032	/nfs/dbraw/zinc/93/10/32/776931032.db2.gz	AQYYADJFOYGECL-ZFWWWQNUSA-N	1	1	319.361	1.028	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCn3nncc3C1)CC2	ZINC001172920576	776931085	/nfs/dbraw/zinc/93/10/85/776931085.db2.gz	KTLVYNWRQYGPTQ-AWEZNQCLSA-N	1	1	313.361	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCn3nncc3C1)CC2	ZINC001172920576	776931087	/nfs/dbraw/zinc/93/10/87/776931087.db2.gz	KTLVYNWRQYGPTQ-AWEZNQCLSA-N	1	1	313.361	1.950	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@@H]2C[C@H](CO)C[C@@H]21	ZINC001173222792	777056076	/nfs/dbraw/zinc/05/60/76/777056076.db2.gz	VPBHAYCIMQMLMB-QIJZBDPFSA-N	1	1	320.389	1.998	20	5		DDBDMO
COC(=O)N1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001173225961	777061506	/nfs/dbraw/zinc/06/15/06/777061506.db2.gz	KIXJOVHVAHCPIF-LBPRGKRZSA-N	1	1	307.350	1.910	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](S(C)(=O)=O)C1	ZINC001173227211	777062416	/nfs/dbraw/zinc/06/24/16/777062416.db2.gz	OJTNPPXIAJJMPZ-FZMZJTMJSA-N	1	1	312.391	1.645	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](S(C)(=O)=O)C1	ZINC001173227211	777062418	/nfs/dbraw/zinc/06/24/18/777062418.db2.gz	OJTNPPXIAJJMPZ-FZMZJTMJSA-N	1	1	312.391	1.645	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](C)CCN1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230956	777063870	/nfs/dbraw/zinc/06/38/70/777063870.db2.gz	GYMSYWLIQDHJTM-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C)CCN1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173230956	777063873	/nfs/dbraw/zinc/06/38/73/777063873.db2.gz	GYMSYWLIQDHJTM-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@@H](O)C3(CC3)C1)OCCO2	ZINC001116696703	780545660	/nfs/dbraw/zinc/54/56/60/780545660.db2.gz	RNBCSLYMGPHZJY-CQSZACIVSA-N	1	1	306.318	1.323	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1C[C@@H](O)C3(CC3)C1)OCCO2	ZINC001116696703	780545663	/nfs/dbraw/zinc/54/56/63/780545663.db2.gz	RNBCSLYMGPHZJY-CQSZACIVSA-N	1	1	306.318	1.323	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCn3nncc3C2)ncc1[N+](=O)[O-]	ZINC001154822836	861486864	/nfs/dbraw/zinc/48/68/64/861486864.db2.gz	VHDCIHGWWVGOJA-ONEGZZNKSA-N	1	1	315.337	1.134	20	5		DDBDMO
CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[C@@H]1[NH2+]C	ZINC001156637198	863219164	/nfs/dbraw/zinc/21/91/64/863219164.db2.gz	ATBUONHABMVRRI-MRVPVSSYSA-N	1	1	314.729	1.576	20	5		DDBDMO
C[N@@H+](C1CN(c2cc([N+](=O)[O-])cc(Cl)n2)C1)[C@H]1CCOC1	ZINC001158726120	864859990	/nfs/dbraw/zinc/85/99/90/864859990.db2.gz	PEWNZTMFPYQYSC-VIFPVBQESA-N	1	1	312.757	1.553	20	5		DDBDMO
Cc1[nH+]ccn1-c1ccc(NC(=O)c2c[nH]nc2[N+](=O)[O-])cn1	ZINC001321242319	867431098	/nfs/dbraw/zinc/43/10/98/867431098.db2.gz	CZFLFEVSGXVPTB-UHFFFAOYSA-N	1	1	313.277	1.459	20	5		DDBDMO
C[C@@H](C[NH+](C)C)Oc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC001226061420	882184295	/nfs/dbraw/zinc/18/42/95/882184295.db2.gz	IRQAEESHARCGLX-VIFPVBQESA-N	1	1	302.352	1.327	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3ncc(Cl)cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226129251	882220982	/nfs/dbraw/zinc/22/09/82/882220982.db2.gz	ANWJLTHVWYQXFP-XRNSZHNASA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ncc(Cl)cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001226129251	882220994	/nfs/dbraw/zinc/22/09/94/882220994.db2.gz	ANWJLTHVWYQXFP-XRNSZHNASA-N	1	1	311.725	1.826	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cc(NCCn2cc[nH+]c2C)n1	ZINC001163919255	868791675	/nfs/dbraw/zinc/79/16/75/868791675.db2.gz	DIAYWBBGTAQFQX-UHFFFAOYSA-N	1	1	305.294	1.393	20	5		DDBDMO
O=C(C[NH+]1CCC(CO)CC1)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001336388723	868917257	/nfs/dbraw/zinc/91/72/57/868917257.db2.gz	LQWUFOFPTYSBBA-UHFFFAOYSA-N	1	1	319.361	1.141	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@@H](CO)[C@H](CCO)C3)c2c1	ZINC001336870500	869192071	/nfs/dbraw/zinc/19/20/71/869192071.db2.gz	VJABJNMPJXLLOD-NEPJUHHUSA-N	1	1	317.345	1.570	20	5		DDBDMO
Cc1nc(N2CCC(c3c[nH+]cn3C)CC2)ncc1[N+](=O)[O-]	ZINC001336901449	869209671	/nfs/dbraw/zinc/20/96/71/869209671.db2.gz	WRLKHBNTYGZLBQ-UHFFFAOYSA-N	1	1	302.338	1.811	20	5		DDBDMO
Cn1c(C[N+](=O)[O-])nnc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC001339553467	870552327	/nfs/dbraw/zinc/55/23/27/870552327.db2.gz	OKRCWAWNDRWBSE-YPMHNXCESA-N	1	1	320.397	1.045	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1C[C@H](C)[N@@H+](CC)C[C@@H]1C	ZINC001340012705	870837395	/nfs/dbraw/zinc/83/73/95/870837395.db2.gz	TVFQQSITVPWUBU-STQMWFEESA-N	1	1	324.429	1.426	20	5		DDBDMO
O=C(NCC[N@@H+](CCC1CCCC1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001317553239	871060504	/nfs/dbraw/zinc/06/05/04/871060504.db2.gz	SYHCHXKFWPCHRO-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NCC[N@H+](CCC1CCCC1)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001317553239	871060515	/nfs/dbraw/zinc/06/05/15/871060515.db2.gz	SYHCHXKFWPCHRO-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NCC[N@@H+](CCC1CCCC1)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001317553239	871060531	/nfs/dbraw/zinc/06/05/31/871060531.db2.gz	SYHCHXKFWPCHRO-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])NCc1c[nH+]c2n1CCC2	ZINC001303550924	871133314	/nfs/dbraw/zinc/13/33/14/871133314.db2.gz	FMVVZXKQKCHNAZ-UHFFFAOYSA-N	1	1	318.308	1.736	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1C[C@H](C)[N@@H+](CC)C[C@@H]1C	ZINC001340877182	871404440	/nfs/dbraw/zinc/40/44/40/871404440.db2.gz	CRXZWLLICMCJAS-SRVKXCTJSA-N	1	1	310.402	1.555	20	5		DDBDMO
Cc1noc(C[C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC001308111906	871472751	/nfs/dbraw/zinc/47/27/51/871472751.db2.gz	BFGTYOUARRSNCL-GFCCVEGCSA-N	1	1	320.353	1.437	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CC[C@@]3(CNC(=O)C3)C2)c1[N+](=O)[O-]	ZINC001308724980	871522258	/nfs/dbraw/zinc/52/22/58/871522258.db2.gz	QGNFAWQSTJNTSN-OAHLLOKOSA-N	1	1	321.333	1.021	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@]3(CNC(=O)C3)C2)c1[N+](=O)[O-]	ZINC001308724980	871522274	/nfs/dbraw/zinc/52/22/74/871522274.db2.gz	QGNFAWQSTJNTSN-OAHLLOKOSA-N	1	1	321.333	1.021	20	5		DDBDMO
CCOCCC[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001318953774	872365496	/nfs/dbraw/zinc/36/54/96/872365496.db2.gz	UJQOSCKOVLASAH-AAVRWANBSA-N	1	1	313.398	1.095	20	5		DDBDMO
COc1c(O)ccc(CNC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC001342898352	872427682	/nfs/dbraw/zinc/42/76/82/872427682.db2.gz	QVUUNJXGKDNGHX-LLVKDONJSA-N	1	1	321.377	1.883	20	5		DDBDMO
COC(=O)c1sc([N+](=O)[O-])cc1O[C@@H]1C[NH+]2CCC1CC2	ZINC001227542216	883070839	/nfs/dbraw/zinc/07/08/39/883070839.db2.gz	VSCIGPREPUCZMT-SNVBAGLBSA-N	1	1	312.347	1.916	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2C)C1	ZINC001355414036	878545697	/nfs/dbraw/zinc/54/56/97/878545697.db2.gz	ASNDSVMJQKZSSC-RYUDHWBXSA-N	1	1	310.402	1.321	20	5		DDBDMO
C[C@H](c1ccccn1)[N@@H+]1CC[C@@H](Oc2ncncc2[N+](=O)[O-])C1	ZINC001228654010	883598770	/nfs/dbraw/zinc/59/87/70/883598770.db2.gz	DLNUXBSTSZTSML-VXGBXAGGSA-N	1	1	315.333	1.994	20	5		DDBDMO
C[C@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ncncc2[N+](=O)[O-])C1	ZINC001228654010	883598774	/nfs/dbraw/zinc/59/87/74/883598774.db2.gz	DLNUXBSTSZTSML-VXGBXAGGSA-N	1	1	315.333	1.994	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nc4c[nH]cc([N+](=O)[O-])c-4n3)[C@H]1CC(=O)C2	ZINC001230230134	884382830	/nfs/dbraw/zinc/38/28/30/884382830.db2.gz	LJZMMSNYPGQDHQ-KOLSJAJHSA-N	1	1	317.305	1.049	20	5		DDBDMO
COC[C@]12COC[C@H]1C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254595550	896522657	/nfs/dbraw/zinc/52/26/57/896522657.db2.gz	LWNMOLNFIFCDHQ-HYVNUMGLSA-N	1	1	318.373	1.657	20	5		DDBDMO
COc1ccc2ncc([N+](=O)[O-])c(NC[C@@H]3CC[N@@H+](C)C3)c2c1	ZINC001262060198	899922630	/nfs/dbraw/zinc/92/26/30/899922630.db2.gz	SOHHWAXEUJMZKK-NSHDSACASA-N	1	1	316.361	1.937	20	5		DDBDMO
COc1cc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000272850717	210246917	/nfs/dbraw/zinc/24/69/17/210246917.db2.gz	HHWWLDMZFVOCRB-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
COc1cc(CN2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000451625968	231142572	/nfs/dbraw/zinc/14/25/72/231142572.db2.gz	QXOIDGAKHWVGIJ-IINYFYTJSA-N	1	1	309.341	1.878	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000495224768	529443398	/nfs/dbraw/zinc/44/33/98/529443398.db2.gz	NQILQEBMMRGVCA-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000495224768	529443399	/nfs/dbraw/zinc/44/33/99/529443399.db2.gz	NQILQEBMMRGVCA-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072385	231290693	/nfs/dbraw/zinc/29/06/93/231290693.db2.gz	WPPMAFWQJZSQIP-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072385	231290696	/nfs/dbraw/zinc/29/06/96/231290696.db2.gz	WPPMAFWQJZSQIP-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000451248530	529485496	/nfs/dbraw/zinc/48/54/96/529485496.db2.gz	DEGIQWNYCRFFRP-JGGQBBKZSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000295617872	529790043	/nfs/dbraw/zinc/79/00/43/529790043.db2.gz	WBGMAYDCMJKPMM-CYBMUJFWSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000295617872	529790044	/nfs/dbraw/zinc/79/00/44/529790044.db2.gz	WBGMAYDCMJKPMM-CYBMUJFWSA-N	1	1	302.334	1.886	20	5		DDBDMO
CC(C)(O)CC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000267422392	282307147	/nfs/dbraw/zinc/30/71/47/282307147.db2.gz	KYNYLQQWBKPQTI-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)[N@H+](C)C1	ZINC000285287739	282343116	/nfs/dbraw/zinc/34/31/16/282343116.db2.gz	RBORNJOXOCJFJG-JSGCOSHPSA-N	1	1	323.349	1.092	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000285287739	282343118	/nfs/dbraw/zinc/34/31/18/282343118.db2.gz	RBORNJOXOCJFJG-JSGCOSHPSA-N	1	1	323.349	1.092	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H]2CCN3CCO[C@H]2C3)cc1[N+](=O)[O-]	ZINC000295159546	282363723	/nfs/dbraw/zinc/36/37/23/282363723.db2.gz	SAVKNRQRDNWELI-BBRMVZONSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1C1CC1	ZINC000272670738	210076253	/nfs/dbraw/zinc/07/62/53/210076253.db2.gz	KNLJKQDYOPFQJW-GXSJLCMTSA-N	1	1	305.334	1.655	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000272670738	210076257	/nfs/dbraw/zinc/07/62/57/210076257.db2.gz	KNLJKQDYOPFQJW-GXSJLCMTSA-N	1	1	305.334	1.655	20	5		DDBDMO
C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000272663218	210066611	/nfs/dbraw/zinc/06/66/11/210066611.db2.gz	IFNLNRGLFWEVJV-VXGBXAGGSA-N	1	1	307.350	1.903	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC[C@@](O)(CO)C2)ccc1[N+](=O)[O-]	ZINC000459628649	233385320	/nfs/dbraw/zinc/38/53/20/233385320.db2.gz	FZYYTZXMRQUGDU-HNNXBMFYSA-N	1	1	310.350	1.313	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@@](O)(CO)C2)ccc1[N+](=O)[O-]	ZINC000459628649	233385326	/nfs/dbraw/zinc/38/53/26/233385326.db2.gz	FZYYTZXMRQUGDU-HNNXBMFYSA-N	1	1	310.350	1.313	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000152434509	186072488	/nfs/dbraw/zinc/07/24/88/186072488.db2.gz	LVEFHICVUXKXLC-CMDGGOBGSA-N	1	1	321.377	1.693	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](C[C@@H]1CCOC1)C1CC1	ZINC000159744545	186139469	/nfs/dbraw/zinc/13/94/69/186139469.db2.gz	YPFTXDLGCOCICW-LBPRGKRZSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCc3cnccn3)CC2)c1	ZINC000601253526	358464558	/nfs/dbraw/zinc/46/45/58/358464558.db2.gz	UMWRAHMRWVICKV-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
CC(C)C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[NH+]1CCOCC1	ZINC000041887898	352317211	/nfs/dbraw/zinc/31/72/11/352317211.db2.gz	SKNPQDKWEOWRIE-GFCCVEGCSA-N	1	1	324.381	1.400	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000072713436	191218770	/nfs/dbraw/zinc/21/87/70/191218770.db2.gz	NCZPOONWYQDALE-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000072713436	191218773	/nfs/dbraw/zinc/21/87/73/191218773.db2.gz	NCZPOONWYQDALE-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000054223573	352683866	/nfs/dbraw/zinc/68/38/66/352683866.db2.gz	YMVARTYMFFTHGZ-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CC2CC2)CC1	ZINC000055669234	352740254	/nfs/dbraw/zinc/74/02/54/352740254.db2.gz	SCSQBYRJYNRQLF-UHFFFAOYSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-]	ZINC000491577358	234207543	/nfs/dbraw/zinc/20/75/43/234207543.db2.gz	VRKSHLLSOWRYBQ-VLWUPBBWSA-N	1	1	307.325	1.910	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1	ZINC000173808634	198255040	/nfs/dbraw/zinc/25/50/40/198255040.db2.gz	BIYYJSQIIFIPFK-LBPRGKRZSA-N	1	1	323.397	1.441	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000072665147	353207803	/nfs/dbraw/zinc/20/78/03/353207803.db2.gz	OLISUYIMNXPWKY-LLVKDONJSA-N	1	1	319.365	1.097	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000072665147	353207807	/nfs/dbraw/zinc/20/78/07/353207807.db2.gz	OLISUYIMNXPWKY-LLVKDONJSA-N	1	1	319.365	1.097	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1csc([N+](=O)[O-])c1	ZINC000076002448	353389911	/nfs/dbraw/zinc/38/99/11/353389911.db2.gz	WMEJLPXMBQAWOM-LLVKDONJSA-N	1	1	313.379	1.497	20	5		DDBDMO
Nc1nc(N[C@@H]2CC[N@@H+](CC3CCCC3)C2)ncc1[N+](=O)[O-]	ZINC000078527211	353521364	/nfs/dbraw/zinc/52/13/64/353521364.db2.gz	QNGSKOKPQVXHCT-LLVKDONJSA-N	1	1	306.370	1.643	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000087191151	353747906	/nfs/dbraw/zinc/74/79/06/353747906.db2.gz	CDHUZOQHUQWXIL-ZDUSSCGKSA-N	1	1	303.362	1.880	20	5		DDBDMO
C[C@H](O)[C@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248470811	354368856	/nfs/dbraw/zinc/36/88/56/354368856.db2.gz	VJYJQXLRXJWSBF-BFHYXJOUSA-N	1	1	324.377	1.570	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CCc3c[nH+]cn3C2)c([N+](=O)[O-])c1	ZINC000588067833	354899458	/nfs/dbraw/zinc/89/94/58/354899458.db2.gz	UAZIYASEKBKKHS-LLVKDONJSA-N	1	1	315.333	1.578	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(C)(CO)CC2)c1	ZINC000589512003	354997786	/nfs/dbraw/zinc/99/77/86/354997786.db2.gz	SJDLAGRRDCQGKI-UHFFFAOYSA-N	1	1	322.361	1.976	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C[C@H](C)[N@@H+]1C	ZINC000590146262	355054057	/nfs/dbraw/zinc/05/40/57/355054057.db2.gz	ACHZVDSZDWZAPH-AOOOYVTPSA-N	1	1	317.349	1.772	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000590548459	355111232	/nfs/dbraw/zinc/11/12/32/355111232.db2.gz	FBVBGUNVRJWQIY-CHWSQXEVSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000590572136	355117547	/nfs/dbraw/zinc/11/75/47/355117547.db2.gz	WRUBQANXSYSZHD-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000593061928	355783515	/nfs/dbraw/zinc/78/35/15/355783515.db2.gz	VPQABKZFSHYHGU-LSDHHAIUSA-N	1	1	324.377	1.964	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000593061928	355783520	/nfs/dbraw/zinc/78/35/20/355783520.db2.gz	VPQABKZFSHYHGU-LSDHHAIUSA-N	1	1	324.377	1.964	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C[C@H](C)O)C1CC1	ZINC000594067155	356104453	/nfs/dbraw/zinc/10/44/53/356104453.db2.gz	YSLSFIKXAWSMKR-JTQLQIEISA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@H](C)O)C1CC1	ZINC000594067155	356104458	/nfs/dbraw/zinc/10/44/58/356104458.db2.gz	YSLSFIKXAWSMKR-JTQLQIEISA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C(=O)NCCF	ZINC000595040802	356376184	/nfs/dbraw/zinc/37/61/84/356376184.db2.gz	XWBNLDADXVHTAV-UWVGGRQHSA-N	1	1	313.329	1.728	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(O[C@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000595348795	356458413	/nfs/dbraw/zinc/45/84/13/356458413.db2.gz	VJOGVFCDQKGBKD-LBPRGKRZSA-N	1	1	311.338	1.661	20	5		DDBDMO
COc1ccc(OCCN(C)Cc2cnc[nH]2)c([N+](=O)[O-])c1	ZINC000595596833	356568717	/nfs/dbraw/zinc/56/87/17/356568717.db2.gz	ONBUVYXLPPHZPQ-UHFFFAOYSA-N	1	1	306.322	1.837	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000595661224	356597175	/nfs/dbraw/zinc/59/71/75/356597175.db2.gz	JYEZQONNJOPOCF-OAHLLOKOSA-N	1	1	310.350	1.447	20	5		DDBDMO
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000595664633	356599470	/nfs/dbraw/zinc/59/94/70/356599470.db2.gz	RGYLCKKEVNKDQA-NWDGAFQWSA-N	1	1	314.725	1.668	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC(=O)N(C)CC2)ccc1[N+](=O)[O-]	ZINC000595775045	356647620	/nfs/dbraw/zinc/64/76/20/356647620.db2.gz	ZKDQADXERNCCIZ-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC(=O)N(C)CC2)ccc1[N+](=O)[O-]	ZINC000595775045	356647625	/nfs/dbraw/zinc/64/76/25/356647625.db2.gz	ZKDQADXERNCCIZ-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
CN1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000595780021	356649622	/nfs/dbraw/zinc/64/96/22/356649622.db2.gz	BPKBXBNZYIBNQE-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595835109	356671691	/nfs/dbraw/zinc/67/16/91/356671691.db2.gz	UNVHUHAKPXALEJ-CHWSQXEVSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595835109	356671694	/nfs/dbraw/zinc/67/16/94/356671694.db2.gz	UNVHUHAKPXALEJ-CHWSQXEVSA-N	1	1	319.361	1.810	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000595824916	356665051	/nfs/dbraw/zinc/66/50/51/356665051.db2.gz	AELLCGSNQNJQGK-CQSZACIVSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000595824916	356665058	/nfs/dbraw/zinc/66/50/58/356665058.db2.gz	AELLCGSNQNJQGK-CQSZACIVSA-N	1	1	306.366	1.783	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@H]1C	ZINC000347202610	283207221	/nfs/dbraw/zinc/20/72/21/283207221.db2.gz	KTMUWLZPDKJMIW-JQWIXIFHSA-N	1	1	308.334	1.987	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595868887	356684732	/nfs/dbraw/zinc/68/47/32/356684732.db2.gz	BYLHVNQMQXXRLP-HSMVNMDESA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595868887	356684735	/nfs/dbraw/zinc/68/47/35/356684735.db2.gz	BYLHVNQMQXXRLP-HSMVNMDESA-N	1	1	321.377	1.872	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596141634	356788934	/nfs/dbraw/zinc/78/89/34/356788934.db2.gz	ILHHAVQUNFXOQX-GFCCVEGCSA-N	1	1	320.393	1.862	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596151943	356792620	/nfs/dbraw/zinc/79/26/20/356792620.db2.gz	MYSZBNFUPDOZAV-GXFFZTMASA-N	1	1	306.366	1.470	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000596439117	356881700	/nfs/dbraw/zinc/88/17/00/356881700.db2.gz	BNMKEAILIVVVHF-NSHDSACASA-N	1	1	308.382	1.784	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)n1	ZINC000596537542	356910241	/nfs/dbraw/zinc/91/02/41/356910241.db2.gz	HLZGFFADSCEVTG-AWEZNQCLSA-N	1	1	320.393	1.642	20	5		DDBDMO
CCN(C(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000597944538	357393981	/nfs/dbraw/zinc/39/39/81/357393981.db2.gz	DVPSDXDCQYHLAB-CYBMUJFWSA-N	1	1	321.377	1.699	20	5		DDBDMO
[NH3+][C@@]12CCC[C@@H]1CN(C(=O)c1[nH]nc3ccc([N+](=O)[O-])cc31)C2	ZINC000598668054	357678453	/nfs/dbraw/zinc/67/84/53/357678453.db2.gz	OOELQRKTFWLWFA-RFAUZJTJSA-N	1	1	315.333	1.425	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000598647124	357669426	/nfs/dbraw/zinc/66/94/26/357669426.db2.gz	BUTVSAKFMWVEFV-CHWSQXEVSA-N	1	1	324.377	1.933	20	5		DDBDMO
C[N@@H+]1C2(CCC2)COC[C@]1(CO)CNc1ccc([N+](=O)[O-])cc1	ZINC000599132126	357824929	/nfs/dbraw/zinc/82/49/29/357824929.db2.gz	XWHMXONGCCPPFF-MRXNPFEDSA-N	1	1	321.377	1.623	20	5		DDBDMO
C[N@H+]1C2(CCC2)COC[C@]1(CO)CNc1ccc([N+](=O)[O-])cc1	ZINC000599132126	357824932	/nfs/dbraw/zinc/82/49/32/357824932.db2.gz	XWHMXONGCCPPFF-MRXNPFEDSA-N	1	1	321.377	1.623	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000598976972	357781145	/nfs/dbraw/zinc/78/11/45/357781145.db2.gz	XFHWBEUCXTXRBB-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)CC1(O)CCC1	ZINC000599404073	357923655	/nfs/dbraw/zinc/92/36/55/357923655.db2.gz	GZZFXKDGQNKSGV-OAHLLOKOSA-N	1	1	308.378	1.735	20	5		DDBDMO
C[C@]1(CO)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000599624942	357997416	/nfs/dbraw/zinc/99/74/16/357997416.db2.gz	ZQEHTKRHPMPOSU-IYBDPMFKSA-N	1	1	308.378	1.450	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CC2(C)COC2)c([N+](=O)[O-])c1	ZINC000599571753	357978932	/nfs/dbraw/zinc/97/89/32/357978932.db2.gz	ULOGSQVZDHWGFT-UHFFFAOYSA-N	1	1	323.349	1.510	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CC2(C)COC2)c([N+](=O)[O-])c1	ZINC000599571753	357978937	/nfs/dbraw/zinc/97/89/37/357978937.db2.gz	ULOGSQVZDHWGFT-UHFFFAOYSA-N	1	1	323.349	1.510	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](CO)C[C@H]2C)c1	ZINC000599674873	358020852	/nfs/dbraw/zinc/02/08/52/358020852.db2.gz	LTDRDGHDTKEINH-VXGBXAGGSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](CO)C[C@H]2C)c1	ZINC000599674873	358020854	/nfs/dbraw/zinc/02/08/54/358020854.db2.gz	LTDRDGHDTKEINH-VXGBXAGGSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601131507	358415049	/nfs/dbraw/zinc/41/50/49/358415049.db2.gz	ZMDDOVADHKCTCQ-CMPLNLGQSA-N	1	1	303.318	1.729	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1	ZINC000601957865	358752930	/nfs/dbraw/zinc/75/29/30/358752930.db2.gz	KPTPRVJEWPQDPT-MRXNPFEDSA-N	1	1	316.361	1.737	20	5		DDBDMO
Cn1cc(CN2CCC[N@H+](C3CCCC3)CC2)c([N+](=O)[O-])n1	ZINC000602451732	358986268	/nfs/dbraw/zinc/98/62/68/358986268.db2.gz	GPLZAPJGPUHXQR-UHFFFAOYSA-N	1	1	307.398	1.779	20	5		DDBDMO
Cn1cc(CN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])n1	ZINC000602484131	359009947	/nfs/dbraw/zinc/00/99/47/359009947.db2.gz	HPIFYHOSWNSOLR-SWLSCSKDSA-N	1	1	319.409	1.777	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@@H]21	ZINC000602997842	359345893	/nfs/dbraw/zinc/34/58/93/359345893.db2.gz	RXEPSEKECZRDHI-ILXRZTDVSA-N	1	1	321.377	1.382	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000609269455	360286198	/nfs/dbraw/zinc/28/61/98/360286198.db2.gz	QZNBVVCFFCBFAW-LLVKDONJSA-N	1	1	313.379	1.497	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])C1	ZINC000610240010	360395798	/nfs/dbraw/zinc/39/57/98/360395798.db2.gz	VBYPZTSXGDZLIX-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000611513694	360742684	/nfs/dbraw/zinc/74/26/84/360742684.db2.gz	WGFKQGQMDFWOSL-JTQLQIEISA-N	1	1	307.306	1.148	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611561473	360760851	/nfs/dbraw/zinc/76/08/51/360760851.db2.gz	JKYVDYALLWVJPW-QWRGUYRKSA-N	1	1	308.334	1.569	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000281287257	216212931	/nfs/dbraw/zinc/21/29/31/216212931.db2.gz	GTLNBITZTVPLCQ-CABCVRRESA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cn(C)nn1	ZINC000611973493	360877521	/nfs/dbraw/zinc/87/75/21/360877521.db2.gz	JEWCBOLBDMQVIL-SNVBAGLBSA-N	1	1	318.337	1.230	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCN(c2[nH]cc[nH+]2)CC1	ZINC000618903269	363789786	/nfs/dbraw/zinc/78/97/86/363789786.db2.gz	NKXYOEHZVXUTNH-UHFFFAOYSA-N	1	1	317.349	1.649	20	5		DDBDMO
CNC(=O)CCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194018533	201164078	/nfs/dbraw/zinc/16/40/78/201164078.db2.gz	NQFKVPNXZSXEJP-UHFFFAOYSA-N	1	1	310.310	1.461	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194018533	201164081	/nfs/dbraw/zinc/16/40/81/201164081.db2.gz	NQFKVPNXZSXEJP-UHFFFAOYSA-N	1	1	310.310	1.461	20	5		DDBDMO
CC1(C)C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000619187187	363926576	/nfs/dbraw/zinc/92/65/76/363926576.db2.gz	WDBROXIAHXDXFK-KGLIPLIRSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC1(C)C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000619187187	363926580	/nfs/dbraw/zinc/92/65/80/363926580.db2.gz	WDBROXIAHXDXFK-KGLIPLIRSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000275353038	212285766	/nfs/dbraw/zinc/28/57/66/212285766.db2.gz	KDNZTUBVVMWABI-VHSXEESVSA-N	1	1	315.320	1.764	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000275353038	212285769	/nfs/dbraw/zinc/28/57/69/212285769.db2.gz	KDNZTUBVVMWABI-VHSXEESVSA-N	1	1	315.320	1.764	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000349779508	284049725	/nfs/dbraw/zinc/04/97/25/284049725.db2.gz	VFGXCJHSQSJODT-NSHDSACASA-N	1	1	315.395	1.602	20	5		DDBDMO
Cc1c(NC(=O)NC[C@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000264599945	204021096	/nfs/dbraw/zinc/02/10/96/204021096.db2.gz	BHGXGTJOXGTKNZ-LBPRGKRZSA-N	1	1	321.381	1.271	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@@H+](C)C1	ZINC000264671173	204068241	/nfs/dbraw/zinc/06/82/41/204068241.db2.gz	YKVUFCCVKGCPLV-LLVKDONJSA-N	1	1	306.366	1.342	20	5		DDBDMO
CNS(=O)(=O)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000264674482	204069442	/nfs/dbraw/zinc/06/94/42/204069442.db2.gz	ZJMCYWWHTKPILV-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)(C)O	ZINC000265097779	204394112	/nfs/dbraw/zinc/39/41/12/204394112.db2.gz	CRXJXIDOXPUXJP-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)(C)O	ZINC000265097779	204394116	/nfs/dbraw/zinc/39/41/16/204394116.db2.gz	CRXJXIDOXPUXJP-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(C)C1=O	ZINC000282470138	217020322	/nfs/dbraw/zinc/02/03/22/217020322.db2.gz	KPMVLZVXVTYAIC-CYBMUJFWSA-N	1	1	305.334	1.564	20	5		DDBDMO
CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(C)C1=O	ZINC000282470138	217020325	/nfs/dbraw/zinc/02/03/25/217020325.db2.gz	KPMVLZVXVTYAIC-CYBMUJFWSA-N	1	1	305.334	1.564	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288285861	220064318	/nfs/dbraw/zinc/06/43/18/220064318.db2.gz	GOGRYCBOZDYJQB-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
CCCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(N)=O	ZINC000282837837	217283834	/nfs/dbraw/zinc/28/38/34/217283834.db2.gz	ZVRTULUZKSTZHR-UHFFFAOYSA-N	1	1	322.365	1.511	20	5		DDBDMO
CN(C)c1cc(NC(=O)CCn2cc([N+](=O)[O-])cn2)cc[nH+]1	ZINC000267219408	205902276	/nfs/dbraw/zinc/90/22/76/205902276.db2.gz	IUJFXPZVJPQTHC-UHFFFAOYSA-N	1	1	304.310	1.281	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000336860617	249269239	/nfs/dbraw/zinc/26/92/39/249269239.db2.gz	SOWXHAZUHRGCDQ-JTQLQIEISA-N	1	1	304.350	1.603	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000284931016	218240492	/nfs/dbraw/zinc/24/04/92/218240492.db2.gz	JBRVTSIGGDWBEG-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000567438727	304219183	/nfs/dbraw/zinc/21/91/83/304219183.db2.gz	DPCOCUXGBZUHJR-GFCCVEGCSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000106397022	194206053	/nfs/dbraw/zinc/20/60/53/194206053.db2.gz	KJHIBIGMPDLKGI-CQSZACIVSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000110653651	194347449	/nfs/dbraw/zinc/34/74/49/194347449.db2.gz	JZKZGFSZUZCGSZ-VIFPVBQESA-N	1	1	308.294	1.185	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H](C)[N@@H+](C)C1CC1	ZINC000057700542	184047750	/nfs/dbraw/zinc/04/77/50/184047750.db2.gz	HCZBRRPWHKGVRK-SNVBAGLBSA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@@H](O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000340982362	251318123	/nfs/dbraw/zinc/31/81/23/251318123.db2.gz	YTDXEHQHVMOBQV-PWSUYJOCSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000341024816	251344869	/nfs/dbraw/zinc/34/48/69/251344869.db2.gz	HZPCLTBPOYNTOT-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269104751	207243203	/nfs/dbraw/zinc/24/32/03/207243203.db2.gz	BLXKJRCGHSHNLZ-NWDGAFQWSA-N	1	1	321.381	1.193	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2CN2CCOCC2)cc1	ZINC000174014518	285112931	/nfs/dbraw/zinc/11/29/31/285112931.db2.gz	ONTBZBJYOZXGOM-INIZCTEOSA-N	1	1	305.378	1.891	20	5		DDBDMO
CCc1[nH+]ccn1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000158701018	197294558	/nfs/dbraw/zinc/29/45/58/197294558.db2.gz	HVDIUTVNUAAPGV-UHFFFAOYSA-N	1	1	318.289	1.721	20	5		DDBDMO
CCNC(=O)NC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352545001	285130026	/nfs/dbraw/zinc/13/00/26/285130026.db2.gz	UMYQOPDHALCGJL-NSHDSACASA-N	1	1	322.365	1.303	20	5		DDBDMO
CCNC(=O)NC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352545001	285130029	/nfs/dbraw/zinc/13/00/29/285130029.db2.gz	UMYQOPDHALCGJL-NSHDSACASA-N	1	1	322.365	1.303	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[C@H]1O	ZINC000286501151	219022448	/nfs/dbraw/zinc/02/24/48/219022448.db2.gz	MJJOEPKTTUQPIO-UKRRQHHQSA-N	1	1	319.361	1.329	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[C@H](NC[C@H]1C[NH2+]CCCO1)C1CC1	ZINC000423494110	285161993	/nfs/dbraw/zinc/16/19/93/285161993.db2.gz	RPTADJVHIPDEGC-CVEARBPZSA-N	1	1	319.405	1.884	20	5		DDBDMO
[NH3+]C[C@H]1CCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000157647215	197204222	/nfs/dbraw/zinc/20/42/22/197204222.db2.gz	YRNOMQDDUCANHX-LDYMZIIASA-N	1	1	303.322	1.328	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CCO)C[C@@H]1C	ZINC000452112975	533219538	/nfs/dbraw/zinc/21/95/38/533219538.db2.gz	HSMUYODBAGPXBE-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
[NH3+]C[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC12CCOCC2	ZINC000414796997	224396270	/nfs/dbraw/zinc/39/62/70/224396270.db2.gz	YMTPBLMFGVCPLT-CQSZACIVSA-N	1	1	305.378	1.782	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CCC[C@@H]([NH+]3CCOCC3)C2)cs1	ZINC000569499637	304358833	/nfs/dbraw/zinc/35/88/33/304358833.db2.gz	FDAQKTFOVXESFB-CYBMUJFWSA-N	1	1	311.407	1.953	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CCC[C@H]([NH+]3CCOCC3)C2)cs1	ZINC000569499639	304358855	/nfs/dbraw/zinc/35/88/55/304358855.db2.gz	FDAQKTFOVXESFB-ZDUSSCGKSA-N	1	1	311.407	1.953	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CCC[N@H+](C(C)C)C1	ZINC000069045933	406677534	/nfs/dbraw/zinc/67/75/34/406677534.db2.gz	QSNWPMXPANBSSG-CYBMUJFWSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@@H](C)[NH2+][C@H](C)C1	ZINC000070076739	406809061	/nfs/dbraw/zinc/80/90/61/406809061.db2.gz	RUABHDYNFGQKBJ-GHMZBOCLSA-N	1	1	313.379	1.274	20	5		DDBDMO
CO[C@H]1CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000076346138	406965786	/nfs/dbraw/zinc/96/57/86/406965786.db2.gz	JEWYSQHOHHMHJO-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000076346138	406965789	/nfs/dbraw/zinc/96/57/89/406965789.db2.gz	JEWYSQHOHHMHJO-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000079338050	407054745	/nfs/dbraw/zinc/05/47/45/407054745.db2.gz	MTPFJCKOTWKOPH-ZDUSSCGKSA-N	1	1	320.393	1.632	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000053403976	407168544	/nfs/dbraw/zinc/16/85/44/407168544.db2.gz	UYKFXYZSVLTIPU-LBPRGKRZSA-N	1	1	323.397	1.418	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000055758204	407207084	/nfs/dbraw/zinc/20/70/84/407207084.db2.gz	BSDYXMVATFXHMZ-FRRDWIJNSA-N	1	1	323.397	1.274	20	5		DDBDMO
Nc1nc(NCC[N@H+]2CCc3ccccc3C2)ncc1[N+](=O)[O-]	ZINC000097474148	407298517	/nfs/dbraw/zinc/29/85/17/407298517.db2.gz	RRPAIBJHGZHXLW-UHFFFAOYSA-N	1	1	314.349	1.437	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000098104764	407306029	/nfs/dbraw/zinc/30/60/29/407306029.db2.gz	SYARJVSSKLPADA-JTQLQIEISA-N	1	1	309.370	1.241	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000108340213	407384714	/nfs/dbraw/zinc/38/47/14/407384714.db2.gz	FHKXVIWLIHAZIB-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)CC1(C)C	ZINC000271076799	407503591	/nfs/dbraw/zinc/50/35/91/407503591.db2.gz	XFDZWTCUAMUWNQ-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@@H](CO)C3)n2)c1	ZINC000265924703	407510885	/nfs/dbraw/zinc/51/08/85/407510885.db2.gz	YXINDWPOEMONFY-SNVBAGLBSA-N	1	1	304.306	1.459	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](CO)C3)n2)c1	ZINC000265924703	407510892	/nfs/dbraw/zinc/51/08/92/407510892.db2.gz	YXINDWPOEMONFY-SNVBAGLBSA-N	1	1	304.306	1.459	20	5		DDBDMO
C[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1	ZINC000179035778	407697978	/nfs/dbraw/zinc/69/79/78/407697978.db2.gz	OYLXZPNWCCXJKE-NSHDSACASA-N	1	1	309.391	1.648	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000186687444	407743766	/nfs/dbraw/zinc/74/37/66/407743766.db2.gz	BPXUSMKUXCGTKN-INIZCTEOSA-N	1	1	314.345	1.923	20	5		DDBDMO
CCC[C@@H]1C[NH2+]CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000262250386	407774753	/nfs/dbraw/zinc/77/47/53/407774753.db2.gz	IQLDWVVWZUDBJI-GFCCVEGCSA-N	1	1	313.379	1.357	20	5		DDBDMO
C[N@@H+](CC1(CO)CC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000186785031	407768323	/nfs/dbraw/zinc/76/83/23/407768323.db2.gz	XPZOUEPNCITEKX-AWEZNQCLSA-N	1	1	319.361	1.404	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])[nH]1)Cc1ccc(F)cc1	ZINC000267310731	407830637	/nfs/dbraw/zinc/83/06/37/407830637.db2.gz	ZULYRODSMPJVGF-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
Cc1nn(CCC(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000153760558	407896943	/nfs/dbraw/zinc/89/69/43/407896943.db2.gz	MERJHNTWXQVHTB-ZDUSSCGKSA-N	1	1	323.397	1.351	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCC[C@@H](C)C1	ZINC000180530402	407898766	/nfs/dbraw/zinc/89/87/66/407898766.db2.gz	TWUVZLYIPOEJHV-MNOVXSKESA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000268233463	407961588	/nfs/dbraw/zinc/96/15/88/407961588.db2.gz	SPFXCJDDDMBGAL-RISCZKNCSA-N	1	1	318.377	1.606	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000272527321	407964984	/nfs/dbraw/zinc/96/49/84/407964984.db2.gz	IAQOFUNTCFSODX-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000154063358	407966569	/nfs/dbraw/zinc/96/65/69/407966569.db2.gz	RKRPNULOVPSKQG-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000154063358	407966574	/nfs/dbraw/zinc/96/65/74/407966574.db2.gz	RKRPNULOVPSKQG-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000268276223	407981551	/nfs/dbraw/zinc/98/15/51/407981551.db2.gz	WGHODFVLYIRGOD-ABAIWWIYSA-N	1	1	303.362	1.736	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000272570166	407988719	/nfs/dbraw/zinc/98/87/19/407988719.db2.gz	FTCDKOMRRXAYDK-IUODEOHRSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000272672217	408009199	/nfs/dbraw/zinc/00/91/99/408009199.db2.gz	TYOQGPOYXPPVKK-GHMZBOCLSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000272672217	408009204	/nfs/dbraw/zinc/00/92/04/408009204.db2.gz	TYOQGPOYXPPVKK-GHMZBOCLSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000272672217	408009208	/nfs/dbraw/zinc/00/92/08/408009208.db2.gz	TYOQGPOYXPPVKK-GHMZBOCLSA-N	1	1	321.381	1.608	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1	ZINC000272937208	408016936	/nfs/dbraw/zinc/01/69/36/408016936.db2.gz	LOBTVBQDHRFCOK-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000245872947	408088037	/nfs/dbraw/zinc/08/80/37/408088037.db2.gz	HEQZTKKFBGNFQS-QWRGUYRKSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000245994030	408116806	/nfs/dbraw/zinc/11/68/06/408116806.db2.gz	AAQFGLLOMFVSML-DOMZBBRYSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000245994030	408116812	/nfs/dbraw/zinc/11/68/12/408116812.db2.gz	AAQFGLLOMFVSML-DOMZBBRYSA-N	1	1	319.361	1.811	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000246253234	408194347	/nfs/dbraw/zinc/19/43/47/408194347.db2.gz	TXNAAEADHMYQQJ-GHMZBOCLSA-N	1	1	322.365	1.236	20	5		DDBDMO
C[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000189897479	408131836	/nfs/dbraw/zinc/13/18/36/408131836.db2.gz	YCGGCAVWBMVKGD-CYBMUJFWSA-N	1	1	307.394	1.872	20	5		DDBDMO
C[C@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)N1CC[NH+](C)CC1	ZINC000182779278	408247843	/nfs/dbraw/zinc/24/78/43/408247843.db2.gz	DFGDETZCCSEJPC-GFCCVEGCSA-N	1	1	318.377	1.120	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269302064	408260070	/nfs/dbraw/zinc/26/00/70/408260070.db2.gz	USIPWXOTPRHTAA-YGRLFVJLSA-N	1	1	307.350	1.713	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269302064	408260081	/nfs/dbraw/zinc/26/00/81/408260081.db2.gz	USIPWXOTPRHTAA-YGRLFVJLSA-N	1	1	307.350	1.713	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000269489603	408329428	/nfs/dbraw/zinc/32/94/28/408329428.db2.gz	LHTFLKMDZJJGKW-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000269489603	408329431	/nfs/dbraw/zinc/32/94/31/408329431.db2.gz	LHTFLKMDZJJGKW-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000269489603	408329435	/nfs/dbraw/zinc/32/94/35/408329435.db2.gz	LHTFLKMDZJJGKW-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000246799091	408341267	/nfs/dbraw/zinc/34/12/67/408341267.db2.gz	REURMGBCFKZUCO-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000246799091	408341275	/nfs/dbraw/zinc/34/12/75/408341275.db2.gz	REURMGBCFKZUCO-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000171268644	162211324	/nfs/dbraw/zinc/21/13/24/162211324.db2.gz	ZVQQJKGEKXIQBQ-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000171439500	162218113	/nfs/dbraw/zinc/21/81/13/162218113.db2.gz	KWFHZRSCYZLZJE-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@H](C)C1	ZINC000246876042	408357794	/nfs/dbraw/zinc/35/77/94/408357794.db2.gz	WJEZXFKEUYGRMU-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@H](C)O)[C@H](C)C1	ZINC000246876042	408357799	/nfs/dbraw/zinc/35/77/99/408357799.db2.gz	WJEZXFKEUYGRMU-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
COCCC[N@@H+](CCOC)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269672027	408384099	/nfs/dbraw/zinc/38/40/99/408384099.db2.gz	OIJYPOMPDYHCHJ-HNNXBMFYSA-N	1	1	312.366	1.613	20	5		DDBDMO
CC(C)[C@@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176828337	408453384	/nfs/dbraw/zinc/45/33/84/408453384.db2.gz	JNMIMAGQVZHVGZ-ZDUSSCGKSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176828337	408453387	/nfs/dbraw/zinc/45/33/87/408453387.db2.gz	JNMIMAGQVZHVGZ-ZDUSSCGKSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000247598772	408497781	/nfs/dbraw/zinc/49/77/81/408497781.db2.gz	OVSZKHUTDFOXHO-BPLDGKMQSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000247598772	408497785	/nfs/dbraw/zinc/49/77/85/408497785.db2.gz	OVSZKHUTDFOXHO-BPLDGKMQSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]1C	ZINC000248344540	408551491	/nfs/dbraw/zinc/55/14/91/408551491.db2.gz	LSQFRHMNRDIBEM-ZJUUUORDSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)[C@H]1C	ZINC000248344540	408551492	/nfs/dbraw/zinc/55/14/92/408551492.db2.gz	LSQFRHMNRDIBEM-ZJUUUORDSA-N	1	1	321.333	1.992	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000177213547	408551515	/nfs/dbraw/zinc/55/15/15/408551515.db2.gz	CNXGJJXMYGKGBZ-ZYHUDNBSSA-N	1	1	321.381	1.231	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000248594661	408593488	/nfs/dbraw/zinc/59/34/88/408593488.db2.gz	SNKOIZSTJNTCCX-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000248594661	408593491	/nfs/dbraw/zinc/59/34/91/408593491.db2.gz	SNKOIZSTJNTCCX-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)[C@H](CNc1cc(N)ccc1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000192772081	408643939	/nfs/dbraw/zinc/64/39/39/408643939.db2.gz	VAXRZWNHCYKEPM-HNNXBMFYSA-N	1	1	308.382	1.946	20	5		DDBDMO
C[C@H](CO)[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@H](C)O	ZINC000248955380	408667952	/nfs/dbraw/zinc/66/79/52/408667952.db2.gz	QCZUFQJSBNLLME-OLZOCXBDSA-N	1	1	312.366	1.427	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000177769368	408708057	/nfs/dbraw/zinc/70/80/57/408708057.db2.gz	WFTIFYXRHNYCBL-OLZOCXBDSA-N	1	1	321.381	1.185	20	5		DDBDMO
Cc1cc([N+](=O)[O-])nn1C[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000184767552	408685941	/nfs/dbraw/zinc/68/59/41/408685941.db2.gz	XNKFPHAXEVZWNE-HNNXBMFYSA-N	1	1	316.361	1.519	20	5		DDBDMO
CC(C)C[C@@H](CO)[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000185311917	408794192	/nfs/dbraw/zinc/79/41/92/408794192.db2.gz	RSTQQFAUUHFCAQ-HNNXBMFYSA-N	1	1	323.393	1.896	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000249737610	408758735	/nfs/dbraw/zinc/75/87/35/408758735.db2.gz	GDHHXCFIRXVDHA-MNOVXSKESA-N	1	1	322.365	1.546	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H](O)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000185167409	408773673	/nfs/dbraw/zinc/77/36/73/408773673.db2.gz	IBMMZVQTLRBKMH-NSHDSACASA-N	1	1	311.313	1.519	20	5		DDBDMO
NC(=O)c1ccnc(NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000290986577	408856306	/nfs/dbraw/zinc/85/63/06/408856306.db2.gz	SKENCUVPBAIZIN-NSHDSACASA-N	1	1	319.365	1.518	20	5		DDBDMO
Cn1nccc1[C@@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000281453509	408886611	/nfs/dbraw/zinc/88/66/11/408886611.db2.gz	QRZRRBBFVYUDAE-ZDUSSCGKSA-N	1	1	304.354	1.752	20	5		DDBDMO
Cn1nccc1[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000281453509	408886613	/nfs/dbraw/zinc/88/66/13/408886613.db2.gz	QRZRRBBFVYUDAE-ZDUSSCGKSA-N	1	1	304.354	1.752	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)NCc3ccccc3[N+](=O)[O-])C2)C1	ZINC000291757936	408918822	/nfs/dbraw/zinc/91/88/22/408918822.db2.gz	UOCMNPPLXIUUFI-INIZCTEOSA-N	1	1	318.377	1.832	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CCC[N@H+](CCO)CC1	ZINC000291805457	408925563	/nfs/dbraw/zinc/92/55/63/408925563.db2.gz	FBLKZFMCKAHAFY-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC1CC[NH+](CCN(C)C)CC1	ZINC000192491496	163225350	/nfs/dbraw/zinc/22/53/50/163225350.db2.gz	OVCWCUHPZQBMDU-UHFFFAOYSA-N	1	1	324.429	1.558	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193621973	163262449	/nfs/dbraw/zinc/26/24/49/163262449.db2.gz	IOIKFPBAXHVGFH-RWMBFGLXSA-N	1	1	318.377	1.415	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000277508390	408954230	/nfs/dbraw/zinc/95/42/30/408954230.db2.gz	KRUFBJJJAMRANU-LBPRGKRZSA-N	1	1	318.377	1.924	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCCn1cc[nH+]c1C	ZINC000277625038	408979503	/nfs/dbraw/zinc/97/95/03/408979503.db2.gz	RHYAORFWUJCOLP-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
CN(C)S(=O)(=O)CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000292247457	409009425	/nfs/dbraw/zinc/00/94/25/409009425.db2.gz	XJNYCJHENXCYEF-UHFFFAOYSA-N	1	1	315.395	1.311	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1(CO)CCC1	ZINC000292247478	409009716	/nfs/dbraw/zinc/00/97/16/409009716.db2.gz	XKWDKKCJAABYRE-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])cn1	ZINC000278814248	409094612	/nfs/dbraw/zinc/09/46/12/409094612.db2.gz	SOUQIJLIJFPBQK-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
O=c1[n-]nc([C@@H]2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)o1	ZINC000283912246	409238219	/nfs/dbraw/zinc/23/82/19/409238219.db2.gz	GCMXKRCZPFAPHK-LLVKDONJSA-N	1	1	304.306	1.651	20	5		DDBDMO
O=c1[n-]nc([C@@H]2CCCN(Cc3cccc([N+](=O)[O-])c3)C2)o1	ZINC000283912246	409238220	/nfs/dbraw/zinc/23/82/20/409238220.db2.gz	GCMXKRCZPFAPHK-LLVKDONJSA-N	1	1	304.306	1.651	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@@H](c3nc(=O)[nH][nH]3)C2)cccc1[N+](=O)[O-]	ZINC000289466457	409277537	/nfs/dbraw/zinc/27/75/37/409277537.db2.gz	QPLPLBSECSBTNL-GFCCVEGCSA-N	1	1	317.349	1.694	20	5		DDBDMO
COCCC[N@H+](C)CCN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284229742	409300215	/nfs/dbraw/zinc/30/02/15/409300215.db2.gz	UMSDPPXVCFYABN-GFCCVEGCSA-N	1	1	310.398	1.796	20	5		DDBDMO
COCCC[N@@H+](C)CCN[C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284229742	409300218	/nfs/dbraw/zinc/30/02/18/409300218.db2.gz	UMSDPPXVCFYABN-GFCCVEGCSA-N	1	1	310.398	1.796	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3ncc([N+](=O)[O-])cc3Cl)[C@@H]2C1	ZINC000284571797	409351709	/nfs/dbraw/zinc/35/17/09/409351709.db2.gz	OKWSUCKTVFRBON-NEPJUHHUSA-N	1	1	312.757	1.553	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc([N+](=O)[O-])c2ncccc12	ZINC000320812487	164043108	/nfs/dbraw/zinc/04/31/08/164043108.db2.gz	LEFNVMALUGXGOS-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000320812487	164043112	/nfs/dbraw/zinc/04/31/12/164043112.db2.gz	LEFNVMALUGXGOS-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000320812487	164043114	/nfs/dbraw/zinc/04/31/14/164043114.db2.gz	LEFNVMALUGXGOS-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccc([N+](=O)[O-])c2ncccc12)C1CC1	ZINC000324467572	164050762	/nfs/dbraw/zinc/05/07/62/164050762.db2.gz	ZFTVOBTWXUSMDM-LBPRGKRZSA-N	1	1	317.345	1.977	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](n2c[nH+]c3c2CCCC3)C1	ZINC000408386111	164315157	/nfs/dbraw/zinc/31/51/57/164315157.db2.gz	NPFRGCFYIJJTNM-LLVKDONJSA-N	1	1	316.365	1.855	20	5		DDBDMO
C[C@@]1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCC[NH2+]C1	ZINC000342711789	409834005	/nfs/dbraw/zinc/83/40/05/409834005.db2.gz	AEQFFPACZKOHBT-OAHLLOKOSA-N	1	1	317.349	1.591	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000332029418	409817253	/nfs/dbraw/zinc/81/72/53/409817253.db2.gz	HUPLBMUBCXJNJY-LSDHHAIUSA-N	1	1	303.362	1.880	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1	ZINC000342874088	409966242	/nfs/dbraw/zinc/96/62/42/409966242.db2.gz	LBCQJIIGJRFUDP-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000342986097	410052358	/nfs/dbraw/zinc/05/23/58/410052358.db2.gz	AMDUWSZGLVGNDO-GZMMTYOYSA-N	1	1	303.322	1.607	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357534211	410090022	/nfs/dbraw/zinc/09/00/22/410090022.db2.gz	QSAFVXGTPYHUAP-ZJUUUORDSA-N	1	1	304.350	1.731	20	5		DDBDMO
Cc1cccc(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000339325527	410094821	/nfs/dbraw/zinc/09/48/21/410094821.db2.gz	MTLKZMVBEPOREX-MELADBBJSA-N	1	1	324.377	1.752	20	5		DDBDMO
COc1c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000332671548	410202471	/nfs/dbraw/zinc/20/24/71/410202471.db2.gz	ZQYJLPVWNKONAF-VXGBXAGGSA-N	1	1	319.361	1.912	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000357712959	410204653	/nfs/dbraw/zinc/20/46/53/410204653.db2.gz	XMKYVVJLDXRZNV-JTQLQIEISA-N	1	1	317.305	1.400	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000347196000	410382028	/nfs/dbraw/zinc/38/20/28/410382028.db2.gz	AVTHKQBOZCDTJZ-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc(C)cc([N+](=O)[O-])c1C	ZINC000351973973	410382548	/nfs/dbraw/zinc/38/25/48/410382548.db2.gz	FLGUUQALNLZDME-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343441161	410455491	/nfs/dbraw/zinc/45/54/91/410455491.db2.gz	BXNVMZSQHMQHPT-BXUZGUMPSA-N	1	1	307.350	1.573	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000343564099	410535316	/nfs/dbraw/zinc/53/53/16/410535316.db2.gz	GYRQCJLANSYZLP-NSHDSACASA-N	1	1	308.338	1.300	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000343620177	410572720	/nfs/dbraw/zinc/57/27/20/410572720.db2.gz	GGXGOGBGTXFAGK-ZDUSSCGKSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1nn(C)c(NC[C@H]2C[N@@H+](CC(C)C)CCO2)c1[N+](=O)[O-]	ZINC000301301613	410695598	/nfs/dbraw/zinc/69/55/98/410695598.db2.gz	VMOVOTXSQLLLGR-LBPRGKRZSA-N	1	1	311.386	1.405	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)[C@H](C)C1	ZINC000330553632	410771856	/nfs/dbraw/zinc/77/18/56/410771856.db2.gz	CTZBMIFKUOKCGS-GHMZBOCLSA-N	1	1	309.370	1.131	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)[C@H](C)C1	ZINC000330553633	410773062	/nfs/dbraw/zinc/77/30/62/410773062.db2.gz	CTZBMIFKUOKCGS-MNOVXSKESA-N	1	1	309.370	1.131	20	5		DDBDMO
C[C@@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1	ZINC000330560762	410778818	/nfs/dbraw/zinc/77/88/18/410778818.db2.gz	HVPLTSJTTGJUNV-QWRGUYRKSA-N	1	1	309.370	1.179	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1	ZINC000330607325	410821114	/nfs/dbraw/zinc/82/11/14/410821114.db2.gz	LMRNKWVMHAOSGO-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1	ZINC000330607325	410821120	/nfs/dbraw/zinc/82/11/20/410821120.db2.gz	LMRNKWVMHAOSGO-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344045599	410918514	/nfs/dbraw/zinc/91/85/14/410918514.db2.gz	JYIHZNKDDBGRSQ-CORIIIEPSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344045599	410918517	/nfs/dbraw/zinc/91/85/17/410918517.db2.gz	JYIHZNKDDBGRSQ-CORIIIEPSA-N	1	1	319.361	1.544	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000344054456	410924225	/nfs/dbraw/zinc/92/42/25/410924225.db2.gz	IXZSRJJQWUKLAJ-NJZAAPMLSA-N	1	1	322.361	1.685	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](CN)C1CC1	ZINC000359997287	410989137	/nfs/dbraw/zinc/98/91/37/410989137.db2.gz	ACKNSHREPVCQND-HNNXBMFYSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](CN)C1CC1	ZINC000359997287	410989143	/nfs/dbraw/zinc/98/91/43/410989143.db2.gz	ACKNSHREPVCQND-HNNXBMFYSA-N	1	1	320.393	1.901	20	5		DDBDMO
CC(C)N(C)C(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000331278106	411055375	/nfs/dbraw/zinc/05/53/75/411055375.db2.gz	DFLFHTUVEXGLMZ-LBPRGKRZSA-N	1	1	321.381	1.343	20	5		DDBDMO
CC(C)N(C)C(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000331278106	411055381	/nfs/dbraw/zinc/05/53/81/411055381.db2.gz	DFLFHTUVEXGLMZ-LBPRGKRZSA-N	1	1	321.381	1.343	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+](C)C2CC(O)C2)cccc1[N+](=O)[O-]	ZINC000353497800	411031685	/nfs/dbraw/zinc/03/16/85/411031685.db2.gz	SYHOGUYNNFSQAX-UNXYVOJBSA-N	1	1	307.350	1.685	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)C2CC(O)C2)cccc1[N+](=O)[O-]	ZINC000353497800	411031690	/nfs/dbraw/zinc/03/16/90/411031690.db2.gz	SYHOGUYNNFSQAX-UNXYVOJBSA-N	1	1	307.350	1.685	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CN3CCOCC3)C2)cc1	ZINC000129299805	196037714	/nfs/dbraw/zinc/03/77/14/196037714.db2.gz	RCDQJVGLZQWCKR-OAHLLOKOSA-N	1	1	305.378	1.749	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)C[NH+]1CCOCC1	ZINC000134145002	196365210	/nfs/dbraw/zinc/36/52/10/196365210.db2.gz	UREMLSZTOBABCJ-JTQLQIEISA-N	1	1	313.379	1.354	20	5		DDBDMO
CN(C)C[C@@H](O)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000417317128	225292697	/nfs/dbraw/zinc/29/26/97/225292697.db2.gz	VRMGPQYHQCLVCJ-HOCLYGCPSA-N	1	1	307.394	1.874	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@H]21	ZINC000374821223	418565214	/nfs/dbraw/zinc/56/52/14/418565214.db2.gz	DYRXLKABHMWOTP-LKFCYVNXSA-N	1	1	322.340	1.482	20	5		DDBDMO
O=C(N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)[C@H]1CC1[N+](=O)[O-]	ZINC000374894929	418574122	/nfs/dbraw/zinc/57/41/22/418574122.db2.gz	OEBYETRWWZLCHN-RQJABVFESA-N	1	1	307.325	1.053	20	5		DDBDMO
C[C@H]1CN(CC[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)CCO1	ZINC000367049122	418554971	/nfs/dbraw/zinc/55/49/71/418554971.db2.gz	CDRHCSVDMYKJBM-KBPBESRZSA-N	1	1	323.397	1.149	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC[NH+](C)C)CC(C)C)c1[N+](=O)[O-]	ZINC000192526664	222129541	/nfs/dbraw/zinc/12/95/41/222129541.db2.gz	DIZJABQHIRKUQF-UHFFFAOYSA-N	1	1	311.386	1.540	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@@H]3C[N@H+](C)C[C@@H]3C)n2)n1C	ZINC000361248775	418612426	/nfs/dbraw/zinc/61/24/26/418612426.db2.gz	CXVDLPKPCNYPOU-IONNQARKSA-N	1	1	306.326	1.352	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000367842530	418644666	/nfs/dbraw/zinc/64/46/66/418644666.db2.gz	XPKYUWFXFSWAMU-NDBYEHHHSA-N	1	1	319.361	1.400	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000367842530	418644669	/nfs/dbraw/zinc/64/46/69/418644669.db2.gz	XPKYUWFXFSWAMU-NDBYEHHHSA-N	1	1	319.361	1.400	20	5		DDBDMO
CC(C)(C)[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000361541723	418674181	/nfs/dbraw/zinc/67/41/81/418674181.db2.gz	SBZNMBKUDJMXJB-OCCSQVGLSA-N	1	1	310.398	1.910	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)[C@H]2CCO[C@H]2C)cc1[N+](=O)[O-]	ZINC000361563855	418678386	/nfs/dbraw/zinc/67/83/86/418678386.db2.gz	LMIMPQYUSNQCTM-AAEUAGOBSA-N	1	1	310.350	1.575	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]([C@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000371232285	418770748	/nfs/dbraw/zinc/77/07/48/418770748.db2.gz	ROBIQQXDXUMAES-STQMWFEESA-N	1	1	319.361	1.892	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)NC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000411476554	418907855	/nfs/dbraw/zinc/90/78/55/418907855.db2.gz	BXFANZRKSKCEJC-NWDGAFQWSA-N	1	1	307.350	1.541	20	5		DDBDMO
CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[N@H+]1C	ZINC000421011087	419449187	/nfs/dbraw/zinc/44/91/87/419449187.db2.gz	RSQCCCUXZSVORW-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011087	419449198	/nfs/dbraw/zinc/44/91/98/419449198.db2.gz	RSQCCCUXZSVORW-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011087	419449211	/nfs/dbraw/zinc/44/92/11/419449211.db2.gz	RSQCCCUXZSVORW-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2cncs2)CC1	ZINC000411876471	419452916	/nfs/dbraw/zinc/45/29/16/419452916.db2.gz	PSQXGGGIVMZYNN-UHFFFAOYSA-N	1	1	319.390	1.811	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](C(=O)N(C)C)C2)cc1[N+](=O)[O-]	ZINC000411947661	419513653	/nfs/dbraw/zinc/51/36/53/419513653.db2.gz	UFBRCDAFXYVBLN-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@H+]1C1CC1	ZINC000426996319	419577239	/nfs/dbraw/zinc/57/72/39/419577239.db2.gz	ZHQCRMQLSDOWCQ-HNNXBMFYSA-N	1	1	303.362	1.880	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000427058711	419589391	/nfs/dbraw/zinc/58/93/91/419589391.db2.gz	FIPLTUINBOLBGI-ZWNOBZJWSA-N	1	1	307.350	1.816	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000421707886	419693730	/nfs/dbraw/zinc/69/37/30/419693730.db2.gz	YOQZIVPRJXSWGK-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421710480	419698258	/nfs/dbraw/zinc/69/82/58/419698258.db2.gz	KVPSHHAESKRTLK-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
Nc1nc(NC[C@@H]2CCC[N@H+]2C2CCCCC2)ncc1[N+](=O)[O-]	ZINC000435596850	420266049	/nfs/dbraw/zinc/26/60/49/420266049.db2.gz	ZZBUZFMFGFBXKH-LBPRGKRZSA-N	1	1	320.397	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CC[C@@H]3CCOC3)C2)nc1	ZINC000438096537	420439829	/nfs/dbraw/zinc/43/98/29/420439829.db2.gz	OWDGXCZLZIKYRK-CHWSQXEVSA-N	1	1	306.366	1.903	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000457108889	420616226	/nfs/dbraw/zinc/61/62/26/420616226.db2.gz	GIXVHPZXYQOKEV-LLVKDONJSA-N	1	1	306.366	1.732	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000453609495	420737620	/nfs/dbraw/zinc/73/76/20/420737620.db2.gz	WOCIODUPCQEDIY-UHFFFAOYSA-N	1	1	323.349	1.466	20	5		DDBDMO
CNc1nc(C(=O)NCCC[N@@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC000454676552	420907328	/nfs/dbraw/zinc/90/73/28/420907328.db2.gz	SKOAYODYOAJTKL-UHFFFAOYSA-N	1	1	309.370	1.492	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000493586418	420888823	/nfs/dbraw/zinc/88/88/23/420888823.db2.gz	POBLPBXNZIBATG-RXNFCKPNSA-N	1	1	311.288	1.674	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455906629	421075035	/nfs/dbraw/zinc/07/50/35/421075035.db2.gz	GLAYHKVWDQNKHC-CMPLNLGQSA-N	1	1	321.381	1.490	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCC[N@H+]1CCCO	ZINC000450588461	421213162	/nfs/dbraw/zinc/21/31/62/421213162.db2.gz	BIMRBXQMUFZSPM-LBPRGKRZSA-N	1	1	311.386	1.378	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CCC[N@@H+]1CCCO	ZINC000450594319	421214324	/nfs/dbraw/zinc/21/43/24/421214324.db2.gz	KIICISMXHIRXGT-LLVKDONJSA-N	1	1	314.773	1.902	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000545397464	421257453	/nfs/dbraw/zinc/25/74/53/421257453.db2.gz	MQHVCEFARJKFOX-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=C1OCCN1C[C@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000497293698	421402627	/nfs/dbraw/zinc/40/26/27/421402627.db2.gz	AMIBHPJJIUYUTH-LBPRGKRZSA-N	1	1	305.334	1.869	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000562705931	421402694	/nfs/dbraw/zinc/40/26/94/421402694.db2.gz	CVANVLJFIBJGNR-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cscn3)CC2)cn1	ZINC000516713941	421563879	/nfs/dbraw/zinc/56/38/79/421563879.db2.gz	LUFMUYHRXRJORZ-UHFFFAOYSA-N	1	1	319.390	1.811	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000517456856	421614501	/nfs/dbraw/zinc/61/45/01/421614501.db2.gz	AROHNCIZNBEXQR-SNVBAGLBSA-N	1	1	321.333	1.395	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000553544423	421619503	/nfs/dbraw/zinc/61/95/03/421619503.db2.gz	KLZOGUXXDBCXPP-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+](C2CCC2)C1	ZINC000553864866	421626397	/nfs/dbraw/zinc/62/63/97/421626397.db2.gz	BBYFHVYMWSUJKU-GFCCVEGCSA-N	1	1	320.393	1.880	20	5		DDBDMO
Cc1nnsc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000521631136	421795769	/nfs/dbraw/zinc/79/57/69/421795769.db2.gz	GJQQYQXOVYCCHO-UHFFFAOYSA-N	1	1	308.367	1.788	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+](C2CC2)C1	ZINC000580934112	421863804	/nfs/dbraw/zinc/86/38/04/421863804.db2.gz	UOFSFYWWLYVEHX-LLVKDONJSA-N	1	1	304.350	1.546	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)CN1	ZINC000581585767	422005272	/nfs/dbraw/zinc/00/52/72/422005272.db2.gz	QAJVBMHMHZODCY-HNNXBMFYSA-N	1	1	315.333	1.183	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)CN1	ZINC000581585767	422005277	/nfs/dbraw/zinc/00/52/77/422005277.db2.gz	QAJVBMHMHZODCY-HNNXBMFYSA-N	1	1	315.333	1.183	20	5		DDBDMO
CCn1ccc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000577842380	422436944	/nfs/dbraw/zinc/43/69/44/422436944.db2.gz	UAGWMWADFSOKLH-AWEZNQCLSA-N	1	1	320.349	1.341	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2cccnc2)C1	ZINC000578765184	422643622	/nfs/dbraw/zinc/64/36/22/422643622.db2.gz	LFHJZLNFMFEOMD-CQSZACIVSA-N	1	1	314.345	1.641	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000578827154	422652374	/nfs/dbraw/zinc/65/23/74/422652374.db2.gz	LAZGMEWDWZYTJA-TXEJJXNPSA-N	1	1	304.350	1.270	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000344414494	272019280	/nfs/dbraw/zinc/01/92/80/272019280.db2.gz	AVDLWQIOGHIUDB-MFKMUULPSA-N	1	1	320.349	1.132	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000346050866	272398967	/nfs/dbraw/zinc/39/89/67/272398967.db2.gz	RIDGHJDJRIVRCO-VXGBXAGGSA-N	1	1	323.397	1.431	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCn3cc[nH+]c3C2)n1	ZINC000347103802	272616084	/nfs/dbraw/zinc/61/60/84/272616084.db2.gz	ANLLGQKMAGKKBF-QMMMGPOBSA-N	1	1	315.293	1.305	20	5		DDBDMO
COCC[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H]1C	ZINC000275376323	274030124	/nfs/dbraw/zinc/03/01/24/274030124.db2.gz	OGKISFCVPGQIDW-GFCCVEGCSA-N	1	1	320.393	1.720	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000294023925	276041017	/nfs/dbraw/zinc/04/10/17/276041017.db2.gz	ZHOYELSPTFWFJZ-OAHLLOKOSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000294023925	276041018	/nfs/dbraw/zinc/04/10/18/276041018.db2.gz	ZHOYELSPTFWFJZ-OAHLLOKOSA-N	1	1	321.381	1.609	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000294023925	276041019	/nfs/dbraw/zinc/04/10/19/276041019.db2.gz	ZHOYELSPTFWFJZ-OAHLLOKOSA-N	1	1	321.381	1.609	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)C[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000264680833	276054443	/nfs/dbraw/zinc/05/44/43/276054443.db2.gz	PFOULJVORCDCCB-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000264680833	276054444	/nfs/dbraw/zinc/05/44/44/276054444.db2.gz	PFOULJVORCDCCB-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000264680833	276054445	/nfs/dbraw/zinc/05/44/45/276054445.db2.gz	PFOULJVORCDCCB-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000133614935	277070137	/nfs/dbraw/zinc/07/01/37/277070137.db2.gz	SOPMXKQHYALAQB-OLZOCXBDSA-N	1	1	318.377	1.614	20	5		DDBDMO
CN1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)Cc2ccccc21	ZINC000265991438	277106871	/nfs/dbraw/zinc/10/68/71/277106871.db2.gz	IQWIQJVUZWAIND-UHFFFAOYSA-N	1	1	301.350	1.743	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000302709284	277182143	/nfs/dbraw/zinc/18/21/43/277182143.db2.gz	DDRCDJFGXZZMDV-RYUDHWBXSA-N	1	1	316.365	1.558	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C(N)=O)c1ccccn1	ZINC000449364560	279382237	/nfs/dbraw/zinc/38/22/37/279382237.db2.gz	SHYAZWFTNGFCJI-ABAIWWIYSA-N	1	1	314.345	1.737	20	5		DDBDMO
COc1cc(OCC(=O)NC[C@H]2CC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000110654041	281058356	/nfs/dbraw/zinc/05/83/56/281058356.db2.gz	HNOAWEWQONQIDY-LLVKDONJSA-N	1	1	323.349	1.050	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCOC1	ZINC000247019105	282029142	/nfs/dbraw/zinc/02/91/42/282029142.db2.gz	LSBBIXZBEFWHTH-TZMCWYRMSA-N	1	1	310.350	1.303	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000358063745	299062430	/nfs/dbraw/zinc/06/24/30/299062430.db2.gz	ZXMZVNHOGRTVFK-INIZCTEOSA-N	1	1	321.377	1.316	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)Nc1cccc([N+](=O)[O-])c1	ZINC000363094696	300209701	/nfs/dbraw/zinc/20/97/01/300209701.db2.gz	HJUNASPVYGGADS-ZIAGYGMSSA-N	1	1	320.349	1.580	20	5		DDBDMO
O=C1NCCCC[C@H]1[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012310	301119504	/nfs/dbraw/zinc/11/95/04/301119504.db2.gz	UWTKDQWGXVZDII-WCQYABFASA-N	1	1	307.354	1.097	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019286	301120218	/nfs/dbraw/zinc/12/02/18/301120218.db2.gz	XLGWVRMUWQDWJT-KBPBESRZSA-N	1	1	323.397	1.149	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@]3(CCCCO3)C2)c1	ZINC000370095055	301274710	/nfs/dbraw/zinc/27/47/10/301274710.db2.gz	RDARFGGVVWUZON-HUUCEWRRSA-N	1	1	324.381	1.187	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000372933793	301633168	/nfs/dbraw/zinc/63/31/68/301633168.db2.gz	QQRQIOYPVFIMLG-CABCVRRESA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)n1	ZINC000378306322	302309783	/nfs/dbraw/zinc/30/97/83/302309783.db2.gz	AFAWYIAPAJOWDX-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)n1	ZINC000378306322	302309785	/nfs/dbraw/zinc/30/97/85/302309785.db2.gz	AFAWYIAPAJOWDX-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)Nc2ncccc2[N+](=O)[O-])CC1	ZINC000450923246	302398604	/nfs/dbraw/zinc/39/86/04/302398604.db2.gz	QFZLSKPBRMZCPP-UHFFFAOYSA-N	1	1	307.398	1.818	20	5		DDBDMO
CC1CCC([NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000363673372	307032997	/nfs/dbraw/zinc/03/29/97/307032997.db2.gz	CBDKHKHILKBMRE-UZVIJOLCSA-N	1	1	309.410	1.811	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H]2OCC[C@H]21	ZINC000366471691	307074536	/nfs/dbraw/zinc/07/45/36/307074536.db2.gz	ICWKESIPZMEXMG-GZBFAFLISA-N	1	1	322.361	1.588	20	5		DDBDMO
CCN(C)C(=O)CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369001202	307113996	/nfs/dbraw/zinc/11/39/96/307113996.db2.gz	KZNTXMAKBHAXMF-GFCCVEGCSA-N	1	1	309.370	1.297	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000371808708	307158191	/nfs/dbraw/zinc/15/81/91/307158191.db2.gz	KEESLKMIGGUNTL-AWEZNQCLSA-N	1	1	307.350	1.262	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000371808708	307158192	/nfs/dbraw/zinc/15/81/92/307158192.db2.gz	KEESLKMIGGUNTL-AWEZNQCLSA-N	1	1	307.350	1.262	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@](O)(C3CC3)C2)c1	ZINC000373907802	307197995	/nfs/dbraw/zinc/19/79/95/307197995.db2.gz	GQMQEIDHNYGMMN-HOCLYGCPSA-N	1	1	322.361	1.181	20	5		DDBDMO
COC(=O)[C@@]12CCC[C@@H]1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000374695376	307211808	/nfs/dbraw/zinc/21/18/08/307211808.db2.gz	FNIMJXROSTXSGG-BXUZGUMPSA-N	1	1	308.338	1.066	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000377563981	307273030	/nfs/dbraw/zinc/27/30/30/307273030.db2.gz	MPBPAHGGKBMDTR-LLVKDONJSA-N	1	1	314.292	1.072	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000299264490	533830104	/nfs/dbraw/zinc/83/01/04/533830104.db2.gz	VKEZKUZPFPNOCX-STQMWFEESA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1c(CN2C[C@@H](C)[N@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000419331778	533847543	/nfs/dbraw/zinc/84/75/43/533847543.db2.gz	RUTJOXPZBVJYDN-CHWSQXEVSA-N	1	1	307.394	1.790	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)c1ccc([N+](=O)[O-])s1	ZINC000452348347	534641616	/nfs/dbraw/zinc/64/16/16/534641616.db2.gz	LFBVLNQSJCCMRX-SNVBAGLBSA-N	1	1	313.379	1.233	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)c1ccc([N+](=O)[O-])cc1	ZINC000452347589	534642284	/nfs/dbraw/zinc/64/22/84/534642284.db2.gz	IYHRNZVZMMJIJJ-CQSZACIVSA-N	1	1	307.350	1.171	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H](n2cc(CO)nn2)C1	ZINC000292981384	534887221	/nfs/dbraw/zinc/88/72/21/534887221.db2.gz	NCNYCICJNOKYNC-AWEZNQCLSA-N	1	1	317.349	1.516	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H](n2cc(CO)nn2)C1	ZINC000292981384	534887222	/nfs/dbraw/zinc/88/72/22/534887222.db2.gz	NCNYCICJNOKYNC-AWEZNQCLSA-N	1	1	317.349	1.516	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000820715696	599084463	/nfs/dbraw/zinc/08/44/63/599084463.db2.gz	CQTJEVHWEUTQGW-SECBINFHSA-N	1	1	318.341	1.066	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736846694	598797602	/nfs/dbraw/zinc/79/76/02/598797602.db2.gz	ALQRNZIWPALNDW-JTQLQIEISA-N	1	1	317.353	1.163	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000824994178	608554783	/nfs/dbraw/zinc/55/47/83/608554783.db2.gz	UBYRWGVADQRACN-NXEZZACHSA-N	1	1	317.353	1.304	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000126524767	696763020	/nfs/dbraw/zinc/76/30/20/696763020.db2.gz	NWYLBVIJHTWCRR-UHFFFAOYSA-N	1	1	319.358	1.352	20	5		DDBDMO
COC(=O)/C(C)=C/C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816050	700136643	/nfs/dbraw/zinc/13/66/43/700136643.db2.gz	CKOORCXASLVZPM-JXDHDYMSSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C(C)=C/C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816050	700136644	/nfs/dbraw/zinc/13/66/44/700136644.db2.gz	CKOORCXASLVZPM-JXDHDYMSSA-N	1	1	320.349	1.595	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776582445	698121626	/nfs/dbraw/zinc/12/16/26/698121626.db2.gz	QOYVJOBTSZLIDS-OCCSQVGLSA-N	1	1	307.350	1.086	20	5		DDBDMO
CN1CCC[N@H+](CCCNCc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000778084067	698240646	/nfs/dbraw/zinc/24/06/46/698240646.db2.gz	CHAUTKPNYLUNAN-UHFFFAOYSA-N	1	1	324.400	1.851	20	5		DDBDMO
CN1CCC[N@@H+](CCCNCc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000778084067	698240647	/nfs/dbraw/zinc/24/06/47/698240647.db2.gz	CHAUTKPNYLUNAN-UHFFFAOYSA-N	1	1	324.400	1.851	20	5		DDBDMO
CO[C@@H]1CC(=O)N(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000800865473	700251341	/nfs/dbraw/zinc/25/13/41/700251341.db2.gz	DFJHMKXZIDMVIT-CQSZACIVSA-N	1	1	307.350	1.274	20	5		DDBDMO
CO[C@@H]1CC(=O)N(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000800865473	700251346	/nfs/dbraw/zinc/25/13/46/700251346.db2.gz	DFJHMKXZIDMVIT-CQSZACIVSA-N	1	1	307.350	1.274	20	5		DDBDMO
CNc1c(C(=O)NCC[N@H+]2CCC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000783913972	698891908	/nfs/dbraw/zinc/89/19/08/698891908.db2.gz	FHEWKSDZIQPGPM-LLVKDONJSA-N	1	1	306.366	1.851	20	5		DDBDMO
CC1(C)C[N@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])CCO1	ZINC000725789416	699333831	/nfs/dbraw/zinc/33/38/31/699333831.db2.gz	BZDVAVKYWBNRPR-UHFFFAOYSA-N	1	1	319.365	1.765	20	5		DDBDMO
CC1(C)C[N@@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])CCO1	ZINC000725789416	699333835	/nfs/dbraw/zinc/33/38/35/699333835.db2.gz	BZDVAVKYWBNRPR-UHFFFAOYSA-N	1	1	319.365	1.765	20	5		DDBDMO
CN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000732165310	699548656	/nfs/dbraw/zinc/54/86/56/699548656.db2.gz	DZCMTFNIOPBJBW-GFCCVEGCSA-N	1	1	304.350	1.486	20	5		DDBDMO
CC(C)[C@H](C[NH+](C)C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000733164656	699581529	/nfs/dbraw/zinc/58/15/29/699581529.db2.gz	ARROZFWVYUMPJX-ZDUSSCGKSA-N	1	1	319.365	1.787	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000739876151	699781994	/nfs/dbraw/zinc/78/19/94/699781994.db2.gz	XUKNFWZVRMORQS-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c1	ZINC000742058398	699858907	/nfs/dbraw/zinc/85/89/07/699858907.db2.gz	BDMDYHXZBOONGU-STQMWFEESA-N	1	1	319.361	1.496	20	5		DDBDMO
C[C@H]1COCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000753991666	700474593	/nfs/dbraw/zinc/47/45/93/700474593.db2.gz	CDVJTCQJXGWVHL-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@H]1COCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000753991666	700474596	/nfs/dbraw/zinc/47/45/96/700474596.db2.gz	CDVJTCQJXGWVHL-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@@H+](C)[C@@H](C)C1	ZINC000761077602	700840595	/nfs/dbraw/zinc/84/05/95/700840595.db2.gz	NDZVILHYIJNDOK-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CC2CCOCC2)c2ncc([N+](=O)[O-])cc12	ZINC000767982653	701150336	/nfs/dbraw/zinc/15/03/36/701150336.db2.gz	LFOVFJWYRYOMHP-UHFFFAOYSA-N	1	1	319.365	1.964	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000804613455	701203715	/nfs/dbraw/zinc/20/37/15/701203715.db2.gz	SFANILZDNQUGSK-SNVBAGLBSA-N	1	1	308.294	1.024	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000804613455	701203718	/nfs/dbraw/zinc/20/37/18/701203718.db2.gz	SFANILZDNQUGSK-SNVBAGLBSA-N	1	1	308.294	1.024	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)c1csc([N+](=O)[O-])c1)C1CC1	ZINC000768813619	701205453	/nfs/dbraw/zinc/20/54/53/701205453.db2.gz	STKQIVHOVPXFOR-UHFFFAOYSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[NH+](C)CCCOc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC000839649941	701766007	/nfs/dbraw/zinc/76/60/07/701766007.db2.gz	MMRRYOVWUCFTIE-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)[nH]1	ZINC000839658327	701768768	/nfs/dbraw/zinc/76/87/68/701768768.db2.gz	FAMHGQDRLDNQOP-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658327	701768776	/nfs/dbraw/zinc/76/87/76/701768776.db2.gz	FAMHGQDRLDNQOP-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000839658327	701768779	/nfs/dbraw/zinc/76/87/79/701768779.db2.gz	FAMHGQDRLDNQOP-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658327	701768785	/nfs/dbraw/zinc/76/87/85/701768785.db2.gz	FAMHGQDRLDNQOP-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000839658327	701768791	/nfs/dbraw/zinc/76/87/91/701768791.db2.gz	FAMHGQDRLDNQOP-JSGCOSHPSA-N	1	1	317.349	1.544	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839700086	701789739	/nfs/dbraw/zinc/78/97/39/701789739.db2.gz	JIUGHIHINDJBTI-ARLBYUKCSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000839700086	701789742	/nfs/dbraw/zinc/78/97/42/701789742.db2.gz	JIUGHIHINDJBTI-ARLBYUKCSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839700086	701789744	/nfs/dbraw/zinc/78/97/44/701789744.db2.gz	JIUGHIHINDJBTI-ARLBYUKCSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000839785162	701826273	/nfs/dbraw/zinc/82/62/73/701826273.db2.gz	BHGNFMJJSDRKBC-FVQBIDKESA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000839785162	701826280	/nfs/dbraw/zinc/82/62/80/701826280.db2.gz	BHGNFMJJSDRKBC-FVQBIDKESA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000839785162	701826287	/nfs/dbraw/zinc/82/62/87/701826287.db2.gz	BHGNFMJJSDRKBC-FVQBIDKESA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000867945022	701846915	/nfs/dbraw/zinc/84/69/15/701846915.db2.gz	OHMZJSURKUKOKP-HFAKWTLXSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000868062295	701920554	/nfs/dbraw/zinc/92/05/54/701920554.db2.gz	KJWFUVRYWCCNCI-KGLIPLIRSA-N	1	1	318.377	1.830	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2C[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000816648797	702135438	/nfs/dbraw/zinc/13/54/38/702135438.db2.gz	PKBBDSZNQRQBQE-QWRGUYRKSA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000816648797	702135440	/nfs/dbraw/zinc/13/54/40/702135440.db2.gz	PKBBDSZNQRQBQE-QWRGUYRKSA-N	1	1	308.334	1.987	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000816954720	702238718	/nfs/dbraw/zinc/23/87/18/702238718.db2.gz	JJNZEHZHEDHZFL-NOZJJQNGSA-N	1	1	320.305	1.279	20	5		DDBDMO
CCC(=O)c1ccc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c([N+](=O)[O-])c1	ZINC000848766282	703586056	/nfs/dbraw/zinc/58/60/56/703586056.db2.gz	OORFMVQDFIYWDH-QWHCGFSZSA-N	1	1	319.361	1.443	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000852498155	704063249	/nfs/dbraw/zinc/06/32/49/704063249.db2.gz	ZSNVSCGAGKAOQS-GWCFXTLKSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000852498155	704063250	/nfs/dbraw/zinc/06/32/50/704063250.db2.gz	ZSNVSCGAGKAOQS-GWCFXTLKSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000852710028	704103865	/nfs/dbraw/zinc/10/38/65/704103865.db2.gz	HZLQNZGOBIKNOA-HNNXBMFYSA-N	1	1	323.368	1.765	20	5		DDBDMO
CN(CC1CCOCC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870911534	704165625	/nfs/dbraw/zinc/16/56/25/704165625.db2.gz	JSXOFHZLBXLCHS-INIZCTEOSA-N	1	1	321.377	1.654	20	5		DDBDMO
CO[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC[C@@H]1C	ZINC000870927747	704171868	/nfs/dbraw/zinc/17/18/68/704171868.db2.gz	FHAFOIOVYGIODF-SGIREYDYSA-N	1	1	321.377	1.652	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cn1ncc3cc([N+](=O)[O-])ccc31)C2	ZINC000853565544	704271803	/nfs/dbraw/zinc/27/18/03/704271803.db2.gz	HBZNGGOPEKKTDR-SWLSCSKDSA-N	1	1	302.334	1.870	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3C)C[C@@H]2C1	ZINC000821322269	704390507	/nfs/dbraw/zinc/39/05/07/704390507.db2.gz	FWPNHRAPXVQTKX-GASCZTMLSA-N	1	1	303.362	1.813	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1N)C2	ZINC000854735267	704445838	/nfs/dbraw/zinc/44/58/38/704445838.db2.gz	MJGUTCKTAPAYMQ-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000855165883	704471748	/nfs/dbraw/zinc/47/17/48/704471748.db2.gz	ZRWHDRQNQODKHJ-VIFPVBQESA-N	1	1	307.354	1.175	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCC[NH+]1CCOCC1	ZINC000873734280	704839314	/nfs/dbraw/zinc/83/93/14/704839314.db2.gz	VMQDYLJXWQHIOM-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874830013	705188229	/nfs/dbraw/zinc/18/82/29/705188229.db2.gz	PRIKSHOALVPETQ-VXGBXAGGSA-N	1	1	319.365	1.340	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2[C@@H]1CCC[N@@H+]2C	ZINC000874842456	705197567	/nfs/dbraw/zinc/19/75/67/705197567.db2.gz	HSLDRILZNQFZLX-OLZOCXBDSA-N	1	1	321.381	1.185	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000861339489	705433262	/nfs/dbraw/zinc/43/32/62/705433262.db2.gz	CDWSWBMNCLSUOB-IAQYHMDHSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826646700	705833331	/nfs/dbraw/zinc/83/33/31/705833331.db2.gz	DRMGDQRVUIVVHS-DOMZBBRYSA-N	1	1	321.377	1.428	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]2C1=O	ZINC000877720334	706188741	/nfs/dbraw/zinc/18/87/41/706188741.db2.gz	NUHVMVWQEFSDLF-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C[C@H]2C1=O	ZINC000877720334	706188743	/nfs/dbraw/zinc/18/87/43/706188743.db2.gz	NUHVMVWQEFSDLF-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1c(F)cccc1[N+](=O)[O-]	ZINC000865057856	706338422	/nfs/dbraw/zinc/33/84/22/706338422.db2.gz	FXDTVXVYTQFIDS-GHMZBOCLSA-N	1	1	323.324	1.327	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH+]2[C@H](CO)CC[C@H]2CO)ccc1Cl	ZINC000878882993	706524656	/nfs/dbraw/zinc/52/46/56/706524656.db2.gz	MUPJLGDYIPFHMM-QWRGUYRKSA-N	1	1	300.742	1.566	20	5		DDBDMO
NC(=O)[C@@H](F)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000879045932	706571892	/nfs/dbraw/zinc/57/18/92/706571892.db2.gz	OIEMWSARSHRYKU-ZDUSSCGKSA-N	1	1	313.304	1.769	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@H](C(F)(F)F)CC1	ZINC000880050598	706864430	/nfs/dbraw/zinc/86/44/30/706864430.db2.gz	CXUSBUDTCGFVJQ-JTQLQIEISA-N	1	1	322.287	1.753	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@H](C(F)(F)F)CC1	ZINC000880050598	706864434	/nfs/dbraw/zinc/86/44/34/706864434.db2.gz	CXUSBUDTCGFVJQ-JTQLQIEISA-N	1	1	322.287	1.753	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137799	706887932	/nfs/dbraw/zinc/88/79/32/706887932.db2.gz	KVMDWBWLQJUECK-BZUAXINKSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137799	706887933	/nfs/dbraw/zinc/88/79/33/706887933.db2.gz	KVMDWBWLQJUECK-BZUAXINKSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@H+]2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137799	706887937	/nfs/dbraw/zinc/88/79/37/706887937.db2.gz	KVMDWBWLQJUECK-BZUAXINKSA-N	1	1	305.378	1.797	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCN1	ZINC000880171207	706900465	/nfs/dbraw/zinc/90/04/65/706900465.db2.gz	VSOINYJQFSYQLQ-UHFFFAOYSA-N	1	1	319.361	1.718	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC2	ZINC000880184550	706904419	/nfs/dbraw/zinc/90/44/19/706904419.db2.gz	KMQWLHRLLUNDSF-DOMZBBRYSA-N	1	1	322.365	1.517	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000880184768	706904809	/nfs/dbraw/zinc/90/48/09/706904809.db2.gz	SBMXLVJTHDQGDE-RISCZKNCSA-N	1	1	308.338	1.246	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430914	706973059	/nfs/dbraw/zinc/97/30/59/706973059.db2.gz	XJLQPXNPKBBGEA-ZIAGYGMSSA-N	1	1	323.349	1.269	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430914	706973063	/nfs/dbraw/zinc/97/30/63/706973063.db2.gz	XJLQPXNPKBBGEA-ZIAGYGMSSA-N	1	1	323.349	1.269	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832866012	706996349	/nfs/dbraw/zinc/99/63/49/706996349.db2.gz	PCUXPUDCXYGGFE-DOMZBBRYSA-N	1	1	323.393	1.865	20	5		DDBDMO
CN1CCCC[C@H]([N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265667	707355818	/nfs/dbraw/zinc/35/58/18/707355818.db2.gz	VALIDUBPBXBUIY-GJZGRUSLSA-N	1	1	321.377	1.571	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265667	707355825	/nfs/dbraw/zinc/35/58/25/707355825.db2.gz	VALIDUBPBXBUIY-GJZGRUSLSA-N	1	1	321.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CNC2CC[NH+](C3CC3)CC2)cc1	ZINC000838986837	708010595	/nfs/dbraw/zinc/01/05/95/708010595.db2.gz	OKDBGXNQESYXNZ-MRXNPFEDSA-N	1	1	305.378	1.845	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000883898312	708079249	/nfs/dbraw/zinc/07/92/49/708079249.db2.gz	XDVUSYLYTFAYMS-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3c([N+](=O)[O-])cccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896912897	708181064	/nfs/dbraw/zinc/18/10/64/708181064.db2.gz	IHAYVYRCTUMVNG-YGRLFVJLSA-N	1	1	306.322	1.891	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3nc4sccn4c3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896914695	708181546	/nfs/dbraw/zinc/18/15/46/708181546.db2.gz	PCFPFGOGFUXMDI-RNCFNFMXSA-N	1	1	307.379	1.692	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)n1	ZINC000897221942	708259410	/nfs/dbraw/zinc/25/94/10/708259410.db2.gz	QOMCJTZXKNQCEC-STQMWFEESA-N	1	1	306.366	1.334	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2CC[C@H](O)C2)c2ccccc21	ZINC000884568614	708330978	/nfs/dbraw/zinc/33/09/78/708330978.db2.gz	PSBJDDQYGULHIL-NSHDSACASA-N	1	1	302.334	1.622	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000886573897	708779271	/nfs/dbraw/zinc/77/92/71/708779271.db2.gz	BOZAOEYZSONRPI-TYNCELHUSA-N	1	1	319.361	1.626	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000886596088	708787533	/nfs/dbraw/zinc/78/75/33/708787533.db2.gz	WOFLDKXUKHRIIM-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000886596088	708787536	/nfs/dbraw/zinc/78/75/36/708787536.db2.gz	WOFLDKXUKHRIIM-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1	ZINC000887939251	709173385	/nfs/dbraw/zinc/17/33/85/709173385.db2.gz	WZOMCXPTYJHTOC-WBMJQRKESA-N	1	1	319.361	1.384	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000900240660	709500533	/nfs/dbraw/zinc/50/05/33/709500533.db2.gz	MGBILCLEXXSNKS-OAHLLOKOSA-N	1	1	307.350	1.058	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090930	713126465	/nfs/dbraw/zinc/12/64/65/713126465.db2.gz	BJPIUVKPLGRILA-MWLCHTKSSA-N	1	1	310.379	1.233	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090930	713126466	/nfs/dbraw/zinc/12/64/66/713126466.db2.gz	BJPIUVKPLGRILA-MWLCHTKSSA-N	1	1	310.379	1.233	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000900857849	709793859	/nfs/dbraw/zinc/79/38/59/709793859.db2.gz	LUHKMQNRORLVFF-INIZCTEOSA-N	1	1	321.377	1.100	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000901233410	709978408	/nfs/dbraw/zinc/97/84/08/709978408.db2.gz	LENXNTUYDMSWDY-MRXNPFEDSA-N	1	1	321.377	1.100	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])c(N2CC[NH+](C)CC2)cc1C	ZINC000891389016	710182136	/nfs/dbraw/zinc/18/21/36/710182136.db2.gz	AGKFLJNKBWRYRF-UHFFFAOYSA-N	1	1	307.350	1.832	20	5		DDBDMO
Cn1c2ccccc2c(NCC[NH+]2CCC2)c([N+](=O)[O-])c1=O	ZINC000892952763	710531523	/nfs/dbraw/zinc/53/15/23/710531523.db2.gz	JPPGLKLWZAZMRK-UHFFFAOYSA-N	1	1	302.334	1.564	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000913281852	713190628	/nfs/dbraw/zinc/19/06/28/713190628.db2.gz	CTYONBHRGVJKLS-CALCHBBNSA-N	1	1	317.389	1.938	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000893875807	710870025	/nfs/dbraw/zinc/87/00/25/710870025.db2.gz	GACKTYCAQNEGBL-CYBMUJFWSA-N	1	1	320.393	1.778	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H](CO)[C@@H]2C)c1[N+](=O)[O-]	ZINC000894940590	711330062	/nfs/dbraw/zinc/33/00/62/711330062.db2.gz	UHQNOCLNVBUOGF-CMPLNLGQSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000913538661	713249413	/nfs/dbraw/zinc/24/94/13/713249413.db2.gz	IHWDEAFZSVDZNJ-TXEJJXNPSA-N	1	1	305.334	1.279	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000913538661	713249415	/nfs/dbraw/zinc/24/94/15/713249415.db2.gz	IHWDEAFZSVDZNJ-TXEJJXNPSA-N	1	1	305.334	1.279	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000895245594	711463624	/nfs/dbraw/zinc/46/36/24/711463624.db2.gz	GOMIIKIAYJDLQL-CMPLNLGQSA-N	1	1	310.402	1.166	20	5		DDBDMO
C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895247510	711464671	/nfs/dbraw/zinc/46/46/71/711464671.db2.gz	VFFJIHKBBUNXPW-BXKDBHETSA-N	1	1	313.789	1.689	20	5		DDBDMO
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1C[N@@H+](C)CCN1C	ZINC000895248476	711464967	/nfs/dbraw/zinc/46/49/67/711464967.db2.gz	LYUYYPNWFLNRFB-BXKDBHETSA-N	1	1	313.789	1.689	20	5		DDBDMO
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NC12CC[NH+](CC1)C2	ZINC000913635156	713273618	/nfs/dbraw/zinc/27/36/18/713273618.db2.gz	SNMSXDYPBFKENT-UHFFFAOYSA-N	1	1	317.345	1.522	20	5		DDBDMO
C[C@H](c1ccc(F)cc1)N1CCC[C@@H]([NH2+]CC[N+](=O)[O-])C1=O	ZINC000905274222	711988839	/nfs/dbraw/zinc/98/88/39/711988839.db2.gz	NXQNLRKYQFBAJN-BXUZGUMPSA-N	1	1	309.341	1.744	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCO[C@@H](C)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000905738949	712135607	/nfs/dbraw/zinc/13/56/07/712135607.db2.gz	MSLOHPJHOTWAPG-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@H+]2CCO[C@@H](C)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000905738949	712135608	/nfs/dbraw/zinc/13/56/08/712135608.db2.gz	MSLOHPJHOTWAPG-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)c1C	ZINC000908347227	712748089	/nfs/dbraw/zinc/74/80/89/712748089.db2.gz	KRPHHXCWHVBQRK-OCCSQVGLSA-N	1	1	303.362	1.988	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929228689	713571561	/nfs/dbraw/zinc/57/15/61/713571561.db2.gz	RBOJWTAZQKGVQU-CABCVRRESA-N	1	1	303.362	1.862	20	5		DDBDMO
Cc1nn(C)c(C(=O)OCC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000920659657	713685851	/nfs/dbraw/zinc/68/58/51/713685851.db2.gz	CQTFBBCTAGIVPU-LLVKDONJSA-N	1	1	310.354	1.668	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1	ZINC000930544328	713862832	/nfs/dbraw/zinc/86/28/32/713862832.db2.gz	FZPHLQURULSURK-VXGBXAGGSA-N	1	1	323.397	1.336	20	5		DDBDMO
COc1ccc(NC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000930770388	713915931	/nfs/dbraw/zinc/91/59/31/713915931.db2.gz	WOJZUFSSDSCPJA-MWLCHTKSSA-N	1	1	308.338	1.818	20	5		DDBDMO
COC1(OC)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000931641301	714147546	/nfs/dbraw/zinc/14/75/46/714147546.db2.gz	XQAVKUUQJPCFJT-CQSZACIVSA-N	1	1	310.350	1.193	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931724846	714169432	/nfs/dbraw/zinc/16/94/32/714169432.db2.gz	INLYLGKBINSJLK-QWHCGFSZSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000932069679	714251749	/nfs/dbraw/zinc/25/17/49/714251749.db2.gz	FLGPCAXAEUGFFU-QEJZJMRPSA-N	1	1	303.362	1.909	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000933557983	714615721	/nfs/dbraw/zinc/61/57/21/714615721.db2.gz	HSVQRFYSTRMOQT-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000933557983	714615722	/nfs/dbraw/zinc/61/57/22/714615722.db2.gz	HSVQRFYSTRMOQT-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(N)=O)C2)cc1[N+](=O)[O-]	ZINC000933750732	714663463	/nfs/dbraw/zinc/66/34/63/714663463.db2.gz	ZOWCWJVODRSNLO-BBRMVZONSA-N	1	1	303.362	1.991	20	5		DDBDMO
Cc1nc(N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923256	721848973	/nfs/dbraw/zinc/84/89/73/721848973.db2.gz	UPJXCWCOVAEYTF-GJZGRUSLSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1nc(N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923256	721848976	/nfs/dbraw/zinc/84/89/76/721848976.db2.gz	UPJXCWCOVAEYTF-GJZGRUSLSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(OC(C)C)cc1-n1cnc(C[NH3+])cc1=N	ZINC001167362534	733295871	/nfs/dbraw/zinc/29/58/71/733295871.db2.gz	ZTHPNEUIVNUAQP-UHFFFAOYSA-N	1	1	317.349	1.814	20	5		DDBDMO
Cc1cccnc1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001002782746	743424040	/nfs/dbraw/zinc/42/40/40/743424040.db2.gz	PAAPIOBVVKOBNI-UKRRQHHQSA-N	1	1	318.377	1.136	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)n1	ZINC001187765915	744607667	/nfs/dbraw/zinc/60/76/67/744607667.db2.gz	XFFHUQSBMHDZPD-BMIGLBTASA-N	1	1	320.349	1.164	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001095574948	750048833	/nfs/dbraw/zinc/04/88/33/750048833.db2.gz	RXXCNOHGZXVHCA-UHFFFAOYSA-N	1	1	323.397	1.273	20	5		DDBDMO
COC(=O)CC[N@@H+](CCCN(C)C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169030384	762186778	/nfs/dbraw/zinc/18/67/78/762186778.db2.gz	ZDLKVPIZLJANCO-KGLIPLIRSA-N	1	1	315.414	1.249	20	5		DDBDMO
COC(=O)CC[N@H+](CCCN(C)C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169030384	762186773	/nfs/dbraw/zinc/18/67/73/762186773.db2.gz	ZDLKVPIZLJANCO-KGLIPLIRSA-N	1	1	315.414	1.249	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CCCN(c3ncccn3)CC2)C1	ZINC001169036291	762191892	/nfs/dbraw/zinc/19/18/92/762191892.db2.gz	NGALCJUFXDFBQD-UONOGXRCSA-N	1	1	305.382	1.434	20	5		DDBDMO
O=C(c1cccs1)N1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169039585	762193389	/nfs/dbraw/zinc/19/33/89/762193389.db2.gz	RCRAUJOLVYRIKH-QWHCGFSZSA-N	1	1	323.418	1.951	20	5		DDBDMO
CCn1nnc2c1CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]2COC	ZINC001169022285	762201220	/nfs/dbraw/zinc/20/12/20/762201220.db2.gz	RQTAVOGLFBBUGT-SCRDCRAPSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1CC[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)[C@H]2COC	ZINC001169022285	762201226	/nfs/dbraw/zinc/20/12/26/762201226.db2.gz	RQTAVOGLFBBUGT-SCRDCRAPSA-N	1	1	323.397	1.289	20	5		DDBDMO
O=C(NCC1CC[NH+](C/C=C/Cl)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001399239	762825526	/nfs/dbraw/zinc/82/55/26/762825526.db2.gz	KIFRCXRWFWYWDP-IYODYBDTSA-N	1	1	301.774	1.232	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347077	766278308	/nfs/dbraw/zinc/27/83/08/766278308.db2.gz	QAHMXNMPQXBTEB-RISCZKNCSA-N	1	1	321.377	1.874	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347077	766278310	/nfs/dbraw/zinc/27/83/10/766278310.db2.gz	QAHMXNMPQXBTEB-RISCZKNCSA-N	1	1	321.377	1.874	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001147155434	773054223	/nfs/dbraw/zinc/05/42/23/773054223.db2.gz	ZPDKEMKPVFGQKL-ZETCQYMHSA-N	1	1	315.761	1.574	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1	ZINC001148757056	773594388	/nfs/dbraw/zinc/59/43/88/773594388.db2.gz	DHJNYZBPHUSARY-ZETCQYMHSA-N	1	1	301.734	1.185	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001093642101	774940511	/nfs/dbraw/zinc/94/05/11/774940511.db2.gz	KOBUDRMQDNJGGZ-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ccccc1[N+](=O)[O-]	ZINC001094517188	775973790	/nfs/dbraw/zinc/97/37/90/775973790.db2.gz	FCGZYTSOBONBNQ-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H]3COC(=O)N[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC001171742129	776460038	/nfs/dbraw/zinc/46/00/38/776460038.db2.gz	WMNIESZZLXFREA-QWHCGFSZSA-N	1	1	305.334	1.834	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H]3COC(=O)N[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC001171742129	776460040	/nfs/dbraw/zinc/46/00/40/776460040.db2.gz	WMNIESZZLXFREA-QWHCGFSZSA-N	1	1	305.334	1.834	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCOC[C@H](O)C1)CC2	ZINC001172903899	776917254	/nfs/dbraw/zinc/91/72/54/776917254.db2.gz	JKBXUHKTIIBVFR-GDBMZVCRSA-N	1	1	306.362	1.535	20	5		DDBDMO
C[C@@H]1C(=O)NCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908134	776918236	/nfs/dbraw/zinc/91/82/36/776918236.db2.gz	BCKJZTCGPQFMBT-BXUZGUMPSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H]1C(=O)NCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908134	776918245	/nfs/dbraw/zinc/91/82/45/776918245.db2.gz	BCKJZTCGPQFMBT-BXUZGUMPSA-N	1	1	303.362	1.663	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001177044222	778406410	/nfs/dbraw/zinc/40/64/10/778406410.db2.gz	PYRMDUIGBRRLBD-WFASDCNBSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1conc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178463917	779061109	/nfs/dbraw/zinc/06/11/09/779061109.db2.gz	NDNPEFQNIUMMMS-TZMCWYRMSA-N	1	1	324.381	1.414	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CC1CCCCC1	ZINC001123138581	859102868	/nfs/dbraw/zinc/10/28/68/859102868.db2.gz	XIMUCAKXRUTNPW-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
C[C@@H]1C[C@H]2CC[C@H](C(=O)NCCn3cc([N+](=O)[O-])cn3)C[N@H+]2C1	ZINC001123668796	859352084	/nfs/dbraw/zinc/35/20/84/859352084.db2.gz	HIGHYNGCOLJXKA-FRRDWIJNSA-N	1	1	321.381	1.028	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(NCC[NH+]2CCSCC2)n1	ZINC001157043701	863534570	/nfs/dbraw/zinc/53/45/70/863534570.db2.gz	VLAGPEPAVWJYBY-UHFFFAOYSA-N	1	1	313.383	1.163	20	5		DDBDMO
CC[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C(C)(C)C1	ZINC001158562945	864727679	/nfs/dbraw/zinc/72/76/79/864727679.db2.gz	OOAQXOPWFPXHKR-UHFFFAOYSA-N	1	1	309.326	1.819	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[C@@H]1[NH+]1CCOCC1	ZINC001160720829	866061933	/nfs/dbraw/zinc/06/19/33/866061933.db2.gz	SSONVZDLKGRXTQ-KGLIPLIRSA-N	1	1	306.366	1.963	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)CC[N@@H+](C)C1CC1	ZINC001320357214	866668581	/nfs/dbraw/zinc/66/85/81/866668581.db2.gz	JTZDRXITFCQIBI-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001323719641	866793938	/nfs/dbraw/zinc/79/39/38/866793938.db2.gz	BVAWHCJUZUJMIO-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
CCC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001323719641	866793946	/nfs/dbraw/zinc/79/39/46/866793946.db2.gz	BVAWHCJUZUJMIO-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
CCC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001323719641	866793956	/nfs/dbraw/zinc/79/39/56/866793956.db2.gz	BVAWHCJUZUJMIO-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N[C@@H]2CCCNC(=O)C2)ncc1[N+](=O)[O-]	ZINC001162454030	867545598	/nfs/dbraw/zinc/54/55/98/867545598.db2.gz	NBUYKNDAOICSSR-HOSRBBHYSA-N	1	1	319.365	1.603	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C1	ZINC001163118521	868118524	/nfs/dbraw/zinc/11/85/24/868118524.db2.gz	ZECRVQXCRJWVBO-GFCCVEGCSA-N	1	1	322.365	1.403	20	5		DDBDMO
Cc1cccc(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001322504967	868210173	/nfs/dbraw/zinc/21/01/73/868210173.db2.gz	HALAKSHRYATWJU-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
COC(=O)Cc1ccc(NCCc2[nH+]ccn2C)c([N+](=O)[O-])c1	ZINC001336398542	868922172	/nfs/dbraw/zinc/92/21/72/868922172.db2.gz	BQKGWVJLXMYZSO-UHFFFAOYSA-N	1	1	318.333	1.698	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1	ZINC001226213567	882284347	/nfs/dbraw/zinc/28/43/47/882284347.db2.gz	DVSAKKVLQWEQQP-LBPRGKRZSA-N	1	1	308.334	1.783	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(c4ncc([N+](=O)[O-])cn4)C[C@]2(C1)CCCC3	ZINC001338199892	869864373	/nfs/dbraw/zinc/86/43/73/869864373.db2.gz	IPUCJCWHRLTISR-GASCZTMLSA-N	1	1	303.366	1.697	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001226360565	882384870	/nfs/dbraw/zinc/38/48/70/882384870.db2.gz	DBQZTJHOZNMJAR-LLVKDONJSA-N	1	1	324.333	1.863	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001303986541	871172431	/nfs/dbraw/zinc/17/24/31/871172431.db2.gz	XJEMBVQTSPZNIW-CYBMUJFWSA-N	1	1	307.350	1.430	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001308109351	871472681	/nfs/dbraw/zinc/47/26/81/871472681.db2.gz	VMMLXNVERUDWHG-UKRRQHHQSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC001348031227	874339437	/nfs/dbraw/zinc/33/94/37/874339437.db2.gz	IQROKTLJSHSKOU-GXSJLCMTSA-N	1	1	302.338	1.532	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC001355313203	878496080	/nfs/dbraw/zinc/49/60/80/878496080.db2.gz	QILVMVUTVYXPOD-ZDUSSCGKSA-N	1	1	320.393	1.921	20	5		DDBDMO
COc1cccc(CO[C@@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC001223809725	881106720	/nfs/dbraw/zinc/10/67/20/881106720.db2.gz	VIOQLILNTARDKQ-LBPRGKRZSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[N@H+]1CCC[C@H](Oc2n[nH]c(=O)c3cccc([N+](=O)[O-])c32)C1	ZINC001229367930	883948751	/nfs/dbraw/zinc/94/87/51/883948751.db2.gz	VREIYJBGCJMSBG-VIFPVBQESA-N	1	1	304.306	1.717	20	5		DDBDMO
CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccnc1	ZINC001230763283	884847513	/nfs/dbraw/zinc/84/75/13/884847513.db2.gz	WFAYKYLSQMONJC-HUUCEWRRSA-N	1	1	320.393	1.464	20	5		DDBDMO
CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001230763283	884847525	/nfs/dbraw/zinc/84/75/25/884847525.db2.gz	WFAYKYLSQMONJC-HUUCEWRRSA-N	1	1	320.393	1.464	20	5		DDBDMO
CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccnc1	ZINC001230763283	884847536	/nfs/dbraw/zinc/84/75/36/884847536.db2.gz	WFAYKYLSQMONJC-HUUCEWRRSA-N	1	1	320.393	1.464	20	5		DDBDMO
OC[C@@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@@H]1O	ZINC001232218317	886165686	/nfs/dbraw/zinc/16/56/86/886165686.db2.gz	FUPHJKIPJQJFDN-RDJZCZTQSA-N	1	1	323.396	1.958	20	5		DDBDMO
Cc1nc(O[C@@H](C)C[N+](C)(C)C)c(Br)c(=O)[nH]1	ZINC001234569792	888108022	/nfs/dbraw/zinc/10/80/22/888108022.db2.gz	UIEILYWHIGBLEP-ZETCQYMHSA-O	1	1	305.196	1.727	20	5		DDBDMO
N[C@@]12C[C@@H]1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246870276	892960823	/nfs/dbraw/zinc/96/08/23/892960823.db2.gz	OGZWMFNJWQTFMJ-MLGOLLRUSA-N	1	1	302.378	1.597	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@@H]3C[C@H](CO)C[C@@H]31)C2	ZINC001254594725	896520553	/nfs/dbraw/zinc/52/05/53/896520553.db2.gz	SPQVGZUGZHGYPP-KLWIRTJPSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@@H]3C[C@H](CO)C[C@@H]31)C2	ZINC001254594725	896520568	/nfs/dbraw/zinc/52/05/68/896520568.db2.gz	SPQVGZUGZHGYPP-KLWIRTJPSA-N	1	1	318.373	1.534	20	5		DDBDMO
Cc1cc(NC(=O)[C@@H]2C[N@@H+]3CCN2C[C@@H]3C)cc([N+](=O)[O-])c1	ZINC001264010942	900871065	/nfs/dbraw/zinc/87/10/65/900871065.db2.gz	QHRXEGHCDZKFKE-FZMZJTMJSA-N	1	1	304.350	1.230	20	5		DDBDMO
CS[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000451308208	231063667	/nfs/dbraw/zinc/06/36/67/231063667.db2.gz	AFGFPSSGHFQTRT-OCCSQVGLSA-N	1	1	312.391	1.772	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCCSCC2)c1	ZINC000089984439	185274452	/nfs/dbraw/zinc/27/44/52/185274452.db2.gz	CELYYVHIBGTSQA-CYBMUJFWSA-N	1	1	312.391	1.773	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])cnc1N)C1CC1	ZINC000457175345	529883697	/nfs/dbraw/zinc/88/36/97/529883697.db2.gz	XPSPDDIFBMQDTD-UHFFFAOYSA-N	1	1	307.354	1.176	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000299526828	530063714	/nfs/dbraw/zinc/06/37/14/530063714.db2.gz	CNVIWFLRLGHIKQ-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000181730113	199344513	/nfs/dbraw/zinc/34/45/13/199344513.db2.gz	NNXLKUZEMWOHGU-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000358330241	299122503	/nfs/dbraw/zinc/12/25/03/299122503.db2.gz	OWSNRVJOWXNIJJ-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000280057669	215344641	/nfs/dbraw/zinc/34/46/41/215344641.db2.gz	MLIVVGLHEIHZHX-OAHLLOKOSA-N	1	1	307.350	1.431	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)n1	ZINC000617403695	363089447	/nfs/dbraw/zinc/08/94/47/363089447.db2.gz	YPUYDYDJEYAJFT-UHFFFAOYSA-N	1	1	323.397	1.758	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000277193080	213357930	/nfs/dbraw/zinc/35/79/30/213357930.db2.gz	BORTWMANCMFFBS-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[NH+]1CCN(CCCCNC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000041362692	352304660	/nfs/dbraw/zinc/30/46/60/352304660.db2.gz	JHEUHANERJDJJQ-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000046036990	352433715	/nfs/dbraw/zinc/43/37/15/352433715.db2.gz	YEMVVMJTZWAJIJ-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000046036990	352433718	/nfs/dbraw/zinc/43/37/18/352433718.db2.gz	YEMVVMJTZWAJIJ-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
CC(C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[NH+]1CCOCC1	ZINC000055473090	352735168	/nfs/dbraw/zinc/73/51/68/352735168.db2.gz	XEDKJTQTXJAQAS-CYBMUJFWSA-N	1	1	310.354	1.010	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000063771225	352924311	/nfs/dbraw/zinc/92/43/11/352924311.db2.gz	FMEOMHNYGNZVNR-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@H]2C[N@H+]3CCC[C@H]3CO2)cc1[N+](=O)[O-]	ZINC000061649602	352893286	/nfs/dbraw/zinc/89/32/86/352893286.db2.gz	JYAQKKUFFJESKE-KBPBESRZSA-N	1	1	319.361	1.496	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1C(N)=O	ZINC000068369190	353107014	/nfs/dbraw/zinc/10/70/14/353107014.db2.gz	RLTZHDXRQJNXCD-CYBMUJFWSA-N	1	1	320.349	1.182	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1	ZINC000072578247	353202569	/nfs/dbraw/zinc/20/25/69/353202569.db2.gz	HAULTVOPEKZBFP-JSGCOSHPSA-N	1	1	305.338	1.317	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC[C@H](C)O	ZINC000072712805	353210529	/nfs/dbraw/zinc/21/05/29/353210529.db2.gz	RELKZPODHMGUMS-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2	ZINC000072833172	353221133	/nfs/dbraw/zinc/22/11/33/353221133.db2.gz	SFOQKXYOGOBYLU-INIZCTEOSA-N	1	1	303.362	1.739	20	5		DDBDMO
CN(C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000074448452	353313891	/nfs/dbraw/zinc/31/38/91/353313891.db2.gz	MLUACXOGYBHBNP-XHSDSOJGSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000074448452	353313895	/nfs/dbraw/zinc/31/38/95/353313895.db2.gz	MLUACXOGYBHBNP-XHSDSOJGSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000074448452	353313898	/nfs/dbraw/zinc/31/38/98/353313898.db2.gz	MLUACXOGYBHBNP-XHSDSOJGSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000174351782	198322848	/nfs/dbraw/zinc/32/28/48/198322848.db2.gz	ZZXFMGHAUDDOJS-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000174351782	198322850	/nfs/dbraw/zinc/32/28/50/198322850.db2.gz	ZZXFMGHAUDDOJS-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cnc(NC2CC[NH+](CCN(C)C)CC2)c([N+](=O)[O-])c1	ZINC000078630116	353525776	/nfs/dbraw/zinc/52/57/76/353525776.db2.gz	RARDRQHBQPOHID-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
C[NH+](C)CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-]	ZINC000090998134	353801410	/nfs/dbraw/zinc/80/14/10/353801410.db2.gz	CJHQEHFVPVPANV-UHFFFAOYSA-N	1	1	323.321	1.565	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000091457692	353827257	/nfs/dbraw/zinc/82/72/57/353827257.db2.gz	QWKOZPCZSXJIGQ-LLVKDONJSA-N	1	1	304.354	1.781	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC1CC[NH+](CC(=O)N(C)C)CC1	ZINC000092652746	353865682	/nfs/dbraw/zinc/86/56/82/353865682.db2.gz	KHQIJGMBNKYCAH-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000093279003	353891238	/nfs/dbraw/zinc/89/12/38/353891238.db2.gz	XJZINQNZSHETMX-GFCCVEGCSA-N	1	1	324.381	1.703	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000108345027	353951499	/nfs/dbraw/zinc/95/14/99/353951499.db2.gz	FLPZUFDKBKLSJD-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
CCC(CC)(C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236791999	202011321	/nfs/dbraw/zinc/01/13/21/202011321.db2.gz	OYTJJTDWFPGEKH-UHFFFAOYSA-N	1	1	305.338	1.718	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000154690479	354207321	/nfs/dbraw/zinc/20/73/21/354207321.db2.gz	JUYJFLYYQLDMHT-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000154690479	354207322	/nfs/dbraw/zinc/20/73/22/354207322.db2.gz	JUYJFLYYQLDMHT-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@H](O)C1CC1	ZINC000156578762	354220062	/nfs/dbraw/zinc/22/00/62/354220062.db2.gz	NRPGWWLZJMTLQR-AWEZNQCLSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H](O)C1CC1	ZINC000156578762	354220065	/nfs/dbraw/zinc/22/00/65/354220065.db2.gz	NRPGWWLZJMTLQR-AWEZNQCLSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@H]1C	ZINC000319123279	354519891	/nfs/dbraw/zinc/51/98/91/354519891.db2.gz	QUQFOVITXDOTBT-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@H]1C	ZINC000319123279	354519894	/nfs/dbraw/zinc/51/98/94/354519894.db2.gz	QUQFOVITXDOTBT-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H](C)C1	ZINC000346231301	283034968	/nfs/dbraw/zinc/03/49/68/283034968.db2.gz	OBROETMBQSTOQC-OUCADQQQSA-N	1	1	320.393	1.736	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)[C@@H]2C1	ZINC000585779646	354839836	/nfs/dbraw/zinc/83/98/36/354839836.db2.gz	HPHVDOBKSKGTAJ-QMTHXVAHSA-N	1	1	306.366	1.200	20	5		DDBDMO
C[C@@H](Nc1cc(N)c([N+](=O)[O-])c(CO)c1)[C@H](C)[NH+]1CCOCC1	ZINC000587882050	354886241	/nfs/dbraw/zinc/88/62/41/354886241.db2.gz	RVBINPWAZUTNER-MNOVXSKESA-N	1	1	324.381	1.190	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)[C@H]2C1	ZINC000590444717	355098220	/nfs/dbraw/zinc/09/82/20/355098220.db2.gz	KEKZHHWPPQVFME-BMIGLBTASA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1	ZINC000591029801	355235890	/nfs/dbraw/zinc/23/58/90/355235890.db2.gz	JORUKIFOWLYBEK-VHDGCEQUSA-N	1	1	303.362	1.909	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000591476897	355320749	/nfs/dbraw/zinc/32/07/49/355320749.db2.gz	CKFAUOOPONSBDA-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000286071915	291067283	/nfs/dbraw/zinc/06/72/83/291067283.db2.gz	RWIARSIEYIOKTP-DZGCQCFKSA-N	1	1	305.378	1.890	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H](O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000592196509	355532771	/nfs/dbraw/zinc/53/27/71/355532771.db2.gz	CBXZXDGZKCIPFD-QWHCGFSZSA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532025	355617724	/nfs/dbraw/zinc/61/77/24/355617724.db2.gz	LYUNHNXBZMUJMA-OLZOCXBDSA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532025	355617728	/nfs/dbraw/zinc/61/77/28/355617728.db2.gz	LYUNHNXBZMUJMA-OLZOCXBDSA-N	1	1	308.334	1.259	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000593187719	355820047	/nfs/dbraw/zinc/82/00/47/355820047.db2.gz	OIVRHKYZESLSSV-UPJWGTAASA-N	1	1	321.377	1.913	20	5		DDBDMO
O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000593252387	355833310	/nfs/dbraw/zinc/83/33/10/355833310.db2.gz	YSWJNVQWADGHGO-LLVKDONJSA-N	1	1	324.312	1.017	20	5		DDBDMO
O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593252387	355833312	/nfs/dbraw/zinc/83/33/12/355833312.db2.gz	YSWJNVQWADGHGO-LLVKDONJSA-N	1	1	324.312	1.017	20	5		DDBDMO
Cc1[nH+]c2c(n1CCO)CC[C@H](Nc1ncccc1[N+](=O)[O-])C2	ZINC000594873864	356346269	/nfs/dbraw/zinc/34/62/69/356346269.db2.gz	OFCXOMQMBAALMR-NSHDSACASA-N	1	1	317.349	1.456	20	5		DDBDMO
Cc1noc(C[N@@H+](CC(C)(C)O)C2CCOCC2)c1[N+](=O)[O-]	ZINC000595334243	356453342	/nfs/dbraw/zinc/45/33/42/356453342.db2.gz	KNWDUMWUDMQAQW-UHFFFAOYSA-N	1	1	313.354	1.643	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000081361389	192256748	/nfs/dbraw/zinc/25/67/48/192256748.db2.gz	NVOMMZBNOCVJRI-LBPRGKRZSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](Cn3ccnn3)C2)c1[N+](=O)[O-]	ZINC000595395075	356476842	/nfs/dbraw/zinc/47/68/42/356476842.db2.gz	GRAJYNXKVQJPNP-LLVKDONJSA-N	1	1	306.326	1.395	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](Cn3ccnn3)C2)c1[N+](=O)[O-]	ZINC000595395075	356476845	/nfs/dbraw/zinc/47/68/45/356476845.db2.gz	GRAJYNXKVQJPNP-LLVKDONJSA-N	1	1	306.326	1.395	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1	ZINC000595608709	356575326	/nfs/dbraw/zinc/57/53/26/356575326.db2.gz	UJQLQTQYOJDKOQ-AWEZNQCLSA-N	1	1	301.350	1.751	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[N@@H+]2CC[C@H](Cn3ccnn3)C2)c(F)c1	ZINC000595608711	356575722	/nfs/dbraw/zinc/57/57/22/356575722.db2.gz	UKCIEQYVCPJZGL-JTQLQIEISA-N	1	1	323.303	1.987	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[N@H+]2CC[C@H](Cn3ccnn3)C2)c(F)c1	ZINC000595608711	356575726	/nfs/dbraw/zinc/57/57/26/356575726.db2.gz	UKCIEQYVCPJZGL-JTQLQIEISA-N	1	1	323.303	1.987	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000595663748	356599329	/nfs/dbraw/zinc/59/93/29/356599329.db2.gz	UGFLRVDOLCYFOS-OAHLLOKOSA-N	1	1	310.350	1.447	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595727835	356624313	/nfs/dbraw/zinc/62/43/13/356624313.db2.gz	DLFQCCWPAUKJJN-GXFFZTMASA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595727835	356624318	/nfs/dbraw/zinc/62/43/18/356624318.db2.gz	DLFQCCWPAUKJJN-GXFFZTMASA-N	1	1	307.325	1.834	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1COCCO1	ZINC000595734852	356627089	/nfs/dbraw/zinc/62/70/89/356627089.db2.gz	CCNCDPOVGGYQCJ-LBPRGKRZSA-N	1	1	323.349	1.271	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000618237910	363537594	/nfs/dbraw/zinc/53/75/94/363537594.db2.gz	CHPPZNQIDYMNAY-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000618237910	363537596	/nfs/dbraw/zinc/53/75/96/363537596.db2.gz	CHPPZNQIDYMNAY-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC2(COC2)C1	ZINC000595832613	356669478	/nfs/dbraw/zinc/66/94/78/356669478.db2.gz	GGSSLMDAQCCUNH-NSHDSACASA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC2(COC2)C1	ZINC000595832613	356669479	/nfs/dbraw/zinc/66/94/79/356669479.db2.gz	GGSSLMDAQCCUNH-NSHDSACASA-N	1	1	305.334	1.644	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CCC3(COC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595833426	356670401	/nfs/dbraw/zinc/67/04/01/356670401.db2.gz	IRTMRWMDTHNSDF-AWEZNQCLSA-N	1	1	317.345	1.422	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC3(COC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595833426	356670403	/nfs/dbraw/zinc/67/04/03/356670403.db2.gz	IRTMRWMDTHNSDF-AWEZNQCLSA-N	1	1	317.345	1.422	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c2c(c1)COCO2	ZINC000595830711	356667827	/nfs/dbraw/zinc/66/78/27/356667827.db2.gz	LGUJHLHFENSEBX-SMDDNHRTSA-N	1	1	320.345	1.930	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](CCC2CC2)CC2CC2)c1	ZINC000595871468	356687195	/nfs/dbraw/zinc/68/71/95/356687195.db2.gz	OOEQDYFTQKZFIX-HNNXBMFYSA-N	1	1	308.382	1.664	20	5		DDBDMO
CC(C)(C)C(F)(F)C[NH2+]C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000596068300	356760399	/nfs/dbraw/zinc/76/03/99/356760399.db2.gz	HIZLISXNMPQRJT-SNVBAGLBSA-N	1	1	306.313	1.423	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)C[C@@H](C)C(=O)NC)ccc1[N+](=O)[O-]	ZINC000276914501	213172702	/nfs/dbraw/zinc/17/27/02/213172702.db2.gz	NZJXXQAJMTUHCX-LLVKDONJSA-N	1	1	309.366	1.807	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596151945	356793060	/nfs/dbraw/zinc/79/30/60/356793060.db2.gz	MYSZBNFUPDOZAV-ZWNOBZJWSA-N	1	1	306.366	1.470	20	5		DDBDMO
Cc1cc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000596538586	356911209	/nfs/dbraw/zinc/91/12/09/356911209.db2.gz	MKUYIJPVJBPUKU-OAHLLOKOSA-N	1	1	305.378	1.939	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000597921918	357382407	/nfs/dbraw/zinc/38/24/07/357382407.db2.gz	HVDYSPYKVXYHEZ-JTQLQIEISA-N	1	1	306.366	1.780	20	5		DDBDMO
CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CC[N@@H+](C)C1	ZINC000597946878	357395186	/nfs/dbraw/zinc/39/51/86/357395186.db2.gz	RVLJNSDNAPGQSL-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598652064	357671955	/nfs/dbraw/zinc/67/19/55/357671955.db2.gz	WTISVTANRRKVJE-OLZOCXBDSA-N	1	1	321.377	1.874	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000292357886	223019473	/nfs/dbraw/zinc/01/94/73/223019473.db2.gz	VYFLCCZGTOQTFB-QGZVFWFLSA-N	1	1	317.389	2.000	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CCC([NH+]2CCOCC2)CC1	ZINC000600113062	358126347	/nfs/dbraw/zinc/12/63/47/358126347.db2.gz	YCXLCWZJNSMPDV-UHFFFAOYSA-N	1	1	319.361	1.532	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000601198529	358443337	/nfs/dbraw/zinc/44/33/37/358443337.db2.gz	CEOYSIKKGPDIDQ-LBPRGKRZSA-N	1	1	310.329	1.164	20	5		DDBDMO
Cn1c[nH+]cc1CCNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601141925	358418169	/nfs/dbraw/zinc/41/81/69/358418169.db2.gz	SMIXSEOZWPVDRM-UHFFFAOYSA-N	1	1	318.259	1.735	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000601162693	358427352	/nfs/dbraw/zinc/42/73/52/358427352.db2.gz	UDRHXBXEAVZRHX-GFCCVEGCSA-N	1	1	324.356	1.678	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000601183714	358437854	/nfs/dbraw/zinc/43/78/54/358437854.db2.gz	DAQFLGFGGMQYPR-QWHCGFSZSA-N	1	1	318.377	1.342	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000601776166	358690590	/nfs/dbraw/zinc/69/05/90/358690590.db2.gz	HICOPDMTSNUAEB-WBMJQRKESA-N	1	1	321.377	1.260	20	5		DDBDMO
CN1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1=O	ZINC000602526307	359025969	/nfs/dbraw/zinc/02/59/69/359025969.db2.gz	IZFSIQPNJBIRKF-JTQLQIEISA-N	1	1	317.267	1.934	20	5		DDBDMO
CCNC(=O)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000602585228	359056906	/nfs/dbraw/zinc/05/69/06/359056906.db2.gz	DNZMDAXQLUSIMQ-UHFFFAOYSA-N	1	1	305.256	1.839	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](n2cc(Cl)cn2)C1	ZINC000602836712	359228174	/nfs/dbraw/zinc/22/81/74/359228174.db2.gz	GYFPVVHNNMRBDH-GFCCVEGCSA-N	1	1	324.772	1.897	20	5		DDBDMO
CN(C)C(=O)C1([NH2+]Cc2cn(C)nc2[N+](=O)[O-])CCCCC1	ZINC000602842145	359231007	/nfs/dbraw/zinc/23/10/07/359231007.db2.gz	QLWTVXQUKOECNK-UHFFFAOYSA-N	1	1	309.370	1.209	20	5		DDBDMO
CC1(C)C[N@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccco1	ZINC000602928006	359299879	/nfs/dbraw/zinc/29/98/79/359299879.db2.gz	VJCRVTDUNVVFBU-TZMCWYRMSA-N	1	1	320.349	1.828	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccco1	ZINC000602928006	359299881	/nfs/dbraw/zinc/29/98/81/359299881.db2.gz	VJCRVTDUNVVFBU-TZMCWYRMSA-N	1	1	320.349	1.828	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](OC)C[C@]1(C)CO	ZINC000602965139	359329476	/nfs/dbraw/zinc/32/94/76/359329476.db2.gz	ZRSBCKOQALTQTI-UKRRQHHQSA-N	1	1	310.350	1.575	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@@H]2CO1	ZINC000281182136	216135598	/nfs/dbraw/zinc/13/55/98/216135598.db2.gz	AZDCFTQNZIJYNA-OCCSQVGLSA-N	1	1	305.334	1.568	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1	ZINC000610514157	360457867	/nfs/dbraw/zinc/45/78/67/360457867.db2.gz	AJZPNRVVLBMBMV-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
CC(C)(CNc1cc(N)c([N+](=O)[O-])c(CO)c1)[NH+]1CCOCC1	ZINC000611525093	360747028	/nfs/dbraw/zinc/74/70/28/360747028.db2.gz	IEIQNNFYWKOIDT-UHFFFAOYSA-N	1	1	324.381	1.192	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c2c(c1)COCO2	ZINC000612134116	360928585	/nfs/dbraw/zinc/92/85/85/360928585.db2.gz	GSJRKLHXOVSRQX-VQISRLSMSA-N	1	1	320.345	1.664	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(Cc3cc4c(cc3[N+](=O)[O-])OCCO4)C[C@H]2C1	ZINC000618826191	363770733	/nfs/dbraw/zinc/77/07/33/363770733.db2.gz	SCSRAVOYNZTPLC-BETUJISGSA-N	1	1	319.361	1.359	20	5		DDBDMO
Cc1n[nH]cc1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000092048278	193148186	/nfs/dbraw/zinc/14/81/86/193148186.db2.gz	GUCKUPUDZKFNGV-UHFFFAOYSA-N	1	1	301.350	1.949	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)NCc1ccccc1[N+](=O)[O-]	ZINC000264809852	204173331	/nfs/dbraw/zinc/17/33/31/204173331.db2.gz	GCMIPZWVWNVCJF-UHFFFAOYSA-N	1	1	324.406	1.443	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000271739694	209170764	/nfs/dbraw/zinc/17/07/64/209170764.db2.gz	WBGYIAIZVOOHLF-LBPRGKRZSA-N	1	1	324.381	1.533	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1	ZINC000282496767	217040607	/nfs/dbraw/zinc/04/06/07/217040607.db2.gz	NAPSMDDDCFBNAH-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
CC[N@H+](CCOCCO)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000282665086	217162643	/nfs/dbraw/zinc/16/26/43/217162643.db2.gz	HAXZBNPMRWRLSQ-UHFFFAOYSA-N	1	1	313.310	1.334	20	5		DDBDMO
CC[N@@H+](CCOCCO)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000282665086	217162645	/nfs/dbraw/zinc/16/26/45/217162645.db2.gz	HAXZBNPMRWRLSQ-UHFFFAOYSA-N	1	1	313.310	1.334	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[NH2+]C[C@H]1c1cccc(F)c1	ZINC000262108141	296186442	/nfs/dbraw/zinc/18/64/42/296186442.db2.gz	ZTSVVFYNWRALRE-AWEZNQCLSA-N	1	1	318.308	1.849	20	5		DDBDMO
CN(C(=O)CN1CCC[N@@H+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000282926211	217329190	/nfs/dbraw/zinc/32/91/90/217329190.db2.gz	FHZXZKQSOUFKDR-UHFFFAOYSA-N	1	1	306.366	1.195	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288484430	220171973	/nfs/dbraw/zinc/17/19/73/220171973.db2.gz	PLSCFGJPNHVFSX-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000267963862	206365282	/nfs/dbraw/zinc/36/52/82/206365282.db2.gz	MWQYLWPDEBTMCO-UHFFFAOYSA-N	1	1	302.334	1.849	20	5		DDBDMO
C[NH+](C)C(C)(C)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000046318006	248195055	/nfs/dbraw/zinc/19/50/55/248195055.db2.gz	DIHWDOPZMXESGW-UHFFFAOYSA-N	1	1	305.338	1.541	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000336859133	249267411	/nfs/dbraw/zinc/26/74/11/249267411.db2.gz	FIZDEHBJZDGWGA-PWSUYJOCSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000042723099	183301581	/nfs/dbraw/zinc/30/15/81/183301581.db2.gz	LKYZHXXKETWFFO-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CC(=O)N(C)C1=O	ZINC000338967546	250224414	/nfs/dbraw/zinc/22/44/14/250224414.db2.gz	GODFLCLBOXFASI-CQSZACIVSA-N	1	1	319.361	1.873	20	5		DDBDMO
CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)[C@@H]1CC(=O)N(C)C1=O	ZINC000338967546	250224417	/nfs/dbraw/zinc/22/44/17/250224417.db2.gz	GODFLCLBOXFASI-CQSZACIVSA-N	1	1	319.361	1.873	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000061380218	184170234	/nfs/dbraw/zinc/17/02/34/184170234.db2.gz	OSNQPJXPSLXKQL-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](O)C[C@@H]1C	ZINC000340907084	251269711	/nfs/dbraw/zinc/26/97/11/251269711.db2.gz	LEQGREUCZROMJL-AAEUAGOBSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000340968968	251309926	/nfs/dbraw/zinc/30/99/26/251309926.db2.gz	DBCWWZJCCVILRK-GFCCVEGCSA-N	1	1	319.361	1.717	20	5		DDBDMO
CCC[C@@]1(CO)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000288754320	220395108	/nfs/dbraw/zinc/39/51/08/220395108.db2.gz	IGOBWFDBXGGZND-OAHLLOKOSA-N	1	1	309.366	1.241	20	5		DDBDMO
COCCCNC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000271646965	209091862	/nfs/dbraw/zinc/09/18/62/209091862.db2.gz	TYLHWYRXVLBWPM-NWDGAFQWSA-N	1	1	309.366	1.787	20	5		DDBDMO
C[N@@H+](CCC1CCOCC1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000120608749	195201297	/nfs/dbraw/zinc/20/12/97/195201297.db2.gz	XJEBFNYKCGYMTJ-UHFFFAOYSA-N	1	1	321.377	1.942	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ncc([N+](=O)[O-])cc1C)C(C)C	ZINC000294980681	224355723	/nfs/dbraw/zinc/35/57/23/224355723.db2.gz	PDILNDTZPGPSJX-ZDUSSCGKSA-N	1	1	324.381	1.887	20	5		DDBDMO
COc1c(C)c[nH+]c(CN(C)Cc2c([N+](=O)[O-])ncn2C)c1C	ZINC000451374498	533409255	/nfs/dbraw/zinc/40/92/55/533409255.db2.gz	KNUJJNOESVKRDM-UHFFFAOYSA-N	1	1	319.365	1.981	20	5		DDBDMO
COC(=O)[C@@H]1CN(Cc2ccc(C)c([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000414493341	533488543	/nfs/dbraw/zinc/48/85/43/533488543.db2.gz	IFMNTMWLVBLGPQ-AWEZNQCLSA-N	1	1	321.377	1.440	20	5		DDBDMO
C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[N@@H+](C)C1CC1	ZINC000069129048	406682453	/nfs/dbraw/zinc/68/24/53/406682453.db2.gz	PHHAENCHRHGANF-QMMMGPOBSA-N	1	1	319.408	1.417	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCOCC3CC3)C2)nc1	ZINC000072665240	406884467	/nfs/dbraw/zinc/88/44/67/406884467.db2.gz	IJPCRYODZKALBM-CYBMUJFWSA-N	1	1	306.366	1.903	20	5		DDBDMO
NC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000037979690	406996218	/nfs/dbraw/zinc/99/62/18/406996218.db2.gz	YACCSXXAFCVFNZ-UHFFFAOYSA-N	1	1	312.757	1.610	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000089620197	407142466	/nfs/dbraw/zinc/14/24/66/407142466.db2.gz	MOQSHNXAACLCJJ-UHFFFAOYSA-N	1	1	315.395	1.750	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000066832328	407260436	/nfs/dbraw/zinc/26/04/36/407260436.db2.gz	PNXKDQNHYBRLJM-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
Cc1c(C(=O)N2CCC[N@H+](C)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000097617891	407300539	/nfs/dbraw/zinc/30/05/39/407300539.db2.gz	PTCNJMUWXJGCNZ-UHFFFAOYSA-N	1	1	322.321	1.589	20	5		DDBDMO
CN(CC[NH+]1CCCC1)S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000103162119	407332928	/nfs/dbraw/zinc/33/29/28/407332928.db2.gz	BUYNPRMKBNBYKX-UHFFFAOYSA-N	1	1	319.408	1.373	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000123856654	407340751	/nfs/dbraw/zinc/34/07/51/407340751.db2.gz	GNRNVFNFHCPTHX-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000123856654	407340753	/nfs/dbraw/zinc/34/07/53/407340753.db2.gz	GNRNVFNFHCPTHX-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076095	407346333	/nfs/dbraw/zinc/34/63/33/407346333.db2.gz	DYBGGNXVQRNWFN-GHMZBOCLSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076095	407346335	/nfs/dbraw/zinc/34/63/35/407346335.db2.gz	DYBGGNXVQRNWFN-GHMZBOCLSA-N	1	1	320.349	1.119	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000124357870	407356217	/nfs/dbraw/zinc/35/62/17/407356217.db2.gz	WBJSXKARKOMFSE-ZDUSSCGKSA-N	1	1	323.397	1.276	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@@H+](C)C2)c1	ZINC000108333538	407384028	/nfs/dbraw/zinc/38/40/28/407384028.db2.gz	WFIGTMZEWKDZJA-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000111262952	407403370	/nfs/dbraw/zinc/40/33/70/407403370.db2.gz	QWIJDSXXOHTKFC-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CCn1cccn1	ZINC000111280812	407405636	/nfs/dbraw/zinc/40/56/36/407405636.db2.gz	MWQTZAXLHFORSA-LBPRGKRZSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CCn1cccn1	ZINC000111280812	407405638	/nfs/dbraw/zinc/40/56/38/407405638.db2.gz	MWQTZAXLHFORSA-LBPRGKRZSA-N	1	1	317.349	1.750	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)[C@H](C)C1	ZINC000185725553	407488261	/nfs/dbraw/zinc/48/82/61/407488261.db2.gz	HTXYQYWGNXIRSH-IAQYHMDHSA-N	1	1	320.393	1.979	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)n1	ZINC000151792977	407498766	/nfs/dbraw/zinc/49/87/66/407498766.db2.gz	OGPODFUSTUFHKG-CHWSQXEVSA-N	1	1	320.349	1.972	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000170768228	407499711	/nfs/dbraw/zinc/49/97/11/407499711.db2.gz	OWUCDDOSKZKTFU-OCCSQVGLSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCC([NH3+])(CC)CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000261673926	407574306	/nfs/dbraw/zinc/57/43/06/407574306.db2.gz	LTFUKWYSWZBSPK-UHFFFAOYSA-N	1	1	319.358	1.530	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H]([NH+]3CC=CC3)C2)c1	ZINC000185848079	407520371	/nfs/dbraw/zinc/52/03/71/407520371.db2.gz	GQCSALYLVKYGRH-CYBMUJFWSA-N	1	1	323.374	1.230	20	5		DDBDMO
CCc1ccc(C(=O)NCC[NH+]2CCSCC2)cc1[N+](=O)[O-]	ZINC000266893711	407665947	/nfs/dbraw/zinc/66/59/47/407665947.db2.gz	FYLBRHWPSJHMTC-UHFFFAOYSA-N	1	1	323.418	1.936	20	5		DDBDMO
C[N@H+](CCc1ccccn1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000152972106	407726143	/nfs/dbraw/zinc/72/61/43/407726143.db2.gz	DEJKAMYDUDRJQM-UHFFFAOYSA-N	1	1	302.334	1.326	20	5		DDBDMO
O=C1CNC(=O)N1CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000153223505	407779444	/nfs/dbraw/zinc/77/94/44/407779444.db2.gz	GUJXBUGOHZVKCA-UHFFFAOYSA-N	1	1	318.333	1.111	20	5		DDBDMO
C[N@@H+]1CC=C(CNS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000272269026	407842495	/nfs/dbraw/zinc/84/24/95/407842495.db2.gz	RPRBXHLDBFJYPN-UHFFFAOYSA-N	1	1	311.363	1.135	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)C[C@@H]1C(C)C	ZINC000153770590	407899456	/nfs/dbraw/zinc/89/94/56/407899456.db2.gz	RGUCPRBJQNBCNY-CYBMUJFWSA-N	1	1	323.397	1.288	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)c1	ZINC000268213358	407952397	/nfs/dbraw/zinc/95/23/97/407952397.db2.gz	AZOSRUCRJISFRS-OCCSQVGLSA-N	1	1	320.349	1.972	20	5		DDBDMO
C[C@H](CO)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272476167	407940472	/nfs/dbraw/zinc/94/04/72/407940472.db2.gz	BJBUIBIZNLUJJS-FZMZJTMJSA-N	1	1	304.350	1.636	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024086	408024399	/nfs/dbraw/zinc/02/43/99/408024399.db2.gz	LNIAOFZVFUROPF-MCIONIFRSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024086	408024407	/nfs/dbraw/zinc/02/44/07/408024407.db2.gz	LNIAOFZVFUROPF-MCIONIFRSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)CC[N@H+]1C[C@H](C)O	ZINC000268479687	408064450	/nfs/dbraw/zinc/06/44/50/408064450.db2.gz	LCRLUWVUTSKYIN-WCQYABFASA-N	1	1	308.382	1.580	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000189682961	408081067	/nfs/dbraw/zinc/08/10/67/408081067.db2.gz	INNOPVBTPTZUAO-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000189682961	408081075	/nfs/dbraw/zinc/08/10/75/408081075.db2.gz	INNOPVBTPTZUAO-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1c(C)ccc(C)c1[N+](=O)[O-]	ZINC000189905577	408130763	/nfs/dbraw/zinc/13/07/63/408130763.db2.gz	VUHICZKLWTWARC-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
C[N@@H+](CCOCC1CC1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273322226	408151265	/nfs/dbraw/zinc/15/12/65/408151265.db2.gz	KJFULLBUGGMGMC-AWEZNQCLSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H]1CCC[C@](CNC(=O)c2n[nH]cc2[N+](=O)[O-])([NH+](C)C)C1	ZINC000137899190	408162051	/nfs/dbraw/zinc/16/20/51/408162051.db2.gz	DDEKFQDNLRUUOJ-YGRLFVJLSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1CO	ZINC000190422659	408242352	/nfs/dbraw/zinc/24/23/52/408242352.db2.gz	AVQZUULGYJRHQY-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CCCC(=O)NC[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176225518	408316035	/nfs/dbraw/zinc/31/60/35/408316035.db2.gz	LFIMEOLMMKXXMZ-ZDUSSCGKSA-N	1	1	323.397	1.420	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccc(O)cc3)CC2)n1	ZINC000176189392	408302796	/nfs/dbraw/zinc/30/27/96/408302796.db2.gz	SPSSIWMFMFHPOW-UHFFFAOYSA-N	1	1	317.349	1.319	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000263919450	408314452	/nfs/dbraw/zinc/31/44/52/408314452.db2.gz	RYWLEWLSVRIXBG-UHFFFAOYSA-N	1	1	309.370	1.193	20	5		DDBDMO
CC[C@@](C)([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(N)=O	ZINC000133136686	162052298	/nfs/dbraw/zinc/05/22/98/162052298.db2.gz	VJYQFEIHFYKSTP-CQSZACIVSA-N	1	1	308.338	1.085	20	5		DDBDMO
Cc1[nH+]ccn1-c1ccc(NC(=O)c2n[nH]cc2[N+](=O)[O-])cn1	ZINC000136280261	162117416	/nfs/dbraw/zinc/11/74/16/162117416.db2.gz	QAOTUOKRTUBDNK-UHFFFAOYSA-N	1	1	313.277	1.459	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000246875996	408359412	/nfs/dbraw/zinc/35/94/12/408359412.db2.gz	WJDZJRWWWCUWAE-RYUDHWBXSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000246875996	408359416	/nfs/dbraw/zinc/35/94/16/408359416.db2.gz	WJDZJRWWWCUWAE-RYUDHWBXSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000264063691	408359039	/nfs/dbraw/zinc/35/90/39/408359039.db2.gz	ABFQRJLITPWJCP-LLVKDONJSA-N	1	1	315.395	1.603	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000247377970	408459284	/nfs/dbraw/zinc/45/92/84/408459284.db2.gz	VOFRVNBOCMZUAN-KBPBESRZSA-N	1	1	307.394	1.524	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000274496609	408427387	/nfs/dbraw/zinc/42/73/87/408427387.db2.gz	GXCYHBIROHYNDL-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000160412473	408482243	/nfs/dbraw/zinc/48/22/43/408482243.db2.gz	TZFWIXZZRBKJAF-NSHDSACASA-N	1	1	309.370	1.323	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000247943361	408516222	/nfs/dbraw/zinc/51/62/22/408516222.db2.gz	HGEKGTVOQDGRMY-YRGRVCCFSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000247943361	408516224	/nfs/dbraw/zinc/51/62/24/408516224.db2.gz	HGEKGTVOQDGRMY-YRGRVCCFSA-N	1	1	310.350	1.444	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000274608515	408467727	/nfs/dbraw/zinc/46/77/27/408467727.db2.gz	WATRULPULRMRHN-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1O	ZINC000275543105	408595599	/nfs/dbraw/zinc/59/55/99/408595599.db2.gz	ZFKCGJCLFBREOE-SWLSCSKDSA-N	1	1	324.377	1.427	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000265270503	408599523	/nfs/dbraw/zinc/59/95/23/408599523.db2.gz	GLKIWLCSIADWGC-ZDUSSCGKSA-N	1	1	305.378	1.938	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC1	ZINC000264600812	408541058	/nfs/dbraw/zinc/54/10/58/408541058.db2.gz	DNLFFSRQLICARS-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000177420513	408611064	/nfs/dbraw/zinc/61/10/64/408611064.db2.gz	XGIRREKCSLNIMM-HNNXBMFYSA-N	1	1	308.334	1.859	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000177445627	408621182	/nfs/dbraw/zinc/62/11/82/408621182.db2.gz	AQOGHTZVQQJTKV-HNNXBMFYSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000270882016	408724975	/nfs/dbraw/zinc/72/49/75/408724975.db2.gz	KGILFXLFFMUKSD-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000270882016	408724977	/nfs/dbraw/zinc/72/49/77/408724977.db2.gz	KGILFXLFFMUKSD-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000162187826	408677377	/nfs/dbraw/zinc/67/73/77/408677377.db2.gz	ZXVLOKSGHZPPDO-GFCCVEGCSA-N	1	1	323.397	1.713	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000270936310	408749809	/nfs/dbraw/zinc/74/98/09/408749809.db2.gz	REMYATPCYPOOTK-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000265756987	408771309	/nfs/dbraw/zinc/77/13/09/408771309.db2.gz	GITOOJMKOJQUNZ-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000290776147	408831319	/nfs/dbraw/zinc/83/13/19/408831319.db2.gz	CBBFMGCYMLBKQR-JTQLQIEISA-N	1	1	310.354	1.546	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCCCO	ZINC000276440202	408858412	/nfs/dbraw/zinc/85/84/12/408858412.db2.gz	UIGFDXIRCTZWOL-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1	ZINC000291614648	408895290	/nfs/dbraw/zinc/89/52/90/408895290.db2.gz	AJALGSFWMRNDGH-INIZCTEOSA-N	1	1	318.377	1.486	20	5		DDBDMO
Cc1nc(NCCN2CC[N@H+](C)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000281648969	408903127	/nfs/dbraw/zinc/90/31/27/408903127.db2.gz	NEZCXOMGCSMXOD-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000291730421	408913884	/nfs/dbraw/zinc/91/38/84/408913884.db2.gz	JNQUXPVYRWGIOO-LSDHHAIUSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+]Cc2nccn2-c2ccccc2)c1	ZINC000191364936	163182036	/nfs/dbraw/zinc/18/20/36/163182036.db2.gz	DBVUQCMUUUQENG-UHFFFAOYSA-N	1	1	312.333	1.767	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193621991	163261254	/nfs/dbraw/zinc/26/12/54/163261254.db2.gz	IOIKFPBAXHVGFH-UPJWGTAASA-N	1	1	318.377	1.415	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC[N@H+](C2CC2)CC1	ZINC000194534720	163287016	/nfs/dbraw/zinc/28/70/16/163287016.db2.gz	JDAKNTPQPYMAFP-UHFFFAOYSA-N	1	1	306.322	1.006	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H](C)[N@@H+](C)C2CC2)n1	ZINC000286332333	408965953	/nfs/dbraw/zinc/96/59/53/408965953.db2.gz	BKJHXSYMOLICTC-VIFPVBQESA-N	1	1	308.338	1.671	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1C	ZINC000293547835	409135136	/nfs/dbraw/zinc/13/51/36/409135136.db2.gz	YRGMMGYWMMWTJV-BETUJISGSA-N	1	1	320.393	1.582	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])c[nH]c3=O)C2)C1	ZINC000295642030	409359175	/nfs/dbraw/zinc/35/91/75/409359175.db2.gz	QUZPNDQGUFOSSN-OAHLLOKOSA-N	1	1	320.349	1.253	20	5		DDBDMO
CCOc1cccc(N2CC[C@@H]3OCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000284995657	409392228	/nfs/dbraw/zinc/39/22/28/409392228.db2.gz	LREHYTSGIHXJDQ-KBPBESRZSA-N	1	1	321.377	1.903	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1COC1	ZINC000295524769	409330193	/nfs/dbraw/zinc/33/01/93/409330193.db2.gz	UXHVKJXAAKGJDT-CQSZACIVSA-N	1	1	310.350	1.444	20	5		DDBDMO
CS[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000296088587	409426407	/nfs/dbraw/zinc/42/64/07/409426407.db2.gz	CWKSVTLHCDNBCK-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
CS[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000296088587	409426411	/nfs/dbraw/zinc/42/64/11/409426411.db2.gz	CWKSVTLHCDNBCK-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000296447463	409560083	/nfs/dbraw/zinc/56/00/83/409560083.db2.gz	WWRDHFHUEVHINU-OSAQELSMSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000345167196	409651895	/nfs/dbraw/zinc/65/18/95/409651895.db2.gz	XVMKPUBDQJDZCV-RYUDHWBXSA-N	1	1	320.393	1.873	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000357058328	409828811	/nfs/dbraw/zinc/82/88/11/409828811.db2.gz	ZTVGJOZOXNFDBN-LLVKDONJSA-N	1	1	309.370	1.132	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000354374215	409806619	/nfs/dbraw/zinc/80/66/19/409806619.db2.gz	YUWDZAUKWJWKTG-LBPRGKRZSA-N	1	1	308.382	1.928	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)C[C@H]1C	ZINC000357049848	409820593	/nfs/dbraw/zinc/82/05/93/409820593.db2.gz	HOLQMOAPOWWGLM-GHMZBOCLSA-N	1	1	309.370	1.273	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000338327079	409911067	/nfs/dbraw/zinc/91/10/67/409911067.db2.gz	IZSDRINPSOKHAQ-UHFFFAOYSA-N	1	1	320.324	1.988	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](C)C1	ZINC000346244106	409870941	/nfs/dbraw/zinc/87/09/41/409870941.db2.gz	UNJPEFOYRLLDEA-QJPTWQEYSA-N	1	1	321.381	1.131	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000354791076	410090347	/nfs/dbraw/zinc/09/03/47/410090347.db2.gz	NURQQYQTHUEEAE-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000343161008	410198207	/nfs/dbraw/zinc/19/82/07/410198207.db2.gz	ARDURVMAHMORDV-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H]1C	ZINC000346997053	410300146	/nfs/dbraw/zinc/30/01/46/410300146.db2.gz	CBNQOEATZXNIOC-ZYHUDNBSSA-N	1	1	308.334	1.987	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)[C@H](O)C1	ZINC000351945776	410357280	/nfs/dbraw/zinc/35/72/80/410357280.db2.gz	ULEJACICEDUGJC-GXFFZTMASA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343451723	410465156	/nfs/dbraw/zinc/46/51/56/410465156.db2.gz	OLEBVOQRUXOEFW-STQMWFEESA-N	1	1	321.377	1.963	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[NH+]1[C@@H](CO)CC[C@@H]1CO	ZINC000347335064	410480089	/nfs/dbraw/zinc/48/00/89/410480089.db2.gz	NHQVUIIBYNJRFP-NXEZZACHSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]12CCC[N@H+]1C[C@H](c1noc(-c3ccc([N+](=O)[O-])[nH]3)n1)OC2	ZINC000347343732	410484703	/nfs/dbraw/zinc/48/47/03/410484703.db2.gz	SSYNBEYMYRCTFS-QMTHXVAHSA-N	1	1	319.321	1.899	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000343596269	410560470	/nfs/dbraw/zinc/56/04/70/410560470.db2.gz	GVJTXWZAQRMWTG-ZYHUDNBSSA-N	1	1	306.366	1.849	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@@](C)(O)C2)cc1[N+](=O)[O-]	ZINC000355762813	410683291	/nfs/dbraw/zinc/68/32/91/410683291.db2.gz	TTZKHGGXFZLWHU-OAHLLOKOSA-N	1	1	324.333	1.103	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)[N@H+](C)C1	ZINC000330564877	410781136	/nfs/dbraw/zinc/78/11/36/410781136.db2.gz	KLZPJQBIYIOJNJ-KBPBESRZSA-N	1	1	321.377	1.665	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)NC(C)(C)c2ccc([N+](=O)[O-])cc2)[N@@H+](C)C1	ZINC000330564877	410781144	/nfs/dbraw/zinc/78/11/44/410781144.db2.gz	KLZPJQBIYIOJNJ-KBPBESRZSA-N	1	1	321.377	1.665	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000337437486	410784478	/nfs/dbraw/zinc/78/44/78/410784478.db2.gz	XWHIESPGWUSQBO-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000330676362	410870518	/nfs/dbraw/zinc/87/05/18/410870518.db2.gz	UHCPHSOIBNHLIM-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
COc1ccc(OCC[N@H+](C)Cc2ccnn2C)c([N+](=O)[O-])c1	ZINC000348381909	410940979	/nfs/dbraw/zinc/94/09/79/410940979.db2.gz	WXLJZKZGJYWUDZ-UHFFFAOYSA-N	1	1	320.349	1.848	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)Cc2ccnn2C)c([N+](=O)[O-])c1	ZINC000348381909	410940983	/nfs/dbraw/zinc/94/09/83/410940983.db2.gz	WXLJZKZGJYWUDZ-UHFFFAOYSA-N	1	1	320.349	1.848	20	5		DDBDMO
C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc2c(c1)OCO2	ZINC000341292815	410988076	/nfs/dbraw/zinc/98/80/76/410988076.db2.gz	HPIPNKPNYCEVHP-VIFPVBQESA-N	1	1	304.306	1.908	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356451578	411039050	/nfs/dbraw/zinc/03/90/50/411039050.db2.gz	WTHBDLYEHCOUTL-TUAOUCFPSA-N	1	1	323.397	1.425	20	5		DDBDMO
COCC[N@@H+](C)CCNc1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC000580186131	422898387	/nfs/dbraw/zinc/89/83/87/422898387.db2.gz	JOCSLDDNIASWFP-UHFFFAOYSA-N	1	1	308.382	1.859	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1ncc([N+](=O)[O-])cc1C(N)=O)CC2	ZINC000374983582	418584189	/nfs/dbraw/zinc/58/41/89/418584189.db2.gz	CXLGBAYVCOOHRM-UHFFFAOYSA-N	1	1	319.365	1.153	20	5		DDBDMO
C[C@H]1COCC[N@@H+]1CCNc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000352645460	418645362	/nfs/dbraw/zinc/64/53/62/418645362.db2.gz	MDYRVWWCZQEJRK-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@H]1COCC[N@H+]1CCNc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000352645460	418645364	/nfs/dbraw/zinc/64/53/64/418645364.db2.gz	MDYRVWWCZQEJRK-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
COc1ccc(CNc2cc[nH+]c(N(C)C)n2)cc1[N+](=O)[O-]	ZINC000354295617	418646916	/nfs/dbraw/zinc/64/69/16/418646916.db2.gz	JFWLLXDZNYBCET-UHFFFAOYSA-N	1	1	303.322	2.072	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000342123969	418627063	/nfs/dbraw/zinc/62/70/63/418627063.db2.gz	HZXIFXWWJRHSKX-UHFFFAOYSA-N	1	1	324.381	2.229	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000361552659	418675771	/nfs/dbraw/zinc/67/57/71/418675771.db2.gz	LVBZEPSLWICOKO-OAHLLOKOSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000361552659	418675772	/nfs/dbraw/zinc/67/57/72/418675772.db2.gz	LVBZEPSLWICOKO-OAHLLOKOSA-N	1	1	320.349	1.039	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000368066178	418683651	/nfs/dbraw/zinc/68/36/51/418683651.db2.gz	WHBGBACSAMRRDC-OAHLLOKOSA-N	1	1	309.366	1.097	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000361630096	418693517	/nfs/dbraw/zinc/69/35/17/418693517.db2.gz	SILWVMMRZGCPMN-RYUDHWBXSA-N	1	1	319.361	1.960	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000408092749	418787292	/nfs/dbraw/zinc/78/72/92/418787292.db2.gz	ZRAIIPQQDYTWGJ-NXEZZACHSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000408092749	418787294	/nfs/dbraw/zinc/78/72/94/418787294.db2.gz	ZRAIIPQQDYTWGJ-NXEZZACHSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000408092749	418787296	/nfs/dbraw/zinc/78/72/96/418787296.db2.gz	ZRAIIPQQDYTWGJ-NXEZZACHSA-N	1	1	309.370	1.606	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365838409	418914047	/nfs/dbraw/zinc/91/40/47/418914047.db2.gz	NVNCRWPYYQOHNM-INIZCTEOSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365838409	418914049	/nfs/dbraw/zinc/91/40/49/418914049.db2.gz	NVNCRWPYYQOHNM-INIZCTEOSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000420952401	419380933	/nfs/dbraw/zinc/38/09/33/419380933.db2.gz	XWDXCUIEEUJJLA-RYUDHWBXSA-N	1	1	322.361	1.912	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000412079913	419635399	/nfs/dbraw/zinc/63/53/99/419635399.db2.gz	LKJRHFUZRYJXID-MFKMUULPSA-N	1	1	307.350	1.287	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000434419297	229294233	/nfs/dbraw/zinc/29/42/33/229294233.db2.gz	KIHBQOVTGCKKCK-NSHDSACASA-N	1	1	319.365	1.319	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CN	ZINC000420290192	420184909	/nfs/dbraw/zinc/18/49/09/420184909.db2.gz	LMSPBEDFMLCXRQ-DOMZBBRYSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CN	ZINC000420290192	420184912	/nfs/dbraw/zinc/18/49/12/420184912.db2.gz	LMSPBEDFMLCXRQ-DOMZBBRYSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000430940276	420214239	/nfs/dbraw/zinc/21/42/39/420214239.db2.gz	OEYZVWSEALHJLF-ZDUSSCGKSA-N	1	1	320.393	1.773	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000416304217	420321174	/nfs/dbraw/zinc/32/11/74/420321174.db2.gz	YRTXKVJVWFEWJT-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000416304217	420321177	/nfs/dbraw/zinc/32/11/77/420321177.db2.gz	YRTXKVJVWFEWJT-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1C1CCN(c2sccc2[N+](=O)[O-])CC1	ZINC000302042547	230057957	/nfs/dbraw/zinc/05/79/57/230057957.db2.gz	WXOOLKDFBFPMRG-NSHDSACASA-N	1	1	324.406	1.575	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000450779375	420529241	/nfs/dbraw/zinc/52/92/41/420529241.db2.gz	NIOATPXYNUQDDN-CMPLNLGQSA-N	1	1	320.349	1.307	20	5		DDBDMO
CC(=O)c1cc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000450788959	420531337	/nfs/dbraw/zinc/53/13/37/420531337.db2.gz	FHDYXIWGQGWLMZ-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000450788959	420531343	/nfs/dbraw/zinc/53/13/43/420531343.db2.gz	FHDYXIWGQGWLMZ-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CCCC[N@@H+]1CCO	ZINC000450619984	420499792	/nfs/dbraw/zinc/49/97/92/420499792.db2.gz	UVUQPTZGNXVGQS-LLVKDONJSA-N	1	1	314.773	1.902	20	5		DDBDMO
O=C1CC[C@H](C[N@@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)CCN1	ZINC000451048466	420587956	/nfs/dbraw/zinc/58/79/56/420587956.db2.gz	KAMLRUBOUZGQKL-LBPRGKRZSA-N	1	1	319.361	1.706	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000443434349	420752327	/nfs/dbraw/zinc/75/23/27/420752327.db2.gz	HSXQHRLMSDOOFJ-SNVBAGLBSA-N	1	1	303.322	1.785	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456007491	421087991	/nfs/dbraw/zinc/08/79/91/421087991.db2.gz	DFDXNKVKXWDYFQ-ZJUUUORDSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456007491	421087994	/nfs/dbraw/zinc/08/79/94/421087994.db2.gz	DFDXNKVKXWDYFQ-ZJUUUORDSA-N	1	1	307.354	1.196	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000488717123	421108169	/nfs/dbraw/zinc/10/81/69/421108169.db2.gz	KGBTXMSTHOJIKE-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000456371964	421152784	/nfs/dbraw/zinc/15/27/84/421152784.db2.gz	GYQSSCGUSBTQHN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000456371964	421152786	/nfs/dbraw/zinc/15/27/86/421152786.db2.gz	GYQSSCGUSBTQHN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000456371964	421152790	/nfs/dbraw/zinc/15/27/90/421152790.db2.gz	GYQSSCGUSBTQHN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000456371964	421152793	/nfs/dbraw/zinc/15/27/93/421152793.db2.gz	GYQSSCGUSBTQHN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CNc1nc(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000515130796	421480102	/nfs/dbraw/zinc/48/01/02/421480102.db2.gz	MLQQIIPQAFRTSB-LLVKDONJSA-N	1	1	321.381	1.492	20	5		DDBDMO
C[C@@H](CNC(=O)c1c[nH]nc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000554856890	421664334	/nfs/dbraw/zinc/66/43/34/421664334.db2.gz	DFJDJLAHFOSSTR-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000518878253	421670695	/nfs/dbraw/zinc/67/06/95/421670695.db2.gz	ITSNTNQEORYLLY-NSHDSACASA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1	ZINC000540116242	421760939	/nfs/dbraw/zinc/76/09/39/421760939.db2.gz	MFONVURWBCCDIR-UHFFFAOYSA-N	1	1	323.397	1.521	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000540932522	421777558	/nfs/dbraw/zinc/77/75/58/421777558.db2.gz	CPYOISRWWXLIBB-NSHDSACASA-N	1	1	307.350	1.761	20	5		DDBDMO
CC(C)Oc1nc(N2CC[NH+](CCCO)CC2)ccc1[N+](=O)[O-]	ZINC000581558559	422002721	/nfs/dbraw/zinc/00/27/21/422002721.db2.gz	URSGGXLQVLQPTA-UHFFFAOYSA-N	1	1	324.381	1.281	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC000299236948	271009032	/nfs/dbraw/zinc/00/90/32/271009032.db2.gz	OFNKKUDHVNAWBS-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1	ZINC000341682534	271167435	/nfs/dbraw/zinc/16/74/35/271167435.db2.gz	CRDNIDLTWVSBOY-ZIAGYGMSSA-N	1	1	321.377	1.505	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000344414495	272019356	/nfs/dbraw/zinc/01/93/56/272019356.db2.gz	AVDLWQIOGHIUDB-ZWNOBZJWSA-N	1	1	320.349	1.132	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000345971490	272379837	/nfs/dbraw/zinc/37/98/37/272379837.db2.gz	VEPSMEUYDGFAGB-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
COc1cccc2c1CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000193707599	274151320	/nfs/dbraw/zinc/15/13/20/274151320.db2.gz	MVOPIBYAADTHTQ-UHFFFAOYSA-N	1	1	316.361	1.901	20	5		DDBDMO
C[C@@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000487740063	274360750	/nfs/dbraw/zinc/36/07/50/274360750.db2.gz	OISMXIVUYPDMPC-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000420606983	277084459	/nfs/dbraw/zinc/08/44/59/277084459.db2.gz	ZBXYWDQTLAGUIX-WCQYABFASA-N	1	1	318.377	1.614	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CCC[N@H+](C)CC2)c1	ZINC000298473597	281015306	/nfs/dbraw/zinc/01/53/06/281015306.db2.gz	UCOUIHQWFVCCDQ-UHFFFAOYSA-N	1	1	321.377	1.836	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000450832980	288285638	/nfs/dbraw/zinc/28/56/38/288285638.db2.gz	SGTVFKXGQMRYSA-JTQLQIEISA-N	1	1	307.354	1.009	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@@H]2CCCN2c2c([N+](=O)[O-])ncn2C)C[C@@H](C)O1	ZINC000408361177	297020224	/nfs/dbraw/zinc/02/02/24/297020224.db2.gz	CWTZINGHSUPRHL-UPJWGTAASA-N	1	1	323.397	1.406	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000362444038	300064471	/nfs/dbraw/zinc/06/44/71/300064471.db2.gz	BRXQEAZRXZLQIJ-BXUZGUMPSA-N	1	1	306.366	1.321	20	5		DDBDMO
O=C([C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1)N1CCCC1	ZINC000363106477	300212132	/nfs/dbraw/zinc/21/21/32/300212132.db2.gz	NJWMRNWIMRIZLJ-ZDUSSCGKSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=C([C@@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1)N1CCCC1	ZINC000363106477	300212135	/nfs/dbraw/zinc/21/21/35/300212135.db2.gz	NJWMRNWIMRIZLJ-ZDUSSCGKSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@]3(CCCCO3)C2)c1	ZINC000370095053	301274841	/nfs/dbraw/zinc/27/48/41/301274841.db2.gz	RDARFGGVVWUZON-CABCVRRESA-N	1	1	324.381	1.187	20	5		DDBDMO
O=C1OC[C@@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000370560203	301365093	/nfs/dbraw/zinc/36/50/93/301365093.db2.gz	XNWHNZSZXCLTSI-ZDUSSCGKSA-N	1	1	321.333	1.500	20	5		DDBDMO
O=C1OC[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000370560203	301365095	/nfs/dbraw/zinc/36/50/95/301365095.db2.gz	XNWHNZSZXCLTSI-ZDUSSCGKSA-N	1	1	321.333	1.500	20	5		DDBDMO
Cc1cn2c([nH+]1)CC[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000373676325	301714466	/nfs/dbraw/zinc/71/44/66/301714466.db2.gz	VSFOHHZQMKZGFL-NSHDSACASA-N	1	1	315.333	1.626	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@](O)(C2CC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000377260448	302160707	/nfs/dbraw/zinc/16/07/07/302160707.db2.gz	DUQRMUCZLJJDHM-MRXNPFEDSA-N	1	1	319.361	1.404	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC3(CCC3)[C@H]2[C@@H]2CCCO2)n1	ZINC000377791129	302233979	/nfs/dbraw/zinc/23/39/79/302233979.db2.gz	ZDLPFZIAUNBWFZ-GXTWGEPZSA-N	1	1	306.366	1.825	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCC[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000378015723	302263927	/nfs/dbraw/zinc/26/39/27/302263927.db2.gz	ZZMDDGDRRDBWTA-CYBMUJFWSA-N	1	1	321.377	1.652	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000378310168	302310509	/nfs/dbraw/zinc/31/05/09/302310509.db2.gz	UHKFMKLURDJEOO-NEPJUHHUSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@@H+]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000378310168	302310513	/nfs/dbraw/zinc/31/05/13/302310513.db2.gz	UHKFMKLURDJEOO-NEPJUHHUSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000378310168	302310517	/nfs/dbraw/zinc/31/05/17/302310517.db2.gz	UHKFMKLURDJEOO-NEPJUHHUSA-N	1	1	315.333	1.146	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000378546580	302333614	/nfs/dbraw/zinc/33/36/14/302333614.db2.gz	WQCBQZTZKHDLHZ-MNOVXSKESA-N	1	1	304.350	1.534	20	5		DDBDMO
Cc1nc(C2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)n[nH]1	ZINC000364013659	307039997	/nfs/dbraw/zinc/03/99/97/307039997.db2.gz	GXRMFDCSRDQPER-UHFFFAOYSA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1nnc(C2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)[nH]1	ZINC000364013659	307039998	/nfs/dbraw/zinc/03/99/98/307039998.db2.gz	GXRMFDCSRDQPER-UHFFFAOYSA-N	1	1	305.342	1.097	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](CCOCC(F)F)C2)c1	ZINC000365295490	307064108	/nfs/dbraw/zinc/06/41/08/307064108.db2.gz	XSYRZXASBSABMF-JTQLQIEISA-N	1	1	304.297	1.710	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000367420220	307092840	/nfs/dbraw/zinc/09/28/40/307092840.db2.gz	PHADLZGAGYZYRF-UHFFFAOYSA-N	1	1	308.382	1.726	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000371808709	307158187	/nfs/dbraw/zinc/15/81/87/307158187.db2.gz	KEESLKMIGGUNTL-CQSZACIVSA-N	1	1	307.350	1.262	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000371808709	307158188	/nfs/dbraw/zinc/15/81/88/307158188.db2.gz	KEESLKMIGGUNTL-CQSZACIVSA-N	1	1	307.350	1.262	20	5		DDBDMO
CCc1[nH+]ccn1C[C@@H]1CCCN1c1ncc([N+](=O)[O-])cn1	ZINC000373393260	307187214	/nfs/dbraw/zinc/18/72/14/307187214.db2.gz	OLYFTETWVXAADH-NSHDSACASA-N	1	1	302.338	1.813	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377647620	307275587	/nfs/dbraw/zinc/27/55/87/307275587.db2.gz	FSEYZLZFOIDPIT-CMPLNLGQSA-N	1	1	320.305	1.071	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@@H]12	ZINC000377647620	307275588	/nfs/dbraw/zinc/27/55/88/307275588.db2.gz	FSEYZLZFOIDPIT-CMPLNLGQSA-N	1	1	320.305	1.071	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCO[C@@H]2CC[N@@H+](C)C[C@H]21	ZINC000584649409	337380497	/nfs/dbraw/zinc/38/04/97/337380497.db2.gz	INEGSBQGXVAGSR-VXGBXAGGSA-N	1	1	309.370	1.029	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000488728636	484215638	/nfs/dbraw/zinc/21/56/38/484215638.db2.gz	FLAAXYDCEIKKJP-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000451308206	533979009	/nfs/dbraw/zinc/97/90/09/533979009.db2.gz	AFGFPSSGHFQTRT-GXTWGEPZSA-N	1	1	312.391	1.772	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1CCO	ZINC000452393408	534333590	/nfs/dbraw/zinc/33/35/90/534333590.db2.gz	SNAWSYIILAMRKX-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCN3CCOCC3)CC2)c1	ZINC000332522017	534886104	/nfs/dbraw/zinc/88/61/04/534886104.db2.gz	CNWFDFILEBSBSJ-UHFFFAOYSA-N	1	1	320.393	1.049	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@](CO)(COC)C2)ccc1[N+](=O)[O-]	ZINC000451940466	528265005	/nfs/dbraw/zinc/26/50/05/528265005.db2.gz	YHGSAABZGIAQAQ-MRXNPFEDSA-N	1	1	324.377	1.824	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000331744404	528549749	/nfs/dbraw/zinc/54/97/49/528549749.db2.gz	YFZFDLCICWNKPK-JQWIXIFHSA-N	1	1	321.381	1.627	20	5		DDBDMO
CC[N@@H+]1C[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000821241149	606731220	/nfs/dbraw/zinc/73/12/20/606731220.db2.gz	KGNQDKJJBORQJO-CABZTGNLSA-N	1	1	317.353	1.527	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000176091942	697401143	/nfs/dbraw/zinc/40/11/43/697401143.db2.gz	KKWQBNUWVVAQGP-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000178776420	697428801	/nfs/dbraw/zinc/42/88/01/697428801.db2.gz	FIHTXOUJZPHTFF-GFCCVEGCSA-N	1	1	318.333	1.930	20	5		DDBDMO
CC[N@H+](Cc1cnn(C)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776273990	698090980	/nfs/dbraw/zinc/09/09/80/698090980.db2.gz	AXGSRGHDSOMRKZ-HNNXBMFYSA-N	1	1	304.350	1.884	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776590911	698123750	/nfs/dbraw/zinc/12/37/50/698123750.db2.gz	MFRSJDQBNAWYMN-KGLIPLIRSA-N	1	1	308.334	1.656	20	5		DDBDMO
[NH3+]CCC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000262029355	698451058	/nfs/dbraw/zinc/45/10/58/698451058.db2.gz	NWCIBXVFWBSOLY-HNNXBMFYSA-N	1	1	320.393	1.414	20	5		DDBDMO
[NH3+]CCC(=O)NC[C@@H]1CCCCN1Cc1ccc([N+](=O)[O-])cc1	ZINC000262029355	698451062	/nfs/dbraw/zinc/45/10/62/698451062.db2.gz	NWCIBXVFWBSOLY-HNNXBMFYSA-N	1	1	320.393	1.414	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000780864927	698564621	/nfs/dbraw/zinc/56/46/21/698564621.db2.gz	HCWFWBSYDGOKMP-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000741720106	699848987	/nfs/dbraw/zinc/84/89/87/699848987.db2.gz	DZIJVNBNCURBSR-ONGXEEELSA-N	1	1	322.321	1.716	20	5		DDBDMO
C[C@H]1CCC[N@@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000751926662	700326768	/nfs/dbraw/zinc/32/67/68/700326768.db2.gz	VGCWYKZGVPBFGK-NSHDSACASA-N	1	1	318.333	1.805	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000751926662	700326772	/nfs/dbraw/zinc/32/67/72/700326772.db2.gz	VGCWYKZGVPBFGK-NSHDSACASA-N	1	1	318.333	1.805	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801886759	700350506	/nfs/dbraw/zinc/35/05/06/700350506.db2.gz	FMOWRJFEIVLXAY-VIFPVBQESA-N	1	1	310.329	1.388	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000761066241	700837873	/nfs/dbraw/zinc/83/78/73/700837873.db2.gz	BFAHBINMVXCTCI-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000761066241	700837875	/nfs/dbraw/zinc/83/78/75/700837875.db2.gz	BFAHBINMVXCTCI-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000761066241	700837876	/nfs/dbraw/zinc/83/78/76/700837876.db2.gz	BFAHBINMVXCTCI-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@@H+]1C	ZINC000761075717	700839925	/nfs/dbraw/zinc/83/99/25/700839925.db2.gz	LHYAAAOGCITWNF-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@H]1CN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[N@H+]1C	ZINC000761075717	700839928	/nfs/dbraw/zinc/83/99/28/700839928.db2.gz	LHYAAAOGCITWNF-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000761076781	700840453	/nfs/dbraw/zinc/84/04/53/700840453.db2.gz	JQYYWKMFXYAWME-GFCCVEGCSA-N	1	1	318.377	1.120	20	5		DDBDMO
C[C@@H]1C[C@H](N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000766028173	701034770	/nfs/dbraw/zinc/03/47/70/701034770.db2.gz	UXWOMRDUAOLYJZ-UIBBOPPKSA-N	1	1	323.393	1.061	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000766028173	701034771	/nfs/dbraw/zinc/03/47/71/701034771.db2.gz	UXWOMRDUAOLYJZ-UIBBOPPKSA-N	1	1	323.393	1.061	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C[C@@]1(C)C(=O)NC2=O	ZINC000879158114	706602001	/nfs/dbraw/zinc/60/20/01/706602001.db2.gz	NQTQHNGEDUAWLS-GASCZTMLSA-N	1	1	321.308	1.219	20	5		DDBDMO
CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccsc1	ZINC000839526349	701725407	/nfs/dbraw/zinc/72/54/07/701725407.db2.gz	DYODSCVJVDHVKK-UPJWGTAASA-N	1	1	311.407	1.912	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000810841891	701859644	/nfs/dbraw/zinc/85/96/44/701859644.db2.gz	RCVGLIZQNKHORD-WDEREUQCSA-N	1	1	308.338	1.595	20	5		DDBDMO
CCOC(C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)OCC	ZINC000879271951	706636647	/nfs/dbraw/zinc/63/66/47/706636647.db2.gz	JOUQEZPFFDLPIM-HNNXBMFYSA-N	1	1	312.366	1.791	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCC[C@@H](CO)[C@H]2CO)c1	ZINC000879362118	706661527	/nfs/dbraw/zinc/66/15/27/706661527.db2.gz	BAKZZEYFVWYWQF-IINYFYTJSA-N	1	1	314.769	1.813	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](CO)[C@H]2CO)c1	ZINC000879362118	706661531	/nfs/dbraw/zinc/66/15/31/706661531.db2.gz	BAKZZEYFVWYWQF-IINYFYTJSA-N	1	1	314.769	1.813	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1(CN)CCC1	ZINC000843389332	702872018	/nfs/dbraw/zinc/87/20/18/702872018.db2.gz	OYRYJHKDIGIHHN-UHFFFAOYSA-N	1	1	324.356	1.876	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1(CN)CCC1	ZINC000843389332	702872021	/nfs/dbraw/zinc/87/20/21/702872021.db2.gz	OYRYJHKDIGIHHN-UHFFFAOYSA-N	1	1	324.356	1.876	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000879534847	706711499	/nfs/dbraw/zinc/71/14/99/706711499.db2.gz	YXNWXTUQXWJGDI-LEWSCRJBSA-N	1	1	317.345	1.511	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](O)C2(C)C)c1	ZINC000844334207	703016614	/nfs/dbraw/zinc/01/66/14/703016614.db2.gz	VHKHQAVCPNLAGO-ZDUSSCGKSA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](O)C2(C)C)c1	ZINC000844334207	703016617	/nfs/dbraw/zinc/01/66/17/703016617.db2.gz	VHKHQAVCPNLAGO-ZDUSSCGKSA-N	1	1	308.334	1.727	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000846292537	703262694	/nfs/dbraw/zinc/26/26/94/703262694.db2.gz	WIZCHAUDIGIBAS-HNNXBMFYSA-N	1	1	323.393	1.722	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000847486665	703425631	/nfs/dbraw/zinc/42/56/31/703425631.db2.gz	CPBXLFKQXPMKQG-UHFFFAOYSA-N	1	1	318.337	1.322	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000848790413	703589723	/nfs/dbraw/zinc/58/97/23/703589723.db2.gz	MOKNJOJQUUNCBP-NSHDSACASA-N	1	1	322.365	1.992	20	5		DDBDMO
CC1(C)OC[C@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)O1	ZINC000851715513	703835787	/nfs/dbraw/zinc/83/57/87/703835787.db2.gz	WXXSQVUWFMOXIT-HNNXBMFYSA-N	1	1	321.377	1.868	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1F	ZINC000852313303	704007621	/nfs/dbraw/zinc/00/76/21/704007621.db2.gz	GFOQTVRTBYHCGZ-GFCCVEGCSA-N	1	1	305.313	1.848	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000818963296	704036129	/nfs/dbraw/zinc/03/61/29/704036129.db2.gz	NTSXJOWQFLYJAS-SQWLQELKSA-N	1	1	305.378	1.845	20	5		DDBDMO
CC[N@@H+]1CCCC[C@H]1C(=O)OC1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000870828430	704137764	/nfs/dbraw/zinc/13/77/64/704137764.db2.gz	QRQPRUWLHZBPDX-UBHUBRDASA-N	1	1	322.365	1.912	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1C(=O)OC1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000870828430	704137766	/nfs/dbraw/zinc/13/77/66/704137766.db2.gz	QRQPRUWLHZBPDX-UBHUBRDASA-N	1	1	322.365	1.912	20	5		DDBDMO
CO[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000870927748	704171875	/nfs/dbraw/zinc/17/18/75/704171875.db2.gz	FHAFOIOVYGIODF-XFJVYGCCSA-N	1	1	321.377	1.652	20	5		DDBDMO
CCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1	ZINC000855489991	704487515	/nfs/dbraw/zinc/48/75/15/704487515.db2.gz	FGRNCESYXZIEMV-LBPRGKRZSA-N	1	1	306.366	1.733	20	5		DDBDMO
Nc1ccc(NC(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000823955967	705344813	/nfs/dbraw/zinc/34/48/13/705344813.db2.gz	LXWCNTHDMPTZRW-UHFFFAOYSA-N	1	1	323.353	1.021	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000823993248	705350954	/nfs/dbraw/zinc/35/09/54/705350954.db2.gz	BQFYITKEEGOAGK-JTQLQIEISA-N	1	1	307.354	1.640	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000861342993	705435208	/nfs/dbraw/zinc/43/52/08/705435208.db2.gz	FZEDVKNEXREHRF-FZMZJTMJSA-N	1	1	311.338	1.199	20	5		DDBDMO
COc1cc(C(=O)OCC[NH+]2CCC2)c([N+](=O)[O-])cc1OC	ZINC000861384173	705451632	/nfs/dbraw/zinc/45/16/32/705451632.db2.gz	GVIPUJRQRMGJRB-UHFFFAOYSA-N	1	1	310.306	1.475	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000825087974	705597679	/nfs/dbraw/zinc/59/76/79/705597679.db2.gz	GSDKYRMDNGCOMI-LBPRGKRZSA-N	1	1	307.350	1.008	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827278613	705967057	/nfs/dbraw/zinc/96/70/57/705967057.db2.gz	XLANGEAKKQFEIA-WCQYABFASA-N	1	1	318.377	1.803	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827375176	705989373	/nfs/dbraw/zinc/98/93/73/705989373.db2.gz	TYKVNXYNKGPWBD-STQMWFEESA-N	1	1	319.361	1.770	20	5		DDBDMO
Cn1cc(CN2CCCC3(CC[NH+](C)CC3)C2)c([N+](=O)[O-])n1	ZINC000877495972	706123594	/nfs/dbraw/zinc/12/35/94/706123594.db2.gz	JGQAWNFIPKBXAE-UHFFFAOYSA-N	1	1	307.398	1.636	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@](O)(c3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000877653513	706171178	/nfs/dbraw/zinc/17/11/78/706171178.db2.gz	LNAZGLBVRFOZPA-INIZCTEOSA-N	1	1	316.361	1.812	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136795	706887527	/nfs/dbraw/zinc/88/75/27/706887527.db2.gz	SGDINAJZXIAXOI-BZUAXINKSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136795	706887529	/nfs/dbraw/zinc/88/75/29/706887529.db2.gz	SGDINAJZXIAXOI-BZUAXINKSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136795	706887530	/nfs/dbraw/zinc/88/75/30/706887530.db2.gz	SGDINAJZXIAXOI-BZUAXINKSA-N	1	1	305.378	1.797	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000880148201	706892647	/nfs/dbraw/zinc/89/26/47/706892647.db2.gz	SYCXPVRGVVWPLU-OLZOCXBDSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C[C@@H]2C1	ZINC000880314069	706938248	/nfs/dbraw/zinc/93/82/48/706938248.db2.gz	VEFZMIAQGJZTPB-BETUJISGSA-N	1	1	307.325	1.644	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2C[C@@]2(O)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000880419754	706968289	/nfs/dbraw/zinc/96/82/89/706968289.db2.gz	PPJAXSIWPNHPSJ-YMTOWFKASA-N	1	1	309.297	1.129	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000833458977	707008779	/nfs/dbraw/zinc/00/87/79/707008779.db2.gz	RIGODNAOMYOISR-HOCLYGCPSA-N	1	1	319.361	1.182	20	5		DDBDMO
CC(C)(O)C[C@@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000871966741	707258287	/nfs/dbraw/zinc/25/82/87/707258287.db2.gz	WPXDNHMIZGKBKU-CYBMUJFWSA-N	1	1	323.393	1.239	20	5		DDBDMO
Cc1c(C[NH2+]C[C@@H](C)N2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873044703	707706565	/nfs/dbraw/zinc/70/65/65/707706565.db2.gz	VTSAIGHNRXIOEI-CYBMUJFWSA-N	1	1	306.410	1.629	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000882766583	707783717	/nfs/dbraw/zinc/78/37/17/707783717.db2.gz	LIVGHCPKKWCRKY-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000882766583	707783723	/nfs/dbraw/zinc/78/37/23/707783723.db2.gz	LIVGHCPKKWCRKY-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CN1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000897094864	708228476	/nfs/dbraw/zinc/22/84/76/708228476.db2.gz	OAITYVHXEIWHKG-UHFFFAOYSA-N	1	1	323.353	1.187	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC000884825334	708388470	/nfs/dbraw/zinc/38/84/70/708388470.db2.gz	QKXDKYAEXWBEOZ-UHFFFAOYSA-N	1	1	308.260	1.345	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886207575	708714771	/nfs/dbraw/zinc/71/47/71/708714771.db2.gz	GNZGGQIPUCGZPH-CYBMUJFWSA-N	1	1	306.366	1.728	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@@H]([C@H]2CCCCN2Cc2cccnc2[N+](=O)[O-])C1	ZINC000886841649	708859437	/nfs/dbraw/zinc/85/94/37/708859437.db2.gz	RLAJDBNPGDCLFN-RBSFLKMASA-N	1	1	320.393	1.851	20	5		DDBDMO
COc1cc2c(cc1O)CC[N@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000887105220	708956542	/nfs/dbraw/zinc/95/65/42/708956542.db2.gz	MBAIWUXXXMBJIC-UHFFFAOYSA-N	1	1	318.333	1.564	20	5		DDBDMO
COc1cc2c(cc1O)CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000887105220	708956545	/nfs/dbraw/zinc/95/65/45/708956545.db2.gz	MBAIWUXXXMBJIC-UHFFFAOYSA-N	1	1	318.333	1.564	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC[C@H]2[C@H](C)C[NH+](C)C)c1[N+](=O)[O-]	ZINC000912811835	713098393	/nfs/dbraw/zinc/09/83/93/713098393.db2.gz	ORXQGARZATYAPZ-PWSUYJOCSA-N	1	1	323.397	1.819	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000910284316	709864997	/nfs/dbraw/zinc/86/49/97/709864997.db2.gz	NIMKYRAVKUSFPO-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000910284316	709865002	/nfs/dbraw/zinc/86/50/02/709865002.db2.gz	NIMKYRAVKUSFPO-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000910284316	709865008	/nfs/dbraw/zinc/86/50/08/709865008.db2.gz	NIMKYRAVKUSFPO-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
O=[N+]([O-])c1c2nonc2ccc1NCC[NH+]1CCSCC1	ZINC000892490350	710446283	/nfs/dbraw/zinc/44/62/83/710446283.db2.gz	ROEBGKDHIUWMID-UHFFFAOYSA-N	1	1	309.351	1.592	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452034	713203223	/nfs/dbraw/zinc/20/32/23/713203223.db2.gz	MNJPKXBZVBTAQL-DOMZBBRYSA-N	1	1	320.393	1.996	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000893668090	710769662	/nfs/dbraw/zinc/76/96/62/710769662.db2.gz	CXBDJEYSERJQBN-GHMZBOCLSA-N	1	1	309.366	1.833	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F	ZINC000928556739	713225535	/nfs/dbraw/zinc/22/55/35/713225535.db2.gz	CAOHQTIJYVROGC-NSHDSACASA-N	1	1	309.341	1.832	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1F	ZINC000928556739	713225537	/nfs/dbraw/zinc/22/55/37/713225537.db2.gz	CAOHQTIJYVROGC-NSHDSACASA-N	1	1	309.341	1.832	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H]([NH+]3CCC3)C2)cc1	ZINC000903214997	711068966	/nfs/dbraw/zinc/06/89/66/711068966.db2.gz	DBESIQNIKFCWBM-GFCCVEGCSA-N	1	1	311.363	1.064	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CC[N@@H+]2C)c1	ZINC000928569236	713232240	/nfs/dbraw/zinc/23/22/40/713232240.db2.gz	LSBCDFVBIXYUSO-GFCCVEGCSA-N	1	1	307.350	1.492	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)C[C@H]1CO	ZINC000894890915	711310904	/nfs/dbraw/zinc/31/09/04/711310904.db2.gz	WGCWYDAJMVJBKB-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CN(C)CC[N@H+]1C	ZINC000895246833	711464805	/nfs/dbraw/zinc/46/48/05/711464805.db2.gz	QNLVKDDNNJISRN-QMTHXVAHSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[N@H+](C)CCN1C	ZINC000895246833	711464816	/nfs/dbraw/zinc/46/48/16/711464816.db2.gz	QNLVKDDNNJISRN-QMTHXVAHSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[N@@H+](C)CCN1C	ZINC000895246833	711464817	/nfs/dbraw/zinc/46/48/17/711464817.db2.gz	QNLVKDDNNJISRN-QMTHXVAHSA-N	1	1	318.381	1.517	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1	ZINC000895703735	711582583	/nfs/dbraw/zinc/58/25/83/711582583.db2.gz	ONLYQPWFAWEBAX-LJEUOOAZSA-N	1	1	320.345	1.608	20	5		DDBDMO
C[C@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1C[NH3+]	ZINC000904410716	711854446	/nfs/dbraw/zinc/85/44/46/711854446.db2.gz	FYBCPMLRQTXRGB-NWDGAFQWSA-N	1	1	321.377	1.783	20	5		DDBDMO
CC1(C)CC[N@H+](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000905680496	712116297	/nfs/dbraw/zinc/11/62/97/712116297.db2.gz	XATSKXFJMVAODL-HNNXBMFYSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000905680496	712116299	/nfs/dbraw/zinc/11/62/99/712116299.db2.gz	XATSKXFJMVAODL-HNNXBMFYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000913930632	713321462	/nfs/dbraw/zinc/32/14/62/713321462.db2.gz	KEDWXUQPKIHLSM-FZMZJTMJSA-N	1	1	321.381	1.399	20	5		DDBDMO
CCOCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000929171994	713561088	/nfs/dbraw/zinc/56/10/88/713561088.db2.gz	SVLFARQSRBWNJW-UHFFFAOYSA-N	1	1	324.381	1.165	20	5		DDBDMO
O=[N+]([O-])CCN1CC[NH+](CCOc2ccc(Cl)cc2)CC1	ZINC000929223568	713570191	/nfs/dbraw/zinc/57/01/91/713570191.db2.gz	YAOZQOFROFPDIO-UHFFFAOYSA-N	1	1	313.785	1.613	20	5		DDBDMO
O=C(Nc1ccc(Cl)cn1)[C@H]1CCC[N@H+](CC[N+](=O)[O-])C1	ZINC000929887083	713713364	/nfs/dbraw/zinc/71/33/64/713713364.db2.gz	JPVSZFVDWYBHOW-JTQLQIEISA-N	1	1	312.757	1.662	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1CCC3(COC3)O1)C2	ZINC000930100059	713755966	/nfs/dbraw/zinc/75/59/66/713755966.db2.gz	QDKGLUFLPGOQJR-ZDUSSCGKSA-N	1	1	304.346	1.901	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1CCC3(COC3)O1)C2	ZINC000930100059	713755967	/nfs/dbraw/zinc/75/59/67/713755967.db2.gz	QDKGLUFLPGOQJR-ZDUSSCGKSA-N	1	1	304.346	1.901	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000931639125	714146557	/nfs/dbraw/zinc/14/65/57/714146557.db2.gz	HRXSNKGRYHOMBD-BXUZGUMPSA-N	1	1	310.350	1.712	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000932346794	714315377	/nfs/dbraw/zinc/31/53/77/714315377.db2.gz	KUWZHCYPKDBHCG-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@H]1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923369576	714330531	/nfs/dbraw/zinc/33/05/31/714330531.db2.gz	KZNCDGMDVNUSMO-SWLSCSKDSA-N	1	1	323.393	1.312	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000932646851	714374768	/nfs/dbraw/zinc/37/47/68/714374768.db2.gz	UTYMGRMWIGRXTA-OCCSQVGLSA-N	1	1	308.334	1.513	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000932646855	714374979	/nfs/dbraw/zinc/37/49/79/714374979.db2.gz	UTYMGRMWIGRXTA-TZMCWYRMSA-N	1	1	308.334	1.513	20	5		DDBDMO
Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)NCC[N@@H+](C)CCO	ZINC000925001486	714722505	/nfs/dbraw/zinc/72/25/05/714722505.db2.gz	OFXJTIMMBJSHDO-UHFFFAOYSA-N	1	1	315.757	1.211	20	5		DDBDMO
COc1cc(C[NH2+][C@@H]2COCC[C@H]2OC)c([N+](=O)[O-])cc1F	ZINC000934038530	714728736	/nfs/dbraw/zinc/72/87/36/714728736.db2.gz	BVSNRGDYXUROIF-DGCLKSJQSA-N	1	1	314.313	1.636	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000935169269	714994016	/nfs/dbraw/zinc/99/40/16/714994016.db2.gz	YWZQJRPKMBNCBK-WDEREUQCSA-N	1	1	309.370	1.041	20	5		DDBDMO
Cc1nc(C[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)co1	ZINC000940108146	716627712	/nfs/dbraw/zinc/62/77/12/716627712.db2.gz	WTPZNHLRPVYGPG-CHWSQXEVSA-N	1	1	322.365	1.119	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCCF)C[C@H]2CC1	ZINC000946589240	718844014	/nfs/dbraw/zinc/84/40/14/718844014.db2.gz	NLLIQXZNUVQWAH-XJFOESAGSA-N	1	1	313.373	1.182	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CCCF)C[C@H]2CC1	ZINC000946589240	718844015	/nfs/dbraw/zinc/84/40/15/718844015.db2.gz	NLLIQXZNUVQWAH-XJFOESAGSA-N	1	1	313.373	1.182	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCCF)C[C@H]2CC1	ZINC000946589240	718844018	/nfs/dbraw/zinc/84/40/18/718844018.db2.gz	NLLIQXZNUVQWAH-XJFOESAGSA-N	1	1	313.373	1.182	20	5		DDBDMO
C[C@@H](Nc1c2c(ccc1[N+](=O)[O-])NCC2)[C@H]1C[N@@H+](C)CCN1C	ZINC001120960721	782258528	/nfs/dbraw/zinc/25/85/28/782258528.db2.gz	WTKRFGWXGPFIAZ-IAQYHMDHSA-N	1	1	319.409	1.609	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCN(C)c1ncccc1[N+](=O)[O-]	ZINC001105459928	741849196	/nfs/dbraw/zinc/84/91/96/741849196.db2.gz	LWLPVKNVVOBPIQ-UHFFFAOYSA-N	1	1	323.397	1.226	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2Cc3c[nH+]cn3C2)c1[N+](=O)[O-]	ZINC001187198041	744515901	/nfs/dbraw/zinc/51/59/01/744515901.db2.gz	DBAOMCHFMOCAQQ-SECBINFHSA-N	1	1	317.305	1.318	20	5		DDBDMO
COc1cc(C)c([N+](=O)[O-])cc1NCCC[NH+]1CCN(C)CC1	ZINC001161708492	745307678	/nfs/dbraw/zinc/30/76/78/745307678.db2.gz	LZCYEFHOTIOJLD-UHFFFAOYSA-N	1	1	322.409	1.961	20	5		DDBDMO
O=C(NCC1C[NH+](CCCc2ccsc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031662560	747337597	/nfs/dbraw/zinc/33/75/97/747337597.db2.gz	HZDVUHOQGFGSOT-ZIAGYGMSSA-N	1	1	323.418	1.394	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1cc[nH]c1	ZINC001031690497	747383391	/nfs/dbraw/zinc/38/33/91/747383391.db2.gz	MEQFVHRNOJMRRC-UHFFFAOYSA-N	1	1	314.345	1.785	20	5		DDBDMO
Cc1ccc(C[NH2+][C@](C)(Cn2cccn2)C(N)=O)cc1[N+](=O)[O-]	ZINC001198575368	747531346	/nfs/dbraw/zinc/53/13/46/747531346.db2.gz	VGRWRFHLKCBOGD-OAHLLOKOSA-N	1	1	317.349	1.134	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CC2CCCC2)CC1	ZINC000997773602	751269815	/nfs/dbraw/zinc/26/98/15/751269815.db2.gz	WRZHSDNYSFYBEJ-HUUCEWRRSA-N	1	1	309.410	1.670	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000823785272	758362219	/nfs/dbraw/zinc/36/22/19/758362219.db2.gz	ZZQIEMZNCHWRON-WFASDCNBSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1ncsc1C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086082988	760943718	/nfs/dbraw/zinc/94/37/18/760943718.db2.gz	JXAWRZAUIWPMJK-WRWGMCAJSA-N	1	1	324.406	1.101	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](F)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC001170327851	766254131	/nfs/dbraw/zinc/25/41/31/766254131.db2.gz	IIKWAZPQSJXIMY-ZBINZKHDSA-N	1	1	312.341	1.939	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccccn2)CC1	ZINC001045436992	766305830	/nfs/dbraw/zinc/30/58/30/766305830.db2.gz	ZXGMERIHCVAUQM-ZIAGYGMSSA-N	1	1	318.377	1.218	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(CCNC2=O)C1	ZINC001173221012	777053088	/nfs/dbraw/zinc/05/30/88/777053088.db2.gz	FGARWIVFGRAKBR-MLGOLLRUSA-N	1	1	303.362	1.738	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H]([C@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243246	778092735	/nfs/dbraw/zinc/09/27/35/778092735.db2.gz	NJRVTAPAOYXVHT-YGRLFVJLSA-N	1	1	324.337	1.602	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H]([C@]3(C)COC(=O)N3)C2)c1[N+](=O)[O-]	ZINC001176243246	778092742	/nfs/dbraw/zinc/09/27/42/778092742.db2.gz	NJRVTAPAOYXVHT-YGRLFVJLSA-N	1	1	324.337	1.602	20	5		DDBDMO
C[C@](O)(C[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307070	781400423	/nfs/dbraw/zinc/40/04/23/781400423.db2.gz	ZOSCEALOKGQACL-SJORKVTESA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@](O)(C[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001119307070	781400426	/nfs/dbraw/zinc/40/04/26/781400426.db2.gz	ZOSCEALOKGQACL-SJORKVTESA-N	1	1	320.389	1.865	20	5		DDBDMO
O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccon1	ZINC001268515538	840356923	/nfs/dbraw/zinc/35/69/23/840356923.db2.gz	CCJCLTQRAMVKLJ-OWOJBTEDSA-N	1	1	322.346	1.720	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@H]3CCC[NH2+]C3)C2)nc1	ZINC001327863869	862525103	/nfs/dbraw/zinc/52/51/03/862525103.db2.gz	JVPRZNIRYYQNEO-QWHCGFSZSA-N	1	1	305.382	1.476	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001156828109	863372543	/nfs/dbraw/zinc/37/25/43/863372543.db2.gz	JTIAZRBHDDXRMB-CQSZACIVSA-N	1	1	320.393	1.853	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[NH+]2CCSCC2)c([N+](=O)[O-])c1	ZINC001157043163	863534412	/nfs/dbraw/zinc/53/44/12/863534412.db2.gz	DLXBRPQDHFWJPH-UHFFFAOYSA-N	1	1	313.339	1.359	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC001160160329	865703868	/nfs/dbraw/zinc/70/38/68/865703868.db2.gz	JELZJLSSINRPRG-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[NH+](C)[C@H]1CCCC[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC001320786414	867026437	/nfs/dbraw/zinc/02/64/37/867026437.db2.gz	ONEBDZLCOODHQS-KGLIPLIRSA-N	1	1	307.350	1.903	20	5		DDBDMO
CCc1ccccc1C[NH2+]C/C=C\CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001321053196	867269569	/nfs/dbraw/zinc/26/95/69/867269569.db2.gz	XGZKODWLSKNVED-ILNYKDOHSA-N	1	1	317.389	1.676	20	5		DDBDMO
C[N@@H+]1CCc2c(Nc3c[nH]c(=O)nc3N)ccc([N+](=O)[O-])c2C1	ZINC001162796634	867829917	/nfs/dbraw/zinc/82/99/17/867829917.db2.gz	MQVIRJZCDSIAPH-UHFFFAOYSA-N	1	1	316.321	1.404	20	5		DDBDMO
C[N@H+]1CCc2c(Nc3c[nH]c(=O)nc3N)ccc([N+](=O)[O-])c2C1	ZINC001162796634	867829933	/nfs/dbraw/zinc/82/99/33/867829933.db2.gz	MQVIRJZCDSIAPH-UHFFFAOYSA-N	1	1	316.321	1.404	20	5		DDBDMO
COc1cc(-c2nnc(C[NH+](C)C)o2)c([N+](=O)[O-])cc1OC	ZINC001322340255	868123230	/nfs/dbraw/zinc/12/32/30/868123230.db2.gz	QINFXXNFSOQPNF-UHFFFAOYSA-N	1	1	308.294	1.724	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C	ZINC001322508684	868212322	/nfs/dbraw/zinc/21/23/22/868212322.db2.gz	DSCBPRSDGRWPMN-ZUZCIYMTSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2c([N+](=O)[O-])cnn2C)CC1	ZINC001335532540	868366323	/nfs/dbraw/zinc/36/63/23/868366323.db2.gz	BRCXQDQUYFENLH-LLVKDONJSA-N	1	1	309.370	1.018	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc([N+](=O)[O-])cc1C(N)=O)C2	ZINC001226165627	882242427	/nfs/dbraw/zinc/24/24/27/882242427.db2.gz	MLHFNFXEIRIIJO-IAZYJMLFSA-N	1	1	305.334	1.698	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@@H]3CCC(=O)N3)ccc([N+](=O)[O-])c2C1	ZINC001164170824	868990267	/nfs/dbraw/zinc/99/02/67/868990267.db2.gz	IVFUVVBRAHNUFI-JTQLQIEISA-N	1	1	304.350	1.273	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@@H]3CCC(=O)N3)ccc([N+](=O)[O-])c2C1	ZINC001164170824	868990272	/nfs/dbraw/zinc/99/02/72/868990272.db2.gz	IVFUVVBRAHNUFI-JTQLQIEISA-N	1	1	304.350	1.273	20	5		DDBDMO
COc1cnc(NCC2(N(C)C)CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC001164211995	869019460	/nfs/dbraw/zinc/01/94/60/869019460.db2.gz	YKJACHYGJIMKSE-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CC(=O)c1c(N[C@H](C)[C@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085165	869791312	/nfs/dbraw/zinc/79/13/12/869791312.db2.gz	VLQABJDAHZELAA-IAQYHMDHSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1c(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085165	869791314	/nfs/dbraw/zinc/79/13/14/869791314.db2.gz	VLQABJDAHZELAA-IAQYHMDHSA-N	1	1	320.393	1.844	20	5		DDBDMO
Cc1nc(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)ccc1[N+](=O)[O-]	ZINC001166032671	869808189	/nfs/dbraw/zinc/80/81/89/869808189.db2.gz	PXBNHVUGJOZQEE-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
C[NH+](C)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCOCC1	ZINC001338475540	870000634	/nfs/dbraw/zinc/00/06/34/870000634.db2.gz	SRDLXLVEZSMCDM-HNNXBMFYSA-N	1	1	323.393	1.329	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]C/C=C\Cl)CC1	ZINC001205229356	871446777	/nfs/dbraw/zinc/44/67/77/871446777.db2.gz	ALRZSBRSLFRRJV-QBEVBOACSA-N	1	1	301.774	1.232	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1[NH2+]CCc2occc21	ZINC001341451904	871663337	/nfs/dbraw/zinc/66/33/37/871663337.db2.gz	UINGDVPGUUVPSI-CQSZACIVSA-N	1	1	301.302	1.691	20	5		DDBDMO
Cn1cc[nH+]c1C[C@@H]1CCCN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC001350475167	875710588	/nfs/dbraw/zinc/71/05/88/875710588.db2.gz	XWJOLRAECMJKFU-NSHDSACASA-N	1	1	316.365	1.765	20	5		DDBDMO
COc1cc(CO[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)cc([N+](=O)[O-])c1	ZINC001223395736	880944440	/nfs/dbraw/zinc/94/44/40/880944440.db2.gz	JKQPXBQCYCSAAD-IUIKQTSFSA-N	1	1	320.345	1.924	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ncc([N+](=O)[O-])c4nc[nH]c43)[C@H]1CC(=O)C2	ZINC001227693218	883136134	/nfs/dbraw/zinc/13/61/34/883136134.db2.gz	OZCVOZBHQGJMRE-JVUFJMBOSA-N	1	1	317.305	1.049	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C(F)F)Cc1ccc([N+](=O)[O-])cc1	ZINC001231017557	885140528	/nfs/dbraw/zinc/14/05/28/885140528.db2.gz	CYMBGXWIHFGGAU-UHFFFAOYSA-N	1	1	301.293	1.798	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccon1)Cc1cccc([N+](=O)[O-])c1	ZINC001234511938	888038401	/nfs/dbraw/zinc/03/84/01/888038401.db2.gz	BCKOFADWYQJCCY-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
CC(=O)Nc1ccc(C(C)=O)c(O[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001234680140	888179404	/nfs/dbraw/zinc/17/94/04/888179404.db2.gz	BDXHAEVJFFJMIF-LLVKDONJSA-N	1	1	321.333	1.839	20	5		DDBDMO
CC(=O)Nc1ccc(C(C)=O)c(O[C@@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC001234680140	888179410	/nfs/dbraw/zinc/17/94/10/888179410.db2.gz	BDXHAEVJFFJMIF-LLVKDONJSA-N	1	1	321.333	1.839	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Oc2nc(NC(C)=O)nc(C)c2[N+](=O)[O-])C1	ZINC001234911802	888246884	/nfs/dbraw/zinc/24/68/84/888246884.db2.gz	QSDWWKMDKFECKM-LLVKDONJSA-N	1	1	323.353	1.515	20	5		DDBDMO
CN1C[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1=O	ZINC001254595041	896522743	/nfs/dbraw/zinc/52/27/43/896522743.db2.gz	HZXQIRKJVXYYCC-YUELXQCFSA-N	1	1	301.346	1.082	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC001263094413	900492926	/nfs/dbraw/zinc/49/29/26/900492926.db2.gz	GFABFLMPVFRACR-OAHLLOKOSA-N	1	1	320.393	1.921	20	5		DDBDMO
CC(=O)N1CCC([N@@H+](CCO)Cc2ccccc2[N+](=O)[O-])CC1	ZINC001264755190	901337253	/nfs/dbraw/zinc/33/72/53/901337253.db2.gz	KCBZISIQUDLKPM-UHFFFAOYSA-N	1	1	321.377	1.400	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1CO	ZINC000248915825	282117549	/nfs/dbraw/zinc/11/75/49/282117549.db2.gz	JUXRGGWZYHVNBA-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
COc1ccc(NC(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000272857290	210250563	/nfs/dbraw/zinc/25/05/63/210250563.db2.gz	RKJKLPXXNDKEMQ-UHFFFAOYSA-N	1	1	320.349	1.987	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000305857352	231076169	/nfs/dbraw/zinc/07/61/69/231076169.db2.gz	KZGIXOGBDIVWGV-SLEUVZQESA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H](C)C(C)(C)O	ZINC000451363041	231077166	/nfs/dbraw/zinc/07/71/66/231077166.db2.gz	RODGRUYBMLKLRL-LLVKDONJSA-N	1	1	309.366	1.933	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@](O)(C(F)F)C2)c1	ZINC000451437558	231095660	/nfs/dbraw/zinc/09/56/60/231095660.db2.gz	LZVZYKAJNJGWHF-ZDUSSCGKSA-N	1	1	302.277	1.676	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCOCC23CCCCC3)c1	ZINC000451817930	231203139	/nfs/dbraw/zinc/20/31/39/231203139.db2.gz	UQVIXPCJMWZJJD-AWEZNQCLSA-N	1	1	324.381	1.187	20	5		DDBDMO
NS(=O)(=O)CC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000089991343	185275279	/nfs/dbraw/zinc/27/52/79/185275279.db2.gz	HCAAJDJQTXUVIS-UHFFFAOYSA-N	1	1	313.379	1.095	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)C(C)(C)C2)cc([N+](=O)[O-])c1	ZINC000614895372	362066765	/nfs/dbraw/zinc/06/67/65/362066765.db2.gz	QUPKFEHKXDPRKN-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)C(C)(C)C2)cc([N+](=O)[O-])c1	ZINC000614895372	362066770	/nfs/dbraw/zinc/06/67/70/362066770.db2.gz	QUPKFEHKXDPRKN-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286637332	219097722	/nfs/dbraw/zinc/09/77/22/219097722.db2.gz	SWQZTFPDSBMQKO-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286637332	219097725	/nfs/dbraw/zinc/09/77/25/219097725.db2.gz	SWQZTFPDSBMQKO-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286637332	219097728	/nfs/dbraw/zinc/09/77/28/219097728.db2.gz	SWQZTFPDSBMQKO-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C1CC1	ZINC000412432012	529883446	/nfs/dbraw/zinc/88/34/46/529883446.db2.gz	ZAJYTHCWLLNSDV-UHFFFAOYSA-N	1	1	308.338	1.300	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)c1	ZINC000108333542	185507227	/nfs/dbraw/zinc/50/72/27/185507227.db2.gz	WFIGTMZEWKDZJA-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000272635806	210036477	/nfs/dbraw/zinc/03/64/77/210036477.db2.gz	NRQJBUXITCRVNH-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1(O)CCCC1	ZINC000152399921	186068858	/nfs/dbraw/zinc/06/88/58/186068858.db2.gz	NWMXYPSHELZNEF-UHFFFAOYSA-N	1	1	307.350	1.431	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000155667307	186101108	/nfs/dbraw/zinc/10/11/08/186101108.db2.gz	SMHJSAAFXPYIHT-LLVKDONJSA-N	1	1	322.365	1.403	20	5		DDBDMO
CC[N@@H+](CCCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000266846467	186357042	/nfs/dbraw/zinc/35/70/42/186357042.db2.gz	ALKVBKWPNYNUIM-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)n1	ZINC000331725254	234049601	/nfs/dbraw/zinc/04/96/01/234049601.db2.gz	MPZRHBFUMSRBSC-MNOVXSKESA-N	1	1	307.354	1.168	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000043754791	352373227	/nfs/dbraw/zinc/37/32/27/352373227.db2.gz	HGEKGTVOQDGRMY-BZPMIXESSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000043754791	352373229	/nfs/dbraw/zinc/37/32/29/352373229.db2.gz	HGEKGTVOQDGRMY-BZPMIXESSA-N	1	1	310.350	1.444	20	5		DDBDMO
CSCC[C@@H](C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000072665979	191211972	/nfs/dbraw/zinc/21/19/72/191211972.db2.gz	OZRLKRWEXGKIDH-PWSUYJOCSA-N	1	1	302.400	1.226	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000054375841	352690670	/nfs/dbraw/zinc/69/06/70/352690670.db2.gz	PMVQBQCCURMVQR-LBPRGKRZSA-N	1	1	310.354	1.010	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1	ZINC000066050032	352975370	/nfs/dbraw/zinc/97/53/70/352975370.db2.gz	WMMUBKBQKYMSTM-CYBMUJFWSA-N	1	1	316.361	1.760	20	5		DDBDMO
CC[NH+]1CCN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1	ZINC000068467943	353113323	/nfs/dbraw/zinc/11/33/23/353113323.db2.gz	IYVAQUZJTCYVDR-UHFFFAOYSA-N	1	1	316.361	1.714	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000331926348	234285224	/nfs/dbraw/zinc/28/52/24/234285224.db2.gz	CUZOQUDSTBRKHI-GXTWGEPZSA-N	1	1	310.350	1.303	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000182091151	199385537	/nfs/dbraw/zinc/38/55/37/199385537.db2.gz	NUHDTCQNKPTBHW-ZDUSSCGKSA-N	1	1	321.377	1.664	20	5		DDBDMO
CCc1ccc(C(=O)NCC[N@@H+](C)CCOC)cc1[N+](=O)[O-]	ZINC000174169629	198300886	/nfs/dbraw/zinc/30/08/86/198300886.db2.gz	AQCZARHDLVBREQ-UHFFFAOYSA-N	1	1	309.366	1.465	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000174341882	198322355	/nfs/dbraw/zinc/32/23/55/198322355.db2.gz	BYZPLROHNFPBLI-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000174341882	198322357	/nfs/dbraw/zinc/32/23/57/198322357.db2.gz	BYZPLROHNFPBLI-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000174536430	198348824	/nfs/dbraw/zinc/34/88/24/198348824.db2.gz	UOVLNXXCOWEEKH-CYBMUJFWSA-N	1	1	321.377	1.774	20	5		DDBDMO
Nc1nc(N[C@H]2CC[N@@H+](CC3CCCC3)C2)ncc1[N+](=O)[O-]	ZINC000078527215	353520955	/nfs/dbraw/zinc/52/09/55/353520955.db2.gz	QNGSKOKPQVXHCT-NSHDSACASA-N	1	1	306.370	1.643	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000617751300	363287681	/nfs/dbraw/zinc/28/76/81/363287681.db2.gz	FHMPGKJKYBEFSW-YWPYICTPSA-N	1	1	321.377	1.534	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000617751300	363287684	/nfs/dbraw/zinc/28/76/84/363287684.db2.gz	FHMPGKJKYBEFSW-YWPYICTPSA-N	1	1	321.377	1.534	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000142137978	354143127	/nfs/dbraw/zinc/14/31/27/354143127.db2.gz	LYCKUTBKOAKPNE-ZDUSSCGKSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@]2(CCOC2)C1	ZINC000153491865	354199733	/nfs/dbraw/zinc/19/97/33/354199733.db2.gz	KBXKJKSZVNDGLI-INIZCTEOSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@]2(CCOC2)C1	ZINC000153491865	354199738	/nfs/dbraw/zinc/19/97/38/354199738.db2.gz	KBXKJKSZVNDGLI-INIZCTEOSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000154690585	354208147	/nfs/dbraw/zinc/20/81/47/354208147.db2.gz	JUYJFLYYQLDMHT-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000154690585	354208150	/nfs/dbraw/zinc/20/81/50/354208150.db2.gz	JUYJFLYYQLDMHT-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
NC(=O)c1ccnc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-]	ZINC000357238222	291026797	/nfs/dbraw/zinc/02/67/97/291026797.db2.gz	MXCAZRGIYDRPCJ-SECBINFHSA-N	1	1	316.321	1.196	20	5		DDBDMO
CC(C)[NH2+]CCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000315163836	354491127	/nfs/dbraw/zinc/49/11/27/354491127.db2.gz	RHTZTYSZEPWBLM-UHFFFAOYSA-N	1	1	319.358	1.400	20	5		DDBDMO
C[C@H](NC(=O)NC[C@]1(O)CC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000358668489	299218445	/nfs/dbraw/zinc/21/84/45/299218445.db2.gz	XNRIFYZIDPGCGH-XHDPSFHLSA-N	1	1	322.365	1.022	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](CC3CC3)C2)n1	ZINC000587973720	354888187	/nfs/dbraw/zinc/88/81/87/354888187.db2.gz	XVYBWTYTNUQCFN-LLVKDONJSA-N	1	1	320.349	1.673	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]([N@H+]3CC[C@H](O)C3)C2)cc([N+](=O)[O-])c1	ZINC000588860630	354943392	/nfs/dbraw/zinc/94/33/92/354943392.db2.gz	KIAFLSQLMLJQHT-HIFRSBDPSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[C@@H]([N@H+]3CC[C@@H](O)C3)C2)c1[N+](=O)[O-]	ZINC000588863634	354944174	/nfs/dbraw/zinc/94/41/74/354944174.db2.gz	SGMITZDFPYJMLW-CHWSQXEVSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C(C)(C)C2)c1	ZINC000589514251	354997715	/nfs/dbraw/zinc/99/77/15/354997715.db2.gz	OURBPKYJXGIJOT-CYBMUJFWSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C(C)(C)C2)c1	ZINC000589514251	354997718	/nfs/dbraw/zinc/99/77/18/354997718.db2.gz	OURBPKYJXGIJOT-CYBMUJFWSA-N	1	1	308.334	1.584	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)[C@@H]2C1	ZINC000590010676	355040072	/nfs/dbraw/zinc/04/00/72/355040072.db2.gz	OSRDJTJXTLYSJK-IAQYHMDHSA-N	1	1	319.361	1.597	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590045570	355043624	/nfs/dbraw/zinc/04/36/24/355043624.db2.gz	RZCDKFQHFUJLNX-TZMCWYRMSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000590344482	355075177	/nfs/dbraw/zinc/07/51/77/355075177.db2.gz	TYXRBPVZCXPUKN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000590344482	355075182	/nfs/dbraw/zinc/07/51/82/355075182.db2.gz	TYXRBPVZCXPUKN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000590344482	355075185	/nfs/dbraw/zinc/07/51/85/355075185.db2.gz	TYXRBPVZCXPUKN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H]1CCOC1	ZINC000494946033	235105970	/nfs/dbraw/zinc/10/59/70/235105970.db2.gz	HFSZKYQSPVZLLK-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000590443457	355097386	/nfs/dbraw/zinc/09/73/86/355097386.db2.gz	KKVUJZJVTKDJAD-GXFFZTMASA-N	1	1	304.350	1.413	20	5		DDBDMO
CCCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592831322	355707262	/nfs/dbraw/zinc/70/72/62/355707262.db2.gz	KSRDFPWAWNACLA-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC000593720279	355976491	/nfs/dbraw/zinc/97/64/91/355976491.db2.gz	JPMZGUOOVYVVRN-RISCZKNCSA-N	1	1	307.325	1.439	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000081362742	192257403	/nfs/dbraw/zinc/25/74/03/192257403.db2.gz	NRFIZTDRRQFFAR-CYBMUJFWSA-N	1	1	323.397	1.372	20	5		DDBDMO
C[C@H](CO)[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595679069	356607471	/nfs/dbraw/zinc/60/74/71/356607471.db2.gz	UTICLVPURXOESR-OCCSQVGLSA-N	1	1	309.366	1.239	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000595745625	356633932	/nfs/dbraw/zinc/63/39/32/356633932.db2.gz	YSSWJUZDQKGQDK-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2NC(=O)CC[C@H]2C1	ZINC000595736343	356628602	/nfs/dbraw/zinc/62/86/02/356628602.db2.gz	FAVGTCMYXPGLPT-FZMZJTMJSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@H]1COC2(CCCC2)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000595816416	356662022	/nfs/dbraw/zinc/66/20/22/356662022.db2.gz	WZMKQJBKGLOCLA-JSGCOSHPSA-N	1	1	324.381	1.186	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000595828452	356667246	/nfs/dbraw/zinc/66/72/46/356667246.db2.gz	FASTVKPTQAMWQI-OLZOCXBDSA-N	1	1	305.334	1.162	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595880769	356689401	/nfs/dbraw/zinc/68/94/01/356689401.db2.gz	ZBVMGICFWAKHGC-OZVIIMIRSA-N	1	1	321.377	1.872	20	5		DDBDMO
CC(C)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1	ZINC000596111070	356776011	/nfs/dbraw/zinc/77/60/11/356776011.db2.gz	WLHHWUXRFXAUKG-UHFFFAOYSA-N	1	1	306.366	1.614	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CCc3c[nH+]cn3C2)ccc1[N+](=O)[O-]	ZINC000596229455	356824601	/nfs/dbraw/zinc/82/46/01/356824601.db2.gz	BZWXAXIDTACLLW-SNVBAGLBSA-N	1	1	301.306	1.317	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000596268626	356839102	/nfs/dbraw/zinc/83/91/02/356839102.db2.gz	KTTHQRJSXAMVEM-LBPRGKRZSA-N	1	1	320.393	1.875	20	5		DDBDMO
CCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@@H]1CC[N@@H+](CC)C1	ZINC000598040095	357438557	/nfs/dbraw/zinc/43/85/57/357438557.db2.gz	CHALXWZIIYPPOU-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
CC[N@H+]1CCCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000598596708	357646906	/nfs/dbraw/zinc/64/69/06/357646906.db2.gz	UBEKIBLEVJCTFM-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CCc3c[nH+]cn3C2)c1[N+](=O)[O-]	ZINC000598625015	357660262	/nfs/dbraw/zinc/66/02/62/357660262.db2.gz	JSYKRPBJBCTTBB-SECBINFHSA-N	1	1	317.305	1.400	20	5		DDBDMO
CCc1nn(C)c(NC2CC([NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000599095385	357814258	/nfs/dbraw/zinc/81/42/58/357814258.db2.gz	SEVBLDVJYBEQFX-UHFFFAOYSA-N	1	1	309.370	1.166	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000599100709	357815939	/nfs/dbraw/zinc/81/59/39/357815939.db2.gz	MHQMDAHCXNIRIB-QWHCGFSZSA-N	1	1	314.345	1.398	20	5		DDBDMO
Cc1cnc(N2CCC([NH+]3CCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000599104821	357816775	/nfs/dbraw/zinc/81/67/75/357816775.db2.gz	ODBYDRDZTQOHLT-UHFFFAOYSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000599141814	357827825	/nfs/dbraw/zinc/82/78/25/357827825.db2.gz	RLWFQJQDZDEQIY-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCC[N@H+]1CC[C@@H](O)C1	ZINC000599176322	357840131	/nfs/dbraw/zinc/84/01/31/357840131.db2.gz	QRUNJJXQAZALOU-LLVKDONJSA-N	1	1	323.349	1.168	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)C[C@H]2C[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000599672295	358018088	/nfs/dbraw/zinc/01/80/88/358018088.db2.gz	KXPMNOGLFJGYCA-RWMBFGLXSA-N	1	1	321.377	1.933	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c([N+](=O)[O-])c1	ZINC000599681983	358023025	/nfs/dbraw/zinc/02/30/25/358023025.db2.gz	SXTSGHCYWINZCP-CUOATXAZSA-N	1	1	305.334	1.039	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1	ZINC000276627924	213009896	/nfs/dbraw/zinc/00/98/96/213009896.db2.gz	VRYGDUKREGRVPS-RYUDHWBXSA-N	1	1	320.349	1.815	20	5		DDBDMO
CCn1cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC000601149862	358422377	/nfs/dbraw/zinc/42/23/77/358422377.db2.gz	QWZWVHDJEFILFH-HNNXBMFYSA-N	1	1	304.350	1.809	20	5		DDBDMO
CCOC1CC(O)(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1	ZINC000601154142	358424110	/nfs/dbraw/zinc/42/41/10/358424110.db2.gz	BVPMSENFECOKBB-UHFFFAOYSA-N	1	1	317.345	1.907	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000181139024	199256332	/nfs/dbraw/zinc/25/63/32/199256332.db2.gz	WVDVXQVBYOHAPU-GFCCVEGCSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cn1cc(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])n1	ZINC000602479860	359006357	/nfs/dbraw/zinc/00/63/57/359006357.db2.gz	RGSZSPOIXZSPRB-CYBMUJFWSA-N	1	1	307.398	1.492	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](C2CCOCC2)C1	ZINC000602793659	359195925	/nfs/dbraw/zinc/19/59/25/359195925.db2.gz	CFASUUYFDAMPIL-CQSZACIVSA-N	1	1	308.382	1.848	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@@H](O)C[C@@H]1c1ccccc1	ZINC000602839814	359228557	/nfs/dbraw/zinc/22/85/57/359228557.db2.gz	IVAMJXIHFUMBNX-LSDHHAIUSA-N	1	1	316.361	1.908	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000602874575	359257043	/nfs/dbraw/zinc/25/70/43/359257043.db2.gz	QNYGLVDDWUXRGY-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@@H](O)C(F)(F)F	ZINC000602809675	359206670	/nfs/dbraw/zinc/20/66/70/359206670.db2.gz	CDWHCBBZWFMONB-SECBINFHSA-N	1	1	310.276	1.345	20	5		DDBDMO
CCN(C(=O)Nc1c(C)cncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000602961629	359324865	/nfs/dbraw/zinc/32/48/65/359324865.db2.gz	XZMKUTDSPXHDIS-GFCCVEGCSA-N	1	1	321.381	1.668	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000186947056	200036271	/nfs/dbraw/zinc/03/62/71/200036271.db2.gz	IRBPJCRBIVCFJP-VXGBXAGGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000186947056	200036273	/nfs/dbraw/zinc/03/62/73/200036273.db2.gz	IRBPJCRBIVCFJP-VXGBXAGGSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000187123647	200064682	/nfs/dbraw/zinc/06/46/82/200064682.db2.gz	VWIIABPBVOHXGG-GXSJLCMTSA-N	1	1	308.338	1.250	20	5		DDBDMO
CC[C@]1(CO)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000187580111	200130534	/nfs/dbraw/zinc/13/05/34/200130534.db2.gz	NDYDAEHMQLQPRU-HNNXBMFYSA-N	1	1	309.366	1.241	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000604278266	359732272	/nfs/dbraw/zinc/73/22/72/359732272.db2.gz	ZLSBSQLOABCARO-SECBINFHSA-N	1	1	317.342	1.106	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000604278266	359732274	/nfs/dbraw/zinc/73/22/74/359732274.db2.gz	ZLSBSQLOABCARO-SECBINFHSA-N	1	1	317.342	1.106	20	5		DDBDMO
CCN(CCC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000188952924	200326835	/nfs/dbraw/zinc/32/68/35/200326835.db2.gz	IGDJEWWSXMXGAG-UHFFFAOYSA-N	1	1	319.365	1.885	20	5		DDBDMO
O=C(NCC[N@@H+]1CCCOCC1)c1ccc([N+](=O)[O-])cc1F	ZINC000189423034	200398653	/nfs/dbraw/zinc/39/86/53/200398653.db2.gz	MFGNPNOTIODJTA-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)c1ccc([N+](=O)[O-])cc1F	ZINC000189423034	200398655	/nfs/dbraw/zinc/39/86/55/200398655.db2.gz	MFGNPNOTIODJTA-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CCCC[NH+](C)C)c1[N+](=O)[O-]	ZINC000610923230	360572772	/nfs/dbraw/zinc/57/27/72/360572772.db2.gz	PSXMJCRRRRNDKH-UHFFFAOYSA-N	1	1	311.386	1.855	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(c3c([N+](=O)[O-])ncn3C)CC2)c1	ZINC000610808821	360542599	/nfs/dbraw/zinc/54/25/99/360542599.db2.gz	OGPLLLVREUTGEV-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
CC[N@H+]1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C[C@@H]1C	ZINC000611084806	360617679	/nfs/dbraw/zinc/61/76/79/360617679.db2.gz	VLSWOQBVNRSCQN-JTQLQIEISA-N	1	1	317.349	1.774	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000611084679	360617782	/nfs/dbraw/zinc/61/77/82/360617782.db2.gz	JKUMCPRCJLCWIP-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000611084679	360617783	/nfs/dbraw/zinc/61/77/83/360617783.db2.gz	JKUMCPRCJLCWIP-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1C	ZINC000611091738	360619500	/nfs/dbraw/zinc/61/95/00/360619500.db2.gz	FMXSVGPNSDCTHW-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612086274	360913733	/nfs/dbraw/zinc/91/37/33/360913733.db2.gz	LVWZMVSICSKQBS-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252442	363945745	/nfs/dbraw/zinc/94/57/45/363945745.db2.gz	LLOSIYFJQIKRRX-LSDHHAIUSA-N	1	1	321.352	1.782	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCCC[C@@H]1C	ZINC000350014791	284132285	/nfs/dbraw/zinc/13/22/85/284132285.db2.gz	QMUXUGYLPUOYTD-WDEREUQCSA-N	1	1	321.381	1.565	20	5		DDBDMO
NC(=O)c1cc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])on1	ZINC000350393966	284189996	/nfs/dbraw/zinc/18/99/96/284189996.db2.gz	QFVIBHYTYWDZOF-HYXAFXHYSA-N	1	1	302.290	1.485	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000264627486	204039647	/nfs/dbraw/zinc/03/96/47/204039647.db2.gz	MZOPQNCQWJIOIX-UHFFFAOYSA-N	1	1	320.393	1.304	20	5		DDBDMO
COc1cc(N[C@@H](C)C[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000266386549	205308121	/nfs/dbraw/zinc/30/81/21/205308121.db2.gz	NOEDMUGMIJBHEI-LBPRGKRZSA-N	1	1	308.382	1.651	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@H](C)C1	ZINC000288515048	220191563	/nfs/dbraw/zinc/19/15/63/220191563.db2.gz	QYKQTJQMWCNTJE-LLVKDONJSA-N	1	1	306.366	1.652	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)[C@H](C)C1	ZINC000288515048	220191565	/nfs/dbraw/zinc/19/15/65/220191565.db2.gz	QYKQTJQMWCNTJE-LLVKDONJSA-N	1	1	306.366	1.652	20	5		DDBDMO
CCCC[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000023696731	182366708	/nfs/dbraw/zinc/36/67/08/182366708.db2.gz	RQMIVHYXIWMUQF-UHFFFAOYSA-N	1	1	309.322	1.994	20	5		DDBDMO
O=[N+]([O-])c1c(NCCC[NH+]2CCOCC2)nc2sccn21	ZINC000029161925	182554839	/nfs/dbraw/zinc/55/48/39/182554839.db2.gz	KGPSZMWEBBEBBN-UHFFFAOYSA-N	1	1	311.367	1.438	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)NCC[NH+]1CCCCC1	ZINC000046034704	248197709	/nfs/dbraw/zinc/19/77/09/248197709.db2.gz	BXHDMYMYVGAMTQ-UHFFFAOYSA-N	1	1	313.379	1.359	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000351931355	284647837	/nfs/dbraw/zinc/64/78/37/284647837.db2.gz	QAQZOTIIYXOUKN-UHFFFAOYSA-N	1	1	315.276	1.632	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](O)C1	ZINC000041886291	183223603	/nfs/dbraw/zinc/22/36/03/183223603.db2.gz	ASFZPMFNPXFVGB-LBPRGKRZSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000284943746	218244727	/nfs/dbraw/zinc/24/47/27/218244727.db2.gz	WRHQSAJDUKYOAT-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000284943746	218244729	/nfs/dbraw/zinc/24/47/29/218244729.db2.gz	WRHQSAJDUKYOAT-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285233053	218343632	/nfs/dbraw/zinc/34/36/32/218343632.db2.gz	YAILYDZEXMKISQ-PHIMTYICSA-N	1	1	323.397	1.804	20	5		DDBDMO
COC(=O)c1cc(C(=O)NC[C@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000109848043	194293071	/nfs/dbraw/zinc/29/30/71/194293071.db2.gz	ZKIMBADPOBIUTL-SNVBAGLBSA-N	1	1	321.333	1.063	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000110995338	194379330	/nfs/dbraw/zinc/37/93/30/194379330.db2.gz	FHJWWIJKSJLKNI-LLVKDONJSA-N	1	1	324.356	1.920	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CC2)CC1	ZINC000061604059	184177620	/nfs/dbraw/zinc/17/76/20/184177620.db2.gz	NHPAYWUIWLCENB-UHFFFAOYSA-N	1	1	318.377	1.703	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000341042248	251350044	/nfs/dbraw/zinc/35/00/44/251350044.db2.gz	HEUQOASJMYLDNJ-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCCC[C@H]2C[NH+]2CCOCC2)nc1	ZINC000301221084	285122812	/nfs/dbraw/zinc/12/28/12/285122812.db2.gz	BGDHJUXOTJCFEX-AWEZNQCLSA-N	1	1	306.366	1.681	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@H](CC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000352541499	285127842	/nfs/dbraw/zinc/12/78/42/285127842.db2.gz	YNGFMXZCKXMYHB-NSHDSACASA-N	1	1	307.350	1.691	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000352659458	285204284	/nfs/dbraw/zinc/20/42/84/285204284.db2.gz	JQPMKXHCGYSHGD-HONMWMINSA-N	1	1	307.350	1.767	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000352662260	285206280	/nfs/dbraw/zinc/20/62/80/285206280.db2.gz	XZCYHPJLRHQGIV-GXTWGEPZSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000120633452	195205898	/nfs/dbraw/zinc/20/58/98/195205898.db2.gz	YJRHJSDDHGTPRD-AWEZNQCLSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000152879652	196832013	/nfs/dbraw/zinc/83/20/13/196832013.db2.gz	PTXFMOQIANTXKX-NFAWXSAZSA-N	1	1	324.377	1.570	20	5		DDBDMO
COc1cc(C[N@H+](C)CCNC(=O)C(C)C)ccc1[N+](=O)[O-]	ZINC000352780485	285296378	/nfs/dbraw/zinc/29/63/78/285296378.db2.gz	UTXDABJFBDAHIK-UHFFFAOYSA-N	1	1	309.366	1.807	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCNC(=O)C(C)C)ccc1[N+](=O)[O-]	ZINC000352780485	285296381	/nfs/dbraw/zinc/29/63/81/285296381.db2.gz	UTXDABJFBDAHIK-UHFFFAOYSA-N	1	1	309.366	1.807	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CCO)C[C@H]1C	ZINC000452112974	533219069	/nfs/dbraw/zinc/21/90/69/533219069.db2.gz	HSMUYODBAGPXBE-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC1(F)F	ZINC000289783081	221222472	/nfs/dbraw/zinc/22/24/72/221222472.db2.gz	LVOHORSOVGMZFO-KOLCDFICSA-N	1	1	304.297	1.129	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC2	ZINC000078619477	407036734	/nfs/dbraw/zinc/03/67/34/407036734.db2.gz	JKNVVLGEYFNCJM-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@H+](Cc1cccc([N+](=O)[O-])c1)CC2	ZINC000078619477	407036736	/nfs/dbraw/zinc/03/67/36/407036736.db2.gz	JKNVVLGEYFNCJM-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000054987099	407192718	/nfs/dbraw/zinc/19/27/18/407192718.db2.gz	DEZNJIPCHABDEP-OAHLLOKOSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000054987099	407192720	/nfs/dbraw/zinc/19/27/20/407192720.db2.gz	DEZNJIPCHABDEP-OAHLLOKOSA-N	1	1	319.361	1.717	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@H](C(N)=O)CC[C@H]2C)cc1[N+](=O)[O-]	ZINC000103284354	407336124	/nfs/dbraw/zinc/33/61/24/407336124.db2.gz	CYMNYYJODXLQQZ-ZYHUDNBSSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@](C)(O)C1	ZINC000124762661	407368463	/nfs/dbraw/zinc/36/84/63/407368463.db2.gz	NBZYONFCINZDKK-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](C)(O)C1	ZINC000124762661	407368464	/nfs/dbraw/zinc/36/84/64/407368464.db2.gz	NBZYONFCINZDKK-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000114063111	407535054	/nfs/dbraw/zinc/53/50/54/407535054.db2.gz	RIUHJVSKSCFNIJ-LLVKDONJSA-N	1	1	323.349	1.664	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000115439653	407680047	/nfs/dbraw/zinc/68/00/47/407680047.db2.gz	SATXPXGZKKXFRT-CYBMUJFWSA-N	1	1	320.393	1.807	20	5		DDBDMO
COCCCOCC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000271543558	407721209	/nfs/dbraw/zinc/72/12/09/407721209.db2.gz	KHMMFOYDNPLJOC-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
CCC[C@@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000152621677	407662805	/nfs/dbraw/zinc/66/28/05/407662805.db2.gz	JGIGVUSUADGCCS-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC[C@@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000152621677	407662811	/nfs/dbraw/zinc/66/28/11/407662811.db2.gz	JGIGVUSUADGCCS-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000171665881	407736517	/nfs/dbraw/zinc/73/65/17/407736517.db2.gz	IWGMZDQSEQZIGT-NSHDSACASA-N	1	1	323.397	1.731	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000153191854	407773613	/nfs/dbraw/zinc/77/36/13/407773613.db2.gz	WWPGNGLGERCYGL-GXFFZTMASA-N	1	1	307.350	1.429	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)CN1CCCC1=O	ZINC000171883064	407789513	/nfs/dbraw/zinc/78/95/13/407789513.db2.gz	DBACEMRDVFSKKP-CYBMUJFWSA-N	1	1	307.350	1.010	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)CN1CCCC1=O	ZINC000171883064	407789505	/nfs/dbraw/zinc/78/95/05/407789505.db2.gz	DBACEMRDVFSKKP-CYBMUJFWSA-N	1	1	307.350	1.010	20	5		DDBDMO
C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000134054791	407885321	/nfs/dbraw/zinc/88/53/21/407885321.db2.gz	RTOORFLEXWVDHX-SMDDNHRTSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](NC(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000134054791	407885325	/nfs/dbraw/zinc/88/53/25/407885325.db2.gz	RTOORFLEXWVDHX-SMDDNHRTSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546651	407975029	/nfs/dbraw/zinc/97/50/29/407975029.db2.gz	KEYPDMKEBPEMJK-RYUDHWBXSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546651	407975032	/nfs/dbraw/zinc/97/50/32/407975032.db2.gz	KEYPDMKEBPEMJK-RYUDHWBXSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000268158908	407920246	/nfs/dbraw/zinc/92/02/46/407920246.db2.gz	HNJFNEJZLORCAO-QPUJVOFHSA-N	1	1	322.340	1.529	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000272441352	407922628	/nfs/dbraw/zinc/92/26/28/407922628.db2.gz	INGPOMKBVCEFHH-WFASDCNBSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1ccccc1[N+](=O)[O-])[C@H]1CCSC1	ZINC000154541287	408048457	/nfs/dbraw/zinc/04/84/57/408048457.db2.gz	RNXGTYRKXNAAPA-LBPRGKRZSA-N	1	1	309.391	1.648	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000245460791	407991181	/nfs/dbraw/zinc/99/11/81/407991181.db2.gz	WALCYYJUIWRPAJ-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000246250968	408191885	/nfs/dbraw/zinc/19/18/85/408191885.db2.gz	SXDVPVAYEIDZFY-WDEREUQCSA-N	1	1	322.365	1.236	20	5		DDBDMO
CC[N@H+](C)C[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269273243	408247025	/nfs/dbraw/zinc/24/70/25/408247025.db2.gz	HHXBOTUAVMFXAD-LLVKDONJSA-N	1	1	307.350	1.714	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000269273243	408247028	/nfs/dbraw/zinc/24/70/28/408247028.db2.gz	HHXBOTUAVMFXAD-LLVKDONJSA-N	1	1	307.350	1.714	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ncc([N+](=O)[O-])cn1	ZINC000273572082	408250852	/nfs/dbraw/zinc/25/08/52/408250852.db2.gz	AIBJUBOEUAWHOF-UHFFFAOYSA-N	1	1	309.370	1.179	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000246306164	408213298	/nfs/dbraw/zinc/21/32/98/408213298.db2.gz	FRXWNAIAJNWQQY-WDEREUQCSA-N	1	1	323.349	1.663	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000247311831	408448707	/nfs/dbraw/zinc/44/87/07/408448707.db2.gz	HMGIBVXCJZTOJJ-SWLSCSKDSA-N	1	1	321.377	1.772	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000247051104	408396629	/nfs/dbraw/zinc/39/66/29/408396629.db2.gz	SOLKBCFSRANGBQ-GHMZBOCLSA-N	1	1	323.349	1.663	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])C1	ZINC000264472599	408504000	/nfs/dbraw/zinc/50/40/00/408504000.db2.gz	GPGXIZHKFAEZRL-LLVKDONJSA-N	1	1	311.313	1.184	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000265361147	408625654	/nfs/dbraw/zinc/62/56/54/408625654.db2.gz	XMRHHQKHEKQMGX-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000249512744	408734935	/nfs/dbraw/zinc/73/49/35/408734935.db2.gz	OQOOYPUHRYIPNQ-KBPBESRZSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000249083761	408684649	/nfs/dbraw/zinc/68/46/49/408684649.db2.gz	HZYXTACCUJKJDT-ZJUUUORDSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000249083761	408684654	/nfs/dbraw/zinc/68/46/54/408684654.db2.gz	HZYXTACCUJKJDT-ZJUUUORDSA-N	1	1	313.379	1.183	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CC[NH+](C)CC1	ZINC000193143886	408700760	/nfs/dbraw/zinc/70/07/60/408700760.db2.gz	QMYDYYIBZOVPST-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)[C@@H](C)C1	ZINC000249598809	408748835	/nfs/dbraw/zinc/74/88/35/408748835.db2.gz	XQEUANFUPUBRKP-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1	ZINC000290783053	408832368	/nfs/dbraw/zinc/83/23/68/408832368.db2.gz	NFMVQQZZZXPUAD-AWEZNQCLSA-N	1	1	317.349	1.308	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)c1	ZINC000291749679	408916929	/nfs/dbraw/zinc/91/69/29/408916929.db2.gz	KLEZNGPASRVKMM-YPMHNXCESA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC(F)(F)[C@@H](CO)C2)c1	ZINC000291749679	408916932	/nfs/dbraw/zinc/91/69/32/408916932.db2.gz	KLEZNGPASRVKMM-YPMHNXCESA-N	1	1	316.304	1.578	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@](O)(C(N)=O)C1	ZINC000286103533	408924117	/nfs/dbraw/zinc/92/41/17/408924117.db2.gz	IMKWPJREWIEHLL-IAQYHMDHSA-N	1	1	307.350	1.276	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+]3CCCC[C@H]23)n1	ZINC000286253080	408949600	/nfs/dbraw/zinc/94/96/00/408949600.db2.gz	IVIYAXOHVIJSHQ-ZYHUDNBSSA-N	1	1	320.349	1.815	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C2)C1	ZINC000292345722	409026713	/nfs/dbraw/zinc/02/67/13/409026713.db2.gz	QJGFJSZJQQEMQF-OAHLLOKOSA-N	1	1	304.350	1.226	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NCC[N@@H+](C)C1CC1	ZINC000282844192	409066284	/nfs/dbraw/zinc/06/62/84/409066284.db2.gz	UBHWOFOJQCHJKZ-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](O)CC2)c2c(c1)COCO2	ZINC000293299462	409084674	/nfs/dbraw/zinc/08/46/74/409084674.db2.gz	WJYKNVDDDKLOFS-CQSZACIVSA-N	1	1	308.334	1.808	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](O)CC2)c2c(c1)COCO2	ZINC000293299462	409084676	/nfs/dbraw/zinc/08/46/76/409084676.db2.gz	WJYKNVDDDKLOFS-CQSZACIVSA-N	1	1	308.334	1.808	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@]3(CNC(=O)C3)C2)cc1[N+](=O)[O-]	ZINC000278936452	409116945	/nfs/dbraw/zinc/11/69/45/409116945.db2.gz	UCIHUUGKAPODCF-OAHLLOKOSA-N	1	1	305.334	1.315	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C2)C1	ZINC000293654770	409154460	/nfs/dbraw/zinc/15/44/60/409154460.db2.gz	HGFICTNQUPDVLU-HNNXBMFYSA-N	1	1	322.340	1.484	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422420	409309781	/nfs/dbraw/zinc/30/97/81/409309781.db2.gz	LYDYQVQSSKOKNT-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422420	409309783	/nfs/dbraw/zinc/30/97/83/409309783.db2.gz	LYDYQVQSSKOKNT-CZUORRHYSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CC=CCC1	ZINC000280204454	409269219	/nfs/dbraw/zinc/26/92/19/409269219.db2.gz	KDQPZRSWSYTQLI-UHFFFAOYSA-N	1	1	305.334	1.352	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC[N@H+](C2CC2)C1	ZINC000295288996	409413280	/nfs/dbraw/zinc/41/32/80/409413280.db2.gz	IJICRUBTZSLBKM-JTQLQIEISA-N	1	1	320.349	1.252	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280750021	409436344	/nfs/dbraw/zinc/43/63/44/409436344.db2.gz	NFEPVVZUZCMBAC-ZUZCIYMTSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H]1CN(C(=O)NCc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1C	ZINC000296173976	409452938	/nfs/dbraw/zinc/45/29/38/409452938.db2.gz	GCZLGSXAQKMBMO-TXEJJXNPSA-N	1	1	306.366	1.829	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000317075299	164025346	/nfs/dbraw/zinc/02/53/46/164025346.db2.gz	ZCOPUBFPRKJFTO-GHMZBOCLSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000357033734	164136924	/nfs/dbraw/zinc/13/69/24/164136924.db2.gz	IAPOWWFQHOFVHW-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000356903497	409704545	/nfs/dbraw/zinc/70/45/45/409704545.db2.gz	PRLJFEMSRQTCBL-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
COC(=O)Cc1ccc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000296890122	409687896	/nfs/dbraw/zinc/68/78/96/409687896.db2.gz	XYBCZWRCQQFDOI-BETUJISGSA-N	1	1	319.361	1.308	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccon1	ZINC000349245484	409763709	/nfs/dbraw/zinc/76/37/09/409763709.db2.gz	RLKKTMFBUXWDFM-PWSUYJOCSA-N	1	1	307.306	1.673	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[NH+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000338785909	410038176	/nfs/dbraw/zinc/03/81/76/410038176.db2.gz	BVKBJFLJVQFFMA-GHMZBOCLSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOc1cc(OC[C@@H](O)C[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000357452064	410049303	/nfs/dbraw/zinc/04/93/03/410049303.db2.gz	KVLSWSWFCBFFIU-LBPRGKRZSA-N	1	1	310.350	1.827	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000342986100	410052463	/nfs/dbraw/zinc/05/24/63/410052463.db2.gz	AMDUWSZGLVGNDO-LDYMZIIASA-N	1	1	303.322	1.607	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000343110956	410156030	/nfs/dbraw/zinc/15/60/30/410156030.db2.gz	YVGJCOIKKMOVCK-IAQYHMDHSA-N	1	1	319.361	1.382	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000351774894	410224016	/nfs/dbraw/zinc/22/40/16/410224016.db2.gz	PGFPHEDEWSVUPT-GXFFZTMASA-N	1	1	321.333	1.205	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]2CCC[C@@H]21	ZINC000339721818	410417200	/nfs/dbraw/zinc/41/72/00/410417200.db2.gz	YPFODDBSGORYJY-IHRRRGAJSA-N	1	1	308.382	1.663	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@H]21	ZINC000339721817	410418015	/nfs/dbraw/zinc/41/80/15/410418015.db2.gz	YPFODDBSGORYJY-BFHYXJOUSA-N	1	1	308.382	1.663	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000298716978	410363496	/nfs/dbraw/zinc/36/34/96/410363496.db2.gz	JMNZZTCZMJYHQK-SNVBAGLBSA-N	1	1	322.317	1.456	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000298716978	410363503	/nfs/dbraw/zinc/36/35/03/410363503.db2.gz	JMNZZTCZMJYHQK-SNVBAGLBSA-N	1	1	322.317	1.456	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343459816	410470555	/nfs/dbraw/zinc/47/05/55/410470555.db2.gz	SHYHHJKYZNGYOU-BXUZGUMPSA-N	1	1	307.350	1.573	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](CO)CC1	ZINC000339748652	410433911	/nfs/dbraw/zinc/43/39/11/410433911.db2.gz	OXUYPDYUPFHPRQ-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](CO)CC1	ZINC000339748652	410433916	/nfs/dbraw/zinc/43/39/16/410433916.db2.gz	OXUYPDYUPFHPRQ-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](C)O)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343511139	410501186	/nfs/dbraw/zinc/50/11/86/410501186.db2.gz	NCZAJAZJKPNJRE-CHWSQXEVSA-N	1	1	312.366	1.426	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H]1CCC[N@@H+]1C	ZINC000299213211	410571057	/nfs/dbraw/zinc/57/10/57/410571057.db2.gz	FCXIBGVBDHIYRP-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000355602900	410603281	/nfs/dbraw/zinc/60/32/81/410603281.db2.gz	WHZWUSXATYUURM-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOc1cc(C(=O)NCC[NH+]2CCC2)c([N+](=O)[O-])cc1OC	ZINC000337289109	410695844	/nfs/dbraw/zinc/69/58/44/410695844.db2.gz	BONVNJMEUSLWJX-UHFFFAOYSA-N	1	1	323.349	1.438	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@@H+](C)CCCO)CC1	ZINC000301303054	410696595	/nfs/dbraw/zinc/69/65/95/410696595.db2.gz	SETIRRABAOPBOA-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
Cc1nccn1CCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000347782988	410718857	/nfs/dbraw/zinc/71/88/57/410718857.db2.gz	JLFKTTJSRYPYLD-UHFFFAOYSA-N	1	1	301.350	1.943	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c21	ZINC000347793190	410721734	/nfs/dbraw/zinc/72/17/34/410721734.db2.gz	LSSMQLLTSYIYON-UHFFFAOYSA-N	1	1	320.349	1.120	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c4cccnc43)C[C@H]21	ZINC000301692306	410773629	/nfs/dbraw/zinc/77/36/29/410773629.db2.gz	ZDGNQSLMJRHHPY-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)C(C)(C)C1	ZINC000330582472	410796650	/nfs/dbraw/zinc/79/66/50/410796650.db2.gz	USLWVPTWZJDQOT-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000330586593	410801748	/nfs/dbraw/zinc/80/17/48/410801748.db2.gz	LTWHXYXSZQRZMB-RYUDHWBXSA-N	1	1	306.366	1.558	20	5		DDBDMO
Cc1cc(N2CCC[C@@H]2C[N@H+]2CCC[C@@H]2CO)ncc1[N+](=O)[O-]	ZINC000301591955	410750352	/nfs/dbraw/zinc/75/03/52/410750352.db2.gz	YMBUURHMBHKJCR-ZIAGYGMSSA-N	1	1	320.393	1.724	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000348174278	410836794	/nfs/dbraw/zinc/83/67/94/410836794.db2.gz	KIPJQQZEKGPNMA-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@]1(CO)CCOC1	ZINC000330894257	410905666	/nfs/dbraw/zinc/90/56/66/410905666.db2.gz	JYGXMPNATUHKGV-ZDUSSCGKSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@]1(CO)CCOC1	ZINC000330894257	410905673	/nfs/dbraw/zinc/90/56/73/410905673.db2.gz	JYGXMPNATUHKGV-ZDUSSCGKSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000353711000	411116942	/nfs/dbraw/zinc/11/69/42/411116942.db2.gz	LWTWHXFLVUQLAV-NSHDSACASA-N	1	1	307.354	1.122	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)cc1	ZINC000129300079	196037760	/nfs/dbraw/zinc/03/77/60/196037760.db2.gz	RCDQJVGLZQWCKR-HNNXBMFYSA-N	1	1	305.378	1.749	20	5		DDBDMO
CN(C)C[C@H](O)C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000417317129	225292364	/nfs/dbraw/zinc/29/23/64/225292364.db2.gz	VRMGPQYHQCLVCJ-ZBFHGGJFSA-N	1	1	307.394	1.874	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000296675260	226112111	/nfs/dbraw/zinc/11/21/11/226112111.db2.gz	KYTPRWQRCUOPHI-AWEZNQCLSA-N	1	1	307.350	1.910	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000361027801	418568804	/nfs/dbraw/zinc/56/88/04/418568804.db2.gz	ZUFJEMGAWFFTDD-PSASIEDQSA-N	1	1	303.322	1.892	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000361006287	418564385	/nfs/dbraw/zinc/56/43/85/418564385.db2.gz	CHBKAXGVKDLERS-WDEREUQCSA-N	1	1	311.386	1.011	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000191814540	222109711	/nfs/dbraw/zinc/10/97/11/222109711.db2.gz	TXVVSNCAUGSNFM-GFCCVEGCSA-N	1	1	323.397	1.806	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000375035558	418591794	/nfs/dbraw/zinc/59/17/94/418591794.db2.gz	CTNFLEBQLKZOOS-XHDPSFHLSA-N	1	1	318.377	1.485	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c3nonc32)CC1	ZINC000375509505	418651487	/nfs/dbraw/zinc/65/14/87/418651487.db2.gz	WCAYVFXLMZRSIY-SNVBAGLBSA-N	1	1	321.337	1.024	20	5		DDBDMO
C[C@H]1[C@H](Nc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CCC[N@H+]1C	ZINC000343497484	418631698	/nfs/dbraw/zinc/63/16/98/418631698.db2.gz	DPTXECOQXSRXBH-GXFFZTMASA-N	1	1	317.349	2.539	20	5		DDBDMO
CCCCNC(=O)[C@@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399825	418635235	/nfs/dbraw/zinc/63/52/35/418635235.db2.gz	AXNSRNNSIYELME-OLZOCXBDSA-N	1	1	323.397	1.733	20	5		DDBDMO
CCCCNC(=O)[C@@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399825	418635236	/nfs/dbraw/zinc/63/52/36/418635236.db2.gz	AXNSRNNSIYELME-OLZOCXBDSA-N	1	1	323.397	1.733	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](CCCN3CCOCC3)C2)c1	ZINC000375404207	418636425	/nfs/dbraw/zinc/63/64/25/418636425.db2.gz	NPRMPOYEFKFXGN-CQSZACIVSA-N	1	1	323.397	1.151	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000367988738	418670246	/nfs/dbraw/zinc/67/02/46/418670246.db2.gz	MPJPSEHGSDMWMW-NSHDSACASA-N	1	1	320.349	1.121	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2C[C@@H]3CCS(=O)(=O)[C@@H]3C2)cc1	ZINC000375768253	418683801	/nfs/dbraw/zinc/68/38/01/418683801.db2.gz	MPZPNDQVTCGXRC-GXTWGEPZSA-N	1	1	310.375	1.256	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2C[C@@H]3CCS(=O)(=O)[C@@H]3C2)cc1	ZINC000375768253	418683802	/nfs/dbraw/zinc/68/38/02/418683802.db2.gz	MPZPNDQVTCGXRC-GXTWGEPZSA-N	1	1	310.375	1.256	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000361630098	418693157	/nfs/dbraw/zinc/69/31/57/418693157.db2.gz	SILWVMMRZGCPMN-VXGBXAGGSA-N	1	1	319.361	1.960	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000370910394	418748670	/nfs/dbraw/zinc/74/86/70/418748670.db2.gz	GRAODFNISYEDSE-UHFFFAOYSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000371338592	418779834	/nfs/dbraw/zinc/77/98/34/418779834.db2.gz	FKNXCAUQTBRILU-CYBMUJFWSA-N	1	1	324.344	2.236	20	5		DDBDMO
Cc1nn(C)c(NC2CCN(c3[nH+]ccn3C)CC2)c1[N+](=O)[O-]	ZINC000364611590	418793411	/nfs/dbraw/zinc/79/34/11/418793411.db2.gz	ZFRQHIWGJFUNJE-UHFFFAOYSA-N	1	1	319.369	1.451	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000371372158	418785299	/nfs/dbraw/zinc/78/52/99/418785299.db2.gz	VTLXCJRIQNWDBQ-AWEZNQCLSA-N	1	1	315.333	1.094	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000371372158	418785302	/nfs/dbraw/zinc/78/53/02/418785302.db2.gz	VTLXCJRIQNWDBQ-AWEZNQCLSA-N	1	1	315.333	1.094	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000364923908	418822858	/nfs/dbraw/zinc/82/28/58/418822858.db2.gz	RYSYZPYTUULFJE-NFBGWVBBSA-N	1	1	319.405	1.997	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000420975175	419396938	/nfs/dbraw/zinc/39/69/38/419396938.db2.gz	NUVULYASXZUUSE-LLVKDONJSA-N	1	1	323.349	1.050	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411656130	419373527	/nfs/dbraw/zinc/37/35/27/419373527.db2.gz	PJPSQIHSGCPQHB-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954653	419383924	/nfs/dbraw/zinc/38/39/24/419383924.db2.gz	ZPLPEHVUYXORML-GHMZBOCLSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954653	419383932	/nfs/dbraw/zinc/38/39/32/419383932.db2.gz	ZPLPEHVUYXORML-GHMZBOCLSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412042796	419580016	/nfs/dbraw/zinc/58/00/16/419580016.db2.gz	UMKDNEFYWOJEQQ-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412042796	419580021	/nfs/dbraw/zinc/58/00/21/419580021.db2.gz	UMKDNEFYWOJEQQ-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)n1	ZINC000427844431	419752587	/nfs/dbraw/zinc/75/25/87/419752587.db2.gz	CUKBEFAKMNOQFE-NEPJUHHUSA-N	1	1	323.397	1.756	20	5		DDBDMO
CC1(C)C[C@H](NC[C@@H]2C[NH2+]CCO2)c2cc([N+](=O)[O-])ccc21	ZINC000423580177	420087356	/nfs/dbraw/zinc/08/73/56/420087356.db2.gz	XHTIRRHKOZJKPL-WFASDCNBSA-N	1	1	305.378	1.895	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c1	ZINC000420425890	420278952	/nfs/dbraw/zinc/27/89/52/420278952.db2.gz	VEDFTIKACUGBCS-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@@H]1C[NH3+]	ZINC000424014711	420306880	/nfs/dbraw/zinc/30/68/80/420306880.db2.gz	LUQRKTKIYNTXLS-ZJUUUORDSA-N	1	1	317.349	1.528	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000420606980	420328815	/nfs/dbraw/zinc/32/88/15/420328815.db2.gz	ZBXYWDQTLAGUIX-DGCLKSJQSA-N	1	1	318.377	1.614	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC(Cc2[nH]cc[nH+]2)CC1	ZINC000425298009	420343765	/nfs/dbraw/zinc/34/37/65/420343765.db2.gz	CKXDSIPCEBXGAD-UHFFFAOYSA-N	1	1	318.337	1.146	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H](n3ccnn3)C2)cc1	ZINC000425504905	420403552	/nfs/dbraw/zinc/40/35/52/420403552.db2.gz	XOBLWHNGIPACMW-AWEZNQCLSA-N	1	1	317.349	1.902	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457115292	420619846	/nfs/dbraw/zinc/61/98/46/420619846.db2.gz	KWSBUMIMKVJRGB-SNVBAGLBSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457115292	420619848	/nfs/dbraw/zinc/61/98/48/420619848.db2.gz	KWSBUMIMKVJRGB-SNVBAGLBSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457115292	420619850	/nfs/dbraw/zinc/61/98/50/420619850.db2.gz	KWSBUMIMKVJRGB-SNVBAGLBSA-N	1	1	309.370	1.435	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)C[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452067392	420620547	/nfs/dbraw/zinc/62/05/47/420620547.db2.gz	MHNDMTOVROIHGC-DRZSPHRISA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)C[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452067392	420620549	/nfs/dbraw/zinc/62/05/49/420620549.db2.gz	MHNDMTOVROIHGC-DRZSPHRISA-N	1	1	321.377	1.933	20	5		DDBDMO
COc1ccc(CN[C@@H](C)C[C@@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000422951211	533684437	/nfs/dbraw/zinc/68/44/37/533684437.db2.gz	ZWAARSCEDWYBJX-WCQYABFASA-N	1	1	309.366	1.460	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000454269364	420827903	/nfs/dbraw/zinc/82/79/03/420827903.db2.gz	FNSCDMOKEDHGAP-CQSZACIVSA-N	1	1	322.365	1.563	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@@H+]2CCCO)c(F)c1	ZINC000449384160	421002391	/nfs/dbraw/zinc/00/23/91/421002391.db2.gz	AGVMMESPKGQIKS-AWEZNQCLSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCN2CCCO)c(F)c1	ZINC000449384160	421002393	/nfs/dbraw/zinc/00/23/93/421002393.db2.gz	AGVMMESPKGQIKS-AWEZNQCLSA-N	1	1	311.357	1.670	20	5		DDBDMO
COc1cc(CN2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000449520278	421019961	/nfs/dbraw/zinc/01/99/61/421019961.db2.gz	RSVXHTGLAMSOCO-SMDDNHRTSA-N	1	1	321.377	1.748	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000455879219	421072868	/nfs/dbraw/zinc/07/28/68/421072868.db2.gz	CBBPRZDXJQOUEJ-VHSXEESVSA-N	1	1	319.365	1.387	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@@H+](C)[C@H](C(C)C)C1	ZINC000489375320	421151294	/nfs/dbraw/zinc/15/12/94/421151294.db2.gz	OUUNVGKJNPIQFX-ZDUSSCGKSA-N	1	1	323.397	1.288	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)C[C@H]1[NH+]1CCOCC1	ZINC000450397526	421192762	/nfs/dbraw/zinc/19/27/62/421192762.db2.gz	VWFKRBWZRARDEF-TZMCWYRMSA-N	1	1	306.366	1.537	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000522901425	421227189	/nfs/dbraw/zinc/22/71/89/421227189.db2.gz	YPTZQMBOIQYONW-NSHDSACASA-N	1	1	309.370	1.097	20	5		DDBDMO
CC(=O)N1CC([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000563415735	421506312	/nfs/dbraw/zinc/50/63/12/421506312.db2.gz	FQTKNEMSHVZCDU-UHFFFAOYSA-N	1	1	315.276	1.517	20	5		DDBDMO
CN1C(=O)C[C@@H]([N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010343	421588222	/nfs/dbraw/zinc/58/82/22/421588222.db2.gz	JOZYWROWBHFUFA-GXTWGEPZSA-N	1	1	317.345	1.532	20	5		DDBDMO
CN1C(=O)C[C@@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010343	421588226	/nfs/dbraw/zinc/58/82/26/421588226.db2.gz	JOZYWROWBHFUFA-GXTWGEPZSA-N	1	1	317.345	1.532	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+](CC(C)(C)O)C1CCOCC1	ZINC000531415998	421634132	/nfs/dbraw/zinc/63/41/32/421634132.db2.gz	XJVSRCIAIBADKY-UHFFFAOYSA-N	1	1	312.370	1.080	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000559637073	421836993	/nfs/dbraw/zinc/83/69/93/421836993.db2.gz	HRRYKFUKXAEJBR-MRXNPFEDSA-N	1	1	322.409	1.029	20	5		DDBDMO
Nc1n[nH]c(C2CC[NH+](Cc3ccc(F)cc3[N+](=O)[O-])CC2)n1	ZINC000595488145	422356305	/nfs/dbraw/zinc/35/63/05/422356305.db2.gz	DUIFNEDLUYOPIY-UHFFFAOYSA-N	1	1	320.328	1.814	20	5		DDBDMO
Nc1nc(N[C@@H]2CC[N@H+](C3CCCCC3)C2)ncc1[N+](=O)[O-]	ZINC000596477882	422378598	/nfs/dbraw/zinc/37/85/98/422378598.db2.gz	LHRHJCLTCLUAOX-SNVBAGLBSA-N	1	1	306.370	1.786	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNc2ccc(N)c([N+](=O)[O-])n2)C[C@H](C)O1	ZINC000590584696	422321061	/nfs/dbraw/zinc/32/10/61/422321061.db2.gz	ACIYOHRFQBJYKB-TXEJJXNPSA-N	1	1	323.397	1.873	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000345825497	272345179	/nfs/dbraw/zinc/34/51/79/272345179.db2.gz	SCBZQTMIKKXGCV-AWEZNQCLSA-N	1	1	321.377	1.667	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000345825497	272345181	/nfs/dbraw/zinc/34/51/81/272345181.db2.gz	SCBZQTMIKKXGCV-AWEZNQCLSA-N	1	1	321.377	1.667	20	5		DDBDMO
COc1cc(N2CCC[N@@H+](CCO)CC2)c([N+](=O)[O-])cc1F	ZINC000125342374	274096257	/nfs/dbraw/zinc/09/62/57/274096257.db2.gz	AVFXJNABOLOZRN-UHFFFAOYSA-N	1	1	313.329	1.247	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CN1CCCCC1	ZINC000449095513	274231202	/nfs/dbraw/zinc/23/12/02/274231202.db2.gz	ZBGKHKQLOLBYHY-HOCLYGCPSA-N	1	1	321.421	1.962	20	5		DDBDMO
CC[N@@H+]1CCC[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000060510976	276178933	/nfs/dbraw/zinc/17/89/33/276178933.db2.gz	RVOSCMSUFBJPTH-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000060510976	276178934	/nfs/dbraw/zinc/17/89/34/276178934.db2.gz	RVOSCMSUFBJPTH-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192004	277110691	/nfs/dbraw/zinc/11/06/91/277110691.db2.gz	WVPGHUACUMNUMJ-WZRBSPASSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192004	277110692	/nfs/dbraw/zinc/11/06/92/277110692.db2.gz	WVPGHUACUMNUMJ-WZRBSPASSA-N	1	1	308.338	1.065	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000286001998	277152541	/nfs/dbraw/zinc/15/25/41/277152541.db2.gz	ZAJJBUZCMFAFCU-KGLIPLIRSA-N	1	1	305.334	1.140	20	5		DDBDMO
COC(=O)C1(O)CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000272427239	277310277	/nfs/dbraw/zinc/31/02/77/277310277.db2.gz	HFQIADABIDBYKZ-LBPRGKRZSA-N	1	1	322.361	1.964	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000119537128	281101678	/nfs/dbraw/zinc/10/16/78/281101678.db2.gz	DUMQAJWTSHUZTD-HNNXBMFYSA-N	1	1	319.361	1.200	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000119537128	281101679	/nfs/dbraw/zinc/10/16/79/281101679.db2.gz	DUMQAJWTSHUZTD-HNNXBMFYSA-N	1	1	319.361	1.200	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000248683298	290239993	/nfs/dbraw/zinc/23/99/93/290239993.db2.gz	XTDHZEGWSRCGDX-STQMWFEESA-N	1	1	318.377	1.614	20	5		DDBDMO
[NH3+]CC(F)(F)CN[C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1	ZINC000423333335	295220251	/nfs/dbraw/zinc/22/02/51/295220251.db2.gz	FDVAOWYQRGWDCH-UWVGGRQHSA-N	1	1	303.313	1.459	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000362193321	300025983	/nfs/dbraw/zinc/02/59/83/300025983.db2.gz	YOVXSKKYDKNBIL-DRCTWCGVSA-N	1	1	310.325	1.945	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363052877	300204650	/nfs/dbraw/zinc/20/46/50/300204650.db2.gz	BFFUIIZGLKHCMK-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363052877	300204653	/nfs/dbraw/zinc/20/46/53/300204653.db2.gz	BFFUIIZGLKHCMK-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363052877	300204656	/nfs/dbraw/zinc/20/46/56/300204656.db2.gz	BFFUIIZGLKHCMK-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000363099273	300210798	/nfs/dbraw/zinc/21/07/98/300210798.db2.gz	FQVFTMVTMDHMAQ-OLZOCXBDSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCOC2)O1	ZINC000369868897	301231924	/nfs/dbraw/zinc/23/19/24/301231924.db2.gz	VTDUJVHWLSUALY-AWEZNQCLSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=C1CCCCN1[C@@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000370025038	301260325	/nfs/dbraw/zinc/26/03/25/301260325.db2.gz	CFGITGFRIBQGQC-CYBMUJFWSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]2Cn2cccn2)n1	ZINC000370027046	301261431	/nfs/dbraw/zinc/26/14/31/301261431.db2.gz	NMCWFPGRRKLTIT-CYBMUJFWSA-N	1	1	304.354	1.543	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)c([N+](=O)[O-])c(=O)[nH]1	ZINC000370263411	301304488	/nfs/dbraw/zinc/30/44/88/301304488.db2.gz	XOXPIIFZKQIUQI-CMPLNLGQSA-N	1	1	320.349	1.170	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000370465580	301344799	/nfs/dbraw/zinc/34/47/99/301344799.db2.gz	TWVADDFRNRVSHC-NWDGAFQWSA-N	1	1	323.324	1.327	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H](O)C2(CC2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000364444974	307045863	/nfs/dbraw/zinc/04/58/63/307045863.db2.gz	RFHMFASCNZFKKW-ZDUSSCGKSA-N	1	1	305.334	1.380	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000364905435	307053469	/nfs/dbraw/zinc/05/34/69/307053469.db2.gz	LVXJPPHNFUMHJX-SNVBAGLBSA-N	1	1	319.365	1.319	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000371555458	307153328	/nfs/dbraw/zinc/15/33/28/307153328.db2.gz	UJOFSJKOXGIUOC-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000376875149	307257533	/nfs/dbraw/zinc/25/75/33/307257533.db2.gz	ILLOSPNNURBPIE-GHMZBOCLSA-N	1	1	305.338	1.160	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)[C@H]2C1	ZINC000378507649	307290636	/nfs/dbraw/zinc/29/06/36/307290636.db2.gz	WPDYHAQXBHKEEU-QWRGUYRKSA-N	1	1	302.338	1.168	20	5		DDBDMO
COc1ccc(CN2CCN(c3[nH]cc[nH+]3)CC2)cc1[N+](=O)[O-]	ZINC000515666060	307408617	/nfs/dbraw/zinc/40/86/17/307408617.db2.gz	DGTQKKAVHXGALB-UHFFFAOYSA-N	1	1	317.349	1.649	20	5		DDBDMO
C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1CC(C)(C)O	ZINC000576088864	308287816	/nfs/dbraw/zinc/28/78/16/308287816.db2.gz	LTTWPFKJJDZCOQ-SNVBAGLBSA-N	1	1	312.345	1.410	20	5		DDBDMO
C[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1CC(C)(C)O	ZINC000576088864	308287818	/nfs/dbraw/zinc/28/78/18/308287818.db2.gz	LTTWPFKJJDZCOQ-SNVBAGLBSA-N	1	1	312.345	1.410	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1F	ZINC000590767509	483927892	/nfs/dbraw/zinc/92/78/92/483927892.db2.gz	ILGYEBQLIKQDOU-RNCFNFMXSA-N	1	1	323.324	1.519	20	5		DDBDMO
O=C(N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000374894932	483943704	/nfs/dbraw/zinc/94/37/04/483943704.db2.gz	OEBYETRWWZLCHN-SYQHCUMBSA-N	1	1	307.325	1.053	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000488728634	484215303	/nfs/dbraw/zinc/21/53/03/484215303.db2.gz	FLAAXYDCEIKKJP-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)C[C@@H]1C	ZINC000457141486	534332030	/nfs/dbraw/zinc/33/20/30/534332030.db2.gz	YGXLTHXMAKQIKL-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)C[C@@H]1C	ZINC000457141486	534332037	/nfs/dbraw/zinc/33/20/37/534332037.db2.gz	YGXLTHXMAKQIKL-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)c1[N+](=O)[O-]	ZINC000452345523	534606014	/nfs/dbraw/zinc/60/60/14/534606014.db2.gz	FFOFPWADSJTUSW-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000330871264	527835812	/nfs/dbraw/zinc/83/58/12/527835812.db2.gz	XSUDTOOPBUQWDR-NSHDSACASA-N	1	1	321.381	1.376	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000302456816	528311645	/nfs/dbraw/zinc/31/16/45/528311645.db2.gz	QPDDJNDBRQPHQA-CHWSQXEVSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC1	ZINC000736569973	598628114	/nfs/dbraw/zinc/62/81/14/598628114.db2.gz	LZZZOWAPNXMOPY-UHFFFAOYSA-N	1	1	317.353	1.307	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122591895	696723616	/nfs/dbraw/zinc/72/36/16/696723616.db2.gz	QXUHNIGBYNJVIV-QWHCGFSZSA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CC[C@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122591895	696723617	/nfs/dbraw/zinc/72/36/17/696723617.db2.gz	QXUHNIGBYNJVIV-QWHCGFSZSA-N	1	1	323.397	1.766	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[NH+](Cc3ccccc3)CC2)c1	ZINC000014194819	696054637	/nfs/dbraw/zinc/05/46/37/696054637.db2.gz	YUVLSCAXRHKWAS-UHFFFAOYSA-N	1	1	301.350	1.567	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@@H]1CCCS1(=O)=O	ZINC000134056403	696833081	/nfs/dbraw/zinc/83/30/81/696833081.db2.gz	HWCFHUKVSUGJIO-NSHDSACASA-N	1	1	318.782	1.915	20	5		DDBDMO
CN1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)c2ccc[nH+]c21	ZINC000777712660	698216924	/nfs/dbraw/zinc/21/69/24/698216924.db2.gz	JLBPJHAFLQGDSE-HNNXBMFYSA-N	1	1	314.345	1.980	20	5		DDBDMO
CN1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2ccc[nH+]c21	ZINC000777712662	698217010	/nfs/dbraw/zinc/21/70/10/698217010.db2.gz	JLBPJHAFLQGDSE-OAHLLOKOSA-N	1	1	314.345	1.980	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000246411966	698349334	/nfs/dbraw/zinc/34/93/34/698349334.db2.gz	QSWSDVLYGBYIRR-JSGCOSHPSA-N	1	1	305.382	1.698	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000780867223	698565526	/nfs/dbraw/zinc/56/55/26/698565526.db2.gz	NIYIPRMQGAXSKH-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCOC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000781666837	698638070	/nfs/dbraw/zinc/63/80/70/698638070.db2.gz	WZZYXWPSZPSSDE-JTQLQIEISA-N	1	1	308.338	1.603	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2C[C@]2(CO)C1	ZINC000782627139	698754551	/nfs/dbraw/zinc/75/45/51/698754551.db2.gz	ZBBQUYCTXDHKBM-JRPNMDOOSA-N	1	1	305.334	1.236	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2C[C@]2(CO)C1	ZINC000782627139	698754556	/nfs/dbraw/zinc/75/45/56/698754556.db2.gz	ZBBQUYCTXDHKBM-JRPNMDOOSA-N	1	1	305.334	1.236	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNc2ccc(N)cc2[N+](=O)[O-])C1	ZINC000786574201	699155464	/nfs/dbraw/zinc/15/54/64/699155464.db2.gz	LOQKEAGAEWTPPH-ZDUSSCGKSA-N	1	1	308.382	1.946	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)CC1	ZINC000729527517	699481646	/nfs/dbraw/zinc/48/16/46/699481646.db2.gz	OUXHJWUWEJDWQT-UHFFFAOYSA-N	1	1	306.366	1.653	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000801840421	700344848	/nfs/dbraw/zinc/34/48/48/700344848.db2.gz	MSQAANSBTJCDLO-MRVPVSSYSA-N	1	1	308.313	1.283	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801857540	700347159	/nfs/dbraw/zinc/34/71/59/700347159.db2.gz	FIPXPVRLJVALTE-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
CC[N@H+](CCOC)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000752789129	700387753	/nfs/dbraw/zinc/38/77/53/700387753.db2.gz	NGIABAAUTUHJHC-UHFFFAOYSA-N	1	1	322.365	1.763	20	5		DDBDMO
CC[N@@H+](CCOC)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000752789129	700387755	/nfs/dbraw/zinc/38/77/55/700387755.db2.gz	NGIABAAUTUHJHC-UHFFFAOYSA-N	1	1	322.365	1.763	20	5		DDBDMO
C[N@@H+](C1CCCC1)C(C)(C)C(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC000754878772	700535680	/nfs/dbraw/zinc/53/56/80/700535680.db2.gz	MYHRJRJRFRZOMQ-UHFFFAOYSA-N	1	1	324.381	1.988	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[NH+](C(C)(C)CO)CC1	ZINC000804461590	701191785	/nfs/dbraw/zinc/19/17/85/701191785.db2.gz	MSDQARZMZQYMEN-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000808228583	701509430	/nfs/dbraw/zinc/50/94/30/701509430.db2.gz	VAHXTMRUEOABJW-SNVBAGLBSA-N	1	1	303.322	1.099	20	5		DDBDMO
COCCOCC[N@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000808237386	701510401	/nfs/dbraw/zinc/51/04/01/701510401.db2.gz	OBLXWSZKWHPEQX-UHFFFAOYSA-N	1	1	308.338	1.497	20	5		DDBDMO
COCCOCC[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000808237386	701510402	/nfs/dbraw/zinc/51/04/02/701510402.db2.gz	OBLXWSZKWHPEQX-UHFFFAOYSA-N	1	1	308.338	1.497	20	5		DDBDMO
COC(=O)[C@@]1(C)CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839665961	701772331	/nfs/dbraw/zinc/77/23/31/701772331.db2.gz	JJUMYRBMWKJWQP-ZBFHGGJFSA-N	1	1	322.361	1.903	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839724437	701798243	/nfs/dbraw/zinc/79/82/43/701798243.db2.gz	IDLDZDDNNXPULU-NMFUWQPSSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839724437	701798248	/nfs/dbraw/zinc/79/82/48/701798248.db2.gz	IDLDZDDNNXPULU-NMFUWQPSSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839724437	701798252	/nfs/dbraw/zinc/79/82/52/701798252.db2.gz	IDLDZDDNNXPULU-NMFUWQPSSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000812342133	702165239	/nfs/dbraw/zinc/16/52/39/702165239.db2.gz	JDXBJOMKNSAKGP-KGLIPLIRSA-N	1	1	303.362	1.547	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000842163528	702678941	/nfs/dbraw/zinc/67/89/41/702678941.db2.gz	PEVFRQXIONNIRI-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc(-c3csc(C[NH3+])n3)n2)n1C	ZINC000843221273	702844790	/nfs/dbraw/zinc/84/47/90/702844790.db2.gz	GPWYCHBZNYHZCU-UHFFFAOYSA-N	1	1	321.322	1.269	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(CN2CC([N@H+]3CC[C@@H](O)C3)C2)c1	ZINC000846067716	703233612	/nfs/dbraw/zinc/23/36/12/703233612.db2.gz	JGLJGAKWPIDXMD-CYBMUJFWSA-N	1	1	311.769	1.499	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000869786031	703853228	/nfs/dbraw/zinc/85/32/28/703853228.db2.gz	OGWPPTMUKKANKC-ZDUSSCGKSA-N	1	1	321.377	1.099	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[NH2+][C@H](c2ccc(O)cc2)C1)[N+](=O)[O-]	ZINC000870089369	703912740	/nfs/dbraw/zinc/91/27/40/703912740.db2.gz	AWJHTSSSMHICRI-AWEZNQCLSA-N	1	1	321.377	1.701	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCC2	ZINC000818969312	704037251	/nfs/dbraw/zinc/03/72/51/704037251.db2.gz	CPQYEHDJLBDYND-ZWNOBZJWSA-N	1	1	317.349	1.517	20	5		DDBDMO
CCC[N@@H+]1CC[C@@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981751	704042093	/nfs/dbraw/zinc/04/20/93/704042093.db2.gz	YFTGFRGSOQYMPU-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981751	704042096	/nfs/dbraw/zinc/04/20/96/704042096.db2.gz	YFTGFRGSOQYMPU-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853500389	704251562	/nfs/dbraw/zinc/25/15/62/704251562.db2.gz	JNOASLJTOYDDEE-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853500389	704251564	/nfs/dbraw/zinc/25/15/64/704251564.db2.gz	JNOASLJTOYDDEE-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[NH+](C)C1CCC2(CC1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC000854675902	704438221	/nfs/dbraw/zinc/43/82/21/704438221.db2.gz	UYVSAHCHBFTVQP-ZIAGYGMSSA-N	1	1	309.410	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(NCC[N@@H+]3CC[C@@H](O)C3)sc2c1	ZINC000858812849	704760812	/nfs/dbraw/zinc/76/08/12/704760812.db2.gz	VNGOJRMPHUPKGD-SNVBAGLBSA-N	1	1	308.363	1.683	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000874843458	705198503	/nfs/dbraw/zinc/19/85/03/705198503.db2.gz	NMZLDTOULMOHFI-HUUCEWRRSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@@](C)(O)c1ccccc1	ZINC000823592243	705275109	/nfs/dbraw/zinc/27/51/09/705275109.db2.gz	QLZAVHRHJOJNME-OAHLLOKOSA-N	1	1	304.350	1.631	20	5		DDBDMO
CN(CC1=CCSC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000876978130	705946671	/nfs/dbraw/zinc/94/66/71/705946671.db2.gz	HDEZBHCNPCIYDD-HNNXBMFYSA-N	1	1	321.402	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC[C@@H]21	ZINC000827269715	705964759	/nfs/dbraw/zinc/96/47/59/705964759.db2.gz	ZCDXABHKJXFDJJ-ZANVPECISA-N	1	1	322.340	1.482	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827278609	705967175	/nfs/dbraw/zinc/96/71/75/705967175.db2.gz	XLANGEAKKQFEIA-AAEUAGOBSA-N	1	1	318.377	1.803	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CC[N@H+]2C)C1	ZINC000827363735	705985271	/nfs/dbraw/zinc/98/52/71/705985271.db2.gz	CABPIJKYHGOBSC-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000863833492	706024473	/nfs/dbraw/zinc/02/44/73/706024473.db2.gz	QBMUFEZIHUGANZ-PABFRNLHSA-N	1	1	319.361	1.181	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@](C)(C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000877578331	706147857	/nfs/dbraw/zinc/14/78/57/706147857.db2.gz	BCMXQGHJJDMNPM-OAHLLOKOSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@](C)(C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000877578331	706147861	/nfs/dbraw/zinc/14/78/61/706147861.db2.gz	BCMXQGHJJDMNPM-OAHLLOKOSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCCCCNC(=O)CC2)c([N+](=O)[O-])n1	ZINC000877685314	706178767	/nfs/dbraw/zinc/17/87/67/706178767.db2.gz	UOTPPYVJYNZDMR-UHFFFAOYSA-N	1	1	309.370	1.211	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CC[NH+](C(C)(C)CO)CC1	ZINC000881985976	707455302	/nfs/dbraw/zinc/45/53/02/707455302.db2.gz	ANPUIFDYPLKCJQ-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000880608422	707038579	/nfs/dbraw/zinc/03/85/79/707038579.db2.gz	AZQDUAYRUHSVEZ-PHIMTYICSA-N	1	1	306.366	1.732	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCN(C)c3ncccc3C2)c([N+](=O)[O-])n1	ZINC000872265008	707354721	/nfs/dbraw/zinc/35/47/21/707354721.db2.gz	CXEZADPYPRLNKR-UHFFFAOYSA-N	1	1	302.338	1.175	20	5		DDBDMO
Cn1cc(C[N@H+]2CCN(C)c3ncccc3C2)c([N+](=O)[O-])n1	ZINC000872265008	707354724	/nfs/dbraw/zinc/35/47/24/707354724.db2.gz	CXEZADPYPRLNKR-UHFFFAOYSA-N	1	1	302.338	1.175	20	5		DDBDMO
C[N@@H+](CCOC(=O)Cn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000837446498	707650828	/nfs/dbraw/zinc/65/08/28/707650828.db2.gz	OCTDQOOFEUHHLO-UHFFFAOYSA-N	1	1	318.333	1.467	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000882481047	707651284	/nfs/dbraw/zinc/65/12/84/707651284.db2.gz	DGMKUKZYXRHYAG-GFCCVEGCSA-N	1	1	309.391	1.897	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000838137345	707851078	/nfs/dbraw/zinc/85/10/78/707851078.db2.gz	QOWQCNNLWYXGAI-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)n1	ZINC000896913893	708180866	/nfs/dbraw/zinc/18/08/66/708180866.db2.gz	XFFHUQSBMHDZPD-ZUZCIYMTSA-N	1	1	320.349	1.164	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897216828	708256128	/nfs/dbraw/zinc/25/61/28/708256128.db2.gz	VTKMGRUDZGWOLA-CHWSQXEVSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000885931573	708665303	/nfs/dbraw/zinc/66/53/03/708665303.db2.gz	VRBYSPJECBHZIO-AWEZNQCLSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cn2cncn2)CC1	ZINC000886147217	708704950	/nfs/dbraw/zinc/70/49/50/708704950.db2.gz	MATUOKFSGMCDBQ-UHFFFAOYSA-N	1	1	302.338	1.494	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202723	708714073	/nfs/dbraw/zinc/71/40/73/708714073.db2.gz	CKGMAGXJXYAMCP-JSGCOSHPSA-N	1	1	306.366	1.285	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202723	708714075	/nfs/dbraw/zinc/71/40/75/708714075.db2.gz	CKGMAGXJXYAMCP-JSGCOSHPSA-N	1	1	306.366	1.285	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cccnc1[N+](=O)[O-])C2	ZINC000886316801	708741331	/nfs/dbraw/zinc/74/13/31/708741331.db2.gz	NIOQCWOUTLZSHC-WFASDCNBSA-N	1	1	305.334	1.765	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@@H]3[C@H](O)CC[C@@H]3C2)c2c(c1)COCO2	ZINC000886581634	708781395	/nfs/dbraw/zinc/78/13/95/708781395.db2.gz	GSJRKLHXOVSRQX-WKPIXPDZSA-N	1	1	320.345	1.664	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000910285166	709866269	/nfs/dbraw/zinc/86/62/69/709866269.db2.gz	RAXXGUCSOSSIEO-LBPRGKRZSA-N	1	1	323.397	1.469	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)[C@H](C)C1	ZINC000910285950	709866970	/nfs/dbraw/zinc/86/69/70/709866970.db2.gz	DKELSMJLLSQJRV-GFCCVEGCSA-N	1	1	323.397	1.433	20	5		DDBDMO
O=C(COC1CC1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000893052289	710547404	/nfs/dbraw/zinc/54/74/04/710547404.db2.gz	AJWOBSMNLPCWKI-HNNXBMFYSA-N	1	1	320.345	1.891	20	5		DDBDMO
O=C(COC1CC1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000893052289	710547405	/nfs/dbraw/zinc/54/74/05/710547405.db2.gz	AJWOBSMNLPCWKI-HNNXBMFYSA-N	1	1	320.345	1.891	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CC[C@H](O)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000893884549	710873998	/nfs/dbraw/zinc/87/39/98/710873998.db2.gz	FANNZIQELAMUIS-LBPRGKRZSA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](O)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000893884549	710874000	/nfs/dbraw/zinc/87/40/00/710874000.db2.gz	FANNZIQELAMUIS-LBPRGKRZSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCCF	ZINC000894255987	711039302	/nfs/dbraw/zinc/03/93/02/711039302.db2.gz	AUZAUZYLDNUXES-MRVPVSSYSA-N	1	1	303.721	1.812	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1CO	ZINC000894885140	711308568	/nfs/dbraw/zinc/30/85/68/711308568.db2.gz	OOVAZUBFBILKGL-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1CO	ZINC000894885140	711308571	/nfs/dbraw/zinc/30/85/71/711308571.db2.gz	OOVAZUBFBILKGL-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
Cc1c(C[C@H](C[NH3+])CNCc2ccccc2[N+](=O)[O-])cnn1C	ZINC000903923042	711333497	/nfs/dbraw/zinc/33/34/97/711333497.db2.gz	KEAUCNJMOZUWQC-CYBMUJFWSA-N	1	1	317.393	1.544	20	5		DDBDMO
C[C@@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1C[NH3+]	ZINC000904410718	711854396	/nfs/dbraw/zinc/85/43/96/711854396.db2.gz	FYBCPMLRQTXRGB-VXGBXAGGSA-N	1	1	321.377	1.783	20	5		DDBDMO
CCOc1ccccc1C[N@@H+]1CCN(CC[N+](=O)[O-])[C@@H](C)C1	ZINC000930321996	713803019	/nfs/dbraw/zinc/80/30/19/713803019.db2.gz	BUABQDDBRBKQQY-AWEZNQCLSA-N	1	1	307.394	1.868	20	5		DDBDMO
CCOc1ccccc1C[N@H+]1CCN(CC[N+](=O)[O-])[C@@H](C)C1	ZINC000930321996	713803022	/nfs/dbraw/zinc/80/30/22/713803022.db2.gz	BUABQDDBRBKQQY-AWEZNQCLSA-N	1	1	307.394	1.868	20	5		DDBDMO
O=C(CN1CCn2cc[nH+]c21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000931522599	714118790	/nfs/dbraw/zinc/11/87/90/714118790.db2.gz	HTCQGTYLOBEPER-UHFFFAOYSA-N	1	1	313.317	1.201	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNC[C@@H]2CC[N@@H+]2C2CCOCC2)c1	ZINC000922951624	714196129	/nfs/dbraw/zinc/19/61/29/714196129.db2.gz	PYPULANVHDVEGZ-INIZCTEOSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNC[C@@H]2CC[N@H+]2C2CCOCC2)c1	ZINC000922951624	714196131	/nfs/dbraw/zinc/19/61/31/714196131.db2.gz	PYPULANVHDVEGZ-INIZCTEOSA-N	1	1	305.378	1.938	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2	ZINC000923269446	714291631	/nfs/dbraw/zinc/29/16/31/714291631.db2.gz	MNOWYAJFEISNCS-YPMHNXCESA-N	1	1	319.361	1.912	20	5		DDBDMO
CC(C)(C)NC(=O)[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000932439104	714331567	/nfs/dbraw/zinc/33/15/67/714331567.db2.gz	FDVZOKGQOGYCIX-LBPRGKRZSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)(C)NC(=O)[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000932439104	714331570	/nfs/dbraw/zinc/33/15/70/714331570.db2.gz	FDVZOKGQOGYCIX-LBPRGKRZSA-N	1	1	309.370	1.170	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000933170682	714526943	/nfs/dbraw/zinc/52/69/43/714526943.db2.gz	KNCKQGHXJQPFLT-UXIGCNINSA-N	1	1	322.361	1.902	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)CC[C@H]1CCCC[N@H+]1C	ZINC000933623412	714633372	/nfs/dbraw/zinc/63/33/72/714633372.db2.gz	QSOHSNUOASNRCI-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC000933731805	714657810	/nfs/dbraw/zinc/65/78/10/714657810.db2.gz	HHBHDEVBQLLIBA-XJKSGUPXSA-N	1	1	305.378	1.987	20	5		DDBDMO
CN1CCN(CCc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)CC1	ZINC000933995590	714718188	/nfs/dbraw/zinc/71/81/88/714718188.db2.gz	FIGWZQPGPMDDCT-UHFFFAOYSA-N	1	1	306.410	1.317	20	5		DDBDMO
CN1CCN(C)CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000933995590	714718190	/nfs/dbraw/zinc/71/81/90/714718190.db2.gz	FIGWZQPGPMDDCT-UHFFFAOYSA-N	1	1	306.410	1.317	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115525	714745271	/nfs/dbraw/zinc/74/52/71/714745271.db2.gz	ATJKKNOKBRBEEN-ZFWWWQNUSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115525	714745272	/nfs/dbraw/zinc/74/52/72/714745272.db2.gz	ATJKKNOKBRBEEN-ZFWWWQNUSA-N	1	1	319.361	1.593	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CC[C@H]1OC	ZINC000934121500	714747778	/nfs/dbraw/zinc/74/77/78/714747778.db2.gz	NARZHFGRVQTBRZ-QWHCGFSZSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CC[C@H]1OC	ZINC000934121500	714747779	/nfs/dbraw/zinc/74/77/79/714747779.db2.gz	NARZHFGRVQTBRZ-QWHCGFSZSA-N	1	1	323.349	1.651	20	5		DDBDMO
O=C1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCCCCN1	ZINC000934155738	714756282	/nfs/dbraw/zinc/75/62/82/714756282.db2.gz	SQPKTTREOUERDI-OAHLLOKOSA-N	1	1	321.377	1.620	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934252388	714774719	/nfs/dbraw/zinc/77/47/19/714774719.db2.gz	MOODQSACGBAKRJ-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H]2[C@@H]1CCCN2CCO	ZINC000934252388	714774720	/nfs/dbraw/zinc/77/47/20/714774720.db2.gz	MOODQSACGBAKRJ-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H]2[C@@H]1CCCN2CCO	ZINC000934252388	714774721	/nfs/dbraw/zinc/77/47/21/714774721.db2.gz	MOODQSACGBAKRJ-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)cs1	ZINC000934258099	714777718	/nfs/dbraw/zinc/77/77/18/714777718.db2.gz	PWLFCIIGQNUBOP-STQMWFEESA-N	1	1	311.407	1.687	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928550	721854372	/nfs/dbraw/zinc/85/43/72/721854372.db2.gz	OFDFHGNKIGDNSP-KGLIPLIRSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928550	721854373	/nfs/dbraw/zinc/85/43/73/721854373.db2.gz	OFDFHGNKIGDNSP-KGLIPLIRSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1	ZINC001020140114	736999213	/nfs/dbraw/zinc/99/92/13/736999213.db2.gz	ZGANVFSRBYMGAX-KLHDSHLOSA-N	1	1	317.389	1.705	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)C1CCC1	ZINC001031511144	746922884	/nfs/dbraw/zinc/92/28/84/746922884.db2.gz	XLVRWFVBKHODLP-UHFFFAOYSA-N	1	1	303.362	1.943	20	5		DDBDMO
CC(C)OCCC[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001200471831	748265485	/nfs/dbraw/zinc/26/54/85/748265485.db2.gz	JUVQMRTWKVHQMU-ZIAGYGMSSA-N	1	1	313.398	1.047	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCc2ccccc2)CC1	ZINC000996428453	749586069	/nfs/dbraw/zinc/58/60/69/749586069.db2.gz	DRQYIHQBCXIQTI-HZPDHXFCSA-N	1	1	317.389	1.475	20	5		DDBDMO
Cc1csc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)n1	ZINC000996429702	749588851	/nfs/dbraw/zinc/58/88/51/749588851.db2.gz	SSDQHOMUYIOSDP-VXGBXAGGSA-N	1	1	324.406	1.197	20	5		DDBDMO
CC(C)(C)OC(=O)c1ccc(-n2cnc(C[NH3+])n2)cc1[N+](=O)[O-]	ZINC001168753431	750368307	/nfs/dbraw/zinc/36/83/07/750368307.db2.gz	BGIHJXODNJHQBY-UHFFFAOYSA-N	1	1	319.321	1.590	20	5		DDBDMO
Cc1conc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001034644417	750626271	/nfs/dbraw/zinc/62/62/71/750626271.db2.gz	GLYBUBBXFQUJRN-HKUMRIAESA-N	1	1	322.365	1.165	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](Cc2ccsc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000674016	762078616	/nfs/dbraw/zinc/07/86/16/762078616.db2.gz	KYGCQHBAUFXSCN-ZIAGYGMSSA-N	1	1	321.402	1.662	20	5		DDBDMO
O=C(NCC1=CC[N@H+](Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674016	762078623	/nfs/dbraw/zinc/07/86/23/762078623.db2.gz	KYGCQHBAUFXSCN-ZIAGYGMSSA-N	1	1	321.402	1.662	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674016	762078630	/nfs/dbraw/zinc/07/86/30/762078630.db2.gz	KYGCQHBAUFXSCN-ZIAGYGMSSA-N	1	1	321.402	1.662	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC001129080698	751247302	/nfs/dbraw/zinc/24/73/02/751247302.db2.gz	VGECPZAUWXQULS-OEAJRASXSA-N	1	1	315.373	1.861	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC001097212392	756983170	/nfs/dbraw/zinc/98/31/70/756983170.db2.gz	SSEQIWGTNMEXOK-BETUJISGSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=C(C1C[NH+]([C@@H]2CCOC2)C1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000827974858	759433286	/nfs/dbraw/zinc/43/32/86/759433286.db2.gz	HYVULXXIRXPGFU-GFCCVEGCSA-N	1	1	317.345	1.205	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@]12CC[N@@H+](C1)CCC2	ZINC000829048852	759871222	/nfs/dbraw/zinc/87/12/22/759871222.db2.gz	BNASQRQLDYMNPW-INIZCTEOSA-N	1	1	303.362	1.739	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCCCC3)C[C@@H]2C1	ZINC001048812843	769932100	/nfs/dbraw/zinc/93/21/00/769932100.db2.gz	QUYXJCPFRRLIOP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CC3CCCCC3)C[C@@H]2C1	ZINC001048812843	769932106	/nfs/dbraw/zinc/93/21/06/769932106.db2.gz	QUYXJCPFRRLIOP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCCCC3)C[C@@H]2C1	ZINC001048812843	769932112	/nfs/dbraw/zinc/93/21/12/769932112.db2.gz	QUYXJCPFRRLIOP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
CC/C=C\CC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001147506994	773155299	/nfs/dbraw/zinc/15/52/99/773155299.db2.gz	JMZLMYJCHMZFPJ-JHZNUDOXSA-N	1	1	307.394	1.542	20	5		DDBDMO
CC/C=C\CC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147506994	773155302	/nfs/dbraw/zinc/15/53/02/773155302.db2.gz	JMZLMYJCHMZFPJ-JHZNUDOXSA-N	1	1	307.394	1.542	20	5		DDBDMO
CC/C=C\CC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147506994	773155303	/nfs/dbraw/zinc/15/53/03/773155303.db2.gz	JMZLMYJCHMZFPJ-JHZNUDOXSA-N	1	1	307.394	1.542	20	5		DDBDMO
Cc1cc(NCCNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC001093673977	774988338	/nfs/dbraw/zinc/98/83/38/774988338.db2.gz	GWVPBFJRWIRHHV-UHFFFAOYSA-N	1	1	308.382	1.772	20	5		DDBDMO
Cc1cnc(NCCNC(=O)C[N@H+](C)C2CCC2)c([N+](=O)[O-])c1	ZINC001094221351	775542503	/nfs/dbraw/zinc/54/25/03/775542503.db2.gz	AQTWEEVIUHEDPW-UHFFFAOYSA-N	1	1	321.381	1.311	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907533	776918072	/nfs/dbraw/zinc/91/80/72/776918072.db2.gz	GXQVGZYIALVFLJ-RISCZKNCSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907533	776918078	/nfs/dbraw/zinc/91/80/78/776918078.db2.gz	GXQVGZYIALVFLJ-RISCZKNCSA-N	1	1	303.362	1.663	20	5		DDBDMO
CN(C)C(=O)C[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172915524	776929954	/nfs/dbraw/zinc/92/99/54/776929954.db2.gz	NXVUPSKIAFRQSE-AWEZNQCLSA-N	1	1	305.378	1.862	20	5		DDBDMO
Cn1cc([C@@H]2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)nn1	ZINC001176887849	778295263	/nfs/dbraw/zinc/29/52/63/778295263.db2.gz	VEPWSPBGWYDVPP-LLVKDONJSA-N	1	1	302.338	1.498	20	5		DDBDMO
Cn1cc([C@@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)nn1	ZINC001176887849	778295270	/nfs/dbraw/zinc/29/52/70/778295270.db2.gz	VEPWSPBGWYDVPP-LLVKDONJSA-N	1	1	302.338	1.498	20	5		DDBDMO
O=c1c2ccccc2ncn1C1CC[NH+](CC[N+](=O)[O-])CC1	ZINC001176994963	778378743	/nfs/dbraw/zinc/37/87/43/778378743.db2.gz	FNGCMCKASFJGKZ-UHFFFAOYSA-N	1	1	302.334	1.310	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC001177515057	778630631	/nfs/dbraw/zinc/63/06/31/778630631.db2.gz	YWEMNOJSTFSERP-UHFFFAOYSA-N	1	1	303.322	1.366	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001326482968	861401821	/nfs/dbraw/zinc/40/18/21/861401821.db2.gz	RPNNPAOIBDOEBH-KCPJHIHWSA-N	1	1	321.377	1.427	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1	ZINC001149922385	861976852	/nfs/dbraw/zinc/97/68/52/861976852.db2.gz	DDGHDBOWQVHEDI-GFCCVEGCSA-N	1	1	317.301	1.680	20	5		DDBDMO
COCCC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](C(C)C)CC1	ZINC001151121809	862636431	/nfs/dbraw/zinc/63/64/31/862636431.db2.gz	UGWDNXDFRNZPQQ-CHWSQXEVSA-N	1	1	313.398	1.047	20	5		DDBDMO
CC1(C)CC(C[N@H+]2CCC3(CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C3)C2)C1	ZINC001072724763	857642109	/nfs/dbraw/zinc/64/21/09/857642109.db2.gz	DORCAEIRQYMEAC-ZIAGYGMSSA-N	1	1	321.421	1.622	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)C1	ZINC001072724763	857642114	/nfs/dbraw/zinc/64/21/14/857642114.db2.gz	DORCAEIRQYMEAC-ZIAGYGMSSA-N	1	1	321.421	1.622	20	5		DDBDMO
CC1(C)CC(C[N@H+]2CCC3(CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C3)C2)C1	ZINC001072724763	857642116	/nfs/dbraw/zinc/64/21/16/857642116.db2.gz	DORCAEIRQYMEAC-ZIAGYGMSSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H](F)C1)NCCc1ccc([N+](=O)[O-])cc1	ZINC001142082212	861014749	/nfs/dbraw/zinc/01/47/49/861014749.db2.gz	BIRIVIFRWIMOSM-CYBMUJFWSA-N	1	1	309.341	1.687	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2ccc(NCC3([NH+]4CCCC4)COC3)nc21	ZINC001157655280	864020618	/nfs/dbraw/zinc/02/06/18/864020618.db2.gz	NLEMSZWVRCRDRY-UHFFFAOYSA-N	1	1	317.349	1.748	20	5		DDBDMO
Cc1cccc(OCC[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157775841	864131510	/nfs/dbraw/zinc/13/15/10/864131510.db2.gz	ZZEFWDDTIDVJCO-HUUCEWRRSA-N	1	1	321.377	1.135	20	5		DDBDMO
C[C@@H]1CN(c2ncc([N+](=O)[O-])c3ccccc32)CC[N@H+]1CCO	ZINC001331599355	865175080	/nfs/dbraw/zinc/17/50/80/865175080.db2.gz	CPNPWDXUWHTRBQ-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1nc(Cl)nc(C)c1[N+](=O)[O-]	ZINC001159293841	865207975	/nfs/dbraw/zinc/20/79/75/865207975.db2.gz	ZWKNSQAAWUSDCY-UHFFFAOYSA-N	1	1	312.717	1.048	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC001159884671	865581852	/nfs/dbraw/zinc/58/18/52/865581852.db2.gz	JVHDOLJHPXIQHN-GVXVVHGQSA-N	1	1	304.350	1.247	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](C(=O)NC3CC3)C2)c1[N+](=O)[O-]	ZINC001333581881	866859111	/nfs/dbraw/zinc/85/91/11/866859111.db2.gz	HNSRLWQAICAPCA-JTQLQIEISA-N	1	1	308.338	1.382	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](C(=O)NC3CC3)C2)c1[N+](=O)[O-]	ZINC001333581881	866859131	/nfs/dbraw/zinc/85/91/31/866859131.db2.gz	HNSRLWQAICAPCA-JTQLQIEISA-N	1	1	308.338	1.382	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NCCC[N@H+]1CCCO[C@H](C)C1	ZINC001322552431	868242300	/nfs/dbraw/zinc/24/23/00/868242300.db2.gz	CVSLKDAHLTWUPF-CYBMUJFWSA-N	1	1	308.382	1.633	20	5		DDBDMO
CC(C)[N@H+](C)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC001335365110	868251219	/nfs/dbraw/zinc/25/12/19/868251219.db2.gz	AGSIURQAOFYGPW-CQSZACIVSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC001335365110	868251235	/nfs/dbraw/zinc/25/12/35/868251235.db2.gz	AGSIURQAOFYGPW-CQSZACIVSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](Oc2ccc([N+](=O)[O-])cc2C(N)=O)C1	ZINC001226173299	882249926	/nfs/dbraw/zinc/24/99/26/882249926.db2.gz	RXCLVLPOQXMHRD-GFCCVEGCSA-N	1	1	307.350	1.945	20	5		DDBDMO
[NH3+][C@@H]1CN(c2cnc3ccc([N+](=O)[O-])cc3n2)CCC1(F)F	ZINC001164319746	869123982	/nfs/dbraw/zinc/12/39/82/869123982.db2.gz	OAMWOPLZFHEBNB-LLVKDONJSA-N	1	1	309.276	1.711	20	5		DDBDMO
Cc1[nH+]cc2n1CCN(c1ncc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001165385593	869558530	/nfs/dbraw/zinc/55/85/30/869558530.db2.gz	XZNDUNHEHHGMIM-UHFFFAOYSA-N	1	1	304.266	1.423	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C	ZINC001339265102	870428469	/nfs/dbraw/zinc/42/84/69/870428469.db2.gz	OXYCMCCZRVYGIL-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC001340021302	870845907	/nfs/dbraw/zinc/84/59/07/870845907.db2.gz	RTJBFQCCISPCDV-QWHCGFSZSA-N	1	1	322.413	1.038	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cccc([N+](=O)[O-])c3N)[C@H]2C1	ZINC001305873766	871307403	/nfs/dbraw/zinc/30/74/03/871307403.db2.gz	KQCIQNDXWBBDPU-ZMLRMANQSA-N	1	1	304.350	1.247	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNc2nn(C)cc2[N+](=O)[O-])C[C@@H](C)O1	ZINC001306922206	871381014	/nfs/dbraw/zinc/38/10/14/871381014.db2.gz	IJQSSDRFHYEKGK-GHMZBOCLSA-N	1	1	311.386	1.628	20	5		DDBDMO
COC(=O)CC(C)(C)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC001340963500	871442330	/nfs/dbraw/zinc/44/23/30/871442330.db2.gz	ZRPLRDXJEOYQFV-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](c3ncccn3)C2)cc1	ZINC001308111071	871471554	/nfs/dbraw/zinc/47/15/54/871471554.db2.gz	BMDWUSCEEIVSQE-DZGCQCFKSA-N	1	1	314.345	1.908	20	5		DDBDMO
CCN(C)C(=O)[C@@H](C)[NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC001308730775	871523868	/nfs/dbraw/zinc/52/38/68/871523868.db2.gz	WJHGVGZUGLIGOY-SECBINFHSA-N	1	1	311.338	1.265	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC001310094312	871620065	/nfs/dbraw/zinc/62/00/65/871620065.db2.gz	FSOHZBNUSRZZHS-LBPRGKRZSA-N	1	1	322.365	1.562	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC001352915739	877005280	/nfs/dbraw/zinc/00/52/80/877005280.db2.gz	DJLQETHWDVNUFU-GFCCVEGCSA-N	1	1	319.365	1.422	20	5		DDBDMO
C[C@@H]([NH2+]CC[N+](=O)[O-])C(=O)Nc1cccc(N2CCCC2)c1	ZINC001356582381	879111463	/nfs/dbraw/zinc/11/14/63/879111463.db2.gz	FIZWNNFVGBYETP-GFCCVEGCSA-N	1	1	306.366	1.480	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3nccc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228014393	883285617	/nfs/dbraw/zinc/28/56/17/883285617.db2.gz	KDVZYRWAXWNGNB-XROYCOCOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3nccc(Cl)c3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001228014393	883285628	/nfs/dbraw/zinc/28/56/28/883285628.db2.gz	KDVZYRWAXWNGNB-XROYCOCOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@@H+]1CCO[C@H](COc2c3ccccc3oc(=O)c2[N+](=O)[O-])C1	ZINC001228803517	883680013	/nfs/dbraw/zinc/68/00/13/883680013.db2.gz	CCCAVUAMVZDFPE-JTQLQIEISA-N	1	1	320.301	1.411	20	5		DDBDMO
C[N@H+]1CCO[C@H](COc2c3ccccc3oc(=O)c2[N+](=O)[O-])C1	ZINC001228803517	883680018	/nfs/dbraw/zinc/68/00/18/883680018.db2.gz	CCCAVUAMVZDFPE-JTQLQIEISA-N	1	1	320.301	1.411	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(F)c([N+](=O)[O-])cc2F)C1	ZINC001233599649	887140115	/nfs/dbraw/zinc/14/01/15/887140115.db2.gz	LDMJIHDNPKTEIQ-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
COC(=O)c1cnc(O[C@H]2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC001233860350	887398996	/nfs/dbraw/zinc/39/89/96/887398996.db2.gz	ZVJOFZYBBHAOIP-NSHDSACASA-N	1	1	309.322	1.640	20	5		DDBDMO
COc1cc(CC[N+](=O)[O-])ccc1OCC[N@@H+]1CC[C@@H](OC)C1	ZINC001233984332	887525226	/nfs/dbraw/zinc/52/52/26/887525226.db2.gz	GQRAZZWGLDOMLX-CQSZACIVSA-N	1	1	324.377	1.614	20	5		DDBDMO
CCCOCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001235137561	888430827	/nfs/dbraw/zinc/43/08/27/888430827.db2.gz	OHGLYNGQZZCGIV-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
[NH3+]C[C@]1(N[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CN2CCC1CC2	ZINC001254580891	896513990	/nfs/dbraw/zinc/51/39/90/896513990.db2.gz	HTTVOUBZSLYYPJ-RDJZCZTQSA-N	1	1	316.405	1.075	20	5		DDBDMO
O=C1NCC[C@@]12CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254594366	896522832	/nfs/dbraw/zinc/52/28/32/896522832.db2.gz	QIINQQHGKCDKHJ-ZBFHGGJFSA-N	1	1	301.346	1.274	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCCC3(C1)OCCO3)C2	ZINC001254602380	896528222	/nfs/dbraw/zinc/52/82/22/896528222.db2.gz	FEYNJGRFGKTPLU-HNNXBMFYSA-N	1	1	304.346	1.901	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001293327197	914416670	/nfs/dbraw/zinc/41/66/70/914416670.db2.gz	DIWDQXOJEJMNCT-NSHDSACASA-N	1	1	307.354	1.176	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1CO	ZINC000248934204	282118655	/nfs/dbraw/zinc/11/86/55/282118655.db2.gz	MYQNXVSWHMYHLY-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CN1CCN(C(=O)CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000278725083	214356615	/nfs/dbraw/zinc/35/66/15/214356615.db2.gz	VKFJVRLOEAREMV-UHFFFAOYSA-N	1	1	320.393	1.191	20	5		DDBDMO
CO[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000451576903	231129881	/nfs/dbraw/zinc/12/98/81/231129881.db2.gz	VCDXAVXYBVYCHT-FZMZJTMJSA-N	1	1	307.350	1.890	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000451576903	231129884	/nfs/dbraw/zinc/12/98/84/231129884.db2.gz	VCDXAVXYBVYCHT-FZMZJTMJSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000451634545	231146694	/nfs/dbraw/zinc/14/66/94/231146694.db2.gz	RQCMMHGSWHRGIR-SLEUVZQESA-N	1	1	318.377	1.558	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000452063834	231287711	/nfs/dbraw/zinc/28/77/11/231287711.db2.gz	CKWOCFPCJRPCEB-FZMZJTMJSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000452063834	231287713	/nfs/dbraw/zinc/28/77/13/231287713.db2.gz	CKWOCFPCJRPCEB-FZMZJTMJSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)[C@@H]2C1	ZINC000425060995	529821696	/nfs/dbraw/zinc/82/16/96/529821696.db2.gz	XEULJONHWSURBR-WCQYABFASA-N	1	1	321.381	1.079	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000330799865	232078182	/nfs/dbraw/zinc/07/81/82/232078182.db2.gz	ZAHXMQPEFLRABH-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000330799865	232078185	/nfs/dbraw/zinc/07/81/85/232078185.db2.gz	ZAHXMQPEFLRABH-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1	ZINC000272659566	210065584	/nfs/dbraw/zinc/06/55/84/210065584.db2.gz	BRSGBXCBIVDJNX-LBPRGKRZSA-N	1	1	319.361	1.740	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1	ZINC000048426747	352539028	/nfs/dbraw/zinc/53/90/28/352539028.db2.gz	LPUJNRZVVVDUGV-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
CCOc1ccc([C@@H](C)[NH2+]Cc2cnnn2C)cc1[N+](=O)[O-]	ZINC000287188753	219369545	/nfs/dbraw/zinc/36/95/45/219369545.db2.gz	CZVLZKKVHPLZTE-SNVBAGLBSA-N	1	1	305.338	1.973	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000189982405	186258230	/nfs/dbraw/zinc/25/82/30/186258230.db2.gz	AMSILJNNGGFGNC-UHFFFAOYSA-N	1	1	300.384	1.334	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC(C)(C)O	ZINC000265154233	186342496	/nfs/dbraw/zinc/34/24/96/186342496.db2.gz	UGGGZIFGEYPIGG-UHFFFAOYSA-N	1	1	307.350	1.187	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000266853564	186359774	/nfs/dbraw/zinc/35/97/74/186359774.db2.gz	FRQGNQMORRHOQI-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000266853564	186359775	/nfs/dbraw/zinc/35/97/75/186359775.db2.gz	FRQGNQMORRHOQI-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000601235249	358458501	/nfs/dbraw/zinc/45/85/01/358458501.db2.gz	NESCJRFERVPUFK-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
CNc1ccc(C(=O)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000027689158	352221813	/nfs/dbraw/zinc/22/18/13/352221813.db2.gz	MNZBLIPWXZEUOS-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
C[C@H](c1cccc(O)c1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000072630226	191206141	/nfs/dbraw/zinc/20/61/41/191206141.db2.gz	QFZOFCAXHORIPK-ABAIWWIYSA-N	1	1	320.349	1.551	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072664885	191211959	/nfs/dbraw/zinc/21/19/59/191211959.db2.gz	LJHPUOYFLNYMTN-LLVKDONJSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072664885	191211962	/nfs/dbraw/zinc/21/19/62/191211962.db2.gz	LJHPUOYFLNYMTN-LLVKDONJSA-N	1	1	321.381	1.391	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172890033	198163444	/nfs/dbraw/zinc/16/34/44/198163444.db2.gz	HBATWPMFRKLTNA-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172890033	198163445	/nfs/dbraw/zinc/16/34/45/198163445.db2.gz	HBATWPMFRKLTNA-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
CCCC[N@@H+](CCO)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000060478305	352874122	/nfs/dbraw/zinc/87/41/22/352874122.db2.gz	GDRARNLCCGADTO-AWEZNQCLSA-N	1	1	312.366	1.429	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC1	ZINC000064739142	352943566	/nfs/dbraw/zinc/94/35/66/352943566.db2.gz	CGYXKSNFVCIGQX-UHFFFAOYSA-N	1	1	323.397	1.370	20	5		DDBDMO
Cc1cc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000073000320	353231356	/nfs/dbraw/zinc/23/13/56/353231356.db2.gz	JIBQCRMLVQKSCB-CQSZACIVSA-N	1	1	321.425	1.982	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](CO)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000174705467	198373245	/nfs/dbraw/zinc/37/32/45/198373245.db2.gz	CTWDBUBROAVZIN-SECBINFHSA-N	1	1	313.741	1.501	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](CO)C1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000174705467	198373246	/nfs/dbraw/zinc/37/32/46/198373246.db2.gz	CTWDBUBROAVZIN-SECBINFHSA-N	1	1	313.741	1.501	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@H](CO)C1	ZINC000174709854	198373457	/nfs/dbraw/zinc/37/34/57/198373457.db2.gz	RPDNBHCHDYGKQG-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@H](CO)C1	ZINC000174709854	198373459	/nfs/dbraw/zinc/37/34/59/198373459.db2.gz	RPDNBHCHDYGKQG-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
CN1CCN(CCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000174722407	198375471	/nfs/dbraw/zinc/37/54/71/198375471.db2.gz	PRLUPIFBUWKXOX-UHFFFAOYSA-N	1	1	306.410	1.664	20	5		DDBDMO
CN1CCN(CCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000174722407	198375473	/nfs/dbraw/zinc/37/54/73/198375473.db2.gz	PRLUPIFBUWKXOX-UHFFFAOYSA-N	1	1	306.410	1.664	20	5		DDBDMO
C[C@H](c1ccccc1F)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174738164	198378632	/nfs/dbraw/zinc/37/86/32/198378632.db2.gz	MHADJYQXKOJFQJ-YPMHNXCESA-N	1	1	322.340	1.984	20	5		DDBDMO
Cc1nn(C)c(NC2CC[NH+](CCN(C)C)CC2)c1[N+](=O)[O-]	ZINC000079884813	353580651	/nfs/dbraw/zinc/58/06/51/353580651.db2.gz	YVKMGJKJPZEDMB-UHFFFAOYSA-N	1	1	310.402	1.075	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000108299434	353949640	/nfs/dbraw/zinc/94/96/40/353949640.db2.gz	IZGNSAOMMZAHLV-AWEZNQCLSA-N	1	1	303.362	1.738	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157631070	354226411	/nfs/dbraw/zinc/22/64/11/354226411.db2.gz	HFBKPJABSVGMIS-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157631070	354226415	/nfs/dbraw/zinc/22/64/15/354226415.db2.gz	HFBKPJABSVGMIS-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
CC1(C)C[N@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)CCO1	ZINC000587749463	354885340	/nfs/dbraw/zinc/88/53/40/354885340.db2.gz	GUGCDANKHCKFDP-UHFFFAOYSA-N	1	1	324.381	1.192	20	5		DDBDMO
CC1(C)C[N@@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)CCO1	ZINC000587749463	354885341	/nfs/dbraw/zinc/88/53/41/354885341.db2.gz	GUGCDANKHCKFDP-UHFFFAOYSA-N	1	1	324.381	1.192	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H]2OCC[N@@H+](C)[C@@H]2C1	ZINC000588838648	354940978	/nfs/dbraw/zinc/94/09/78/354940978.db2.gz	XHSOQWCGNKXCOZ-VXGBXAGGSA-N	1	1	309.370	1.029	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)[C@@H](C)C2)c1	ZINC000589514772	354998601	/nfs/dbraw/zinc/99/86/01/354998601.db2.gz	LNSYVYHLUHZHFD-IINYFYTJSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@@H](C)C2)c1	ZINC000589514772	354998603	/nfs/dbraw/zinc/99/86/03/354998603.db2.gz	LNSYVYHLUHZHFD-IINYFYTJSA-N	1	1	308.334	1.584	20	5		DDBDMO
CN(C(=O)CN1CC[C@H]2C[N@@H+](C)C[C@@H]21)c1ccc([N+](=O)[O-])cc1	ZINC000590012327	355040723	/nfs/dbraw/zinc/04/07/23/355040723.db2.gz	QWZXLAMFDMQCFV-WFASDCNBSA-N	1	1	318.377	1.194	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21)c1ccc([N+](=O)[O-])cc1F	ZINC000590045685	355043444	/nfs/dbraw/zinc/04/34/44/355043444.db2.gz	SVRKMGJNYXVODN-RWSFTLGLSA-N	1	1	321.352	2.000	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC(C[NH+]2CCOCC2)C1	ZINC000590558505	355113843	/nfs/dbraw/zinc/11/38/43/355113843.db2.gz	RHKWHJLGUFQIPA-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000590442263	355096348	/nfs/dbraw/zinc/09/63/48/355096348.db2.gz	FCGFGKYRIZNOIE-CABZTGNLSA-N	1	1	319.317	1.100	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000590443440	355097178	/nfs/dbraw/zinc/09/71/78/355097178.db2.gz	IRCCTHOBQYUGRL-SMDDNHRTSA-N	1	1	305.334	1.136	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1	ZINC000590446620	355099675	/nfs/dbraw/zinc/09/96/75/355099675.db2.gz	TYJAIVXHGVBAHF-HZMBPMFUSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CSc2ccc([N+](=O)[O-])cc2)C1	ZINC000590446351	355099795	/nfs/dbraw/zinc/09/97/95/355099795.db2.gz	UTPAZNMRFOSNOL-FZMZJTMJSA-N	1	1	321.402	1.849	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000590655919	355138878	/nfs/dbraw/zinc/13/88/78/355138878.db2.gz	MZFNRPSVYUMKFS-WCQYABFASA-N	1	1	322.361	1.959	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@H](CCCO)C1)OCCO2	ZINC000590663761	355139961	/nfs/dbraw/zinc/13/99/61/355139961.db2.gz	CWIJRBZSRBDYAU-LBPRGKRZSA-N	1	1	322.361	1.960	20	5		DDBDMO
CCCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592831323	355707314	/nfs/dbraw/zinc/70/73/14/355707314.db2.gz	KSRDFPWAWNACLA-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1ccnc2cc([N+](=O)[O-])ccc21	ZINC000593461741	355892473	/nfs/dbraw/zinc/89/24/73/355892473.db2.gz	OJNSHGTXHNQRLR-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
Cn1ccnc1[C@H]1C[NH2+]CCN1Cc1cc(O)ccc1[N+](=O)[O-]	ZINC000593727780	355976994	/nfs/dbraw/zinc/97/69/94/355976994.db2.gz	RVALRBHSRMWEPF-CQSZACIVSA-N	1	1	317.349	1.180	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)n1	ZINC000594198978	356138049	/nfs/dbraw/zinc/13/80/49/356138049.db2.gz	WXAPPBXZEBOZSJ-QWRGUYRKSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000080780353	192189241	/nfs/dbraw/zinc/18/92/41/192189241.db2.gz	ZNQHXRHTGUZMRC-CYBMUJFWSA-N	1	1	322.365	1.515	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCN(C)C1=O	ZINC000595011335	356372460	/nfs/dbraw/zinc/37/24/60/356372460.db2.gz	HDPFPLKKBLKDMO-GWCFXTLKSA-N	1	1	307.350	1.875	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000081434200	192264688	/nfs/dbraw/zinc/26/46/88/192264688.db2.gz	SKRFPGQYTMFWQP-OAHLLOKOSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@H+]1CCO[C@@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000081434200	192264690	/nfs/dbraw/zinc/26/46/90/192264690.db2.gz	SKRFPGQYTMFWQP-OAHLLOKOSA-N	1	1	321.377	1.364	20	5		DDBDMO
Nc1cccc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1	ZINC000595522643	356532119	/nfs/dbraw/zinc/53/21/19/356532119.db2.gz	DLUDONSHKABVHM-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000081579335	192295926	/nfs/dbraw/zinc/29/59/26/192295926.db2.gz	VVPQGLAFBZTBPJ-NSHDSACASA-N	1	1	322.365	1.237	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC2(COC2)C1	ZINC000595835712	356671484	/nfs/dbraw/zinc/67/14/84/356671484.db2.gz	XBKCYAWIPLJJGY-LBPRGKRZSA-N	1	1	308.334	1.057	20	5		DDBDMO
Cc1nn(C)c(N2CCC([N@H+]3CCCOCC3)CC2)c1[N+](=O)[O-]	ZINC000596269341	356838726	/nfs/dbraw/zinc/83/87/26/356838726.db2.gz	RPHUZBGNFIWJCZ-UHFFFAOYSA-N	1	1	323.397	1.328	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1COCCO1	ZINC000597207832	357092906	/nfs/dbraw/zinc/09/29/06/357092906.db2.gz	VYPVBXFDEOTGRS-LBPRGKRZSA-N	1	1	324.333	1.213	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1COCCO1	ZINC000597207832	357092907	/nfs/dbraw/zinc/09/29/07/357092907.db2.gz	VYPVBXFDEOTGRS-LBPRGKRZSA-N	1	1	324.333	1.213	20	5		DDBDMO
CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597946004	357393663	/nfs/dbraw/zinc/39/36/63/357393663.db2.gz	MKQIXAHPBPAMNO-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@H+](C)C1	ZINC000597946004	357393669	/nfs/dbraw/zinc/39/36/69/357393669.db2.gz	MKQIXAHPBPAMNO-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597946004	357393676	/nfs/dbraw/zinc/39/36/76/357393676.db2.gz	MKQIXAHPBPAMNO-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000598342334	357545596	/nfs/dbraw/zinc/54/55/96/357545596.db2.gz	MDOCILWLKDQCNA-NSHDSACASA-N	1	1	309.370	1.127	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000598342782	357545926	/nfs/dbraw/zinc/54/59/26/357545926.db2.gz	QDEVTLBGHGNAMX-NSHDSACASA-N	1	1	321.333	1.538	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598650803	357670197	/nfs/dbraw/zinc/67/01/97/357670197.db2.gz	OXQNQBOIWBPGGZ-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598650803	357670201	/nfs/dbraw/zinc/67/02/01/357670201.db2.gz	OXQNQBOIWBPGGZ-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(C)COC1	ZINC000599571755	357979267	/nfs/dbraw/zinc/97/92/67/357979267.db2.gz	ULTOUURXPKGKJV-NSHDSACASA-N	1	1	307.350	1.890	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@](C)(O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000180184296	199127399	/nfs/dbraw/zinc/12/73/99/199127399.db2.gz	KGXZNPNSUZEACJ-MRXNPFEDSA-N	1	1	316.361	1.952	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000600473145	358234658	/nfs/dbraw/zinc/23/46/58/358234658.db2.gz	RXWLVDIBCCQWHH-GFCCVEGCSA-N	1	1	306.366	1.680	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@@H](Nc3ncc(F)cc3[N+](=O)[O-])C2)CC1	ZINC000601115795	358408103	/nfs/dbraw/zinc/40/81/03/358408103.db2.gz	CGRJFHYSYGVUMG-GFCCVEGCSA-N	1	1	323.372	1.709	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3ncc(F)cc3[N+](=O)[O-])C2)CC1	ZINC000601115795	358408106	/nfs/dbraw/zinc/40/81/06/358408106.db2.gz	CGRJFHYSYGVUMG-GFCCVEGCSA-N	1	1	323.372	1.709	20	5		DDBDMO
CNC(=O)[C@H](C)CN(C)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601124857	358412720	/nfs/dbraw/zinc/41/27/20/358412720.db2.gz	VFLTZTQVIUMGAE-SNVBAGLBSA-N	1	1	302.334	1.961	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccnc2ccc([N+](=O)[O-])cc21	ZINC000601172728	358432303	/nfs/dbraw/zinc/43/23/03/358432303.db2.gz	HOACFGCBXCGJGP-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
NC(=O)c1ccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1	ZINC000271645942	283378771	/nfs/dbraw/zinc/37/87/71/283378771.db2.gz	QUSPMUOHVSQCMD-NSHDSACASA-N	1	1	315.333	1.801	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000602043316	358788998	/nfs/dbraw/zinc/78/89/98/358788998.db2.gz	CUJZMUSWSFVUNI-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681233	359122385	/nfs/dbraw/zinc/12/23/85/359122385.db2.gz	MWKSYFYJSHXJTO-IONNQARKSA-N	1	1	308.260	1.073	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681233	359122387	/nfs/dbraw/zinc/12/23/87/359122387.db2.gz	MWKSYFYJSHXJTO-IONNQARKSA-N	1	1	308.260	1.073	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602792801	359194888	/nfs/dbraw/zinc/19/48/88/359194888.db2.gz	COOYBKKAGPOJKV-XQQFMLRXSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1[C@H]1CCCOC1	ZINC000602851684	359239214	/nfs/dbraw/zinc/23/92/14/359239214.db2.gz	CAFQMLHOOUUXRD-KBPBESRZSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@@]2(CCSC2)C1	ZINC000602853469	359240449	/nfs/dbraw/zinc/24/04/49/359240449.db2.gz	ZQUZCISAYZNLSH-ZDUSSCGKSA-N	1	1	312.395	1.308	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@@]2(CCSC2)C1	ZINC000602853469	359240452	/nfs/dbraw/zinc/24/04/52/359240452.db2.gz	ZQUZCISAYZNLSH-ZDUSSCGKSA-N	1	1	312.395	1.308	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@H]1[C@H]1CNC(=O)C1	ZINC000602795884	359197400	/nfs/dbraw/zinc/19/74/00/359197400.db2.gz	BYAGAKDJUMSECD-OLZOCXBDSA-N	1	1	321.381	1.090	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)C[C@@](C)(O)C1CC1	ZINC000602821805	359215912	/nfs/dbraw/zinc/21/59/12/359215912.db2.gz	ACWYRPRIPKJFLL-IAGOWNOFSA-N	1	1	322.405	1.981	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000602899318	359281163	/nfs/dbraw/zinc/28/11/63/359281163.db2.gz	PNCNHHNHGNOMIP-DZGCQCFKSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC(C)[N@@H+](CCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000188876102	200315144	/nfs/dbraw/zinc/31/51/44/200315144.db2.gz	GGPYFWREKAZULJ-UHFFFAOYSA-N	1	1	313.329	1.765	20	5		DDBDMO
COc1cc(C[N@H+](C)CC2(CO)CC2)c([N+](=O)[O-])cc1OC	ZINC000188954621	200326890	/nfs/dbraw/zinc/32/68/90/200326890.db2.gz	NXLXZONTZHGRIU-UHFFFAOYSA-N	1	1	310.350	1.816	20	5		DDBDMO
COc1cc(C[N@@H+](C)CC2(CO)CC2)c([N+](=O)[O-])cc1OC	ZINC000188954621	200326892	/nfs/dbraw/zinc/32/68/92/200326892.db2.gz	NXLXZONTZHGRIU-UHFFFAOYSA-N	1	1	310.350	1.816	20	5		DDBDMO
O=C(NCc1cnc[nH]1)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000610491360	360450370	/nfs/dbraw/zinc/45/03/70/360450370.db2.gz	YDIGURUOTBFWTI-UHFFFAOYSA-N	1	1	304.262	1.019	20	5		DDBDMO
O=C(CC[N@H+]1CCc2c[nH]nc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000611008633	360599466	/nfs/dbraw/zinc/59/94/66/360599466.db2.gz	FFDSUVXDHAPYAL-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2cn[nH]c2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000611008633	360599477	/nfs/dbraw/zinc/59/94/77/360599477.db2.gz	FFDSUVXDHAPYAL-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
O=C(CC[N@H+]1CCc2cn[nH]c2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000611008633	360599482	/nfs/dbraw/zinc/59/94/82/360599482.db2.gz	FFDSUVXDHAPYAL-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C(C)(C)CO)CC1	ZINC000611165853	360643238	/nfs/dbraw/zinc/64/32/38/360643238.db2.gz	AQTZWTSGRNHIHF-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C	ZINC000611087904	360618737	/nfs/dbraw/zinc/61/87/37/360618737.db2.gz	QSJOUHINQBFGPK-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)C[C@@H]1C	ZINC000611087904	360618739	/nfs/dbraw/zinc/61/87/39/360618739.db2.gz	QSJOUHINQBFGPK-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092458	360621752	/nfs/dbraw/zinc/62/17/52/360621752.db2.gz	UQRMQOSOMUEWKW-NSHDSACASA-N	1	1	306.366	1.220	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1	ZINC000281261211	216192604	/nfs/dbraw/zinc/19/26/04/216192604.db2.gz	HLVRAWMJSUPDOO-YPMHNXCESA-N	1	1	321.333	1.534	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1	ZINC000281261211	216192608	/nfs/dbraw/zinc/19/26/08/216192608.db2.gz	HLVRAWMJSUPDOO-YPMHNXCESA-N	1	1	321.333	1.534	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCO1	ZINC000611268274	360683899	/nfs/dbraw/zinc/68/38/99/360683899.db2.gz	IXBHJWJURXARLK-LLVKDONJSA-N	1	1	308.334	1.977	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCO1	ZINC000611268274	360683902	/nfs/dbraw/zinc/68/39/02/360683902.db2.gz	IXBHJWJURXARLK-LLVKDONJSA-N	1	1	308.334	1.977	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@H]1C	ZINC000611515355	360742678	/nfs/dbraw/zinc/74/26/78/360742678.db2.gz	ORPTWDJLKVCEOV-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@H]1C	ZINC000611515355	360742679	/nfs/dbraw/zinc/74/26/79/360742679.db2.gz	ORPTWDJLKVCEOV-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000619578935	364070936	/nfs/dbraw/zinc/07/09/36/364070936.db2.gz	UZDOEUORQHKZIL-LBPRGKRZSA-N	1	1	306.366	1.855	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1	ZINC000275240551	212218524	/nfs/dbraw/zinc/21/85/24/212218524.db2.gz	OCPLALKHJIXQTF-UHFFFAOYSA-N	1	1	318.377	1.992	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000359287952	299397119	/nfs/dbraw/zinc/39/71/19/299397119.db2.gz	JVXKRUHWHBXTHV-CYBMUJFWSA-N	1	1	321.377	1.364	20	5		DDBDMO
Cc1nn(C)cc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534235	193266085	/nfs/dbraw/zinc/26/60/85/193266085.db2.gz	BLVZKPAZVVMCHV-ZDUSSCGKSA-N	1	1	316.365	1.718	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000264633050	204041605	/nfs/dbraw/zinc/04/16/05/204041605.db2.gz	OIJHSSFBYWOJDS-UHFFFAOYSA-N	1	1	310.329	1.484	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])C1	ZINC000264591767	204015816	/nfs/dbraw/zinc/01/58/16/204015816.db2.gz	WENAZKIYCPOVTB-LBPRGKRZSA-N	1	1	307.350	1.354	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288473198	220164885	/nfs/dbraw/zinc/16/48/85/220164885.db2.gz	QNIACTBUTYEIDS-KOLCDFICSA-N	1	1	307.354	1.325	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000267998223	206385090	/nfs/dbraw/zinc/38/50/90/206385090.db2.gz	ULCWXUVLZJZGPS-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
Cn1nccc1CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000338546992	250025569	/nfs/dbraw/zinc/02/55/69/250025569.db2.gz	PXUKNRUXCKGBFZ-GFCCVEGCSA-N	1	1	316.365	1.452	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)NC3CC3)C2)cc1[N+](=O)[O-]	ZINC000273776324	211049722	/nfs/dbraw/zinc/04/97/22/211049722.db2.gz	RYEJNGPNGQYXTG-CQSZACIVSA-N	1	1	318.377	1.939	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)NC3CC3)C2)cc1[N+](=O)[O-]	ZINC000273776324	211049727	/nfs/dbraw/zinc/04/97/27/211049727.db2.gz	RYEJNGPNGQYXTG-CQSZACIVSA-N	1	1	318.377	1.939	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[NH+](CC(C)(C)O)CC2)cc1[N+](=O)[O-]	ZINC000106399139	194207031	/nfs/dbraw/zinc/20/70/31/194207031.db2.gz	YUVKBZRXDDEFDI-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](CO)[C@H]2CCCO2)c(F)c1	ZINC000352403962	285027894	/nfs/dbraw/zinc/02/78/94/285027894.db2.gz	ZVWOFLRGOOESDQ-CHWSQXEVSA-N	1	1	302.277	1.503	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000425069416	533134647	/nfs/dbraw/zinc/13/46/47/533134647.db2.gz	VBVIGHCVOGLDOP-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@@H](C)C1	ZINC000352670847	285213763	/nfs/dbraw/zinc/21/37/63/285213763.db2.gz	GXGNJBGSUSHJKV-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC2([NH+]3CCOCC3)CCOCC2)cn1	ZINC000413394217	224188686	/nfs/dbraw/zinc/18/86/86/224188686.db2.gz	ASNRKFJKSGOIJJ-UHFFFAOYSA-N	1	1	322.365	1.283	20	5		DDBDMO
COCCCOCC[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271603980	209051545	/nfs/dbraw/zinc/05/15/45/209051545.db2.gz	UFINQDWZAMUVMJ-OAHLLOKOSA-N	1	1	312.366	1.613	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nc(=O)[nH][nH]2)C1	ZINC000289487168	221011847	/nfs/dbraw/zinc/01/18/47/221011847.db2.gz	SGSYDSXLJWGPLF-MNOVXSKESA-N	1	1	317.349	1.947	20	5		DDBDMO
C[N@H+](CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000289605530	221097825	/nfs/dbraw/zinc/09/78/25/221097825.db2.gz	KZHTUVXSYGPBAE-UHFFFAOYSA-N	1	1	303.265	1.503	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000289605530	221097827	/nfs/dbraw/zinc/09/78/27/221097827.db2.gz	KZHTUVXSYGPBAE-UHFFFAOYSA-N	1	1	303.265	1.503	20	5		DDBDMO
COCCCC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000419385719	533252057	/nfs/dbraw/zinc/25/20/57/533252057.db2.gz	LMIBHYBKDZSLIU-UHFFFAOYSA-N	1	1	321.377	1.842	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CC=CCC2)c([N+](=O)[O-])cc1F	ZINC000451344410	533533583	/nfs/dbraw/zinc/53/35/83/533533583.db2.gz	BCRRPGCWBZFMCH-UHFFFAOYSA-N	1	1	323.324	1.734	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+]2CC=CCC2)c([N+](=O)[O-])cc1F	ZINC000451344410	533533589	/nfs/dbraw/zinc/53/35/89/533533589.db2.gz	BCRRPGCWBZFMCH-UHFFFAOYSA-N	1	1	323.324	1.734	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000299690374	533547380	/nfs/dbraw/zinc/54/73/80/533547380.db2.gz	VWTLYVGPBKJMKC-CHWSQXEVSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000266555546	407558115	/nfs/dbraw/zinc/55/81/15/407558115.db2.gz	VVLGYKRKLZBDPH-QWRGUYRKSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000266555546	407558117	/nfs/dbraw/zinc/55/81/17/407558117.db2.gz	VVLGYKRKLZBDPH-QWRGUYRKSA-N	1	1	313.379	1.279	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1	ZINC000070714810	406823111	/nfs/dbraw/zinc/82/31/11/406823111.db2.gz	YXNDBCWEJYMVLL-UHFFFAOYSA-N	1	1	306.366	1.439	20	5		DDBDMO
Cc1ccc(NC(=O)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000071899144	406864473	/nfs/dbraw/zinc/86/44/73/406864473.db2.gz	KJTUIHUFAJOZSX-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
Cc1nn(C)c(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000072015989	406871655	/nfs/dbraw/zinc/87/16/55/406871655.db2.gz	JZJMTHJYKCSJQU-CYBMUJFWSA-N	1	1	324.429	1.321	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCOCC3CC3)C2)nc1	ZINC000072665241	406884437	/nfs/dbraw/zinc/88/44/37/406884437.db2.gz	IJPCRYODZKALBM-ZDUSSCGKSA-N	1	1	306.366	1.903	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)C2	ZINC000073990392	406898612	/nfs/dbraw/zinc/89/86/12/406898612.db2.gz	WJWHLVXSVZEPID-DZGCQCFKSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CCO1	ZINC000124309995	407354101	/nfs/dbraw/zinc/35/41/01/407354101.db2.gz	XUIWTGHLUBDZMQ-NSHDSACASA-N	1	1	323.349	1.513	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000103284352	407335663	/nfs/dbraw/zinc/33/56/63/407335663.db2.gz	CYMNYYJODXLQQZ-JQWIXIFHSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000124497306	407360351	/nfs/dbraw/zinc/36/03/51/407360351.db2.gz	ANOYWGXQRWWUGK-TZMCWYRMSA-N	1	1	321.377	1.915	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000108783243	407390344	/nfs/dbraw/zinc/39/03/44/407390344.db2.gz	VIIXPIBSCVRFOU-GFCCVEGCSA-N	1	1	318.377	1.607	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706273	407482068	/nfs/dbraw/zinc/48/20/68/407482068.db2.gz	MLBHCVWKULZFMP-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706273	407482072	/nfs/dbraw/zinc/48/20/72/407482072.db2.gz	MLBHCVWKULZFMP-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706273	407482074	/nfs/dbraw/zinc/48/20/74/407482074.db2.gz	MLBHCVWKULZFMP-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706273	407482081	/nfs/dbraw/zinc/48/20/81/407482081.db2.gz	MLBHCVWKULZFMP-LLVKDONJSA-N	1	1	309.370	1.293	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000170912349	407552175	/nfs/dbraw/zinc/55/21/75/407552175.db2.gz	WAQUFZKNRYJRHV-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000170912349	407552180	/nfs/dbraw/zinc/55/21/80/407552180.db2.gz	WAQUFZKNRYJRHV-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCOC1	ZINC000178757900	407586525	/nfs/dbraw/zinc/58/65/25/407586525.db2.gz	MEWPYDQYFFDQGS-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@H]2C[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000171665965	407735620	/nfs/dbraw/zinc/73/56/20/407735620.db2.gz	ARXZETMKNIRIDY-LLVKDONJSA-N	1	1	321.381	1.581	20	5		DDBDMO
C[C@]1(O)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000267168585	407775096	/nfs/dbraw/zinc/77/50/96/407775096.db2.gz	ACNJRGXWGMOMCJ-ZDUSSCGKSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[C@]1(O)CC[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000267168585	407775102	/nfs/dbraw/zinc/77/51/02/407775102.db2.gz	ACNJRGXWGMOMCJ-ZDUSSCGKSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1CCc1ccc([N+](=O)[O-])cc1	ZINC000189431051	408014062	/nfs/dbraw/zinc/01/40/62/408014062.db2.gz	HBKFPJNVPUCTFB-AWEZNQCLSA-N	1	1	321.421	1.914	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCSC1	ZINC000182259747	408111006	/nfs/dbraw/zinc/11/10/06/408111006.db2.gz	RLDNYIMREMTOMM-VXGBXAGGSA-N	1	1	312.391	1.772	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@H+](C)C[C@@H]1C	ZINC000121206046	408161693	/nfs/dbraw/zinc/16/16/93/408161693.db2.gz	LMOXTLVGWZTGPC-IINYFYTJSA-N	1	1	306.366	1.710	20	5		DDBDMO
CCOCC[N@@H+](CC)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273346901	408164018	/nfs/dbraw/zinc/16/40/18/408164018.db2.gz	OROZCSRQEZFXAE-ZDUSSCGKSA-N	1	1	312.366	1.693	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cn1	ZINC000263761504	408243629	/nfs/dbraw/zinc/24/36/29/408243629.db2.gz	USLDQLRHTSYWEL-ZDUSSCGKSA-N	1	1	321.381	1.344	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000263666838	408197615	/nfs/dbraw/zinc/19/76/15/408197615.db2.gz	LCJKLHUCUXTDBR-WDEREUQCSA-N	1	1	323.397	1.731	20	5		DDBDMO
CSCC[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000151155775	408265388	/nfs/dbraw/zinc/26/53/88/408265388.db2.gz	VGJZMZOSDGGPAH-GFCCVEGCSA-N	1	1	300.380	1.629	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](C)[C@H]2CO)c([N+](=O)[O-])c1	ZINC000190401685	408236219	/nfs/dbraw/zinc/23/62/19/408236219.db2.gz	SKIBTXCYIIUYPB-SMDDNHRTSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000157425434	408303863	/nfs/dbraw/zinc/30/38/63/408303863.db2.gz	JCJWWMZMKKWBKJ-NSHDSACASA-N	1	1	316.361	1.687	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000270421238	408529540	/nfs/dbraw/zinc/52/95/40/408529540.db2.gz	GDVVUGMASBDFLJ-GWCFXTLKSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[C@@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c2nonc21	ZINC000264387793	408471056	/nfs/dbraw/zinc/47/10/56/408471056.db2.gz	JZGVFCYTJFYWDT-JTQLQIEISA-N	1	1	320.353	1.179	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000270552176	408575077	/nfs/dbraw/zinc/57/50/77/408575077.db2.gz	RNSIAOOMTBGXBP-UHFFFAOYSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177133867	408532620	/nfs/dbraw/zinc/53/26/20/408532620.db2.gz	FNIMYLZJIQDGDJ-NEPJUHHUSA-N	1	1	319.361	1.715	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2[nH]ncc2[N+](=O)[O-])[nH+]c1	ZINC000161777143	408637684	/nfs/dbraw/zinc/63/76/84/408637684.db2.gz	XGLDBXYDSUILBW-UHFFFAOYSA-N	1	1	304.310	1.253	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000177797062	408714940	/nfs/dbraw/zinc/71/49/40/408714940.db2.gz	HUIRMFBMVDMKAH-OLZOCXBDSA-N	1	1	321.381	1.267	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1O	ZINC000249542584	408738387	/nfs/dbraw/zinc/73/83/87/408738387.db2.gz	FJBBQDJVHUNRMA-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](O)[C@@H](C)C1	ZINC000249536713	408739164	/nfs/dbraw/zinc/73/91/64/408739164.db2.gz	CQJOBKLCANJOJP-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CCCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000265553100	408691178	/nfs/dbraw/zinc/69/11/78/408691178.db2.gz	YYVYQUGVPDQCMG-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1	ZINC000250243000	408777017	/nfs/dbraw/zinc/77/70/17/408777017.db2.gz	UJBDVVJBXVMRNI-VXGBXAGGSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[C@H]1CN(c2ncc([N+](=O)[O-])c(N)n2)CC[N@H+](C2CCC2)C1	ZINC000291621532	408896781	/nfs/dbraw/zinc/89/67/81/408896781.db2.gz	ATSSNMXPUGGIIT-SNVBAGLBSA-N	1	1	306.370	1.278	20	5		DDBDMO
CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000286086488	408921466	/nfs/dbraw/zinc/92/14/66/408921466.db2.gz	SQFNFZUMEKGCMO-LLVKDONJSA-N	1	1	323.397	1.948	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCC[NH+]1CCN(CC)CC1	ZINC000192494599	163225283	/nfs/dbraw/zinc/22/52/83/163225283.db2.gz	CLSRSLYIHXHYLV-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000277570284	408968092	/nfs/dbraw/zinc/96/80/92/408968092.db2.gz	ZTERFYPKXJKZHP-NSHDSACASA-N	1	1	319.365	1.518	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292126284	408985657	/nfs/dbraw/zinc/98/56/57/408985657.db2.gz	GXCNGAITXYUACP-INIZCTEOSA-N	1	1	303.362	1.692	20	5		DDBDMO
CC[N@@H+](CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1	ZINC000278109262	409067051	/nfs/dbraw/zinc/06/70/51/409067051.db2.gz	KWFMKIAKFROFMQ-UHFFFAOYSA-N	1	1	317.349	1.572	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000293108290	409052190	/nfs/dbraw/zinc/05/21/90/409052190.db2.gz	LMXOEIYLTPMOSU-OAHLLOKOSA-N	1	1	321.377	1.941	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H](C)CO	ZINC000293532176	409132826	/nfs/dbraw/zinc/13/28/26/409132826.db2.gz	XDUWAXZOVHTFBD-JTQLQIEISA-N	1	1	313.329	1.765	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[NH2+]CC[C@@H]2C1	ZINC000293348115	409095041	/nfs/dbraw/zinc/09/50/41/409095041.db2.gz	JVKUNBLDPVIUAQ-SKDRFNHKSA-N	1	1	315.333	1.295	20	5		DDBDMO
CN(C)C(=O)CC[NH+]1CCN(c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000287970117	409124608	/nfs/dbraw/zinc/12/46/08/409124608.db2.gz	UFFIEPXPFPVBGF-UHFFFAOYSA-N	1	1	324.356	1.334	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1CCN(C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000330708697	287015305	/nfs/dbraw/zinc/01/53/05/287015305.db2.gz	RJMVAUKRVUADNR-GFCCVEGCSA-N	1	1	306.366	1.019	20	5		DDBDMO
Cc1ccnc(N(C)CCC[N@H+](C)CCN(C)C)c1[N+](=O)[O-]	ZINC000289149299	409225032	/nfs/dbraw/zinc/22/50/32/409225032.db2.gz	STVHFLXSGIXGFG-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1ccnc(N(C)CCCN(C)CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000289149299	409225035	/nfs/dbraw/zinc/22/50/35/409225035.db2.gz	STVHFLXSGIXGFG-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
C[NH+](C)CCn1nccc1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000294274749	409271479	/nfs/dbraw/zinc/27/14/79/409271479.db2.gz	ZJCGNASIICPSGC-UHFFFAOYSA-N	1	1	319.321	1.311	20	5		DDBDMO
C[C@@H](CO)[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1CCC1	ZINC000280606610	409377595	/nfs/dbraw/zinc/37/75/95/409377595.db2.gz	VOJRYVKWANPIQF-NSHDSACASA-N	1	1	321.377	1.677	20	5		DDBDMO
Cc1cccc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000285350936	409412290	/nfs/dbraw/zinc/41/22/90/409412290.db2.gz	ULYQQCFHADZPFB-KBPBESRZSA-N	1	1	319.361	1.448	20	5		DDBDMO
CN1CC[NH+](CCNc2ccc([N+](=O)[O-])c3ncccc23)CC1	ZINC000322114907	164045921	/nfs/dbraw/zinc/04/59/21/164045921.db2.gz	PTQRKLMKXNTAKO-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000321888214	164046117	/nfs/dbraw/zinc/04/61/17/164046117.db2.gz	RMGHKINCVIRRAP-VXGBXAGGSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347020518	164098375	/nfs/dbraw/zinc/09/83/75/164098375.db2.gz	YFTMKMDPPYOKSK-ZDUSSCGKSA-N	1	1	321.381	1.185	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1	ZINC000295435893	409480524	/nfs/dbraw/zinc/48/05/24/409480524.db2.gz	VGXOQQZNLRBISC-LLVKDONJSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](C2CC2)C1	ZINC000295435893	409480528	/nfs/dbraw/zinc/48/05/28/409480528.db2.gz	VGXOQQZNLRBISC-LLVKDONJSA-N	1	1	319.361	1.857	20	5		DDBDMO
Cn1c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)ccc1[N+](=O)[O-]	ZINC000408223892	164266575	/nfs/dbraw/zinc/26/65/75/164266575.db2.gz	VKNGQNUOKRTHLH-UHFFFAOYSA-N	1	1	306.366	1.634	20	5		DDBDMO
CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C2CC2)C1	ZINC000356802289	409620153	/nfs/dbraw/zinc/62/01/53/409620153.db2.gz	JRLSSQVAZOVEDU-LBPRGKRZSA-N	1	1	305.334	1.609	20	5		DDBDMO
CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000356802289	409620159	/nfs/dbraw/zinc/62/01/59/409620159.db2.gz	JRLSSQVAZOVEDU-LBPRGKRZSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000342452887	409640898	/nfs/dbraw/zinc/64/08/98/409640898.db2.gz	QPLOYVQMBSLFLY-YPMHNXCESA-N	1	1	319.361	1.573	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000356903495	409707343	/nfs/dbraw/zinc/70/73/43/409707343.db2.gz	PRLJFEMSRQTCBL-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1	ZINC000356834983	409645365	/nfs/dbraw/zinc/64/53/65/409645365.db2.gz	BYWYKLKPYZOIHW-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1	ZINC000356834983	409645369	/nfs/dbraw/zinc/64/53/69/409645369.db2.gz	BYWYKLKPYZOIHW-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331591927	409672703	/nfs/dbraw/zinc/67/27/03/409672703.db2.gz	XZBUEQYHXSLZJN-QWRGUYRKSA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)[C@H](C)[C@@H]1C	ZINC000357029288	409808059	/nfs/dbraw/zinc/80/80/59/409808059.db2.gz	CSFDTOJKCUYDAP-OLZOCXBDSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1CC[N@H+](C)CCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000354485083	409889785	/nfs/dbraw/zinc/88/97/85/409889785.db2.gz	BOVCAQAXZQHVFS-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000354485083	409889789	/nfs/dbraw/zinc/88/97/89/409889789.db2.gz	BOVCAQAXZQHVFS-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000332250898	410015176	/nfs/dbraw/zinc/01/51/76/410015176.db2.gz	RFKGCWRACCZWPO-JTQLQIEISA-N	1	1	317.349	1.429	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000332250898	410015181	/nfs/dbraw/zinc/01/51/81/410015181.db2.gz	RFKGCWRACCZWPO-JTQLQIEISA-N	1	1	317.349	1.429	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687668	410082919	/nfs/dbraw/zinc/08/29/19/410082919.db2.gz	MIAQHRZRLVQGLS-HUBLWGQQSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687668	410082928	/nfs/dbraw/zinc/08/29/28/410082928.db2.gz	MIAQHRZRLVQGLS-HUBLWGQQSA-N	1	1	319.361	1.689	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H]1C	ZINC000346997048	410299586	/nfs/dbraw/zinc/29/95/86/410299586.db2.gz	CBNQOEATZXNIOC-JQWIXIFHSA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790186	410400243	/nfs/dbraw/zinc/40/02/43/410400243.db2.gz	JMXYLJIUKWVAQU-GHMZBOCLSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790186	410400251	/nfs/dbraw/zinc/40/02/51/410400251.db2.gz	JMXYLJIUKWVAQU-GHMZBOCLSA-N	1	1	321.333	1.417	20	5		DDBDMO
Cn1c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)ccc1[N+](=O)[O-]	ZINC000347319729	410467596	/nfs/dbraw/zinc/46/75/96/410467596.db2.gz	OKCOCRYHROZTGE-GFCCVEGCSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000355373635	410476330	/nfs/dbraw/zinc/47/63/30/410476330.db2.gz	ULJOLMVAHWISJQ-GJZGRUSLSA-N	1	1	319.361	1.530	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)O[C@H](C(N)=O)C1	ZINC000347358663	410494165	/nfs/dbraw/zinc/49/41/65/410494165.db2.gz	LHFYVTZGTRSOBY-QLWBUIJQSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)O[C@H](C(N)=O)C1	ZINC000347358663	410494169	/nfs/dbraw/zinc/49/41/69/410494169.db2.gz	LHFYVTZGTRSOBY-QLWBUIJQSA-N	1	1	319.361	1.573	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000339953013	410572753	/nfs/dbraw/zinc/57/27/53/410572753.db2.gz	MQVOTKDXQMPIBH-NEPJUHHUSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H](C)O	ZINC000352213154	410550430	/nfs/dbraw/zinc/55/04/30/410550430.db2.gz	UAQCPEISNQUYMV-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H](C)O	ZINC000352213154	410550436	/nfs/dbraw/zinc/55/04/36/410550436.db2.gz	UAQCPEISNQUYMV-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337310861	410708903	/nfs/dbraw/zinc/70/89/03/410708903.db2.gz	BOQVATCONKFUIF-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)CN1C	ZINC000337310861	410708907	/nfs/dbraw/zinc/70/89/07/410708907.db2.gz	BOQVATCONKFUIF-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)CN1C	ZINC000337310861	410708913	/nfs/dbraw/zinc/70/89/13/410708913.db2.gz	BOQVATCONKFUIF-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2[C@H](O)C(F)(F)F)c1	ZINC000340207726	410754722	/nfs/dbraw/zinc/75/47/22/410754722.db2.gz	YXGUXKLVGJFNPS-MNOVXSKESA-N	1	1	322.287	1.569	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2[C@H](O)C(F)(F)F)c1	ZINC000340207726	410754729	/nfs/dbraw/zinc/75/47/29/410754729.db2.gz	YXGUXKLVGJFNPS-MNOVXSKESA-N	1	1	322.287	1.569	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330565221	410782512	/nfs/dbraw/zinc/78/25/12/410782512.db2.gz	ACZKFZRTZIDVSU-CHWSQXEVSA-N	1	1	320.393	1.582	20	5		DDBDMO
CC[N@H+](CCOCCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000337453629	410795688	/nfs/dbraw/zinc/79/56/88/410795688.db2.gz	VFRLZPRVNSUEQK-UHFFFAOYSA-N	1	1	308.338	1.302	20	5		DDBDMO
CC[N@@H+](CCOCCO)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000337453629	410795693	/nfs/dbraw/zinc/79/56/93/410795693.db2.gz	VFRLZPRVNSUEQK-UHFFFAOYSA-N	1	1	308.338	1.302	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCC[C@@H](C)C1	ZINC000330586045	410802443	/nfs/dbraw/zinc/80/24/43/410802443.db2.gz	SIRJJKNKNLOYKY-VXGBXAGGSA-N	1	1	308.382	1.784	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000359810581	410894412	/nfs/dbraw/zinc/89/44/12/410894412.db2.gz	RUBQYWQEKKJCKN-JTQLQIEISA-N	1	1	311.386	1.487	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(CC[NH+](C)C)C2CC2)c1[N+](=O)[O-]	ZINC000356293084	410948952	/nfs/dbraw/zinc/94/89/52/410948952.db2.gz	HFAWHDGEQMWZHL-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(O)CCC1	ZINC000353467879	411005510	/nfs/dbraw/zinc/00/55/10/411005510.db2.gz	NFCNGFORNMYMHA-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)Cc1c([N+](=O)[O-])ncn1C	ZINC000353544636	411056236	/nfs/dbraw/zinc/05/62/36/411056236.db2.gz	PEOXFAKORLHATL-UHFFFAOYSA-N	1	1	321.381	1.875	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000331201529	411015392	/nfs/dbraw/zinc/01/53/92/411015392.db2.gz	QJKPRYYDDORZGF-CHWSQXEVSA-N	1	1	321.377	1.881	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2C/C=C\c1ccccc1[N+](=O)[O-]	ZINC000353667898	411103805	/nfs/dbraw/zinc/10/38/05/411103805.db2.gz	WASPELRIADEQTK-FJDWXNHUSA-N	1	1	301.346	1.961	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@H](C[NH+]2CCCCCC2)C1	ZINC000360221013	411104735	/nfs/dbraw/zinc/10/47/35/411104735.db2.gz	CKHJPGCUOBCYFM-KFWWJZLASA-N	1	1	309.410	1.766	20	5		DDBDMO
CNc1nccc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000519180178	416896916	/nfs/dbraw/zinc/89/69/16/416896916.db2.gz	KNASUCLAZKLQPH-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
C[C@@H]1C[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000360651163	418484515	/nfs/dbraw/zinc/48/45/15/418484515.db2.gz	FWWZAXQQUKBHDW-GHMZBOCLSA-N	1	1	313.379	1.356	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](c3ccco3)C2)c1	ZINC000374139251	418494153	/nfs/dbraw/zinc/49/41/53/418494153.db2.gz	ABKDLWAHKNDYTF-WCQYABFASA-N	1	1	306.322	1.235	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000374821519	418566272	/nfs/dbraw/zinc/56/62/72/418566272.db2.gz	FRFKWPNRJQVBRI-SNVBAGLBSA-N	1	1	322.340	1.626	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@H]21	ZINC000374821241	418566871	/nfs/dbraw/zinc/56/68/71/418566871.db2.gz	DYRXLKABHMWOTP-YMTOWFKASA-N	1	1	322.340	1.482	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)n1	ZINC000191772475	222109022	/nfs/dbraw/zinc/10/90/22/222109022.db2.gz	QSCYALNLGWISIQ-RYUDHWBXSA-N	1	1	323.397	1.661	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])CC[N@H+]1CCCOCC1	ZINC000361379595	418640863	/nfs/dbraw/zinc/64/08/63/418640863.db2.gz	VRVOCTBPUOQFMT-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CCN1CCCOCC1	ZINC000361379595	418640865	/nfs/dbraw/zinc/64/08/65/418640865.db2.gz	VRVOCTBPUOQFMT-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CCN1CCCOCC1	ZINC000361379595	418640868	/nfs/dbraw/zinc/64/08/68/418640868.db2.gz	VRVOCTBPUOQFMT-UHFFFAOYSA-N	1	1	307.394	1.791	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000361385456	418641612	/nfs/dbraw/zinc/64/16/12/418641612.db2.gz	QCEJCVUXWNBXSE-GFCCVEGCSA-N	1	1	321.333	1.614	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000362057538	418746004	/nfs/dbraw/zinc/74/60/04/418746004.db2.gz	LEZLKVIGXIMEKZ-GFCCVEGCSA-N	1	1	306.366	1.917	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CC1CC1	ZINC000420975361	419397708	/nfs/dbraw/zinc/39/77/08/419397708.db2.gz	QMFJVIDPGRGLCJ-UHFFFAOYSA-N	1	1	313.379	1.215	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000420983401	419411811	/nfs/dbraw/zinc/41/18/11/419411811.db2.gz	ZJKYAIIYGUOWRL-SECBINFHSA-N	1	1	311.313	1.310	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000420983401	419411822	/nfs/dbraw/zinc/41/18/22/419411822.db2.gz	ZJKYAIIYGUOWRL-SECBINFHSA-N	1	1	311.313	1.310	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000420943351	419374693	/nfs/dbraw/zinc/37/46/93/419374693.db2.gz	PSSHVQSGBFTFFP-QWHCGFSZSA-N	1	1	321.377	1.874	20	5		DDBDMO
C[C@@H]1CN(Cc2c(Cl)cccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000426481026	419483598	/nfs/dbraw/zinc/48/35/98/419483598.db2.gz	DKKVTVPHBPZAMK-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C[C@@H]1CCC[N@H+]1C	ZINC000420998105	419435243	/nfs/dbraw/zinc/43/52/43/419435243.db2.gz	HWFKNEPOUXGRKW-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044266	419590177	/nfs/dbraw/zinc/59/01/77/419590177.db2.gz	WOWDKWGVMPHBNU-QJPTWQEYSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044266	419590182	/nfs/dbraw/zinc/59/01/82/419590182.db2.gz	WOWDKWGVMPHBNU-QJPTWQEYSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1nn(CCC(=O)N(C)C[C@H]2CCC[N@H+]2C)c(C)c1[N+](=O)[O-]	ZINC000421705516	419685872	/nfs/dbraw/zinc/68/58/72/419685872.db2.gz	RMSZUXAVNIRYFN-CYBMUJFWSA-N	1	1	323.397	1.351	20	5		DDBDMO
COC(=O)[C@@H]1CSCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000412092349	419648653	/nfs/dbraw/zinc/64/86/53/419648653.db2.gz	ZISQZDVNKYPDQU-ZDUSSCGKSA-N	1	1	324.402	1.975	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1	ZINC000421767824	419717819	/nfs/dbraw/zinc/71/78/19/419717819.db2.gz	MEMZHEUUMDZHHM-ZDUSSCGKSA-N	1	1	321.377	1.662	20	5		DDBDMO
CC[C@@H]1CN(CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CCO1	ZINC000428067471	419807320	/nfs/dbraw/zinc/80/73/20/419807320.db2.gz	ALYYJSITRBKDPY-CQSZACIVSA-N	1	1	323.349	1.141	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](N2CCCC2=O)C1	ZINC000430229497	420092912	/nfs/dbraw/zinc/09/29/12/420092912.db2.gz	VVZCUJJQRPHDSV-AWEZNQCLSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](N2CCCC2=O)C1	ZINC000430229497	420092915	/nfs/dbraw/zinc/09/29/15/420092915.db2.gz	VVZCUJJQRPHDSV-AWEZNQCLSA-N	1	1	319.361	1.800	20	5		DDBDMO
C[C@@H](CN)[N@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000430924949	420208493	/nfs/dbraw/zinc/20/84/93/420208493.db2.gz	BWDVLAHQOSJQBL-JTQLQIEISA-N	1	1	308.338	1.172	20	5		DDBDMO
C[C@@H](CN)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000430924949	420208497	/nfs/dbraw/zinc/20/84/97/420208497.db2.gz	BWDVLAHQOSJQBL-JTQLQIEISA-N	1	1	308.338	1.172	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420605195	420329748	/nfs/dbraw/zinc/32/97/48/420329748.db2.gz	UMFFEFUMEFPUFM-UHFFFAOYSA-N	1	1	303.322	1.701	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1	ZINC000444697968	230122960	/nfs/dbraw/zinc/12/29/60/230122960.db2.gz	RIFCAGAKKRDMMC-GXSJLCMTSA-N	1	1	322.287	1.427	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000439132598	420481570	/nfs/dbraw/zinc/48/15/70/420481570.db2.gz	XSPFXQXKYSYASH-UHFFFAOYSA-N	1	1	303.326	1.313	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@H+]1CCCC1(C)C	ZINC000457069530	420601810	/nfs/dbraw/zinc/60/18/10/420601810.db2.gz	GBACKRFJZSWNCQ-UHFFFAOYSA-N	1	1	309.370	1.090	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450959495	420571302	/nfs/dbraw/zinc/57/13/02/420571302.db2.gz	YMYPIELANMSHOV-NSHDSACASA-N	1	1	307.350	1.300	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450959495	420571308	/nfs/dbraw/zinc/57/13/08/420571308.db2.gz	YMYPIELANMSHOV-NSHDSACASA-N	1	1	307.350	1.300	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000457101600	420612606	/nfs/dbraw/zinc/61/26/06/420612606.db2.gz	YPGLFIASEWDSHD-LLVKDONJSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000457101600	420612612	/nfs/dbraw/zinc/61/26/12/420612612.db2.gz	YPGLFIASEWDSHD-LLVKDONJSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)N1CCN(C)CC1	ZINC000449134359	420957237	/nfs/dbraw/zinc/95/72/37/420957237.db2.gz	IRBNDVKSUJVSBH-CABCVRRESA-N	1	1	320.437	1.751	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000489924024	421180685	/nfs/dbraw/zinc/18/06/85/421180685.db2.gz	KWFVDIMHRCYMPL-NSHDSACASA-N	1	1	315.333	1.578	20	5		DDBDMO
C[C@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CCO	ZINC000450456062	421199787	/nfs/dbraw/zinc/19/97/87/421199787.db2.gz	WPMOPDQFDQLNJQ-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)n1	ZINC000548692862	421463764	/nfs/dbraw/zinc/46/37/64/421463764.db2.gz	LKSAQIGJQZEBGD-ZDUSSCGKSA-N	1	1	322.409	1.888	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000558764587	421825021	/nfs/dbraw/zinc/82/50/21/421825021.db2.gz	HMHBATUQMGNQQK-LLVKDONJSA-N	1	1	309.370	1.416	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000542778312	421829289	/nfs/dbraw/zinc/82/92/89/421829289.db2.gz	KUWDZIAQYYHDGQ-HIFRSBDPSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1nnc2n1CCCCC2	ZINC000595434376	422356506	/nfs/dbraw/zinc/35/65/06/422356506.db2.gz	VBWDIYKKNUWURF-LLVKDONJSA-N	1	1	319.369	1.460	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000577294239	422383898	/nfs/dbraw/zinc/38/38/98/422383898.db2.gz	MGMOGRLPXSVXFO-MNOVXSKESA-N	1	1	321.381	1.565	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000597605244	422388687	/nfs/dbraw/zinc/38/86/87/422388687.db2.gz	OTQWARRXCOUBTG-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000597922620	422392482	/nfs/dbraw/zinc/39/24/82/422392482.db2.gz	JKTMMTUJDMYVLH-VIFPVBQESA-N	1	1	307.354	1.175	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000342074447	271291208	/nfs/dbraw/zinc/29/12/08/271291208.db2.gz	XEZPBTHPHPACLH-CQSZACIVSA-N	1	1	321.377	1.821	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(N)=O	ZINC000342119362	271304648	/nfs/dbraw/zinc/30/46/48/271304648.db2.gz	UYAAFNDLDZEDOK-LBPRGKRZSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(N)=O	ZINC000342119362	271304652	/nfs/dbraw/zinc/30/46/52/271304652.db2.gz	UYAAFNDLDZEDOK-LBPRGKRZSA-N	1	1	317.349	1.340	20	5		DDBDMO
Cn1cc([C@@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)C(C)(C)C)cn1	ZINC000342314807	271372756	/nfs/dbraw/zinc/37/27/56/271372756.db2.gz	ZVSGAAYRZXSKFV-GFCCVEGCSA-N	1	1	306.370	1.939	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000343997911	271928709	/nfs/dbraw/zinc/92/87/09/271928709.db2.gz	YDNUFDCETJTWJP-OAHLLOKOSA-N	1	1	310.350	1.729	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C	ZINC000344593447	272066588	/nfs/dbraw/zinc/06/65/88/272066588.db2.gz	CCUIQKISQUWMBO-LBPRGKRZSA-N	1	1	323.397	1.336	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000344704497	272095307	/nfs/dbraw/zinc/09/53/07/272095307.db2.gz	ASXNNDIIBHMSTA-UHFFFAOYSA-N	1	1	315.333	1.216	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1	ZINC000276597983	274538614	/nfs/dbraw/zinc/53/86/14/274538614.db2.gz	KEWIEPNPZRIBAO-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc(OC)ccc1[N+](=O)[O-])C1CC1	ZINC000263702448	276130072	/nfs/dbraw/zinc/13/00/72/276130072.db2.gz	IXSRPAYEYLVWFF-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@@H]21	ZINC000408026840	277129714	/nfs/dbraw/zinc/12/97/14/277129714.db2.gz	JJAOSVJPLOKGTO-GJZGRUSLSA-N	1	1	318.377	1.472	20	5		DDBDMO
C[C@@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272738699	278330126	/nfs/dbraw/zinc/33/01/26/278330126.db2.gz	CLEHEUDGEADIMX-SNVBAGLBSA-N	1	1	304.350	1.557	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000573566211	304601843	/nfs/dbraw/zinc/60/18/43/304601843.db2.gz	ZJCFUUYAVFNERA-CQSZACIVSA-N	1	1	315.333	1.115	20	5		DDBDMO
C[NH+](C)CC(=O)Nc1cc(Br)cc([N+](=O)[O-])c1	ZINC000356870723	298896404	/nfs/dbraw/zinc/89/64/04/298896404.db2.gz	VVJLWNIPFRDZMW-UHFFFAOYSA-N	1	1	302.128	1.857	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@H]21	ZINC000364300809	300372329	/nfs/dbraw/zinc/37/23/29/300372329.db2.gz	GURFOZRAFNSNMS-VHSXEESVSA-N	1	1	307.379	1.834	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@H]21	ZINC000368590252	301060211	/nfs/dbraw/zinc/06/02/11/301060211.db2.gz	KJKJCAFWGXTFHR-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1c(C(=O)N2CCC[N@H+]([C@@H](C)CO)CC2)cccc1[N+](=O)[O-]	ZINC000368967057	301112905	/nfs/dbraw/zinc/11/29/05/301112905.db2.gz	UOUXEVPBLJWGPG-LBPRGKRZSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1c(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cccc1[N+](=O)[O-]	ZINC000368976268	301115467	/nfs/dbraw/zinc/11/54/67/301115467.db2.gz	VGECAVZOBQBKCJ-GZBFAFLISA-N	1	1	303.362	1.989	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)O1	ZINC000369039599	301123491	/nfs/dbraw/zinc/12/34/91/301123491.db2.gz	BLTRNTURLNIXKU-OAHLLOKOSA-N	1	1	321.333	1.548	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)O1	ZINC000369039599	301123493	/nfs/dbraw/zinc/12/34/93/301123493.db2.gz	BLTRNTURLNIXKU-OAHLLOKOSA-N	1	1	321.333	1.548	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000369998242	301254562	/nfs/dbraw/zinc/25/45/62/301254562.db2.gz	QRCPFOHZFWNPPX-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000369998242	301254564	/nfs/dbraw/zinc/25/45/64/301254564.db2.gz	QRCPFOHZFWNPPX-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000369998242	301254567	/nfs/dbraw/zinc/25/45/67/301254567.db2.gz	QRCPFOHZFWNPPX-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1	ZINC000370092584	301274475	/nfs/dbraw/zinc/27/44/75/301274475.db2.gz	ZGUVTBJZNJIKIT-UHFFFAOYSA-N	1	1	306.366	1.735	20	5		DDBDMO
COc1cc(N2CC[N@@H+]3CCOC[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000375845418	302003375	/nfs/dbraw/zinc/00/33/75/302003375.db2.gz	GQMCKSGICPSARG-SNVBAGLBSA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1cc(N2CC[N@H+]3CCOC[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000375845418	302003378	/nfs/dbraw/zinc/00/33/78/302003378.db2.gz	GQMCKSGICPSARG-SNVBAGLBSA-N	1	1	311.313	1.263	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccccn2)c1	ZINC000530963067	303222815	/nfs/dbraw/zinc/22/28/15/303222815.db2.gz	BJBIZILWCHPDFY-UKRRQHHQSA-N	1	1	317.349	1.384	20	5		DDBDMO
C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)S(C)(=O)=O	ZINC000541555371	303423249	/nfs/dbraw/zinc/42/32/49/303423249.db2.gz	AWQGYUHTNHISHP-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC[C@H]([NH+]2CC=CC2)C1	ZINC000173524179	304809880	/nfs/dbraw/zinc/80/98/80/304809880.db2.gz	WMBFFISTBZMPNB-LBPRGKRZSA-N	1	1	323.374	1.230	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC	ZINC000369683107	307126597	/nfs/dbraw/zinc/12/65/97/307126597.db2.gz	IXKOHSMTTVHZFX-MRXNPFEDSA-N	1	1	322.361	1.959	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2CC[C@@H](C1)O2)Nc1ccc([N+](=O)[O-])cc1	ZINC000374092034	307203310	/nfs/dbraw/zinc/20/33/10/307203310.db2.gz	HULCTILOPSUZKR-OKILXGFUSA-N	1	1	305.334	1.787	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)n1	ZINC000375431863	307226185	/nfs/dbraw/zinc/22/61/85/307226185.db2.gz	TVWRURBDUHWQLQ-NSHDSACASA-N	1	1	318.337	1.541	20	5		DDBDMO
COC(=O)[C@@]12CCC[C@H]1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000376268387	307242061	/nfs/dbraw/zinc/24/20/61/307242061.db2.gz	VKHIKEGCHHZLGN-SMDDNHRTSA-N	1	1	308.338	1.066	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000376660569	307252256	/nfs/dbraw/zinc/25/22/56/307252256.db2.gz	OWFXZHNSARVHPS-HNNXBMFYSA-N	1	1	321.377	1.363	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)C[C@H]21	ZINC000376662928	307252466	/nfs/dbraw/zinc/25/24/66/307252466.db2.gz	DANQRIJTORCLAL-GXFFZTMASA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000567178776	308075117	/nfs/dbraw/zinc/07/51/17/308075117.db2.gz	PSIHNVINLIDZSW-CYBMUJFWSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)n1	ZINC000576686349	308331950	/nfs/dbraw/zinc/33/19/50/308331950.db2.gz	KZOPGTSBJZXLKC-ONGXEEELSA-N	1	1	307.354	1.024	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488801830	484219050	/nfs/dbraw/zinc/21/90/50/484219050.db2.gz	NHVIXJIZBKDJLO-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cnn(C)c1	ZINC000348325729	490749016	/nfs/dbraw/zinc/74/90/16/490749016.db2.gz	RRHXOUIKNBLNMG-SECBINFHSA-N	1	1	303.322	1.278	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)c1csc([N+](=O)[O-])c1	ZINC000452348121	534573673	/nfs/dbraw/zinc/57/36/73/534573673.db2.gz	KOINODGLXODLFB-NSHDSACASA-N	1	1	313.379	1.233	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000331853619	534714254	/nfs/dbraw/zinc/71/42/54/534714254.db2.gz	AYZHESOEYSHYHN-UHFFFAOYSA-N	1	1	303.322	1.905	20	5		DDBDMO
CC(C)(C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(N)=O	ZINC000444660259	526710596	/nfs/dbraw/zinc/71/05/96/526710596.db2.gz	JDYQUPBZKXKWPW-GFCCVEGCSA-N	1	1	305.338	1.461	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](CC)C2)c1	ZINC000412880633	528612172	/nfs/dbraw/zinc/61/21/72/528612172.db2.gz	RMMQGIFZQGCBDS-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000490289062	528723572	/nfs/dbraw/zinc/72/35/72/528723572.db2.gz	FSYKPJDFVVCBPH-HNNXBMFYSA-N	1	1	305.378	1.936	20	5		DDBDMO
CC[N@@H+](CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)C(C)C	ZINC000736537511	598352708	/nfs/dbraw/zinc/35/27/08/598352708.db2.gz	VLSXCRSXXFZGMS-UHFFFAOYSA-N	1	1	319.369	1.917	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000820877006	606706253	/nfs/dbraw/zinc/70/62/53/606706253.db2.gz	XZXURUGLDJSLBQ-SECBINFHSA-N	1	1	320.357	1.312	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)NCc1ccccn1)c1ccccc1[N+](=O)[O-]	ZINC000746048412	700003452	/nfs/dbraw/zinc/00/34/52/700003452.db2.gz	IGKZZFKJKHRDNU-GFCCVEGCSA-N	1	1	314.345	1.957	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1	ZINC000068240289	696369537	/nfs/dbraw/zinc/36/95/37/696369537.db2.gz	SIPXSWBINHADOB-UHFFFAOYSA-N	1	1	320.393	1.829	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CCCC1)C2	ZINC000981764144	696907390	/nfs/dbraw/zinc/90/73/90/696907390.db2.gz	OHEJRPVULRNBPQ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CC1CCCC1)C2	ZINC000981764144	696907393	/nfs/dbraw/zinc/90/73/93/696907393.db2.gz	OHEJRPVULRNBPQ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CC1CCCC1)C2	ZINC000981764144	696907396	/nfs/dbraw/zinc/90/73/96/696907396.db2.gz	OHEJRPVULRNBPQ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]CC2=CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983655804	697286957	/nfs/dbraw/zinc/28/69/57/697286957.db2.gz	VOJWNYYIVSIQKF-KBUPBQIOSA-N	1	1	307.394	1.636	20	5		DDBDMO
CC(=O)N1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274408	698090563	/nfs/dbraw/zinc/09/05/63/698090563.db2.gz	HLCLUBNEKIOESZ-HNNXBMFYSA-N	1	1	307.350	1.182	20	5		DDBDMO
CC(=O)N1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274408	698090569	/nfs/dbraw/zinc/09/05/69/698090569.db2.gz	HLCLUBNEKIOESZ-HNNXBMFYSA-N	1	1	307.350	1.182	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000776591753	698123595	/nfs/dbraw/zinc/12/35/95/698123595.db2.gz	WMRATURRMVCFQH-SQWLQELKSA-N	1	1	306.362	1.987	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000778840940	698375620	/nfs/dbraw/zinc/37/56/20/698375620.db2.gz	SESPBJMITLIKBM-UHFFFAOYSA-N	1	1	307.310	1.470	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1	ZINC000800846288	700248547	/nfs/dbraw/zinc/24/85/47/700248547.db2.gz	IJYOIZNFDKYDRM-ZDUSSCGKSA-N	1	1	306.366	1.478	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(NCC[N@H+]2CCCOCC2)c1	ZINC000782418722	698723507	/nfs/dbraw/zinc/72/35/07/698723507.db2.gz	WLWYHOVSNZXWDJ-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](c3ccnn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000800860787	700250392	/nfs/dbraw/zinc/25/03/92/700250392.db2.gz	XYMZECUPRUYYTJ-ZDUSSCGKSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](c3ccnn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000800860787	700250394	/nfs/dbraw/zinc/25/03/94/700250394.db2.gz	XYMZECUPRUYYTJ-ZDUSSCGKSA-N	1	1	318.381	1.979	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000786922548	699180134	/nfs/dbraw/zinc/18/01/34/699180134.db2.gz	ISHQUXRFQVNLHJ-LLVKDONJSA-N	1	1	304.350	1.391	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](C2OCCO2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000719037219	699298021	/nfs/dbraw/zinc/29/80/21/699298021.db2.gz	WQTPSDRRLPUGEL-NSHDSACASA-N	1	1	321.333	1.228	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](C2OCCO2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000719037219	699298022	/nfs/dbraw/zinc/29/80/22/699298022.db2.gz	WQTPSDRRLPUGEL-NSHDSACASA-N	1	1	321.333	1.228	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@@H+]1Cn1cc([N+](=O)[O-])c(C)n1	ZINC000789518343	699392588	/nfs/dbraw/zinc/39/25/88/699392588.db2.gz	FQSXYDSVNYOCGP-GFCCVEGCSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1cc([N+](=O)[O-])c(C)n1	ZINC000789518343	699392591	/nfs/dbraw/zinc/39/25/91/699392591.db2.gz	FQSXYDSVNYOCGP-GFCCVEGCSA-N	1	1	309.370	1.438	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3COCCO3)CC2)cc1	ZINC000733302524	699587940	/nfs/dbraw/zinc/58/79/40/699587940.db2.gz	YYYMRZVQQZYVFW-HNNXBMFYSA-N	1	1	307.350	1.132	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000735833005	699705033	/nfs/dbraw/zinc/70/50/33/699705033.db2.gz	VGIVAQMYVUEAEI-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000744408551	699948178	/nfs/dbraw/zinc/94/81/78/699948178.db2.gz	XJUISDGSRFKZSS-UHFFFAOYSA-N	1	1	319.321	1.445	20	5		DDBDMO
CO[C@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000751947509	700329112	/nfs/dbraw/zinc/32/91/12/700329112.db2.gz	QQFMDHUPQHOHKL-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000751947509	700329116	/nfs/dbraw/zinc/32/91/16/700329116.db2.gz	QQFMDHUPQHOHKL-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
COc1ccc(NC(=O)CN2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000761068762	700838239	/nfs/dbraw/zinc/83/82/39/700838239.db2.gz	JKEYCIQWFNGFHZ-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000764280318	700965964	/nfs/dbraw/zinc/96/59/64/700965964.db2.gz	UGLDXNGHYRHUFY-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000764280318	700965965	/nfs/dbraw/zinc/96/59/65/700965965.db2.gz	UGLDXNGHYRHUFY-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2c([N+](=O)[O-])cccc2[N+](=O)[O-])C1	ZINC000804442358	701190596	/nfs/dbraw/zinc/19/05/96/701190596.db2.gz	VOSTUYPDQLAFDV-SNVBAGLBSA-N	1	1	310.310	1.636	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@]3(CCOC3)C2)cc1	ZINC000769220543	701237311	/nfs/dbraw/zinc/23/73/11/701237311.db2.gz	MCERGUOIDGXQHK-GJZGRUSLSA-N	1	1	308.334	1.120	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@]3(CCOC3)C2)cc1	ZINC000769220543	701237312	/nfs/dbraw/zinc/23/73/12/701237312.db2.gz	MCERGUOIDGXQHK-GJZGRUSLSA-N	1	1	308.334	1.120	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000840358465	702082793	/nfs/dbraw/zinc/08/27/93/702082793.db2.gz	NYXOCUCVXFQJGB-UHFFFAOYSA-N	1	1	323.393	1.687	20	5		DDBDMO
CC(C)[C@H]1CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000879601136	706733958	/nfs/dbraw/zinc/73/39/58/706733958.db2.gz	JXZNRKNEBDPHJX-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000848353160	703542248	/nfs/dbraw/zinc/54/22/48/703542248.db2.gz	YIITWRMBONOIPY-OLZOCXBDSA-N	1	1	319.365	1.319	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)N1	ZINC000852297126	704000144	/nfs/dbraw/zinc/00/01/44/704000144.db2.gz	FESLKWLKHLKYJP-HNNXBMFYSA-N	1	1	317.345	1.498	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000852432208	704044852	/nfs/dbraw/zinc/04/48/52/704044852.db2.gz	JANRVEWSTGLAQR-CQSZACIVSA-N	1	1	305.334	1.664	20	5		DDBDMO
C[C@H](C[C@H]1CCCC[N@H+]1C)OC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000870789514	704132497	/nfs/dbraw/zinc/13/24/97/704132497.db2.gz	HFZLOLUEBLJUSD-CHWSQXEVSA-N	1	1	324.381	1.988	20	5		DDBDMO
CN(C[C@@H]1CCCO1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870879113	704155110	/nfs/dbraw/zinc/15/51/10/704155110.db2.gz	UCHZNNDLMHUFNP-DZGCQCFKSA-N	1	1	307.350	1.406	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)n1	ZINC000853964782	704341317	/nfs/dbraw/zinc/34/13/17/704341317.db2.gz	AMQFURYJWQCGDX-CYBMUJFWSA-N	1	1	306.366	1.334	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@@H+](CC)C1	ZINC000855490880	704487542	/nfs/dbraw/zinc/48/75/42/704487542.db2.gz	LGRBEUSZTVFDPO-GFCCVEGCSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000832783684	706983487	/nfs/dbraw/zinc/98/34/87/706983487.db2.gz	SYZGQGGXXKCBNZ-LLVKDONJSA-N	1	1	324.337	1.001	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000860165422	705120936	/nfs/dbraw/zinc/12/09/36/705120936.db2.gz	VQXDAPYKRDTDRI-NXEZZACHSA-N	1	1	310.281	1.347	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000860165422	705120939	/nfs/dbraw/zinc/12/09/39/705120939.db2.gz	VQXDAPYKRDTDRI-NXEZZACHSA-N	1	1	310.281	1.347	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000874834294	705192279	/nfs/dbraw/zinc/19/22/79/705192279.db2.gz	QWBCFIGOYMITMK-KGLIPLIRSA-N	1	1	304.350	1.486	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2[C@H]1CCC[N@@H+]2C	ZINC000874842455	705197527	/nfs/dbraw/zinc/19/75/27/705197527.db2.gz	HSLDRILZNQFZLX-CHWSQXEVSA-N	1	1	321.381	1.185	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823927160	705340636	/nfs/dbraw/zinc/34/06/36/705340636.db2.gz	OMDOCJGYNQVRNN-NSHDSACASA-N	1	1	307.354	1.735	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825378905	705658055	/nfs/dbraw/zinc/65/80/55/705658055.db2.gz	IXCDWRQYSZWIDU-RISCZKNCSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825615412	705703340	/nfs/dbraw/zinc/70/33/40/705703340.db2.gz	VOVQYDSIGGGLGZ-FZMZJTMJSA-N	1	1	309.366	1.475	20	5		DDBDMO
C[C@H](c1nc(-c2ccc([N+](=O)[O-])cc2)no1)N1CC[NH2+]CC1=O	ZINC000863657721	705978049	/nfs/dbraw/zinc/97/80/49/705978049.db2.gz	DVMNYBBBKHLYQV-SECBINFHSA-N	1	1	317.305	1.138	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CC[NH+](CC(C)(C)O)CC1	ZINC000881906719	707418662	/nfs/dbraw/zinc/41/86/62/707418662.db2.gz	YMYYCLNNADZLPA-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
C[C@H](NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000828905414	706253414	/nfs/dbraw/zinc/25/34/14/706253414.db2.gz	WPIPNMOQBOVGAA-XHDPSFHLSA-N	1	1	319.361	1.395	20	5		DDBDMO
Cn1nnnc1CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000878327032	706360767	/nfs/dbraw/zinc/36/07/67/706360767.db2.gz	XNLCTCLJSHSADL-UHFFFAOYSA-N	1	1	302.338	1.325	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880528823	707005292	/nfs/dbraw/zinc/00/52/92/707005292.db2.gz	HBIPXIIVAMFXCW-NWANDNLSSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880528823	707005296	/nfs/dbraw/zinc/00/52/96/707005296.db2.gz	HBIPXIIVAMFXCW-NWANDNLSSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=[N+]([O-])c1ccc([O-])cc1C[N@@H+]1C[C@H](O)CC2(CCOCC2)C1	ZINC000880581103	707025737	/nfs/dbraw/zinc/02/57/37/707025737.db2.gz	WPWVSWRUGHOGKO-CQSZACIVSA-N	1	1	322.361	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc([O-])cc1CN1C[C@H](O)CC2(CCOCC2)C1	ZINC000880581103	707025740	/nfs/dbraw/zinc/02/57/40/707025740.db2.gz	WPWVSWRUGHOGKO-CQSZACIVSA-N	1	1	322.361	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](O)CC3(CCOCC3)C2)cc1	ZINC000880585227	707027857	/nfs/dbraw/zinc/02/78/57/707027857.db2.gz	FSFPIYXVMGDBGZ-OAHLLOKOSA-N	1	1	306.362	1.958	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000880614810	707042496	/nfs/dbraw/zinc/04/24/96/707042496.db2.gz	ZWFUFXPFYOBTCX-GFCCVEGCSA-N	1	1	323.397	1.288	20	5		DDBDMO
CCC1([NH+]2CCCCC2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000881628699	707308782	/nfs/dbraw/zinc/30/87/82/707308782.db2.gz	AUHUWSUPPRRIGI-ZIAGYGMSSA-N	1	1	309.410	1.909	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1N1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000872758430	707587827	/nfs/dbraw/zinc/58/78/27/707587827.db2.gz	ZWFLMKYDLAYAIR-NWDGAFQWSA-N	1	1	311.769	1.894	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC000872785648	707600904	/nfs/dbraw/zinc/60/09/04/707600904.db2.gz	GLDAYOJSQQUOCJ-PHIMTYICSA-N	1	1	303.322	1.184	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000882491505	707662497	/nfs/dbraw/zinc/66/24/97/707662497.db2.gz	GTOPKTBKRYTEHX-LBPRGKRZSA-N	1	1	307.350	1.492	20	5		DDBDMO
CCOC(=O)c1ccnc(NC[C@@H]2CC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000882960759	707874673	/nfs/dbraw/zinc/87/46/73/707874673.db2.gz	UXXZTOMUQMLOHT-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)C[C@]2(C)C1	ZINC000896913208	708181274	/nfs/dbraw/zinc/18/12/74/708181274.db2.gz	OJBYMRAUTWGGCK-BZNIZROVSA-N	1	1	313.361	1.926	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCCC[C@H]1CN1CCOCC1	ZINC000886026568	708684052	/nfs/dbraw/zinc/68/40/52/708684052.db2.gz	YKNNQKSCJFFEAK-HNNXBMFYSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCCC[C@H]1CN1CCOCC1	ZINC000886026568	708684054	/nfs/dbraw/zinc/68/40/54/708684054.db2.gz	YKNNQKSCJFFEAK-HNNXBMFYSA-N	1	1	320.393	1.677	20	5		DDBDMO
O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])CN1	ZINC000886098678	708697937	/nfs/dbraw/zinc/69/79/37/708697937.db2.gz	PKHFKEMSRIYGQE-QWHCGFSZSA-N	1	1	304.350	1.480	20	5		DDBDMO
CN1CCC2(CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)C1=O	ZINC000886175068	708710324	/nfs/dbraw/zinc/71/03/24/708710324.db2.gz	PPWIAKHJXSXSBY-UHFFFAOYSA-N	1	1	304.350	1.434	20	5		DDBDMO
CC(C)NC(=O)[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285384	708735783	/nfs/dbraw/zinc/73/57/83/708735783.db2.gz	HJPGMCNWJVQRPD-ZDUSSCGKSA-N	1	1	306.366	1.726	20	5		DDBDMO
CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285384	708735784	/nfs/dbraw/zinc/73/57/84/708735784.db2.gz	HJPGMCNWJVQRPD-ZDUSSCGKSA-N	1	1	306.366	1.726	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C)C[C@H]1CC(C)C	ZINC000886593586	708785838	/nfs/dbraw/zinc/78/58/38/708785838.db2.gz	UVHVRITZDVKLDZ-CYBMUJFWSA-N	1	1	323.397	1.288	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3ncccn3)C2)c1	ZINC000886680637	708812464	/nfs/dbraw/zinc/81/24/64/708812464.db2.gz	IWGGCZJXRAOFOR-LBPRGKRZSA-N	1	1	302.338	1.461	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]([C@@H]2CCCO2)C1	ZINC000886823106	708854161	/nfs/dbraw/zinc/85/41/61/708854161.db2.gz	ZAIWXAMQLVNYLE-OCCSQVGLSA-N	1	1	307.350	1.257	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000892144412	710379820	/nfs/dbraw/zinc/37/98/20/710379820.db2.gz	OAHJCJKAVALSSE-ZYHUDNBSSA-N	1	1	308.338	1.274	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000892417912	710434125	/nfs/dbraw/zinc/43/41/25/710434125.db2.gz	KGYDYGUNERFCSF-CABCVRRESA-N	1	1	318.377	1.973	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C	ZINC000928439690	713196522	/nfs/dbraw/zinc/19/65/22/713196522.db2.gz	JVQKRKDKVNHQOG-GXSJLCMTSA-N	1	1	302.334	1.899	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)c1	ZINC000928459940	713206173	/nfs/dbraw/zinc/20/61/73/713206173.db2.gz	YJMPGQZVGIOOKA-QWHCGFSZSA-N	1	1	321.377	1.881	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2Cc3c[nH+]cn3C2)c1	ZINC000894995396	711356146	/nfs/dbraw/zinc/35/61/46/711356146.db2.gz	CFLTZRCBWZRZFH-SNVBAGLBSA-N	1	1	302.290	1.615	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H](C)[C@@](C)(CO)C2)c1[N+](=O)[O-]	ZINC000895455598	711516506	/nfs/dbraw/zinc/51/65/06/711516506.db2.gz	CFMMLIRKVBKSCM-ZUZCIYMTSA-N	1	1	310.350	1.759	20	5		DDBDMO
CC(C)c1ccc(CN2CCNCC[NH2+]CC2)cc1[N+](=O)[O-]	ZINC000904397883	711852364	/nfs/dbraw/zinc/85/23/64/711852364.db2.gz	JSFXRBJIVFZCDD-UHFFFAOYSA-N	1	1	306.410	1.713	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1C	ZINC000914290941	713371574	/nfs/dbraw/zinc/37/15/74/713371574.db2.gz	FIQKQXVWVFYDJR-MFKMUULPSA-N	1	1	322.365	1.495	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1C[C@@H]2COC[C@@H]2O1	ZINC000930353099	713812071	/nfs/dbraw/zinc/81/20/71/713812071.db2.gz	HFWIBODEMPHSNK-KBMXLJTQSA-N	1	1	306.362	1.873	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCc1cc(F)ccc1[N+](=O)[O-])C1CC1	ZINC000930648070	713886790	/nfs/dbraw/zinc/88/67/90/713886790.db2.gz	GFKYWHNDGIGWPC-UHFFFAOYSA-N	1	1	309.341	1.877	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000930770131	713916056	/nfs/dbraw/zinc/91/60/56/713916056.db2.gz	VUFUOCDWENYWIM-ZWNOBZJWSA-N	1	1	320.349	1.771	20	5		DDBDMO
C[C@H]1[C@@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043575	713989391	/nfs/dbraw/zinc/98/93/91/713989391.db2.gz	QQULNZKQEVDCKO-JSGCOSHPSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043575	713989394	/nfs/dbraw/zinc/98/93/94/713989394.db2.gz	QQULNZKQEVDCKO-JSGCOSHPSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@](CO)([NH2+]Cc1cnn(CCF)c1)c1cccc([N+](=O)[O-])c1	ZINC000922308265	714017426	/nfs/dbraw/zinc/01/74/26/714017426.db2.gz	WNHNZUXWNYOICT-OAHLLOKOSA-N	1	1	322.340	1.758	20	5		DDBDMO
COc1cc(CN[C@H]2CC[N@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557438	714087603	/nfs/dbraw/zinc/08/76/03/714087603.db2.gz	OEOVQLIWOIYUAL-JQWIXIFHSA-N	1	1	309.366	1.794	20	5		DDBDMO
COc1cc(CN[C@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557438	714087604	/nfs/dbraw/zinc/08/76/04/714087604.db2.gz	OEOVQLIWOIYUAL-JQWIXIFHSA-N	1	1	309.366	1.794	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1	ZINC000931431656	714095328	/nfs/dbraw/zinc/09/53/28/714095328.db2.gz	YTYUUFXSIZCLGM-GXTWGEPZSA-N	1	1	305.378	1.987	20	5		DDBDMO
CN(C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1	ZINC000923279032	714295328	/nfs/dbraw/zinc/29/53/28/714295328.db2.gz	BBQNXTZYOGPBII-CYBMUJFWSA-N	1	1	309.366	1.018	20	5		DDBDMO
Cn1nccc1[C@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000932267315	714295839	/nfs/dbraw/zinc/29/58/39/714295839.db2.gz	OBTGHXZFZOPXMA-CQSZACIVSA-N	1	1	317.349	1.327	20	5		DDBDMO
Cn1nccc1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000932267315	714295842	/nfs/dbraw/zinc/29/58/42/714295842.db2.gz	OBTGHXZFZOPXMA-CQSZACIVSA-N	1	1	317.349	1.327	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@@H]1C[C@H]1CCOC1	ZINC000933675767	714645579	/nfs/dbraw/zinc/64/55/79/714645579.db2.gz	OFIKESHARHOTQV-KGLIPLIRSA-N	1	1	324.381	1.227	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@@H]1C[C@H]1CCOC1	ZINC000933675767	714645580	/nfs/dbraw/zinc/64/55/80/714645580.db2.gz	OFIKESHARHOTQV-KGLIPLIRSA-N	1	1	324.381	1.227	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@@H]1C[C@H]1CCCO1	ZINC000933684392	714647967	/nfs/dbraw/zinc/64/79/67/714647967.db2.gz	ARKIRYPUHBUNEN-UONOGXRCSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@@H]1C[C@H]1CCCO1	ZINC000933684392	714647968	/nfs/dbraw/zinc/64/79/68/714647968.db2.gz	ARKIRYPUHBUNEN-UONOGXRCSA-N	1	1	324.381	1.370	20	5		DDBDMO
O=C1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCCCCN1	ZINC000934156290	714756713	/nfs/dbraw/zinc/75/67/13/714756713.db2.gz	CEFLBPNGFJHNTK-OAHLLOKOSA-N	1	1	321.377	1.620	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CCC3)C[C@H]2CC1	ZINC000946589156	718844632	/nfs/dbraw/zinc/84/46/32/718844632.db2.gz	JGMIXRZOUDUYOW-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CC3CCC3)C[C@H]2CC1	ZINC000946589156	718844636	/nfs/dbraw/zinc/84/46/36/718844636.db2.gz	JGMIXRZOUDUYOW-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CCC3)C[C@H]2CC1	ZINC000946589156	718844640	/nfs/dbraw/zinc/84/46/40/718844640.db2.gz	JGMIXRZOUDUYOW-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4ccc([N+](=O)[O-])cc4n3)C[C@@H]21	ZINC001164667048	719385342	/nfs/dbraw/zinc/38/53/42/719385342.db2.gz	MNXYLSYULDGMCU-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4cccc([N+](=O)[O-])c4n3)C[C@@H]21	ZINC001164664733	719389899	/nfs/dbraw/zinc/38/98/99/719389899.db2.gz	COEQLDSSFIOBFM-KBPBESRZSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[C@H](Nc1c2c(ccc1[N+](=O)[O-])NCC2)[C@@H]1C[N@@H+](C)CCN1C	ZINC001120960723	782257878	/nfs/dbraw/zinc/25/78/78/782257878.db2.gz	WTKRFGWXGPFIAZ-NHYWBVRUSA-N	1	1	319.409	1.609	20	5		DDBDMO
CCc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001022064118	734368710	/nfs/dbraw/zinc/36/87/10/734368710.db2.gz	WZBUBEGWAVKNPO-QKPAOTATSA-N	1	1	317.389	1.651	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCC2=CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022064170	734369176	/nfs/dbraw/zinc/36/91/76/734369176.db2.gz	ZFPSHOSHBVIVQW-LXTVHRRPSA-N	1	1	307.394	1.779	20	5		DDBDMO
Cc1ccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(Cl)c1	ZINC001126936846	742842907	/nfs/dbraw/zinc/84/29/07/742842907.db2.gz	UKLGJLKLCRUQND-DGCLKSJQSA-N	1	1	311.769	1.519	20	5		DDBDMO
C[C@H]1Cc2n[nH]cc2C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC001197787338	747265020	/nfs/dbraw/zinc/26/50/20/747265020.db2.gz	UDZCFTPCBUNPGE-NSHDSACASA-N	1	1	317.349	1.174	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@H]1[C@@H]1CCCO1	ZINC001198685211	747577048	/nfs/dbraw/zinc/57/70/48/747577048.db2.gz	HZUCEWJFBCCKJK-GJZGRUSLSA-N	1	1	321.377	1.790	20	5		DDBDMO
[NH3+]C1(c2cccnc2)CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001168992060	762165808	/nfs/dbraw/zinc/16/58/08/762165808.db2.gz	JFHAJNCAOBBSHF-ZFWWWQNUSA-N	1	1	304.394	1.777	20	5		DDBDMO
O=C1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038654	762193624	/nfs/dbraw/zinc/19/36/24/762193624.db2.gz	JXKLKTISFAUVFU-HOTGVXAUSA-N	1	1	317.389	1.776	20	5		DDBDMO
O=C1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038654	762193625	/nfs/dbraw/zinc/19/36/25/762193625.db2.gz	JXKLKTISFAUVFU-HOTGVXAUSA-N	1	1	317.389	1.776	20	5		DDBDMO
COC[C@]12CCCO[C@@H]1CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169022096	762201050	/nfs/dbraw/zinc/20/10/50/762201050.db2.gz	MUZSECJYXQWMOG-QKPAOTATSA-N	1	1	312.410	1.949	20	5		DDBDMO
CN1CCN(C2CC[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)CC1	ZINC001169026324	762203392	/nfs/dbraw/zinc/20/33/92/762203392.db2.gz	KVKJFFNMTGJGMT-GOEBONIOSA-N	1	1	310.442	1.144	20	5		DDBDMO
COC[C@H]1Cn2nccc2C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169026722	762204919	/nfs/dbraw/zinc/20/49/19/762204919.db2.gz	NLIUFLOZFOOPOV-MJBXVCDLSA-N	1	1	308.382	1.407	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](Oc3ncccn3)C2)C1	ZINC001169053134	762208033	/nfs/dbraw/zinc/20/80/33/762208033.db2.gz	HQHGIWFPRMVVCW-MGPQQGTHSA-N	1	1	306.366	1.765	20	5		DDBDMO
Cc1cnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169057627	762210911	/nfs/dbraw/zinc/21/09/11/762210911.db2.gz	WKJXUXIZWWHSSM-HZSPNIEDSA-N	1	1	306.366	1.684	20	5		DDBDMO
Cc1ccc(F)c(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001020139770	760614200	/nfs/dbraw/zinc/61/42/00/760614200.db2.gz	MRAZGYARSWHZDS-RGCMKSIDSA-N	1	1	321.352	1.536	20	5		DDBDMO
Cc1cnc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC001086083317	760943317	/nfs/dbraw/zinc/94/33/17/760943317.db2.gz	VCLQPLJKFNVJIF-WRWGMCAJSA-N	1	1	324.406	1.101	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccc(N(C)C)cc1[N+](=O)[O-]	ZINC001170343719	766275870	/nfs/dbraw/zinc/27/58/70/766275870.db2.gz	ZYFZNCHHMREFDZ-UHFFFAOYSA-N	1	1	305.338	1.362	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1	ZINC001170344620	766276317	/nfs/dbraw/zinc/27/63/17/766276317.db2.gz	DIVCYWYZJWQDDV-LBPRGKRZSA-N	1	1	322.361	1.983	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1	ZINC001170344620	766276320	/nfs/dbraw/zinc/27/63/20/766276320.db2.gz	DIVCYWYZJWQDDV-LBPRGKRZSA-N	1	1	322.361	1.983	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@H](C)n2cnc(C[NH3+])n2)c1F	ZINC001173188177	777036539	/nfs/dbraw/zinc/03/65/39/777036539.db2.gz	IUIUVAMUIXUALE-QMMMGPOBSA-N	1	1	309.301	1.596	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001173235889	777063849	/nfs/dbraw/zinc/06/38/49/777063849.db2.gz	CBLYZLMFSAWQKM-JSGCOSHPSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)N1CC[NH+](C)CC1	ZINC001116143340	780478011	/nfs/dbraw/zinc/47/80/11/780478011.db2.gz	LQJAEEKDFMKHHU-LBPRGKRZSA-N	1	1	318.377	1.073	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[NH+](CCOC(C)C)CC1	ZINC001326409268	861342455	/nfs/dbraw/zinc/34/24/55/861342455.db2.gz	XAOJUMFKAFKSKJ-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Nc1cc(C)cc([N+](=O)[O-])c1	ZINC001123361592	859193492	/nfs/dbraw/zinc/19/34/92/859193492.db2.gz	YIVVJEIYTBKGPF-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
CC(C)[N@@H+](C)[C@@H]1CCN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C1	ZINC001157018973	863520990	/nfs/dbraw/zinc/52/09/90/863520990.db2.gz	CAACTYFFDNCINM-SNVBAGLBSA-N	1	1	314.773	1.801	20	5		DDBDMO
CCC[N@@H+]1CCCC[C@H]1C(=O)OCc1cn(C)nc1[N+](=O)[O-]	ZINC001330850716	864654146	/nfs/dbraw/zinc/65/41/46/864654146.db2.gz	QOHGLLCQWXLUSP-LBPRGKRZSA-N	1	1	310.354	1.636	20	5		DDBDMO
CCC[N@H+]1CCCC[C@H]1C(=O)OCc1cn(C)nc1[N+](=O)[O-]	ZINC001330850716	864654150	/nfs/dbraw/zinc/65/41/50/864654150.db2.gz	QOHGLLCQWXLUSP-LBPRGKRZSA-N	1	1	310.354	1.636	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@H]1[NH+]1CCOCC1	ZINC001160720830	866059560	/nfs/dbraw/zinc/05/95/60/866059560.db2.gz	SSONVZDLKGRXTQ-UONOGXRCSA-N	1	1	306.366	1.963	20	5		DDBDMO
Nc1nc(N[C@@H]2CCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160724459	866072082	/nfs/dbraw/zinc/07/20/82/866072082.db2.gz	LBZZQSCCFPMECE-GHMZBOCLSA-N	1	1	307.354	1.237	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1NCC[C@H]1CCC[N@H+]1C	ZINC001160966577	866230962	/nfs/dbraw/zinc/23/09/62/866230962.db2.gz	PQBSIYPZNSGYDA-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H]1CCC3(COC3)O1)CC2	ZINC001333118173	866436379	/nfs/dbraw/zinc/43/63/79/866436379.db2.gz	ICSYTRSUVIOPTN-OAHLLOKOSA-N	1	1	304.346	1.901	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@H]1CCC3(COC3)O1)CC2	ZINC001333118173	866436392	/nfs/dbraw/zinc/43/63/92/866436392.db2.gz	ICSYTRSUVIOPTN-OAHLLOKOSA-N	1	1	304.346	1.901	20	5		DDBDMO
COc1cnc(NCCC[NH+]2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC001161703977	866912858	/nfs/dbraw/zinc/91/28/58/866912858.db2.gz	VGSRJXDPAAREMH-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
C[N@H+](CC(=O)OCc1cccnc1[N+](=O)[O-])[C@@H]1CCSC1	ZINC001333907367	867144960	/nfs/dbraw/zinc/14/49/60/867144960.db2.gz	AYOUTYNOKMIBLI-LLVKDONJSA-N	1	1	311.363	1.470	20	5		DDBDMO
C[N@@H+](CC(=O)OCc1cccnc1[N+](=O)[O-])[C@@H]1CCSC1	ZINC001333907367	867144978	/nfs/dbraw/zinc/14/49/78/867144978.db2.gz	AYOUTYNOKMIBLI-LLVKDONJSA-N	1	1	311.363	1.470	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1F	ZINC001325167086	867834151	/nfs/dbraw/zinc/83/41/51/867834151.db2.gz	WBZOQVGGGQYCPN-SECBINFHSA-N	1	1	311.313	1.519	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1F	ZINC001325167086	867834163	/nfs/dbraw/zinc/83/41/63/867834163.db2.gz	WBZOQVGGGQYCPN-SECBINFHSA-N	1	1	311.313	1.519	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1NCc1noc3c1CNCC3)C[NH2+]C2	ZINC001163131955	868141860	/nfs/dbraw/zinc/14/18/60/868141860.db2.gz	QBMDMDXXMIXUNX-UHFFFAOYSA-N	1	1	315.333	1.444	20	5		DDBDMO
[NH3+][C@H]1CN(c2cnc3ccc([N+](=O)[O-])cc3n2)CCC1(F)F	ZINC001164319747	869124006	/nfs/dbraw/zinc/12/40/06/869124006.db2.gz	OAMWOPLZFHEBNB-NSHDSACASA-N	1	1	309.276	1.711	20	5		DDBDMO
CC(C)Oc1nc(N2CCC(F)(F)[C@@H]([NH3+])C2)ccc1[N+](=O)[O-]	ZINC001164325900	869129345	/nfs/dbraw/zinc/12/93/45/869129345.db2.gz	ABYAPOHLYJFXEC-JTQLQIEISA-N	1	1	316.308	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@H](CO)[C@@H](CCO)C3)c2c1	ZINC001336870501	869192231	/nfs/dbraw/zinc/19/22/31/869192231.db2.gz	VJABJNMPJXLLOD-NWDGAFQWSA-N	1	1	317.345	1.570	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC001297359020	870001382	/nfs/dbraw/zinc/00/13/82/870001382.db2.gz	KPMWHRDDXGVVBJ-JSGCOSHPSA-N	1	1	322.340	1.435	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NCCC[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC001338680971	870112894	/nfs/dbraw/zinc/11/28/94/870112894.db2.gz	HGZGIULHWLNIRU-BETUJISGSA-N	1	1	308.382	1.631	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC001339264381	870427880	/nfs/dbraw/zinc/42/78/80/870427880.db2.gz	KWMAYMIZBVQCHB-NSHDSACASA-N	1	1	321.333	1.538	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC)C1	ZINC001339468485	870512246	/nfs/dbraw/zinc/51/22/46/870512246.db2.gz	VPCCTRLFFYPMPB-QWHCGFSZSA-N	1	1	324.429	1.804	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1O[C@@H]1CCc2[nH+]ccn2C1	ZINC001227125099	882858576	/nfs/dbraw/zinc/85/85/76/882858576.db2.gz	YNXKDEIAFKFCCM-SNVBAGLBSA-N	1	1	317.301	1.972	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC001350914985	875955134	/nfs/dbraw/zinc/95/51/34/875955134.db2.gz	GAVKBMRVNSFFIJ-DUFXMDAXSA-N	1	1	307.325	1.804	20	5		DDBDMO
C[N@@H+]1C[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC001213935549	876108647	/nfs/dbraw/zinc/10/86/47/876108647.db2.gz	SBLMOOUACGUZHS-GFCCVEGCSA-N	1	1	313.379	1.213	20	5		DDBDMO
C[N@H+]1C[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC001213935549	876108655	/nfs/dbraw/zinc/10/86/55/876108655.db2.gz	SBLMOOUACGUZHS-GFCCVEGCSA-N	1	1	313.379	1.213	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CCC[N@H+](C)CC2)cc1O	ZINC001228811396	883681747	/nfs/dbraw/zinc/68/17/47/883681747.db2.gz	QAHDCGCARYHPBJ-JTQLQIEISA-N	1	1	324.333	1.950	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CCC[N@@H+](C)CC2)cc1O	ZINC001228811396	883681753	/nfs/dbraw/zinc/68/17/53/883681753.db2.gz	QAHDCGCARYHPBJ-JTQLQIEISA-N	1	1	324.333	1.950	20	5		DDBDMO
OC[C@@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@@H]1O	ZINC001232219311	886166022	/nfs/dbraw/zinc/16/60/22/886166022.db2.gz	SOTSTVUVIYSOPA-RDJZCZTQSA-N	1	1	323.396	1.958	20	5		DDBDMO
OC[C@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@H]1O	ZINC001232219310	886166163	/nfs/dbraw/zinc/16/61/63/886166163.db2.gz	SOTSTVUVIYSOPA-NVXWUHKLSA-N	1	1	323.396	1.958	20	5		DDBDMO
[NH3+]C[C@]1(O)CCCCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001246564304	892700478	/nfs/dbraw/zinc/70/04/78/892700478.db2.gz	XHKYEOACEBKMRH-HZPDHXFCSA-N	1	1	305.378	1.238	20	5		DDBDMO
Cc1ncc(C[NH3+])c(=N)n1[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254538431	896494198	/nfs/dbraw/zinc/49/41/98/896494198.db2.gz	UZFOZISRAKFCQK-JTQLQIEISA-N	1	1	301.350	1.842	20	5		DDBDMO
[NH3+]C[C@]1(N[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CN2CCC1CC2	ZINC001254580893	896513889	/nfs/dbraw/zinc/51/38/89/896513889.db2.gz	HTTVOUBZSLYYPJ-WBVHZDCISA-N	1	1	316.405	1.075	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@@H]3C[C@@H](CO)C[C@H]31)C2	ZINC001254594727	896522304	/nfs/dbraw/zinc/52/23/04/896522304.db2.gz	SPQVGZUGZHGYPP-KSHAWTQOSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CCO[C@@H]3C[C@@H](CO)C[C@H]31)C2	ZINC001254594727	896522315	/nfs/dbraw/zinc/52/23/15/896522315.db2.gz	SPQVGZUGZHGYPP-KSHAWTQOSA-N	1	1	318.373	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[NH+]([C@H]3CCOC3)CC1)C2	ZINC001254596770	896522800	/nfs/dbraw/zinc/52/28/00/896522800.db2.gz	GAYUFNYIZDIGGT-IRXDYDNUSA-N	1	1	317.389	1.469	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN([C@H]3CCOC3)CC1)C2	ZINC001254596770	896522813	/nfs/dbraw/zinc/52/28/13/896522813.db2.gz	GAYUFNYIZDIGGT-IRXDYDNUSA-N	1	1	317.389	1.469	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1C	ZINC001254605779	896526799	/nfs/dbraw/zinc/52/67/99/896526799.db2.gz	DLEDTOAFXWNDPE-VQISRLSMSA-N	1	1	304.346	1.803	20	5		DDBDMO
CN1CCN(CC[N@H+](C)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254603804	896527386	/nfs/dbraw/zinc/52/73/86/896527386.db2.gz	QWQCKQJQQNHMRK-KRWDZBQOSA-N	1	1	318.421	1.241	20	5		DDBDMO
CN1CCN(CC[N@@H+](C)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254603804	896527401	/nfs/dbraw/zinc/52/74/01/896527401.db2.gz	QWQCKQJQQNHMRK-KRWDZBQOSA-N	1	1	318.421	1.241	20	5		DDBDMO
CSc1cccc(C(=O)NCC[NH+]2CC=CC2)c1[N+](=O)[O-]	ZINC001255254459	896808312	/nfs/dbraw/zinc/80/83/12/896808312.db2.gz	BKFDAINHIZKKHW-UHFFFAOYSA-N	1	1	307.375	1.918	20	5		DDBDMO
C/C=C(/C)C(=O)NCCC[N@@H+](CC)Cc1c([N+](=O)[O-])ncn1C	ZINC001265107158	901567086	/nfs/dbraw/zinc/56/70/86/901567086.db2.gz	BIFOCBCTIFDWSH-XGICHPGQSA-N	1	1	323.397	1.623	20	5		DDBDMO
C/C=C(/C)C(=O)NCCC[N@H+](CC)Cc1c([N+](=O)[O-])ncn1C	ZINC001265107158	901567098	/nfs/dbraw/zinc/56/70/98/901567098.db2.gz	BIFOCBCTIFDWSH-XGICHPGQSA-N	1	1	323.397	1.623	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)n1	ZINC001294222911	914991782	/nfs/dbraw/zinc/99/17/82/914991782.db2.gz	DNIUGACFBDNANT-NEPJUHHUSA-N	1	1	304.350	1.607	20	5		DDBDMO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000081903844	192337280	/nfs/dbraw/zinc/33/72/80/192337280.db2.gz	HHIUBNGISPZBJS-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
CS[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000451308207	231063624	/nfs/dbraw/zinc/06/36/24/231063624.db2.gz	AFGFPSSGHFQTRT-JSGCOSHPSA-N	1	1	312.391	1.772	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](CCO)C(C)(C)C2)c1	ZINC000614829328	362042227	/nfs/dbraw/zinc/04/22/27/362042227.db2.gz	SDFOHWATOPPOQN-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
CC[N@H+](CCc1nccs1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090589606	185305464	/nfs/dbraw/zinc/30/54/64/185305464.db2.gz	OJJNAXWHDHDDDT-UHFFFAOYSA-N	1	1	322.390	1.778	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1	ZINC000413232431	529801036	/nfs/dbraw/zinc/80/10/36/529801036.db2.gz	NGHKJMSHALDTCA-LLVKDONJSA-N	1	1	320.271	1.487	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC(C)(C)CO	ZINC000294733200	529980229	/nfs/dbraw/zinc/98/02/29/529980229.db2.gz	GLLIPNLRFSHFDX-UHFFFAOYSA-N	1	1	310.350	1.912	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330913840	232158248	/nfs/dbraw/zinc/15/82/48/232158248.db2.gz	IDYZKNKNBAUNAU-GFCCVEGCSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330913840	232158252	/nfs/dbraw/zinc/15/82/52/232158252.db2.gz	IDYZKNKNBAUNAU-GFCCVEGCSA-N	1	1	306.366	1.194	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)c1	ZINC000277678362	213686970	/nfs/dbraw/zinc/68/69/70/213686970.db2.gz	GDMNTLCUGLZLNR-ONGXEEELSA-N	1	1	322.287	1.427	20	5		DDBDMO
COC[C@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000279783349	215144474	/nfs/dbraw/zinc/14/44/74/215144474.db2.gz	LNLCGOSHGZQLEF-LBPRGKRZSA-N	1	1	323.374	1.815	20	5		DDBDMO
C[N@@H+](CCCCCO)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000279795927	215153689	/nfs/dbraw/zinc/15/36/89/215153689.db2.gz	WCKFUWJLFUJYQA-ZDUSSCGKSA-N	1	1	312.366	1.429	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000048428674	352539706	/nfs/dbraw/zinc/53/97/06/352539706.db2.gz	XOWBFQZGQCEQEB-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)NCC[N@@H+]1CC=CCC1	ZINC000279965585	215277051	/nfs/dbraw/zinc/27/70/51/215277051.db2.gz	PLWMJVUDNKTKIL-UHFFFAOYSA-N	1	1	318.377	1.698	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000072714768	191221582	/nfs/dbraw/zinc/22/15/82/191221582.db2.gz	SHHHIDOAQAZKLM-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CC[C@H](C)O)c([N+](=O)[O-])c1	ZINC000072714768	191221583	/nfs/dbraw/zinc/22/15/83/191221583.db2.gz	SHHHIDOAQAZKLM-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)C1	ZINC000491564790	234204236	/nfs/dbraw/zinc/20/42/36/234204236.db2.gz	ZAIKOVMKVHMVPY-GXMNPTEKSA-N	1	1	319.361	1.445	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000061648926	352891835	/nfs/dbraw/zinc/89/18/35/352891835.db2.gz	HVEBEGFFEYNWLO-UONOGXRCSA-N	1	1	319.361	1.496	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000277096741	213291507	/nfs/dbraw/zinc/29/15/07/213291507.db2.gz	CBCKHUJKYUDRQN-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
COC[C@@](C)(CC(=O)OC)[NH2+]Cc1c(F)cccc1[N+](=O)[O-]	ZINC000078662017	353527132	/nfs/dbraw/zinc/52/71/32/353527132.db2.gz	XYSVISAGKFEPFA-CQSZACIVSA-N	1	1	314.313	1.792	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc(F)cc1[N+](=O)[O-]	ZINC000108297133	353948555	/nfs/dbraw/zinc/94/85/55/353948555.db2.gz	AKIFPYRRZNTZAA-NSHDSACASA-N	1	1	322.340	1.530	20	5		DDBDMO
Nc1c(C(=O)N2CC[NH+](CCCF)CC2)cccc1[N+](=O)[O-]	ZINC000402694227	354669312	/nfs/dbraw/zinc/66/93/12/354669312.db2.gz	MMEDALGNBYCPKW-UHFFFAOYSA-N	1	1	310.329	1.294	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589501668	354996976	/nfs/dbraw/zinc/99/69/76/354996976.db2.gz	VPWQHTGZJGGUED-SNVBAGLBSA-N	1	1	323.349	1.195	20	5		DDBDMO
CN(CC(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21)c1ccccc1[N+](=O)[O-]	ZINC000590046408	355043711	/nfs/dbraw/zinc/04/37/11/355043711.db2.gz	CKRSECMEWLYSPC-DOMZBBRYSA-N	1	1	318.377	1.194	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1	ZINC000590442952	355097867	/nfs/dbraw/zinc/09/78/67/355097867.db2.gz	IGLRAPYLOKYOIF-YGRLFVJLSA-N	1	1	305.334	1.380	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CCC[C@@H]3COC[C@@H]32)c([N+](=O)[O-])c1	ZINC000590972438	355227404	/nfs/dbraw/zinc/22/74/04/355227404.db2.gz	UKGHVHIJPVJIKN-OCCSQVGLSA-N	1	1	305.334	1.305	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H]3COC[C@@H]32)c([N+](=O)[O-])c1	ZINC000590972438	355227406	/nfs/dbraw/zinc/22/74/06/355227406.db2.gz	UKGHVHIJPVJIKN-OCCSQVGLSA-N	1	1	305.334	1.305	20	5		DDBDMO
Cc1nc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cs1	ZINC000591729085	355373859	/nfs/dbraw/zinc/37/38/59/355373859.db2.gz	KKRBLBGUZXBWFZ-CYBMUJFWSA-N	1	1	323.374	1.889	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)[C@@H]2C1	ZINC000591830107	355392839	/nfs/dbraw/zinc/39/28/39/355392839.db2.gz	FCVKTAZOSPBJJG-IINYFYTJSA-N	1	1	306.366	1.200	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)[C@H]1CC[N@@H+](C)C1	ZINC000592830345	355706032	/nfs/dbraw/zinc/70/60/32/355706032.db2.gz	DJJVALJBIXTAHP-LBPRGKRZSA-N	1	1	306.366	1.855	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593519676	355912274	/nfs/dbraw/zinc/91/22/74/355912274.db2.gz	AOBQPXFRMSGWTM-YGRLFVJLSA-N	1	1	321.352	1.875	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593454270	355889339	/nfs/dbraw/zinc/88/93/39/355889339.db2.gz	HCVOQSPUFQHIRA-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])c1	ZINC000594066320	356103469	/nfs/dbraw/zinc/10/34/69/356103469.db2.gz	VPGMSRBSAMKBOS-LLVKDONJSA-N	1	1	310.350	1.827	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N(C)CC1C[NH+](C)C1	ZINC000594845559	356335120	/nfs/dbraw/zinc/33/51/20/356335120.db2.gz	BNACMWMHEZBYNF-UHFFFAOYSA-N	1	1	313.379	1.085	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595551448	356546556	/nfs/dbraw/zinc/54/65/56/356546556.db2.gz	LZMGPXFKDXOHES-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1c[nH]cn1	ZINC000595593368	356566092	/nfs/dbraw/zinc/56/60/92/356566092.db2.gz	DRTFIYYFWIRVCL-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1c[nH]cn1	ZINC000595593368	356566095	/nfs/dbraw/zinc/56/60/95/356566095.db2.gz	DRTFIYYFWIRVCL-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cnc[nH]1	ZINC000595593368	356566098	/nfs/dbraw/zinc/56/60/98/356566098.db2.gz	DRTFIYYFWIRVCL-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cnc[nH]1	ZINC000595593368	356566101	/nfs/dbraw/zinc/56/61/01/356566101.db2.gz	DRTFIYYFWIRVCL-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595741686	356631089	/nfs/dbraw/zinc/63/10/89/356631089.db2.gz	DBUWNENQQZKHKS-OZTPJHRESA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595741686	356631091	/nfs/dbraw/zinc/63/10/91/356631091.db2.gz	DBUWNENQQZKHKS-OZTPJHRESA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595761062	356642211	/nfs/dbraw/zinc/64/22/11/356642211.db2.gz	WLSUIAYUPQMIJC-WQGACYEGSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595761062	356642213	/nfs/dbraw/zinc/64/22/13/356642213.db2.gz	WLSUIAYUPQMIJC-WQGACYEGSA-N	1	1	319.361	1.890	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595836996	356672603	/nfs/dbraw/zinc/67/26/03/356672603.db2.gz	ZQIPEGFZQVMEAB-MELADBBJSA-N	1	1	322.361	1.303	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1	ZINC000595826786	356666030	/nfs/dbraw/zinc/66/60/30/356666030.db2.gz	IOEKLKUNKQGBAJ-OCCSQVGLSA-N	1	1	320.345	1.850	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc(Cl)ccc3[N+](=O)[O-])C[C@H]2C1	ZINC000192465855	283210806	/nfs/dbraw/zinc/21/08/06/283210806.db2.gz	WKHRWROMWVHDOL-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
Cc1c(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cccc1[N+](=O)[O-]	ZINC000595864502	356682832	/nfs/dbraw/zinc/68/28/32/356682832.db2.gz	BGIJJSGBNMBVMT-MRXNPFEDSA-N	1	1	319.405	1.934	20	5		DDBDMO
CC1(C)C[N@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)CCO1	ZINC000596101639	356771692	/nfs/dbraw/zinc/77/16/92/356771692.db2.gz	JMKRTHKWVVOTNI-UHFFFAOYSA-N	1	1	322.365	1.216	20	5		DDBDMO
CC1(C)C[N@@H+](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)CCO1	ZINC000596101639	356771696	/nfs/dbraw/zinc/77/16/96/356771696.db2.gz	JMKRTHKWVVOTNI-UHFFFAOYSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@@H](C)[NH+]1CCOCC1	ZINC000596113918	356776508	/nfs/dbraw/zinc/77/65/08/356776508.db2.gz	FBFHWMGQHMKLNZ-GHMZBOCLSA-N	1	1	322.365	1.215	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1NC[C@@H]1CCC[N@@H+]1CCCO	ZINC000596257489	356834746	/nfs/dbraw/zinc/83/47/46/356834746.db2.gz	LFEYKXUUZSAYNM-JTQLQIEISA-N	1	1	314.773	1.324	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000598648775	357669889	/nfs/dbraw/zinc/66/98/89/357669889.db2.gz	HGEAZGKGYOHXAO-QWHCGFSZSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000598648775	357669893	/nfs/dbraw/zinc/66/98/93/357669893.db2.gz	HGEAZGKGYOHXAO-QWHCGFSZSA-N	1	1	321.377	1.508	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000599564178	357974466	/nfs/dbraw/zinc/97/44/66/357974466.db2.gz	QCSUDTGDOJMBRO-XHDPSFHLSA-N	1	1	308.334	1.920	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599669059	358016962	/nfs/dbraw/zinc/01/69/62/358016962.db2.gz	BGXSDKBJHSQFGN-BJHJDKERSA-N	1	1	307.350	1.544	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@H]21	ZINC000599659041	358012583	/nfs/dbraw/zinc/01/25/83/358012583.db2.gz	OAXNDBFFFKBLNB-BFHYXJOUSA-N	1	1	322.365	1.455	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599673874	358019129	/nfs/dbraw/zinc/01/91/29/358019129.db2.gz	VDGIAUMJNDUUMJ-UTUOFQBUSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[NH+](CCCF)CC1	ZINC000600072506	358115432	/nfs/dbraw/zinc/11/54/32/358115432.db2.gz	WIVCIOQXLRLGLQ-UHFFFAOYSA-N	1	1	313.304	1.851	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1	ZINC000600228489	358162399	/nfs/dbraw/zinc/16/23/99/358162399.db2.gz	BTAJWUXRCXLZFL-LBPRGKRZSA-N	1	1	321.381	1.465	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1[nH]ncc1[N+](=O)[O-]	ZINC000600228809	358163509	/nfs/dbraw/zinc/16/35/09/358163509.db2.gz	FWOZIMIDOPTOBI-LLVKDONJSA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000600228809	358163512	/nfs/dbraw/zinc/16/35/12/358163512.db2.gz	FWOZIMIDOPTOBI-LLVKDONJSA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000600228809	358163517	/nfs/dbraw/zinc/16/35/17/358163517.db2.gz	FWOZIMIDOPTOBI-LLVKDONJSA-N	1	1	307.354	1.455	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCc3nnc4n3CCC4)c2c1	ZINC000601100778	358401818	/nfs/dbraw/zinc/40/18/18/358401818.db2.gz	BJWMOTXGTDKDSY-UHFFFAOYSA-N	1	1	310.317	1.715	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](CO)[C@H](O)C3)c2c1	ZINC000601153057	358424100	/nfs/dbraw/zinc/42/41/00/358424100.db2.gz	UXTHWLQQXGPNJB-MEBBXXQBSA-N	1	1	303.318	1.323	20	5		DDBDMO
O=C1CCC[C@@H](CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)N1	ZINC000601156466	358425523	/nfs/dbraw/zinc/42/55/23/358425523.db2.gz	RAAVIPZTHFCKEA-JTQLQIEISA-N	1	1	300.318	1.646	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@@H]4COC[C@H](C3)O4)c2c1	ZINC000601161205	358427584	/nfs/dbraw/zinc/42/75/84/358427584.db2.gz	DZZRWBWWAAXJSG-TXEJJXNPSA-N	1	1	301.302	1.747	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000601189387	358440117	/nfs/dbraw/zinc/44/01/17/358440117.db2.gz	QPAQAWFKLAFQHS-NSHDSACASA-N	1	1	306.366	1.614	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000602099669	358812828	/nfs/dbraw/zinc/81/28/28/358812828.db2.gz	ZALUZIINPTYMBR-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cn1cc(C[C@H]2CC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)cn1	ZINC000602482229	359007036	/nfs/dbraw/zinc/00/70/36/359007036.db2.gz	HPCQIYRYVSWEFT-LLVKDONJSA-N	1	1	304.354	1.126	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](Cc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602603218	359067029	/nfs/dbraw/zinc/06/70/29/359067029.db2.gz	WMLAQWUMRGRESY-ZDUSSCGKSA-N	1	1	301.350	1.788	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@](CO)(c3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000602677055	359120434	/nfs/dbraw/zinc/12/04/34/359120434.db2.gz	QBJOOQCDYNOQLH-MRXNPFEDSA-N	1	1	316.361	1.464	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C)O[C@@]2(CCO[C@@H]2C)C1	ZINC000602819419	359214615	/nfs/dbraw/zinc/21/46/15/359214615.db2.gz	BGPUSIKALOJBCS-ZOWXZIJZSA-N	1	1	324.381	1.368	20	5		DDBDMO
CN(CC1CC1)C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602962125	359325501	/nfs/dbraw/zinc/32/55/01/359325501.db2.gz	HTIWFGDMMXAXOX-MRXNPFEDSA-N	1	1	321.377	1.260	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(C)(C)O)CCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000186901298	200028795	/nfs/dbraw/zinc/02/87/95/200028795.db2.gz	BTBJVIYSMFFKAZ-SNVBAGLBSA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000186901298	200028797	/nfs/dbraw/zinc/02/87/97/200028797.db2.gz	BTBJVIYSMFFKAZ-SNVBAGLBSA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000186935292	200034535	/nfs/dbraw/zinc/03/45/35/200034535.db2.gz	CTDNJNKHJHUNAT-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000186935292	200034537	/nfs/dbraw/zinc/03/45/37/200034537.db2.gz	CTDNJNKHJHUNAT-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1O	ZINC000186884119	200026750	/nfs/dbraw/zinc/02/67/50/200026750.db2.gz	NCLSMCTVUJXNSN-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1O	ZINC000186884119	200026752	/nfs/dbraw/zinc/02/67/52/200026752.db2.gz	NCLSMCTVUJXNSN-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1	ZINC000189212001	200364745	/nfs/dbraw/zinc/36/47/45/200364745.db2.gz	OTPIPEORKNZCNY-GFCCVEGCSA-N	1	1	321.377	1.983	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C[C@H]1C	ZINC000359020303	299308586	/nfs/dbraw/zinc/30/85/86/299308586.db2.gz	PUAGKZAOZTWVGH-VXGBXAGGSA-N	1	1	321.381	1.748	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610615505	360482024	/nfs/dbraw/zinc/48/20/24/360482024.db2.gz	HSXPCRDSACSXGE-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610615505	360482029	/nfs/dbraw/zinc/48/20/29/360482029.db2.gz	HSXPCRDSACSXGE-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611087637	360618840	/nfs/dbraw/zinc/61/88/40/360618840.db2.gz	ZIBMCHZCLUYAHO-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611088457	360620188	/nfs/dbraw/zinc/62/01/88/360620188.db2.gz	XEOSHALHXKIYFU-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC[N@H+]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611092114	360621841	/nfs/dbraw/zinc/62/18/41/360621841.db2.gz	JAESPISAXNWFTR-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
CCc1nn(C)c(N2CC[NH+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000611280635	360688181	/nfs/dbraw/zinc/68/81/81/360688181.db2.gz	CAMLAWVNKBVCHZ-GFCCVEGCSA-N	1	1	323.397	1.192	20	5		DDBDMO
C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@H+](C)CCO1	ZINC000611712049	360802519	/nfs/dbraw/zinc/80/25/19/360802519.db2.gz	UXOZEQZGEUHUMC-HZMBPMFUSA-N	1	1	317.349	1.669	20	5		DDBDMO
C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000611712049	360802524	/nfs/dbraw/zinc/80/25/24/360802524.db2.gz	UXOZEQZGEUHUMC-HZMBPMFUSA-N	1	1	317.349	1.669	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000272003799	209375357	/nfs/dbraw/zinc/37/53/57/209375357.db2.gz	RXJVIMXKXZXSQL-UHFFFAOYSA-N	1	1	305.334	1.352	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000612030669	360895103	/nfs/dbraw/zinc/89/51/03/360895103.db2.gz	WIWJMUGNOLWRJS-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000618898196	363787901	/nfs/dbraw/zinc/78/79/01/363787901.db2.gz	ZYFLWGBOGOPOMC-NHYWBVRUSA-N	1	1	320.393	1.590	20	5		DDBDMO
CC1(C)C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000619187189	363926783	/nfs/dbraw/zinc/92/67/83/363926783.db2.gz	WDBROXIAHXDXFK-ZIAGYGMSSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC1(C)C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000619187189	363926789	/nfs/dbraw/zinc/92/67/89/363926789.db2.gz	WDBROXIAHXDXFK-ZIAGYGMSSA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1sc(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)cc1[N+](=O)[O-]	ZINC000619873568	364170328	/nfs/dbraw/zinc/17/03/28/364170328.db2.gz	NSZWGEBRGQAXOW-NSHDSACASA-N	1	1	324.406	1.084	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000275457178	212345807	/nfs/dbraw/zinc/34/58/07/212345807.db2.gz	HHUPTGOQJMQTIH-GFCCVEGCSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[N@H+]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000349787769	284053335	/nfs/dbraw/zinc/05/33/35/284053335.db2.gz	VKKVBLPJOYQDJZ-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CN1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000349787769	284053336	/nfs/dbraw/zinc/05/33/36/284053336.db2.gz	VKKVBLPJOYQDJZ-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CN1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000349787769	284053337	/nfs/dbraw/zinc/05/33/37/284053337.db2.gz	VKKVBLPJOYQDJZ-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000359276118	299391139	/nfs/dbraw/zinc/39/11/39/299391139.db2.gz	CJSTXIZJDLWXAY-BETUJISGSA-N	1	1	318.377	1.383	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCCS(=O)(=O)C1	ZINC000093632928	193277246	/nfs/dbraw/zinc/27/72/46/193277246.db2.gz	NIANBVFRRUCONW-NSHDSACASA-N	1	1	318.782	1.915	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H]3CO)n2)c1	ZINC000264272110	203804475	/nfs/dbraw/zinc/80/44/75/203804475.db2.gz	MJQQJTUNWYWOEC-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H]3CO)n2)c1	ZINC000264272110	203804480	/nfs/dbraw/zinc/80/44/80/203804480.db2.gz	MJQQJTUNWYWOEC-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1F	ZINC000264609146	204026966	/nfs/dbraw/zinc/02/69/66/204026966.db2.gz	FBBOFINVHHCOMQ-UHFFFAOYSA-N	1	1	310.373	1.808	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000264661745	204060150	/nfs/dbraw/zinc/06/01/50/204060150.db2.gz	TXHGGMAHZGYSTO-LBPRGKRZSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000288573630	220251902	/nfs/dbraw/zinc/25/19/02/220251902.db2.gz	BLLUILYXXDOUDF-KCQAQPDRSA-N	1	1	324.377	1.427	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000267604927	206168604	/nfs/dbraw/zinc/16/86/04/206168604.db2.gz	MMAFDCNTIZQREY-VIFPVBQESA-N	1	1	305.290	1.731	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000267604927	206168609	/nfs/dbraw/zinc/16/86/09/206168609.db2.gz	MMAFDCNTIZQREY-VIFPVBQESA-N	1	1	305.290	1.731	20	5		DDBDMO
C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCO	ZINC000267901149	206325390	/nfs/dbraw/zinc/32/53/90/206325390.db2.gz	JSXLBEPUGNRLOO-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCO	ZINC000267901149	206325393	/nfs/dbraw/zinc/32/53/93/206325393.db2.gz	JSXLBEPUGNRLOO-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
NC(=O)CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000174813149	248380052	/nfs/dbraw/zinc/38/00/52/248380052.db2.gz	FVQXFAUJAAXFSW-UHFFFAOYSA-N	1	1	317.349	1.169	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@](F)(CO)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000338588524	250042009	/nfs/dbraw/zinc/04/20/09/250042009.db2.gz	YHQGUZUGYDEVHV-AWEZNQCLSA-N	1	1	311.313	1.330	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000105820984	194136191	/nfs/dbraw/zinc/13/61/91/194136191.db2.gz	PYQOCSXXNYEPFO-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000105824081	194138236	/nfs/dbraw/zinc/13/82/36/194138236.db2.gz	MIWSTJFFHIUTGG-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@@H](C)O	ZINC000105825356	194138550	/nfs/dbraw/zinc/13/85/50/194138550.db2.gz	ZLMUXWNHUOOKLZ-HIFRSBDPSA-N	1	1	307.394	1.872	20	5		DDBDMO
CCOCC[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000105829146	194139430	/nfs/dbraw/zinc/13/94/30/194139430.db2.gz	NFIFRJLIOFZDCM-UHFFFAOYSA-N	1	1	323.393	1.758	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC[C@@H]1CCCO1	ZINC000285208361	218333917	/nfs/dbraw/zinc/33/39/17/218333917.db2.gz	DLAQSWYBBFQTLO-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC[C@@H]1CCCO1	ZINC000285208361	218333920	/nfs/dbraw/zinc/33/39/20/218333920.db2.gz	DLAQSWYBBFQTLO-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000109966739	194300640	/nfs/dbraw/zinc/30/06/40/194300640.db2.gz	VEHCQVZXAIHOKJ-CYBMUJFWSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023401	207173744	/nfs/dbraw/zinc/17/37/44/207173744.db2.gz	QIGAAVSCRRJLHH-WDEREUQCSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023401	207173748	/nfs/dbraw/zinc/17/37/48/207173748.db2.gz	QIGAAVSCRRJLHH-WDEREUQCSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023401	207173752	/nfs/dbraw/zinc/17/37/52/207173752.db2.gz	QIGAAVSCRRJLHH-WDEREUQCSA-N	1	1	307.354	1.183	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CC(N)=O)CC1	ZINC000061332522	184168907	/nfs/dbraw/zinc/16/89/07/184168907.db2.gz	ZNZQBPIFOALGMX-UHFFFAOYSA-N	1	1	307.350	1.691	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000340967281	251308555	/nfs/dbraw/zinc/30/85/55/251308555.db2.gz	APIIOZLTLMXDTA-LLVKDONJSA-N	1	1	304.350	1.360	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CCNC(C)=O)c([N+](=O)[O-])c1	ZINC000567812064	304244891	/nfs/dbraw/zinc/24/48/91/304244891.db2.gz	DDNOTXIUGJSPGE-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@@H]1C	ZINC000158881095	197307914	/nfs/dbraw/zinc/30/79/14/197307914.db2.gz	FHQKHSPZYMQJET-WCQYABFASA-N	1	1	323.397	1.335	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCC[C@@H]1O	ZINC000352692825	285232462	/nfs/dbraw/zinc/23/24/62/285232462.db2.gz	GZAWORRXVKCKKC-KGLIPLIRSA-N	1	1	308.334	1.807	20	5		DDBDMO
CON1CCC([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000459583697	533309252	/nfs/dbraw/zinc/30/92/52/533309252.db2.gz	UAGYUDYHXKADQD-UHFFFAOYSA-N	1	1	319.365	1.929	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C)c2)[C@H](C)C1	ZINC000301986549	533427703	/nfs/dbraw/zinc/42/77/03/533427703.db2.gz	KDGXWNYZNOIOJP-CYBMUJFWSA-N	1	1	321.377	1.977	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000068336856	406633211	/nfs/dbraw/zinc/63/32/11/406633211.db2.gz	WALZMXZAHUKVBS-VOTSOKGWSA-N	1	1	307.350	1.302	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCCS(=O)(=O)C2)c1	ZINC000069141070	406683861	/nfs/dbraw/zinc/68/38/61/406683861.db2.gz	JZMDMKMGNUAUIR-JTQLQIEISA-N	1	1	318.782	1.915	20	5		DDBDMO
CC[N@@H+](CCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000029840693	406927995	/nfs/dbraw/zinc/92/79/95/406927995.db2.gz	GDDBZWFPYBSYDM-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000090459272	407168581	/nfs/dbraw/zinc/16/85/81/407168581.db2.gz	BJRFOMPVGFFEQN-OLZOCXBDSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000090459272	407168584	/nfs/dbraw/zinc/16/85/84/407168584.db2.gz	BJRFOMPVGFFEQN-OLZOCXBDSA-N	1	1	319.361	1.578	20	5		DDBDMO
C[N@H+](CCn1cccn1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000111280690	407406219	/nfs/dbraw/zinc/40/62/19/407406219.db2.gz	ABSRGNKXCYZXOG-UHFFFAOYSA-N	1	1	303.322	1.022	20	5		DDBDMO
C[N@@H+](CCn1cccn1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000111280690	407406220	/nfs/dbraw/zinc/40/62/20/407406220.db2.gz	ABSRGNKXCYZXOG-UHFFFAOYSA-N	1	1	303.322	1.022	20	5		DDBDMO
COC[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806947	407465102	/nfs/dbraw/zinc/46/51/02/407465102.db2.gz	OZBGLTRGPAWGJB-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806947	407465108	/nfs/dbraw/zinc/46/51/08/407465108.db2.gz	OZBGLTRGPAWGJB-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H]([C@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1)S(C)(=O)=O	ZINC000113257608	407482057	/nfs/dbraw/zinc/48/20/57/407482057.db2.gz	KXEYFDPZQHLKTI-NWDGAFQWSA-N	1	1	314.407	1.891	20	5		DDBDMO
C[C@H]([C@H](C)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1)S(C)(=O)=O	ZINC000113257608	407482061	/nfs/dbraw/zinc/48/20/61/407482061.db2.gz	KXEYFDPZQHLKTI-NWDGAFQWSA-N	1	1	314.407	1.891	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1O	ZINC000271347254	407648624	/nfs/dbraw/zinc/64/86/24/407648624.db2.gz	PGOWBHLFANAJPY-MFKMUULPSA-N	1	1	310.350	1.815	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000115433354	407679345	/nfs/dbraw/zinc/67/93/45/407679345.db2.gz	SPZKTZXODZYNCI-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1ccccc1	ZINC000179338561	407770971	/nfs/dbraw/zinc/77/09/71/407770971.db2.gz	KGDKJGXCIKJHIH-FZMZJTMJSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)C[N@H+]1C1CC1	ZINC000133535609	407855896	/nfs/dbraw/zinc/85/58/96/407855896.db2.gz	DVHHENDGNCALHP-IUCAKERBSA-N	1	1	305.338	1.126	20	5		DDBDMO
[NH3+]C[C@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237958156	407856509	/nfs/dbraw/zinc/85/65/09/407856509.db2.gz	BTVIADQPPLBWSP-SNVBAGLBSA-N	1	1	303.322	1.425	20	5		DDBDMO
O=C(NCC[N@@H+]1CCCOCC1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000189470863	408030089	/nfs/dbraw/zinc/03/00/89/408030089.db2.gz	HGFSTOHHBJNRQG-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000189470863	408030094	/nfs/dbraw/zinc/03/00/94/408030094.db2.gz	HGFSTOHHBJNRQG-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000136089178	408077433	/nfs/dbraw/zinc/07/74/33/408077433.db2.gz	WMRPGBCLQAPHNP-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1CCCCNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000136089178	408077436	/nfs/dbraw/zinc/07/74/36/408077436.db2.gz	WMRPGBCLQAPHNP-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000136089178	408077443	/nfs/dbraw/zinc/07/74/43/408077443.db2.gz	WMRPGBCLQAPHNP-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
Cc1nc2sccn2c1C[N@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000268516161	408079136	/nfs/dbraw/zinc/07/91/36/408079136.db2.gz	YFSBWCCQVNCTAH-UHFFFAOYSA-N	1	1	320.378	1.941	20	5		DDBDMO
Cc1nc2sccn2c1C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000268516161	408079148	/nfs/dbraw/zinc/07/91/48/408079148.db2.gz	YFSBWCCQVNCTAH-UHFFFAOYSA-N	1	1	320.378	1.941	20	5		DDBDMO
COCCO[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000189732403	408093606	/nfs/dbraw/zinc/09/36/06/408093606.db2.gz	NVKKFGSPSKVGRQ-LBPRGKRZSA-N	1	1	321.333	1.973	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000189732403	408093614	/nfs/dbraw/zinc/09/36/14/408093614.db2.gz	NVKKFGSPSKVGRQ-LBPRGKRZSA-N	1	1	321.333	1.973	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000136330825	408097433	/nfs/dbraw/zinc/09/74/33/408097433.db2.gz	GTLRIYNNDSIICG-GUTXKFCHSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000189571658	408054748	/nfs/dbraw/zinc/05/47/48/408054748.db2.gz	IGDURHQZAHBJBW-IOASZLSFSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[N@H+](C[C@H]1CCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000246047169	408129527	/nfs/dbraw/zinc/12/95/27/408129527.db2.gz	UIOMHPVRAMROAO-CABCVRRESA-N	1	1	319.361	1.811	20	5		DDBDMO
C[N@@H+](C[C@H]1CCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000246047169	408129535	/nfs/dbraw/zinc/12/95/35/408129535.db2.gz	UIOMHPVRAMROAO-CABCVRRESA-N	1	1	319.361	1.811	20	5		DDBDMO
O=c1c(Cl)cc([N+](=O)[O-])cn1CCC[NH+]1CCOCC1	ZINC000268637218	408133033	/nfs/dbraw/zinc/13/30/33/408133033.db2.gz	RMCPYZUJVSGOBR-UHFFFAOYSA-N	1	1	301.730	1.132	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000155298936	408148011	/nfs/dbraw/zinc/14/80/11/408148011.db2.gz	JJRXOVWENRUESK-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000246284918	408204026	/nfs/dbraw/zinc/20/40/26/408204026.db2.gz	XESUDVFLGSKCDT-WDEREUQCSA-N	1	1	322.365	1.236	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000246479686	408265916	/nfs/dbraw/zinc/26/59/16/408265916.db2.gz	PJIQFBCQLYHMJI-WCQYABFASA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000246756433	408333042	/nfs/dbraw/zinc/33/30/42/408333042.db2.gz	BPZHPKOFDGUVHB-SWLSCSKDSA-N	1	1	305.378	1.982	20	5		DDBDMO
CC[C@](C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(N)=O	ZINC000133103250	162050554	/nfs/dbraw/zinc/05/05/54/162050554.db2.gz	BMQRJIFJLYYFPX-AWEZNQCLSA-N	1	1	309.322	1.205	20	5		DDBDMO
CSCC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000138267361	162129534	/nfs/dbraw/zinc/12/95/34/162129534.db2.gz	NJACUIKPGLEGIZ-UHFFFAOYSA-N	1	1	309.391	1.779	20	5		DDBDMO
CSCC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000138267361	162129537	/nfs/dbraw/zinc/12/95/37/162129537.db2.gz	NJACUIKPGLEGIZ-UHFFFAOYSA-N	1	1	309.391	1.779	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1CCCC1	ZINC000264134066	408374702	/nfs/dbraw/zinc/37/47/02/408374702.db2.gz	FJORQDCWZPSQOJ-UHFFFAOYSA-N	1	1	324.356	1.920	20	5		DDBDMO
Cc1cc(N[C@H](C)CCN2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000274526533	408439297	/nfs/dbraw/zinc/43/92/97/408439297.db2.gz	XSVCGDVLLBPTMK-CYBMUJFWSA-N	1	1	307.398	1.736	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000247598783	408498150	/nfs/dbraw/zinc/49/81/50/408498150.db2.gz	OVSZKHUTDFOXHO-VHDGCEQUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000247598783	408498154	/nfs/dbraw/zinc/49/81/54/408498154.db2.gz	OVSZKHUTDFOXHO-VHDGCEQUSA-N	1	1	324.377	1.834	20	5		DDBDMO
COCC1(O)CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000270406897	408521248	/nfs/dbraw/zinc/52/12/48/408521248.db2.gz	WSFVHUOIUSNFLI-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176876398	408464761	/nfs/dbraw/zinc/46/47/61/408464761.db2.gz	KFXVWTYDKGJOED-UHFFFAOYSA-N	1	1	317.349	1.892	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000191666763	408468618	/nfs/dbraw/zinc/46/86/18/408468618.db2.gz	ALUDMJDUYGUVBR-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCSC1	ZINC000248465298	408573182	/nfs/dbraw/zinc/57/31/82/408573182.db2.gz	RLDNYIMREMTOMM-NWDGAFQWSA-N	1	1	312.391	1.772	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248466415	408573392	/nfs/dbraw/zinc/57/33/92/408573392.db2.gz	SIPZURBNOKEKJI-ZIAGYGMSSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC1(O)CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1	ZINC000177316555	408580207	/nfs/dbraw/zinc/58/02/07/408580207.db2.gz	IKDQWPZEZDBBIV-UHFFFAOYSA-N	1	1	308.334	1.808	20	5		DDBDMO
COc1cc(C[NH2+]CC2(N(C)C)CCC2)c([N+](=O)[O-])cc1O	ZINC000275630365	408626853	/nfs/dbraw/zinc/62/68/53/408626853.db2.gz	PYRGDWPTGCEGDQ-UHFFFAOYSA-N	1	1	309.366	1.883	20	5		DDBDMO
CC[N@@H+](CCCO)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000270684896	408637119	/nfs/dbraw/zinc/63/71/19/408637119.db2.gz	APVLWAYOKNWEDO-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](CCO)C2CCC2)c([N+](=O)[O-])c1	ZINC000275884239	408708880	/nfs/dbraw/zinc/70/88/80/408708880.db2.gz	QUNPCJZDGLVNBE-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](CCO)C2CCC2)c([N+](=O)[O-])c1	ZINC000275884239	408708889	/nfs/dbraw/zinc/70/88/89/408708889.db2.gz	QUNPCJZDGLVNBE-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CC[C@@H](NC(=O)[C@@H]1C[N@H+](CC)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177789091	408713479	/nfs/dbraw/zinc/71/34/79/408713479.db2.gz	LTXOLJLUKDMAAT-CABCVRRESA-N	1	1	321.377	1.883	20	5		DDBDMO
CC[C@@H](NC(=O)[C@@H]1C[N@@H+](CC)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177789091	408713484	/nfs/dbraw/zinc/71/34/84/408713484.db2.gz	LTXOLJLUKDMAAT-CABCVRRESA-N	1	1	321.377	1.883	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1O	ZINC000270900175	408732909	/nfs/dbraw/zinc/73/29/09/408732909.db2.gz	MKEAOHQIRUNWSD-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(C)C[C@H](CO)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000185371905	408801028	/nfs/dbraw/zinc/80/10/28/408801028.db2.gz	SVDXINWJTKOVKD-CYBMUJFWSA-N	1	1	309.366	1.533	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000177984606	408749684	/nfs/dbraw/zinc/74/96/84/408749684.db2.gz	FFSCZOLLSZKKHY-UKRRQHHQSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[C@@]1(O)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000177984606	408749688	/nfs/dbraw/zinc/74/96/88/408749688.db2.gz	FFSCZOLLSZKKHY-UKRRQHHQSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000185126389	408763540	/nfs/dbraw/zinc/76/35/40/408763540.db2.gz	NDDLCHFPWBEEST-BIBXISHDSA-N	1	1	300.380	1.672	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)[N@H+]1CCC[C@@H](C)C1	ZINC000249860316	408769402	/nfs/dbraw/zinc/76/94/02/408769402.db2.gz	QGRODJJMIDXFSI-GHMZBOCLSA-N	1	1	322.365	1.546	20	5		DDBDMO
C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000285853550	408876641	/nfs/dbraw/zinc/87/66/41/408876641.db2.gz	QHPFRHDJNVXVLC-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@H]32)cc([N+](=O)[O-])c1	ZINC000285872558	408880451	/nfs/dbraw/zinc/88/04/51/408880451.db2.gz	RLCNJFFXPORUHD-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)cc1F	ZINC000276288049	408829542	/nfs/dbraw/zinc/82/95/42/408829542.db2.gz	HDFFUVQXHVMMOJ-AWEZNQCLSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H](C[NH+]3CCOCC3)C2)cc1F	ZINC000276288049	408829546	/nfs/dbraw/zinc/82/95/46/408829546.db2.gz	HDFFUVQXHVMMOJ-AWEZNQCLSA-N	1	1	323.368	1.888	20	5		DDBDMO
C[N@H+](CCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000281777437	408927535	/nfs/dbraw/zinc/92/75/35/408927535.db2.gz	JAEYHFIIOZZIAM-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
C[N@@H+](CCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000281777437	408927537	/nfs/dbraw/zinc/92/75/37/408927537.db2.gz	JAEYHFIIOZZIAM-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+](C)C(C)C)cc([N+](=O)[O-])c1C	ZINC000191735213	163200570	/nfs/dbraw/zinc/20/05/70/163200570.db2.gz	OWKSMNCDOWBLGY-UHFFFAOYSA-N	1	1	309.366	1.982	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)n1	ZINC000286253077	408949534	/nfs/dbraw/zinc/94/95/34/408949534.db2.gz	IVIYAXOHVIJSHQ-PWSUYJOCSA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000277456013	408943495	/nfs/dbraw/zinc/94/34/95/408943495.db2.gz	GORMHWORVGJFFC-LLVKDONJSA-N	1	1	307.354	1.373	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)n1	ZINC000291925582	408945800	/nfs/dbraw/zinc/94/58/00/408945800.db2.gz	SNFSXELCUPSXFU-MRXNPFEDSA-N	1	1	316.361	1.427	20	5		DDBDMO
C[C@@H](C[NH+](C)C)Nc1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000286299170	408959093	/nfs/dbraw/zinc/95/90/93/408959093.db2.gz	GBFCSJKFCQNDKR-ZETCQYMHSA-N	1	1	307.397	1.422	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1CCCNc1c(F)cccc1[N+](=O)[O-]	ZINC000286410660	408980506	/nfs/dbraw/zinc/98/05/06/408980506.db2.gz	ASKCDFXAJYSORA-GFCCVEGCSA-N	1	1	310.329	1.486	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+](C2CCC2)C1	ZINC000292256956	409010910	/nfs/dbraw/zinc/01/09/10/409010910.db2.gz	FDGCEOTWDHSOGU-NSHDSACASA-N	1	1	306.366	1.869	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293762892	409176499	/nfs/dbraw/zinc/17/64/99/409176499.db2.gz	PDSGYYYLJNBECO-OLZOCXBDSA-N	1	1	321.425	1.464	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCc2occc2C1	ZINC000288775745	409177817	/nfs/dbraw/zinc/17/78/17/409177817.db2.gz	JYJULMKTQULASR-UHFFFAOYSA-N	1	1	303.318	1.798	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](C2CC2)O1	ZINC000279453518	409217333	/nfs/dbraw/zinc/21/73/33/409217333.db2.gz	ZQIHUAFFVWWTJW-RISCZKNCSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](C2CC2)O1	ZINC000279453518	409217335	/nfs/dbraw/zinc/21/73/35/409217335.db2.gz	ZQIHUAFFVWWTJW-RISCZKNCSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[C@@H]1Cc2[nH+]cn(C[C@H](O)Cn3cc([N+](=O)[O-])cn3)c2C[C@@H]1C	ZINC000295067195	409312668	/nfs/dbraw/zinc/31/26/68/409312668.db2.gz	CGWUPRPRYITLLO-MDZLAQPJSA-N	1	1	319.365	1.420	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@H]21	ZINC000284887887	409369133	/nfs/dbraw/zinc/36/91/33/409369133.db2.gz	GWNNXUMCCNJIDR-ZIAGYGMSSA-N	1	1	317.349	1.380	20	5		DDBDMO
CC[NH+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000280507543	409332672	/nfs/dbraw/zinc/33/26/72/409332672.db2.gz	JOMWVKAWFBWEJC-UHFFFAOYSA-N	1	1	307.350	1.446	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+](CCCO)C1	ZINC000296075454	409421261	/nfs/dbraw/zinc/42/12/61/409421261.db2.gz	CYMPETPSDHLOHQ-ZDUSSCGKSA-N	1	1	322.365	1.563	20	5		DDBDMO
CS[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000296088580	409425818	/nfs/dbraw/zinc/42/58/18/409425818.db2.gz	CWKSVTLHCDNBCK-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000280721289	409425720	/nfs/dbraw/zinc/42/57/20/409425720.db2.gz	IAYJDADTFAWPQV-UKRRQHHQSA-N	1	1	307.350	1.086	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000296088580	409425820	/nfs/dbraw/zinc/42/58/20/409425820.db2.gz	CWKSVTLHCDNBCK-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1	ZINC000324174993	164049901	/nfs/dbraw/zinc/04/99/01/164049901.db2.gz	WFYGKBDOCUKSOM-CQSZACIVSA-N	1	1	317.349	1.308	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@H](C)C[N@@H+]1C	ZINC000408069488	164217235	/nfs/dbraw/zinc/21/72/35/164217235.db2.gz	BVJUOJIYYHSDGS-MNOVXSKESA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@H](C)C[N@H+]1C	ZINC000408069488	164217236	/nfs/dbraw/zinc/21/72/36/164217236.db2.gz	BVJUOJIYYHSDGS-MNOVXSKESA-N	1	1	309.370	1.077	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000296311655	409500354	/nfs/dbraw/zinc/50/03/54/409500354.db2.gz	OEVHPXSPBSAWDC-MRXNPFEDSA-N	1	1	322.361	1.915	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C)[C@H]1CO	ZINC000305706020	409761884	/nfs/dbraw/zinc/76/18/84/409761884.db2.gz	CVNOBPXPYNZQAL-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@H]1CO	ZINC000305706020	409761889	/nfs/dbraw/zinc/76/18/89/409761889.db2.gz	CVNOBPXPYNZQAL-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[NH+](C)CC(C)(C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000308674530	409784957	/nfs/dbraw/zinc/78/49/57/409784957.db2.gz	HEOSEOAYZDTOQG-UHFFFAOYSA-N	1	1	319.358	1.352	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCNc2cc[nH+]cc2Br)c1	ZINC000342693338	409816924	/nfs/dbraw/zinc/81/69/24/409816924.db2.gz	UCNPDTALOQHFKJ-UHFFFAOYSA-N	1	1	312.127	1.483	20	5		DDBDMO
O=C([C@H]1CC[NH2+]CC1(F)F)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000342758495	409883726	/nfs/dbraw/zinc/88/37/26/409883726.db2.gz	XMEWIDYOTRAFNV-SNVBAGLBSA-N	1	1	311.288	1.729	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NCC1=CC[N@@H+](C)CC1	ZINC000354566601	409943227	/nfs/dbraw/zinc/94/32/27/409943227.db2.gz	CYZIELYSEBSPCK-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2ccccn2)CC1	ZINC000298213725	410135521	/nfs/dbraw/zinc/13/55/21/410135521.db2.gz	XVUIDSPRGBERSJ-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000343199625	410227345	/nfs/dbraw/zinc/22/73/45/410227345.db2.gz	FGOXMKVNQWHRGP-GRYCIOLGSA-N	1	1	321.381	1.795	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000351779758	410228764	/nfs/dbraw/zinc/22/87/64/410228764.db2.gz	KJRSNMHUEZBJHK-CABZTGNLSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000351779758	410228769	/nfs/dbraw/zinc/22/87/69/410228769.db2.gz	KJRSNMHUEZBJHK-CABZTGNLSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCCC[C@@H]1C	ZINC000347012138	410311840	/nfs/dbraw/zinc/31/18/40/410311840.db2.gz	LSJBRUAPOIIYCR-WDEREUQCSA-N	1	1	309.370	1.321	20	5		DDBDMO
NC(=O)CC[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000339708513	410405958	/nfs/dbraw/zinc/40/59/58/410405958.db2.gz	MLPXYUYANZHDBX-ZDUSSCGKSA-N	1	1	321.377	1.951	20	5		DDBDMO
COC(=O)COc1ccc(C[NH+]2CCC(O)CC2)cc1[N+](=O)[O-]	ZINC000355610125	410606089	/nfs/dbraw/zinc/60/60/89/410606089.db2.gz	RBBNJCFMCAVHEF-UHFFFAOYSA-N	1	1	324.333	1.103	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C[C@H](C)O	ZINC000352202348	410543712	/nfs/dbraw/zinc/54/37/12/410543712.db2.gz	JHEFRJFPZHOZEO-NSHDSACASA-N	1	1	309.366	1.935	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)NCCc2ccccc2[N+](=O)[O-])no1	ZINC000359432760	410658450	/nfs/dbraw/zinc/65/84/50/410658450.db2.gz	BRLRURPJGMSUDR-UHFFFAOYSA-N	1	1	318.333	1.617	20	5		DDBDMO
CN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000348211748	410857499	/nfs/dbraw/zinc/85/74/99/410857499.db2.gz	FXNIZQZDTQYCEX-ZDUSSCGKSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000337578182	410871627	/nfs/dbraw/zinc/87/16/27/410871627.db2.gz	HKRGSBGUJKVTCF-UHFFFAOYSA-N	1	1	315.333	1.216	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330679535	410871827	/nfs/dbraw/zinc/87/18/27/410871827.db2.gz	XUKXPQRVZUZRBZ-GFCCVEGCSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCN(C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330679535	410871830	/nfs/dbraw/zinc/87/18/30/410871830.db2.gz	XUKXPQRVZUZRBZ-GFCCVEGCSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCN(C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330679535	410871836	/nfs/dbraw/zinc/87/18/36/410871836.db2.gz	XUKXPQRVZUZRBZ-GFCCVEGCSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399681	411011315	/nfs/dbraw/zinc/01/13/15/411011315.db2.gz	YMXCIWFECXCOBX-RYUDHWBXSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399681	411011318	/nfs/dbraw/zinc/01/13/18/411011318.db2.gz	YMXCIWFECXCOBX-RYUDHWBXSA-N	1	1	305.334	1.657	20	5		DDBDMO
NC(=O)C[NH+]1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000129767312	196074150	/nfs/dbraw/zinc/07/41/50/196074150.db2.gz	YODHMBGTTUIASO-UHFFFAOYSA-N	1	1	313.745	1.005	20	5		DDBDMO
CCOC(=O)C[N@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000580286723	422912841	/nfs/dbraw/zinc/91/28/41/422912841.db2.gz	RSWYAZLCXLMJFA-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
CCOC(=O)C[N@@H+](CC)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000580286723	422912845	/nfs/dbraw/zinc/91/28/45/422912845.db2.gz	RSWYAZLCXLMJFA-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](CO)C(C)(C)C	ZINC000134430201	196390643	/nfs/dbraw/zinc/39/06/43/196390643.db2.gz	KCHITKAVBHBWOQ-ZDUSSCGKSA-N	1	1	309.366	1.533	20	5		DDBDMO
CCOC(=O)c1ccnc(NCCc2c[nH+]cn2C)c1[N+](=O)[O-]	ZINC000544354066	416656152	/nfs/dbraw/zinc/65/61/52/416656152.db2.gz	YSSZQFPKBRHQRA-UHFFFAOYSA-N	1	1	319.321	1.555	20	5		DDBDMO
C[NH+](C)C1(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1	ZINC000419010005	226003622	/nfs/dbraw/zinc/00/36/22/226003622.db2.gz	OSMRUPVCSMQINK-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000367888857	418653248	/nfs/dbraw/zinc/65/32/48/418653248.db2.gz	ZDBQZLCPIQNPTP-NSHDSACASA-N	1	1	318.377	1.924	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000368065795	418683184	/nfs/dbraw/zinc/68/31/84/418683184.db2.gz	VDRULCUJLHOEKI-INIZCTEOSA-N	1	1	321.377	1.874	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000368065795	418683186	/nfs/dbraw/zinc/68/31/86/418683186.db2.gz	VDRULCUJLHOEKI-INIZCTEOSA-N	1	1	321.377	1.874	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000368133899	418694543	/nfs/dbraw/zinc/69/45/43/418694543.db2.gz	IDLDZDDNNXPULU-RZFFKMDDSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000368133899	418694545	/nfs/dbraw/zinc/69/45/45/418694545.db2.gz	IDLDZDDNNXPULU-RZFFKMDDSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000368133899	418694547	/nfs/dbraw/zinc/69/45/47/418694547.db2.gz	IDLDZDDNNXPULU-RZFFKMDDSA-N	1	1	303.362	1.288	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CCN2CC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000364666245	418798005	/nfs/dbraw/zinc/79/80/05/418798005.db2.gz	ZMMLUCXUNGHDMJ-BETUJISGSA-N	1	1	303.362	1.821	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H]1CCCN1c1ncc([N+](=O)[O-])c(C)n1	ZINC000297536582	227272530	/nfs/dbraw/zinc/27/25/30/227272530.db2.gz	PONAQHYUCGVLNS-LBPRGKRZSA-N	1	1	302.338	1.867	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000364933212	418825530	/nfs/dbraw/zinc/82/55/30/418825530.db2.gz	LOBNYOKQEAERMX-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC1(CNC(=O)[C@H]2CC2[N+](=O)[O-])C[NH+](Cc2ccccc2)C1	ZINC000365564745	418876696	/nfs/dbraw/zinc/87/66/96/418876696.db2.gz	NQUKJWWCAIJFKQ-KBPBESRZSA-N	1	1	303.362	1.290	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000365668957	418892075	/nfs/dbraw/zinc/89/20/75/418892075.db2.gz	FRJSIHHGNJGEEN-OLZOCXBDSA-N	1	1	319.361	1.496	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411916389	419482234	/nfs/dbraw/zinc/48/22/34/419482234.db2.gz	YORGXYDTGKKMLP-SWHYSGLUSA-N	1	1	323.349	1.003	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411916389	419482248	/nfs/dbraw/zinc/48/22/48/419482248.db2.gz	YORGXYDTGKKMLP-SWHYSGLUSA-N	1	1	323.349	1.003	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000421395093	419597523	/nfs/dbraw/zinc/59/75/23/419597523.db2.gz	YBZKIQBEKFOPRZ-JTQLQIEISA-N	1	1	323.349	1.180	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000421710518	419696651	/nfs/dbraw/zinc/69/66/51/419696651.db2.gz	KZMHHZAJUCLMOH-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+]1C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000421710518	419696656	/nfs/dbraw/zinc/69/66/56/419696656.db2.gz	KZMHHZAJUCLMOH-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000421710518	419696663	/nfs/dbraw/zinc/69/66/63/419696663.db2.gz	KZMHHZAJUCLMOH-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(Cc2c([N+](=O)[O-])ncn2C)C[C@@H](C)C1	ZINC000429005574	419961870	/nfs/dbraw/zinc/96/18/70/419961870.db2.gz	MNMRJNRJCPYETF-AGIUHOORSA-N	1	1	307.398	1.490	20	5		DDBDMO
C[C@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+](C2CCC2)C1	ZINC000429354203	420007651	/nfs/dbraw/zinc/00/76/51/420007651.db2.gz	MICGVRSKNSCSTK-ZDUSSCGKSA-N	1	1	307.398	1.598	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]([NH3+])C1CC1	ZINC000423317286	420012174	/nfs/dbraw/zinc/01/21/74/420012174.db2.gz	KGMTZPDVIJGKJM-QMTHXVAHSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](N)C1CC1	ZINC000423317286	420012179	/nfs/dbraw/zinc/01/21/79/420012179.db2.gz	KGMTZPDVIJGKJM-QMTHXVAHSA-N	1	1	306.366	1.639	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)c1[N+](=O)[O-]	ZINC000423676262	420124131	/nfs/dbraw/zinc/12/41/31/420124131.db2.gz	FVNBJDKDMOUCIF-AWEZNQCLSA-N	1	1	311.313	1.377	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)CC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000431989412	420242348	/nfs/dbraw/zinc/24/23/48/420242348.db2.gz	ANOVAQUYDJSSCO-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CN1	ZINC000434754423	420262582	/nfs/dbraw/zinc/26/25/82/420262582.db2.gz	GCJZOSAXWFUMPN-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CN1	ZINC000434754423	420262584	/nfs/dbraw/zinc/26/25/84/420262584.db2.gz	GCJZOSAXWFUMPN-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000416296640	420312676	/nfs/dbraw/zinc/31/26/76/420312676.db2.gz	OHTONMABVRRVDZ-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@H+](CCO)C[C@H]1C	ZINC000416296640	420312679	/nfs/dbraw/zinc/31/26/79/420312679.db2.gz	OHTONMABVRRVDZ-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[N@@H+](CCCCNc1c(C(N)=O)cccc1[N+](=O)[O-])C1CC1	ZINC000420638878	420339314	/nfs/dbraw/zinc/33/93/14/420339314.db2.gz	PNDNNSBDSIYRGV-UHFFFAOYSA-N	1	1	306.366	1.980	20	5		DDBDMO
CN1C(=O)NCC12CC[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC2	ZINC000425540274	420413108	/nfs/dbraw/zinc/41/31/08/420413108.db2.gz	LGOMSKZNGTYTTD-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000450782924	420529876	/nfs/dbraw/zinc/52/98/76/420529876.db2.gz	ZHINPYKGAHUIAT-CMPLNLGQSA-N	1	1	320.349	1.225	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000457117281	420621802	/nfs/dbraw/zinc/62/18/02/420621802.db2.gz	JLRHTFRETXVJKZ-LBPRGKRZSA-N	1	1	321.377	1.296	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000457117281	420621804	/nfs/dbraw/zinc/62/18/04/420621804.db2.gz	JLRHTFRETXVJKZ-LBPRGKRZSA-N	1	1	321.377	1.296	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000443434347	420752128	/nfs/dbraw/zinc/75/21/28/420752128.db2.gz	HSXQHRLMSDOOFJ-JTQLQIEISA-N	1	1	303.322	1.785	20	5		DDBDMO
O=C1CO[C@H]2CC[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@@H]2N1	ZINC000453578191	420732501	/nfs/dbraw/zinc/73/25/01/420732501.db2.gz	UKSZQTFYRKLPCA-SLUZZZFTSA-N	1	1	317.345	1.197	20	5		DDBDMO
O=C1CO[C@H]2CC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@@H]2N1	ZINC000453578191	420732505	/nfs/dbraw/zinc/73/25/05/420732505.db2.gz	UKSZQTFYRKLPCA-SLUZZZFTSA-N	1	1	317.345	1.197	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000449747226	421074598	/nfs/dbraw/zinc/07/45/98/421074598.db2.gz	WDVRPGBWWRPORV-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CN(C)C(=O)N[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000449747226	421074601	/nfs/dbraw/zinc/07/46/01/421074601.db2.gz	WDVRPGBWWRPORV-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000455906630	421075350	/nfs/dbraw/zinc/07/53/50/421075350.db2.gz	GLAYHKVWDQNKHC-JQWIXIFHSA-N	1	1	321.381	1.490	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000525291527	421284353	/nfs/dbraw/zinc/28/43/53/421284353.db2.gz	IIPWSALUPBIWIJ-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000525620060	421294016	/nfs/dbraw/zinc/29/40/16/421294016.db2.gz	ZESTYBXVEDMQJH-NXEZZACHSA-N	1	1	321.333	1.536	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)CC1	ZINC000548163375	421406935	/nfs/dbraw/zinc/40/69/35/421406935.db2.gz	PSXUTSHTCUFLOD-UHFFFAOYSA-N	1	1	323.397	1.521	20	5		DDBDMO
C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000549189195	421496815	/nfs/dbraw/zinc/49/68/15/421496815.db2.gz	BEUGNSLVFWJYBU-QWRGUYRKSA-N	1	1	321.381	1.701	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000531630420	421639696	/nfs/dbraw/zinc/63/96/96/421639696.db2.gz	XPJKPIPHENEIJL-GFCCVEGCSA-N	1	1	306.366	1.840	20	5		DDBDMO
CN1CCN(CCC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CC1	ZINC000571225100	421698274	/nfs/dbraw/zinc/69/82/74/421698274.db2.gz	SQHQITDMTLNZJF-MRXNPFEDSA-N	1	1	318.421	1.809	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000571577376	421727394	/nfs/dbraw/zinc/72/73/94/421727394.db2.gz	OWLBBQTYIFDNEC-WDEREUQCSA-N	1	1	318.377	1.992	20	5		DDBDMO
O=C(Cn1c[nH+]c2c1CCCC2)NCc1ccc([N+](=O)[O-])cc1	ZINC000537583536	421733111	/nfs/dbraw/zinc/73/31/11/421733111.db2.gz	YJCKMWWYTOXFST-UHFFFAOYSA-N	1	1	314.345	1.987	20	5		DDBDMO
CC[NH2+]CCCN[C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000574799845	422183460	/nfs/dbraw/zinc/18/34/60/422183460.db2.gz	LLIIWLOEVRVWOA-GFCCVEGCSA-N	1	1	308.382	1.901	20	5		DDBDMO
CC1(C)C[N@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)CCO1	ZINC000179294862	263357935	/nfs/dbraw/zinc/35/79/35/263357935.db2.gz	LDOZYYOMTQHZEW-UHFFFAOYSA-N	1	1	320.353	1.160	20	5		DDBDMO
CC1(C)C[N@@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)CCO1	ZINC000179294862	263357939	/nfs/dbraw/zinc/35/79/39/263357939.db2.gz	LDOZYYOMTQHZEW-UHFFFAOYSA-N	1	1	320.353	1.160	20	5		DDBDMO
CNC(=O)N[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000342362543	271390123	/nfs/dbraw/zinc/39/01/23/271390123.db2.gz	MDBOABJUIFRCJJ-LLVKDONJSA-N	1	1	308.338	1.107	20	5		DDBDMO
CNC(=O)N[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000342362543	271390124	/nfs/dbraw/zinc/39/01/24/271390124.db2.gz	MDBOABJUIFRCJJ-LLVKDONJSA-N	1	1	308.338	1.107	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000266221132	273747474	/nfs/dbraw/zinc/74/74/74/273747474.db2.gz	QNWSYLWHHSNBDB-LLVKDONJSA-N	1	1	324.337	1.396	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@H]21	ZINC000247104506	277070194	/nfs/dbraw/zinc/07/01/94/277070194.db2.gz	SOPMXKQHYALAQB-CHWSQXEVSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3ncc(Cl)cc3[N+](=O)[O-])C[C@@H]21	ZINC000285012782	277130030	/nfs/dbraw/zinc/13/00/30/277130030.db2.gz	MKUFLZVNNGCLAT-RYUDHWBXSA-N	1	1	312.757	1.553	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000279763102	278262900	/nfs/dbraw/zinc/26/29/00/278262900.db2.gz	RSTWUHWVSBAOHP-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
CC[C@@H](CO)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000275867071	280150573	/nfs/dbraw/zinc/15/05/73/280150573.db2.gz	JMKGGUFHADQMEI-GXTWGEPZSA-N	1	1	304.350	1.778	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2CN2CCOCC2)cc1	ZINC000075889608	280363031	/nfs/dbraw/zinc/36/30/31/280363031.db2.gz	FDPURMBQYBJYJV-QGZVFWFLSA-N	1	1	319.405	1.934	20	5		DDBDMO
C[C@@H]1C[NH2+]CCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000054371031	288319755	/nfs/dbraw/zinc/31/97/55/288319755.db2.gz	KINBDDOBPHTGDM-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H](C)[NH2+]1	ZINC000130948447	281400069	/nfs/dbraw/zinc/40/00/69/281400069.db2.gz	QYDVNICIAQGITE-GHMZBOCLSA-N	1	1	313.379	1.107	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1CCOC1	ZINC000247232108	282040048	/nfs/dbraw/zinc/04/00/48/282040048.db2.gz	ZJFCKPPYVIDVQI-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270929682	290386287	/nfs/dbraw/zinc/38/62/87/290386287.db2.gz	DYGWHWRHOCJMIW-LBPRGKRZSA-N	1	1	323.397	1.713	20	5		DDBDMO
NC(=O)c1ccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c([N+](=O)[O-])c1	ZINC000271645938	295181240	/nfs/dbraw/zinc/18/12/40/295181240.db2.gz	QUSPMUOHVSQCMD-LLVKDONJSA-N	1	1	315.333	1.801	20	5		DDBDMO
Cc1c(CNC(=O)NCC[N@@H+]2CC=CCC2)cccc1[N+](=O)[O-]	ZINC000354288237	298392879	/nfs/dbraw/zinc/39/28/79/298392879.db2.gz	XCXYQTKNIDGOFN-UHFFFAOYSA-N	1	1	318.377	1.964	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362077780	300001408	/nfs/dbraw/zinc/00/14/08/300001408.db2.gz	ONVIWAJOJUSOJD-QWHCGFSZSA-N	1	1	321.377	1.792	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CC[C@H](C)C1	ZINC000362153845	300017850	/nfs/dbraw/zinc/01/78/50/300017850.db2.gz	GIWMKFKJKPWSKO-KBPBESRZSA-N	1	1	323.393	1.894	20	5		DDBDMO
Cn1nccc1[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000363327062	300251713	/nfs/dbraw/zinc/25/17/13/300251713.db2.gz	IZAHKWPCXLDNTJ-GFCCVEGCSA-N	1	1	304.354	1.404	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497260	301041216	/nfs/dbraw/zinc/04/12/16/301041216.db2.gz	XBSQUIIMJXFIBB-KLHDSHLOSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497260	301041218	/nfs/dbraw/zinc/04/12/18/301041218.db2.gz	XBSQUIIMJXFIBB-KLHDSHLOSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497260	301041222	/nfs/dbraw/zinc/04/12/22/301041222.db2.gz	XBSQUIIMJXFIBB-KLHDSHLOSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC2(CCOCC2)O1	ZINC000369292589	301158632	/nfs/dbraw/zinc/15/86/32/301158632.db2.gz	GDLIVUHXJUAXHD-GFCCVEGCSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2Cn2cccn2)c1	ZINC000369996421	301254989	/nfs/dbraw/zinc/25/49/89/301254989.db2.gz	LWPDTHMDDJCBQP-CYBMUJFWSA-N	1	1	304.354	1.543	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@@H+](CC(C)C)CC2)c1[N+](=O)[O-]	ZINC000370067031	301269858	/nfs/dbraw/zinc/26/98/58/301269858.db2.gz	WIPZSVJFYJJEOY-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](CC(C)C)CC2)c1[N+](=O)[O-]	ZINC000370067031	301269861	/nfs/dbraw/zinc/26/98/61/301269861.db2.gz	WIPZSVJFYJJEOY-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](CC(C)C)CC2)c1[N+](=O)[O-]	ZINC000370067031	301269862	/nfs/dbraw/zinc/26/98/62/301269862.db2.gz	WIPZSVJFYJJEOY-UHFFFAOYSA-N	1	1	323.397	1.684	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](CC(N)=O)C1	ZINC000377604871	302197127	/nfs/dbraw/zinc/19/71/27/302197127.db2.gz	JTLIBOBPEWBVQI-QWRGUYRKSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000377604871	302197131	/nfs/dbraw/zinc/19/71/31/302197131.db2.gz	JTLIBOBPEWBVQI-QWRGUYRKSA-N	1	1	320.349	1.119	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000377661492	302206130	/nfs/dbraw/zinc/20/61/30/302206130.db2.gz	GNNGYDXFCZPOAH-AWEZNQCLSA-N	1	1	307.350	1.320	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(OC[C@H]2CCOC2)CC1	ZINC000534124073	303326668	/nfs/dbraw/zinc/32/66/68/303326668.db2.gz	IPTHARMFQMWRTJ-LBPRGKRZSA-N	1	1	324.381	1.346	20	5		DDBDMO
Cc1n[nH]c(C)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000535072339	303344158	/nfs/dbraw/zinc/34/41/58/303344158.db2.gz	KELVJMGLMCWTDM-UHFFFAOYSA-N	1	1	316.365	1.652	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000362254137	307015602	/nfs/dbraw/zinc/01/56/02/307015602.db2.gz	BOCBYPWNTBCYJH-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC000364485933	307046455	/nfs/dbraw/zinc/04/64/55/307046455.db2.gz	SKMBJLXENRHXNE-RRFJBIMHSA-N	1	1	309.410	1.622	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]([C@@H]2CCOC2)C1	ZINC000367142501	307087104	/nfs/dbraw/zinc/08/71/04/307087104.db2.gz	XKUSYUFGUVJORP-CHWSQXEVSA-N	1	1	307.350	1.115	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369017390	307114490	/nfs/dbraw/zinc/11/44/90/307114490.db2.gz	OIDFLILIDQXYMR-KBPBESRZSA-N	1	1	307.398	1.913	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@H]2CCc3[nH+]c[nH]c3C2)nc2sccn21	ZINC000370861360	307138625	/nfs/dbraw/zinc/13/86/25/307138625.db2.gz	MUEURBKEJDHIKI-ZETCQYMHSA-N	1	1	304.335	1.997	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000373973119	307198766	/nfs/dbraw/zinc/19/87/66/307198766.db2.gz	BBAQTIDEPAXKDX-ZDUSSCGKSA-N	1	1	323.393	1.492	20	5		DDBDMO
Cc1cc(N2CCC[N@@H+](CCN(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000374221225	307204180	/nfs/dbraw/zinc/20/41/80/307204180.db2.gz	VUFLQPNPVRIEEB-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
Cc1cc(N2CCC[N@H+](CCN(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000374221225	307204181	/nfs/dbraw/zinc/20/41/81/307204181.db2.gz	VUFLQPNPVRIEEB-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000376875151	307257495	/nfs/dbraw/zinc/25/74/95/307257495.db2.gz	ILLOSPNNURBPIE-QWRGUYRKSA-N	1	1	305.338	1.160	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000378496201	307289945	/nfs/dbraw/zinc/28/99/45/307289945.db2.gz	MSWJLAFXDJTAKL-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1cc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000548717168	307788606	/nfs/dbraw/zinc/78/86/06/307788606.db2.gz	GJVDQNRGMRQEDK-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
CN(CCC[NH3+])Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000567864663	308098878	/nfs/dbraw/zinc/09/88/78/308098878.db2.gz	HLOHDEMSLGZGKT-UHFFFAOYSA-N	1	1	303.366	1.776	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(CN3CC[N@H+]4CCC[C@@H]4C3)nc2c1	ZINC000576883445	308346831	/nfs/dbraw/zinc/34/68/31/308346831.db2.gz	WUYLIBULGGRKFA-GFCCVEGCSA-N	1	1	301.350	1.751	20	5		DDBDMO
C[C@@H](C(=O)NCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000579190161	308512842	/nfs/dbraw/zinc/51/28/42/308512842.db2.gz	XUMVAABHFCKZEQ-CYBMUJFWSA-N	1	1	321.377	1.537	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cnn(C)c1	ZINC000348325731	490749009	/nfs/dbraw/zinc/74/90/09/490749009.db2.gz	RRHXOUIKNBLNMG-VIFPVBQESA-N	1	1	303.322	1.278	20	5		DDBDMO
CCOc1cccc(NCC(=O)N2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC001120809511	782157664	/nfs/dbraw/zinc/15/76/64/782157664.db2.gz	LQZKHXRRBNDCBJ-UHFFFAOYSA-N	1	1	322.365	1.179	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)CO	ZINC000444686809	534073306	/nfs/dbraw/zinc/07/33/06/534073306.db2.gz	UEMOKZFSLIMOIA-UWVGGRQHSA-N	1	1	308.338	1.035	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)CO	ZINC000444686809	534073311	/nfs/dbraw/zinc/07/33/11/534073311.db2.gz	UEMOKZFSLIMOIA-UWVGGRQHSA-N	1	1	308.338	1.035	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000416731809	534361426	/nfs/dbraw/zinc/36/14/26/534361426.db2.gz	ORGDMNPVXXSNTO-VXGBXAGGSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000416731809	534361435	/nfs/dbraw/zinc/36/14/35/534361435.db2.gz	ORGDMNPVXXSNTO-VXGBXAGGSA-N	1	1	322.365	1.514	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](CCCNc2sccc2[N+](=O)[O-])C1	ZINC000302005400	534426410	/nfs/dbraw/zinc/42/64/10/534426410.db2.gz	UONNHDRLQGKZFB-SNVBAGLBSA-N	1	1	312.395	1.656	20	5		DDBDMO
CCOCC[C@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000444657232	528870360	/nfs/dbraw/zinc/87/03/60/528870360.db2.gz	KBVXXSFWOBKWDQ-JSGCOSHPSA-N	1	1	324.381	1.264	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000452113998	529076170	/nfs/dbraw/zinc/07/61/70/529076170.db2.gz	JGHZCYWSYVLCPB-ZDUSSCGKSA-N	1	1	308.382	1.171	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CCN(c2[nH+]ccn2C)CC1	ZINC000747221953	700060532	/nfs/dbraw/zinc/06/05/32/700060532.db2.gz	HOHVSRCZQSWJDA-UHFFFAOYSA-N	1	1	301.350	1.963	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CC[NH+](Cc2cccs2)CC1	ZINC000047252714	696195813	/nfs/dbraw/zinc/19/58/13/696195813.db2.gz	BNLOXEKIFWOGDV-UHFFFAOYSA-N	1	1	307.379	1.628	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1S(=O)(=O)NCC[NH+]1CCCC1	ZINC000157113014	696973513	/nfs/dbraw/zinc/97/35/13/696973513.db2.gz	DUFYZDXDEGYNQL-UHFFFAOYSA-N	1	1	317.342	1.108	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000157906857	696982647	/nfs/dbraw/zinc/98/26/47/696982647.db2.gz	QSWSDVLYGBYIRR-TZMCWYRMSA-N	1	1	305.382	1.698	20	5		DDBDMO
CCn1cc(C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000749691065	700177682	/nfs/dbraw/zinc/17/76/82/700177682.db2.gz	PCELMWDULYIJQR-HNNXBMFYSA-N	1	1	304.350	1.977	20	5		DDBDMO
CON(C)C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000774640440	697905351	/nfs/dbraw/zinc/90/53/51/697905351.db2.gz	TVZQRMNFXZLGII-UHFFFAOYSA-N	1	1	323.349	1.458	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCOC3(CCOCC3)C2)cc1	ZINC000776587551	698122513	/nfs/dbraw/zinc/12/25/13/698122513.db2.gz	WKDIXBLAYNSSMY-OAHLLOKOSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCOC3(CCOCC3)C2)cc1	ZINC000776587551	698122514	/nfs/dbraw/zinc/12/25/14/698122514.db2.gz	WKDIXBLAYNSSMY-OAHLLOKOSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000776593582	698124031	/nfs/dbraw/zinc/12/40/31/698124031.db2.gz	YDZBOTWCCZXDSQ-NWDGAFQWSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000776593582	698124034	/nfs/dbraw/zinc/12/40/34/698124034.db2.gz	YDZBOTWCCZXDSQ-NWDGAFQWSA-N	1	1	320.267	1.627	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676957	699237767	/nfs/dbraw/zinc/23/77/67/699237767.db2.gz	BLUNENGNZDEQNR-MFKMUULPSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676957	699237768	/nfs/dbraw/zinc/23/77/68/699237768.db2.gz	BLUNENGNZDEQNR-MFKMUULPSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C2)CN1	ZINC000788381823	699310035	/nfs/dbraw/zinc/31/00/35/699310035.db2.gz	IFTHJMYXEBRBSU-HNNXBMFYSA-N	1	1	315.333	1.114	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC000789955456	699425232	/nfs/dbraw/zinc/42/52/32/699425232.db2.gz	OUDYDADAMZPDGF-SNVBAGLBSA-N	1	1	310.310	1.539	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C(C)C	ZINC000801898019	700350980	/nfs/dbraw/zinc/35/09/80/700350980.db2.gz	LYHAAVQOCOUZTB-UHFFFAOYSA-N	1	1	312.345	1.776	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000801911957	700352104	/nfs/dbraw/zinc/35/21/04/700352104.db2.gz	WNCUUOLZMFWUOS-DTWKUNHWSA-N	1	1	310.329	1.529	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@@H]1C	ZINC000801934919	700357266	/nfs/dbraw/zinc/35/72/66/700357266.db2.gz	SSQPQBGYBXLIFK-VHSXEESVSA-N	1	1	324.356	1.871	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@@H+](C)[C@H](C)C1	ZINC000761072087	700839258	/nfs/dbraw/zinc/83/92/58/700839258.db2.gz	DPSALZQHGCTENT-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)[C@H](C)C1	ZINC000761072087	700839259	/nfs/dbraw/zinc/83/92/59/700839259.db2.gz	DPSALZQHGCTENT-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C)[C@H](C)C1	ZINC000761072087	700839261	/nfs/dbraw/zinc/83/92/61/700839261.db2.gz	DPSALZQHGCTENT-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804429193	701188288	/nfs/dbraw/zinc/18/82/88/701188288.db2.gz	ABKLQHRPAOHRSU-JTQLQIEISA-N	1	1	310.310	1.006	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2c([N+](=O)[O-])cccc2[N+](=O)[O-])C1	ZINC000804442356	701190613	/nfs/dbraw/zinc/19/06/13/701190613.db2.gz	VOSTUYPDQLAFDV-JTQLQIEISA-N	1	1	310.310	1.636	20	5		DDBDMO
C[C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000804477497	701193243	/nfs/dbraw/zinc/19/32/43/701193243.db2.gz	VCVBYSVBIAGIMS-NSHDSACASA-N	1	1	324.337	1.883	20	5		DDBDMO
C[N@@H+]1CC=C(CNS(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000768886982	701214032	/nfs/dbraw/zinc/21/40/32/701214032.db2.gz	FUSQRYXEKDFXHS-UHFFFAOYSA-N	1	1	317.392	1.197	20	5		DDBDMO
Cc1[nH+]ccn1-c1ncccc1CNc1ccncc1[N+](=O)[O-]	ZINC000808011960	701494301	/nfs/dbraw/zinc/49/43/01/701494301.db2.gz	AIOOMBJYQMUBOW-UHFFFAOYSA-N	1	1	310.317	1.913	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000808227725	701509669	/nfs/dbraw/zinc/50/96/69/701509669.db2.gz	CVNTUCVBWQKXFN-JTQLQIEISA-N	1	1	303.322	1.099	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839726122	701798883	/nfs/dbraw/zinc/79/88/83/701798883.db2.gz	MQUNQWXRHKLCGR-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@@H]2COC[C@]2(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867985417	701874110	/nfs/dbraw/zinc/87/41/10/701874110.db2.gz	CPQVMESUOFVANX-UHOFOFEASA-N	1	1	319.361	1.264	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000812332548	702156274	/nfs/dbraw/zinc/15/62/74/702156274.db2.gz	JUGUFEHFOSZAPX-QWHCGFSZSA-N	1	1	319.361	1.627	20	5		DDBDMO
Cc1cc(NCC(=O)N2CC[NH+](C)CC2)c(F)cc1[N+](=O)[O-]	ZINC000812457011	702183513	/nfs/dbraw/zinc/18/35/13/702183513.db2.gz	AUMDESMHEFLISY-UHFFFAOYSA-N	1	1	310.329	1.228	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc(F)c([N+](=O)[O-])cc3CO)CC[C@@H]21	ZINC000866209021	706649231	/nfs/dbraw/zinc/64/92/31/706649231.db2.gz	NEVSYRSBRFUYLY-MFKMUULPSA-N	1	1	309.341	1.757	20	5		DDBDMO
CNC(=O)NC[C@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000879334370	706652856	/nfs/dbraw/zinc/65/28/56/706652856.db2.gz	KBSHRCVTRABWJR-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
CNC(=O)NC[C@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000879334370	706652857	/nfs/dbraw/zinc/65/28/57/706652857.db2.gz	KBSHRCVTRABWJR-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCS(=O)(=O)C2CC2)c1	ZINC000840964957	702296285	/nfs/dbraw/zinc/29/62/85/702296285.db2.gz	UIFKASNUHBSTLV-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
C[N@H+]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000844052224	702963380	/nfs/dbraw/zinc/96/33/80/702963380.db2.gz	VDCJTSMOOIPQNC-APIJFGDWSA-N	1	1	303.362	1.113	20	5		DDBDMO
C[N@@H+]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000844052224	702963381	/nfs/dbraw/zinc/96/33/81/702963381.db2.gz	VDCJTSMOOIPQNC-APIJFGDWSA-N	1	1	303.362	1.113	20	5		DDBDMO
C[N@H+]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000844052224	702963382	/nfs/dbraw/zinc/96/33/82/702963382.db2.gz	VDCJTSMOOIPQNC-APIJFGDWSA-N	1	1	303.362	1.113	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CC[N@H+](CC3CC3)C2)cc1	ZINC000819039568	704056755	/nfs/dbraw/zinc/05/67/55/704056755.db2.gz	RWDVJMDVCPPHRG-GDBMZVCRSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CC[N@@H+](CC3CC3)C2)cc1	ZINC000819039568	704056757	/nfs/dbraw/zinc/05/67/57/704056757.db2.gz	RWDVJMDVCPPHRG-GDBMZVCRSA-N	1	1	305.378	1.702	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870861546	704147978	/nfs/dbraw/zinc/14/79/78/704147978.db2.gz	BPPDIXCZNGWPER-HIFRSBDPSA-N	1	1	307.350	1.406	20	5		DDBDMO
C[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000871157339	704233684	/nfs/dbraw/zinc/23/36/84/704233684.db2.gz	LTKPCXCQNAHSMK-AWEZNQCLSA-N	1	1	321.377	1.571	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CC2CN(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000853553662	704267158	/nfs/dbraw/zinc/26/71/58/704267158.db2.gz	RLGDQBYYCGYSGW-UHFFFAOYSA-N	1	1	304.354	1.099	20	5		DDBDMO
Cc1nn(C[N@H+](C)CC2CN(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000853553662	704267160	/nfs/dbraw/zinc/26/71/60/704267160.db2.gz	RLGDQBYYCGYSGW-UHFFFAOYSA-N	1	1	304.354	1.099	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@@H]2COCCO2)c2ccc([N+](=O)[O-])cc12	ZINC000853559585	704269712	/nfs/dbraw/zinc/26/97/12/704269712.db2.gz	ZRYCSAWTVAASGR-CYBMUJFWSA-N	1	1	320.349	1.558	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@H]2COCCO2)c2ccc([N+](=O)[O-])cc12	ZINC000853559585	704269717	/nfs/dbraw/zinc/26/97/17/704269717.db2.gz	ZRYCSAWTVAASGR-CYBMUJFWSA-N	1	1	320.349	1.558	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)C2	ZINC000854736990	704446183	/nfs/dbraw/zinc/44/61/83/704446183.db2.gz	LYOMOEWBTJYUQY-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000822635019	704993512	/nfs/dbraw/zinc/99/35/12/704993512.db2.gz	NIHXJYUIZDOBAQ-SECBINFHSA-N	1	1	321.293	1.180	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2ccc([N+](=O)[O-])cc2C)no1	ZINC000822808413	705046096	/nfs/dbraw/zinc/04/60/96/705046096.db2.gz	SQASKWHVTBSICF-NSHDSACASA-N	1	1	320.305	1.906	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000874840449	705195586	/nfs/dbraw/zinc/19/55/86/705195586.db2.gz	OBJVCMICRZAPKI-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H](n3ccnn3)C2)cc1	ZINC000823468834	705250307	/nfs/dbraw/zinc/25/03/07/705250307.db2.gz	LIBKLMXKOFIXLQ-LSDHHAIUSA-N	1	1	317.349	1.557	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000824003000	705352604	/nfs/dbraw/zinc/35/26/04/705352604.db2.gz	LCFJYEHIXOROSD-NWDGAFQWSA-N	1	1	319.365	1.925	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000861037749	705357700	/nfs/dbraw/zinc/35/77/00/705357700.db2.gz	ILLOXQZQBHMTKN-LBPRGKRZSA-N	1	1	302.371	1.476	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000861391509	705456091	/nfs/dbraw/zinc/45/60/91/705456091.db2.gz	TZUHEIUMDISSCO-UHFFFAOYSA-N	1	1	316.317	1.643	20	5		DDBDMO
CON(C)C(=O)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000862539746	705728794	/nfs/dbraw/zinc/72/87/94/705728794.db2.gz	UQZFDJWOPHJYHO-QMMMGPOBSA-N	1	1	301.730	1.746	20	5		DDBDMO
Cc1nn(C[N@H+](C)CC2(C)COC2)c2ncc([N+](=O)[O-])cc12	ZINC000863296846	705893972	/nfs/dbraw/zinc/89/39/72/705893972.db2.gz	QHKLQDVKZIWWIO-UHFFFAOYSA-N	1	1	305.338	1.574	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000827137222	705938009	/nfs/dbraw/zinc/93/80/09/705938009.db2.gz	VHAHOYQPYMMQOU-RBSFLKMASA-N	1	1	303.362	1.909	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827244433	705958915	/nfs/dbraw/zinc/95/89/15/705958915.db2.gz	AKXCSFVTEVAQMZ-SNPRPXQTSA-N	1	1	319.361	1.181	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827375174	705989247	/nfs/dbraw/zinc/98/92/47/705989247.db2.gz	TYKVNXYNKGPWBD-OLZOCXBDSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000827490926	706012990	/nfs/dbraw/zinc/01/29/90/706012990.db2.gz	JHPDJJNHUFAHQB-CABCVRRESA-N	1	1	321.377	1.427	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCC[C@@H]1C1OCCO1	ZINC000878046521	706274002	/nfs/dbraw/zinc/27/40/02/706274002.db2.gz	BQJQSEVPJXHPCE-GFCCVEGCSA-N	1	1	310.354	1.327	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@@H]1C1OCCO1	ZINC000878046521	706274003	/nfs/dbraw/zinc/27/40/03/706274003.db2.gz	BQJQSEVPJXHPCE-GFCCVEGCSA-N	1	1	310.354	1.327	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000864963338	706313688	/nfs/dbraw/zinc/31/36/88/706313688.db2.gz	USCOMQGAUKLGRB-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000880071304	706870156	/nfs/dbraw/zinc/87/01/56/706870156.db2.gz	XAFQIOXIQVTTNZ-UONOGXRCSA-N	1	1	309.341	1.375	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC2	ZINC000880180763	706903206	/nfs/dbraw/zinc/90/32/06/706903206.db2.gz	CLEOHGQEDYDCEM-RISCZKNCSA-N	1	1	308.338	1.209	20	5		DDBDMO
Cn1cc(C[NH2+][C@@]2(c3ccccc3)C[C@@H](O)C2)c([N+](=O)[O-])n1	ZINC000880222546	706913137	/nfs/dbraw/zinc/91/31/37/706913137.db2.gz	XBHNDIGWABGBCK-OTVXOJSOSA-N	1	1	302.334	1.468	20	5		DDBDMO
CC(C)C[C@@H](C(N)=O)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000880587541	707029236	/nfs/dbraw/zinc/02/92/36/707029236.db2.gz	GWQPYVHWISYZHE-AWEZNQCLSA-N	1	1	309.366	1.805	20	5		DDBDMO
CC(C)(O)C[C@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000871966743	707258119	/nfs/dbraw/zinc/25/81/19/707258119.db2.gz	WPXDNHMIZGKBKU-ZDUSSCGKSA-N	1	1	323.393	1.239	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000882315453	707580757	/nfs/dbraw/zinc/58/07/57/707580757.db2.gz	ICFJSYGICDJPGT-LBPRGKRZSA-N	1	1	324.356	1.678	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000882484577	707655304	/nfs/dbraw/zinc/65/53/04/707655304.db2.gz	HLJRZXVTMUKJNQ-LLVKDONJSA-N	1	1	302.334	1.900	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+]CCO[C@@H]3CCOC3)nc2c1	ZINC000897202161	708251592	/nfs/dbraw/zinc/25/15/92/708251592.db2.gz	QJQMYMRJUHBGAX-LLVKDONJSA-N	1	1	307.306	1.631	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CCCOCC2)c1C	ZINC000897502885	708354430	/nfs/dbraw/zinc/35/44/30/708354430.db2.gz	RCNBDSAAPLZXLX-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCOCC2)c1C	ZINC000897502885	708354434	/nfs/dbraw/zinc/35/44/34/708354434.db2.gz	RCNBDSAAPLZXLX-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000897683207	708418741	/nfs/dbraw/zinc/41/87/41/708418741.db2.gz	ATSMIWYWIBSXOU-ABAIWWIYSA-N	1	1	316.361	1.808	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@@H+](C)CCO	ZINC000912605533	713044930	/nfs/dbraw/zinc/04/49/30/713044930.db2.gz	YTUDVBNAGZEWGA-SEYXRHQNSA-N	1	1	321.377	1.381	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000886596152	708787654	/nfs/dbraw/zinc/78/76/54/708787654.db2.gz	XTEOVYIALDRROZ-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000886596152	708787655	/nfs/dbraw/zinc/78/76/55/708787655.db2.gz	XTEOVYIALDRROZ-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)n1	ZINC000886597934	708788375	/nfs/dbraw/zinc/78/83/75/708788375.db2.gz	PTXCUHNLPMVFFJ-LBPRGKRZSA-N	1	1	323.397	1.614	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)n1	ZINC000886597934	708788377	/nfs/dbraw/zinc/78/83/77/708788377.db2.gz	PTXCUHNLPMVFFJ-LBPRGKRZSA-N	1	1	323.397	1.614	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@H]([C@@H]2CCCCN2Cc2cccnc2[N+](=O)[O-])C1	ZINC000886841646	708859467	/nfs/dbraw/zinc/85/94/67/708859467.db2.gz	RLAJDBNPGDCLFN-ILXRZTDVSA-N	1	1	320.393	1.851	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)CCO)cc1Cl	ZINC000899738862	709184692	/nfs/dbraw/zinc/18/46/92/709184692.db2.gz	OJOQWQQPIDYBNL-UHFFFAOYSA-N	1	1	315.757	1.211	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C	ZINC000900159755	709311001	/nfs/dbraw/zinc/31/10/01/709311001.db2.gz	PVFIATGNZBNBEY-DOMZBBRYSA-N	1	1	307.350	1.008	20	5		DDBDMO
C[C@@H](NC(=O)C[C@]1(O)CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000901328965	710011660	/nfs/dbraw/zinc/01/16/60/710011660.db2.gz	JVNSWJRBOHIIPU-MLGOLLRUSA-N	1	1	321.377	1.619	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000892678985	710480589	/nfs/dbraw/zinc/48/05/89/710480589.db2.gz	AQCNVRMTYARDIT-LBPRGKRZSA-N	1	1	322.365	1.157	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOC(=O)c2ccc([N+](=O)[O-])n2C)CCO1	ZINC000893392420	710633898	/nfs/dbraw/zinc/63/38/98/710633898.db2.gz	RULUGCJNNJPIOM-NSHDSACASA-N	1	1	311.338	1.201	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928441883	713197461	/nfs/dbraw/zinc/19/74/61/713197461.db2.gz	PTMZBRMUWIOEHC-QMTHXVAHSA-N	1	1	316.361	1.827	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000928457576	713205436	/nfs/dbraw/zinc/20/54/36/713205436.db2.gz	XJIMFBWRCBCTSG-KOLCDFICSA-N	1	1	323.349	1.434	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000928459992	713206312	/nfs/dbraw/zinc/20/63/12/713206312.db2.gz	YYGSZSDOSAXUHI-MFKMUULPSA-N	1	1	317.349	1.153	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637831	710832984	/nfs/dbraw/zinc/83/29/84/710832984.db2.gz	JTIILFKOGSSESI-ZIAGYGMSSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637831	710832988	/nfs/dbraw/zinc/83/29/88/710832988.db2.gz	JTIILFKOGSSESI-ZIAGYGMSSA-N	1	1	317.349	1.920	20	5		DDBDMO
COc1cc([C@H](C)NC[C@H]2C[N@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091854	711029731	/nfs/dbraw/zinc/02/97/31/711029731.db2.gz	BMJJVKYGMXKSJU-WFASDCNBSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([C@H](C)NC[C@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091854	711029733	/nfs/dbraw/zinc/02/97/33/711029733.db2.gz	BMJJVKYGMXKSJU-WFASDCNBSA-N	1	1	322.409	1.500	20	5		DDBDMO
C[N@@H+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894881984	711307184	/nfs/dbraw/zinc/30/71/84/711307184.db2.gz	QCRFMVXEHAZYFD-LLVKDONJSA-N	1	1	320.324	1.395	20	5		DDBDMO
C[N@H+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894881984	711307186	/nfs/dbraw/zinc/30/71/86/711307186.db2.gz	QCRFMVXEHAZYFD-LLVKDONJSA-N	1	1	320.324	1.395	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@]1(C)C[C@H](O)C[N@H+]1C	ZINC000908052258	712672189	/nfs/dbraw/zinc/67/21/89/712672189.db2.gz	CAOPPTACMUFTSA-HOCLYGCPSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@@]1(O)CCC[N@H+](C)C1	ZINC000908267256	712724661	/nfs/dbraw/zinc/72/46/61/712724661.db2.gz	FAPHVWNZWJAPDE-INIZCTEOSA-N	1	1	321.377	1.997	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@H]1NC(=O)OC(C)(C)C	ZINC000930093820	713754732	/nfs/dbraw/zinc/75/47/32/713754732.db2.gz	FSKIAVWRHXKTMN-VXGBXAGGSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@H]1[C@@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044512	713989595	/nfs/dbraw/zinc/98/95/95/713989595.db2.gz	NNODNCYMAIEMTG-WFASDCNBSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044512	713989597	/nfs/dbraw/zinc/98/95/97/713989597.db2.gz	NNODNCYMAIEMTG-WFASDCNBSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@]1([C@@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)COC(=O)N1	ZINC000932016806	714236261	/nfs/dbraw/zinc/23/62/61/714236261.db2.gz	PLDAUXNTJOCUFG-DOMZBBRYSA-N	1	1	320.349	1.700	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1	ZINC000933737202	714659386	/nfs/dbraw/zinc/65/93/86/714659386.db2.gz	LYMSKPTXQGSOJR-BMFZPTHFSA-N	1	1	305.378	1.512	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H]2CCC[C@]2(C(N)=O)C1	ZINC000933749724	714662965	/nfs/dbraw/zinc/66/29/65/714662965.db2.gz	FWCJIWXQLOTYKU-LRDDRELGSA-N	1	1	319.361	1.691	20	5		DDBDMO
C[C@@]1(C2CC2)COCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000934478510	714829735	/nfs/dbraw/zinc/82/97/35/714829735.db2.gz	UZBVNBUARHGTOM-HNNXBMFYSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[C@@]1(C2CC2)COCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000934478510	714829736	/nfs/dbraw/zinc/82/97/36/714829736.db2.gz	UZBVNBUARHGTOM-HNNXBMFYSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)C[C@H]21	ZINC000347409208	719475508	/nfs/dbraw/zinc/47/55/08/719475508.db2.gz	GYAWUDBSYJFAFF-OLZOCXBDSA-N	1	1	315.333	1.057	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC001167358599	733289113	/nfs/dbraw/zinc/28/91/13/733289113.db2.gz	WCQBQXXSKAKJLS-UHFFFAOYSA-N	1	1	314.227	1.132	20	5		DDBDMO
Cc1ccc(F)cc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001022063746	734368359	/nfs/dbraw/zinc/36/83/59/734368359.db2.gz	KZZLGVFRTIMCRF-LXTVHRRPSA-N	1	1	321.352	1.536	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])c(C)c1NC1C[NH+](C(C)C)C1	ZINC001168315823	742181778	/nfs/dbraw/zinc/18/17/78/742181778.db2.gz	YDVATMSKXSHAQG-UHFFFAOYSA-N	1	1	308.338	1.589	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1CCC=CCC1	ZINC001151285701	743743820	/nfs/dbraw/zinc/74/38/20/743743820.db2.gz	ACWKBWVXYCZWJU-UHFFFAOYSA-N	1	1	321.381	1.281	20	5		DDBDMO
COC(=O)c1cnc(NCc2[nH]c(C)[nH+]c2C)c([N+](=O)[O-])c1	ZINC001187663496	744589140	/nfs/dbraw/zinc/58/91/40/744589140.db2.gz	WPIKNENGSZQPBB-UHFFFAOYSA-N	1	1	305.294	1.728	20	5		DDBDMO
CNC(=O)N[C@@H]1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759131	747247798	/nfs/dbraw/zinc/24/77/98/747247798.db2.gz	NBKNNJQCOGSYSI-TZMCWYRMSA-N	1	1	322.365	1.022	20	5		DDBDMO
CNC(=O)N[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759131	747247803	/nfs/dbraw/zinc/24/78/03/747247803.db2.gz	NBKNNJQCOGSYSI-TZMCWYRMSA-N	1	1	322.365	1.022	20	5		DDBDMO
COC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023987	762202106	/nfs/dbraw/zinc/20/21/06/762202106.db2.gz	WLVSQIZRNPORGQ-AGIUHOORSA-N	1	1	308.382	1.411	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169023987	762202111	/nfs/dbraw/zinc/20/21/11/762202111.db2.gz	WLVSQIZRNPORGQ-AGIUHOORSA-N	1	1	308.382	1.411	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@@H](Oc3cnccn3)C2)C1	ZINC001169053886	762208642	/nfs/dbraw/zinc/20/86/42/762208642.db2.gz	JYLIBIAEYKRAEZ-HZSPNIEDSA-N	1	1	306.366	1.765	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC001097212504	756983263	/nfs/dbraw/zinc/98/32/63/756983263.db2.gz	WKJZZBQHOXBNQM-TXEJJXNPSA-N	1	1	321.381	1.391	20	5		DDBDMO
Cc1cccnc1C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086083267	760943549	/nfs/dbraw/zinc/94/35/49/760943549.db2.gz	SKERJJLRJIQMCE-QVHKTLOISA-N	1	1	318.377	1.040	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCOC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334098	766256933	/nfs/dbraw/zinc/25/69/33/766256933.db2.gz	BLDCXUKLPVYLEM-DGCLKSJQSA-N	1	1	310.350	1.228	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1F	ZINC001093641919	774939483	/nfs/dbraw/zinc/93/94/83/774939483.db2.gz	AUVVUJBMPLBMDG-UHFFFAOYSA-N	1	1	321.312	1.467	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC001093840783	775125914	/nfs/dbraw/zinc/12/59/14/775125914.db2.gz	WIYMGTUERQWWBZ-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001094517194	775972635	/nfs/dbraw/zinc/97/26/35/775972635.db2.gz	FJTBBOHEPZBSSC-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
NC(=O)[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1	ZINC001172918313	776930927	/nfs/dbraw/zinc/93/09/27/776930927.db2.gz	AQYYADJFOYGECL-UKRRQHHQSA-N	1	1	319.361	1.028	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2[C@H](C1)OCCN2C	ZINC001173220965	777053399	/nfs/dbraw/zinc/05/33/99/777053399.db2.gz	DTOUANAQJFLNGQ-MAZHCROVSA-N	1	1	305.378	1.541	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](C)(CO)[C@@H](O)C1	ZINC001173223388	777057090	/nfs/dbraw/zinc/05/70/90/777057090.db2.gz	ZNSRRHMZRJZCMO-KCXAZCMYSA-N	1	1	308.378	1.591	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)C(F)F	ZINC001269356722	841560530	/nfs/dbraw/zinc/56/05/30/841560530.db2.gz	UNUYJKOEAWGBQQ-UHFFFAOYSA-N	1	1	305.306	1.660	20	5		DDBDMO
Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)n1	ZINC001269411442	841618503	/nfs/dbraw/zinc/61/85/03/841618503.db2.gz	HMWVGSWWDRSVBC-ZIAGYGMSSA-N	1	1	318.377	1.102	20	5		DDBDMO
CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C(N)=O	ZINC001142940135	861315879	/nfs/dbraw/zinc/31/58/79/861315879.db2.gz	LIQOSISOLNQLJB-UHFFFAOYSA-N	1	1	324.340	1.380	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H]2C[N@@H+]3CCN2C[C@H]3C)cc1[N+](=O)[O-]	ZINC001123474142	859251153	/nfs/dbraw/zinc/25/11/53/859251153.db2.gz	YRWUPTCNQVKGHP-BXUZGUMPSA-N	1	1	304.350	1.230	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)[nH+]1	ZINC001156476909	863083091	/nfs/dbraw/zinc/08/30/91/863083091.db2.gz	ZCPMRHOJABFCHJ-UHFFFAOYSA-N	1	1	324.728	1.517	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3ncnc(OC)c3[N+](=O)[O-])C[C@H]2C1	ZINC001157692632	864052457	/nfs/dbraw/zinc/05/24/57/864052457.db2.gz	YBGGIPVTIAIDFB-PHIMTYICSA-N	1	1	307.354	1.171	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC001158366057	864606167	/nfs/dbraw/zinc/60/61/67/864606167.db2.gz	VFNZCCVFZMSXAT-VIFPVBQESA-N	1	1	310.329	1.530	20	5		DDBDMO
COc1nc(N2CC[N@@H+](C)CC23CCCC3)ncc1[N+](=O)[O-]	ZINC001158405317	864631561	/nfs/dbraw/zinc/63/15/61/864631561.db2.gz	PKAQDJPIOVXZDX-UHFFFAOYSA-N	1	1	307.354	1.458	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[C@H]1[NH+]1CCOCC1	ZINC001160724979	866074992	/nfs/dbraw/zinc/07/49/92/866074992.db2.gz	NMQYNTXITJZPPM-CHWSQXEVSA-N	1	1	307.354	1.237	20	5		DDBDMO
CCCC[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])c(F)c1	ZINC001333470435	866775258	/nfs/dbraw/zinc/77/52/58/866775258.db2.gz	IOLZXCIZLLQBOZ-UKRRQHHQSA-N	1	1	323.368	1.997	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC001333721527	866963858	/nfs/dbraw/zinc/96/38/58/866963858.db2.gz	IKMANHXZMYLWKT-NHYWBVRUSA-N	1	1	317.349	1.574	20	5		DDBDMO
Cc1nc(N[C@H](C[NH+]2CCOCC2)C(C)(C)C)ncc1[N+](=O)[O-]	ZINC001162879604	867895054	/nfs/dbraw/zinc/89/50/54/867895054.db2.gz	DEYSJQJKSHAHQK-CYBMUJFWSA-N	1	1	323.397	1.852	20	5		DDBDMO
Cc1nc(N2CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-]	ZINC001163117355	868114496	/nfs/dbraw/zinc/11/44/96/868114496.db2.gz	FPAJHQGXCRAJMR-CYBMUJFWSA-N	1	1	322.365	1.403	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@@H]1C	ZINC001322508681	868212064	/nfs/dbraw/zinc/21/20/64/868212064.db2.gz	DSCBPRSDGRWPMN-BONVTDFDSA-N	1	1	318.377	1.849	20	5		DDBDMO
COc1nc(SC)nc(NCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC001163919938	868793009	/nfs/dbraw/zinc/79/30/09/868793009.db2.gz	OVVCCRRXHDPRAL-UHFFFAOYSA-N	1	1	324.366	1.732	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@@](C)(O)[C@@H](F)C2)ncc1[N+](=O)[O-]	ZINC001164288004	869088686	/nfs/dbraw/zinc/08/86/86/869088686.db2.gz	ASGLBFDJLXRVDI-OZQCQIJRSA-N	1	1	324.356	1.821	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2ccns2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494946	869234195	/nfs/dbraw/zinc/23/41/95/869234195.db2.gz	YXNJPNKSRSPGLV-VXGBXAGGSA-N	1	1	324.406	1.184	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC001337585070	869551724	/nfs/dbraw/zinc/55/17/24/869551724.db2.gz	FNXJGYKLQHQDIQ-LBPRGKRZSA-N	1	1	304.350	1.480	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC001337585070	869551736	/nfs/dbraw/zinc/55/17/36/869551736.db2.gz	FNXJGYKLQHQDIQ-LBPRGKRZSA-N	1	1	304.350	1.480	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1cc([N+](=O)[O-])ccn1)CC2	ZINC001166032742	869808532	/nfs/dbraw/zinc/80/85/32/869808532.db2.gz	RXOMDKXZQIJACK-UHFFFAOYSA-N	1	1	305.338	1.624	20	5		DDBDMO
COC(=O)C1([NH3+])CCN(c2nccc(Cl)c2[N+](=O)[O-])CC1	ZINC001166794488	870253778	/nfs/dbraw/zinc/25/37/78/870253778.db2.gz	CZZRWTBPWLGFEQ-UHFFFAOYSA-N	1	1	314.729	1.114	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](Nc2ncccn2)C1	ZINC001308140451	871475632	/nfs/dbraw/zinc/47/56/32/871475632.db2.gz	LCDBGDQCHLGHGC-LBPRGKRZSA-N	1	1	317.353	1.076	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]3CCCC[C@@H]3C2)c1	ZINC001319181582	872482777	/nfs/dbraw/zinc/48/27/77/872482777.db2.gz	MKZCNYDJRIZNDQ-UMVBOHGHSA-N	1	1	308.382	1.664	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001319297819	872550289	/nfs/dbraw/zinc/55/02/89/872550289.db2.gz	DQSSYPVMVROHCN-LLVKDONJSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[N@@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001319297819	872550297	/nfs/dbraw/zinc/55/02/97/872550297.db2.gz	DQSSYPVMVROHCN-LLVKDONJSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001319297819	872550306	/nfs/dbraw/zinc/55/03/06/872550306.db2.gz	DQSSYPVMVROHCN-LLVKDONJSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CC[N@@H+](C)C(C)(C)C1	ZINC001344466150	873013690	/nfs/dbraw/zinc/01/36/90/873013690.db2.gz	HHUCOLJKTQZTMU-UHFFFAOYSA-N	1	1	310.402	1.241	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC2CC2)C[C@@H]1C	ZINC001348145018	874378366	/nfs/dbraw/zinc/37/83/66/874378366.db2.gz	JLMLDVBFJILHMN-RYUDHWBXSA-N	1	1	322.413	1.556	20	5		DDBDMO
C[C@H](COC(=O)c1ccccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC001349655491	875285375	/nfs/dbraw/zinc/28/53/75/875285375.db2.gz	LGGJMBHUOXXYHN-LBPRGKRZSA-N	1	1	308.334	1.720	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCc2cccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC001223664362	881050566	/nfs/dbraw/zinc/05/05/66/881050566.db2.gz	HWHMBDNBECDDOJ-LBPRGKRZSA-N	1	1	308.334	1.992	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CO[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001223943266	881158336	/nfs/dbraw/zinc/15/83/36/881158336.db2.gz	KOBMOMQBNOBZLL-JGGQBBKZSA-N	1	1	320.345	1.924	20	5		DDBDMO
O=c1[nH]c(C2CC2)nc(O[C@@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC001228604844	883567694	/nfs/dbraw/zinc/56/76/94/883567694.db2.gz	WXADJCGHHYNZGO-SNVBAGLBSA-N	1	1	306.322	1.441	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cn[nH]c1)Cc1ccc([N+](=O)[O-])cc1	ZINC001234368253	887910568	/nfs/dbraw/zinc/91/05/68/887910568.db2.gz	BRDHZRZYYLHXOF-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@](O)(CN)C1	ZINC001246554960	892693844	/nfs/dbraw/zinc/69/38/44/892693844.db2.gz	AFPPLSKFIXMXIR-BBRMVZONSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@](O)(CN)C1	ZINC001246554960	892693848	/nfs/dbraw/zinc/69/38/48/892693848.db2.gz	AFPPLSKFIXMXIR-BBRMVZONSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@](O)(C[NH3+])C1	ZINC001246554960	892693853	/nfs/dbraw/zinc/69/38/53/892693853.db2.gz	AFPPLSKFIXMXIR-BBRMVZONSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCCC[C@@](O)(C[NH3+])C1	ZINC001246559079	892698152	/nfs/dbraw/zinc/69/81/52/892698152.db2.gz	NFEMFNYYOHHEDD-XJKSGUPXSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@@H]1C(=O)NCC[N@@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478764	896455631	/nfs/dbraw/zinc/45/56/31/896455631.db2.gz	IXXOUTZZSNRJDX-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
C[C@@H]1C(=O)NCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478764	896455636	/nfs/dbraw/zinc/45/56/36/896455636.db2.gz	IXXOUTZZSNRJDX-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
CC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1	ZINC001279363796	903237088	/nfs/dbraw/zinc/23/70/88/903237088.db2.gz	WJYMGNMLWXXJKS-OPCZEIQHSA-N	1	1	307.394	1.398	20	5		DDBDMO
CC/C=C\CC[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001279363796	903237100	/nfs/dbraw/zinc/23/71/00/903237100.db2.gz	WJYMGNMLWXXJKS-OPCZEIQHSA-N	1	1	307.394	1.398	20	5		DDBDMO
CC/C=C\CC[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001279363796	903237115	/nfs/dbraw/zinc/23/71/15/903237115.db2.gz	WJYMGNMLWXXJKS-OPCZEIQHSA-N	1	1	307.394	1.398	20	5		DDBDMO
CC[C@]1(C)C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248951633	282120187	/nfs/dbraw/zinc/12/01/87/282120187.db2.gz	PQJGGUFQXFTFKV-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248951633	282120188	/nfs/dbraw/zinc/12/01/88/282120188.db2.gz	PQJGGUFQXFTFKV-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000272809073	210211246	/nfs/dbraw/zinc/21/12/46/210211246.db2.gz	IWSBTQUUXYHOHR-LBPRGKRZSA-N	1	1	320.349	1.915	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C2)C1	ZINC000292406069	529801281	/nfs/dbraw/zinc/80/12/81/529801281.db2.gz	ZENBIKWCNXTRFN-MRXNPFEDSA-N	1	1	303.362	1.692	20	5		DDBDMO
COc1cc(NC[C@@H](C)[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000266422723	282302369	/nfs/dbraw/zinc/30/23/69/282302369.db2.gz	SHCFYVYDMORFAT-GFCCVEGCSA-N	1	1	308.382	1.651	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000299331512	530058003	/nfs/dbraw/zinc/05/80/03/530058003.db2.gz	ZKFYKYRDCFOUES-LLVKDONJSA-N	1	1	302.334	1.900	20	5		DDBDMO
C[C@@H]1CN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330860125	232119933	/nfs/dbraw/zinc/11/99/33/232119933.db2.gz	VWMOXXFDSLBUBO-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000330860125	232119937	/nfs/dbraw/zinc/11/99/37/232119937.db2.gz	VWMOXXFDSLBUBO-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000330860125	232119941	/nfs/dbraw/zinc/11/99/41/232119941.db2.gz	VWMOXXFDSLBUBO-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1c(CNC(=O)N[C@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000616200570	362584209	/nfs/dbraw/zinc/58/42/09/362584209.db2.gz	JANWMVWOLJUKHG-ZDUSSCGKSA-N	1	1	306.366	1.797	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000342426597	282555809	/nfs/dbraw/zinc/55/58/09/282555809.db2.gz	DTFOVKLGRMLNDB-PRHODGIISA-N	1	1	318.782	1.771	20	5		DDBDMO
CC(C)(C)[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000279943286	215258733	/nfs/dbraw/zinc/25/87/33/215258733.db2.gz	XIMQYDXRCOQRQG-CYBMUJFWSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC(C)(C)[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000279943286	215258736	/nfs/dbraw/zinc/25/87/36/215258736.db2.gz	XIMQYDXRCOQRQG-CYBMUJFWSA-N	1	1	309.366	1.503	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000191861922	186266085	/nfs/dbraw/zinc/26/60/85/186266085.db2.gz	OJFRGCZHTJFZLT-UGFHNGPFSA-N	1	1	322.361	1.759	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cn1	ZINC000027214970	352215140	/nfs/dbraw/zinc/21/51/40/352215140.db2.gz	JZAPKESIJOEODJ-CQSZACIVSA-N	1	1	320.349	1.200	20	5		DDBDMO
CC[NH+]1CCN(CCCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000042309689	352334212	/nfs/dbraw/zinc/33/42/12/352334212.db2.gz	QXSDXFZLSXVKOR-UHFFFAOYSA-N	1	1	323.397	1.070	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NCC[N@H+]1CCc2ccccc2C1	ZINC000045026610	352399932	/nfs/dbraw/zinc/39/99/32/352399932.db2.gz	VWCRSEUUQRKNOZ-UHFFFAOYSA-N	1	1	301.350	1.799	20	5		DDBDMO
NC(=O)C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000052826674	352626460	/nfs/dbraw/zinc/62/64/60/352626460.db2.gz	QHHODTFLPXDRRP-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@H](C)O1	ZINC000054925851	352710465	/nfs/dbraw/zinc/71/04/65/352710465.db2.gz	LHQRTSYUYYVJIJ-PHIMTYICSA-N	1	1	324.381	1.541	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@H](C)O1	ZINC000054925851	352710468	/nfs/dbraw/zinc/71/04/68/352710468.db2.gz	LHQRTSYUYYVJIJ-PHIMTYICSA-N	1	1	324.381	1.541	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000066870881	353020641	/nfs/dbraw/zinc/02/06/41/353020641.db2.gz	QLNSJOKYUJWEFE-UHFFFAOYSA-N	1	1	317.342	1.106	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1C(N)=O	ZINC000068369195	353106962	/nfs/dbraw/zinc/10/69/62/353106962.db2.gz	RLTZHDXRQJNXCD-ZDUSSCGKSA-N	1	1	320.349	1.182	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCO)C1CC1	ZINC000067965662	353077653	/nfs/dbraw/zinc/07/76/53/353077653.db2.gz	MJJDORVPDYQEGP-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000069529207	353165704	/nfs/dbraw/zinc/16/57/04/353165704.db2.gz	WRAKFHNQQNVCCX-AWEZNQCLSA-N	1	1	307.350	1.435	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-]	ZINC000073993039	353283560	/nfs/dbraw/zinc/28/35/60/353283560.db2.gz	ZJMSLXWWINAYMP-OLZOCXBDSA-N	1	1	318.377	1.945	20	5		DDBDMO
Nc1nc(N2CC[NH+](Cc3cccs3)CC2)ncc1[N+](=O)[O-]	ZINC000076511506	353423925	/nfs/dbraw/zinc/42/39/25/353423925.db2.gz	GQJUPONRCCHMAB-UHFFFAOYSA-N	1	1	320.378	1.351	20	5		DDBDMO
COc1ccc([C@H](CO)[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000174861024	198394090	/nfs/dbraw/zinc/39/40/90/198394090.db2.gz	WQNQAXAKUQLYRN-HNNXBMFYSA-N	1	1	320.349	1.465	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000174808640	198387645	/nfs/dbraw/zinc/38/76/45/198387645.db2.gz	HSSWNIULOGTAOL-UHFFFAOYSA-N	1	1	304.350	1.940	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@]3(CCCOC3)C2)c1	ZINC000355776141	291004036	/nfs/dbraw/zinc/00/40/36/291004036.db2.gz	BBSUGMQCQXLIPY-HUUCEWRRSA-N	1	1	324.381	1.045	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000091457694	353827116	/nfs/dbraw/zinc/82/71/16/353827116.db2.gz	QWKOZPCZSXJIGQ-NSHDSACASA-N	1	1	304.354	1.781	20	5		DDBDMO
COc1cccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)c1	ZINC000090512160	353795210	/nfs/dbraw/zinc/79/52/10/353795210.db2.gz	FAFHTHVNTAZBIQ-UHFFFAOYSA-N	1	1	317.345	1.897	20	5		DDBDMO
CCOC(=O)CC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000161896678	354244803	/nfs/dbraw/zinc/24/48/03/354244803.db2.gz	OOZDCDBJHSJWGU-ZDUSSCGKSA-N	1	1	324.381	1.847	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000157689748	354226678	/nfs/dbraw/zinc/22/66/78/354226678.db2.gz	XJFLPXCFSXWLHF-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000157689748	354226681	/nfs/dbraw/zinc/22/66/81/354226681.db2.gz	XJFLPXCFSXWLHF-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](CCO)C2)c1	ZINC000589499646	354996772	/nfs/dbraw/zinc/99/67/72/354996772.db2.gz	ZMKHWPTWADCKBE-GFCCVEGCSA-N	1	1	322.361	1.976	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000591047957	355238944	/nfs/dbraw/zinc/23/89/44/355238944.db2.gz	WUVPOXOHWKSFFO-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000593992743	356081201	/nfs/dbraw/zinc/08/12/01/356081201.db2.gz	BTEYSBPWTYHUMN-LBPRGKRZSA-N	1	1	321.381	1.065	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(O[C@@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000595348789	356457913	/nfs/dbraw/zinc/45/79/13/356457913.db2.gz	VJOGVFCDQKGBKD-GFCCVEGCSA-N	1	1	311.338	1.661	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000595689573	356611455	/nfs/dbraw/zinc/61/14/55/356611455.db2.gz	RWPDTYCBAVLJHC-IYBDPMFKSA-N	1	1	319.361	1.552	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000595661220	356597254	/nfs/dbraw/zinc/59/72/54/356597254.db2.gz	JYEZQONNJOPOCF-HNNXBMFYSA-N	1	1	310.350	1.447	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](CCF)C2)c1	ZINC000595756850	356639197	/nfs/dbraw/zinc/63/91/97/356639197.db2.gz	XXSCJCMIZZNOBZ-AAEUAGOBSA-N	1	1	300.334	1.224	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595836582	356671678	/nfs/dbraw/zinc/67/16/78/356671678.db2.gz	WTHODXSOAQQDCG-QWHCGFSZSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595836582	356671680	/nfs/dbraw/zinc/67/16/80/356671680.db2.gz	WTHODXSOAQQDCG-QWHCGFSZSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595868890	356685042	/nfs/dbraw/zinc/68/50/42/356685042.db2.gz	BYLHVNQMQXXRLP-XHBSWPGZSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595868890	356685045	/nfs/dbraw/zinc/68/50/45/356685045.db2.gz	BYLHVNQMQXXRLP-XHBSWPGZSA-N	1	1	321.377	1.872	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCSC[C@@H]2CCO)c1	ZINC000347508120	283218493	/nfs/dbraw/zinc/21/84/93/283218493.db2.gz	AFRUHSRXMNIKPL-ZDUSSCGKSA-N	1	1	312.391	1.773	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCSC[C@H]2CCO)c1	ZINC000347508117	283218672	/nfs/dbraw/zinc/21/86/72/283218672.db2.gz	AFRUHSRXMNIKPL-CYBMUJFWSA-N	1	1	312.391	1.773	20	5		DDBDMO
O=c1[nH]ccc(NCCc2cn3c([nH+]2)CCCC3)c1[N+](=O)[O-]	ZINC000596072433	356762125	/nfs/dbraw/zinc/76/21/25/356762125.db2.gz	AKDCJRWZQOSXGO-UHFFFAOYSA-N	1	1	303.322	1.883	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000598343860	357546970	/nfs/dbraw/zinc/54/69/70/357546970.db2.gz	WYEAXESMVXJHCR-JTQLQIEISA-N	1	1	309.370	1.655	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598648528	357669075	/nfs/dbraw/zinc/66/90/75/357669075.db2.gz	UCQWXYUOKGHQGN-MGPQQGTHSA-N	1	1	324.377	1.285	20	5		DDBDMO
Cc1cc(NCC[N@H+]2CC[C@@H](O)C2)c2cccc([N+](=O)[O-])c2n1	ZINC000599175439	357840484	/nfs/dbraw/zinc/84/04/84/357840484.db2.gz	BFYMKNIGCUSCTC-GFCCVEGCSA-N	1	1	316.361	1.930	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1	ZINC000599553487	357970968	/nfs/dbraw/zinc/97/09/68/357970968.db2.gz	WSYAFCVTZUFRKI-UPJWGTAASA-N	1	1	312.395	1.122	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3COCC[NH2+]3)o2)cc1	ZINC000600679077	358281168	/nfs/dbraw/zinc/28/11/68/358281168.db2.gz	ZATHKFXMNFPVTQ-CYBMUJFWSA-N	1	1	317.345	1.933	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000600835038	358328963	/nfs/dbraw/zinc/32/89/63/358328963.db2.gz	HAMIOUGPZSRLNE-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](CO)[C@H](O)C3)c2c1	ZINC000601153058	358424196	/nfs/dbraw/zinc/42/41/96/358424196.db2.gz	UXTHWLQQXGPNJB-ZUZCIYMTSA-N	1	1	303.318	1.323	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]2C1	ZINC000601183702	358437510	/nfs/dbraw/zinc/43/75/10/358437510.db2.gz	CSOFEZWGEVUSBJ-MNOVXSKESA-N	1	1	301.350	1.859	20	5		DDBDMO
Cc1cn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)nc1[N+](=O)[O-]	ZINC000601956013	358752360	/nfs/dbraw/zinc/75/23/60/358752360.db2.gz	CUHUQJRFIBYCII-MRXNPFEDSA-N	1	1	316.361	1.737	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCSC[C@H]1C[N@H+](C)CCO1	ZINC000601918117	358740367	/nfs/dbraw/zinc/74/03/67/358740367.db2.gz	ONFQPCMIERMYNE-LLVKDONJSA-N	1	1	300.384	1.164	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCSC[C@H]1C[N@@H+](C)CCO1	ZINC000601918117	358740372	/nfs/dbraw/zinc/74/03/72/358740372.db2.gz	ONFQPCMIERMYNE-LLVKDONJSA-N	1	1	300.384	1.164	20	5		DDBDMO
C[NH+](C)[C@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1(C)C	ZINC000602174240	358863305	/nfs/dbraw/zinc/86/33/05/358863305.db2.gz	SQUSVGQQXAZXRV-OLZOCXBDSA-N	1	1	307.350	1.759	20	5		DDBDMO
COCC[N@@H+](C)CCNCc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602531676	359030400	/nfs/dbraw/zinc/03/04/00/359030400.db2.gz	WNTIUNSZOBLIFK-UHFFFAOYSA-N	1	1	308.338	1.404	20	5		DDBDMO
COCCN(C)CC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602531676	359030403	/nfs/dbraw/zinc/03/04/03/359030403.db2.gz	WNTIUNSZOBLIFK-UHFFFAOYSA-N	1	1	308.338	1.404	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@@H]1n1ccnc1	ZINC000602482356	359008795	/nfs/dbraw/zinc/00/87/95/359008795.db2.gz	FNZOCNGWIYKYMU-AAEUAGOBSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@@H]1n1ccnc1	ZINC000602482356	359008797	/nfs/dbraw/zinc/00/87/97/359008797.db2.gz	FNZOCNGWIYKYMU-AAEUAGOBSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000602652298	359101583	/nfs/dbraw/zinc/10/15/83/359101583.db2.gz	CIMIDWBELSVCLB-UHFFFAOYSA-N	1	1	305.256	1.921	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@]3(C)C(=O)NC(=O)[C@]3(C)C2)cc1[N+](=O)[O-]	ZINC000602729682	359153381	/nfs/dbraw/zinc/15/33/81/359153381.db2.gz	AZVKLXPMRINQKM-IYBDPMFKSA-N	1	1	317.345	1.388	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O	ZINC000602843195	359231102	/nfs/dbraw/zinc/23/11/02/359231102.db2.gz	WERNWIYYNUDZDW-MGPQQGTHSA-N	1	1	308.382	1.725	20	5		DDBDMO
CC(C)[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])[C@H](O)C(F)(F)F	ZINC000602829422	359220869	/nfs/dbraw/zinc/22/08/69/359220869.db2.gz	ISUYTIJHJWVYAF-IUCAKERBSA-N	1	1	310.276	1.366	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](CO)C1	ZINC000602932457	359302604	/nfs/dbraw/zinc/30/26/04/359302604.db2.gz	YLDAVTULBGRMEB-DOMZBBRYSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H](CO)C1	ZINC000602932457	359302609	/nfs/dbraw/zinc/30/26/09/359302609.db2.gz	YLDAVTULBGRMEB-DOMZBBRYSA-N	1	1	321.377	1.650	20	5		DDBDMO
Cn1cc(C2=CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cn1	ZINC000602888087	359272042	/nfs/dbraw/zinc/27/20/42/359272042.db2.gz	PACXCFYHYBBDQX-UHFFFAOYSA-N	1	1	302.338	1.314	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@H](OC)C[C@@]2(C)CO)cc1[N+](=O)[O-]	ZINC000602963871	359327922	/nfs/dbraw/zinc/32/79/22/359327922.db2.gz	JLEQPQOAGDOFCA-DOMZBBRYSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](OC)C[C@@]1(C)CO	ZINC000602964699	359328031	/nfs/dbraw/zinc/32/80/31/359328031.db2.gz	SFVDFVLKXSZJPP-HIFRSBDPSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](OC)C[C@@]1(C)CO	ZINC000602964699	359328032	/nfs/dbraw/zinc/32/80/32/359328032.db2.gz	SFVDFVLKXSZJPP-HIFRSBDPSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000189393848	200393607	/nfs/dbraw/zinc/39/36/07/200393607.db2.gz	CEFCRWMDBWICIO-LLVKDONJSA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccccc1[N+](=O)[O-]	ZINC000189428725	200399466	/nfs/dbraw/zinc/39/94/66/200399466.db2.gz	UJGNDYMAHXQACJ-ZDUSSCGKSA-N	1	1	307.394	1.872	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C2CCC2)CC1	ZINC000609594580	360331383	/nfs/dbraw/zinc/33/13/83/360331383.db2.gz	XVJSOWZKHCKCCN-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[C@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000359029748	299311728	/nfs/dbraw/zinc/31/17/28/299311728.db2.gz	SOWIHTXJBXYJCS-VXGBXAGGSA-N	1	1	321.381	1.796	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611088488	360619294	/nfs/dbraw/zinc/61/92/94/360619294.db2.gz	ZGASKBKNMKNKQJ-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)N(C)C	ZINC000611204851	360658669	/nfs/dbraw/zinc/65/86/69/360658669.db2.gz	BNJHAQJNOIGNNE-UHFFFAOYSA-N	1	1	322.365	1.334	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000611599958	360775260	/nfs/dbraw/zinc/77/52/60/360775260.db2.gz	XIGYIXBDSCWHHY-NSHDSACASA-N	1	1	305.338	1.018	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000271898636	209306103	/nfs/dbraw/zinc/30/61/03/209306103.db2.gz	GIVHSAGPSQTZPJ-UHFFFAOYSA-N	1	1	319.361	1.742	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(N3CC[N@@H+]4CCOC[C@H]4C3)c2c1	ZINC000612451063	361021873	/nfs/dbraw/zinc/02/18/73/361021873.db2.gz	AKWJHKDBRHBELA-GFCCVEGCSA-N	1	1	315.333	1.059	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncnc(N3CC[N@H+]4CCOC[C@H]4C3)c2c1	ZINC000612451063	361021876	/nfs/dbraw/zinc/02/18/76/361021876.db2.gz	AKWJHKDBRHBELA-GFCCVEGCSA-N	1	1	315.333	1.059	20	5		DDBDMO
C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@]1(CO)CCOC1	ZINC000613130291	361283313	/nfs/dbraw/zinc/28/33/13/361283313.db2.gz	SLQCGEGOWHJRMQ-AWEZNQCLSA-N	1	1	307.306	1.319	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@]1(CO)CCOC1	ZINC000613130291	361283315	/nfs/dbraw/zinc/28/33/15/361283315.db2.gz	SLQCGEGOWHJRMQ-AWEZNQCLSA-N	1	1	307.306	1.319	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NCCC[NH+]2CCN(C)CC2)n1	ZINC000359110915	299328414	/nfs/dbraw/zinc/32/84/14/299328414.db2.gz	TYPRLJDRPUKVRL-UHFFFAOYSA-N	1	1	307.398	1.656	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1C(F)F	ZINC000566004709	304109577	/nfs/dbraw/zinc/10/95/77/304109577.db2.gz	ZLZDNVUVOHTBSX-LBPRGKRZSA-N	1	1	313.304	1.891	20	5		DDBDMO
CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@@H]1O	ZINC000275440850	212332473	/nfs/dbraw/zinc/33/24/73/212332473.db2.gz	KIWNGPHITKOGML-ZDUSSCGKSA-N	1	1	307.350	1.287	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@@H]1O	ZINC000275440850	212332476	/nfs/dbraw/zinc/33/24/76/212332476.db2.gz	KIWNGPHITKOGML-ZDUSSCGKSA-N	1	1	307.350	1.287	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1cn[nH]c1	ZINC000275149961	212152587	/nfs/dbraw/zinc/15/25/87/212152587.db2.gz	GKQYIRLXADGVMP-SECBINFHSA-N	1	1	319.321	1.616	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=C(C)CC1	ZINC000349974358	284124649	/nfs/dbraw/zinc/12/46/49/284124649.db2.gz	PSJSVQSVTIBAFB-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CN1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000264553276	203993011	/nfs/dbraw/zinc/99/30/11/203993011.db2.gz	SBTYMDMGBUGNEY-HNNXBMFYSA-N	1	1	319.409	1.596	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1F	ZINC000264571340	204003252	/nfs/dbraw/zinc/00/32/52/204003252.db2.gz	HPIXLCPJWZKXID-ZDUSSCGKSA-N	1	1	310.329	1.486	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000288260256	220047517	/nfs/dbraw/zinc/04/75/17/220047517.db2.gz	FMVSWVIRKSXUCF-NSHDSACASA-N	1	1	309.370	1.042	20	5		DDBDMO
CN1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1=O	ZINC000338954300	250216395	/nfs/dbraw/zinc/21/63/95/250216395.db2.gz	MVOZSSZAMLNPSK-SECBINFHSA-N	1	1	315.276	1.517	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000106394223	194206330	/nfs/dbraw/zinc/20/63/30/194206330.db2.gz	CWMRAVPSGNQKRH-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000109992062	194303220	/nfs/dbraw/zinc/30/32/20/194303220.db2.gz	DDDVPKPLNAIQRB-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000340969552	251310065	/nfs/dbraw/zinc/31/00/65/251310065.db2.gz	SLUGMVGBBUQRRR-LLVKDONJSA-N	1	1	323.349	1.054	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341009071	251333666	/nfs/dbraw/zinc/33/36/66/251333666.db2.gz	AHJGRHFAVIKMMT-YPMHNXCESA-N	1	1	306.366	1.877	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000063757939	184287800	/nfs/dbraw/zinc/28/78/00/184287800.db2.gz	SBVRZFAHHBLQLI-ZDUSSCGKSA-N	1	1	323.397	1.562	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1	ZINC000567796240	304243039	/nfs/dbraw/zinc/24/30/39/304243039.db2.gz	MDQJISUIVLKWBF-INWMFGNUSA-N	1	1	322.361	1.445	20	5		DDBDMO
CCc1[nH+]ccn1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000158327813	197262564	/nfs/dbraw/zinc/26/25/64/197262564.db2.gz	HKAXUSNNGMZJIS-UHFFFAOYSA-N	1	1	300.318	1.943	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)nc1	ZINC000274025819	285177607	/nfs/dbraw/zinc/17/76/07/285177607.db2.gz	WMZDQTWLXRGZIE-FZMZJTMJSA-N	1	1	303.366	1.838	20	5		DDBDMO
CNc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000568079227	304267141	/nfs/dbraw/zinc/26/71/41/304267141.db2.gz	KXTWETDKOPYWJZ-SWLSCSKDSA-N	1	1	318.377	1.803	20	5		DDBDMO
O=C(NCCC[C@H]1CCC[NH2+]1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000294798267	224228409	/nfs/dbraw/zinc/22/84/09/224228409.db2.gz	IDNUSMGRQWVROL-SNVBAGLBSA-N	1	1	317.349	1.733	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCC[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-]	ZINC000299516980	533665367	/nfs/dbraw/zinc/66/53/67/533665367.db2.gz	HZJMFCRGQQDFSE-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000068121399	406619018	/nfs/dbraw/zinc/61/90/18/406619018.db2.gz	YXKMTMHHGIWMSV-SNVBAGLBSA-N	1	1	324.356	1.920	20	5		DDBDMO
C[C@@H](NC(=O)CN1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000076410428	406967653	/nfs/dbraw/zinc/96/76/53/406967653.db2.gz	CARPVRNFORYGRH-GFCCVEGCSA-N	1	1	306.366	1.019	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1CN1CCOCC1	ZINC000075890421	406945808	/nfs/dbraw/zinc/94/58/08/406945808.db2.gz	HSFBBJLAPZRLPG-OAHLLOKOSA-N	1	1	305.378	1.891	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H]1CCCO1	ZINC000076298342	406962595	/nfs/dbraw/zinc/96/25/95/406962595.db2.gz	VTAZPNRMEIQSHW-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H]1CCCO1	ZINC000076298342	406962597	/nfs/dbraw/zinc/96/25/97/406962597.db2.gz	VTAZPNRMEIQSHW-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090550846	407170165	/nfs/dbraw/zinc/17/01/65/407170165.db2.gz	ZULAFDQXPPPVQS-CQSZACIVSA-N	1	1	322.409	1.563	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)c1	ZINC000057701191	407217003	/nfs/dbraw/zinc/21/70/03/407217003.db2.gz	QLMTWQWNYPKIAH-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)s1	ZINC000123364226	407327023	/nfs/dbraw/zinc/32/70/23/407327023.db2.gz	FPWFULCWLSGXHQ-UHFFFAOYSA-N	1	1	307.397	1.195	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000108339284	407384638	/nfs/dbraw/zinc/38/46/38/407384638.db2.gz	JKWZVHJSGZOIHU-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111320868	407407357	/nfs/dbraw/zinc/40/73/57/407407357.db2.gz	YTQCRTHCEWVJFY-HJIFLFLRSA-N	1	1	319.361	1.910	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111320868	407407358	/nfs/dbraw/zinc/40/73/58/407407358.db2.gz	YTQCRTHCEWVJFY-HJIFLFLRSA-N	1	1	319.361	1.910	20	5		DDBDMO
C[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000271035846	407481623	/nfs/dbraw/zinc/48/16/23/407481623.db2.gz	LQXBEDKCRNKPDB-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC(=O)N1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000178568715	407497029	/nfs/dbraw/zinc/49/70/29/407497029.db2.gz	OAWCYTWTJSHJBT-HNNXBMFYSA-N	1	1	307.350	1.182	20	5		DDBDMO
CC(=O)N1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000178568715	407497035	/nfs/dbraw/zinc/49/70/35/407497035.db2.gz	OAWCYTWTJSHJBT-HNNXBMFYSA-N	1	1	307.350	1.182	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]2C[C@H](O)c2ccco2)n1	ZINC000151792884	407498957	/nfs/dbraw/zinc/49/89/57/407498957.db2.gz	OGPODFUSTUFHKG-STQMWFEESA-N	1	1	320.349	1.972	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000185774987	407499872	/nfs/dbraw/zinc/49/98/72/407499872.db2.gz	AQKWFDRVPVZNHT-VHSXEESVSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000185774987	407499879	/nfs/dbraw/zinc/49/98/79/407499879.db2.gz	AQKWFDRVPVZNHT-VHSXEESVSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3CC[C@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000185774987	407499885	/nfs/dbraw/zinc/49/98/85/407499885.db2.gz	AQKWFDRVPVZNHT-VHSXEESVSA-N	1	1	307.354	1.189	20	5		DDBDMO
C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCN(C)CC1	ZINC000127716783	407457871	/nfs/dbraw/zinc/45/78/71/407457871.db2.gz	NRILAAWMYZHLJG-KGLIPLIRSA-N	1	1	306.410	1.881	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000270999650	407459931	/nfs/dbraw/zinc/45/99/31/407459931.db2.gz	YSKBSBUVENXMOG-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000270999650	407459934	/nfs/dbraw/zinc/45/99/34/407459934.db2.gz	YSKBSBUVENXMOG-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[C@H](C[NH3+])CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000261695189	407580256	/nfs/dbraw/zinc/58/02/56/407580256.db2.gz	IUGYHNRMWCWOSX-RKDXNWHRSA-N	1	1	303.322	1.280	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCOC1	ZINC000128579284	407550133	/nfs/dbraw/zinc/55/01/33/407550133.db2.gz	XRYLBFMZEALRGU-LLVKDONJSA-N	1	1	311.313	1.783	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000266709488	407608816	/nfs/dbraw/zinc/60/88/16/407608816.db2.gz	DFPSPAYLUUVTHR-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000266709488	407608822	/nfs/dbraw/zinc/60/88/22/407608822.db2.gz	DFPSPAYLUUVTHR-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[N@@H+]1CC=C(CNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000272228909	407824304	/nfs/dbraw/zinc/82/43/04/407824304.db2.gz	LRAYKUPEJXONKA-UHFFFAOYSA-N	1	1	311.363	1.135	20	5		DDBDMO
O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@H]1COCC[NH2+]1	ZINC000238022006	407872746	/nfs/dbraw/zinc/87/27/46/407872746.db2.gz	YITAXBAEUBBQAM-CQSZACIVSA-N	1	1	307.350	1.022	20	5		DDBDMO
CC(C)[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000175057967	408039116	/nfs/dbraw/zinc/03/91/16/408039116.db2.gz	XGKBHJJIZQPPQN-QWHCGFSZSA-N	1	1	321.381	1.265	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(N)=O)CC1	ZINC000175062382	408043761	/nfs/dbraw/zinc/04/37/61/408043761.db2.gz	LOKIPYRZSLYWPU-UHFFFAOYSA-N	1	1	307.350	1.691	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@@H](CO)C1	ZINC000245437638	407984528	/nfs/dbraw/zinc/98/45/28/407984528.db2.gz	RPDNBHCHDYGKQG-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@@H](CO)C1	ZINC000245437638	407984531	/nfs/dbraw/zinc/98/45/31/407984531.db2.gz	RPDNBHCHDYGKQG-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCc3ccccc3[C@@H]2CO)c1	ZINC000268457405	408052323	/nfs/dbraw/zinc/05/23/23/408052323.db2.gz	COVXKDMIHFKOPV-HNNXBMFYSA-N	1	1	302.334	1.383	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000189729033	408092424	/nfs/dbraw/zinc/09/24/24/408092424.db2.gz	XDLXHRCTTREPRC-ZDUSSCGKSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182220784	408098708	/nfs/dbraw/zinc/09/87/08/408098708.db2.gz	DQGXXAUHODJIDV-MJBXVCDLSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)CO	ZINC000190831611	408327533	/nfs/dbraw/zinc/32/75/33/408327533.db2.gz	AICUYZCJOPXMML-VHSXEESVSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)CO	ZINC000190831611	408327539	/nfs/dbraw/zinc/32/75/39/408327539.db2.gz	AICUYZCJOPXMML-VHSXEESVSA-N	1	1	302.758	1.812	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000246524874	408282616	/nfs/dbraw/zinc/28/26/16/408282616.db2.gz	WAWRXJKWWOFGMD-GHMZBOCLSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)(C)[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000131375857	162012947	/nfs/dbraw/zinc/01/29/47/162012947.db2.gz	HQRNVLJCKMHXRI-UHFFFAOYSA-N	1	1	309.366	1.950	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000164632622	162154123	/nfs/dbraw/zinc/15/41/23/162154123.db2.gz	OAUJIPWTAJYZCR-UHFFFAOYSA-N	1	1	323.397	1.665	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183221034	408358084	/nfs/dbraw/zinc/35/80/84/408358084.db2.gz	RSAYSIBWSYZCBR-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183221034	408358091	/nfs/dbraw/zinc/35/80/91/408358091.db2.gz	RSAYSIBWSYZCBR-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COC[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172886924	162308893	/nfs/dbraw/zinc/30/88/93/162308893.db2.gz	HGHIYGDBQXIEIG-CQSZACIVSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172886924	162308895	/nfs/dbraw/zinc/30/88/95/162308895.db2.gz	HGHIYGDBQXIEIG-CQSZACIVSA-N	1	1	323.349	1.271	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCC[N@H+](C(C)C)C1	ZINC000274427202	408402266	/nfs/dbraw/zinc/40/22/66/408402266.db2.gz	FIPJTARBIVLSKI-ZDUSSCGKSA-N	1	1	323.397	1.479	20	5		DDBDMO
C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(N)=O	ZINC000264220319	408409587	/nfs/dbraw/zinc/40/95/87/408409587.db2.gz	VOINKGSLPXCGDO-UHFFFAOYSA-N	1	1	304.306	1.209	20	5		DDBDMO
C[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(N)=O	ZINC000264220319	408409592	/nfs/dbraw/zinc/40/95/92/408409592.db2.gz	VOINKGSLPXCGDO-UHFFFAOYSA-N	1	1	304.306	1.209	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000274543559	408444553	/nfs/dbraw/zinc/44/45/53/408444553.db2.gz	UUUKGIOXRAHXEU-HZMBPMFUSA-N	1	1	306.366	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cccc(O)c3)CC2)n1	ZINC000177023299	408499967	/nfs/dbraw/zinc/49/99/67/408499967.db2.gz	VISOIEWJFFAISV-UHFFFAOYSA-N	1	1	317.349	1.319	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)[C@H](C)C1	ZINC000176868047	408462851	/nfs/dbraw/zinc/46/28/51/408462851.db2.gz	PJIQFBCQLYHMJI-DGCLKSJQSA-N	1	1	320.393	1.979	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000177445643	408620653	/nfs/dbraw/zinc/62/06/53/408620653.db2.gz	AQOGHTZVQQJTKV-OAHLLOKOSA-N	1	1	308.334	1.988	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@H](C)C1	ZINC000248842120	408646824	/nfs/dbraw/zinc/64/68/24/408646824.db2.gz	RBOHAOCLEWAHQY-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C[C@H](C)O)[C@H](C)C1	ZINC000248842120	408646828	/nfs/dbraw/zinc/64/68/28/408646828.db2.gz	RBOHAOCLEWAHQY-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000192792413	408649903	/nfs/dbraw/zinc/64/99/03/408649903.db2.gz	YKVWBMOXBAESOJ-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000192792413	408649907	/nfs/dbraw/zinc/64/99/07/408649907.db2.gz	YKVWBMOXBAESOJ-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000192792413	408649911	/nfs/dbraw/zinc/64/99/11/408649911.db2.gz	YKVWBMOXBAESOJ-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162634682	408721441	/nfs/dbraw/zinc/72/14/41/408721441.db2.gz	XKDLGVXEIWZEKE-ZDUSSCGKSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162634682	408721448	/nfs/dbraw/zinc/72/14/48/408721448.db2.gz	XKDLGVXEIWZEKE-ZDUSSCGKSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000193021627	408684303	/nfs/dbraw/zinc/68/43/03/408684303.db2.gz	HVGSUDQNMQLZCE-LLVKDONJSA-N	1	1	304.350	1.512	20	5		DDBDMO
COC(=O)c1ccc(OC[C@H](O)C[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000290798887	408834636	/nfs/dbraw/zinc/83/46/36/408834636.db2.gz	PIGADPSQTIYVMJ-GFCCVEGCSA-N	1	1	324.333	1.215	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1	ZINC000276775818	408896068	/nfs/dbraw/zinc/89/60/68/408896068.db2.gz	NTCYXVDWVMFVRH-NEPJUHHUSA-N	1	1	320.349	1.449	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1	ZINC000292053773	408970585	/nfs/dbraw/zinc/97/05/85/408970585.db2.gz	AEOWKPKPEGDIFX-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)CC1(C)C	ZINC000277617911	408978780	/nfs/dbraw/zinc/97/87/80/408978780.db2.gz	QRWDVXASWUBWDT-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)CC1(C)C	ZINC000277617911	408978783	/nfs/dbraw/zinc/97/87/83/408978783.db2.gz	QRWDVXASWUBWDT-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000286412625	408980718	/nfs/dbraw/zinc/98/07/18/408980718.db2.gz	AUYSGCATKYGCIS-VIFPVBQESA-N	1	1	323.378	1.732	20	5		DDBDMO
C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000292292620	409018284	/nfs/dbraw/zinc/01/82/84/409018284.db2.gz	UJHFWJWFSCCEAL-CYBMUJFWSA-N	1	1	313.379	1.061	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000292292620	409018287	/nfs/dbraw/zinc/01/82/87/409018287.db2.gz	UJHFWJWFSCCEAL-CYBMUJFWSA-N	1	1	313.379	1.061	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@]3(CNC(=O)C3)C2)c([N+](=O)[O-])cc1F	ZINC000278969879	409123245	/nfs/dbraw/zinc/12/32/45/409123245.db2.gz	XRPVPWNWNKDLAE-OAHLLOKOSA-N	1	1	323.324	1.455	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@]3(CNC(=O)C3)C2)c([N+](=O)[O-])cc1F	ZINC000278969879	409123246	/nfs/dbraw/zinc/12/32/46/409123246.db2.gz	XRPVPWNWNKDLAE-OAHLLOKOSA-N	1	1	323.324	1.455	20	5		DDBDMO
O=c1nc([C@H]2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)[nH][nH]1	ZINC000289167308	409227093	/nfs/dbraw/zinc/22/70/93/409227093.db2.gz	FAWVWDBCVHEWGH-NSHDSACASA-N	1	1	303.322	1.386	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC(C)(C)CO	ZINC000295164058	409351039	/nfs/dbraw/zinc/35/10/39/409351039.db2.gz	FRTXTPVWMKNYMN-CYBMUJFWSA-N	1	1	312.366	1.285	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3nccc(C(N)=O)c3[N+](=O)[O-])CC[C@@H]21	ZINC000290497372	409424656	/nfs/dbraw/zinc/42/46/56/409424656.db2.gz	ALVTTYSONHAHAQ-JQWIXIFHSA-N	1	1	319.365	1.009	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280750019	409437079	/nfs/dbraw/zinc/43/70/79/409437079.db2.gz	NFEPVVZUZCMBAC-MEBBXXQBSA-N	1	1	320.349	1.119	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CCC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717249	409641495	/nfs/dbraw/zinc/64/14/95/409641495.db2.gz	NLQOMXZSKVCMJJ-IUODEOHRSA-N	1	1	319.361	1.404	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717249	409641503	/nfs/dbraw/zinc/64/15/03/409641503.db2.gz	NLQOMXZSKVCMJJ-IUODEOHRSA-N	1	1	319.361	1.404	20	5		DDBDMO
C[C@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000342437225	409629636	/nfs/dbraw/zinc/62/96/36/409629636.db2.gz	OBCHWSIXNNKURJ-UFBFGSQYSA-N	1	1	302.327	1.257	20	5		DDBDMO
CCN(CC[NH+]1CCCCCC1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000331602539	409682608	/nfs/dbraw/zinc/68/26/08/409682608.db2.gz	ZGGKEVZRDXFSIB-UHFFFAOYSA-N	1	1	323.397	1.964	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(=O)n1Cc1[nH+]ccn1CC(F)(F)F	ZINC000349251207	409763631	/nfs/dbraw/zinc/76/36/31/409763631.db2.gz	IRLISKNIBNSQIO-UHFFFAOYSA-N	1	1	316.239	1.872	20	5		DDBDMO
Cc1nnc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH]1	ZINC000349372598	409813238	/nfs/dbraw/zinc/81/32/38/409813238.db2.gz	MWBFIJVSYGSFIE-NSHDSACASA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1n[nH]c([C@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000349372598	409813246	/nfs/dbraw/zinc/81/32/46/409813246.db2.gz	MWBFIJVSYGSFIE-NSHDSACASA-N	1	1	305.342	1.097	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000332245574	410010988	/nfs/dbraw/zinc/01/09/88/410010988.db2.gz	APVRWNNOKCWLFY-GFCCVEGCSA-N	1	1	316.361	1.712	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000332245574	410011011	/nfs/dbraw/zinc/01/10/11/410011011.db2.gz	APVRWNNOKCWLFY-GFCCVEGCSA-N	1	1	316.361	1.712	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357513645	410078699	/nfs/dbraw/zinc/07/86/99/410078699.db2.gz	NPRREUVXTCNYLQ-RKDXNWHRSA-N	1	1	305.338	1.126	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1C	ZINC000346691744	410085706	/nfs/dbraw/zinc/08/57/06/410085706.db2.gz	WAZSXXSPSZRMFJ-SKDRFNHKSA-N	1	1	321.333	1.077	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000346759155	410136673	/nfs/dbraw/zinc/13/66/73/410136673.db2.gz	APHFVAVIVLZCLM-RYUDHWBXSA-N	1	1	323.397	1.468	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000357637911	410154010	/nfs/dbraw/zinc/15/40/10/410154010.db2.gz	TWWQRDRUYBYKSI-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
CC[N@@H+]1CC[C@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000339393611	410154409	/nfs/dbraw/zinc/15/44/09/410154409.db2.gz	KQKNBXFHDKXJQD-HZPDHXFCSA-N	1	1	321.377	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000339393611	410154414	/nfs/dbraw/zinc/15/44/14/410154414.db2.gz	KQKNBXFHDKXJQD-HZPDHXFCSA-N	1	1	321.377	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000339399025	410161181	/nfs/dbraw/zinc/16/11/81/410161181.db2.gz	YNBATDFBURBILB-CVEARBPZSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000332695033	410218679	/nfs/dbraw/zinc/21/86/79/410218679.db2.gz	RJERJTBNEAAPTB-MWLCHTKSSA-N	1	1	321.333	1.536	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000343273047	410299134	/nfs/dbraw/zinc/29/91/34/410299134.db2.gz	QTMKWJIMSCIMNO-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000343273047	410299139	/nfs/dbraw/zinc/29/91/39/410299139.db2.gz	QTMKWJIMSCIMNO-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCSC[C@H]2CCO)cc1	ZINC000347365394	410498559	/nfs/dbraw/zinc/49/85/59/410498559.db2.gz	HHYXYJZJVPNADN-CYBMUJFWSA-N	1	1	312.391	1.773	20	5		DDBDMO
COC1CC([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000352186084	410531499	/nfs/dbraw/zinc/53/14/99/410531499.db2.gz	IZCXENQETKNLFQ-UHFFFAOYSA-N	1	1	319.361	1.593	20	5		DDBDMO
COC1CC([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000352186084	410531503	/nfs/dbraw/zinc/53/15/03/410531503.db2.gz	IZCXENQETKNLFQ-UHFFFAOYSA-N	1	1	319.361	1.593	20	5		DDBDMO
CCCCNC(=O)[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355555876	410576507	/nfs/dbraw/zinc/57/65/07/410576507.db2.gz	PWPSJCFUDVJHJQ-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355555876	410576516	/nfs/dbraw/zinc/57/65/16/410576516.db2.gz	PWPSJCFUDVJHJQ-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000299361174	410588828	/nfs/dbraw/zinc/58/88/28/410588828.db2.gz	SAMFNEJFGYIETR-UHFFFAOYSA-N	1	1	324.356	1.382	20	5		DDBDMO
CCNC(=O)C[N@H+]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000299361174	410588834	/nfs/dbraw/zinc/58/88/34/410588834.db2.gz	SAMFNEJFGYIETR-UHFFFAOYSA-N	1	1	324.356	1.382	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCCOC1	ZINC000352201992	410544734	/nfs/dbraw/zinc/54/47/34/410544734.db2.gz	HSARQZSPIRCPLU-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCCOC1	ZINC000352201992	410544741	/nfs/dbraw/zinc/54/47/41/410544741.db2.gz	HSARQZSPIRCPLU-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@@H+](C[C@H](C)O)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000352202910	410545133	/nfs/dbraw/zinc/54/51/33/410545133.db2.gz	NLQALLCWHRECLO-JQWIXIFHSA-N	1	1	309.366	1.933	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000343598127	410561497	/nfs/dbraw/zinc/56/14/97/410561497.db2.gz	ICBHVSLZYMAEPS-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000340088160	410667178	/nfs/dbraw/zinc/66/71/78/410667178.db2.gz	IOHJJXLZKQLDTC-ZDUSSCGKSA-N	1	1	318.377	1.673	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000330408754	410673374	/nfs/dbraw/zinc/67/33/74/410673374.db2.gz	PRTKXHVSXRNDAN-UHFFFAOYSA-N	1	1	324.381	1.353	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cn1	ZINC000347801332	410726514	/nfs/dbraw/zinc/72/65/14/410726514.db2.gz	TXDYLGCVYHYBJB-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1ccc(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cn1	ZINC000347801332	410726521	/nfs/dbraw/zinc/72/65/21/410726521.db2.gz	TXDYLGCVYHYBJB-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]2[C@@H](O)C(F)(F)F)c1	ZINC000340207725	410754275	/nfs/dbraw/zinc/75/42/75/410754275.db2.gz	YXGUXKLVGJFNPS-GHMZBOCLSA-N	1	1	322.287	1.569	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2[C@@H](O)C(F)(F)F)c1	ZINC000340207725	410754280	/nfs/dbraw/zinc/75/42/80/410754280.db2.gz	YXGUXKLVGJFNPS-GHMZBOCLSA-N	1	1	322.287	1.569	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330579869	410794947	/nfs/dbraw/zinc/79/49/47/410794947.db2.gz	IHOMCXCZHJJCMT-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1OCC[NH2+][C@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000343921696	410811284	/nfs/dbraw/zinc/81/12/84/410811284.db2.gz	VFKPXCAFZKVMBN-SWLSCSKDSA-N	1	1	321.377	1.411	20	5		DDBDMO
CCc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@@H]3C2)c1[N+](=O)[O-]	ZINC000301917197	410830239	/nfs/dbraw/zinc/83/02/39/410830239.db2.gz	ANWRBMXTBASLGS-SCRDCRAPSA-N	1	1	319.409	1.811	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000330660863	410856215	/nfs/dbraw/zinc/85/62/15/410856215.db2.gz	BVJXSTVEQRILKA-SNVBAGLBSA-N	1	1	321.333	1.158	20	5		DDBDMO
COC(=O)c1cc(C(=O)N2CC[N@@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000330660863	410856220	/nfs/dbraw/zinc/85/62/20/410856220.db2.gz	BVJXSTVEQRILKA-SNVBAGLBSA-N	1	1	321.333	1.158	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330664463	410860926	/nfs/dbraw/zinc/86/09/26/410860926.db2.gz	GEMMXANVHNQHQW-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330664463	410860932	/nfs/dbraw/zinc/86/09/32/410860932.db2.gz	GEMMXANVHNQHQW-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356150762	410862815	/nfs/dbraw/zinc/86/28/15/410862815.db2.gz	PGIOBODAWGKLCG-TXEJJXNPSA-N	1	1	323.397	1.426	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356150092	410864561	/nfs/dbraw/zinc/86/45/61/410864561.db2.gz	HSPBMPYURKVEER-LLVKDONJSA-N	1	1	309.370	1.323	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344038838	410912450	/nfs/dbraw/zinc/91/24/50/410912450.db2.gz	GKCPKLRRRBTWPL-NJZAAPMLSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344038838	410912456	/nfs/dbraw/zinc/91/24/56/410912456.db2.gz	GKCPKLRRRBTWPL-NJZAAPMLSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cn1nccc1C[N@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000348368871	410938054	/nfs/dbraw/zinc/93/80/54/410938054.db2.gz	KLWHFGVICXGMKG-ZDUSSCGKSA-N	1	1	320.349	1.200	20	5		DDBDMO
Cn1nccc1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000348368871	410938059	/nfs/dbraw/zinc/93/80/59/410938059.db2.gz	KLWHFGVICXGMKG-ZDUSSCGKSA-N	1	1	320.349	1.200	20	5		DDBDMO
CC(=O)NC1CCC([N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000344051448	410923395	/nfs/dbraw/zinc/92/33/95/410923395.db2.gz	ANOPKLJAQOTIDU-UHFFFAOYSA-N	1	1	309.370	1.207	20	5		DDBDMO
CC(=O)NC1CCC([N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000344051448	410923399	/nfs/dbraw/zinc/92/33/99/410923399.db2.gz	ANOPKLJAQOTIDU-UHFFFAOYSA-N	1	1	309.370	1.207	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331250740	411041600	/nfs/dbraw/zinc/04/16/00/411041600.db2.gz	ZYWNFEGAXGSVJG-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000331250740	411041603	/nfs/dbraw/zinc/04/16/03/411041603.db2.gz	ZYWNFEGAXGSVJG-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331250740	411041607	/nfs/dbraw/zinc/04/16/07/411041607.db2.gz	ZYWNFEGAXGSVJG-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331430501	411086732	/nfs/dbraw/zinc/08/67/32/411086732.db2.gz	CDGQKCSYECETFG-GXFFZTMASA-N	1	1	319.361	1.816	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000353687821	411109554	/nfs/dbraw/zinc/10/95/54/411109554.db2.gz	JPTNSWVDTFBVLF-UHFFFAOYSA-N	1	1	304.306	1.295	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000130782267	196109225	/nfs/dbraw/zinc/10/92/25/196109225.db2.gz	KHZHTBNXSASBIW-NSHDSACASA-N	1	1	304.350	1.808	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000296665999	226104524	/nfs/dbraw/zinc/10/45/24/226104524.db2.gz	KJOKVXOJRGIMRP-HOCLYGCPSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H]1C[C@]2(CCO1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000374018911	418483874	/nfs/dbraw/zinc/48/38/74/418483874.db2.gz	QCDWTCAAEFIBHI-UMVBOHGHSA-N	1	1	324.381	1.450	20	5		DDBDMO
C[C@@H]1C[C@]2(CCO1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000374018911	418483876	/nfs/dbraw/zinc/48/38/76/418483876.db2.gz	QCDWTCAAEFIBHI-UMVBOHGHSA-N	1	1	324.381	1.450	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3ccco3)C2)c1	ZINC000374139250	418493766	/nfs/dbraw/zinc/49/37/66/418493766.db2.gz	ABKDLWAHKNDYTF-DGCLKSJQSA-N	1	1	306.322	1.235	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)n1	ZINC000191678724	222107296	/nfs/dbraw/zinc/10/72/96/222107296.db2.gz	WECAAVLCWGPBQZ-NWDGAFQWSA-N	1	1	321.381	1.368	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@@H]1CO	ZINC000190378186	222076964	/nfs/dbraw/zinc/07/69/64/222076964.db2.gz	HFPRSXBPTVQTSU-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]21	ZINC000375015956	418588133	/nfs/dbraw/zinc/58/81/33/418588133.db2.gz	DHABDNAWXQEBJG-XHDPSFHLSA-N	1	1	318.377	1.220	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]21	ZINC000375052762	418596005	/nfs/dbraw/zinc/59/60/05/418596005.db2.gz	ZLZVUUFUZYGOEC-QMTHXVAHSA-N	1	1	304.350	1.224	20	5		DDBDMO
Cc1ccc(C[N@H+](CCO)CCn2cc([N+](=O)[O-])ccc2=O)o1	ZINC000361520407	418669196	/nfs/dbraw/zinc/66/91/96/418669196.db2.gz	UCDTZIVXPMKNRL-UHFFFAOYSA-N	1	1	321.333	1.152	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCO)CCn2cc([N+](=O)[O-])ccc2=O)o1	ZINC000361520407	418669198	/nfs/dbraw/zinc/66/91/98/418669198.db2.gz	UCDTZIVXPMKNRL-UHFFFAOYSA-N	1	1	321.333	1.152	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@@H+](CCO)CCOc1ccccc1[N+](=O)[O-]	ZINC000361586780	418688128	/nfs/dbraw/zinc/68/81/28/418688128.db2.gz	UJOCKURRZLRCRE-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
COCCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000372014015	418831397	/nfs/dbraw/zinc/83/13/97/418831397.db2.gz	SUCDDWSFVDLVSF-UHFFFAOYSA-N	1	1	322.365	1.174	20	5		DDBDMO
O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)NCC1CCC1	ZINC000365520636	418870967	/nfs/dbraw/zinc/87/09/67/418870967.db2.gz	YINZSIXFRPKCSC-UHFFFAOYSA-N	1	1	321.381	1.345	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000411567113	419346716	/nfs/dbraw/zinc/34/67/16/419346716.db2.gz	IUQOTEKZTCMPIP-CYBMUJFWSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)C1COC1	ZINC000411775664	419404645	/nfs/dbraw/zinc/40/46/45/419404645.db2.gz	SKJSXZQXVTWXIV-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@H]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000426220769	419411763	/nfs/dbraw/zinc/41/17/63/419411763.db2.gz	SZQQOKRWRSKUSJ-CYBMUJFWSA-N	1	1	307.350	1.404	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C[C@H]2C[C@@H](O)C2)CC1	ZINC000420940693	419368494	/nfs/dbraw/zinc/36/84/94/419368494.db2.gz	RQYVTNBVQVNOGX-JNSHFYNHSA-N	1	1	319.361	1.124	20	5		DDBDMO
COC(=O)[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411915477	419484288	/nfs/dbraw/zinc/48/42/88/419484288.db2.gz	ZHEDROKJBCKGPO-CYBMUJFWSA-N	1	1	307.350	1.131	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1CCO	ZINC000426272487	419425689	/nfs/dbraw/zinc/42/56/89/419425689.db2.gz	XJIPQPBTBYZEDS-NSHDSACASA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1CCO	ZINC000426272487	419425696	/nfs/dbraw/zinc/42/56/96/419425696.db2.gz	XJIPQPBTBYZEDS-NSHDSACASA-N	1	1	323.349	1.389	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000426799643	419550300	/nfs/dbraw/zinc/55/03/00/419550300.db2.gz	LPHPESPCPLEAQY-LBPRGKRZSA-N	1	1	308.382	1.852	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000412039220	419582105	/nfs/dbraw/zinc/58/21/05/419582105.db2.gz	JHBLFBMSSKEWGM-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000412039220	419582115	/nfs/dbraw/zinc/58/21/15/419582115.db2.gz	JHBLFBMSSKEWGM-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](CO)[C@H]1C	ZINC000412067518	419616985	/nfs/dbraw/zinc/61/69/85/419616985.db2.gz	DTNIRYVEFAANPZ-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](CO)[C@H]1C	ZINC000412067518	419616994	/nfs/dbraw/zinc/61/69/94/419616994.db2.gz	DTNIRYVEFAANPZ-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
COC(=O)[C@@H]1CSCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000412088474	419644463	/nfs/dbraw/zinc/64/44/63/419644463.db2.gz	WSENGSQXTKWRBH-LBPRGKRZSA-N	1	1	310.375	1.933	20	5		DDBDMO
CC(C)Oc1cc(C(=O)NCC[NH+]2CCC2)ccc1[N+](=O)[O-]	ZINC000412213927	419725131	/nfs/dbraw/zinc/72/51/31/419725131.db2.gz	XIBXLQRFVXIQNE-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000427968833	419778534	/nfs/dbraw/zinc/77/85/34/419778534.db2.gz	VHDAEBSRGVCDHV-FZMZJTMJSA-N	1	1	319.361	1.514	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(N)=O	ZINC000429143336	419975054	/nfs/dbraw/zinc/97/50/54/419975054.db2.gz	OYFDZDUHOSQZIN-UHFFFAOYSA-N	1	1	322.365	1.429	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@H]([NH3+])C1CC1	ZINC000423317284	420012268	/nfs/dbraw/zinc/01/22/68/420012268.db2.gz	KGMTZPDVIJGKJM-HZMBPMFUSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H](N)C1CC1	ZINC000423317284	420012272	/nfs/dbraw/zinc/01/22/72/420012272.db2.gz	KGMTZPDVIJGKJM-HZMBPMFUSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000430968963	420227792	/nfs/dbraw/zinc/22/77/92/420227792.db2.gz	ZVFKQJNQPJGQIG-CYBMUJFWSA-N	1	1	320.393	1.773	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000420741558	420374614	/nfs/dbraw/zinc/37/46/14/420374614.db2.gz	STYGWEXVPBHEDW-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H](n2ccnn2)C1	ZINC000425505705	420403527	/nfs/dbraw/zinc/40/35/27/420403527.db2.gz	YWKLQIDLLTXKEO-ZDUSSCGKSA-N	1	1	317.349	1.902	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)Nc1cccc([N+](=O)[O-])c1	ZINC000454150248	420807281	/nfs/dbraw/zinc/80/72/81/420807281.db2.gz	QJVRXOKNIPOJBV-CQSZACIVSA-N	1	1	322.365	1.563	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1)C(=O)OC(C)(C)C	ZINC000459803599	420878118	/nfs/dbraw/zinc/87/81/18/420878118.db2.gz	JYQDBDVVDOSTBT-NSHDSACASA-N	1	1	312.370	1.701	20	5		DDBDMO
CO[C@@H]1COC[C@@H]1[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000459836702	420889259	/nfs/dbraw/zinc/88/92/59/420889259.db2.gz	ZNFCFRXEXCGENW-SCDSUCTJSA-N	1	1	323.349	1.234	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000455769098	421060139	/nfs/dbraw/zinc/06/01/39/421060139.db2.gz	YUSJAPJMERAGML-NXEZZACHSA-N	1	1	307.354	1.244	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000523285001	421233273	/nfs/dbraw/zinc/23/32/73/421233273.db2.gz	PULOYRUZHBJPOQ-LBPRGKRZSA-N	1	1	323.397	1.373	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000525293088	421287627	/nfs/dbraw/zinc/28/76/27/421287627.db2.gz	WHMPMZQFESVUTB-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000531634631	421641157	/nfs/dbraw/zinc/64/11/57/421641157.db2.gz	BSILMQBNOYCVHL-RISCZKNCSA-N	1	1	306.366	1.792	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000531634750	421642089	/nfs/dbraw/zinc/64/20/89/421642089.db2.gz	JOTPWECCMASVLG-NWDGAFQWSA-N	1	1	306.366	1.935	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000572672816	421810827	/nfs/dbraw/zinc/81/08/27/421810827.db2.gz	NKAVBRHCTMFOMV-HNNXBMFYSA-N	1	1	304.350	1.548	20	5		DDBDMO
O=C1C[C@@H]([N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960200	421874987	/nfs/dbraw/zinc/87/49/87/421874987.db2.gz	HCNHCLOGAZDERY-WCQYABFASA-N	1	1	303.318	1.189	20	5		DDBDMO
O=C1C[C@@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960200	421874992	/nfs/dbraw/zinc/87/49/92/421874992.db2.gz	HCNHCLOGAZDERY-WCQYABFASA-N	1	1	303.318	1.189	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1	ZINC000587415713	422313836	/nfs/dbraw/zinc/31/38/36/422313836.db2.gz	CXVPGNLHSLTFFC-SNVBAGLBSA-N	1	1	317.349	2.140	20	5		DDBDMO
Nc1ccc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)nc1[N+](=O)[O-]	ZINC000596569632	422380821	/nfs/dbraw/zinc/38/08/21/422380821.db2.gz	ALUCPJIEJRPVRY-GFCCVEGCSA-N	1	1	305.382	2.106	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC[N@H+](C2CCC2)C1	ZINC000344732966	272103961	/nfs/dbraw/zinc/10/39/61/272103961.db2.gz	ULVQEXCAVYWYKK-LLVKDONJSA-N	1	1	321.381	1.275	20	5		DDBDMO
CCOc1cccc(N2CC[NH+](C[C@H](C)O)CC2)c1[N+](=O)[O-]	ZINC000274982844	273709179	/nfs/dbraw/zinc/70/91/79/273709179.db2.gz	BVMQYWZSQWREEP-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1	ZINC000450780244	274004709	/nfs/dbraw/zinc/00/47/09/274004709.db2.gz	PVVFIYBQCVVQKV-SMDDNHRTSA-N	1	1	305.334	1.522	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CCC[N@H+](CCO)CC2)c1	ZINC000450319525	275038637	/nfs/dbraw/zinc/03/86/37/275038637.db2.gz	ZAOGTPNAOBLWTO-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3csc([N+](=O)[O-])c3)[C@H]2C1	ZINC000339396123	276220873	/nfs/dbraw/zinc/22/08/73/276220873.db2.gz	TWECKCWIRXRMQP-STQMWFEESA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932450	281029892	/nfs/dbraw/zinc/02/98/92/281029892.db2.gz	JHGMMIAMAZEULC-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932450	281029894	/nfs/dbraw/zinc/02/98/94/281029894.db2.gz	JHGMMIAMAZEULC-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932453	281030040	/nfs/dbraw/zinc/03/00/40/281030040.db2.gz	JHGMMIAMAZEULC-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000089932453	281030041	/nfs/dbraw/zinc/03/00/41/281030041.db2.gz	JHGMMIAMAZEULC-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc(CO)o3)C2)nc1	ZINC000093534484	281042727	/nfs/dbraw/zinc/04/27/27/281042727.db2.gz	NAVCLDYHJCGNIY-NSHDSACASA-N	1	1	318.333	1.762	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290732632	290175403	/nfs/dbraw/zinc/17/54/03/290175403.db2.gz	GCQVBDUUNXUHKH-CMPLNLGQSA-N	1	1	319.365	1.009	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000362287588	300044373	/nfs/dbraw/zinc/04/43/73/300044373.db2.gz	OKAYVEIMXGJVHB-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)Nc1cccc([N+](=O)[O-])c1	ZINC000363094695	300209362	/nfs/dbraw/zinc/20/93/62/300209362.db2.gz	HJUNASPVYGGADS-UONOGXRCSA-N	1	1	320.349	1.580	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000363435614	300266746	/nfs/dbraw/zinc/26/67/46/300266746.db2.gz	VQBRZRMAKXNHAG-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCCOC2)O1	ZINC000369535744	301195995	/nfs/dbraw/zinc/19/59/95/301195995.db2.gz	CDAZQCPDSRIJDA-ZFWWWQNUSA-N	1	1	324.381	1.451	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC[C@H]21	ZINC000369981750	301251345	/nfs/dbraw/zinc/25/13/45/301251345.db2.gz	CYMBKKKSLFGHQJ-ZWNOBZJWSA-N	1	1	319.365	1.128	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000377632357	302201102	/nfs/dbraw/zinc/20/11/02/302201102.db2.gz	UWTUBQCEGDRUMB-GHMZBOCLSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000377632357	302201104	/nfs/dbraw/zinc/20/11/04/302201104.db2.gz	UWTUBQCEGDRUMB-GHMZBOCLSA-N	1	1	309.753	1.816	20	5		DDBDMO
CN(C(=O)C[NH+]1CCC2(CCO2)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000367106224	307086069	/nfs/dbraw/zinc/08/60/69/307086069.db2.gz	IAEZEKAKUDASSX-UHFFFAOYSA-N	1	1	319.361	1.813	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000373813344	307195727	/nfs/dbraw/zinc/19/57/27/307195727.db2.gz	SXVINOZPVPJYNI-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000373813344	307195728	/nfs/dbraw/zinc/19/57/28/307195728.db2.gz	SXVINOZPVPJYNI-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373938682	307198221	/nfs/dbraw/zinc/19/82/21/307198221.db2.gz	OGZYIQHHQBBERN-QWHCGFSZSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C1CC2(CN1)CC[NH+](Cc1cc(F)ccc1[N+](=O)[O-])CC2	ZINC000374077930	307202826	/nfs/dbraw/zinc/20/28/26/307202826.db2.gz	HQQZBPZGKFWXBT-UHFFFAOYSA-N	1	1	307.325	1.836	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000375203073	307218504	/nfs/dbraw/zinc/21/85/04/307218504.db2.gz	TXFDLFCQQUYIMF-UHFFFAOYSA-N	1	1	321.381	1.337	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)C[C@@H]21	ZINC000376662929	307252455	/nfs/dbraw/zinc/25/24/55/307252455.db2.gz	DANQRIJTORCLAL-MFKMUULPSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[N@H+](C)C[C@H]21	ZINC000378489998	307289504	/nfs/dbraw/zinc/28/95/04/307289504.db2.gz	CEJKPQKVTXHWNH-BXUZGUMPSA-N	1	1	304.350	1.464	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1ccccc1[N+](=O)[O-])CC2	ZINC000582742794	337128316	/nfs/dbraw/zinc/12/83/16/337128316.db2.gz	MZEITVOIWYWCHF-ZDUSSCGKSA-N	1	1	314.345	1.979	20	5		DDBDMO
CC(C)OC[C@@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000493796298	484239559	/nfs/dbraw/zinc/23/95/59/484239559.db2.gz	OTSKTBCHCUMZAA-JSGCOSHPSA-N	1	1	324.381	1.262	20	5		DDBDMO
CCC[C@@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)CC[N@H+]1CCOC	ZINC000297400121	527789422	/nfs/dbraw/zinc/78/94/22/527789422.db2.gz	FSYMEAUFNUHXDP-CYBMUJFWSA-N	1	1	323.397	1.630	20	5		DDBDMO
CCOC(=O)[C@@H]1NCC[C@@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000423017457	527902248	/nfs/dbraw/zinc/90/22/48/527902248.db2.gz	ORDBLJNXCCSDEL-VHRBIJSZSA-N	1	1	307.350	1.539	20	5		DDBDMO
CC(C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[NH+]1CCOCC1	ZINC000330427708	528461881	/nfs/dbraw/zinc/46/18/81/528461881.db2.gz	GFVVLWWOPGMIND-CYBMUJFWSA-N	1	1	324.381	1.020	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccc(C(N)=O)c1	ZINC000747959451	700093326	/nfs/dbraw/zinc/09/33/26/700093326.db2.gz	PENHVFZKKZEDSV-UHFFFAOYSA-N	1	1	303.322	1.022	20	5		DDBDMO
C[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCOC1	ZINC000106857505	696628161	/nfs/dbraw/zinc/62/81/61/696628161.db2.gz	AJDQAEOUNXVCRK-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
C[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCOC1	ZINC000106857505	696628163	/nfs/dbraw/zinc/62/81/63/696628163.db2.gz	AJDQAEOUNXVCRK-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000153920812	696923958	/nfs/dbraw/zinc/92/39/58/696923958.db2.gz	WOEMMHMHEKODFY-ABAIWWIYSA-N	1	1	322.361	1.902	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc[nH+]1	ZINC000748511944	700122997	/nfs/dbraw/zinc/12/29/97/700122997.db2.gz	UOTDCQUHFZQKBK-UHFFFAOYSA-N	1	1	301.306	1.890	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000178776622	697428753	/nfs/dbraw/zinc/42/87/53/697428753.db2.gz	ZGKDOSZCIDNMLF-LBPRGKRZSA-N	1	1	318.333	1.930	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000178776622	697428755	/nfs/dbraw/zinc/42/87/55/697428755.db2.gz	ZGKDOSZCIDNMLF-LBPRGKRZSA-N	1	1	318.333	1.930	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000780868833	698566521	/nfs/dbraw/zinc/56/65/21/698566521.db2.gz	ZNGIGURVMPBJPD-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])ccc2N)[nH+]1	ZINC000787070092	699188716	/nfs/dbraw/zinc/18/87/16/699188716.db2.gz	DYZSVNQNSQTLHT-UHFFFAOYSA-N	1	1	315.333	1.722	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@H]1C	ZINC000787187632	699194910	/nfs/dbraw/zinc/19/49/10/699194910.db2.gz	TUFJOXFXHPPYAT-MNOVXSKESA-N	1	1	306.366	1.732	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1C	ZINC000787326595	699206342	/nfs/dbraw/zinc/20/63/42/699206342.db2.gz	IMCGWWXDCBCSOX-ZLKJLUDKSA-N	1	1	308.334	1.512	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000731018846	699520899	/nfs/dbraw/zinc/52/08/99/699520899.db2.gz	AWBWQIJAQSWFAQ-LBPRGKRZSA-N	1	1	304.350	1.391	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C[C@@H]21	ZINC000794971406	699838816	/nfs/dbraw/zinc/83/88/16/699838816.db2.gz	ILLBDICMMFUZKS-YABSGUDNSA-N	1	1	306.318	1.454	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C[C@@H]21	ZINC000794971406	699838818	/nfs/dbraw/zinc/83/88/18/699838818.db2.gz	ILLBDICMMFUZKS-YABSGUDNSA-N	1	1	306.318	1.454	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000796556226	699938664	/nfs/dbraw/zinc/93/86/64/699938664.db2.gz	ODHIYUYCDFVFIL-UHOFOFEASA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@]2(CCOC2)O1	ZINC000796556226	699938665	/nfs/dbraw/zinc/93/86/65/699938665.db2.gz	ODHIYUYCDFVFIL-UHOFOFEASA-N	1	1	322.361	1.508	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000801994005	700362516	/nfs/dbraw/zinc/36/25/16/700362516.db2.gz	VMODWNSIPHPMNJ-HNNXBMFYSA-N	1	1	312.366	1.348	20	5		DDBDMO
C[N@@H+](C1CCCC1)C(C)(C)C(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC000754873326	700535254	/nfs/dbraw/zinc/53/52/54/700535254.db2.gz	OIFNRVFIAXIOKI-UHFFFAOYSA-N	1	1	324.381	1.988	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C[C@H]1C	ZINC000755939930	700594095	/nfs/dbraw/zinc/59/40/95/700594095.db2.gz	ZRBKKJDDRRTWMG-ZWNOBZJWSA-N	1	1	318.333	1.643	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000758115699	700684602	/nfs/dbraw/zinc/68/46/02/700684602.db2.gz	ZEMUPSCUCATABD-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
C[C@@H]1COCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000769455706	701245494	/nfs/dbraw/zinc/24/54/94/701245494.db2.gz	JGOJHZGUOCIRIB-NSHDSACASA-N	1	1	308.334	1.834	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000769455706	701245495	/nfs/dbraw/zinc/24/54/95/701245495.db2.gz	JGOJHZGUOCIRIB-NSHDSACASA-N	1	1	308.334	1.834	20	5		DDBDMO
C[N@H+](CCc1cnccn1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000770663374	701288834	/nfs/dbraw/zinc/28/88/34/701288834.db2.gz	MFUQPTMTGQBJJD-UHFFFAOYSA-N	1	1	312.333	1.867	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000770663374	701288835	/nfs/dbraw/zinc/28/88/35/701288835.db2.gz	MFUQPTMTGQBJJD-UHFFFAOYSA-N	1	1	312.333	1.867	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406646	701318831	/nfs/dbraw/zinc/31/88/31/701318831.db2.gz	PDVKGQFKAGFYLB-WDEREUQCSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406646	701318832	/nfs/dbraw/zinc/31/88/32/701318832.db2.gz	PDVKGQFKAGFYLB-WDEREUQCSA-N	1	1	306.366	1.650	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000839636233	701762308	/nfs/dbraw/zinc/76/23/08/701762308.db2.gz	PEMDUCYTWWANKD-NSHDSACASA-N	1	1	322.321	1.413	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000812319723	702145425	/nfs/dbraw/zinc/14/54/25/702145425.db2.gz	QLMDAJPUBXPWEF-KGLIPLIRSA-N	1	1	303.362	1.927	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000812330417	702154672	/nfs/dbraw/zinc/15/46/72/702154672.db2.gz	NFIOENHLMJCZBX-KGLIPLIRSA-N	1	1	303.362	1.547	20	5		DDBDMO
Nc1ccc(-c2noc(C[NH2+]C[C@H]3CCCO3)n2)cc1[N+](=O)[O-]	ZINC000843169716	702832443	/nfs/dbraw/zinc/83/24/43/702832443.db2.gz	LSKVYMUSDYRVKB-SNVBAGLBSA-N	1	1	319.321	1.496	20	5		DDBDMO
CC1([NH3+])CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1	ZINC000843375332	702869697	/nfs/dbraw/zinc/86/96/97/702869697.db2.gz	HRNRPLKJMGJWIP-UHFFFAOYSA-N	1	1	324.356	1.876	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cccc(F)n3)CC2)n1	ZINC000831477473	706715048	/nfs/dbraw/zinc/71/50/48/706715048.db2.gz	FZBIRQURSFKXKU-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
CCN1C[C@@H](C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)OC1=O	ZINC000846893003	703347728	/nfs/dbraw/zinc/34/77/28/703347728.db2.gz	DWEOHQXITBRUEZ-CQSZACIVSA-N	1	1	307.350	1.910	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2ccnn2C)c1	ZINC000879687718	706759587	/nfs/dbraw/zinc/75/95/87/706759587.db2.gz	VPAUFDKACNHCCQ-JTQLQIEISA-N	1	1	318.333	1.966	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCOCC1	ZINC000852494180	704061529	/nfs/dbraw/zinc/06/15/29/704061529.db2.gz	XLUAOJSQYLTTGA-UHFFFAOYSA-N	1	1	313.741	1.372	20	5		DDBDMO
COC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000852767745	704119417	/nfs/dbraw/zinc/11/94/17/704119417.db2.gz	PSVANCHXTWBAIF-UHFFFAOYSA-N	1	1	323.349	1.924	20	5		DDBDMO
C[C@H](C[C@H]1CCCC[N@H+]1C)OC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000870789978	704133021	/nfs/dbraw/zinc/13/30/21/704133021.db2.gz	LFZVPOHFWALDKJ-VXGBXAGGSA-N	1	1	310.354	1.597	20	5		DDBDMO
CCN(C[C@@H]1CCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870875365	704153731	/nfs/dbraw/zinc/15/37/31/704153731.db2.gz	LUKUNUFUXKUTHQ-LRDDRELGSA-N	1	1	321.377	1.654	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000855159448	704471548	/nfs/dbraw/zinc/47/15/48/704471548.db2.gz	AMUBXRNLFFMIBM-SNVBAGLBSA-N	1	1	321.381	1.422	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000855285639	704477306	/nfs/dbraw/zinc/47/73/06/704477306.db2.gz	HLZFOLXZGDWMJX-SECBINFHSA-N	1	1	307.354	1.175	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1F	ZINC000821884218	704834017	/nfs/dbraw/zinc/83/40/17/704834017.db2.gz	QPBIFKOYNFZPEL-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000874822361	705181764	/nfs/dbraw/zinc/18/17/64/705181764.db2.gz	ARBBDDZLZGIVMT-UONOGXRCSA-N	1	1	321.352	1.972	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839959	705196116	/nfs/dbraw/zinc/19/61/16/705196116.db2.gz	YOHLHBPDTOZNQS-GHMZBOCLSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874839959	705196117	/nfs/dbraw/zinc/19/61/17/705196117.db2.gz	YOHLHBPDTOZNQS-GHMZBOCLSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839959	705196118	/nfs/dbraw/zinc/19/61/18/705196118.db2.gz	YOHLHBPDTOZNQS-GHMZBOCLSA-N	1	1	321.381	1.750	20	5		DDBDMO
CCCN(C(=O)Cn1c(C)ncc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000823500096	705256166	/nfs/dbraw/zinc/25/61/66/705256166.db2.gz	UPURNWSOZZZJIO-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000861352437	705441139	/nfs/dbraw/zinc/44/11/39/705441139.db2.gz	JDISQSIEPGTBPT-FZMZJTMJSA-N	1	1	302.371	1.474	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827300343	705971271	/nfs/dbraw/zinc/97/12/71/705971271.db2.gz	MJACEPXRDOTZIK-HOCLYGCPSA-N	1	1	317.389	1.998	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827371934	705988204	/nfs/dbraw/zinc/98/82/04/705988204.db2.gz	BELWJINKVDYOSD-YPMHNXCESA-N	1	1	304.350	1.343	20	5		DDBDMO
COC(=O)[C@H]1C[C@H](O)C[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000877608273	706158046	/nfs/dbraw/zinc/15/80/46/706158046.db2.gz	ODRSQNPIKDUHAW-STQMWFEESA-N	1	1	322.361	1.567	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000864610879	706211838	/nfs/dbraw/zinc/21/18/38/706211838.db2.gz	VBAGLXZVUVCWOE-LBPRGKRZSA-N	1	1	309.341	1.877	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2ccnn2C)C1	ZINC000877976684	706256418	/nfs/dbraw/zinc/25/64/18/706256418.db2.gz	YAJUFZGHYKAIBB-ZDUSSCGKSA-N	1	1	318.381	1.713	20	5		DDBDMO
Cc1ccc(CN[C@H]2CC[N@H+](CC(C)(C)O)C2)cc1[N+](=O)[O-]	ZINC000865655190	706488614	/nfs/dbraw/zinc/48/86/14/706488614.db2.gz	AHBXQXFYKCCCCM-AWEZNQCLSA-N	1	1	307.394	1.838	20	5		DDBDMO
Cc1ccc(CN[C@H]2CC[N@@H+](CC(C)(C)O)C2)cc1[N+](=O)[O-]	ZINC000865655190	706488615	/nfs/dbraw/zinc/48/86/15/706488615.db2.gz	AHBXQXFYKCCCCM-AWEZNQCLSA-N	1	1	307.394	1.838	20	5		DDBDMO
COC(=O)CC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000880040605	706861034	/nfs/dbraw/zinc/86/10/34/706861034.db2.gz	YFRYXCROOCPXCE-LBPRGKRZSA-N	1	1	310.354	1.457	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880528628	707005198	/nfs/dbraw/zinc/00/51/98/707005198.db2.gz	FJCYPLQFDLTCTP-TUKIKUTGSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880528628	707005201	/nfs/dbraw/zinc/00/52/01/707005201.db2.gz	FJCYPLQFDLTCTP-TUKIKUTGSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[C@@H]([NH2+]CC1(S(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068874	707287378	/nfs/dbraw/zinc/28/73/78/707287378.db2.gz	JTGXBXDQMPAAFO-SECBINFHSA-N	1	1	316.354	1.962	20	5		DDBDMO
Cc1c(C[NH2+]C[C@H](C)N2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873044704	707706778	/nfs/dbraw/zinc/70/67/78/707706778.db2.gz	VTSAIGHNRXIOEI-ZDUSSCGKSA-N	1	1	306.410	1.629	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1	ZINC000896912957	708181014	/nfs/dbraw/zinc/18/10/14/708181014.db2.gz	LTBGYBHESFJARO-BLLLJJGKSA-N	1	1	319.361	1.769	20	5		DDBDMO
Cc1cc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)ncc1[N+](=O)[O-]	ZINC000897220415	708258551	/nfs/dbraw/zinc/25/85/51/708258551.db2.gz	AYBTWJRBMLILOM-CHWSQXEVSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@]2(O)CC[N@H+](C)C2)c1C	ZINC000897397984	708315178	/nfs/dbraw/zinc/31/51/78/708315178.db2.gz	PENAQBOCEMSDCF-OAHLLOKOSA-N	1	1	307.350	1.008	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[NH+]1CCC(O[C@@H]2CCOC2)CC1	ZINC000886032725	708685274	/nfs/dbraw/zinc/68/52/74/708685274.db2.gz	MPTXKLJPGDWDMM-CQSZACIVSA-N	1	1	307.350	1.760	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)Cc1cccnc1[N+](=O)[O-]	ZINC000886208039	708715114	/nfs/dbraw/zinc/71/51/14/708715114.db2.gz	SXHPXXBVWYBAHY-UHFFFAOYSA-N	1	1	309.414	1.305	20	5		DDBDMO
CN(CCCN(C)Cc1cccnc1[N+](=O)[O-])CC[NH+](C)C	ZINC000886208039	708715115	/nfs/dbraw/zinc/71/51/15/708715115.db2.gz	SXHPXXBVWYBAHY-UHFFFAOYSA-N	1	1	309.414	1.305	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000886597442	708787582	/nfs/dbraw/zinc/78/75/82/708787582.db2.gz	DUCHYKXUMZBTDQ-LBPRGKRZSA-N	1	1	322.365	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](c3ncccn3)C2)n1	ZINC000886681123	708812909	/nfs/dbraw/zinc/81/29/09/708812909.db2.gz	SLSWNTSDWOPUBX-LBPRGKRZSA-N	1	1	302.338	1.461	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@H](NC(=O)OC)C2)ccc1[N+](=O)[O-]	ZINC000886854605	708864891	/nfs/dbraw/zinc/86/48/91/708864891.db2.gz	VACRTVSFPWUYFN-LBPRGKRZSA-N	1	1	323.349	1.924	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](NC(=O)OC)C2)ccc1[N+](=O)[O-]	ZINC000886854605	708864893	/nfs/dbraw/zinc/86/48/93/708864893.db2.gz	VACRTVSFPWUYFN-LBPRGKRZSA-N	1	1	323.349	1.924	20	5		DDBDMO
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+](C)CCO	ZINC000899737206	709183815	/nfs/dbraw/zinc/18/38/15/709183815.db2.gz	DDWPZFBTVZJZLT-AWEZNQCLSA-N	1	1	323.393	1.204	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090927	713126495	/nfs/dbraw/zinc/12/64/95/713126495.db2.gz	BJPIUVKPLGRILA-GXSJLCMTSA-N	1	1	310.379	1.233	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090927	713126498	/nfs/dbraw/zinc/12/64/98/713126498.db2.gz	BJPIUVKPLGRILA-GXSJLCMTSA-N	1	1	310.379	1.233	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000892418106	710434121	/nfs/dbraw/zinc/43/41/21/710434121.db2.gz	MZQJGZPLMNSOFH-GFCCVEGCSA-N	1	1	306.366	1.878	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc3nonc3c2[N+](=O)[O-])C1	ZINC000892730835	710489140	/nfs/dbraw/zinc/48/91/40/710489140.db2.gz	KBINOXDTZGLVPR-JTQLQIEISA-N	1	1	305.338	1.909	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928431522	713192635	/nfs/dbraw/zinc/19/26/35/713192635.db2.gz	FBEXYQXVJIIWOX-SMDDNHRTSA-N	1	1	319.361	1.767	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928435833	713194619	/nfs/dbraw/zinc/19/46/19/713194619.db2.gz	DEAFQGRXNCMFBS-NEPJUHHUSA-N	1	1	306.366	1.240	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000928452606	713203838	/nfs/dbraw/zinc/20/38/38/713203838.db2.gz	NFAFISGKRFEFLQ-ZYHUDNBSSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000893936007	710892633	/nfs/dbraw/zinc/89/26/33/710892633.db2.gz	TYNZPZWGTDGQJQ-JGVFFNPUSA-N	1	1	319.287	1.487	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000928554903	713224371	/nfs/dbraw/zinc/22/43/71/713224371.db2.gz	LBUSIIWDRLMKAS-SNVBAGLBSA-N	1	1	300.318	1.577	20	5		DDBDMO
C[N@H+]1CCN(c2nccc3c2cccc3[N+](=O)[O-])C[C@H]1CO	ZINC000894883894	711307722	/nfs/dbraw/zinc/30/77/22/711307722.db2.gz	BKVICEWRKUUAJK-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
COc1c(O)ccc(C[N@H+](C)C[C@H]2COCCO2)c1[N+](=O)[O-]	ZINC000895364442	711494785	/nfs/dbraw/zinc/49/47/85/711494785.db2.gz	PVWZBWZOBDGVBR-NSHDSACASA-N	1	1	312.322	1.156	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+](C)C[C@H]2COCCO2)c1[N+](=O)[O-]	ZINC000895364442	711494787	/nfs/dbraw/zinc/49/47/87/711494787.db2.gz	PVWZBWZOBDGVBR-NSHDSACASA-N	1	1	312.322	1.156	20	5		DDBDMO
Cc1c(C(=O)N[C@@H]2CCC[N@H+](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000918395282	713541554	/nfs/dbraw/zinc/54/15/54/713541554.db2.gz	MWSPVBUXFGMYOE-SNVBAGLBSA-N	1	1	322.321	1.635	20	5		DDBDMO
O=[N+]([O-])CCN1CCN([C@@H]2CC[N@@H+](Cc3ccccc3)C2)CC1	ZINC000930454232	713839512	/nfs/dbraw/zinc/83/95/12/713839512.db2.gz	FLSUVLVKSSZZDJ-QGZVFWFLSA-N	1	1	318.421	1.155	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@@H]1CCC[N@@H+](C)C1	ZINC000930877557	713947986	/nfs/dbraw/zinc/94/79/86/713947986.db2.gz	VOARABLXKHBRDW-LLVKDONJSA-N	1	1	307.354	1.278	20	5		DDBDMO
O=[N+]([O-])CC[NH+]1CCC(Cc2nc(C3CCOCC3)no2)CC1	ZINC000931252959	714049072	/nfs/dbraw/zinc/04/90/72/714049072.db2.gz	PZBJGZJPLRDGDN-UHFFFAOYSA-N	1	1	324.381	1.495	20	5		DDBDMO
C[NH+](C)CC1(O)CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000931483176	714108402	/nfs/dbraw/zinc/10/84/02/714108402.db2.gz	XHVWILNDQNQABE-HNNXBMFYSA-N	1	1	323.393	1.017	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOC[C@@H]2C[C@@H]2CCCO2)n1	ZINC000933682118	714647338	/nfs/dbraw/zinc/64/73/38/714647338.db2.gz	OMMSDXQRUWEYBV-STQMWFEESA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC[C@@H]2C[C@@H]2CCCO2)n1	ZINC000933682118	714647339	/nfs/dbraw/zinc/64/73/39/714647339.db2.gz	OMMSDXQRUWEYBV-STQMWFEESA-N	1	1	310.354	1.061	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC1)CC[NH+](CCF)CC2	ZINC000957547732	715950414	/nfs/dbraw/zinc/95/04/14/715950414.db2.gz	NQRKYMPWZNAPNU-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)n1	ZINC001164631364	719254269	/nfs/dbraw/zinc/25/42/69/719254269.db2.gz	DODQEMVSIJWTFV-IUCAKERBSA-N	1	1	322.369	1.180	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@H](C)[N@H+](C)C[C@@H]2C)n1	ZINC001164631364	719254271	/nfs/dbraw/zinc/25/42/71/719254271.db2.gz	DODQEMVSIJWTFV-IUCAKERBSA-N	1	1	322.369	1.180	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923252	721849038	/nfs/dbraw/zinc/84/90/38/721849038.db2.gz	UNHOKRDCMBXEFW-KGLIPLIRSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923252	721849040	/nfs/dbraw/zinc/84/90/40/721849040.db2.gz	UNHOKRDCMBXEFW-KGLIPLIRSA-N	1	1	305.382	1.204	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001120873809	782202014	/nfs/dbraw/zinc/20/20/14/782202014.db2.gz	GYEXGHRHKQUKQF-BLLLJJGKSA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@H]1CN(C)CC[N@@H+]1C	ZINC001120873809	782202017	/nfs/dbraw/zinc/20/20/17/782202017.db2.gz	GYEXGHRHKQUKQF-BLLLJJGKSA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@H]1CN(C)CC[N@H+]1C	ZINC001120873809	782202022	/nfs/dbraw/zinc/20/20/22/782202022.db2.gz	GYEXGHRHKQUKQF-BLLLJJGKSA-N	1	1	322.409	1.787	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@@H]2CO)o1	ZINC001167347330	733251226	/nfs/dbraw/zinc/25/12/26/733251226.db2.gz	KNWFEXCCEWKMJB-SNVBAGLBSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H]2CO)o1	ZINC001167347330	733251229	/nfs/dbraw/zinc/25/12/29/733251229.db2.gz	KNWFEXCCEWKMJB-SNVBAGLBSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C1CC1	ZINC001025645522	736808003	/nfs/dbraw/zinc/80/80/03/736808003.db2.gz	NETNXRLWHAQYPB-FICVDOATSA-N	1	1	301.346	1.551	20	5		DDBDMO
O=C(NCC[NH2+]CCCCOc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126939434	742881190	/nfs/dbraw/zinc/88/11/90/742881190.db2.gz	YDEXUPWDAAPZED-HUUCEWRRSA-N	1	1	321.377	1.217	20	5		DDBDMO
COc1cnc(NCC2([NH+]3CCCC3)COC2)cc1[N+](=O)[O-]	ZINC001168443682	744923742	/nfs/dbraw/zinc/92/37/42/744923742.db2.gz	OLNWAIBQDAQTGK-UHFFFAOYSA-N	1	1	308.338	1.275	20	5		DDBDMO
CCC/C=C\CC[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001195762114	746689196	/nfs/dbraw/zinc/68/91/96/746689196.db2.gz	WXKPLWGZYYENFC-ZYDHHDLOSA-N	1	1	309.410	1.932	20	5		DDBDMO
CCC/C=C\CC[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195762114	746689198	/nfs/dbraw/zinc/68/91/98/746689198.db2.gz	WXKPLWGZYYENFC-ZYDHHDLOSA-N	1	1	309.410	1.932	20	5		DDBDMO
CCC/C=C\CC[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195762114	746689201	/nfs/dbraw/zinc/68/92/01/746689201.db2.gz	WXKPLWGZYYENFC-ZYDHHDLOSA-N	1	1	309.410	1.932	20	5		DDBDMO
O=C(C1CCC1)N1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169028399	762185430	/nfs/dbraw/zinc/18/54/30/762185430.db2.gz	RXQPQMCMDXHHPY-HIFRSBDPSA-N	1	1	309.410	1.766	20	5		DDBDMO
C[N@@H+](C1CN(C(=O)OC(C)(C)C)C1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169038235	762192644	/nfs/dbraw/zinc/19/26/44/762192644.db2.gz	XGUXSHACXFZCFQ-NWDGAFQWSA-N	1	1	313.398	1.983	20	5		DDBDMO
CCN1CC[C@]2(CCC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)C1=O	ZINC001169019203	762199274	/nfs/dbraw/zinc/19/92/74/762199274.db2.gz	FNZDXYVVUCRQKA-YCPHGPKFSA-N	1	1	309.410	1.766	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169055296	762209665	/nfs/dbraw/zinc/20/96/65/762209665.db2.gz	PBRHVCPJGUSICP-JHJVBQTASA-N	1	1	300.355	1.086	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169055296	762209672	/nfs/dbraw/zinc/20/96/72/762209672.db2.gz	PBRHVCPJGUSICP-JHJVBQTASA-N	1	1	300.355	1.086	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000828588419	759683900	/nfs/dbraw/zinc/68/39/00/759683900.db2.gz	AWBGDIYUZNZRTG-MJBXVCDLSA-N	1	1	321.377	1.113	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCOC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334097	766256942	/nfs/dbraw/zinc/25/69/42/766256942.db2.gz	BLDCXUKLPVYLEM-AAEUAGOBSA-N	1	1	310.350	1.228	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1	ZINC001145018214	772755920	/nfs/dbraw/zinc/75/59/20/772755920.db2.gz	UQIRLYVQLGZYDQ-ZETCQYMHSA-N	1	1	301.734	1.043	20	5		DDBDMO
O=C(CCc1cnc[nH]1)NCCCNc1ccccc1[N+](=O)[O-]	ZINC001094856340	776526036	/nfs/dbraw/zinc/52/60/36/776526036.db2.gz	XSLLBKUMNIERID-UHFFFAOYSA-N	1	1	317.349	1.869	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCN1CCN(C)CC1	ZINC001173217068	777048863	/nfs/dbraw/zinc/04/88/63/777048863.db2.gz	OXVXSLCVEFTXAJ-OAHLLOKOSA-N	1	1	320.437	1.753	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](S(C)(=O)=O)C1	ZINC001173227212	777062516	/nfs/dbraw/zinc/06/25/16/777062516.db2.gz	OJTNPPXIAJJMPZ-RISCZKNCSA-N	1	1	312.391	1.645	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](S(C)(=O)=O)C1	ZINC001173227212	777062518	/nfs/dbraw/zinc/06/25/18/777062518.db2.gz	OJTNPPXIAJJMPZ-RISCZKNCSA-N	1	1	312.391	1.645	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC001110193524	778065954	/nfs/dbraw/zinc/06/59/54/778065954.db2.gz	KXRLKIMIJCTSRB-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC001176735416	778223255	/nfs/dbraw/zinc/22/32/55/778223255.db2.gz	WTJDEBONSKOTJY-UHFFFAOYSA-N	1	1	323.349	1.339	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001177044221	778406354	/nfs/dbraw/zinc/40/63/54/778406354.db2.gz	PYRMDUIGBRRLBD-SWLSCSKDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(C)(C)C1	ZINC001178709317	779154622	/nfs/dbraw/zinc/15/46/22/779154622.db2.gz	MDOBQLYLOGHHHL-CYBMUJFWSA-N	1	1	309.341	1.733	20	5		DDBDMO
O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccon1	ZINC001268515539	840356550	/nfs/dbraw/zinc/35/65/50/840356550.db2.gz	CCJCLTQRAMVKLJ-UPHRSURJSA-N	1	1	322.346	1.720	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001273359497	849661063	/nfs/dbraw/zinc/66/10/63/849661063.db2.gz	HMMGGYBVYLCLSK-PWSUYJOCSA-N	1	1	305.334	1.380	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2CC[C@H]([N@@H+](C)C(C)C)C2)n1	ZINC001157010832	863514996	/nfs/dbraw/zinc/51/49/96/863514996.db2.gz	TZHCSYMTCVJHCL-NSHDSACASA-N	1	1	309.370	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)CC1(O)CCC1)CC2	ZINC001329224489	863546964	/nfs/dbraw/zinc/54/69/64/863546964.db2.gz	YHXITANBWMPPBU-HNNXBMFYSA-N	1	1	306.362	1.619	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)CC1(O)CCC1)CC2	ZINC001329224489	863546972	/nfs/dbraw/zinc/54/69/72/863546972.db2.gz	YHXITANBWMPPBU-HNNXBMFYSA-N	1	1	306.362	1.619	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1c(F)cccc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001157760347	864111632	/nfs/dbraw/zinc/11/16/32/864111632.db2.gz	DCUQJIGLLZAGJP-NOZJJQNGSA-N	1	1	313.304	1.226	20	5		DDBDMO
CCc1ccccc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767434	864117863	/nfs/dbraw/zinc/11/78/63/864117863.db2.gz	MSIQAIBLAZTMCG-HUUCEWRRSA-N	1	1	305.378	1.510	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1nc(Cl)nc2ccc([N+](=O)[O-])cc21	ZINC001159786274	865523370	/nfs/dbraw/zinc/52/33/70/865523370.db2.gz	XMNOBXLZZGQKLI-JTQLQIEISA-N	1	1	310.745	1.627	20	5		DDBDMO
C[C@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[NH+]1CCSCC1	ZINC001324321701	867203479	/nfs/dbraw/zinc/20/34/79/867203479.db2.gz	BVRMPRAWCYOCFC-LLVKDONJSA-N	1	1	321.402	1.874	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCCC[C@H]2CO)ncc1[N+](=O)[O-]	ZINC001163552209	868523819	/nfs/dbraw/zinc/52/38/19/868523819.db2.gz	BZABAXLTIXTERD-CFNZNRNTSA-N	1	1	306.366	1.873	20	5		DDBDMO
CCn1c([C@@H](C)[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@@H]1C	ZINC001339340147	870452334	/nfs/dbraw/zinc/45/23/34/870452334.db2.gz	MOXKTVBMGJSKGB-XQQFMLRXSA-N	1	1	324.429	1.802	20	5		DDBDMO
Cc1nnc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])n1C	ZINC001345639995	873463026	/nfs/dbraw/zinc/46/30/26/873463026.db2.gz	VUQLHDOWQKGLSC-UHFFFAOYSA-N	1	1	318.337	1.150	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3[O-])[C@H]2C1	ZINC001347597692	874205748	/nfs/dbraw/zinc/20/57/48/874205748.db2.gz	RYERSXZWKPHXGH-TVYUQYBPSA-N	1	1	305.334	1.370	20	5		DDBDMO
O=[N+]([O-])c1cnc(O[C@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1	ZINC001227111420	882841279	/nfs/dbraw/zinc/84/12/79/882841279.db2.gz	LGMBXRSGJSCRRT-VIFPVBQESA-N	1	1	305.250	1.488	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c([N+](=O)[O-])c1	ZINC001354400833	877953420	/nfs/dbraw/zinc/95/34/20/877953420.db2.gz	LZAATGFZRANWCD-FRRDWIJNSA-N	1	1	318.377	1.707	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)n1	ZINC001358285541	880391015	/nfs/dbraw/zinc/39/10/15/880391015.db2.gz	DVLSJANIDIXTLC-LBPRGKRZSA-N	1	1	315.333	1.115	20	5		DDBDMO
Cc1[nH]c(=O)cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c1[N+](=O)[O-]	ZINC001228686843	883619131	/nfs/dbraw/zinc/61/91/31/883619131.db2.gz	RMNAYGGAQFNRKM-GDPRMGEGSA-N	1	1	307.306	1.187	20	5		DDBDMO
OC[C@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@@H]1O	ZINC001232219396	886166205	/nfs/dbraw/zinc/16/62/05/886166205.db2.gz	TZIRRFBKKKXJGR-ZBFHGGJFSA-N	1	1	309.369	1.568	20	5		DDBDMO
COc1ccc(C[C@H](C)N[C@@H]2CC[NH2+]C[C@@H]2F)c([N+](=O)[O-])c1	ZINC001246087557	892409069	/nfs/dbraw/zinc/40/90/69/892409069.db2.gz	OZWDOPFCTPYFKC-LEWSCRJBSA-N	1	1	311.357	1.824	20	5		DDBDMO
O=C1NCC[C@@]12CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254598324	896523804	/nfs/dbraw/zinc/52/38/04/896523804.db2.gz	WHRJMOOUTXTYJI-DOTOQJQBSA-N	1	1	315.373	1.664	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254605013	896526428	/nfs/dbraw/zinc/52/64/28/896526428.db2.gz	ZTGIHZHPVJIJNU-IUODEOHRSA-N	1	1	304.346	1.947	20	5		DDBDMO
COc1cc(N2CCC([N@@H+](C)C3COC3)CC2)ccc1[N+](=O)[O-]	ZINC001256098941	897282549	/nfs/dbraw/zinc/28/25/49/897282549.db2.gz	GJIGLXOYSKSMCX-UHFFFAOYSA-N	1	1	321.377	1.903	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@H]1C[N@H+](C)CCN1C	ZINC001262705525	900320974	/nfs/dbraw/zinc/32/09/74/900320974.db2.gz	LIMGDEHWRCWJDU-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001262705525	900320983	/nfs/dbraw/zinc/32/09/83/900320983.db2.gz	LIMGDEHWRCWJDU-MEDUHNTESA-N	1	1	320.393	1.844	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2cc(C)c([N+](=O)[O-])cc2F)CC1	ZINC000292806232	529388124	/nfs/dbraw/zinc/38/81/24/529388124.db2.gz	YVFBBPFKBIEZBG-GFCCVEGCSA-N	1	1	311.357	1.935	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CN1	ZINC000278741795	214368879	/nfs/dbraw/zinc/36/88/79/214368879.db2.gz	AGLZGFZRDDLQHX-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CN1	ZINC000278741795	214368880	/nfs/dbraw/zinc/36/88/80/214368880.db2.gz	AGLZGFZRDDLQHX-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)c(F)c1	ZINC000319271565	231182290	/nfs/dbraw/zinc/18/22/90/231182290.db2.gz	FBEGNJRNQYUUQH-CQSZACIVSA-N	1	1	309.341	1.640	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](N3CCOCC3)C2)c(F)c1	ZINC000319271565	231182294	/nfs/dbraw/zinc/18/22/94/231182294.db2.gz	FBEGNJRNQYUUQH-CQSZACIVSA-N	1	1	309.341	1.640	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000495225946	529441636	/nfs/dbraw/zinc/44/16/36/529441636.db2.gz	RAYRPTQGVKLPHB-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000495225946	529441639	/nfs/dbraw/zinc/44/16/39/529441639.db2.gz	RAYRPTQGVKLPHB-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[NH2+]1	ZINC000088059424	185238504	/nfs/dbraw/zinc/23/85/04/185238504.db2.gz	CYLNAJOBHQNWID-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
CC1(C)CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000614831801	362041899	/nfs/dbraw/zinc/04/18/99/362041899.db2.gz	SOMBKZYWIMEXCG-UHFFFAOYSA-N	1	1	322.365	1.515	20	5		DDBDMO
CC1(C)CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000614831801	362041902	/nfs/dbraw/zinc/04/19/02/362041902.db2.gz	SOMBKZYWIMEXCG-UHFFFAOYSA-N	1	1	322.365	1.515	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@H]2C1	ZINC000255417900	282255989	/nfs/dbraw/zinc/25/59/89/282255989.db2.gz	NBTVRIHNBQAFBW-DANTVBBOSA-N	1	1	301.346	1.915	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCCO1	ZINC000255831611	282280423	/nfs/dbraw/zinc/28/04/23/282280423.db2.gz	KGURSSPIIOIYIP-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3c(N)cccc3[N+](=O)[O-])[C@@H]2C1	ZINC000425063977	529822717	/nfs/dbraw/zinc/82/27/17/529822717.db2.gz	GVOLTCURYFQOMQ-GXFFZTMASA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000272748878	210152278	/nfs/dbraw/zinc/15/22/78/210152278.db2.gz	NYZOGGJQKYFWBP-LBPRGKRZSA-N	1	1	303.362	1.904	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1CCN(C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000330708698	232009358	/nfs/dbraw/zinc/00/93/58/232009358.db2.gz	RJMVAUKRVUADNR-LBPRGKRZSA-N	1	1	306.366	1.019	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000458215461	530060819	/nfs/dbraw/zinc/06/08/19/530060819.db2.gz	NHABCSBYMVMHQP-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000458215461	530060820	/nfs/dbraw/zinc/06/08/20/530060820.db2.gz	NHABCSBYMVMHQP-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748435	215111872	/nfs/dbraw/zinc/11/18/72/215111872.db2.gz	LEEKUTLAUHXQLY-BXUZGUMPSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748435	215111876	/nfs/dbraw/zinc/11/18/76/215111876.db2.gz	LEEKUTLAUHXQLY-BXUZGUMPSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC1(C)C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000279905614	215224916	/nfs/dbraw/zinc/22/49/16/215224916.db2.gz	VKISUZMBVHIWNW-CQSZACIVSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC1(C)C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000279905614	215224920	/nfs/dbraw/zinc/22/49/20/215224920.db2.gz	VKISUZMBVHIWNW-CQSZACIVSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000138226314	186014739	/nfs/dbraw/zinc/01/47/39/186014739.db2.gz	NENGFHYCNVQBEL-JTQLQIEISA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138226314	186014740	/nfs/dbraw/zinc/01/47/40/186014740.db2.gz	NENGFHYCNVQBEL-JTQLQIEISA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138226314	186014742	/nfs/dbraw/zinc/01/47/42/186014742.db2.gz	NENGFHYCNVQBEL-JTQLQIEISA-N	1	1	309.370	1.558	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000172041311	198030047	/nfs/dbraw/zinc/03/00/47/198030047.db2.gz	UTQRTFHLXYIGHF-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000066924606	353025783	/nfs/dbraw/zinc/02/57/83/353025783.db2.gz	VUCWYACYRDTNSX-UHFFFAOYSA-N	1	1	321.333	1.190	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000174296072	198316619	/nfs/dbraw/zinc/31/66/19/198316619.db2.gz	WJEZXFKEUYGRMU-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000174296072	198316621	/nfs/dbraw/zinc/31/66/21/198316621.db2.gz	WJEZXFKEUYGRMU-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000174673063	198368847	/nfs/dbraw/zinc/36/88/47/198368847.db2.gz	OVOUVJYNXDMNSG-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000140004038	354133421	/nfs/dbraw/zinc/13/34/21/354133421.db2.gz	CEVOVUOLUANJJF-YUTCNCBUSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000140004038	354133423	/nfs/dbraw/zinc/13/34/23/354133423.db2.gz	CEVOVUOLUANJJF-YUTCNCBUSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000140004038	354133427	/nfs/dbraw/zinc/13/34/27/354133427.db2.gz	CEVOVUOLUANJJF-YUTCNCBUSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C1NCCN1[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000139008141	354124987	/nfs/dbraw/zinc/12/49/87/354124987.db2.gz	MGUNDAUQICQWRY-AWEZNQCLSA-N	1	1	304.350	1.584	20	5		DDBDMO
COc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157630926	354226007	/nfs/dbraw/zinc/22/60/07/354226007.db2.gz	HFBKPJABSVGMIS-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157630926	354226010	/nfs/dbraw/zinc/22/60/10/354226010.db2.gz	HFBKPJABSVGMIS-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
CN(C(=O)C[N@H+](C)C[C@@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000305215191	354469406	/nfs/dbraw/zinc/46/94/06/354469406.db2.gz	ICMHYNKYIMXXEQ-CQSZACIVSA-N	1	1	307.350	1.260	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000305215191	354469408	/nfs/dbraw/zinc/46/94/08/354469408.db2.gz	ICMHYNKYIMXXEQ-CQSZACIVSA-N	1	1	307.350	1.260	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@H]2N1	ZINC000320069209	354524933	/nfs/dbraw/zinc/52/49/33/354524933.db2.gz	KAMSHELKFOBSKW-SMDDNHRTSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@H]2N1	ZINC000320069209	354524935	/nfs/dbraw/zinc/52/49/35/354524935.db2.gz	KAMSHELKFOBSKW-SMDDNHRTSA-N	1	1	307.325	1.834	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1	ZINC000346292085	283058408	/nfs/dbraw/zinc/05/84/08/283058408.db2.gz	AZGNKBRZTKIUHA-INIZCTEOSA-N	1	1	321.352	1.831	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000588976803	354954104	/nfs/dbraw/zinc/95/41/04/354954104.db2.gz	YUAOPLBYHXYMFR-SECBINFHSA-N	1	1	303.322	1.168	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000588976803	354954106	/nfs/dbraw/zinc/95/41/06/354954106.db2.gz	YUAOPLBYHXYMFR-SECBINFHSA-N	1	1	303.322	1.168	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(OC)CC2)c1	ZINC000589495051	354996219	/nfs/dbraw/zinc/99/62/19/354996219.db2.gz	UZHFZIINDPPVLK-UHFFFAOYSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)[C@H]2C1	ZINC000590044700	355043516	/nfs/dbraw/zinc/04/35/16/355043516.db2.gz	MFTWICXGYRRWNP-RISCZKNCSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C[C@@H]21	ZINC000590776537	355176420	/nfs/dbraw/zinc/17/64/20/355176420.db2.gz	VWLJFNZFBBZPIK-BMIGLBTASA-N	1	1	314.345	1.852	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+]Cc1cscn1	ZINC000591728800	355373290	/nfs/dbraw/zinc/37/32/90/355373290.db2.gz	OCVVBKFSDFNMIC-NSHDSACASA-N	1	1	309.347	1.581	20	5		DDBDMO
CCc1[nH+]ccn1[C@H](C)CC(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC000592777360	355686243	/nfs/dbraw/zinc/68/62/43/355686243.db2.gz	LGGCEZHJEGLRML-LLVKDONJSA-N	1	1	320.353	1.318	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000594204727	356139022	/nfs/dbraw/zinc/13/90/22/356139022.db2.gz	XSYHNFBNPQEGOI-RYUDHWBXSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594601413	356262226	/nfs/dbraw/zinc/26/22/26/356262226.db2.gz	AMDPOXHAPMKTIG-QWHCGFSZSA-N	1	1	305.334	1.053	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1C[N@@H+](C)CCN1C	ZINC000595017606	356372795	/nfs/dbraw/zinc/37/27/95/356372795.db2.gz	KSTURMJKVCDXLH-JSGCOSHPSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CN(C)CCN1C	ZINC000595017606	356372797	/nfs/dbraw/zinc/37/27/97/356372797.db2.gz	KSTURMJKVCDXLH-JSGCOSHPSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCCNC1=O	ZINC000595005613	356371596	/nfs/dbraw/zinc/37/15/96/356371596.db2.gz	BMXKOQXGMWFYJK-GXFFZTMASA-N	1	1	307.350	1.923	20	5		DDBDMO
Cc1noc(CN2CCN([C@H]3CCC[N@H+](C)C3)CC2)c1[N+](=O)[O-]	ZINC000595370768	356468216	/nfs/dbraw/zinc/46/82/16/356468216.db2.gz	JFLYPOQYSKVLTK-ZDUSSCGKSA-N	1	1	323.397	1.103	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CSCc1ccc([N+](=O)[O-])cc1	ZINC000565224453	304055082	/nfs/dbraw/zinc/05/50/82/304055082.db2.gz	JCUAANSZRLUIGI-AWEZNQCLSA-N	1	1	314.407	1.767	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc(F)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000595515843	356528377	/nfs/dbraw/zinc/52/83/77/356528377.db2.gz	CCPCEWXBICRTKN-TXEJJXNPSA-N	1	1	311.357	1.621	20	5		DDBDMO
CC1(C)C[C@H]([NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)CO1	ZINC000595524527	356532667	/nfs/dbraw/zinc/53/26/67/356532667.db2.gz	WTMGUVQNOSQXRR-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@@H]3CCC[NH2+]C3)CC2)c1[N+](=O)[O-]	ZINC000595936097	356711986	/nfs/dbraw/zinc/71/19/86/356711986.db2.gz	MYZHFGPXUUJNDV-GFCCVEGCSA-N	1	1	321.381	1.478	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)C1=CC[N@@H+](C)CC1	ZINC000596186504	356806195	/nfs/dbraw/zinc/80/61/95/356806195.db2.gz	LILQSWMSGICHFX-JTQLQIEISA-N	1	1	304.350	1.756	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+](C2CC2)C1	ZINC000596255404	356834421	/nfs/dbraw/zinc/83/44/21/356834421.db2.gz	OKKSUUPBOWELEO-NSHDSACASA-N	1	1	318.377	1.614	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)c2ccc(N)c([N+](=O)[O-])n2)C[C@H](C)O1	ZINC000596214058	356817270	/nfs/dbraw/zinc/81/72/70/356817270.db2.gz	BRCWQDZTYCOBQY-PHIMTYICSA-N	1	1	309.370	1.117	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)c2ccc(N)c([N+](=O)[O-])n2)C[C@H](C)O1	ZINC000596214058	356817274	/nfs/dbraw/zinc/81/72/74/356817274.db2.gz	BRCWQDZTYCOBQY-PHIMTYICSA-N	1	1	309.370	1.117	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000597853877	357358400	/nfs/dbraw/zinc/35/84/00/357358400.db2.gz	CSCIVSGMVPXBNL-NSHDSACASA-N	1	1	309.370	1.028	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000598343407	357545625	/nfs/dbraw/zinc/54/56/25/357545625.db2.gz	ULIMWFNLZVIXGB-CYBMUJFWSA-N	1	1	320.393	1.632	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000598589078	357643139	/nfs/dbraw/zinc/64/31/39/357643139.db2.gz	CVUFVKBDWALIFM-NEPJUHHUSA-N	1	1	320.349	1.815	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1CO	ZINC000598648475	357668469	/nfs/dbraw/zinc/66/84/69/357668469.db2.gz	RYJWXIMRZIMVHH-QWRGUYRKSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1CO	ZINC000598648475	357668474	/nfs/dbraw/zinc/66/84/74/357668474.db2.gz	RYJWXIMRZIMVHH-QWRGUYRKSA-N	1	1	304.350	1.921	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598647077	357669121	/nfs/dbraw/zinc/66/91/21/357669121.db2.gz	BPUSHZBFEBCPKL-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598647077	357669124	/nfs/dbraw/zinc/66/91/24/357669124.db2.gz	BPUSHZBFEBCPKL-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
CC1(C)CC[C@@H](CO)[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000598650039	357670421	/nfs/dbraw/zinc/67/04/21/357670421.db2.gz	XLOPKFKOYCRIBN-ZDUSSCGKSA-N	1	1	309.366	1.239	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598560484	357633005	/nfs/dbraw/zinc/63/30/05/357633005.db2.gz	MVKYGGNRTHDTFD-LLVKDONJSA-N	1	1	307.354	1.170	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+](CC2CC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598560484	357633008	/nfs/dbraw/zinc/63/30/08/357633008.db2.gz	MVKYGGNRTHDTFD-LLVKDONJSA-N	1	1	307.354	1.170	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598560484	357633010	/nfs/dbraw/zinc/63/30/10/357633010.db2.gz	MVKYGGNRTHDTFD-LLVKDONJSA-N	1	1	307.354	1.170	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000598560408	357633139	/nfs/dbraw/zinc/63/31/39/357633139.db2.gz	LDDMUVIXRVISLB-LBPRGKRZSA-N	1	1	321.381	1.478	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1CO	ZINC000598676816	357683052	/nfs/dbraw/zinc/68/30/52/357683052.db2.gz	LMTMAKYFQWZUEG-WCQYABFASA-N	1	1	322.361	1.816	20	5		DDBDMO
C[NH+]1CCN(CC2CN(c3ccc(Cl)cc3[N+](=O)[O-])C2)CC1	ZINC000599105833	357817404	/nfs/dbraw/zinc/81/74/04/357817404.db2.gz	HUOPFYXCOFZPGJ-UHFFFAOYSA-N	1	1	324.812	1.932	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000599561705	357973511	/nfs/dbraw/zinc/97/35/11/357973511.db2.gz	CEXOHBDOXKIJEC-HNNXBMFYSA-N	1	1	324.333	1.238	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599624025	357996557	/nfs/dbraw/zinc/99/65/57/357996557.db2.gz	JKUVLIUMPUHKNS-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599624025	357996560	/nfs/dbraw/zinc/99/65/60/357996560.db2.gz	JKUVLIUMPUHKNS-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)n1	ZINC000600470450	358233206	/nfs/dbraw/zinc/23/32/06/358233206.db2.gz	OLHOWSIOBMQLBC-LBPRGKRZSA-N	1	1	321.381	1.558	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H]3COC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000601974190	358761474	/nfs/dbraw/zinc/76/14/74/358761474.db2.gz	QNAFAZDHSIGFFX-RWMBFGLXSA-N	1	1	319.361	1.808	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)[C@H](CO)C1	ZINC000601979300	358763594	/nfs/dbraw/zinc/76/35/94/358763594.db2.gz	DIPHERIWOVCYNT-JTQLQIEISA-N	1	1	317.292	1.309	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)[C@H](CO)C1	ZINC000601979300	358763595	/nfs/dbraw/zinc/76/35/95/358763595.db2.gz	DIPHERIWOVCYNT-JTQLQIEISA-N	1	1	317.292	1.309	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](CO)C1	ZINC000601979305	358763790	/nfs/dbraw/zinc/76/37/90/358763790.db2.gz	DMACHBCQHYGIDU-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](CO)C1	ZINC000601979305	358763792	/nfs/dbraw/zinc/76/37/92/358763792.db2.gz	DMACHBCQHYGIDU-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)C[C@](C)(O)C1CC1	ZINC000602821807	359215831	/nfs/dbraw/zinc/21/58/31/359215831.db2.gz	ACWYRPRIPKJFLL-SJORKVTESA-N	1	1	322.405	1.981	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C[C@](C)(O)C1CC1	ZINC000602821806	359215906	/nfs/dbraw/zinc/21/59/06/359215906.db2.gz	ACWYRPRIPKJFLL-IRXDYDNUSA-N	1	1	322.405	1.981	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3	ZINC000602904031	359284235	/nfs/dbraw/zinc/28/42/35/359284235.db2.gz	HYNBAWGFFQFLAD-IYBDPMFKSA-N	1	1	320.393	1.992	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C1	ZINC000602953481	359319659	/nfs/dbraw/zinc/31/96/59/359319659.db2.gz	AAARNFYUVUCFQK-GFCCVEGCSA-N	1	1	321.381	1.526	20	5		DDBDMO
CN(C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000602962536	359325213	/nfs/dbraw/zinc/32/52/13/359325213.db2.gz	LZQQAEKRUJGXJD-HNNXBMFYSA-N	1	1	307.350	1.013	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](OC)C[C@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964605	359327758	/nfs/dbraw/zinc/32/77/58/359327758.db2.gz	RWDUEEYRCIIWSC-IUODEOHRSA-N	1	1	310.350	1.575	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])nc1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000609802291	360352534	/nfs/dbraw/zinc/35/25/34/360352534.db2.gz	OOVLWEGXVVHWIF-OAHLLOKOSA-N	1	1	319.409	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)[C@H](C)C1	ZINC000610177830	360388938	/nfs/dbraw/zinc/38/89/38/360388938.db2.gz	HUXVWSPPVVOONH-DGCLKSJQSA-N	1	1	308.382	1.736	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000610489119	360449638	/nfs/dbraw/zinc/44/96/38/360449638.db2.gz	FBZLIWUEYBVLBV-CYBMUJFWSA-N	1	1	306.366	1.681	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C[C@H]1C	ZINC000611091891	360621322	/nfs/dbraw/zinc/62/13/22/360621322.db2.gz	BUTZGNGYRDEOGJ-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+](CCCO)C1CC1)OCCO2	ZINC000611271591	360685234	/nfs/dbraw/zinc/68/52/34/360685234.db2.gz	HAVKAHWCSWWLOU-UHFFFAOYSA-N	1	1	308.334	1.713	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+](CCCO)C1CC1)OCCO2	ZINC000611271591	360685241	/nfs/dbraw/zinc/68/52/41/360685241.db2.gz	HAVKAHWCSWWLOU-UHFFFAOYSA-N	1	1	308.334	1.713	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000611704746	360799347	/nfs/dbraw/zinc/79/93/47/360799347.db2.gz	DLFNOUJRQIYARG-LLVKDONJSA-N	1	1	317.349	1.671	20	5		DDBDMO
CC(C)[C@@H](CNc1cc(N)ccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000193381457	201042737	/nfs/dbraw/zinc/04/27/37/201042737.db2.gz	UBVAEJYFPLNVHO-MRXNPFEDSA-N	1	1	321.425	1.861	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCN1CC[N@H+](C)C(C)(C)C1	ZINC000281543055	216373136	/nfs/dbraw/zinc/37/31/36/216373136.db2.gz	BHTQKHUDNVKVGM-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000566115247	304120030	/nfs/dbraw/zinc/12/00/30/304120030.db2.gz	IHSSANDHDBUBME-MCIONIFRSA-N	1	1	323.393	1.407	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2cccc(C)c2[N+](=O)[O-])CC1	ZINC000275375022	212295641	/nfs/dbraw/zinc/29/56/41/212295641.db2.gz	AFEDRABDQXDOSN-UHFFFAOYSA-N	1	1	306.366	1.526	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2C)CC[N@H+]1C[C@H](C)O	ZINC000266309738	205255916	/nfs/dbraw/zinc/25/59/16/205255916.db2.gz	DIKFHRDHFWDIDC-STQMWFEESA-N	1	1	308.382	1.580	20	5		DDBDMO
CNc1c(C(=O)N2C[C@H](C)[NH+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000336894851	249284445	/nfs/dbraw/zinc/28/44/45/249284445.db2.gz	XGJWYUBSIQUISJ-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CC(C)(C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000338670295	250084052	/nfs/dbraw/zinc/08/40/52/250084052.db2.gz	BQPFSPNPUCROKD-NEPJUHHUSA-N	1	1	321.381	1.269	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000109621883	194277840	/nfs/dbraw/zinc/27/78/40/194277840.db2.gz	KGKLFZGOYFPNKQ-NSHDSACASA-N	1	1	321.381	1.581	20	5		DDBDMO
O=C1NCCCC[C@@H]1[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000010987083	284874422	/nfs/dbraw/zinc/87/44/22/284874422.db2.gz	SZAQAKAWNKSOER-HNNXBMFYSA-N	1	1	318.377	1.386	20	5		DDBDMO
CO[C@@H]1C[C@H]([N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C12CCC2	ZINC000451836355	532954262	/nfs/dbraw/zinc/95/42/62/532954262.db2.gz	BMXPNAAKLHINKJ-HZSPNIEDSA-N	1	1	324.381	1.042	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1	ZINC000491559809	532976133	/nfs/dbraw/zinc/97/61/33/532976133.db2.gz	BJYCJJTYMZGVIA-HJHHMULASA-N	1	1	319.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@H]2CCCCO2)CC1	ZINC000298027878	285166264	/nfs/dbraw/zinc/16/62/64/285166264.db2.gz	FMXRFYOFEPQVEA-CYBMUJFWSA-N	1	1	306.366	1.681	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000120633266	195204507	/nfs/dbraw/zinc/20/45/07/195204507.db2.gz	YJRHJSDDHGTPRD-CQSZACIVSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[NH+](C)Cc1cnc(CNCCn2cc([N+](=O)[O-])cn2)s1	ZINC000352756009	285278846	/nfs/dbraw/zinc/27/88/46/285278846.db2.gz	AFEOUYRWZQYQCU-UHFFFAOYSA-N	1	1	310.383	1.099	20	5		DDBDMO
COCCCOCC[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271603977	209051120	/nfs/dbraw/zinc/05/11/20/209051120.db2.gz	UFINQDWZAMUVMJ-HNNXBMFYSA-N	1	1	312.366	1.613	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](N3CCCC3=O)C2)ccc1[N+](=O)[O-]	ZINC000352777733	285294258	/nfs/dbraw/zinc/29/42/58/285294258.db2.gz	ICWNHPVHHKDMEX-CYBMUJFWSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](N3CCCC3=O)C2)ccc1[N+](=O)[O-]	ZINC000352777733	285294261	/nfs/dbraw/zinc/29/42/61/285294261.db2.gz	ICWNHPVHHKDMEX-CYBMUJFWSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(COC(=O)N2)CC1	ZINC000495033257	533219951	/nfs/dbraw/zinc/21/99/51/533219951.db2.gz	VNTXJYXBDGUOJS-UHFFFAOYSA-N	1	1	321.333	1.678	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@H]3[NH2+]CC3(C)C)CC2)c1[N+](=O)[O-]	ZINC000424043572	533659874	/nfs/dbraw/zinc/65/98/74/533659874.db2.gz	QYWCXPAUWFOBMK-CYBMUJFWSA-N	1	1	321.381	1.477	20	5		DDBDMO
CC(C)NC(=O)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000026259563	406903847	/nfs/dbraw/zinc/90/38/47/406903847.db2.gz	LONGRPNNBAHLEU-UHFFFAOYSA-N	1	1	322.365	1.380	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000078644206	407038709	/nfs/dbraw/zinc/03/87/09/407038709.db2.gz	YCOCNYWGLCMUSA-AWEZNQCLSA-N	1	1	322.365	1.827	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000124708275	407367128	/nfs/dbraw/zinc/36/71/28/407367128.db2.gz	IJIFRITWZGZUGH-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccncc2)C2CC2)c1	ZINC000124860832	407371879	/nfs/dbraw/zinc/37/18/79/407371879.db2.gz	BAPWVLVMJVBGOC-HNNXBMFYSA-N	1	1	317.349	1.212	20	5		DDBDMO
COC[C@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806939	407465198	/nfs/dbraw/zinc/46/51/98/407465198.db2.gz	OZBGLTRGPAWGJB-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806939	407465203	/nfs/dbraw/zinc/46/52/03/407465203.db2.gz	OZBGLTRGPAWGJB-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000271010975	407467053	/nfs/dbraw/zinc/46/70/53/407467053.db2.gz	ZSXFOQLZQMCTIK-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000185725450	407488873	/nfs/dbraw/zinc/48/88/73/407488873.db2.gz	QZVOVBDFJQJIKV-JQWIXIFHSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000185725450	407488878	/nfs/dbraw/zinc/48/88/78/407488878.db2.gz	QZVOVBDFJQJIKV-JQWIXIFHSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000185725450	407488881	/nfs/dbraw/zinc/48/88/81/407488881.db2.gz	QZVOVBDFJQJIKV-JQWIXIFHSA-N	1	1	323.397	1.683	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN2CCC[N@H+](C3CC3)CC2)c1	ZINC000178858390	407630065	/nfs/dbraw/zinc/63/00/65/407630065.db2.gz	NVWYJMMKYISOBF-MRXNPFEDSA-N	1	1	305.378	1.798	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+](CCO)Cc2cccnc2)c1	ZINC000178867024	407633642	/nfs/dbraw/zinc/63/36/42/407633642.db2.gz	ROLYUIYRMNQTIA-MRXNPFEDSA-N	1	1	317.345	1.518	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000152733530	407677671	/nfs/dbraw/zinc/67/76/71/407677671.db2.gz	KBNXRZDRANGQCV-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000115716899	407701815	/nfs/dbraw/zinc/70/18/15/407701815.db2.gz	ZVPFZAPJUWFYPQ-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000115716899	407701824	/nfs/dbraw/zinc/70/18/24/407701824.db2.gz	ZVPFZAPJUWFYPQ-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CC(C)COC[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000132587877	407791400	/nfs/dbraw/zinc/79/14/00/407791400.db2.gz	CVLDVYXBMWXZNX-MRXNPFEDSA-N	1	1	308.378	1.986	20	5		DDBDMO
CC(C)COC[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000132587877	407791405	/nfs/dbraw/zinc/79/14/05/407791405.db2.gz	CVLDVYXBMWXZNX-MRXNPFEDSA-N	1	1	308.378	1.986	20	5		DDBDMO
CCOC(=O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173465507	407880841	/nfs/dbraw/zinc/88/08/41/407880841.db2.gz	LCMKLGYNMXOTNJ-NSHDSACASA-N	1	1	308.338	1.429	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000272428630	407914674	/nfs/dbraw/zinc/91/46/74/407914674.db2.gz	HJCOHNICAFFRFT-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
C[C@H]1C[NH2+]CC[C@@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000262812751	407942416	/nfs/dbraw/zinc/94/24/16/407942416.db2.gz	YLJQOWKADJRFJA-WPRPVWTQSA-N	1	1	317.342	1.010	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000155626267	408190392	/nfs/dbraw/zinc/19/03/92/408190392.db2.gz	GHFOWOFHYQSSDX-UHFFFAOYSA-N	1	1	319.358	1.352	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@H](C)[C@H]2CO)c([N+](=O)[O-])c1	ZINC000190403215	408237138	/nfs/dbraw/zinc/23/71/38/408237138.db2.gz	YBIRJTVNFNXFHY-IINYFYTJSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@H](C)[C@H]2CO)c([N+](=O)[O-])c1	ZINC000190403215	408237147	/nfs/dbraw/zinc/23/71/47/408237147.db2.gz	YBIRJTVNFNXFHY-IINYFYTJSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488375	408327034	/nfs/dbraw/zinc/32/70/34/408327034.db2.gz	YCYXKXZYWNMJAA-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488375	408327042	/nfs/dbraw/zinc/32/70/42/408327042.db2.gz	YCYXKXZYWNMJAA-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000269506948	408333811	/nfs/dbraw/zinc/33/38/11/408333811.db2.gz	GHGOPHHIADWGQF-GFCCVEGCSA-N	1	1	323.397	1.724	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000183182441	408344627	/nfs/dbraw/zinc/34/46/27/408344627.db2.gz	UVZJBTZZAIWLEJ-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
CNC(=O)C[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000269533552	408345189	/nfs/dbraw/zinc/34/51/89/408345189.db2.gz	SRICZPYSKKJZEO-UHFFFAOYSA-N	1	1	318.333	1.470	20	5		DDBDMO
CNC(=O)C[N@@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000269533552	408345194	/nfs/dbraw/zinc/34/51/94/408345194.db2.gz	SRICZPYSKKJZEO-UHFFFAOYSA-N	1	1	318.333	1.470	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662238	408383264	/nfs/dbraw/zinc/38/32/64/408383264.db2.gz	QVMSHLBTGJHWHW-CABCVRRESA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662238	408383268	/nfs/dbraw/zinc/38/32/68/408383268.db2.gz	QVMSHLBTGJHWHW-CABCVRRESA-N	1	1	319.361	1.371	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc([N+](=O)[O-])[nH]1	ZINC000269860233	408451165	/nfs/dbraw/zinc/45/11/65/408451165.db2.gz	VICLGJHOXCOMQE-UHFFFAOYSA-N	1	1	324.381	1.353	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000183560057	408440577	/nfs/dbraw/zinc/44/05/77/408440577.db2.gz	ZSKUBMASTYDLDP-ZDUSSCGKSA-N	1	1	307.354	1.794	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177121092	408525755	/nfs/dbraw/zinc/52/57/55/408525755.db2.gz	UMKKDXRQWQXLLT-UWVGGRQHSA-N	1	1	304.350	1.532	20	5		DDBDMO
Cc1ccnc(NC2CC[NH+](CCN(C)C)CC2)c1[N+](=O)[O-]	ZINC000265238529	408588281	/nfs/dbraw/zinc/58/82/81/408588281.db2.gz	OIFVPBYERNFEGU-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N2CC[NH2+][C@H](C)C2)cc1[N+](=O)[O-]	ZINC000193278555	408709549	/nfs/dbraw/zinc/70/95/49/408709549.db2.gz	JTAWLNKVDRGRQN-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@H](C)O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000249492438	408731648	/nfs/dbraw/zinc/73/16/48/408731648.db2.gz	FNXHOTOTDUYEIS-OLZOCXBDSA-N	1	1	307.394	1.790	20	5		DDBDMO
O=[N+]([O-])c1cc(Br)ccc1C[NH+](CCO)CCO	ZINC000162448830	408701644	/nfs/dbraw/zinc/70/16/44/408701644.db2.gz	ZJNHGMJUKBUPRW-UHFFFAOYSA-N	1	1	319.155	1.144	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249582260	408745448	/nfs/dbraw/zinc/74/54/48/408745448.db2.gz	ROXWVCJZHQSACB-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000290840041	408842848	/nfs/dbraw/zinc/84/28/48/408842848.db2.gz	VQPLXSDNOHAHHA-MWLCHTKSSA-N	1	1	304.350	1.731	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CCCCO)cccc1[N+](=O)[O-]	ZINC000276460232	408862790	/nfs/dbraw/zinc/86/27/90/408862790.db2.gz	XINHBMSGMLQHOB-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[N@H+](CCCCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000276459964	408862856	/nfs/dbraw/zinc/86/28/56/408862856.db2.gz	XGNRWEQBGBWITA-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[N@@H+](CCCCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000276459964	408862858	/nfs/dbraw/zinc/86/28/58/408862858.db2.gz	XGNRWEQBGBWITA-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000276501247	408872260	/nfs/dbraw/zinc/87/22/60/408872260.db2.gz	JMWODCZBGYTLRB-LKFCYVNXSA-N	1	1	304.350	1.390	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000183648242	306712022	/nfs/dbraw/zinc/71/20/22/306712022.db2.gz	JAVQGONZEAAQDX-VIFPVBQESA-N	1	1	318.337	1.143	20	5		DDBDMO
C[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O	ZINC000189881910	163123553	/nfs/dbraw/zinc/12/35/53/163123553.db2.gz	LYTPFWYFHASZGP-ZDUSSCGKSA-N	1	1	307.394	1.872	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000277609201	408976579	/nfs/dbraw/zinc/97/65/79/408976579.db2.gz	PNOPMVSYYFROCT-KGLIPLIRSA-N	1	1	319.361	1.960	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000279217626	409171594	/nfs/dbraw/zinc/17/15/94/409171594.db2.gz	NDLFDFXNAKZEJM-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000289044596	409211449	/nfs/dbraw/zinc/21/14/49/409211449.db2.gz	PVXWHSINWAOKJG-MELADBBJSA-N	1	1	324.377	1.427	20	5		DDBDMO
O=c1nc([C@@H]2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)[nH][nH]1	ZINC000289167306	409227404	/nfs/dbraw/zinc/22/74/04/409227404.db2.gz	FAWVWDBCVHEWGH-LLVKDONJSA-N	1	1	303.322	1.386	20	5		DDBDMO
C[N@@H+]1CCC[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000294184066	409256668	/nfs/dbraw/zinc/25/66/68/409256668.db2.gz	PEORJGFOQZZQMN-MRXNPFEDSA-N	1	1	319.361	1.858	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000294184066	409256670	/nfs/dbraw/zinc/25/66/70/409256670.db2.gz	PEORJGFOQZZQMN-MRXNPFEDSA-N	1	1	319.361	1.858	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000295655214	409360672	/nfs/dbraw/zinc/36/06/72/409360672.db2.gz	HSIXEHQZKNFOME-GFCCVEGCSA-N	1	1	307.350	1.187	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000280628377	409385765	/nfs/dbraw/zinc/38/57/65/409385765.db2.gz	UINXVKUASPUTQO-GFCCVEGCSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CC(C)(C)CO	ZINC000295362284	409450569	/nfs/dbraw/zinc/45/05/69/409450569.db2.gz	ZGJZPXIDPGWCJG-NSHDSACASA-N	1	1	309.366	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC(C)(C)CO	ZINC000295362284	409450574	/nfs/dbraw/zinc/45/05/74/409450574.db2.gz	ZGJZPXIDPGWCJG-NSHDSACASA-N	1	1	309.366	1.872	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1	ZINC000295454280	409491372	/nfs/dbraw/zinc/49/13/72/409491372.db2.gz	WULLYATUGVUAMH-LLVKDONJSA-N	1	1	321.381	1.042	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@@H](C)OC)c([N+](=O)[O-])c1	ZINC000285594551	409502353	/nfs/dbraw/zinc/50/23/53/409502353.db2.gz	IYMDKKJQFARKAA-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C[C@@H](C)OC)c([N+](=O)[O-])c1	ZINC000285594551	409502360	/nfs/dbraw/zinc/50/23/60/409502360.db2.gz	IYMDKKJQFARKAA-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC[C@@H]3CO)o2)cc1	ZINC000303049556	409530778	/nfs/dbraw/zinc/53/07/78/409530778.db2.gz	ZMJDAUYJFGGLSF-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC[C@@H]3CO)o2)cc1	ZINC000303049556	409530782	/nfs/dbraw/zinc/53/07/82/409530782.db2.gz	ZMJDAUYJFGGLSF-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2CCC[C@@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000303979082	409553643	/nfs/dbraw/zinc/55/36/43/409553643.db2.gz	DMYDJBKDOQKKMM-KGLIPLIRSA-N	1	1	305.334	1.157	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC[C@@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000303979082	409553652	/nfs/dbraw/zinc/55/36/52/409553652.db2.gz	DMYDJBKDOQKKMM-KGLIPLIRSA-N	1	1	305.334	1.157	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1	ZINC000356834991	409646926	/nfs/dbraw/zinc/64/69/26/409646926.db2.gz	BYWYKLKPYZOIHW-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1	ZINC000356834991	409646933	/nfs/dbraw/zinc/64/69/33/409646933.db2.gz	BYWYKLKPYZOIHW-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)NC2C[NH+](C(C)C)C2)cc([N+](=O)[O-])c1C	ZINC000297189408	409844866	/nfs/dbraw/zinc/84/48/66/409844866.db2.gz	VELCIPYXSUMDPM-UHFFFAOYSA-N	1	1	307.350	1.734	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)C	ZINC000354367298	409801706	/nfs/dbraw/zinc/80/17/06/409801706.db2.gz	JSASUAXXZZLBSD-NSHDSACASA-N	1	1	309.366	1.939	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000346316721	409911596	/nfs/dbraw/zinc/91/15/96/409911596.db2.gz	IAPXYKOSDCXJHG-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H](C)C1	ZINC000346224443	409861464	/nfs/dbraw/zinc/86/14/64/409861464.db2.gz	NUHFUYOGNIDLPV-GVXVVHGQSA-N	1	1	306.366	1.725	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000342857474	409952641	/nfs/dbraw/zinc/95/26/41/409952641.db2.gz	MFSPIUBWGDDFOX-UWERJEOXSA-N	1	1	319.405	1.995	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CCC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000342835807	409938941	/nfs/dbraw/zinc/93/89/41/409938941.db2.gz	QOPXAQBAOVVKHY-CMPLNLGQSA-N	1	1	322.365	1.979	20	5		DDBDMO
CCS(=O)(=O)NCC[N@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338359851	409940341	/nfs/dbraw/zinc/94/03/41/409940341.db2.gz	ZXHMZNULYQOMEG-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
CCS(=O)(=O)NCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338359851	409940346	/nfs/dbraw/zinc/94/03/46/409940346.db2.gz	ZXHMZNULYQOMEG-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@H]1CCC[C@H]1O	ZINC000339133973	410062189	/nfs/dbraw/zinc/06/21/89/410062189.db2.gz	BNBSKHRHMQIHPM-TZMCWYRMSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@H]1O	ZINC000339133973	410062194	/nfs/dbraw/zinc/06/21/94/410062194.db2.gz	BNBSKHRHMQIHPM-TZMCWYRMSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357534203	410087683	/nfs/dbraw/zinc/08/76/83/410087683.db2.gz	QSAFVXGTPYHUAP-NXEZZACHSA-N	1	1	304.350	1.731	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCCC[C@@H]1C	ZINC000343076664	410125467	/nfs/dbraw/zinc/12/54/67/410125467.db2.gz	NHECTAVUUKKFOV-NWDGAFQWSA-N	1	1	308.382	1.926	20	5		DDBDMO
Cc1cnc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cn1	ZINC000332456926	410173014	/nfs/dbraw/zinc/17/30/14/410173014.db2.gz	OQZGHBVZXHWALZ-UHFFFAOYSA-N	1	1	302.338	1.727	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@@H](O)C1	ZINC000351827958	410271399	/nfs/dbraw/zinc/27/13/99/410271399.db2.gz	MSUSNIUMXFCBPM-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
COc1ccc(OCCN2CC[C@@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])c1	ZINC000351847588	410286059	/nfs/dbraw/zinc/28/60/59/410286059.db2.gz	AQPRIDCYSKHMQV-NWDGAFQWSA-N	1	1	309.366	1.651	20	5		DDBDMO
CCOc1ccc([C@H](C)NC[C@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358251981	410420264	/nfs/dbraw/zinc/42/02/64/410420264.db2.gz	NDFMMNRJFANMOT-BLLLJJGKSA-N	1	1	323.393	1.711	20	5		DDBDMO
CCOc1ccc([C@H](C)[NH2+]C[C@]2(O)CCN(C)C2)cc1[N+](=O)[O-]	ZINC000358251981	410420269	/nfs/dbraw/zinc/42/02/69/410420269.db2.gz	NDFMMNRJFANMOT-BLLLJJGKSA-N	1	1	323.393	1.711	20	5		DDBDMO
COc1cc(C[N@@H+]2CCCN(C(C)=O)CC2)ccc1[N+](=O)[O-]	ZINC000351971170	410382903	/nfs/dbraw/zinc/38/29/03/410382903.db2.gz	QDQUZIXCZDQISJ-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
COc1cc(C[N@H+]2CCCN(C(C)=O)CC2)ccc1[N+](=O)[O-]	ZINC000351971170	410382909	/nfs/dbraw/zinc/38/29/09/410382909.db2.gz	QDQUZIXCZDQISJ-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](NC(N)=O)C1	ZINC000347361671	410496398	/nfs/dbraw/zinc/49/63/98/410496398.db2.gz	PWMBVKBYKCWAIX-HJTPGIPUSA-N	1	1	304.350	1.741	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000339953023	410572018	/nfs/dbraw/zinc/57/20/18/410572018.db2.gz	MQVOTKDXQMPIBH-VXGBXAGGSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000355594269	410599503	/nfs/dbraw/zinc/59/95/03/410599503.db2.gz	DNFXYLCOYXZVAL-OAHLLOKOSA-N	1	1	322.365	1.400	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000301443393	410719866	/nfs/dbraw/zinc/71/98/66/410719866.db2.gz	WTDUMZLDELTZEO-YPMHNXCESA-N	1	1	318.377	1.627	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](C)[C@H]1CO	ZINC000330575467	410789742	/nfs/dbraw/zinc/78/97/42/410789742.db2.gz	OGHXAYDOJRRBKF-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@H]1CO	ZINC000330575467	410789744	/nfs/dbraw/zinc/78/97/44/410789744.db2.gz	OGHXAYDOJRRBKF-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000330678258	410872583	/nfs/dbraw/zinc/87/25/83/410872583.db2.gz	WLJHKOFSPGOMIQ-GFCCVEGCSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000135541348	196484780	/nfs/dbraw/zinc/48/47/80/196484780.db2.gz	XZWAFRJLCNNKKW-AAEUAGOBSA-N	1	1	319.365	1.097	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000613049714	416674085	/nfs/dbraw/zinc/67/40/85/416674085.db2.gz	ORKFNVVUYQPFPU-CQSZACIVSA-N	1	1	303.322	1.017	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000296567254	226000922	/nfs/dbraw/zinc/00/09/22/226000922.db2.gz	CWPZAVHOMGTINQ-GFCCVEGCSA-N	1	1	323.349	1.746	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000296567254	226000926	/nfs/dbraw/zinc/00/09/26/226000926.db2.gz	CWPZAVHOMGTINQ-GFCCVEGCSA-N	1	1	323.349	1.746	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]2OCC(=O)N[C@@H]2C1	ZINC000374025704	418485530	/nfs/dbraw/zinc/48/55/30/418485530.db2.gz	YMOXRNOFXYZTSN-NILFDRSVSA-N	1	1	319.361	1.554	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2OCC(=O)N[C@@H]2C1	ZINC000374025704	418485532	/nfs/dbraw/zinc/48/55/32/418485532.db2.gz	YMOXRNOFXYZTSN-NILFDRSVSA-N	1	1	319.361	1.554	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2OCC(=O)N[C@H]2C1	ZINC000366810978	418520742	/nfs/dbraw/zinc/52/07/42/418520742.db2.gz	QQKQLROFQGJROF-DDTOSNHZSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2OCC(=O)N[C@H]2C1	ZINC000366810978	418520743	/nfs/dbraw/zinc/52/07/43/418520743.db2.gz	QQKQLROFQGJROF-DDTOSNHZSA-N	1	1	305.334	1.245	20	5		DDBDMO
Cc1c([C@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cnn1C	ZINC000360848405	418533783	/nfs/dbraw/zinc/53/37/83/418533783.db2.gz	KJNFMOQACJLTCD-CYBMUJFWSA-N	1	1	304.354	1.670	20	5		DDBDMO
CN(C)CC[N@@H+]1CCCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000367165665	418567148	/nfs/dbraw/zinc/56/71/48/418567148.db2.gz	OTQMFUGVTNLRTH-UHFFFAOYSA-N	1	1	307.398	1.251	20	5		DDBDMO
CN(C)CC[N@H+]1CCCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000367165665	418567151	/nfs/dbraw/zinc/56/71/51/418567151.db2.gz	OTQMFUGVTNLRTH-UHFFFAOYSA-N	1	1	307.398	1.251	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)n1	ZINC000191772459	222108152	/nfs/dbraw/zinc/10/81/52/222108152.db2.gz	QSCYALNLGWISIQ-NWDGAFQWSA-N	1	1	323.397	1.661	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@]2(C1)CCC[N@H+](C)C2	ZINC000294231584	418583067	/nfs/dbraw/zinc/58/30/67/418583067.db2.gz	RNIGAPARVNNCMZ-HNNXBMFYSA-N	1	1	321.381	1.044	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000361363660	418635791	/nfs/dbraw/zinc/63/57/91/418635791.db2.gz	ZFLIWQIZMPODAU-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2CCC[C@H]2[NH+]2CCOCC2)s1	ZINC000375592097	418659830	/nfs/dbraw/zinc/65/98/30/418659830.db2.gz	QOOKXMYQNBRCHT-WDEREUQCSA-N	1	1	312.395	1.964	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]12	ZINC000368064695	418683596	/nfs/dbraw/zinc/68/35/96/418683596.db2.gz	QNHFRCFPTHJPCW-FZMZJTMJSA-N	1	1	305.334	1.042	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)CCOc1cccc([N+](=O)[O-])c1	ZINC000361587117	418688088	/nfs/dbraw/zinc/68/80/88/418688088.db2.gz	UWNFTDBMEYHTSN-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C(=O)NCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411292469	418889275	/nfs/dbraw/zinc/88/92/75/418889275.db2.gz	MRLRRCDBKMBNRK-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
CC[C@@H]1C(=O)NCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411292469	418889276	/nfs/dbraw/zinc/88/92/76/418889276.db2.gz	MRLRRCDBKMBNRK-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000372125449	418838732	/nfs/dbraw/zinc/83/87/32/418838732.db2.gz	KBCVMYVNGCFKNW-UGFHNGPFSA-N	1	1	318.377	1.388	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365840938	418915417	/nfs/dbraw/zinc/91/54/17/418915417.db2.gz	XBJOLLCGFALCMQ-ZBEGNZNMSA-N	1	1	319.361	1.769	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1(CO)CCC1	ZINC000411754676	419399806	/nfs/dbraw/zinc/39/98/06/419399806.db2.gz	FKQCOPQRBGMBJK-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)C(N)=O	ZINC000411765812	419404272	/nfs/dbraw/zinc/40/42/72/419404272.db2.gz	AHUKHWYMBGONAN-UHFFFAOYSA-N	1	1	308.338	1.119	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H]1CCO)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000426241815	419418044	/nfs/dbraw/zinc/41/80/44/419418044.db2.gz	XEKWEDDOLCNWAV-CYBMUJFWSA-N	1	1	319.361	1.331	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](CO)C[C@H](C)C1	ZINC000420940663	419368673	/nfs/dbraw/zinc/36/86/73/419368673.db2.gz	NAVSSGOONGCSGG-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](CO)C[C@H](C)C1	ZINC000420940663	419368683	/nfs/dbraw/zinc/36/86/83/419368683.db2.gz	NAVSSGOONGCSGG-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000420943352	419373091	/nfs/dbraw/zinc/37/30/91/419373091.db2.gz	PSSHVQSGBFTFFP-STQMWFEESA-N	1	1	321.377	1.874	20	5		DDBDMO
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000299399637	229097924	/nfs/dbraw/zinc/09/79/24/229097924.db2.gz	KEORYNAYEXGBGY-LBPRGKRZSA-N	1	1	314.345	1.996	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@H]1C	ZINC000430231956	420091804	/nfs/dbraw/zinc/09/18/04/420091804.db2.gz	DNRHJSRXBUYVDY-GXFFZTMASA-N	1	1	308.334	1.987	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CN)C1CC1	ZINC000420309766	420199509	/nfs/dbraw/zinc/19/95/09/420199509.db2.gz	FMYMJTMHFMNPHN-AWEZNQCLSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CN)C1CC1	ZINC000420309766	420199514	/nfs/dbraw/zinc/19/95/14/420199514.db2.gz	FMYMJTMHFMNPHN-AWEZNQCLSA-N	1	1	306.366	1.593	20	5		DDBDMO
CC(C)(C)[C@H](C[NH3+])NCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420373418	420246842	/nfs/dbraw/zinc/24/68/42/420246842.db2.gz	ZDTWQWJJFDYXQR-ZDUSSCGKSA-N	1	1	308.382	1.886	20	5		DDBDMO
CN(C)C[C@H](O)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000433124556	420247761	/nfs/dbraw/zinc/24/77/61/420247761.db2.gz	DFUFHWRUKBKWQV-IUODEOHRSA-N	1	1	307.394	1.829	20	5		DDBDMO
C[C@@H]1CCN[C@@H](C)[C@@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420381743	420250415	/nfs/dbraw/zinc/25/04/15/420250415.db2.gz	ZJHWHSGTCDHDCS-BFQNTYOBSA-N	1	1	320.393	1.900	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](C[C@H]3COCCO3)CC2)c1	ZINC000354633009	306781108	/nfs/dbraw/zinc/78/11/08/306781108.db2.gz	OOJDQAGNJGFVKJ-HNNXBMFYSA-N	1	1	307.350	1.132	20	5		DDBDMO
CN(C)C[C@@H](O)C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21	ZINC000417317127	420448816	/nfs/dbraw/zinc/44/88/16/420448816.db2.gz	VRMGPQYHQCLVCJ-GOEBONIOSA-N	1	1	307.394	1.874	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000457080290	420604155	/nfs/dbraw/zinc/60/41/55/420604155.db2.gz	UIQIDNDZWYKQSR-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
COc1ccc(CN2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000449534831	421023755	/nfs/dbraw/zinc/02/37/55/421023755.db2.gz	NDDCLDSGXBVXDQ-BETUJISGSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000449787388	421084815	/nfs/dbraw/zinc/08/48/15/421084815.db2.gz	VEEJEDSCXCOQMY-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
COc1c(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-]	ZINC000456335532	421143885	/nfs/dbraw/zinc/14/38/85/421143885.db2.gz	XHSNNURXUAQKOM-YOGCLGLASA-N	1	1	319.361	1.958	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000516853152	421570220	/nfs/dbraw/zinc/57/02/20/421570220.db2.gz	BFLVUUHPTDZSST-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000516853152	421570223	/nfs/dbraw/zinc/57/02/23/421570223.db2.gz	BFLVUUHPTDZSST-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000553785428	421625546	/nfs/dbraw/zinc/62/55/46/421625546.db2.gz	ZEFLTRVISQPIRV-ZOWXZIJZSA-N	1	1	318.377	1.792	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000521672131	421796571	/nfs/dbraw/zinc/79/65/71/421796571.db2.gz	OPMSHGIVHKSCGB-TXEJJXNPSA-N	1	1	308.382	1.926	20	5		DDBDMO
Nc1nccc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000594345123	422346308	/nfs/dbraw/zinc/34/63/08/422346308.db2.gz	UEENKVZFCYAHFT-LLVKDONJSA-N	1	1	319.365	1.319	20	5		DDBDMO
CCC(=O)CCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000578309592	422542080	/nfs/dbraw/zinc/54/20/80/422542080.db2.gz	SYNSRGRLNSYETR-UHFFFAOYSA-N	1	1	306.366	1.871	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589558	422600097	/nfs/dbraw/zinc/60/00/97/422600097.db2.gz	ZVUCRLSZDBDBCQ-DZGCQCFKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589558	422600104	/nfs/dbraw/zinc/60/01/04/422600104.db2.gz	ZVUCRLSZDBDBCQ-DZGCQCFKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589558	422600108	/nfs/dbraw/zinc/60/01/08/422600108.db2.gz	ZVUCRLSZDBDBCQ-DZGCQCFKSA-N	1	1	323.393	1.361	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@]1(O)CC[N@@H+](C)C1	ZINC000344869429	272132732	/nfs/dbraw/zinc/13/27/32/272132732.db2.gz	RSIKXSZJQXYRFY-RQPMMQJISA-N	1	1	305.378	1.654	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CNC[C@@]1(O)CC[N@H+](C)C1	ZINC000344869429	272132735	/nfs/dbraw/zinc/13/27/35/272132735.db2.gz	RSIKXSZJQXYRFY-RQPMMQJISA-N	1	1	305.378	1.654	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000102183692	276131678	/nfs/dbraw/zinc/13/16/78/276131678.db2.gz	NNBCVKCICVDEPS-UHFFFAOYSA-N	1	1	313.379	1.357	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH+]2CCN(C3CC3)CC2)c1	ZINC000125909103	281220173	/nfs/dbraw/zinc/22/01/73/281220173.db2.gz	TZTXPNJNHDTIHG-HNNXBMFYSA-N	1	1	321.377	1.115	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246630567	282003059	/nfs/dbraw/zinc/00/30/59/282003059.db2.gz	AWSBLIBGLYVMAC-SWLSCSKDSA-N	1	1	304.350	1.845	20	5		DDBDMO
O=C([C@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295552	300246570	/nfs/dbraw/zinc/24/65/70/300246570.db2.gz	HVUGFFZWCLUJPT-LSDHHAIUSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2CCCCC2)CC1	ZINC000363295552	300246572	/nfs/dbraw/zinc/24/65/72/300246572.db2.gz	HVUGFFZWCLUJPT-LSDHHAIUSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295552	300246573	/nfs/dbraw/zinc/24/65/73/300246573.db2.gz	HVUGFFZWCLUJPT-LSDHHAIUSA-N	1	1	309.410	1.766	20	5		DDBDMO
Cn1cc(C[C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000363352639	300255708	/nfs/dbraw/zinc/25/57/08/300255708.db2.gz	NHXLFWGFSAYPRF-GFCCVEGCSA-N	1	1	304.354	1.089	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000364350385	300382014	/nfs/dbraw/zinc/38/20/14/300382014.db2.gz	XTEZEFSDJIXDSR-LSDHHAIUSA-N	1	1	321.381	1.267	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000364395948	300389498	/nfs/dbraw/zinc/38/94/98/300389498.db2.gz	CEVOVUOLUANJJF-UBHSHLNASA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000364395948	300389502	/nfs/dbraw/zinc/38/95/02/300389502.db2.gz	CEVOVUOLUANJJF-UBHSHLNASA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000364395948	300389504	/nfs/dbraw/zinc/38/95/04/300389504.db2.gz	CEVOVUOLUANJJF-UBHSHLNASA-N	1	1	323.418	1.742	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000368957644	301109845	/nfs/dbraw/zinc/10/98/45/301109845.db2.gz	FAFWREAWUAHILJ-CQDKDKBSSA-N	1	1	319.361	1.559	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)c([N+](=O)[O-])c(=O)[nH]1	ZINC000370263412	301304848	/nfs/dbraw/zinc/30/48/48/301304848.db2.gz	XOXPIIFZKQIUQI-JQWIXIFHSA-N	1	1	320.349	1.170	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000370465581	301344468	/nfs/dbraw/zinc/34/44/68/301344468.db2.gz	TWVADDFRNRVSHC-RYUDHWBXSA-N	1	1	323.324	1.327	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H]3OCC[C@H]3C2)c1	ZINC000376034707	302028368	/nfs/dbraw/zinc/02/83/68/302028368.db2.gz	MDQJISUIVLKWBF-JGGQBBKZSA-N	1	1	322.361	1.445	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)CC1	ZINC000534306279	303330730	/nfs/dbraw/zinc/33/07/30/303330730.db2.gz	OPSYFQWFXULEBQ-UHFFFAOYSA-N	1	1	323.397	1.521	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000538714001	303390043	/nfs/dbraw/zinc/39/00/43/303390043.db2.gz	GFVUDZNREXXXAJ-ABAIWWIYSA-N	1	1	318.377	1.803	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000366442182	307073876	/nfs/dbraw/zinc/07/38/76/307073876.db2.gz	QDSSICFBGNWCHN-GDNZZTSVSA-N	1	1	305.334	1.094	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c2n1CCCC2	ZINC000367068667	307084625	/nfs/dbraw/zinc/08/46/25/307084625.db2.gz	RLGPDCAHKUQUHC-UHFFFAOYSA-N	1	1	315.333	1.761	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@H+](C2CCOCC2)CC1	ZINC000369543747	307123218	/nfs/dbraw/zinc/12/32/18/307123218.db2.gz	LRRFUBONVLOHRS-UHFFFAOYSA-N	1	1	323.349	1.515	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])c1	ZINC000370864270	307138648	/nfs/dbraw/zinc/13/86/48/307138648.db2.gz	YUCZNQZSSDSKOF-JTQLQIEISA-N	1	1	315.333	1.647	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000370864270	307138649	/nfs/dbraw/zinc/13/86/49/307138649.db2.gz	YUCZNQZSSDSKOF-JTQLQIEISA-N	1	1	315.333	1.647	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H](O)C2(CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000372297519	307167968	/nfs/dbraw/zinc/16/79/68/307167968.db2.gz	VKEVZPPGVCPWTH-ZDUSSCGKSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](S(N)(=O)=O)C1	ZINC000372739191	307174196	/nfs/dbraw/zinc/17/41/96/307174196.db2.gz	KJBVTKPPWHQFGE-CYBMUJFWSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](S(N)(=O)=O)C1	ZINC000372739191	307174197	/nfs/dbraw/zinc/17/41/97/307174197.db2.gz	KJBVTKPPWHQFGE-CYBMUJFWSA-N	1	1	313.379	1.156	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1	ZINC000374050596	307200963	/nfs/dbraw/zinc/20/09/63/307200963.db2.gz	LAKQLEVAURMBGN-HNNXBMFYSA-N	1	1	319.361	1.593	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1	ZINC000374050596	307200964	/nfs/dbraw/zinc/20/09/64/307200964.db2.gz	LAKQLEVAURMBGN-HNNXBMFYSA-N	1	1	319.361	1.593	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)n1	ZINC000375431862	307226208	/nfs/dbraw/zinc/22/62/08/307226208.db2.gz	TVWRURBDUHWQLQ-LLVKDONJSA-N	1	1	318.337	1.541	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421021461	307300702	/nfs/dbraw/zinc/30/07/02/307300702.db2.gz	OBYSYWSVYKWLTO-UPJWGTAASA-N	1	1	310.350	1.180	20	5		DDBDMO
CC1(C)CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCS1	ZINC000434696155	307304556	/nfs/dbraw/zinc/30/45/56/307304556.db2.gz	XBGHLPRKAPFRHF-GFCCVEGCSA-N	1	1	314.411	1.370	20	5		DDBDMO
COC(=O)Cc1ccc(NCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000294846192	533762475	/nfs/dbraw/zinc/76/24/75/533762475.db2.gz	BVEDTASELDSGTQ-UHFFFAOYSA-N	1	1	319.361	1.984	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000305759648	534025270	/nfs/dbraw/zinc/02/52/70/534025270.db2.gz	ILPWCNORGBGEOA-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000305759648	534025277	/nfs/dbraw/zinc/02/52/77/534025277.db2.gz	ILPWCNORGBGEOA-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000331338430	534461525	/nfs/dbraw/zinc/46/15/25/534461525.db2.gz	JMEIXTJWSHQKBG-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)CN1C	ZINC000331338430	534461529	/nfs/dbraw/zinc/46/15/29/534461529.db2.gz	JMEIXTJWSHQKBG-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)CN1C	ZINC000331338430	534461532	/nfs/dbraw/zinc/46/15/32/534461532.db2.gz	JMEIXTJWSHQKBG-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000154398483	527312991	/nfs/dbraw/zinc/31/29/91/527312991.db2.gz	DWVCBCMWPDXPEA-WFASDCNBSA-N	1	1	318.377	1.855	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000433266842	528024588	/nfs/dbraw/zinc/02/45/88/528024588.db2.gz	BRZGMOQSBOHKKF-ZDUSSCGKSA-N	1	1	312.366	1.691	20	5		DDBDMO
CC(C)c1ccc(C[N@@H+]2CC[C@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557082	528094250	/nfs/dbraw/zinc/09/42/50/528094250.db2.gz	KZOZTBGXWAXMJB-CJNGLKHVSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CC[C@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557082	528094252	/nfs/dbraw/zinc/09/42/52/528094252.db2.gz	KZOZTBGXWAXMJB-CJNGLKHVSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736328956	598420867	/nfs/dbraw/zinc/42/08/67/598420867.db2.gz	ZMTWTQCFYGRWRP-JTQLQIEISA-N	1	1	319.369	1.917	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000122066772	696718554	/nfs/dbraw/zinc/71/85/54/696718554.db2.gz	IZNQUHMVMSVBDI-BETUJISGSA-N	1	1	321.377	1.776	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000122066772	696718556	/nfs/dbraw/zinc/71/85/56/696718556.db2.gz	IZNQUHMVMSVBDI-BETUJISGSA-N	1	1	321.377	1.776	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](C/C=C/Cl)C2	ZINC000981764129	696907217	/nfs/dbraw/zinc/90/72/17/696907217.db2.gz	NNMVCUKBWWYBLT-VNPHXJNISA-N	1	1	313.785	1.329	20	5		DDBDMO
CON(C)C(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000799127760	700120854	/nfs/dbraw/zinc/12/08/54/700120854.db2.gz	XOAQNYNWGDHGCJ-UHFFFAOYSA-N	1	1	307.350	1.969	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)cc1	ZINC000981137609	697015468	/nfs/dbraw/zinc/01/54/68/697015468.db2.gz	ZQNKAVJZOZFRME-HZPDHXFCSA-N	1	1	317.389	1.695	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1	ZINC000981137609	697015471	/nfs/dbraw/zinc/01/54/71/697015471.db2.gz	ZQNKAVJZOZFRME-HZPDHXFCSA-N	1	1	317.389	1.695	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1	ZINC000981137609	697015473	/nfs/dbraw/zinc/01/54/73/697015473.db2.gz	ZQNKAVJZOZFRME-HZPDHXFCSA-N	1	1	317.389	1.695	20	5		DDBDMO
C[N@H+](CCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000799365202	700138752	/nfs/dbraw/zinc/13/87/52/700138752.db2.gz	UTYSJPDALWQTJG-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
C[N@@H+](CCCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000799365202	700138755	/nfs/dbraw/zinc/13/87/55/700138755.db2.gz	UTYSJPDALWQTJG-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000775775774	698031190	/nfs/dbraw/zinc/03/11/90/698031190.db2.gz	BDQWSCRYANIKJU-AWEZNQCLSA-N	1	1	316.317	1.182	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1(C(N)=O)CCCC1	ZINC000776593887	698124362	/nfs/dbraw/zinc/12/43/62/698124362.db2.gz	PCJQCKGWYJGRCC-ZDUSSCGKSA-N	1	1	307.350	1.358	20	5		DDBDMO
Cc1cc(C(=O)OCCC[NH+]2CCOCC2)c(N)c([N+](=O)[O-])c1	ZINC000750886603	700254213	/nfs/dbraw/zinc/25/42/13/700254213.db2.gz	VRLYLWBTQRDVMM-UHFFFAOYSA-N	1	1	323.349	1.365	20	5		DDBDMO
COc1ccc2c(c1)CC[N@@H+](Cn1nccc1[N+](=O)[O-])CC2	ZINC000783979856	698897904	/nfs/dbraw/zinc/89/79/04/698897904.db2.gz	GGBYORJWYNJUHS-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](Cn1nccc1[N+](=O)[O-])CC2	ZINC000783979856	698897907	/nfs/dbraw/zinc/89/79/07/698897907.db2.gz	GGBYORJWYNJUHS-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C2OCCO2)C1	ZINC000718986440	699296430	/nfs/dbraw/zinc/29/64/30/699296430.db2.gz	DPZVHBFHZLAXJP-NSHDSACASA-N	1	1	308.334	1.798	20	5		DDBDMO
Cc1c(C[N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)cnn1C	ZINC000790453191	699461468	/nfs/dbraw/zinc/46/14/68/699461468.db2.gz	QBNQBNQYZDONHU-HNNXBMFYSA-N	1	1	304.350	1.802	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2cc(F)ccc2[N+](=O)[O-])n1C	ZINC000733969987	699629615	/nfs/dbraw/zinc/62/96/15/699629615.db2.gz	FBMLVUNZHSGHSI-UHFFFAOYSA-N	1	1	321.312	1.463	20	5		DDBDMO
CC[N@H+](C[C@@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794632457	699820108	/nfs/dbraw/zinc/82/01/08/699820108.db2.gz	PJIBAODOCUFDTM-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
CC[N@@H+](C[C@@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794632457	699820111	/nfs/dbraw/zinc/82/01/11/699820111.db2.gz	PJIBAODOCUFDTM-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000741721813	699848996	/nfs/dbraw/zinc/84/89/96/699848996.db2.gz	CQUXNWNRGOJRKG-VXGBXAGGSA-N	1	1	320.393	1.873	20	5		DDBDMO
COc1c(C(=O)NCC[N@H+]2CCC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000795271000	699855022	/nfs/dbraw/zinc/85/50/22/699855022.db2.gz	PNFDDHCXADJCES-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CNC(=O)c1ccc(NCC[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000742426786	699878454	/nfs/dbraw/zinc/87/84/54/699878454.db2.gz	BTQHBMNPBDZRIT-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000795754074	699889804	/nfs/dbraw/zinc/88/98/04/699889804.db2.gz	YLVAMFAPWSIATR-GFCCVEGCSA-N	1	1	322.365	1.761	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000795754074	699889807	/nfs/dbraw/zinc/88/98/07/699889807.db2.gz	YLVAMFAPWSIATR-GFCCVEGCSA-N	1	1	322.365	1.761	20	5		DDBDMO
CC[NH+]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1	ZINC000753851634	700462077	/nfs/dbraw/zinc/46/20/77/700462077.db2.gz	XQTQOKHXRQVQQN-UHFFFAOYSA-N	1	1	317.349	1.782	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000757035754	700653242	/nfs/dbraw/zinc/65/32/42/700653242.db2.gz	UWIAGKVHZKLKTI-CYBMUJFWSA-N	1	1	318.377	1.757	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000879145357	706598742	/nfs/dbraw/zinc/59/87/42/706598742.db2.gz	TXQNPXWWKXTHHE-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
C[NH+](C)C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000839762522	701814692	/nfs/dbraw/zinc/81/46/92/701814692.db2.gz	YLIRMBPOHCKXKX-FRRDWIJNSA-N	1	1	311.769	1.724	20	5		DDBDMO
CN(C[C@@H]1CCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867945229	701846805	/nfs/dbraw/zinc/84/68/05/701846805.db2.gz	BANUTZZDIYCQNI-NHYWBVRUSA-N	1	1	307.350	1.264	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc43)CC[C@@H]21	ZINC000866207007	706648406	/nfs/dbraw/zinc/64/84/06/706648406.db2.gz	NUVVZLLYSJTWOX-ZJUUUORDSA-N	1	1	303.322	1.661	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1	ZINC000866210125	706649570	/nfs/dbraw/zinc/64/95/70/706649570.db2.gz	YFGYRTVUFHDXIL-CHWSQXEVSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cc2noc(C[NH2+]C[C@H]3CCCO3)n2)nc1	ZINC000843192702	702838238	/nfs/dbraw/zinc/83/82/38/702838238.db2.gz	XHOQPPBCYKAWFJ-GFCCVEGCSA-N	1	1	319.321	1.232	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000843868965	702935870	/nfs/dbraw/zinc/93/58/70/702935870.db2.gz	PKSAARVGEWIBPL-PHIMTYICSA-N	1	1	307.325	1.676	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccnc(F)c3)CC2)c1	ZINC000831454227	706710117	/nfs/dbraw/zinc/71/01/17/706710117.db2.gz	HBLQZJRCDUNTTC-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
O=C1O[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC000844312611	703011090	/nfs/dbraw/zinc/01/10/90/703011090.db2.gz	DFRKDIJOEXUAFU-CYBMUJFWSA-N	1	1	318.333	1.331	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CN1C1CC1	ZINC000844312611	703011093	/nfs/dbraw/zinc/01/10/93/703011093.db2.gz	DFRKDIJOEXUAFU-CYBMUJFWSA-N	1	1	318.333	1.331	20	5		DDBDMO
C[C@@H]1C[C@H]([NH3+])CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000846709023	703322236	/nfs/dbraw/zinc/32/22/36/703322236.db2.gz	XWOTVLNTZIQZBE-GHMZBOCLSA-N	1	1	324.356	1.874	20	5		DDBDMO
Cn1ccnc1[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000846835479	703339359	/nfs/dbraw/zinc/33/93/59/703339359.db2.gz	BNPNHWSHEGRTGA-ZFWWWQNUSA-N	1	1	316.361	1.851	20	5		DDBDMO
CNc1nccc(C(=O)OCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000848792147	703590118	/nfs/dbraw/zinc/59/01/18/703590118.db2.gz	WHOQAMXWOCMRKR-UHFFFAOYSA-N	1	1	305.294	1.393	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[NH2+][C@@H](c2ccc(O)cc2)C1)[N+](=O)[O-]	ZINC000870089370	703912521	/nfs/dbraw/zinc/91/25/21/703912521.db2.gz	AWJHTSSSMHICRI-CQSZACIVSA-N	1	1	321.377	1.701	20	5		DDBDMO
C[N@H+](C[C@@H]1COCCO1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853558249	704269507	/nfs/dbraw/zinc/26/95/07/704269507.db2.gz	FUUNTKGHBSSFLT-CYBMUJFWSA-N	1	1	306.322	1.249	20	5		DDBDMO
C[N@@H+](C[C@@H]1COCCO1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853558249	704269509	/nfs/dbraw/zinc/26/95/09/704269509.db2.gz	FUUNTKGHBSSFLT-CYBMUJFWSA-N	1	1	306.322	1.249	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@H]1C[N@H+](C)CCN1C	ZINC000874457158	705074168	/nfs/dbraw/zinc/07/41/68/705074168.db2.gz	HVVDXIASOJPFGI-ZDUSSCGKSA-N	1	1	320.393	1.187	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000824002749	705352582	/nfs/dbraw/zinc/35/25/82/705352582.db2.gz	HAMAOQHRSSAJGL-SNVBAGLBSA-N	1	1	307.354	1.640	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825099413	705599262	/nfs/dbraw/zinc/59/92/62/705599262.db2.gz	ZCLTXVLJADWJHE-IUODEOHRSA-N	1	1	321.377	1.619	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000825895019	705742612	/nfs/dbraw/zinc/74/26/12/705742612.db2.gz	AMSTWBDWQLGTEI-CQSZACIVSA-N	1	1	309.366	1.475	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000827035608	705915999	/nfs/dbraw/zinc/91/59/99/705915999.db2.gz	RPHTYFSOPSWULA-VCTAVGKDSA-N	1	1	319.361	1.227	20	5		DDBDMO
CC(C)(CCC(=O)NCCCC[N@H+]1CCC[C@H]1CO)[N+](=O)[O-]	ZINC000827349186	705983046	/nfs/dbraw/zinc/98/30/46/705983046.db2.gz	HTEWMFFJSDEHHL-ZDUSSCGKSA-N	1	1	315.414	1.175	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000877438394	706107721	/nfs/dbraw/zinc/10/77/21/706107721.db2.gz	NLMVRBPRUGEUHM-ZDUSSCGKSA-N	1	1	307.394	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCN(CCO)[C@@H](C)C1	ZINC000877438394	706107727	/nfs/dbraw/zinc/10/77/27/706107727.db2.gz	NLMVRBPRUGEUHM-ZDUSSCGKSA-N	1	1	307.394	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCN(CCO)[C@@H](C)C1	ZINC000877438394	706107729	/nfs/dbraw/zinc/10/77/29/706107729.db2.gz	NLMVRBPRUGEUHM-ZDUSSCGKSA-N	1	1	307.394	1.710	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000828095280	706117320	/nfs/dbraw/zinc/11/73/20/706117320.db2.gz	LWXFGHNKNAAQTN-HUBLWGQQSA-N	1	1	321.377	1.569	20	5		DDBDMO
COC(=O)C1=NO[C@@]2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000877714543	706186449	/nfs/dbraw/zinc/18/64/49/706186449.db2.gz	NUPRNWAIOYJCKQ-HNNXBMFYSA-N	1	1	319.317	1.489	20	5		DDBDMO
COC(=O)C1=NO[C@@]2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000877714543	706186450	/nfs/dbraw/zinc/18/64/50/706186450.db2.gz	NUPRNWAIOYJCKQ-HNNXBMFYSA-N	1	1	319.317	1.489	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000864963337	706313475	/nfs/dbraw/zinc/31/34/75/706313475.db2.gz	USCOMQGAUKLGRB-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000830110205	706456321	/nfs/dbraw/zinc/45/63/21/706456321.db2.gz	BQSDJGYEUARYBU-AQNFWKISSA-N	1	1	303.362	1.907	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1onc(C)c1[N+](=O)[O-])CC2	ZINC000880184712	706904676	/nfs/dbraw/zinc/90/46/76/706904676.db2.gz	QGLAQTWPZDPIBS-RISCZKNCSA-N	1	1	309.322	1.809	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CO)c1ccccc1	ZINC000880460705	706981858	/nfs/dbraw/zinc/98/18/58/706981858.db2.gz	BNSOSEYWAZWBGQ-OAHLLOKOSA-N	1	1	304.350	1.847	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000883079648	707920536	/nfs/dbraw/zinc/92/05/36/707920536.db2.gz	ZBKVSNPIIUJTNU-GFCCVEGCSA-N	1	1	321.381	1.400	20	5		DDBDMO
CC(=O)c1ccc(N2CCN(C)CC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000897098441	708229908	/nfs/dbraw/zinc/22/99/08/708229908.db2.gz	GOSWUKREXUXOQG-UHFFFAOYSA-N	1	1	320.393	1.481	20	5		DDBDMO
CC(=O)c1ccc(N2CCN(C)CC[N@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000897098441	708229910	/nfs/dbraw/zinc/22/99/10/708229910.db2.gz	GOSWUKREXUXOQG-UHFFFAOYSA-N	1	1	320.393	1.481	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)n1	ZINC000897221940	708259337	/nfs/dbraw/zinc/25/93/37/708259337.db2.gz	QOMCJTZXKNQCEC-OLZOCXBDSA-N	1	1	306.366	1.334	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886193736	708712300	/nfs/dbraw/zinc/71/23/00/708712300.db2.gz	BEAYUAXAQMBYDC-CYBMUJFWSA-N	1	1	306.366	1.871	20	5		DDBDMO
O=C1CCCN1C[C@@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285197	708735814	/nfs/dbraw/zinc/73/58/14/708735814.db2.gz	AYSRTBVUXHMETD-GFCCVEGCSA-N	1	1	304.350	1.434	20	5		DDBDMO
O=C1CCCN1C[C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285197	708735815	/nfs/dbraw/zinc/73/58/15/708735815.db2.gz	AYSRTBVUXHMETD-GFCCVEGCSA-N	1	1	304.350	1.434	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC000887928170	709167702	/nfs/dbraw/zinc/16/77/02/709167702.db2.gz	YMFJLRZHJZVLTJ-MEDUHNTESA-N	1	1	319.361	1.627	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000901233409	709978301	/nfs/dbraw/zinc/97/83/01/709978301.db2.gz	LENXNTUYDMSWDY-INIZCTEOSA-N	1	1	321.377	1.100	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1	ZINC000891346536	710166913	/nfs/dbraw/zinc/16/69/13/710166913.db2.gz	YRESJGTUXRFOAD-CYBMUJFWSA-N	1	1	313.333	1.479	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[NH+](Cc2cccs2)CC1	ZINC000891559072	710235910	/nfs/dbraw/zinc/23/59/10/710235910.db2.gz	HLMIFULYTUOCKG-UHFFFAOYSA-N	1	1	307.379	1.712	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CCC3(CC2)OCCO3)c1[N+](=O)[O-]	ZINC000891567334	710237755	/nfs/dbraw/zinc/23/77/55/710237755.db2.gz	HLTFPHVGIAKKBZ-UHFFFAOYSA-N	1	1	324.333	1.648	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928453867	713204100	/nfs/dbraw/zinc/20/41/00/713204100.db2.gz	OWSUDWXEZYAJAP-VXGBXAGGSA-N	1	1	306.366	1.606	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)c1	ZINC000928459939	713206191	/nfs/dbraw/zinc/20/61/91/713206191.db2.gz	YJMPGQZVGIOOKA-OLZOCXBDSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000928560173	713226866	/nfs/dbraw/zinc/22/68/66/713226866.db2.gz	PHWXTRKOPPTWKG-VIFPVBQESA-N	1	1	315.276	1.630	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000928560173	713226869	/nfs/dbraw/zinc/22/68/69/713226869.db2.gz	PHWXTRKOPPTWKG-VIFPVBQESA-N	1	1	315.276	1.630	20	5		DDBDMO
COc1c(O)ccc(CN(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000894981424	711349449	/nfs/dbraw/zinc/34/94/49/711349449.db2.gz	IFUVBUPBGVTVQW-LBPRGKRZSA-N	1	1	309.366	1.835	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000895101157	711412478	/nfs/dbraw/zinc/41/24/78/711412478.db2.gz	ZXIOYRRWKZQJJM-PHIMTYICSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895245595	711463333	/nfs/dbraw/zinc/46/33/33/711463333.db2.gz	GOMIIKIAYJDLQL-JQWIXIFHSA-N	1	1	310.402	1.166	20	5		DDBDMO
O=c1[nH]ccc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-]	ZINC000895570433	711545576	/nfs/dbraw/zinc/54/55/76/711545576.db2.gz	SYKVXOBFCDZVIF-GXSJLCMTSA-N	1	1	310.379	1.687	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000896580796	711758213	/nfs/dbraw/zinc/75/82/13/711758213.db2.gz	IYKJTLDPURECNG-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2[C@H](C)CCC[C@H]2CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000914444059	713396185	/nfs/dbraw/zinc/39/61/85/713396185.db2.gz	OVIGKETXHXVVDD-PWSUYJOCSA-N	1	1	323.397	1.961	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000930915425	713957572	/nfs/dbraw/zinc/95/75/72/713957572.db2.gz	KWSXGMHCKRNEFO-JMSVASOKSA-N	1	1	321.377	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043576	713989347	/nfs/dbraw/zinc/98/93/47/713989347.db2.gz	QQULNZKQEVDCKO-OCCSQVGLSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000931043576	713989349	/nfs/dbraw/zinc/98/93/49/713989349.db2.gz	QQULNZKQEVDCKO-OCCSQVGLSA-N	1	1	320.393	1.948	20	5		DDBDMO
CO[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000932178273	714279740	/nfs/dbraw/zinc/27/97/40/714279740.db2.gz	KVULTFPKRPABQG-JIMOISOXSA-N	1	1	314.363	1.057	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000923330838	714317128	/nfs/dbraw/zinc/31/71/28/714317128.db2.gz	CJSDOWYUUOJWJF-BVUBDWEXSA-N	1	1	305.378	1.687	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000932646848	714374607	/nfs/dbraw/zinc/37/46/07/714374607.db2.gz	UTYMGRMWIGRXTA-JSGCOSHPSA-N	1	1	308.334	1.513	20	5		DDBDMO
C[C@H]([NH2+][C@H]1C(=O)NCC12CCOCC2)c1ccccc1[N+](=O)[O-]	ZINC000933038613	714506046	/nfs/dbraw/zinc/50/60/46/714506046.db2.gz	NGZIYLMBPLWHOH-FZMZJTMJSA-N	1	1	319.361	1.541	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@]2(C(N)=O)C1	ZINC000933757254	714665189	/nfs/dbraw/zinc/66/51/89/714665189.db2.gz	MMLOVRYGUCOCSV-LRDDRELGSA-N	1	1	319.361	1.691	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122782	714748722	/nfs/dbraw/zinc/74/87/22/714748722.db2.gz	WOIFGXQCGSYYQT-KBPBESRZSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122782	714748726	/nfs/dbraw/zinc/74/87/26/714748726.db2.gz	WOIFGXQCGSYYQT-KBPBESRZSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3cnc4cc([N+](=O)[O-])ccc4n3)C[C@@H]21	ZINC001164669123	719379662	/nfs/dbraw/zinc/37/96/62/719379662.db2.gz	QBKCUQXSDZXWPF-KBPBESRZSA-N	1	1	315.333	1.057	20	5		DDBDMO
O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@]12CC[N@@H+](C1)CCC2	ZINC000895488237	740797600	/nfs/dbraw/zinc/79/76/00/740797600.db2.gz	WKSZZZMKHGJVNM-INIZCTEOSA-N	1	1	318.377	1.609	20	5		DDBDMO
Cc1ncsc1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001002784109	743426392	/nfs/dbraw/zinc/42/63/92/743426392.db2.gz	YQRMUQVUKWHKKS-VXGBXAGGSA-N	1	1	324.406	1.197	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](CO)[C@@H](CCO)C1	ZINC001184364206	744019668	/nfs/dbraw/zinc/01/96/68/744019668.db2.gz	OOJSGTIPHGIZPV-XGFUNVHXSA-N	1	1	320.389	1.921	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H](O)CC23CCC3)c([N+](=O)[O-])c1	ZINC001195305569	746572247	/nfs/dbraw/zinc/57/22/47/746572247.db2.gz	DGUPGQGKQVRKTK-ZDUSSCGKSA-N	1	1	319.361	1.573	20	5		DDBDMO
CNC(=O)N[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC001197759197	747248450	/nfs/dbraw/zinc/24/84/50/747248450.db2.gz	OTLFCZBNPTZINZ-GFCCVEGCSA-N	1	1	322.365	1.367	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC001129080700	751247100	/nfs/dbraw/zinc/24/71/00/751247100.db2.gz	VGECPZAUWXQULS-OJLVUWQFSA-N	1	1	315.373	1.861	20	5		DDBDMO
CCOC(=O)C1([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)CCOCC1	ZINC001168960764	762155363	/nfs/dbraw/zinc/15/53/63/762155363.db2.gz	GYLJWYWSVPWPLJ-RYUDHWBXSA-N	1	1	300.355	1.134	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011997	762178738	/nfs/dbraw/zinc/17/87/38/762178738.db2.gz	OMIMZTMCAYEEAZ-VLEAKVRGSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011997	762178741	/nfs/dbraw/zinc/17/87/41/762178741.db2.gz	OMIMZTMCAYEEAZ-VLEAKVRGSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1)C1CCC1	ZINC001169057439	762210639	/nfs/dbraw/zinc/21/06/39/762210639.db2.gz	VIOXNHDUPCBKPX-CFVMTHIKSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCCF)CC2	ZINC001040699869	762652708	/nfs/dbraw/zinc/65/27/08/762652708.db2.gz	HENARKREOWMVRO-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1ccc(-c2cccc([N+](=O)[O-])c2)nn1	ZINC001170897948	771896996	/nfs/dbraw/zinc/89/69/96/771896996.db2.gz	QVLMVFNAFVFXNV-CYBMUJFWSA-N	1	1	302.338	1.487	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001136444166	771969499	/nfs/dbraw/zinc/96/94/99/771969499.db2.gz	CQCSSZUFUUEYEK-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
CCC1(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CCCC1	ZINC001146274642	772833188	/nfs/dbraw/zinc/83/31/88/772833188.db2.gz	YSDUHROHBHPXMG-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC001093642219	774918662	/nfs/dbraw/zinc/91/86/62/774918662.db2.gz	QSDXYKRXSJZTRV-UHFFFAOYSA-N	1	1	321.312	1.467	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ncc([N+](=O)[O-])cc1C	ZINC001093770927	775068521	/nfs/dbraw/zinc/06/85/21/775068521.db2.gz	OPOHPENCOLSXHB-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC001110158579	775939444	/nfs/dbraw/zinc/93/94/44/775939444.db2.gz	MIBBZPNKGUPKHA-UHFFFAOYSA-N	1	1	320.393	1.996	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172899762	776915065	/nfs/dbraw/zinc/91/50/65/776915065.db2.gz	PFUIZBCSQWCEOY-CQSZACIVSA-N	1	1	313.361	1.850	20	5		DDBDMO
C[C@]1(O)COCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1	ZINC001172906390	776917075	/nfs/dbraw/zinc/91/70/75/776917075.db2.gz	XPBWHHXHGSSTGE-NVXWUHKLSA-N	1	1	320.389	1.925	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC([N@@H+](C)[C@H]2CCOC2)C1	ZINC001173235433	777065159	/nfs/dbraw/zinc/06/51/59/777065159.db2.gz	WYJLKJHLROVBGX-BBRMVZONSA-N	1	1	319.405	1.931	20	5		DDBDMO
CC[N@H+](Cc1ccccc1F)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC001116150877	780479761	/nfs/dbraw/zinc/47/97/61/780479761.db2.gz	ZMAWRYCLOVVTJG-AWEZNQCLSA-N	1	1	322.340	1.813	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@]2(C1)CCC[N@@H+](C)C2	ZINC001120040269	781734901	/nfs/dbraw/zinc/73/49/01/781734901.db2.gz	CBVCMYYIFCQQCF-HNNXBMFYSA-N	1	1	306.366	1.921	20	5		DDBDMO
Cc1cnc(NCC2(N(C)C)CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC001156176014	862776629	/nfs/dbraw/zinc/77/66/29/862776629.db2.gz	HIQCHNKHHZPIDI-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@H+](C3CCC3)C2)n1	ZINC001161177803	859978978	/nfs/dbraw/zinc/97/89/78/859978978.db2.gz	UOCVEWPWIWBDQU-JTQLQIEISA-N	1	1	307.354	1.741	20	5		DDBDMO
C[NH2+][C@@H]1CCN1c1ccc(-c2ccc(F)c([N+](=O)[O-])c2)nn1	ZINC001156658494	863241020	/nfs/dbraw/zinc/24/10/20/863241020.db2.gz	CGZSANDMJZHMGU-ZDUSSCGKSA-N	1	1	303.297	1.947	20	5		DDBDMO
Cc1nc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])sc1C	ZINC001157760694	864111190	/nfs/dbraw/zinc/11/11/90/864111190.db2.gz	HINUQABQZHULBA-GHMZBOCLSA-N	1	1	312.395	1.021	20	5		DDBDMO
CC(=O)N1CC(Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001159934081	865606906	/nfs/dbraw/zinc/60/69/06/865606906.db2.gz	IGFFHNNLPFIDLL-SNAWJCMRSA-N	1	1	305.338	1.165	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C	ZINC001225613016	881937246	/nfs/dbraw/zinc/93/72/46/881937246.db2.gz	MVTCJSMYTBMPGM-ZKYQVNSYSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001225613016	881937255	/nfs/dbraw/zinc/93/72/55/881937255.db2.gz	MVTCJSMYTBMPGM-ZKYQVNSYSA-N	1	1	306.318	1.786	20	5		DDBDMO
O=[N+]([O-])c1cc[n+]([O-])c(NCC[NH+]2CCC(F)(F)CC2)c1	ZINC001160747301	866093170	/nfs/dbraw/zinc/09/31/70/866093170.db2.gz	HNZFYNZCDGLBCV-UHFFFAOYSA-N	1	1	302.281	1.371	20	5		DDBDMO
CCc1ccccc1C[NH2+]C/C=C/CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001321053191	867269251	/nfs/dbraw/zinc/26/92/51/867269251.db2.gz	XGZKODWLSKNVED-DOOVEFGSSA-N	1	1	317.389	1.676	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N[C@@]1(C)CCC[N@@H+](C)C1	ZINC001162341319	867474750	/nfs/dbraw/zinc/47/47/50/867474750.db2.gz	KLEAAZHIFNNZKH-AWEZNQCLSA-N	1	1	308.338	1.673	20	5		DDBDMO
NC(=O)COC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC001321424033	867583898	/nfs/dbraw/zinc/58/38/98/867583898.db2.gz	PNAJUDZVRFIZSX-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2N)C[C@@H]1C(C)(C)C	ZINC001163929784	868801718	/nfs/dbraw/zinc/80/17/18/868801718.db2.gz	NENIAYAIQVLCNR-CQSZACIVSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2Cc3cncnc3C2)ncc1[N+](=O)[O-]	ZINC001163984485	868845512	/nfs/dbraw/zinc/84/55/12/868845512.db2.gz	FUMGLHIJACSQID-ONEGZZNKSA-N	1	1	312.333	1.832	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC001336725109	869110246	/nfs/dbraw/zinc/11/02/46/869110246.db2.gz	AXJHCWLWEUGWLO-UHFFFAOYSA-N	1	1	322.409	1.909	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001336745183	869119639	/nfs/dbraw/zinc/11/96/39/869119639.db2.gz	GNMRDFSFHOMKDA-NSHDSACASA-N	1	1	322.365	1.981	20	5		DDBDMO
CCn1c([C@@H](C)[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@H]1C	ZINC001339340146	870452338	/nfs/dbraw/zinc/45/23/38/870452338.db2.gz	MOXKTVBMGJSKGB-UPJWGTAASA-N	1	1	324.429	1.802	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cccnc1)Cc1ccc([N+](=O)[O-])cc1	ZINC001317439427	870837424	/nfs/dbraw/zinc/83/74/24/870837424.db2.gz	SEHFIEPIPMGWOA-UHFFFAOYSA-N	1	1	314.345	1.852	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC001340735210	871318225	/nfs/dbraw/zinc/31/82/25/871318225.db2.gz	JWSUNMMMAIWADB-YGRLFVJLSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC001340735210	871318244	/nfs/dbraw/zinc/31/82/44/871318244.db2.gz	JWSUNMMMAIWADB-YGRLFVJLSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC001340735207	871318888	/nfs/dbraw/zinc/31/88/88/871318888.db2.gz	JWSUNMMMAIWADB-HZMBPMFUSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC001340735207	871318907	/nfs/dbraw/zinc/31/89/07/871318907.db2.gz	JWSUNMMMAIWADB-HZMBPMFUSA-N	1	1	322.365	1.085	20	5		DDBDMO
C[C@H]1COCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC001341004480	871462925	/nfs/dbraw/zinc/46/29/25/871462925.db2.gz	HHWPXGALRIUCIH-IAQYHMDHSA-N	1	1	307.350	1.264	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(OCC[N@@H+]2CC[C@@H](OC)C2)c1	ZINC001227043632	882790672	/nfs/dbraw/zinc/79/06/72/882790672.db2.gz	HCAFSUFPAKNDIM-GFCCVEGCSA-N	1	1	324.333	1.481	20	5		DDBDMO
CC(C)[C@H](C(=O)Oc1cc2c(cc1[N+](=O)[O-])OCCO2)[NH+](C)C	ZINC001347948132	874315795	/nfs/dbraw/zinc/31/57/95/874315795.db2.gz	BQSWIDNVNOCYBB-CQSZACIVSA-N	1	1	324.333	1.858	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC001348998648	874915733	/nfs/dbraw/zinc/91/57/33/874915733.db2.gz	MLTKTYAHMOTCFZ-VXGBXAGGSA-N	1	1	322.340	1.625	20	5		DDBDMO
C[C@H]([NH2+]C1CC[NH+](CC(=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1	ZINC001350622694	875789227	/nfs/dbraw/zinc/78/92/27/875789227.db2.gz	FODOTWRIKSVRGR-NSHDSACASA-N	1	1	307.350	1.794	20	5		DDBDMO
C[N@H+]1CC[C@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1	ZINC001227448635	883026279	/nfs/dbraw/zinc/02/62/79/883026279.db2.gz	HODLYXMZJYBFKL-ZDUSSCGKSA-N	1	1	312.325	1.614	20	5		DDBDMO
CC(C)CNC(=O)CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC001351783231	876430203	/nfs/dbraw/zinc/43/02/03/876430203.db2.gz	VQJSOCRZEUINQL-UHFFFAOYSA-N	1	1	302.334	1.749	20	5		DDBDMO
CC[N@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1C	ZINC001300086628	876874203	/nfs/dbraw/zinc/87/42/03/876874203.db2.gz	IGHPYHYALLFCPW-AOOOYVTPSA-N	1	1	307.354	1.127	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1C	ZINC001300086628	876874207	/nfs/dbraw/zinc/87/42/07/876874207.db2.gz	IGHPYHYALLFCPW-AOOOYVTPSA-N	1	1	307.354	1.127	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228602941	883568276	/nfs/dbraw/zinc/56/82/76/883568276.db2.gz	HIXNYFJGXSQXKB-SNVBAGLBSA-N	1	1	308.338	1.831	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228602941	883568285	/nfs/dbraw/zinc/56/82/85/883568285.db2.gz	HIXNYFJGXSQXKB-SNVBAGLBSA-N	1	1	308.338	1.831	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)c2cnc(N)c([N+](=O)[O-])c2)CC1	ZINC001292259343	913628359	/nfs/dbraw/zinc/62/83/59/913628359.db2.gz	WVZJHZRKKSTAFS-UHFFFAOYSA-N	1	1	321.381	1.518	20	5		DDBDMO
O=C1NC[C@@H]2CC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]12	ZINC001254602095	896525410	/nfs/dbraw/zinc/52/54/10/896525410.db2.gz	AYUIHCAFDWUGFH-GLQYFDAESA-N	1	1	301.346	1.130	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)O1	ZINC001254603455	896526575	/nfs/dbraw/zinc/52/65/75/896526575.db2.gz	NGPTYYNHPHAOIR-ZBFHGGJFSA-N	1	1	317.345	1.636	20	5		DDBDMO
CC(C)(CNc1nc2cc([N+](=O)[O-])ccc2[nH]1)[NH+]1CCOCC1	ZINC000278386515	214132579	/nfs/dbraw/zinc/13/25/79/214132579.db2.gz	FOAAMHGEBXGAKK-UHFFFAOYSA-N	1	1	319.365	1.994	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305770780	231048477	/nfs/dbraw/zinc/04/84/77/231048477.db2.gz	XYLPSRHELDHNNT-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305770780	231048479	/nfs/dbraw/zinc/04/84/79/231048479.db2.gz	XYLPSRHELDHNNT-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H](C)C(C)(C)O	ZINC000451363043	231076681	/nfs/dbraw/zinc/07/66/81/231076681.db2.gz	RODGRUYBMLKLRL-NSHDSACASA-N	1	1	309.366	1.933	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)CN1	ZINC000278760989	214383064	/nfs/dbraw/zinc/38/30/64/214383064.db2.gz	BNOGNRNNMGBMGG-HNNXBMFYSA-N	1	1	305.334	1.186	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000495209543	529441579	/nfs/dbraw/zinc/44/15/79/529441579.db2.gz	BCNULLOPQBLBQU-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C(N)=O)C1	ZINC000249585270	282177975	/nfs/dbraw/zinc/17/79/75/282177975.db2.gz	SSHADDZWKUMIAL-BXUZGUMPSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C(N)=O)C1	ZINC000249585270	282177976	/nfs/dbraw/zinc/17/79/76/282177976.db2.gz	SSHADDZWKUMIAL-BXUZGUMPSA-N	1	1	307.350	1.559	20	5		DDBDMO
CNC(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000083132909	185213637	/nfs/dbraw/zinc/21/36/37/185213637.db2.gz	QGXAACIELYCISG-UHFFFAOYSA-N	1	1	318.333	1.694	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452071335	231289851	/nfs/dbraw/zinc/28/98/51/231289851.db2.gz	UMKDNEFYWOJEQQ-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452071335	231289855	/nfs/dbraw/zinc/28/98/55/231289855.db2.gz	UMKDNEFYWOJEQQ-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)cc([N+](=O)[O-])c1	ZINC000452346739	231354086	/nfs/dbraw/zinc/35/40/86/231354086.db2.gz	HGJYUROXNWEBRQ-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000358133548	299085093	/nfs/dbraw/zinc/08/50/93/299085093.db2.gz	ZCMQRIAYVSAWQJ-SNVBAGLBSA-N	1	1	306.322	1.425	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000420813313	529966626	/nfs/dbraw/zinc/96/66/26/529966626.db2.gz	YGYMQIKJBWLYOC-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000458168647	530054558	/nfs/dbraw/zinc/05/45/58/530054558.db2.gz	NPNYCXLGDPREJJ-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3nc4sccn4c3[N+](=O)[O-])C2)C1	ZINC000292391674	282355525	/nfs/dbraw/zinc/35/55/25/282355525.db2.gz	UBIXIYLJJPBOGV-CYBMUJFWSA-N	1	1	307.379	1.836	20	5		DDBDMO
C[NH+]1CCN(CCC(C)(C)NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000331009141	530072122	/nfs/dbraw/zinc/07/21/22/530072122.db2.gz	RCFHNKGSVVATNA-UHFFFAOYSA-N	1	1	323.397	1.069	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000279730483	215098992	/nfs/dbraw/zinc/09/89/92/215098992.db2.gz	JOINSVHHWXOAGR-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000279730483	215098995	/nfs/dbraw/zinc/09/89/95/215098995.db2.gz	JOINSVHHWXOAGR-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000272562889	209979336	/nfs/dbraw/zinc/97/93/36/209979336.db2.gz	UNRDILDCLUKAFC-TZMCWYRMSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC(=O)N1CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000026160112	352206385	/nfs/dbraw/zinc/20/63/85/352206385.db2.gz	KSJLOYJBVLQWQS-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000046047163	352434058	/nfs/dbraw/zinc/43/40/58/352434058.db2.gz	GTNPKBHWUWADIY-ZDUSSCGKSA-N	1	1	322.365	1.250	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000052519050	352613375	/nfs/dbraw/zinc/61/33/75/352613375.db2.gz	WMYVTTSXKJSPTE-ZDUSSCGKSA-N	1	1	321.381	1.400	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3ncccn3)CC2)cc1	ZINC000051205562	352581071	/nfs/dbraw/zinc/58/10/71/352581071.db2.gz	YAZVOBNOHKTPTF-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
C[C@@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCCC[C@@H]1C	ZINC000055362621	352730125	/nfs/dbraw/zinc/73/01/25/352730125.db2.gz	HYFYOIFIFATVMS-RYUDHWBXSA-N	1	1	309.370	1.170	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)[N@@H+](C)C1CC1	ZINC000057716566	352825832	/nfs/dbraw/zinc/82/58/32/352825832.db2.gz	AHQZNMYGUSGGNL-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000063812469	352925929	/nfs/dbraw/zinc/92/59/29/352925929.db2.gz	HPBFNSLFFWLSGP-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000063834458	352926483	/nfs/dbraw/zinc/92/64/83/352926483.db2.gz	YYXMFCRXDFEDBW-CYBMUJFWSA-N	1	1	321.377	1.820	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1	ZINC000173808647	198254981	/nfs/dbraw/zinc/25/49/81/198254981.db2.gz	BIYYJSQIIFIPFK-GFCCVEGCSA-N	1	1	323.397	1.441	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000069502311	353164521	/nfs/dbraw/zinc/16/45/21/353164521.db2.gz	NQAFUKCBSYIPOU-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cn1cc(CC[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000072665167	353208044	/nfs/dbraw/zinc/20/80/44/353208044.db2.gz	FBXFJFOMKCVVEJ-CYBMUJFWSA-N	1	1	316.365	1.452	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)CC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000074105744	353292539	/nfs/dbraw/zinc/29/25/39/353292539.db2.gz	WFJRXAJIVRZKBI-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H](C[N@@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000174471251	198338989	/nfs/dbraw/zinc/33/89/89/198338989.db2.gz	CPYBYWFRSUECHU-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H](C[N@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000174471251	198338991	/nfs/dbraw/zinc/33/89/91/198338991.db2.gz	CPYBYWFRSUECHU-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H](C[N@@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000174471251	198338993	/nfs/dbraw/zinc/33/89/93/198338993.db2.gz	CPYBYWFRSUECHU-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1	ZINC000089265586	353763745	/nfs/dbraw/zinc/76/37/45/353763745.db2.gz	KDGXWNYZNOIOJP-ZDUSSCGKSA-N	1	1	321.377	1.977	20	5		DDBDMO
C[N@H+](Cc1cn[nH]c1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000085825087	353736766	/nfs/dbraw/zinc/73/67/66/353736766.db2.gz	ZUFGEVQMUHVSMM-CYBMUJFWSA-N	1	1	306.322	1.190	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000092830321	353872482	/nfs/dbraw/zinc/87/24/82/353872482.db2.gz	QMHWYSPODQFSNS-GFCCVEGCSA-N	1	1	323.397	1.049	20	5		DDBDMO
Cc1c(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154979196	354210125	/nfs/dbraw/zinc/21/01/25/354210125.db2.gz	RGENMQFYFUQVRX-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1c(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154979196	354210129	/nfs/dbraw/zinc/21/01/29/354210129.db2.gz	RGENMQFYFUQVRX-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH2+]C(C)(C)C1	ZINC000212552978	354310385	/nfs/dbraw/zinc/31/03/85/354310385.db2.gz	DSPPHAZQGMIDAY-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@H](CO)CC1	ZINC000293056327	354453277	/nfs/dbraw/zinc/45/32/77/354453277.db2.gz	IFHQJXOLRKTUPR-UONOGXRCSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[N@@H+](C[C@H](O)C1CC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000305708925	354470809	/nfs/dbraw/zinc/47/08/09/354470809.db2.gz	FJOOCMTZJGLBQH-CABCVRRESA-N	1	1	319.361	1.403	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000317784203	354512773	/nfs/dbraw/zinc/51/27/73/354512773.db2.gz	XWFFGYKTDCAADJ-LLVKDONJSA-N	1	1	303.322	1.281	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000317784203	354512775	/nfs/dbraw/zinc/51/27/75/354512775.db2.gz	XWFFGYKTDCAADJ-LLVKDONJSA-N	1	1	303.322	1.281	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)CCn2cccn2)c1	ZINC000589499756	354996736	/nfs/dbraw/zinc/99/67/36/354996736.db2.gz	BHPPCUBTHAAKKE-UHFFFAOYSA-N	1	1	318.333	1.710	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CCn2cccn2)c1	ZINC000589499756	354996738	/nfs/dbraw/zinc/99/67/38/354996738.db2.gz	BHPPCUBTHAAKKE-UHFFFAOYSA-N	1	1	318.333	1.710	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000589515035	354998579	/nfs/dbraw/zinc/99/85/79/354998579.db2.gz	OJGBUPHCMWPEEY-OAHLLOKOSA-N	1	1	308.334	1.728	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@H]2C1	ZINC000590012856	355041895	/nfs/dbraw/zinc/04/18/95/355041895.db2.gz	ZWWMMEGCKZHOJH-YGRLFVJLSA-N	1	1	301.350	1.607	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000590047002	355043642	/nfs/dbraw/zinc/04/36/42/355043642.db2.gz	SCONKIOSKQMRRM-UKRRQHHQSA-N	1	1	303.362	1.690	20	5		DDBDMO
CN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000593070123	355786495	/nfs/dbraw/zinc/78/64/95/355786495.db2.gz	QEOYVGDPXCAEGZ-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000593108102	355800745	/nfs/dbraw/zinc/80/07/45/355800745.db2.gz	MZZHQWYAIUEPIB-NSHDSACASA-N	1	1	323.349	1.596	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCC[N@H+](C)CC(C)C)c1[N+](=O)[O-]	ZINC000593204807	355823845	/nfs/dbraw/zinc/82/38/45/355823845.db2.gz	RFWAOJCGWHIBPH-UHFFFAOYSA-N	1	1	311.386	1.344	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594026411	356093301	/nfs/dbraw/zinc/09/33/01/356093301.db2.gz	AXDRKFNUAXPFEZ-LSDHHAIUSA-N	1	1	321.377	1.244	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594613781	356266382	/nfs/dbraw/zinc/26/63/82/356266382.db2.gz	UORWFRXNXYLKQP-RVDBLKIQSA-N	1	1	317.389	1.749	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000594716038	356294274	/nfs/dbraw/zinc/29/42/74/356294274.db2.gz	GWZOXUPYWIFDGD-LSDHHAIUSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000594716038	356294279	/nfs/dbraw/zinc/29/42/79/356294279.db2.gz	GWZOXUPYWIFDGD-LSDHHAIUSA-N	1	1	320.324	1.738	20	5		DDBDMO
Cc1noc(CN(C)CCC[N@H+](C)CCN(C)C)c1[N+](=O)[O-]	ZINC000595491305	356515935	/nfs/dbraw/zinc/51/59/35/356515935.db2.gz	VILBGMUPZUYBII-UHFFFAOYSA-N	1	1	313.402	1.207	20	5		DDBDMO
Cc1noc(CN(C)CCCN(C)CC[NH+](C)C)c1[N+](=O)[O-]	ZINC000595491305	356515940	/nfs/dbraw/zinc/51/59/40/356515940.db2.gz	VILBGMUPZUYBII-UHFFFAOYSA-N	1	1	313.402	1.207	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1[N+](=O)[O-]	ZINC000595605763	356573101	/nfs/dbraw/zinc/57/31/01/356573101.db2.gz	FXXVXFIGDJUPCZ-ZDUSSCGKSA-N	1	1	317.349	1.717	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@]4(O)C[C@H]4C3)o2)cc1	ZINC000595763482	356643141	/nfs/dbraw/zinc/64/31/41/356643141.db2.gz	FHIXAMDQZQCUKF-XHDPSFHLSA-N	1	1	316.317	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@]4(O)C[C@H]4C3)o2)cc1	ZINC000595763482	356643144	/nfs/dbraw/zinc/64/31/44/356643144.db2.gz	FHIXAMDQZQCUKF-XHDPSFHLSA-N	1	1	316.317	1.602	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](C3CCC3)C2)c1	ZINC000595838739	356673094	/nfs/dbraw/zinc/67/30/94/356673094.db2.gz	VHVLNKQLXHPJTC-ZFWWWQNUSA-N	1	1	308.382	1.664	20	5		DDBDMO
CC(C)(CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)[NH+]1CCOCC1	ZINC000596053812	356754524	/nfs/dbraw/zinc/75/45/24/356754524.db2.gz	IPJSDGVHKGPZKP-UHFFFAOYSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2cc[nH]c(=O)c2[N+](=O)[O-])C[C@H](C)O1	ZINC000596065563	356758475	/nfs/dbraw/zinc/75/84/75/356758475.db2.gz	SEFHZWKRBQUZDT-PHIMTYICSA-N	1	1	324.381	1.995	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000596268207	356838607	/nfs/dbraw/zinc/83/86/07/356838607.db2.gz	HXAZWCWSSIFDBR-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C	ZINC000597859806	357362547	/nfs/dbraw/zinc/36/25/47/357362547.db2.gz	YHYYXJJETDVDPL-LBPRGKRZSA-N	1	1	323.397	1.479	20	5		DDBDMO
CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)[C@@H]1CC[N@@H+](C)C1	ZINC000597946291	357395040	/nfs/dbraw/zinc/39/50/40/357395040.db2.gz	NKFYEUQTEJYECG-CYBMUJFWSA-N	1	1	323.397	1.351	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000598599465	357648949	/nfs/dbraw/zinc/64/89/49/357648949.db2.gz	OIWMFSGPDNZREM-VHSXEESVSA-N	1	1	308.338	1.671	20	5		DDBDMO
COC(=O)c1ccnc(NCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000598614727	357654368	/nfs/dbraw/zinc/65/43/68/357654368.db2.gz	SIKWJJLSEZIURZ-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H](CO)C1	ZINC000598647023	357669256	/nfs/dbraw/zinc/66/92/56/357669256.db2.gz	BPUSHZBFEBCPKL-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](CO)C1	ZINC000598647023	357669260	/nfs/dbraw/zinc/66/92/60/357669260.db2.gz	BPUSHZBFEBCPKL-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H](CO)C1	ZINC000598651460	357671600	/nfs/dbraw/zinc/67/16/00/357671600.db2.gz	SVENGAPEZBXIAW-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H](CO)C1	ZINC000598651460	357671605	/nfs/dbraw/zinc/67/16/05/357671605.db2.gz	SVENGAPEZBXIAW-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598651504	357671804	/nfs/dbraw/zinc/67/18/04/357671804.db2.gz	UPHUJDLSXVWQQV-NEPJUHHUSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598651504	357671808	/nfs/dbraw/zinc/67/18/08/357671808.db2.gz	UPHUJDLSXVWQQV-NEPJUHHUSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1CN(c2ccc3cnccc3c2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000599071090	357807881	/nfs/dbraw/zinc/80/78/81/357807881.db2.gz	PQPDHPIGUKWLIM-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000599568168	357976758	/nfs/dbraw/zinc/97/67/58/357976758.db2.gz	QVEWEMFEVDZEMP-ABAIWWIYSA-N	1	1	308.334	1.920	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c([N+](=O)[O-])c1	ZINC000599639636	358002082	/nfs/dbraw/zinc/00/20/82/358002082.db2.gz	KXCIGUMQHJKAEM-XJKSGUPXSA-N	1	1	319.361	1.288	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599674070	358019793	/nfs/dbraw/zinc/01/97/93/358019793.db2.gz	WBSNPHCOVVKPEW-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
COC[C@@]1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000599695356	358029687	/nfs/dbraw/zinc/02/96/87/358029687.db2.gz	XNQYPISQBCPATH-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@@]1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000599695356	358029691	/nfs/dbraw/zinc/02/96/91/358029691.db2.gz	XNQYPISQBCPATH-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599786084	358059129	/nfs/dbraw/zinc/05/91/29/358059129.db2.gz	CTNWIRHOZSJZQP-CYBMUJFWSA-N	1	1	322.365	1.345	20	5		DDBDMO
C[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC1	ZINC000599829694	358068141	/nfs/dbraw/zinc/06/81/41/358068141.db2.gz	CCMLBJUCCZMFCM-UHFFFAOYSA-N	1	1	315.333	1.922	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CCC([NH+]2CCOCC2)CC1	ZINC000600112601	358126886	/nfs/dbraw/zinc/12/68/86/358126886.db2.gz	RRWDNFIZMXAKPE-UHFFFAOYSA-N	1	1	309.322	1.125	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CC[N@H+]1C1CCCCC1	ZINC000600229133	358163538	/nfs/dbraw/zinc/16/35/38/358163538.db2.gz	PWLAWDBKMXZPGW-CYBMUJFWSA-N	1	1	321.381	1.315	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000600553246	358255038	/nfs/dbraw/zinc/25/50/38/358255038.db2.gz	TZKRPVZWSQPUDE-SNVBAGLBSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[NH+]1CCN(C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)CC1	ZINC000600885433	358338809	/nfs/dbraw/zinc/33/88/09/358338809.db2.gz	GYSIQGKXLLCSEL-UHFFFAOYSA-N	1	1	303.362	1.791	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Nc2ccsc2[N+](=O)[O-])CC1	ZINC000601116100	358408271	/nfs/dbraw/zinc/40/82/71/358408271.db2.gz	OEEPKQXOXZWXBJ-UHFFFAOYSA-N	1	1	312.395	1.621	20	5		DDBDMO
CN(CC(=O)NC1CC1)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601100993	358401672	/nfs/dbraw/zinc/40/16/72/358401672.db2.gz	SFPULKNUBPTEHT-UHFFFAOYSA-N	1	1	300.318	1.858	20	5		DDBDMO
C[N@H+]1CCN(CCNc2ncc(F)cc2[N+](=O)[O-])CC1(C)C	ZINC000601159971	358426443	/nfs/dbraw/zinc/42/64/43/358426443.db2.gz	OTCBRLNPVCHKSX-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601175890	358434256	/nfs/dbraw/zinc/43/42/56/358434256.db2.gz	RJFRCSYSFSARAW-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CCN1C[C@H](CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000601183490	358437763	/nfs/dbraw/zinc/43/77/63/358437763.db2.gz	CQCMWJGTLDTVQZ-NSHDSACASA-N	1	1	314.345	1.845	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CC([N@H+]4CC[C@@H](O)C4)C3)c2c1	ZINC000601185339	358438521	/nfs/dbraw/zinc/43/85/21/358438521.db2.gz	WOUXPWZOFWIYNO-CYBMUJFWSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601973312	358760075	/nfs/dbraw/zinc/76/00/75/358760075.db2.gz	JVXPQFJQNQMZCG-SDDRHHMPSA-N	1	1	305.334	1.500	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](O)C[C@@H]1c1ccccc1	ZINC000602839812	359229347	/nfs/dbraw/zinc/22/93/47/359229347.db2.gz	IVAMJXIHFUMBNX-HUUCEWRRSA-N	1	1	316.361	1.908	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](C)C[C@H]2CO)ccc1[N+](=O)[O-]	ZINC000602907662	359286639	/nfs/dbraw/zinc/28/66/39/359286639.db2.gz	ZSOGSBWINAQYED-ZDUSSCGKSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O	ZINC000602914822	359291537	/nfs/dbraw/zinc/29/15/37/359291537.db2.gz	JKZIHDPSPHUFJT-SMDDFHAHSA-N	1	1	312.395	1.085	20	5		DDBDMO
Cn1cc(C2=CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000602889941	359273729	/nfs/dbraw/zinc/27/37/29/359273729.db2.gz	XKBZQOUCHAJTNU-UHFFFAOYSA-N	1	1	302.338	1.314	20	5		DDBDMO
Cn1cc(C2=CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000602889941	359273731	/nfs/dbraw/zinc/27/37/31/359273731.db2.gz	XKBZQOUCHAJTNU-UHFFFAOYSA-N	1	1	302.338	1.314	20	5		DDBDMO
C[NH+](C)C[C@@]1(O)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891703	359275634	/nfs/dbraw/zinc/27/56/34/359275634.db2.gz	OCGNFKMXSUEMIY-INIZCTEOSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[NH+](C)C[C@@]1(O)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891703	359275639	/nfs/dbraw/zinc/27/56/39/359275639.db2.gz	OCGNFKMXSUEMIY-INIZCTEOSA-N	1	1	307.394	1.526	20	5		DDBDMO
CN(C)C[C@@]1(O)CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891703	359275643	/nfs/dbraw/zinc/27/56/43/359275643.db2.gz	OCGNFKMXSUEMIY-INIZCTEOSA-N	1	1	307.394	1.526	20	5		DDBDMO
CN(C)C[C@@]1(O)CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000602891703	359275646	/nfs/dbraw/zinc/27/56/46/359275646.db2.gz	OCGNFKMXSUEMIY-INIZCTEOSA-N	1	1	307.394	1.526	20	5		DDBDMO
O=[N+]([O-])c1cc(Cn2cc(C[N@H+]3CCC[C@@H]3CO)nn2)cs1	ZINC000603206261	359481059	/nfs/dbraw/zinc/48/10/59/359481059.db2.gz	ONBWHSOTVNMRBB-GFCCVEGCSA-N	1	1	323.378	1.253	20	5		DDBDMO
O=[N+]([O-])c1cc(Cn2cc(C[N@@H+]3CCC[C@@H]3CO)nn2)cs1	ZINC000603206261	359481061	/nfs/dbraw/zinc/48/10/61/359481061.db2.gz	ONBWHSOTVNMRBB-GFCCVEGCSA-N	1	1	323.378	1.253	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@@H]1O	ZINC000186915341	200030220	/nfs/dbraw/zinc/03/02/20/200030220.db2.gz	NTUAGCVDPLSWLR-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@@H]1O	ZINC000186915341	200030221	/nfs/dbraw/zinc/03/02/21/200030221.db2.gz	NTUAGCVDPLSWLR-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC1(C)[C@H](Nc2ccc([N+](=O)[O-])nc2)C[C@H]1[NH+]1CCOCC1	ZINC000603407689	359621675	/nfs/dbraw/zinc/62/16/75/359621675.db2.gz	SPOXAQZFCVGVCK-CHWSQXEVSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000187124624	200065967	/nfs/dbraw/zinc/06/59/67/200065967.db2.gz	GOKKRQVLLNAAHJ-UHFFFAOYSA-N	1	1	319.321	1.411	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000609357433	360300880	/nfs/dbraw/zinc/30/08/80/360300880.db2.gz	INVWVGHFTKJLGN-SNVBAGLBSA-N	1	1	321.333	1.395	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2cccnc2[N+](=O)[O-])CC1	ZINC000609111599	360260569	/nfs/dbraw/zinc/26/05/69/360260569.db2.gz	PIQMSQXLXHZROA-CYBMUJFWSA-N	1	1	307.398	1.675	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3cccnc3[N+](=O)[O-])CC2)C1	ZINC000609675160	360344126	/nfs/dbraw/zinc/34/41/26/360344126.db2.gz	ZVPIIDLMKINKNR-ZDUSSCGKSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000609471160	360311995	/nfs/dbraw/zinc/31/19/95/360311995.db2.gz	CWHGPHBJPFHBAN-LBPRGKRZSA-N	1	1	322.365	1.367	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2CCOc1cccc([N+](=O)[O-])c1	ZINC000610506556	360456319	/nfs/dbraw/zinc/45/63/19/360456319.db2.gz	BKNSRYAQLWXBEY-YPMHNXCESA-N	1	1	305.334	1.327	20	5		DDBDMO
CN(C)C(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])s2)CC1	ZINC000610756450	360528945	/nfs/dbraw/zinc/52/89/45/360528945.db2.gz	NJDKCTBQXJMMBT-UHFFFAOYSA-N	1	1	312.395	1.257	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H](O)C1CC1	ZINC000612086860	360913971	/nfs/dbraw/zinc/91/39/71/360913971.db2.gz	YZYIHLRJYCOCLA-GXTWGEPZSA-N	1	1	310.350	1.037	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCOCC2(CC2)C1	ZINC000612120810	360924919	/nfs/dbraw/zinc/92/49/19/360924919.db2.gz	XAOOTEIONWKJKW-CYBMUJFWSA-N	1	1	322.361	1.447	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619255014	363946621	/nfs/dbraw/zinc/94/66/21/363946621.db2.gz	SIMWKWIQUFEUSC-ZIAGYGMSSA-N	1	1	322.340	1.557	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000619759459	364143274	/nfs/dbraw/zinc/14/32/74/364143274.db2.gz	MPAXTROGFFDLEH-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[N@@H+](CC2CCC2)CC1	ZINC000619879243	364172150	/nfs/dbraw/zinc/17/21/50/364172150.db2.gz	NWPWSFRGJMMGFS-UHFFFAOYSA-N	1	1	307.354	1.266	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](O)CC1	ZINC000293013088	223352300	/nfs/dbraw/zinc/35/23/00/223352300.db2.gz	DRZOVRRKJLIZAR-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](O)CC1	ZINC000293013088	223352301	/nfs/dbraw/zinc/35/23/01/223352301.db2.gz	DRZOVRRKJLIZAR-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[NH2+][C@@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1cnn(C)c1	ZINC000261987855	203167791	/nfs/dbraw/zinc/16/77/91/203167791.db2.gz	KRSHZZHQFGVOSO-CYBMUJFWSA-N	1	1	303.322	1.536	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)C/C=C\c1ccccc1[N+](=O)[O-]	ZINC000350049649	284138779	/nfs/dbraw/zinc/13/87/79/284138779.db2.gz	QLSJTQUSYRYXPU-VURMDHGXSA-N	1	1	306.366	1.811	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000264731073	204111919	/nfs/dbraw/zinc/11/19/19/204111919.db2.gz	HXUYMPXAPFJXNP-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)c1csc([N+](=O)[O-])c1	ZINC000264798550	204164354	/nfs/dbraw/zinc/16/43/54/204164354.db2.gz	MLOGWLYUKWZVAW-UHFFFAOYSA-N	1	1	301.393	1.435	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)C(=O)NCCF	ZINC000282650524	217152178	/nfs/dbraw/zinc/15/21/78/217152178.db2.gz	LBNDWCRYIXYQJZ-SNVBAGLBSA-N	1	1	313.329	1.557	20	5		DDBDMO
CC[N@H+](CCO)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000267855044	206305765	/nfs/dbraw/zinc/30/57/65/206305765.db2.gz	DIMYOQKKXHQPKZ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CCO)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000267855044	206305766	/nfs/dbraw/zinc/30/57/66/206305766.db2.gz	DIMYOQKKXHQPKZ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000174646604	248373083	/nfs/dbraw/zinc/37/30/83/248373083.db2.gz	ZDNXYYLOAMEKLN-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
COc1ccccc1CC[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000174847597	248384624	/nfs/dbraw/zinc/38/46/24/248384624.db2.gz	KYYIEJQQXLGAMA-UHFFFAOYSA-N	1	1	304.350	1.974	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000106397043	194206069	/nfs/dbraw/zinc/20/60/69/194206069.db2.gz	OSUSBQCFCWVRAR-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](CC(C)(C)O)CC2)ccc1[N+](=O)[O-]	ZINC000106401843	194208028	/nfs/dbraw/zinc/20/80/28/194208028.db2.gz	LWTKDHGXCYFITD-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000109428750	194262182	/nfs/dbraw/zinc/26/21/82/194262182.db2.gz	WWQNEZCAGUATIQ-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939986	251289766	/nfs/dbraw/zinc/28/97/66/251289766.db2.gz	XTJUVCLSYINTFS-JOYOIKCWSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939986	251289772	/nfs/dbraw/zinc/28/97/72/251289772.db2.gz	XTJUVCLSYINTFS-JOYOIKCWSA-N	1	1	304.306	1.600	20	5		DDBDMO
NC(=O)c1cccc(NC[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-]	ZINC000340924593	251280227	/nfs/dbraw/zinc/28/02/27/251280227.db2.gz	NSLGUBBRXRJXBY-JTQLQIEISA-N	1	1	315.333	1.565	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H](C3CC[NH+](C)CC3)C2)c1[N+](=O)[O-]	ZINC000270063297	208120959	/nfs/dbraw/zinc/12/09/59/208120959.db2.gz	FPBBLVHPRAUKEW-GFCCVEGCSA-N	1	1	321.381	1.430	20	5		DDBDMO
COc1ccc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000272944065	210328866	/nfs/dbraw/zinc/32/88/66/210328866.db2.gz	MEKOGDSSZPPAPL-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](F)C1	ZINC000451199593	533137912	/nfs/dbraw/zinc/13/79/12/533137912.db2.gz	RGIFCSRBVPCBFO-JTQLQIEISA-N	1	1	311.313	1.976	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCC[C@@H]1O	ZINC000352692823	285232458	/nfs/dbraw/zinc/23/24/58/285232458.db2.gz	GZAWORRXVKCKKC-KBPBESRZSA-N	1	1	308.334	1.807	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)C[C@@H]1COCCN1	ZINC000422711135	533222772	/nfs/dbraw/zinc/22/27/72/533222772.db2.gz	GRAUZRNZMPFUIJ-WCQYABFASA-N	1	1	309.366	1.460	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCS(=O)(=O)C2)c(Cl)c1	ZINC000069144507	406686806	/nfs/dbraw/zinc/68/68/06/406686806.db2.gz	UVCZJPKTCFPGRI-JTQLQIEISA-N	1	1	318.782	1.915	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)[NH2+][C@H](C)C1	ZINC000070076794	406808435	/nfs/dbraw/zinc/80/84/35/406808435.db2.gz	QNYMVCFDOJRHAQ-NXEZZACHSA-N	1	1	313.379	1.274	20	5		DDBDMO
O=C(NCCC[NH+]1CCOCC1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000077221080	406981012	/nfs/dbraw/zinc/98/10/12/406981012.db2.gz	NWBPJRDXBCPTPN-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
CO[C@H]1CCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000076345141	406964893	/nfs/dbraw/zinc/96/48/93/406964893.db2.gz	GMFCEABNXJTZNJ-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000076345141	406964894	/nfs/dbraw/zinc/96/48/94/406964894.db2.gz	GMFCEABNXJTZNJ-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)cc1C	ZINC000088059692	407120668	/nfs/dbraw/zinc/12/06/68/407120668.db2.gz	MVGHFIXWQYTIKP-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCN1CCOCC1	ZINC000092974696	407193373	/nfs/dbraw/zinc/19/33/73/407193373.db2.gz	WDAYHAZRIKAWCK-GQCTYLIASA-N	1	1	305.378	1.872	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000063693018	407234309	/nfs/dbraw/zinc/23/43/09/407234309.db2.gz	ULHQOSXDNYIFJD-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
COC[C@@](C)(CC(=O)OC)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000123466185	407329632	/nfs/dbraw/zinc/32/96/32/407329632.db2.gz	APGDAEPDWIYXQB-CQSZACIVSA-N	1	1	314.313	1.792	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+](C)C2)c1	ZINC000104188958	407349242	/nfs/dbraw/zinc/34/92/42/407349242.db2.gz	KLEWDCXARQCRPB-JTQLQIEISA-N	1	1	309.391	1.998	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC[NH2+][C@H](C)C1	ZINC000124198739	407350874	/nfs/dbraw/zinc/35/08/74/407350874.db2.gz	OWYAETCEBVDMKE-SNVBAGLBSA-N	1	1	313.379	1.140	20	5		DDBDMO
CCOCC[N@H+](CC)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000107680924	407377860	/nfs/dbraw/zinc/37/78/60/407377860.db2.gz	ULMOBRHTZGPNDZ-UHFFFAOYSA-N	1	1	321.377	1.842	20	5		DDBDMO
CCOCC[N@@H+](CC)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000107680924	407377861	/nfs/dbraw/zinc/37/78/61/407377861.db2.gz	ULMOBRHTZGPNDZ-UHFFFAOYSA-N	1	1	321.377	1.842	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000112309288	407425527	/nfs/dbraw/zinc/42/55/27/407425527.db2.gz	JBFAJZRUFIBJHC-UHFFFAOYSA-N	1	1	311.386	1.375	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](CO)C3)n2)c1	ZINC000265831901	407474509	/nfs/dbraw/zinc/47/45/09/407474509.db2.gz	MRNRBOQZTUBJEL-LLVKDONJSA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](CO)C3)n2)c1	ZINC000265831901	407474514	/nfs/dbraw/zinc/47/45/14/407474514.db2.gz	MRNRBOQZTUBJEL-LLVKDONJSA-N	1	1	318.333	1.849	20	5		DDBDMO
CN(CC(=O)N(C)[C@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000266333749	407537531	/nfs/dbraw/zinc/53/75/31/407537531.db2.gz	WJELZZUJZGSIGL-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[N@H+](Cc1ccc(Cl)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266381960	407538185	/nfs/dbraw/zinc/53/81/85/407538185.db2.gz	AXAXNQDQOGCESE-AWEZNQCLSA-N	1	1	324.768	1.938	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000271304598	407627484	/nfs/dbraw/zinc/62/74/84/407627484.db2.gz	JQGLWVZHMYRODT-UHFFFAOYSA-N	1	1	309.351	1.281	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](O)C[C@H]1CO	ZINC000186518768	407690159	/nfs/dbraw/zinc/69/01/59/407690159.db2.gz	MFYKRSUJKGYKQX-KBPBESRZSA-N	1	1	310.350	1.310	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](O)C[C@H]1CO	ZINC000186518768	407690163	/nfs/dbraw/zinc/69/01/63/407690163.db2.gz	MFYKRSUJKGYKQX-KBPBESRZSA-N	1	1	310.350	1.310	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000130500327	407696740	/nfs/dbraw/zinc/69/67/40/407696740.db2.gz	BXTAWVNOKSJOEU-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
CN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000153493416	407836100	/nfs/dbraw/zinc/83/61/00/407836100.db2.gz	BEQJOTKGWPLPSF-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CCN([C@H]3CC[NH2+]C3)CC2)cc1	ZINC000262583741	407874032	/nfs/dbraw/zinc/87/40/32/407874032.db2.gz	ZKILLPCTQGZJHB-INIZCTEOSA-N	1	1	304.394	1.117	20	5		DDBDMO
Cn1ncc2c1CCC[C@@H]2[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000135561204	408031460	/nfs/dbraw/zinc/03/14/60/408031460.db2.gz	NVECDCTZMCOIPT-LBPRGKRZSA-N	1	1	304.354	1.534	20	5		DDBDMO
C[C@@H](NC(=O)CNc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000273060355	408038627	/nfs/dbraw/zinc/03/86/27/408038627.db2.gz	YJKRMQOLEQXAJS-GFCCVEGCSA-N	1	1	318.377	1.773	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000119440136	408070474	/nfs/dbraw/zinc/07/04/74/408070474.db2.gz	ZJYZFBNUKLGITF-UHFFFAOYSA-N	1	1	309.366	1.140	20	5		DDBDMO
C[N@@H+](CC(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1	ZINC000154825378	408092495	/nfs/dbraw/zinc/09/24/95/408092495.db2.gz	SQGVZNWSXLVTCX-AWEZNQCLSA-N	1	1	323.418	1.691	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000189572957	408055937	/nfs/dbraw/zinc/05/59/37/408055937.db2.gz	OQOOYPUHRYIPNQ-UONOGXRCSA-N	1	1	307.394	1.524	20	5		DDBDMO
CC[N@@H+](CCNc1ccc(C(=O)NC)cc1[N+](=O)[O-])C1CC1	ZINC000263754745	408241321	/nfs/dbraw/zinc/24/13/21/408241321.db2.gz	QEAMIDUODBLFJN-UHFFFAOYSA-N	1	1	306.366	1.851	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)CC[N@H+]1CCOC	ZINC000150768386	408196727	/nfs/dbraw/zinc/19/67/27/408196727.db2.gz	ONSMJZDDWHBYTP-ZDUSSCGKSA-N	1	1	308.382	1.845	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000246371218	408235611	/nfs/dbraw/zinc/23/56/11/408235611.db2.gz	LVUMSQJTJSQXSU-WDEREUQCSA-N	1	1	323.349	1.663	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccccc1	ZINC000176207813	408308967	/nfs/dbraw/zinc/30/89/67/408308967.db2.gz	MHAMGWCFDUYVFY-UHFFFAOYSA-N	1	1	303.322	1.362	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)Nc1ccccc1	ZINC000176207813	408308971	/nfs/dbraw/zinc/30/89/71/408308971.db2.gz	MHAMGWCFDUYVFY-UHFFFAOYSA-N	1	1	303.322	1.362	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000183195844	408350039	/nfs/dbraw/zinc/35/00/39/408350039.db2.gz	CMCIEMWMFLZBEV-TUAOUCFPSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@@H+]1CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000247268363	408440970	/nfs/dbraw/zinc/44/09/70/408440970.db2.gz	KGDKJGXCIKJHIH-SMDDNHRTSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000247268363	408440977	/nfs/dbraw/zinc/44/09/77/408440977.db2.gz	KGDKJGXCIKJHIH-SMDDNHRTSA-N	1	1	315.333	1.493	20	5		DDBDMO
CC(C)[N@@H+]1CCC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000274828899	408546953	/nfs/dbraw/zinc/54/69/53/408546953.db2.gz	YZLFSKDVDAYPLL-LBPRGKRZSA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000274828899	408546958	/nfs/dbraw/zinc/54/69/58/408546958.db2.gz	YZLFSKDVDAYPLL-LBPRGKRZSA-N	1	1	307.350	1.903	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccncc2)c1	ZINC000270544558	408573485	/nfs/dbraw/zinc/57/34/85/408573485.db2.gz	MBWJOXNFVCFQGS-LSDHHAIUSA-N	1	1	317.349	1.384	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184246855	408577953	/nfs/dbraw/zinc/57/79/53/408577953.db2.gz	FQIABSMWUNWUCY-VIFPVBQESA-N	1	1	314.313	1.983	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184246855	408577958	/nfs/dbraw/zinc/57/79/58/408577958.db2.gz	FQIABSMWUNWUCY-VIFPVBQESA-N	1	1	314.313	1.983	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1O	ZINC000249566285	408743430	/nfs/dbraw/zinc/74/34/30/408743430.db2.gz	NCLSMCTVUJXNSN-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1O	ZINC000249566285	408743433	/nfs/dbraw/zinc/74/34/33/408743433.db2.gz	NCLSMCTVUJXNSN-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[NH+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000265529859	408685117	/nfs/dbraw/zinc/68/51/17/408685117.db2.gz	FHBATYZRYQNUOB-UHFFFAOYSA-N	1	1	311.769	1.955	20	5		DDBDMO
O=C1NCC[C@H]1[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000178206424	408786639	/nfs/dbraw/zinc/78/66/39/408786639.db2.gz	LOHMIJZNRBHBRW-CQSZACIVSA-N	1	1	305.334	1.327	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CCC(N)=O)cccc1[N+](=O)[O-]	ZINC000286354492	408968793	/nfs/dbraw/zinc/96/87/93/408968793.db2.gz	HDLPMRFJPWHFKW-SNVBAGLBSA-N	1	1	308.338	1.037	20	5		DDBDMO
CC(C)([NH2+]CC(=O)Nc1nncs1)c1ccccc1[N+](=O)[O-]	ZINC000292113473	408983891	/nfs/dbraw/zinc/98/38/91/408983891.db2.gz	JIZABEIYFMPSBQ-UHFFFAOYSA-N	1	1	321.362	1.910	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-]	ZINC000292269748	409013126	/nfs/dbraw/zinc/01/31/26/409013126.db2.gz	QARTYDXPLQBCIV-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1C[N@@H+](C)CCN1C	ZINC000287549768	409053714	/nfs/dbraw/zinc/05/37/14/409053714.db2.gz	WGCFISWEVPXTKZ-ZDUSSCGKSA-N	1	1	306.366	1.455	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H]1C[N@H+](C)CCN1C	ZINC000287549768	409053716	/nfs/dbraw/zinc/05/37/16/409053716.db2.gz	WGCFISWEVPXTKZ-ZDUSSCGKSA-N	1	1	306.366	1.455	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](O)CC3)n2)cc1	ZINC000293269555	409079762	/nfs/dbraw/zinc/07/97/62/409079762.db2.gz	UVRDGSZVUWRKOD-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](O)CC3)n2)cc1	ZINC000293269555	409079765	/nfs/dbraw/zinc/07/97/65/409079765.db2.gz	UVRDGSZVUWRKOD-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(CNC(=O)C2)C1	ZINC000278865668	409103908	/nfs/dbraw/zinc/10/39/08/409103908.db2.gz	LRSGUBJFWFIMEE-OAHLLOKOSA-N	1	1	305.334	1.315	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+](C2CCC2)C1	ZINC000293604298	409146288	/nfs/dbraw/zinc/14/62/88/409146288.db2.gz	DCMHEUKNMJIJKT-SNVBAGLBSA-N	1	1	307.354	1.264	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000288610878	409172656	/nfs/dbraw/zinc/17/26/56/409172656.db2.gz	WZXQKNDXZAYYJQ-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000288610878	409172658	/nfs/dbraw/zinc/17/26/58/409172658.db2.gz	WZXQKNDXZAYYJQ-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1C1CC1	ZINC000279492341	409223707	/nfs/dbraw/zinc/22/37/07/409223707.db2.gz	RSEFPJUUPNLAIC-RKDXNWHRSA-N	1	1	322.340	1.671	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[N@@H+](CCO)CC1	ZINC000283977274	409250640	/nfs/dbraw/zinc/25/06/40/409250640.db2.gz	ZRNURLKZDZZHSD-UHFFFAOYSA-N	1	1	307.350	1.302	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000280274026	409282880	/nfs/dbraw/zinc/28/28/80/409282880.db2.gz	MWOGCSFGFNYAOQ-ZDUSSCGKSA-N	1	1	308.294	1.200	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)c1[N+](=O)[O-]	ZINC000295221625	409381907	/nfs/dbraw/zinc/38/19/07/409381907.db2.gz	MTWNCPNVCUMRFO-CYBMUJFWSA-N	1	1	313.333	1.044	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)c1[N+](=O)[O-]	ZINC000295221625	409381913	/nfs/dbraw/zinc/38/19/13/409381913.db2.gz	MTWNCPNVCUMRFO-CYBMUJFWSA-N	1	1	313.333	1.044	20	5		DDBDMO
C[N@H+](Cc1ccccn1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000295243785	409394392	/nfs/dbraw/zinc/39/43/92/409394392.db2.gz	YKTZZNBLLJOMGD-OAHLLOKOSA-N	1	1	317.345	1.862	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357056813	164138310	/nfs/dbraw/zinc/13/83/10/164138310.db2.gz	XZGLJNYDMVITDQ-NSHDSACASA-N	1	1	309.370	1.275	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000408182339	164254075	/nfs/dbraw/zinc/25/40/75/164254075.db2.gz	JJSXAAJFPIDZKI-RYUDHWBXSA-N	1	1	306.366	1.632	20	5		DDBDMO
C[C@@H]1C[N@@H+](C2CC2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798517	409617095	/nfs/dbraw/zinc/61/70/95/409617095.db2.gz	GLOLHYMIOYYQEO-YMTOWFKASA-N	1	1	305.334	1.513	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798517	409617097	/nfs/dbraw/zinc/61/70/97/409617097.db2.gz	GLOLHYMIOYYQEO-YMTOWFKASA-N	1	1	305.334	1.513	20	5		DDBDMO
C[C@@H]1C[N@@H+](C2CC2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798492	409618274	/nfs/dbraw/zinc/61/82/74/409618274.db2.gz	GLOLHYMIOYYQEO-OTYXRUKQSA-N	1	1	305.334	1.513	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798492	409618277	/nfs/dbraw/zinc/61/82/77/409618277.db2.gz	GLOLHYMIOYYQEO-OTYXRUKQSA-N	1	1	305.334	1.513	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccccn2)cc1	ZINC000342351062	409586020	/nfs/dbraw/zinc/58/60/20/409586020.db2.gz	ZNOVJWKYPKZRGG-UHFFFAOYSA-N	1	1	321.358	1.553	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356851426	409660860	/nfs/dbraw/zinc/66/08/60/409660860.db2.gz	MPTRJULPERWSEL-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356851426	409660863	/nfs/dbraw/zinc/66/08/63/409660863.db2.gz	MPTRJULPERWSEL-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[N@@H+](CC[C@@H]1CCCO1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000342609860	409763249	/nfs/dbraw/zinc/76/32/49/409763249.db2.gz	WGULFFXXYIXQOS-GJZGRUSLSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@@H+](CC[C@H]1CCCO1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000342609862	409763708	/nfs/dbraw/zinc/76/37/08/409763708.db2.gz	WGULFFXXYIXQOS-HUUCEWRRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357052079	409821598	/nfs/dbraw/zinc/82/15/98/409821598.db2.gz	QXMANWCXANSZMM-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
CC(C)CC[C@H](O)C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298146610	410123188	/nfs/dbraw/zinc/12/31/88/410123188.db2.gz	RFQPMBBMGNTMFF-AWEZNQCLSA-N	1	1	322.409	1.909	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@H](O)C1	ZINC000351787261	410234353	/nfs/dbraw/zinc/23/43/53/410234353.db2.gz	YTGXOEZMEGSNIZ-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1C	ZINC000351940184	410352984	/nfs/dbraw/zinc/35/29/84/410352984.db2.gz	ZUCYTKUUCNAYSQ-VHSXEESVSA-N	1	1	307.354	1.127	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@H+]([C@H](C)CO)CC2)c1	ZINC000347152521	410364856	/nfs/dbraw/zinc/36/48/56/410364856.db2.gz	YPUXJGUXIIUGCM-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000298735794	410371123	/nfs/dbraw/zinc/37/11/23/410371123.db2.gz	KLTUWDHVYUVGKW-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cc(C(N)=O)no1	ZINC000347367295	410497973	/nfs/dbraw/zinc/49/79/73/410497973.db2.gz	FFYHXMHDVQMKQY-YHYXMXQVSA-N	1	1	316.317	1.875	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000299123461	410532558	/nfs/dbraw/zinc/53/25/58/410532558.db2.gz	WZFZFRVGHFYIDT-UHFFFAOYSA-N	1	1	306.366	1.484	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000299210920	410571458	/nfs/dbraw/zinc/57/14/58/410571458.db2.gz	CUKTUDNTPCVFLW-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
O=C(CCN1C[C@H]2C[NH2+]C[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000359305292	410591756	/nfs/dbraw/zinc/59/17/56/410591756.db2.gz	KTBHMENRKKTCNT-TXEJJXNPSA-N	1	1	304.350	1.075	20	5		DDBDMO
CC[N@@H+](C[C@H](C)O)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000352202909	410544984	/nfs/dbraw/zinc/54/49/84/410544984.db2.gz	NLQALLCWHRECLO-CMPLNLGQSA-N	1	1	309.366	1.933	20	5		DDBDMO
CNC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000301208215	410675567	/nfs/dbraw/zinc/67/55/67/410675567.db2.gz	QSUUCKRHZVLQKG-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
C[C@H]1C[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000352952637	410697783	/nfs/dbraw/zinc/69/77/83/410697783.db2.gz	VXJVMUKNUPRGIM-QWRGUYRKSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1CC(C)(C)O	ZINC000330449419	410697848	/nfs/dbraw/zinc/69/78/48/410697848.db2.gz	HMMUDEHGXFNEKA-LBPRGKRZSA-N	1	1	323.393	1.577	20	5		DDBDMO
C[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000330449419	410697854	/nfs/dbraw/zinc/69/78/54/410697854.db2.gz	HMMUDEHGXFNEKA-LBPRGKRZSA-N	1	1	323.393	1.577	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000337375107	410744118	/nfs/dbraw/zinc/74/41/18/410744118.db2.gz	ZVPPBUKJRAWFPF-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000330599616	410815451	/nfs/dbraw/zinc/81/54/51/410815451.db2.gz	ULMZLCIZBONOSL-VXGBXAGGSA-N	1	1	307.350	1.525	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C)[C@H]1CO	ZINC000330549384	410769945	/nfs/dbraw/zinc/76/99/45/410769945.db2.gz	DFIMTDQAFADQER-SMDDNHRTSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C)[C@H]1CO	ZINC000330549384	410769948	/nfs/dbraw/zinc/76/99/48/410769948.db2.gz	DFIMTDQAFADQER-SMDDNHRTSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCNC1=O	ZINC000340222397	410772632	/nfs/dbraw/zinc/77/26/32/410772632.db2.gz	MHFIGONZHKTCSP-CYBMUJFWSA-N	1	1	320.349	1.052	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000330586594	410801063	/nfs/dbraw/zinc/80/10/63/410801063.db2.gz	LTWHXYXSZQRZMB-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
CCc1nn(C)c(N2CC[N@H+](CCOC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000301914549	410826561	/nfs/dbraw/zinc/82/65/61/410826561.db2.gz	FUPFVHWUUHMGHF-NSHDSACASA-N	1	1	311.386	1.048	20	5		DDBDMO
CCc1nn(C)c(N2CC[N@@H+](CCOC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000301914549	410826568	/nfs/dbraw/zinc/82/65/68/410826568.db2.gz	FUPFVHWUUHMGHF-NSHDSACASA-N	1	1	311.386	1.048	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CCCCC2)n1	ZINC000330656080	410854279	/nfs/dbraw/zinc/85/42/79/410854279.db2.gz	OMMQKXZXTIZKSN-UHFFFAOYSA-N	1	1	309.370	1.323	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000344054453	410924511	/nfs/dbraw/zinc/92/45/11/410924511.db2.gz	IXZSRJJQWUKLAJ-LNSITVRQSA-N	1	1	322.361	1.685	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1ncnc2cccc([N+](=O)[O-])c21	ZINC000337762998	410988224	/nfs/dbraw/zinc/98/82/24/410988224.db2.gz	AKSWPAUSKWUYGA-UHFFFAOYSA-N	1	1	312.333	2.545	20	5		DDBDMO
C[C@@H](C(=O)NCCc1ccc([N+](=O)[O-])cc1)[NH+]1CCSCC1	ZINC000131387123	196164262	/nfs/dbraw/zinc/16/42/62/196164262.db2.gz	MKZFZNMDIVTQBZ-LBPRGKRZSA-N	1	1	323.418	1.691	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000362086965	307013711	/nfs/dbraw/zinc/01/37/11/307013711.db2.gz	LFXAKBUVMMJIAF-NWDGAFQWSA-N	1	1	310.350	1.542	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461925	418431240	/nfs/dbraw/zinc/43/12/40/418431240.db2.gz	SIWSWKUMUOWVGP-QKPAOTATSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461925	418431243	/nfs/dbraw/zinc/43/12/43/418431243.db2.gz	SIWSWKUMUOWVGP-QKPAOTATSA-N	1	1	315.373	1.242	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1	ZINC000373461925	418431245	/nfs/dbraw/zinc/43/12/45/418431245.db2.gz	SIWSWKUMUOWVGP-QKPAOTATSA-N	1	1	315.373	1.242	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@H]3CCSC3)CC2)n1	ZINC000366299026	418453418	/nfs/dbraw/zinc/45/34/18/418453418.db2.gz	SUOJBIIHXDKYER-LBPRGKRZSA-N	1	1	308.407	1.926	20	5		DDBDMO
Cc1cc(C2=CC[N@@H+]([C@H]3CCNC3=O)CC2)cc([N+](=O)[O-])c1N	ZINC000366488882	418480273	/nfs/dbraw/zinc/48/02/73/418480273.db2.gz	UZRHEIISWHTEMO-ZDUSSCGKSA-N	1	1	316.361	1.463	20	5		DDBDMO
Cc1cc(C2=CC[N@H+]([C@H]3CCNC3=O)CC2)cc([N+](=O)[O-])c1N	ZINC000366488882	418480276	/nfs/dbraw/zinc/48/02/76/418480276.db2.gz	UZRHEIISWHTEMO-ZDUSSCGKSA-N	1	1	316.361	1.463	20	5		DDBDMO
C=Cn1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000193983960	222168804	/nfs/dbraw/zinc/16/88/04/222168804.db2.gz	MFUWDVPSMQCTKO-ZDUSSCGKSA-N	1	1	314.349	1.973	20	5		DDBDMO
CC(C)C[N@@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])s2)C1	ZINC000195506418	222203531	/nfs/dbraw/zinc/20/35/31/222203531.db2.gz	DVYBRKMCUOAFOQ-JTQLQIEISA-N	1	1	300.384	1.820	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNc2ncc([N+](=O)[O-])s2)C1	ZINC000195506418	222203535	/nfs/dbraw/zinc/20/35/35/222203535.db2.gz	DVYBRKMCUOAFOQ-JTQLQIEISA-N	1	1	300.384	1.820	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CCOc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000375034707	418591800	/nfs/dbraw/zinc/59/18/00/418591800.db2.gz	DDUATUHTINATFK-UKRRQHHQSA-N	1	1	305.378	2.000	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000361414269	418647917	/nfs/dbraw/zinc/64/79/17/418647917.db2.gz	ILSFYHKNTIMSRU-BXUZGUMPSA-N	1	1	310.350	1.180	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@H](n3cncn3)C2)cc1[N+](=O)[O-]	ZINC000375331650	418628751	/nfs/dbraw/zinc/62/87/51/418628751.db2.gz	IUSWRMIFSWAVQI-LBPRGKRZSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](n3cncn3)C2)cc1[N+](=O)[O-]	ZINC000375331650	418628753	/nfs/dbraw/zinc/62/87/53/418628753.db2.gz	IUSWRMIFSWAVQI-LBPRGKRZSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2CC[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC000361361351	418633842	/nfs/dbraw/zinc/63/38/42/418633842.db2.gz	GBAIXFMVJSLITO-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[N@@H+](CCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)C(C)C	ZINC000357256833	418651199	/nfs/dbraw/zinc/65/11/99/418651199.db2.gz	AXNTXYKJFBLMQI-UHFFFAOYSA-N	1	1	319.365	2.386	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2C(=O)NC[C@H]2C1	ZINC000368230636	418706631	/nfs/dbraw/zinc/70/66/31/418706631.db2.gz	DYQZQBXUCHKQSW-GXTWGEPZSA-N	1	1	319.361	1.561	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000361592163	418688704	/nfs/dbraw/zinc/68/87/04/418688704.db2.gz	AGJGJECJMZDLKJ-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000361592163	418688708	/nfs/dbraw/zinc/68/87/08/418688708.db2.gz	AGJGJECJMZDLKJ-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000361593755	418689686	/nfs/dbraw/zinc/68/96/86/418689686.db2.gz	HICVYHGTKJRNPY-KGLIPLIRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000364621816	418794141	/nfs/dbraw/zinc/79/41/41/418794141.db2.gz	FBMXTYVBVSNCEX-UZWSLXQKSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000364621816	418794144	/nfs/dbraw/zinc/79/41/44/418794144.db2.gz	FBMXTYVBVSNCEX-UZWSLXQKSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000364621816	418794146	/nfs/dbraw/zinc/79/41/46/418794146.db2.gz	FBMXTYVBVSNCEX-UZWSLXQKSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000372973149	418917599	/nfs/dbraw/zinc/91/75/99/418917599.db2.gz	JCTIBSAUMWBMQP-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21	ZINC000425049914	228355102	/nfs/dbraw/zinc/35/51/02/228355102.db2.gz	PYQJLYYWWBSAPT-SMDDNHRTSA-N	1	1	304.350	1.464	20	5		DDBDMO
COc1ccc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000421700063	419690344	/nfs/dbraw/zinc/69/03/44/419690344.db2.gz	CXXJNMBQJPLKPC-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2c(N)cccc2[N+](=O)[O-])cc[nH+]1	ZINC000354557015	306779411	/nfs/dbraw/zinc/77/94/11/306779411.db2.gz	VRBSROBPHPGFIB-UHFFFAOYSA-N	1	1	301.306	1.890	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1(CO)CCC1	ZINC000429227233	419987334	/nfs/dbraw/zinc/98/73/34/419987334.db2.gz	NWGGWHOFGCSFJQ-ZDUSSCGKSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CNCC[C@@H]1C	ZINC000423355973	420025109	/nfs/dbraw/zinc/02/51/09/420025109.db2.gz	GCHPJJCJACRMQK-ZOWXZIJZSA-N	1	1	320.393	1.900	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[C@@H](NC[C@H]1C[NH2+]CCCO1)C1CC1	ZINC000423494112	420061779	/nfs/dbraw/zinc/06/17/79/420061779.db2.gz	RPTADJVHIPDEGC-HZPDHXFCSA-N	1	1	319.405	1.884	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC(F)(F)C[NH3+]	ZINC000415756777	420168104	/nfs/dbraw/zinc/16/81/04/420168104.db2.gz	FJRXFOYAYFEIRD-UHFFFAOYSA-N	1	1	302.281	1.873	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000423966239	420285841	/nfs/dbraw/zinc/28/58/41/420285841.db2.gz	IIRKNMBROUZEID-HNNXBMFYSA-N	1	1	312.329	1.777	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000423969124	420287035	/nfs/dbraw/zinc/28/70/35/420287035.db2.gz	LGHAPHDEXPXGER-GFCCVEGCSA-N	1	1	301.306	1.105	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000416296422	420313409	/nfs/dbraw/zinc/31/34/09/420313409.db2.gz	NVKSLGUSTQTOLW-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c(C)cc1[N+](=O)[O-]	ZINC000416383564	420351687	/nfs/dbraw/zinc/35/16/87/420351687.db2.gz	DWZSRIPZLGUGLJ-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c(C)cc1[N+](=O)[O-]	ZINC000416383564	420351690	/nfs/dbraw/zinc/35/16/90/420351690.db2.gz	DWZSRIPZLGUGLJ-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
CN(C)c1[nH+]cc(CN2CCc3ccc([N+](=O)[O-])cc3C2)n1C	ZINC000425341716	420360051	/nfs/dbraw/zinc/36/00/51/420360051.db2.gz	XUPBISLZBFUEMS-UHFFFAOYSA-N	1	1	315.377	1.953	20	5		DDBDMO
Cc1sc(S(=O)(=O)NC[C@@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000416496863	420394778	/nfs/dbraw/zinc/39/47/78/420394778.db2.gz	RAAAQMPMCPUICL-VIFPVBQESA-N	1	1	319.408	1.195	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)[C@@H](C)O1	ZINC000446061668	230222684	/nfs/dbraw/zinc/22/26/84/230222684.db2.gz	RCNGODKAIKJIBX-RQJABVFESA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)[C@@H](C)O1	ZINC000446061668	230222687	/nfs/dbraw/zinc/22/26/87/230222687.db2.gz	RCNGODKAIKJIBX-RQJABVFESA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439102608	420479491	/nfs/dbraw/zinc/47/94/91/420479491.db2.gz	TXGOKJUPKPOUGA-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ncnc2sc([N+](=O)[O-])cc21	ZINC000450950242	420569278	/nfs/dbraw/zinc/56/92/78/420569278.db2.gz	CHNONMDLMHPDDN-SECBINFHSA-N	1	1	323.378	1.102	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@H](O)C[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000452068829	420620326	/nfs/dbraw/zinc/62/03/26/420620326.db2.gz	PCPCWBCBKNHKGC-WCQYABFASA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000487948954	421059559	/nfs/dbraw/zinc/05/95/59/421059559.db2.gz	MYWBOJQSNDAASZ-TZMCWYRMSA-N	1	1	305.378	1.793	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488725272	421108480	/nfs/dbraw/zinc/10/84/80/421108480.db2.gz	ALCAOBWMBAYRQG-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488725272	421108482	/nfs/dbraw/zinc/10/84/82/421108482.db2.gz	ALCAOBWMBAYRQG-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000488724932	421108838	/nfs/dbraw/zinc/10/88/38/421108838.db2.gz	AXHIHJCOCBBSEZ-GHMZBOCLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000525804610	421303368	/nfs/dbraw/zinc/30/33/68/421303368.db2.gz	FHHOMFUTJUKDLI-ZDUSSCGKSA-N	1	1	320.393	1.489	20	5		DDBDMO
C[C@@H](C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000562302204	421349539	/nfs/dbraw/zinc/34/95/39/421349539.db2.gz	VLQWCSQZLHUGHS-BNOWGMLFSA-N	1	1	303.362	1.718	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000562850368	421420473	/nfs/dbraw/zinc/42/04/73/421420473.db2.gz	QSZMQSGRAOPNJX-LBPRGKRZSA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000562850368	421420474	/nfs/dbraw/zinc/42/04/74/421420474.db2.gz	QSZMQSGRAOPNJX-LBPRGKRZSA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000562933253	421428283	/nfs/dbraw/zinc/42/82/83/421428283.db2.gz	CLVYUJFESHVXPJ-CYBMUJFWSA-N	1	1	306.366	1.220	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C	ZINC000548403848	421434037	/nfs/dbraw/zinc/43/40/37/421434037.db2.gz	HDWYBMFEWHFEPW-CYBMUJFWSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC1(C)[C@H](O)C[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000563821272	421546626	/nfs/dbraw/zinc/54/66/26/421546626.db2.gz	QBJIKQSUAFPMTP-VXGBXAGGSA-N	1	1	318.333	1.894	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-]	ZINC000533827339	421683845	/nfs/dbraw/zinc/68/38/45/421683845.db2.gz	BCKFMSAUCJBLBH-GFCCVEGCSA-N	1	1	315.333	1.543	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-]	ZINC000533827339	421683849	/nfs/dbraw/zinc/68/38/49/421683849.db2.gz	BCKFMSAUCJBLBH-GFCCVEGCSA-N	1	1	315.333	1.543	20	5		DDBDMO
O=C(Cn1c[nH+]c2c1CCCC2)NCc1cccc([N+](=O)[O-])c1	ZINC000543645788	421839512	/nfs/dbraw/zinc/83/95/12/421839512.db2.gz	CDIUWKTXJAXAEQ-UHFFFAOYSA-N	1	1	314.345	1.987	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2ccc(N)c([N+](=O)[O-])n2)C[C@H](C)O1	ZINC000590571734	422320351	/nfs/dbraw/zinc/32/03/51/422320351.db2.gz	GULPJLOBHUHDBG-PHIMTYICSA-N	1	1	323.397	1.872	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)CCn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000344477073	272034002	/nfs/dbraw/zinc/03/40/02/272034002.db2.gz	YSSDARZFKGKOHI-TXEJJXNPSA-N	1	1	323.397	1.431	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000345962908	272376798	/nfs/dbraw/zinc/37/67/98/272376798.db2.gz	PTDVYNBGDNIVOT-WDEREUQCSA-N	1	1	306.366	1.732	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](Cc3cccs3)CC2)nc1	ZINC000302153255	275041091	/nfs/dbraw/zinc/04/10/91/275041091.db2.gz	LMFONTCZJNJYQL-UHFFFAOYSA-N	1	1	305.363	1.769	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000279192438	276041394	/nfs/dbraw/zinc/04/13/94/276041394.db2.gz	KDDMUVNSOIQADB-AOOOYVTPSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000279192438	276041395	/nfs/dbraw/zinc/04/13/95/276041395.db2.gz	KDDMUVNSOIQADB-AOOOYVTPSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000279192438	276041397	/nfs/dbraw/zinc/04/13/97/276041397.db2.gz	KDDMUVNSOIQADB-AOOOYVTPSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1	ZINC000183120774	279031884	/nfs/dbraw/zinc/03/18/84/279031884.db2.gz	URVOVVWSZFOTNM-AWEZNQCLSA-N	1	1	320.349	1.156	20	5		DDBDMO
C[C@H](c1cccs1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246705829	282008166	/nfs/dbraw/zinc/00/81/66/282008166.db2.gz	JXKPKNZWVOZHHW-ZYHUDNBSSA-N	1	1	310.379	1.907	20	5		DDBDMO
C[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)[NH+]1CCSCC1	ZINC000089304767	298156937	/nfs/dbraw/zinc/15/69/37/298156937.db2.gz	TZBUOJWSSPPKTB-GFCCVEGCSA-N	1	1	323.418	1.691	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000354005115	298336800	/nfs/dbraw/zinc/33/68/00/298336800.db2.gz	FBRLTGKWFHQBBU-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1	ZINC000354241686	298379101	/nfs/dbraw/zinc/37/91/01/298379101.db2.gz	XQQNJUGCVINPGO-GFCCVEGCSA-N	1	1	316.361	1.617	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000362905825	300175195	/nfs/dbraw/zinc/17/51/95/300175195.db2.gz	JRZIVCSYBGNOEG-AWEZNQCLSA-N	1	1	319.361	1.670	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000362982491	300193778	/nfs/dbraw/zinc/19/37/78/300193778.db2.gz	MEEQCJVGNRZGER-GXFFZTMASA-N	1	1	304.350	1.072	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)cc([N+](=O)[O-])c1	ZINC000363125567	300215747	/nfs/dbraw/zinc/21/57/47/300215747.db2.gz	RFBOOHWYROVARE-HIFRSBDPSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000368579791	301056611	/nfs/dbraw/zinc/05/66/11/301056611.db2.gz	UIIKPGDLXUFWMH-WDEREUQCSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000531506000	303247695	/nfs/dbraw/zinc/24/76/95/303247695.db2.gz	BBDFBTLFIRGBNT-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000532988075	303303371	/nfs/dbraw/zinc/30/33/71/303303371.db2.gz	JOEZQXXEMXZRBO-UHFFFAOYSA-N	1	1	307.350	1.668	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@@H](c2[nH]cc[nH+]2)C1	ZINC000420586178	303347582	/nfs/dbraw/zinc/34/75/82/303347582.db2.gz	OPCUEQXDUGEUTL-SNVBAGLBSA-N	1	1	315.333	1.801	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000548387562	303585752	/nfs/dbraw/zinc/58/57/52/303585752.db2.gz	NXNDHIRQQCFIEI-UHFFFAOYSA-N	1	1	315.333	1.209	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)c1	ZINC000361925043	307011437	/nfs/dbraw/zinc/01/14/37/307011437.db2.gz	IDIUPVGKISDPFJ-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C3CCN(C)CC3)C2)n1	ZINC000363779155	307035658	/nfs/dbraw/zinc/03/56/58/307035658.db2.gz	CGYYRDNVFCJRSR-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)n1	ZINC000363779155	307035659	/nfs/dbraw/zinc/03/56/59/307035659.db2.gz	CGYYRDNVFCJRSR-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000371511977	307151824	/nfs/dbraw/zinc/15/18/24/307151824.db2.gz	ULRSRLPAANYTGF-STQMWFEESA-N	1	1	319.361	1.960	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000372864757	307175163	/nfs/dbraw/zinc/17/51/63/307175163.db2.gz	ABGHAJZUPPGXLZ-ZDUSSCGKSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@@H+]2CCOc1cccc([N+](=O)[O-])c1	ZINC000374072841	307202430	/nfs/dbraw/zinc/20/24/30/307202430.db2.gz	UNQHARNDWKREFZ-ZIAGYGMSSA-N	1	1	305.334	1.184	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](CCn1ccc([N+](=O)[O-])n1)CC2	ZINC000374390424	307207256	/nfs/dbraw/zinc/20/72/56/307207256.db2.gz	WGOGYLZULQRHJP-UHFFFAOYSA-N	1	1	316.361	1.901	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCCC23CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000375942952	307234767	/nfs/dbraw/zinc/23/47/67/307234767.db2.gz	RXBFWEUSKDVHIC-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](n2cncn2)C1	ZINC000377217218	307266358	/nfs/dbraw/zinc/26/63/58/307266358.db2.gz	XRMNYRMIIGWGKR-ZDUSSCGKSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](n2cncn2)C1	ZINC000377217218	307266359	/nfs/dbraw/zinc/26/63/59/307266359.db2.gz	XRMNYRMIIGWGKR-ZDUSSCGKSA-N	1	1	303.322	1.642	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000582961067	337218980	/nfs/dbraw/zinc/21/89/80/337218980.db2.gz	NAGWPXJPPUBOJV-LLVKDONJSA-N	1	1	303.366	1.997	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@]1(C)CO	ZINC000595874490	490371993	/nfs/dbraw/zinc/37/19/93/490371993.db2.gz	PCNNODFNRQTKFK-BZNIZROVSA-N	1	1	322.361	1.912	20	5		DDBDMO
C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304290276	533755918	/nfs/dbraw/zinc/75/59/18/533755918.db2.gz	CFDLHPLGNGUOLU-DHMWGJHJSA-N	1	1	308.382	1.805	20	5		DDBDMO
COc1cc(CN2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000419344558	533829003	/nfs/dbraw/zinc/82/90/03/533829003.db2.gz	SAOSHEOHHYWYNH-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
Cc1c(NC(=O)CCN2CCC[N@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000298120491	533899727	/nfs/dbraw/zinc/89/97/27/533899727.db2.gz	SYHGIRMRCYZVQH-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000298120491	533899737	/nfs/dbraw/zinc/89/97/37/533899737.db2.gz	SYHGIRMRCYZVQH-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000298120491	533899742	/nfs/dbraw/zinc/89/97/42/533899742.db2.gz	SYHGIRMRCYZVQH-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](O)C12CCCC2	ZINC000292839964	534320311	/nfs/dbraw/zinc/32/03/11/534320311.db2.gz	UUHSWKFYHIZJMX-ZDUSSCGKSA-N	1	1	307.350	1.136	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](S(N)(=O)=O)C1	ZINC000330715829	534348454	/nfs/dbraw/zinc/34/84/54/534348454.db2.gz	SYXIJMYRMRVWQN-CMPLNLGQSA-N	1	1	313.379	1.327	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H](S(N)(=O)=O)C1	ZINC000330715829	534348458	/nfs/dbraw/zinc/34/84/58/534348458.db2.gz	SYXIJMYRMRVWQN-CMPLNLGQSA-N	1	1	313.379	1.327	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000331341072	528936408	/nfs/dbraw/zinc/93/64/08/528936408.db2.gz	NKUSBWNPWSIBQE-UHFFFAOYSA-N	1	1	322.365	1.547	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736328957	598420725	/nfs/dbraw/zinc/42/07/25/598420725.db2.gz	ZMTWTQCFYGRWRP-SNVBAGLBSA-N	1	1	319.369	1.917	20	5		DDBDMO
CC[N@@H+](CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1)C(C)C	ZINC000736536058	598500581	/nfs/dbraw/zinc/50/05/81/598500581.db2.gz	AHHZECBYFWKFLI-UHFFFAOYSA-N	1	1	320.357	1.312	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)C1)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000736847531	598797233	/nfs/dbraw/zinc/79/72/33/598797233.db2.gz	GQTAKSLIKUUFFT-SNVBAGLBSA-N	1	1	317.353	1.163	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000821241148	606731716	/nfs/dbraw/zinc/73/17/16/606731716.db2.gz	KGNQDKJJBORQJO-BXKDBHETSA-N	1	1	317.353	1.527	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000063762172	696330624	/nfs/dbraw/zinc/33/06/24/696330624.db2.gz	CPQQTHRXSHLORR-UHFFFAOYSA-N	1	1	320.393	1.585	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000194731288	697719466	/nfs/dbraw/zinc/71/94/66/697719466.db2.gz	VDNBNMMSYIWDFL-NSHDSACASA-N	1	1	322.321	1.635	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccnn1C	ZINC000774205668	697854780	/nfs/dbraw/zinc/85/47/80/697854780.db2.gz	ZWYGIBALAYHGBX-JTQLQIEISA-N	1	1	303.322	1.618	20	5		DDBDMO
CN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000776581634	698120852	/nfs/dbraw/zinc/12/08/52/698120852.db2.gz	FQAHGJLKHUBMJI-CVEARBPZSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C2CC2)C1	ZINC000776581634	698120854	/nfs/dbraw/zinc/12/08/54/698120854.db2.gz	FQAHGJLKHUBMJI-CVEARBPZSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN(C2CC2)C1	ZINC000776581634	698120856	/nfs/dbraw/zinc/12/08/56/698120856.db2.gz	FQAHGJLKHUBMJI-CVEARBPZSA-N	1	1	305.378	1.797	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582149	698121088	/nfs/dbraw/zinc/12/10/88/698121088.db2.gz	RKFKOZGLDACWKR-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582149	698121090	/nfs/dbraw/zinc/12/10/90/698121090.db2.gz	RKFKOZGLDACWKR-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
CN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000750066369	700201942	/nfs/dbraw/zinc/20/19/42/700201942.db2.gz	ISYXXUOBHMDGHR-CVEARBPZSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1	ZINC000750066369	700201944	/nfs/dbraw/zinc/20/19/44/700201944.db2.gz	ISYXXUOBHMDGHR-CVEARBPZSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1	ZINC000750066369	700201947	/nfs/dbraw/zinc/20/19/47/700201947.db2.gz	ISYXXUOBHMDGHR-CVEARBPZSA-N	1	1	305.378	1.797	20	5		DDBDMO
COc1cccc([C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+](C)C)c1	ZINC000248252485	698371387	/nfs/dbraw/zinc/37/13/87/698371387.db2.gz	QKNPISCLTQTCHQ-MCIONIFRSA-N	1	1	307.350	1.079	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1O	ZINC000782524609	698734075	/nfs/dbraw/zinc/73/40/75/698734075.db2.gz	OMGPJTVWRLUXRF-ZANVPECISA-N	1	1	311.313	1.375	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000783923321	698892581	/nfs/dbraw/zinc/89/25/81/698892581.db2.gz	YCYQHUUJOBDBAJ-JTQLQIEISA-N	1	1	321.333	1.538	20	5		DDBDMO
CS(=O)(=O)[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000714243557	699269738	/nfs/dbraw/zinc/26/97/38/699269738.db2.gz	YBWUSNLNMPUSBR-HOMQSWHASA-N	1	1	318.782	1.913	20	5		DDBDMO
C[C@H]1[C@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000719624989	699302815	/nfs/dbraw/zinc/30/28/15/699302815.db2.gz	NLCCIGVLSLZIMT-IONNQARKSA-N	1	1	315.171	1.679	20	5		DDBDMO
C[C@H]1[C@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000719624989	699302816	/nfs/dbraw/zinc/30/28/16/699302816.db2.gz	NLCCIGVLSLZIMT-IONNQARKSA-N	1	1	315.171	1.679	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)Cn1cc([N+](=O)[O-])cn1	ZINC000795751115	699889398	/nfs/dbraw/zinc/88/93/98/699889398.db2.gz	ICJUJTFJHWRDSI-UHFFFAOYSA-N	1	1	307.354	1.796	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H]1CC[N@H+](CCF)C1	ZINC000802242311	700388905	/nfs/dbraw/zinc/38/89/05/700388905.db2.gz	ZMTKUITVRYCHMH-NSHDSACASA-N	1	1	314.317	1.077	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H]1CC[N@@H+](CCF)C1	ZINC000802242311	700388909	/nfs/dbraw/zinc/38/89/09/700388909.db2.gz	ZMTKUITVRYCHMH-NSHDSACASA-N	1	1	314.317	1.077	20	5		DDBDMO
Cn1ccnc1[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000767116950	701084777	/nfs/dbraw/zinc/08/47/77/701084777.db2.gz	OSEKGCIFCAJLBZ-DZGCQCFKSA-N	1	1	316.361	1.851	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839595170	701749317	/nfs/dbraw/zinc/74/93/17/701749317.db2.gz	KLXZKYVHNKTIBK-BZUAXINKSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839595170	701749320	/nfs/dbraw/zinc/74/93/20/701749320.db2.gz	KLXZKYVHNKTIBK-BZUAXINKSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839595170	701749325	/nfs/dbraw/zinc/74/93/25/701749325.db2.gz	KLXZKYVHNKTIBK-BZUAXINKSA-N	1	1	317.389	1.680	20	5		DDBDMO
COC(=O)[C@]1(C)CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839665958	701772926	/nfs/dbraw/zinc/77/29/26/701772926.db2.gz	JJUMYRBMWKJWQP-GDBMZVCRSA-N	1	1	322.361	1.903	20	5		DDBDMO
COCCC[N@H+](C)CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839972708	701884805	/nfs/dbraw/zinc/88/48/05/701884805.db2.gz	GOONXQWWHOLFRL-HNNXBMFYSA-N	1	1	323.349	1.458	20	5		DDBDMO
COCCC[N@@H+](C)CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839972708	701884810	/nfs/dbraw/zinc/88/48/10/701884810.db2.gz	GOONXQWWHOLFRL-HNNXBMFYSA-N	1	1	323.349	1.458	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000868075532	701927464	/nfs/dbraw/zinc/92/74/64/701927464.db2.gz	KXLFDLNUDGUOPQ-UKRRQHHQSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840176561	702013517	/nfs/dbraw/zinc/01/35/17/702013517.db2.gz	CZCMZESLFIWOPR-CQSZACIVSA-N	1	1	315.377	1.955	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCC[C@H]1CCCC[N@@H+]1C	ZINC000840226023	702035653	/nfs/dbraw/zinc/03/56/53/702035653.db2.gz	SJBHVILSQZGFHA-CYBMUJFWSA-N	1	1	324.381	1.907	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840403072	702098690	/nfs/dbraw/zinc/09/86/90/702098690.db2.gz	CVXISKHOALTKRX-ZIAGYGMSSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[N@H+](Cc1ccccc1)CC(C)(C)NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000840403072	702098696	/nfs/dbraw/zinc/09/86/96/702098696.db2.gz	CVXISKHOALTKRX-ZIAGYGMSSA-N	1	1	305.378	1.678	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)CC(C)(C)NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000840403072	702098702	/nfs/dbraw/zinc/09/87/02/702098702.db2.gz	CVXISKHOALTKRX-ZIAGYGMSSA-N	1	1	305.378	1.678	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812344581	702166940	/nfs/dbraw/zinc/16/69/40/702166940.db2.gz	VUCXKKFQPJZQBM-NEPJUHHUSA-N	1	1	319.361	1.627	20	5		DDBDMO
COc1ccc(C[NH2+]CCS(=O)(=O)C2CC2)cc1[N+](=O)[O-]	ZINC000840964455	702296309	/nfs/dbraw/zinc/29/63/09/702296309.db2.gz	LGBGDKSHLSLBRM-UHFFFAOYSA-N	1	1	314.363	1.270	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C[N@@H+]1CCO	ZINC000842045981	702663245	/nfs/dbraw/zinc/66/32/45/702663245.db2.gz	NYILUWRCWLCHHY-MNOVXSKESA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000842045981	702663246	/nfs/dbraw/zinc/66/32/46/702663246.db2.gz	NYILUWRCWLCHHY-MNOVXSKESA-N	1	1	324.337	1.394	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H](CO)C[NH+]2CCCCC2)cc1	ZINC000843112599	702821291	/nfs/dbraw/zinc/82/12/91/702821291.db2.gz	IRMFVOHOFICZPS-GDBMZVCRSA-N	1	1	323.393	1.065	20	5		DDBDMO
CC[NH2+]Cc1noc(-c2cc(C(=O)OC)cc([N+](=O)[O-])c2)n1	ZINC000843144950	702828656	/nfs/dbraw/zinc/82/86/56/702828656.db2.gz	PKYRSMGKRQLCON-UHFFFAOYSA-N	1	1	306.278	1.541	20	5		DDBDMO
C[C@@H]1C[C@H]1C(N)=[NH+]OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000848520487	703560623	/nfs/dbraw/zinc/56/06/23/703560623.db2.gz	QOUIKTOMIJYDPN-BXKDBHETSA-N	1	1	318.333	1.638	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@]2(O)C[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000852539507	704071254	/nfs/dbraw/zinc/07/12/54/704071254.db2.gz	SHSDDHBAWUUNMA-ZUZCIYMTSA-N	1	1	323.324	1.519	20	5		DDBDMO
C[C@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000870789975	704133014	/nfs/dbraw/zinc/13/30/14/704133014.db2.gz	LFZVPOHFWALDKJ-NEPJUHHUSA-N	1	1	310.354	1.597	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)CCc3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000820264840	704248608	/nfs/dbraw/zinc/24/86/08/704248608.db2.gz	SNGZPRRJUHAGET-SWLSCSKDSA-N	1	1	321.352	1.829	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CC2CN(C)C2)c2ccc([N+](=O)[O-])cc12	ZINC000853552564	704266650	/nfs/dbraw/zinc/26/66/50/704266650.db2.gz	AZMVYTPEQKDJCT-UHFFFAOYSA-N	1	1	303.366	1.704	20	5		DDBDMO
Cc1nn(C[N@H+](C)CC2CN(C)C2)c2ccc([N+](=O)[O-])cc12	ZINC000853552564	704266653	/nfs/dbraw/zinc/26/66/53/704266653.db2.gz	AZMVYTPEQKDJCT-UHFFFAOYSA-N	1	1	303.366	1.704	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CCCOCC3)CC2)n1	ZINC000853688454	704300023	/nfs/dbraw/zinc/30/00/23/704300023.db2.gz	OOKCFAXXVYERKI-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
Nc1ccc(NC(=O)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000824008732	705354383	/nfs/dbraw/zinc/35/43/83/705354383.db2.gz	UPAVQYZJGUNNBW-UHFFFAOYSA-N	1	1	323.353	1.021	20	5		DDBDMO
Cc1ccc(CNC(=O)[C@H](C)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000825648583	705708654	/nfs/dbraw/zinc/70/86/54/705708654.db2.gz	UYDVGOFQVUIFSW-ZDUSSCGKSA-N	1	1	320.393	1.155	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825830351	705735271	/nfs/dbraw/zinc/73/52/71/705735271.db2.gz	KNQHOVDEIUKUMP-CABCVRRESA-N	1	1	321.377	1.619	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000825895018	705742455	/nfs/dbraw/zinc/74/24/55/705742455.db2.gz	AMSTWBDWQLGTEI-AWEZNQCLSA-N	1	1	309.366	1.475	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]CCCN3CCCCC3)C2)c1	ZINC000876901056	705915461	/nfs/dbraw/zinc/91/54/61/705915461.db2.gz	XNIKDSJJCKZSDV-UHFFFAOYSA-N	1	1	307.398	1.960	20	5		DDBDMO
C[C@@H](c1nc(-c2ccc([N+](=O)[O-])s2)no1)N1CC[NH2+]CC1=O	ZINC000863670453	705982222	/nfs/dbraw/zinc/98/22/22/705982222.db2.gz	MQMJOPHIFMNFOT-ZETCQYMHSA-N	1	1	323.334	1.199	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)N(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000877197340	706014591	/nfs/dbraw/zinc/01/45/91/706014591.db2.gz	IEARXBWZMSHOQZ-PEYYIBSZSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000880441028	706977482	/nfs/dbraw/zinc/97/74/82/706977482.db2.gz	OHIZDHFCARDRQZ-ZWNOBZJWSA-N	1	1	308.334	1.807	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832866014	706996394	/nfs/dbraw/zinc/99/63/94/706996394.db2.gz	PCUXPUDCXYGGFE-IUODEOHRSA-N	1	1	323.393	1.865	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000837609793	707695114	/nfs/dbraw/zinc/69/51/14/707695114.db2.gz	PYUCAOIOIKCZHT-NSHDSACASA-N	1	1	310.354	1.748	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1	ZINC000884825245	708387923	/nfs/dbraw/zinc/38/79/23/708387923.db2.gz	NASBFQKWDPKIBS-UHFFFAOYSA-N	1	1	316.361	1.993	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ncc([N+](=O)[O-])cc1Br	ZINC000884824790	708388139	/nfs/dbraw/zinc/38/81/39/708388139.db2.gz	NUKRKOQEDURMMM-UHFFFAOYSA-N	1	1	319.159	1.088	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000885855389	708640364	/nfs/dbraw/zinc/64/03/64/708640364.db2.gz	PWCJXTYBNKSKCW-HNNXBMFYSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@](CO)(C(F)(F)F)C2)n1	ZINC000886799701	708847235	/nfs/dbraw/zinc/84/72/35/708847235.db2.gz	VLBOFNFCCZMHFT-SNVBAGLBSA-N	1	1	308.260	1.038	20	5		DDBDMO
COc1cc2c(cc1O)CC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000887105473	708956141	/nfs/dbraw/zinc/95/61/41/708956141.db2.gz	XAISRACMIRYJKS-UHFFFAOYSA-N	1	1	318.333	1.564	20	5		DDBDMO
COc1cc2c(cc1O)CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000887105473	708956144	/nfs/dbraw/zinc/95/61/44/708956144.db2.gz	XAISRACMIRYJKS-UHFFFAOYSA-N	1	1	318.333	1.564	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000900288494	709522855	/nfs/dbraw/zinc/52/28/55/709522855.db2.gz	YWTPISDKTGSPJU-HNNXBMFYSA-N	1	1	307.350	1.058	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@H]([NH+]2CCC2)C1	ZINC000912920932	713125056	/nfs/dbraw/zinc/12/50/56/713125056.db2.gz	DQTFYZNDBKTEGC-NSHDSACASA-N	1	1	315.333	1.391	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096534	713129048	/nfs/dbraw/zinc/12/90/48/713129048.db2.gz	MVOBRTKUXJWBPO-GXTWGEPZSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096534	713129050	/nfs/dbraw/zinc/12/90/50/713129050.db2.gz	MVOBRTKUXJWBPO-GXTWGEPZSA-N	1	1	321.402	1.904	20	5		DDBDMO
CC1(C)C[NH+](CCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC(C)(C)O1	ZINC000893476541	710670859	/nfs/dbraw/zinc/67/08/59/710670859.db2.gz	AKQXDIYKWXVLBE-GHMZBOCLSA-N	1	1	300.355	1.084	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(c3ncnc4sc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000893941961	710894797	/nfs/dbraw/zinc/89/47/97/710894797.db2.gz	XULUMRVBBJOEQD-PSASIEDQSA-N	1	1	305.363	1.740	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000928556052	713225103	/nfs/dbraw/zinc/22/51/03/713225103.db2.gz	RKJGLWUKTORJES-CYBMUJFWSA-N	1	1	305.334	1.378	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000928556052	713225105	/nfs/dbraw/zinc/22/51/05/713225105.db2.gz	RKJGLWUKTORJES-CYBMUJFWSA-N	1	1	305.334	1.378	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@H]([NH+]3CCC3)C2)c1	ZINC000903208821	711066056	/nfs/dbraw/zinc/06/60/56/711066056.db2.gz	ZTGVPCFOQDHCFW-LBPRGKRZSA-N	1	1	311.363	1.064	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000912024919	711128851	/nfs/dbraw/zinc/12/88/51/711128851.db2.gz	WEZOVDNTYBHDMO-TXEJJXNPSA-N	1	1	323.397	1.468	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC000894591808	711198627	/nfs/dbraw/zinc/19/86/27/711198627.db2.gz	WBQXMKYERQHMAD-UHFFFAOYSA-N	1	1	308.382	1.229	20	5		DDBDMO
C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1C[N@@H+](C)CCN1C	ZINC000895249498	711465626	/nfs/dbraw/zinc/46/56/26/711465626.db2.gz	UVQBBJUJDQHKMM-NOZJJQNGSA-N	1	1	314.336	1.919	20	5		DDBDMO
Cc1ccc(NCC[N@@H+]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1	ZINC000895254022	711467782	/nfs/dbraw/zinc/46/77/82/711467782.db2.gz	PRMOHXUSBCVJLO-UHFFFAOYSA-N	1	1	307.350	1.764	20	5		DDBDMO
Cc1ccc(NCC[N@H+]2CCC3(C2)OCCO3)c([N+](=O)[O-])c1	ZINC000895254022	711467784	/nfs/dbraw/zinc/46/77/84/711467784.db2.gz	PRMOHXUSBCVJLO-UHFFFAOYSA-N	1	1	307.350	1.764	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c1[N+](=O)[O-]	ZINC000895444168	711513903	/nfs/dbraw/zinc/51/39/03/711513903.db2.gz	RFGFWHZJYRQKMC-NWDGAFQWSA-N	1	1	308.334	1.777	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1	ZINC000895708879	711585093	/nfs/dbraw/zinc/58/50/93/711585093.db2.gz	WROMTKCVXLZSKZ-MRXNPFEDSA-N	1	1	322.361	1.828	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@@H+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1	ZINC000895708879	711585096	/nfs/dbraw/zinc/58/50/96/711585096.db2.gz	WROMTKCVXLZSKZ-MRXNPFEDSA-N	1	1	322.361	1.828	20	5		DDBDMO
C[C@H]1[C@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+]1C	ZINC000895735150	711590349	/nfs/dbraw/zinc/59/03/49/711590349.db2.gz	VFKUYKZQOAFIRI-IINYFYTJSA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C[C@H](C)O)CC2)c1C	ZINC000896203898	711690862	/nfs/dbraw/zinc/69/08/62/711690862.db2.gz	AEUOCKGATUCXCF-LBPRGKRZSA-N	1	1	321.377	1.350	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C[C@H]1C	ZINC000905710085	712127531	/nfs/dbraw/zinc/12/75/31/712127531.db2.gz	GOAUNVWRPFULCH-BXKDBHETSA-N	1	1	310.354	1.497	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C[C@H]1C	ZINC000905710085	712127533	/nfs/dbraw/zinc/12/75/33/712127533.db2.gz	GOAUNVWRPFULCH-BXKDBHETSA-N	1	1	310.354	1.497	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000905984565	712209440	/nfs/dbraw/zinc/20/94/40/712209440.db2.gz	NCNNTYGLVNKZES-OUAUKWLOSA-N	1	1	309.370	1.039	20	5		DDBDMO
Cc1[nH]c(C)c(Cn2cc(Br)c([N+](=O)[O-])n2)[nH+]1	ZINC000916747740	713465801	/nfs/dbraw/zinc/46/58/01/713465801.db2.gz	NONDAKZGSBWLIL-UHFFFAOYSA-N	1	1	300.116	1.942	20	5		DDBDMO
Cc1[nH]c(Cn2cc(Br)c([N+](=O)[O-])n2)c(C)[nH+]1	ZINC000916747740	713465803	/nfs/dbraw/zinc/46/58/03/713465803.db2.gz	NONDAKZGSBWLIL-UHFFFAOYSA-N	1	1	300.116	1.942	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC000929090337	713543711	/nfs/dbraw/zinc/54/37/11/713543711.db2.gz	BDLYBPKHKQYGKA-GWCFXTLKSA-N	1	1	320.349	1.771	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCS1(=O)=O	ZINC000930354564	713812471	/nfs/dbraw/zinc/81/24/71/713812471.db2.gz	QBEZIWRKULLONV-AWEZNQCLSA-N	1	1	312.391	1.646	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCS1(=O)=O	ZINC000930354564	713812469	/nfs/dbraw/zinc/81/24/69/713812469.db2.gz	QBEZIWRKULLONV-AWEZNQCLSA-N	1	1	312.391	1.646	20	5		DDBDMO
Cc1[nH]c(CN2CCN(c3ncccc3[N+](=O)[O-])CC2)c(C)[nH+]1	ZINC000930681204	713894311	/nfs/dbraw/zinc/89/43/11/713894311.db2.gz	SZNVPLGGQYSVTC-UHFFFAOYSA-N	1	1	316.365	1.652	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1	ZINC000931118451	714006338	/nfs/dbraw/zinc/00/63/38/714006338.db2.gz	TVANXVPILZAVAO-ZDUSSCGKSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000931397339	714084239	/nfs/dbraw/zinc/08/42/39/714084239.db2.gz	MGTPOFDLVCYROM-ZNMIVQPWSA-N	1	1	321.377	1.113	20	5		DDBDMO
C[N@H+]1CC[C@@H]2C[NH+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931438997	714098217	/nfs/dbraw/zinc/09/82/17/714098217.db2.gz	MGMQUSBUTDCVHD-IJEWVQPXSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931438997	714098226	/nfs/dbraw/zinc/09/82/26/714098226.db2.gz	MGMQUSBUTDCVHD-IJEWVQPXSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931438997	714098230	/nfs/dbraw/zinc/09/82/30/714098230.db2.gz	MGMQUSBUTDCVHD-IJEWVQPXSA-N	1	1	305.378	1.512	20	5		DDBDMO
O=C(NC1CC[NH+](CC[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000931549913	714125547	/nfs/dbraw/zinc/12/55/47/714125547.db2.gz	HJKSBSGWBXZCGP-UHFFFAOYSA-N	1	1	307.350	1.654	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(CC[N+](=O)[O-])C2)O1	ZINC000931704874	714165715	/nfs/dbraw/zinc/16/57/15/714165715.db2.gz	RZYPANHCMONAFE-NVXWUHKLSA-N	1	1	319.405	1.629	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000932072781	714252531	/nfs/dbraw/zinc/25/25/31/714252531.db2.gz	ZJUJYOCVVYEWFS-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@@H]1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923369574	714330389	/nfs/dbraw/zinc/33/03/89/714330389.db2.gz	KZNCDGMDVNUSMO-DOMZBBRYSA-N	1	1	323.393	1.312	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000934889909	714925106	/nfs/dbraw/zinc/92/51/06/714925106.db2.gz	KUJIQDSEROSXDY-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(N2C[C@@H]3[C@H](C2)OCC[N@@H+]3C)nc1Cl	ZINC001164664944	719385826	/nfs/dbraw/zinc/38/58/26/719385826.db2.gz	DAHCHOGOLPNYCK-MNOVXSKESA-N	1	1	312.757	1.471	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1=CCCCCC1	ZINC001126210794	738637675	/nfs/dbraw/zinc/63/76/75/738637675.db2.gz	XQVVJUQLEWXYKO-UHFFFAOYSA-N	1	1	321.381	1.425	20	5		DDBDMO
COC(=O)COc1c(C)cc(N[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001167281240	732896610	/nfs/dbraw/zinc/89/66/10/732896610.db2.gz	POVCZFQIGFGJIO-NSHDSACASA-N	1	1	323.349	1.571	20	5		DDBDMO
C[C@H](c1nnc(N2CCC(c3c[nH+]cn3C)CC2)n1C)[N+](=O)[O-]	ZINC001121297295	782448434	/nfs/dbraw/zinc/44/84/34/782448434.db2.gz	ORCQSNRXUUIHNN-SNVBAGLBSA-N	1	1	319.369	1.270	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cc2ccccc2o1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932275	742776543	/nfs/dbraw/zinc/77/65/43/742776543.db2.gz	POWNISBZKPTTSF-CHWSQXEVSA-N	1	1	303.318	1.304	20	5		DDBDMO
Cc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)n(C)n1	ZINC001181264856	743130366	/nfs/dbraw/zinc/13/03/66/743130366.db2.gz	BHCDSGMJCWVQJC-UHFFFAOYSA-N	1	1	300.322	1.803	20	5		DDBDMO
O=C(NC1CC[NH+](CC2CC(F)(F)C2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002788853	743431538	/nfs/dbraw/zinc/43/15/38/743431538.db2.gz	PZVKYCLTVKPULN-VXGBXAGGSA-N	1	1	317.336	1.278	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@@H](C)[C@@H](O)C(F)(F)F)c1[N+](=O)[O-]	ZINC001183270343	743813544	/nfs/dbraw/zinc/81/35/44/743813544.db2.gz	SRTXBZCHEKJWTA-UPONEAKYSA-N	1	1	324.255	1.710	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](O)C1)Nc1cc2cccnc2c2ncccc12	ZINC001186049193	744336027	/nfs/dbraw/zinc/33/60/27/744336027.db2.gz	QTKSXNWMFVGQOF-ZDUSSCGKSA-N	1	1	322.368	1.788	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](O)C1)Nc1cc2cccnc2c2ncccc12	ZINC001186049193	744336028	/nfs/dbraw/zinc/33/60/28/744336028.db2.gz	QTKSXNWMFVGQOF-ZDUSSCGKSA-N	1	1	322.368	1.788	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)c1cn[nH]c1	ZINC001031559210	747034238	/nfs/dbraw/zinc/03/42/38/747034238.db2.gz	BBNOATKUBGFMAG-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1	ZINC001198270679	747444422	/nfs/dbraw/zinc/44/44/22/747444422.db2.gz	OATGXUPMTANCDT-CJNGLKHVSA-N	1	1	305.378	1.987	20	5		DDBDMO
CN(C)c1ccc(NCCCN2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC001161710592	748478770	/nfs/dbraw/zinc/47/87/70/748478770.db2.gz	TWZGDNNWZBBWME-UHFFFAOYSA-N	1	1	321.425	1.710	20	5		DDBDMO
CN1CCN(C(=[NH2+])Nc2ncnc3sc([N+](=O)[O-])cc32)CC1	ZINC001168737347	748518727	/nfs/dbraw/zinc/51/87/27/748518727.db2.gz	YXKYOCFCGYSCEN-UHFFFAOYSA-N	1	1	321.366	1.194	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017583	762198107	/nfs/dbraw/zinc/19/81/07/762198107.db2.gz	AQTYZTMBLRVMQE-MELADBBJSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017583	762198111	/nfs/dbraw/zinc/19/81/11/762198111.db2.gz	AQTYZTMBLRVMQE-MELADBBJSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169024542	762201915	/nfs/dbraw/zinc/20/19/15/762201915.db2.gz	WWLWBWAIEZAOJF-RWMBFGLXSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169024542	762201920	/nfs/dbraw/zinc/20/19/20/762201920.db2.gz	WWLWBWAIEZAOJF-RWMBFGLXSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCOCc1ncn2c1C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169025765	762203290	/nfs/dbraw/zinc/20/32/90/762203290.db2.gz	UVKOYHBALNIAKV-OLZOCXBDSA-N	1	1	308.382	1.681	20	5		DDBDMO
CCOCc1ncn2c1C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169025765	762203295	/nfs/dbraw/zinc/20/32/95/762203295.db2.gz	UVKOYHBALNIAKV-OLZOCXBDSA-N	1	1	308.382	1.681	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCC[C@@H](Oc3cnccn3)C2)C1	ZINC001169053888	762209088	/nfs/dbraw/zinc/20/90/88/762209088.db2.gz	JYLIBIAEYKRAEZ-MGPQQGTHSA-N	1	1	306.366	1.765	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000829037760	759864353	/nfs/dbraw/zinc/86/43/53/759864353.db2.gz	JFKOHHXKLXJHJS-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
CN(C)C1(CNc2ncc(F)cc2[N+](=O)[O-])CC[NH+](C)CC1	ZINC001156177033	761856149	/nfs/dbraw/zinc/85/61/49/761856149.db2.gz	YPAMHNKFQGIAJE-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
COCC(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC001048630353	769592030	/nfs/dbraw/zinc/59/20/30/769592030.db2.gz	BUDNIUYENGOFTR-OKILXGFUSA-N	1	1	319.361	1.131	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ncc1N[C@H]1C[C@H]2CC[N@@H+](C1)[C@H]2C	ZINC001170978557	772004689	/nfs/dbraw/zinc/00/46/89/772004689.db2.gz	BDWUNFTWPRBOBO-AXFHLTTASA-N	1	1	320.349	1.671	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001093642046	774939691	/nfs/dbraw/zinc/93/96/91/774939691.db2.gz	IEBJEVYZRGWXQL-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1cc(C)ccc1[N+](=O)[O-]	ZINC001094008234	775324209	/nfs/dbraw/zinc/32/42/09/775324209.db2.gz	IXFGDPNYMVYBQU-UHFFFAOYSA-N	1	1	317.349	1.636	20	5		DDBDMO
CNC(=O)N1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001173232392	777063647	/nfs/dbraw/zinc/06/36/47/777063647.db2.gz	QWLOCNLWRRSNND-GFCCVEGCSA-N	1	1	306.366	1.483	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ncc([N+](=O)[O-])cc1C	ZINC001101756590	777479455	/nfs/dbraw/zinc/47/94/55/777479455.db2.gz	FNDSMNOSNAOSQM-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C(C)(C)C1	ZINC001178860600	779215019	/nfs/dbraw/zinc/21/50/19/779215019.db2.gz	GFNDWRYQWJKZDM-NSHDSACASA-N	1	1	308.338	1.156	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@H](O)C3(CC3)C1)OCCO2	ZINC001116696702	780545271	/nfs/dbraw/zinc/54/52/71/780545271.db2.gz	RNBCSLYMGPHZJY-AWEZNQCLSA-N	1	1	306.318	1.323	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1C[C@H](O)C3(CC3)C1)OCCO2	ZINC001116696702	780545282	/nfs/dbraw/zinc/54/52/82/780545282.db2.gz	RNBCSLYMGPHZJY-AWEZNQCLSA-N	1	1	306.318	1.323	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816078	780904421	/nfs/dbraw/zinc/90/44/21/780904421.db2.gz	QNDUSXVZRVVHMI-JSGCOSHPSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816078	780904427	/nfs/dbraw/zinc/90/44/27/780904427.db2.gz	QNDUSXVZRVVHMI-JSGCOSHPSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC001119450845	781458440	/nfs/dbraw/zinc/45/84/40/781458440.db2.gz	YYYKXEORJGUMPI-AWEZNQCLSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1ccc(F)c(C[NH2+]C/C=C\CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001274014631	851851272	/nfs/dbraw/zinc/85/12/72/851851272.db2.gz	BAFVQJRIQLNMHE-KXAWDHGWSA-N	1	1	321.352	1.561	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])c(NCC2(N(C)C)CC[NH+](C)CC2)n1	ZINC001156182475	862787943	/nfs/dbraw/zinc/78/79/43/862787943.db2.gz	VHYPFXIJSLYSAJ-UHFFFAOYSA-N	1	1	308.386	1.131	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCc1[nH]c(C)[nH+]c1C	ZINC001156221395	862835458	/nfs/dbraw/zinc/83/54/58/862835458.db2.gz	NOTLQADCDWUBGJ-UHFFFAOYSA-N	1	1	304.306	1.873	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1C[N@@H+]2CCN1C[C@H]2C	ZINC001123879895	859452387	/nfs/dbraw/zinc/45/23/87/859452387.db2.gz	JVSVCNQCEQGZSZ-BXUZGUMPSA-N	1	1	318.377	1.538	20	5		DDBDMO
COc1nc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160722698	866069074	/nfs/dbraw/zinc/06/90/74/866069074.db2.gz	IDZJJQQQALMZNO-RYUDHWBXSA-N	1	1	322.365	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H]1C[C@H]3COC[C@@H]3O1)CC2	ZINC001334613743	867710954	/nfs/dbraw/zinc/71/09/54/867710954.db2.gz	JGWGQTPHQHFIPT-BPUTZDHNSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@H]3COC[C@@H]3O1)CC2	ZINC001334613743	867710967	/nfs/dbraw/zinc/71/09/67/867710967.db2.gz	JGWGQTPHQHFIPT-BPUTZDHNSA-N	1	1	304.346	1.757	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCC[NH+]1CC=CC1	ZINC001335496810	868343379	/nfs/dbraw/zinc/34/33/79/868343379.db2.gz	BPAZCJDGVKDNSO-UHFFFAOYSA-N	1	1	305.260	1.631	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3nc(Cl)nc(Cl)c3[N+](=O)[O-])C[C@H]2C1	ZINC001165147395	869408062	/nfs/dbraw/zinc/40/80/62/869408062.db2.gz	IWTDPYCZDHPWAM-KNVOCYPGSA-N	1	1	318.164	1.689	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C(C)(C)C1	ZINC001304042933	871181030	/nfs/dbraw/zinc/18/10/30/871181030.db2.gz	PDXVASBSPYWUHN-NSHDSACASA-N	1	1	307.354	1.032	20	5		DDBDMO
Cc1[nH+]ccn1CCCn1nnc(-c2ccccc2[N+](=O)[O-])n1	ZINC001307404920	871434106	/nfs/dbraw/zinc/43/41/06/871434106.db2.gz	RMKSLFMJKPBBTN-UHFFFAOYSA-N	1	1	313.321	1.844	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC001205555931	871628197	/nfs/dbraw/zinc/62/81/97/871628197.db2.gz	YKLVIOFQBPOHLL-HNNXBMFYSA-N	1	1	323.349	1.267	20	5		DDBDMO
C[NH+]1CCN(c2ncc(Nc3ccccc3[N+](=O)[O-])cn2)CC1	ZINC001206144164	872086705	/nfs/dbraw/zinc/08/67/05/872086705.db2.gz	GALMMUXUPDSHJC-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C3(CC3)C2)c1	ZINC001346118692	873616538	/nfs/dbraw/zinc/61/65/38/873616538.db2.gz	WBIOQVOWTQMOKU-ZDUSSCGKSA-N	1	1	306.318	1.338	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C3(CC3)C2)c1	ZINC001346118692	873616545	/nfs/dbraw/zinc/61/65/45/873616545.db2.gz	WBIOQVOWTQMOKU-ZDUSSCGKSA-N	1	1	306.318	1.338	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(F)ccc3[N+](=O)[O-])[C@H]2C1	ZINC001347539439	874178579	/nfs/dbraw/zinc/17/85/79/874178579.db2.gz	KYJTWLVQHSFMKV-TVYUQYBPSA-N	1	1	307.325	1.804	20	5		DDBDMO
Nc1cc(N2CC[NH+](Cc3cccs3)CC2)ncc1[N+](=O)[O-]	ZINC001347865674	874294006	/nfs/dbraw/zinc/29/40/06/874294006.db2.gz	HGLWBRJRTBSIIB-UHFFFAOYSA-N	1	1	319.390	1.956	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC001350914984	875955421	/nfs/dbraw/zinc/95/54/21/875955421.db2.gz	GAVKBMRVNSFFIJ-BHYNMZESSA-N	1	1	307.325	1.804	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2cn(C3CCC3)nn2)cc1	ZINC001356545362	879096475	/nfs/dbraw/zinc/09/64/75/879096475.db2.gz	VGMZZDQACBIUTJ-HNNXBMFYSA-N	1	1	317.349	1.735	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001228602607	883567848	/nfs/dbraw/zinc/56/78/48/883567848.db2.gz	CTZMOUBNRQHSCX-SNVBAGLBSA-N	1	1	308.338	1.831	20	5		DDBDMO
C[N@H+]1CCC[C@@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001228602607	883567856	/nfs/dbraw/zinc/56/78/56/883567856.db2.gz	CTZMOUBNRQHSCX-SNVBAGLBSA-N	1	1	308.338	1.831	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2nc(NC(C)=O)nc(C)c2[N+](=O)[O-])C1	ZINC001234907425	888242987	/nfs/dbraw/zinc/24/29/87/888242987.db2.gz	AZSPVCCSEKPBKK-JTQLQIEISA-N	1	1	309.326	1.125	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@@H]3CC[NH2+]C[C@H]3F)CC2)cc1	ZINC001246085802	892409446	/nfs/dbraw/zinc/40/94/46/892409446.db2.gz	IZMYRNDSEVCMNT-HZPDHXFCSA-N	1	1	322.384	1.853	20	5		DDBDMO
COC(=O)[C@]1(F)CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596395	896521683	/nfs/dbraw/zinc/52/16/83/896521683.db2.gz	CXYQEQFQJWGSPV-HIFRSBDPSA-N	1	1	308.309	1.649	20	5		DDBDMO
COC(=O)[C@]1(F)CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596395	896521701	/nfs/dbraw/zinc/52/17/01/896521701.db2.gz	CXYQEQFQJWGSPV-HIFRSBDPSA-N	1	1	308.309	1.649	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254599695	896523885	/nfs/dbraw/zinc/52/38/85/896523885.db2.gz	PAFWHLFEUPVTHR-DOMZBBRYSA-N	1	1	304.346	1.947	20	5		DDBDMO
C[C@@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC001293397079	914452281	/nfs/dbraw/zinc/45/22/81/914452281.db2.gz	ZEVRZNTWMGWPFZ-GFCCVEGCSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[C@@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC001293397079	914452290	/nfs/dbraw/zinc/45/22/90/914452290.db2.gz	ZEVRZNTWMGWPFZ-GFCCVEGCSA-N	1	1	306.366	1.194	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000278782533	214397557	/nfs/dbraw/zinc/39/75/57/214397557.db2.gz	ZOSNGZHYEMDSMY-UHFFFAOYSA-N	1	1	319.340	1.790	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CCC[N@H+]2CCCO)cc([N+](=O)[O-])c1	ZINC000452346740	231354264	/nfs/dbraw/zinc/35/42/64/231354264.db2.gz	HGJYUROXNWEBRQ-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1CCC[N@@H+]1CCCO	ZINC000452366035	231362625	/nfs/dbraw/zinc/36/26/25/231362625.db2.gz	OGUDFUXMQMJROY-OAHLLOKOSA-N	1	1	321.377	1.100	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000299455274	529784005	/nfs/dbraw/zinc/78/40/05/529784005.db2.gz	VFAFJPDOBZYZEZ-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000299455274	529784007	/nfs/dbraw/zinc/78/40/07/529784007.db2.gz	VFAFJPDOBZYZEZ-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000181644499	199332037	/nfs/dbraw/zinc/33/20/37/199332037.db2.gz	MKFVNZSTJWOKKL-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(=O)c1cc(NCC[N@@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000286703001	219119100	/nfs/dbraw/zinc/11/91/00/219119100.db2.gz	OMWZAGDWFFWJPH-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CC(=O)c1cc(NCC[N@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000286703001	219119102	/nfs/dbraw/zinc/11/91/02/219119102.db2.gz	OMWZAGDWFFWJPH-UHFFFAOYSA-N	1	1	307.350	1.932	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301962658	529930425	/nfs/dbraw/zinc/93/04/25/529930425.db2.gz	ISAIONUFMVYBHA-LBPRGKRZSA-N	1	1	318.381	1.948	20	5		DDBDMO
C[C@@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[NH+](C)C	ZINC000272865336	282318828	/nfs/dbraw/zinc/31/88/28/282318828.db2.gz	RKKRNKQAOPRSJB-ZETCQYMHSA-N	1	1	307.397	1.422	20	5		DDBDMO
C[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000331330766	530071901	/nfs/dbraw/zinc/07/19/01/530071901.db2.gz	HKOSICTXLRDSCY-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000331330766	530071902	/nfs/dbraw/zinc/07/19/02/530071902.db2.gz	HKOSICTXLRDSCY-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000331330766	530071903	/nfs/dbraw/zinc/07/19/03/530071903.db2.gz	HKOSICTXLRDSCY-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279816731	215171424	/nfs/dbraw/zinc/17/14/24/215171424.db2.gz	QGCHQCSPVKMDHY-GXFFZTMASA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279816731	215171428	/nfs/dbraw/zinc/17/14/28/215171428.db2.gz	QGCHQCSPVKMDHY-GXFFZTMASA-N	1	1	307.350	1.625	20	5		DDBDMO
CC1(C)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000279920722	215238406	/nfs/dbraw/zinc/23/84/06/215238406.db2.gz	WFHAJKWTPJWENC-CYBMUJFWSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(C1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1)C(F)(F)F	ZINC000186028079	186232730	/nfs/dbraw/zinc/23/27/30/186232730.db2.gz	FDRIGWMPQXFEKI-UHFFFAOYSA-N	1	1	320.271	1.635	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([NH+]3CCCCC3)CC2)c1[N+](=O)[O-]	ZINC000264255899	186329248	/nfs/dbraw/zinc/32/92/48/186329248.db2.gz	OHUIZPSXSIRCLM-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1nccs1	ZINC000564845223	304019123	/nfs/dbraw/zinc/01/91/23/304019123.db2.gz	RYRXBHSDKKJLSJ-SNVBAGLBSA-N	1	1	309.347	1.581	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cnccn3)CC2)cn1	ZINC000601253293	358464536	/nfs/dbraw/zinc/46/45/36/358464536.db2.gz	KBADRRCPRATGGH-UHFFFAOYSA-N	1	1	314.349	1.145	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@@H+]2CCCC[C@H]2CC)c1[N+](=O)[O-]	ZINC000172163788	198049612	/nfs/dbraw/zinc/04/96/12/198049612.db2.gz	VXRMJCCSSMJFBA-LLVKDONJSA-N	1	1	323.397	1.875	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C(C)C)CC1	ZINC000025136916	352194403	/nfs/dbraw/zinc/19/44/03/352194403.db2.gz	JMYBLZLOLAMIMI-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000047143872	352482766	/nfs/dbraw/zinc/48/27/66/352482766.db2.gz	ZWMQUKYXECALPP-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000060792462	352879918	/nfs/dbraw/zinc/87/99/18/352879918.db2.gz	WMUQOSNHKKFNMV-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
NC(=O)C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000065534654	352954122	/nfs/dbraw/zinc/95/41/22/352954122.db2.gz	JYGPGONEWTYMRG-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000067298897	353043210	/nfs/dbraw/zinc/04/32/10/353043210.db2.gz	TZVIWXBLLWFCBM-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@H]3CO)o2)cc1	ZINC000072609948	353204432	/nfs/dbraw/zinc/20/44/32/353204432.db2.gz	JYWNFYRVJQDSAI-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H]3CO)o2)cc1	ZINC000072609948	353204435	/nfs/dbraw/zinc/20/44/35/353204435.db2.gz	JYWNFYRVJQDSAI-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000093342409	353896522	/nfs/dbraw/zinc/89/65/22/353896522.db2.gz	VJXIKCWAOIZXTL-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC(C)[C@@H]([NH3+])CCN(C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000236779266	202004128	/nfs/dbraw/zinc/00/41/28/202004128.db2.gz	FSEFYYMFRVFYBL-LBPRGKRZSA-N	1	1	319.365	1.917	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C[C@@H]1C(C)C	ZINC000154096058	354204015	/nfs/dbraw/zinc/20/40/15/354204015.db2.gz	JRFRQYNEBRWGSR-CQSZACIVSA-N	1	1	306.366	1.710	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C[C@@H]1C(C)C	ZINC000154096058	354204021	/nfs/dbraw/zinc/20/40/21/354204021.db2.gz	JRFRQYNEBRWGSR-CQSZACIVSA-N	1	1	306.366	1.710	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357244416	291030123	/nfs/dbraw/zinc/03/01/23/291030123.db2.gz	ZZUAFFIVDWGYHY-PHIMTYICSA-N	1	1	321.381	1.764	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000601310472	358490349	/nfs/dbraw/zinc/49/03/49/358490349.db2.gz	PMJFASSNPBLPCY-CABZTGNLSA-N	1	1	307.325	1.946	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN(C)CC[N@@H+](C)C2CC2)c1	ZINC000589516369	354998698	/nfs/dbraw/zinc/99/86/98/354998698.db2.gz	QMHKXWVKLQSLEI-UHFFFAOYSA-N	1	1	321.377	1.907	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC000590011325	355040314	/nfs/dbraw/zinc/04/03/14/355040314.db2.gz	HYVXHWXAYNKYOL-WFASDCNBSA-N	1	1	318.377	1.478	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000590573514	355117722	/nfs/dbraw/zinc/11/77/22/355117722.db2.gz	ZOGOEAPMODYPDR-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])cc3F)C2)CC1	ZINC000591147598	355255133	/nfs/dbraw/zinc/25/51/33/355255133.db2.gz	STIJRALQIWJLHN-NSHDSACASA-N	1	1	323.372	1.709	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3ncc([N+](=O)[O-])cc3F)C2)CC1	ZINC000591147598	355255135	/nfs/dbraw/zinc/25/51/35/355255135.db2.gz	STIJRALQIWJLHN-NSHDSACASA-N	1	1	323.372	1.709	20	5		DDBDMO
CC1(C)C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000591475981	355320364	/nfs/dbraw/zinc/32/03/64/355320364.db2.gz	MUVPKOPVXLVLOA-HNNXBMFYSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000565159467	304047884	/nfs/dbraw/zinc/04/78/84/304047884.db2.gz	YVFNQMVCYPTKCR-MRXNPFEDSA-N	1	1	307.394	1.872	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@H]2CO)c1	ZINC000593024742	355772524	/nfs/dbraw/zinc/77/25/24/355772524.db2.gz	LOCXTLDBABTFBF-QMTHXVAHSA-N	1	1	308.334	1.584	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2C[C@H]1C[S@]2=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000593100114	355796412	/nfs/dbraw/zinc/79/64/12/355796412.db2.gz	CYJCOOKSANJNCT-UTWWPYJBSA-N	1	1	323.374	1.129	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000593108004	355800004	/nfs/dbraw/zinc/80/00/04/355800004.db2.gz	SRQCSIQKBUJKLE-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000593108004	355800007	/nfs/dbraw/zinc/80/00/07/355800007.db2.gz	SRQCSIQKBUJKLE-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@H](C)CCO)cccc1[N+](=O)[O-]	ZINC000593108009	355800046	/nfs/dbraw/zinc/80/00/46/355800046.db2.gz	STKPXDNRAJWSEI-LLVKDONJSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000593992742	356081443	/nfs/dbraw/zinc/08/14/43/356081443.db2.gz	BTEYSBPWTYHUMN-GFCCVEGCSA-N	1	1	321.381	1.065	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](OC3CCC3)C2)c1	ZINC000594027790	356093825	/nfs/dbraw/zinc/09/38/25/356093825.db2.gz	ZVFYKPXMTXZKLD-DZGCQCFKSA-N	1	1	324.381	1.186	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000594057375	356102556	/nfs/dbraw/zinc/10/25/56/356102556.db2.gz	ZQZJXEAQYOXZMR-NWDGAFQWSA-N	1	1	320.349	1.186	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594418563	356203968	/nfs/dbraw/zinc/20/39/68/356203968.db2.gz	KDZXQNSEIRHDJO-NWDGAFQWSA-N	1	1	321.381	1.627	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(CCn1cc([N+](=O)[O-])ccc1=O)C2	ZINC000595505799	356522759	/nfs/dbraw/zinc/52/27/59/356522759.db2.gz	YNVNPIZHEWIAQG-INIZCTEOSA-N	1	1	320.393	1.174	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601339432	358506393	/nfs/dbraw/zinc/50/63/93/358506393.db2.gz	XSFGBFTYKZTQKL-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000595862323	356681876	/nfs/dbraw/zinc/68/18/76/356681876.db2.gz	ABRWVQKIENSLEF-HNNXBMFYSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+][C@@H](CO)c2ccc(F)cc2F)c1	ZINC000595868026	356684562	/nfs/dbraw/zinc/68/45/62/356684562.db2.gz	QQFNKWFOHMKRBG-ZDUSSCGKSA-N	1	1	312.276	1.393	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@H](C(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000276929791	213183036	/nfs/dbraw/zinc/18/30/36/213183036.db2.gz	QRGANFWWAHQVPT-ZDUSSCGKSA-N	1	1	321.377	1.952	20	5		DDBDMO
Cc1ccc(NC(=O)c2c[nH]nc2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-]	ZINC000595923684	356706041	/nfs/dbraw/zinc/70/60/41/356706041.db2.gz	AWZRCFXZVCOOTK-SNVBAGLBSA-N	1	1	315.333	1.956	20	5		DDBDMO
COCCC1C[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000597183637	357087194	/nfs/dbraw/zinc/08/71/94/357087194.db2.gz	ONKCFRAYAOWSTM-UHFFFAOYSA-N	1	1	308.334	1.834	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000597925760	357384392	/nfs/dbraw/zinc/38/43/92/357384392.db2.gz	QYUIJRXBWYBCQS-LBPRGKRZSA-N	1	1	320.393	1.996	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000598595180	357646359	/nfs/dbraw/zinc/64/63/59/357646359.db2.gz	GUVMBIIUJKWFGM-LLVKDONJSA-N	1	1	320.349	1.673	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598647153	357668847	/nfs/dbraw/zinc/66/88/47/357668847.db2.gz	CEBZUTZWMUNWBW-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598647153	357668853	/nfs/dbraw/zinc/66/88/53/357668853.db2.gz	CEBZUTZWMUNWBW-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000598648778	357670363	/nfs/dbraw/zinc/67/03/63/357670363.db2.gz	HGEAZGKGYOHXAO-STQMWFEESA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000598648778	357670367	/nfs/dbraw/zinc/67/03/67/357670367.db2.gz	HGEAZGKGYOHXAO-STQMWFEESA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1cc(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)ccn1	ZINC000347789945	283277937	/nfs/dbraw/zinc/27/79/37/283277937.db2.gz	FDARIJRJKQZZOY-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1cc(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)ccn1	ZINC000347789945	283277940	/nfs/dbraw/zinc/27/79/40/283277940.db2.gz	FDARIJRJKQZZOY-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCC([NH+]2CCOCC2)CC1	ZINC000599101805	357815555	/nfs/dbraw/zinc/81/55/55/357815555.db2.gz	CBIZROJHCHFIEV-UHFFFAOYSA-N	1	1	323.397	1.421	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CCCC[N@@H+](C)C2)n1	ZINC000599137645	357826627	/nfs/dbraw/zinc/82/66/27/357826627.db2.gz	ARVKLQWEIGQFLR-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
CC1([NH+]2CCOCC2)CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000599160225	357833771	/nfs/dbraw/zinc/83/37/71/357833771.db2.gz	KJPADZCUDQHVOJ-UHFFFAOYSA-N	1	1	312.395	1.742	20	5		DDBDMO
Cn1cc(CC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)nn1	ZINC000599263466	357867013	/nfs/dbraw/zinc/86/70/13/357867013.db2.gz	PFUGNRFDBOHFDN-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000179410118	199030866	/nfs/dbraw/zinc/03/08/66/199030866.db2.gz	BEJSEYNPVOMKQX-UHFFFAOYSA-N	1	1	311.338	1.180	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000179410118	199030868	/nfs/dbraw/zinc/03/08/68/199030868.db2.gz	BEJSEYNPVOMKQX-UHFFFAOYSA-N	1	1	311.338	1.180	20	5		DDBDMO
C[N@@H+](C[C@H]1C[C@@H](O)C1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000599654772	358009309	/nfs/dbraw/zinc/00/93/09/358009309.db2.gz	IJQHMVZECFKJPO-BYCMXARLSA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000600472136	358233587	/nfs/dbraw/zinc/23/35/87/358233587.db2.gz	MXUHJTDEHMEEEZ-ZDUSSCGKSA-N	1	1	321.381	1.233	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c(N)cccc1[N+](=O)[O-])C1CCCC1	ZINC000180756751	199205631	/nfs/dbraw/zinc/20/56/31/199205631.db2.gz	YRIOIEZEGNSDJR-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCc2cc([N+](=O)[O-])ccc2OC)CC[N@H+]1C	ZINC000601006017	358379564	/nfs/dbraw/zinc/37/95/64/358379564.db2.gz	QXAWGGAWOBISPH-UONOGXRCSA-N	1	1	321.377	1.950	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc3ncc([N+](=O)[O-])n3n2)C[C@@H]1C	ZINC000348109424	283372871	/nfs/dbraw/zinc/37/28/71/283372871.db2.gz	VLXMWIGSXGNZTM-WDEREUQCSA-N	1	1	304.354	1.556	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](CO)[C@H]3CCOC3)c2c1	ZINC000601159135	358427210	/nfs/dbraw/zinc/42/72/10/358427210.db2.gz	HRMJCTSXDCRKGS-RYUDHWBXSA-N	1	1	317.345	1.622	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1C[C@H]2CC[N@@H+](C)[C@H]2C1	ZINC000601172048	358432418	/nfs/dbraw/zinc/43/24/18/358432418.db2.gz	VCJUUUOJLWONSJ-SFYZADRCSA-N	1	1	319.287	1.487	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000601972937	358760256	/nfs/dbraw/zinc/76/02/56/358760256.db2.gz	ARVGDUGOLBDSDY-TXEJJXNPSA-N	1	1	308.334	1.690	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000602669473	359115428	/nfs/dbraw/zinc/11/54/28/359115428.db2.gz	XOAODBILAHYYAQ-QWHCGFSZSA-N	1	1	308.382	1.967	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](Oc2ccncc2)C1	ZINC000602822491	359217101	/nfs/dbraw/zinc/21/71/01/359217101.db2.gz	QWLKPUJFICRQHA-CQSZACIVSA-N	1	1	317.349	1.648	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000602951373	359317604	/nfs/dbraw/zinc/31/76/04/359317604.db2.gz	JAIATILNGJUXIF-WCQYABFASA-N	1	1	319.365	1.278	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000618467676	363642733	/nfs/dbraw/zinc/64/27/33/363642733.db2.gz	PFKXCJSWCJEBBJ-DGCLKSJQSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000618467676	363642735	/nfs/dbraw/zinc/64/27/35/363642735.db2.gz	PFKXCJSWCJEBBJ-DGCLKSJQSA-N	1	1	307.350	1.352	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602952566	359318717	/nfs/dbraw/zinc/31/87/17/359318717.db2.gz	NPJYSFWTXFODPX-RYUDHWBXSA-N	1	1	321.381	1.667	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000602959527	359322399	/nfs/dbraw/zinc/32/23/99/359322399.db2.gz	VYDQUDVRAHDBDX-NEPJUHHUSA-N	1	1	319.365	1.421	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@](C)(CO)C1	ZINC000602963635	359326154	/nfs/dbraw/zinc/32/61/54/359326154.db2.gz	HPSSJNDNLGQSAH-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cn2cc(C[N@H+]3CCC[C@H]3CO)nn2)c1	ZINC000603165172	359449665	/nfs/dbraw/zinc/44/96/65/359449665.db2.gz	VKOIGJMHZDKRBZ-HNNXBMFYSA-N	1	1	317.349	1.191	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cn2cc(C[N@@H+]3CCC[C@H]3CO)nn2)c1	ZINC000603165172	359449669	/nfs/dbraw/zinc/44/96/69/359449669.db2.gz	VKOIGJMHZDKRBZ-HNNXBMFYSA-N	1	1	317.349	1.191	20	5		DDBDMO
CC1(C)[C@H]([NH+]2CCOCC2)C[C@@H]1Nc1ccc([N+](=O)[O-])nc1	ZINC000603407691	359621927	/nfs/dbraw/zinc/62/19/27/359621927.db2.gz	SPOXAQZFCVGVCK-QWHCGFSZSA-N	1	1	306.366	1.901	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC1(O)CCCCCC1	ZINC000187342037	200098268	/nfs/dbraw/zinc/09/82/68/200098268.db2.gz	VUGZITRFHHXZFO-UHFFFAOYSA-N	1	1	323.393	1.774	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C(C)C)C2)n1	ZINC000281072520	216060666	/nfs/dbraw/zinc/06/06/66/216060666.db2.gz	AQDHWBWORIBIPL-SNVBAGLBSA-N	1	1	308.338	1.671	20	5		DDBDMO
COC(=O)c1cc(C(=O)N[C@@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000604198012	359725641	/nfs/dbraw/zinc/72/56/41/359725641.db2.gz	DHWMFJWOTHPDPI-GFCCVEGCSA-N	1	1	321.333	1.205	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604278145	359732423	/nfs/dbraw/zinc/73/24/23/359732423.db2.gz	KGUGSKGNCCMWEQ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604278145	359732424	/nfs/dbraw/zinc/73/24/24/359732424.db2.gz	KGUGSKGNCCMWEQ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
COC[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	ZINC000189406207	200396119	/nfs/dbraw/zinc/39/61/19/200396119.db2.gz	CQHZVXHKBKFNJB-IUODEOHRSA-N	1	1	310.350	1.709	20	5		DDBDMO
COC[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	ZINC000189406207	200396121	/nfs/dbraw/zinc/39/61/21/200396121.db2.gz	CQHZVXHKBKFNJB-IUODEOHRSA-N	1	1	310.350	1.709	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)NCc1cccc([N+](=O)[O-])c1	ZINC000609573095	360327550	/nfs/dbraw/zinc/32/75/50/360327550.db2.gz	CBTKGDHCPMWKPE-UHFFFAOYSA-N	1	1	324.406	1.443	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)[C@H]2CC[N@H+](C)C2)c([N+](=O)[O-])c1	ZINC000610069333	360377858	/nfs/dbraw/zinc/37/78/58/360377858.db2.gz	LOVBDWGOQAHPGN-ZDUSSCGKSA-N	1	1	320.393	1.773	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Nc2ccncc2[N+](=O)[O-])C[C@@H]1C	ZINC000359027172	299311147	/nfs/dbraw/zinc/31/11/47/299311147.db2.gz	NAHPDXIYIUGYBF-QWRGUYRKSA-N	1	1	307.354	1.358	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000611088489	360620232	/nfs/dbraw/zinc/62/02/32/360620232.db2.gz	ZGJLAAPFXSAASL-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000611088489	360620234	/nfs/dbraw/zinc/62/02/34/360620234.db2.gz	ZGJLAAPFXSAASL-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCC[C@@H]1O	ZINC000611285737	360690353	/nfs/dbraw/zinc/69/03/53/360690353.db2.gz	KBFKHTJTMBTQGS-RISCZKNCSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCOC1	ZINC000612059422	360904536	/nfs/dbraw/zinc/90/45/36/360904536.db2.gz	RSACOTZNVOHBFT-ZIAGYGMSSA-N	1	1	324.377	1.693	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000281357589	216247344	/nfs/dbraw/zinc/24/73/44/216247344.db2.gz	ZYHYKALFETVRHJ-HNNXBMFYSA-N	1	1	318.333	1.694	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C(=O)NCC[C@@H]1C	ZINC000193633894	201091408	/nfs/dbraw/zinc/09/14/08/201091408.db2.gz	JMJVIXQRGVJDHE-NHYWBVRUSA-N	1	1	321.377	1.996	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252436	363945724	/nfs/dbraw/zinc/94/57/24/363945724.db2.gz	LLOSIYFJQIKRRX-GJZGRUSLSA-N	1	1	321.352	1.782	20	5		DDBDMO
Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000261628183	203082637	/nfs/dbraw/zinc/08/26/37/203082637.db2.gz	AQPKFHNTJBFGGT-JTQLQIEISA-N	1	1	321.362	1.177	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCc2c[nH+]c(N(C)C)n2C)c1	ZINC000266156420	205142882	/nfs/dbraw/zinc/14/28/82/205142882.db2.gz	SAHFPRLTYOWRPY-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])cnc2N)[nH+]1	ZINC000351557873	284377760	/nfs/dbraw/zinc/37/77/60/284377760.db2.gz	LGAZTBGIORUXIY-UHFFFAOYSA-N	1	1	316.321	1.117	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1	ZINC000332693283	248894034	/nfs/dbraw/zinc/89/40/34/248894034.db2.gz	KTXXPPULRSOSED-NSHDSACASA-N	1	1	309.370	1.051	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc(F)cc1[N+](=O)[O-]	ZINC000336862215	249269856	/nfs/dbraw/zinc/26/98/56/249269856.db2.gz	HPFDGBWIUVHNRN-SECBINFHSA-N	1	1	308.313	1.283	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNc2ncc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000273934810	211187953	/nfs/dbraw/zinc/18/79/53/211187953.db2.gz	KZEMGUSHBRJFLQ-TXEJJXNPSA-N	1	1	309.370	1.686	20	5		DDBDMO
CN1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1=O	ZINC000338954301	250216498	/nfs/dbraw/zinc/21/64/98/250216498.db2.gz	MVOZSSZAMLNPSK-VIFPVBQESA-N	1	1	315.276	1.517	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2[C@H]2CCC[C@@H]2O)cc1	ZINC000285020509	218258695	/nfs/dbraw/zinc/25/86/95/218258695.db2.gz	ZCFHCPNTCCCPCM-ZACQAIPSSA-N	1	1	320.389	1.999	20	5		DDBDMO
CC(C)OC(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000567578619	304226608	/nfs/dbraw/zinc/22/66/08/304226608.db2.gz	LCUAZSOVMDGALK-UHFFFAOYSA-N	1	1	322.365	1.454	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341025446	251345118	/nfs/dbraw/zinc/34/51/18/251345118.db2.gz	JCNSXHOKDYJJTC-TZMCWYRMSA-N	1	1	320.393	1.919	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)c1ncc([N+](=O)[O-])s1	ZINC000341054692	251357134	/nfs/dbraw/zinc/35/71/34/251357134.db2.gz	SKFHUYXUYLWTOX-UHFFFAOYSA-N	1	1	301.416	1.371	20	5		DDBDMO
CN(CCCN(C)c1ncc([N+](=O)[O-])s1)CC[NH+](C)C	ZINC000341054692	251357137	/nfs/dbraw/zinc/35/71/37/251357137.db2.gz	SKFHUYXUYLWTOX-UHFFFAOYSA-N	1	1	301.416	1.371	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@H](CNC(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000352425674	285041741	/nfs/dbraw/zinc/04/17/41/285041741.db2.gz	MORRKXVFAZCYDC-AWEZNQCLSA-N	1	1	321.377	1.952	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@]1(C)CO	ZINC000567970558	304256766	/nfs/dbraw/zinc/25/67/66/304256766.db2.gz	ICJWDIAWSILKOG-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@]1(C)CO	ZINC000567970558	304256768	/nfs/dbraw/zinc/25/67/68/304256768.db2.gz	ICJWDIAWSILKOG-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
[NH3+]C[C@@H]1CCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000157647624	197204516	/nfs/dbraw/zinc/20/45/16/197204516.db2.gz	YRNOMQDDUCANHX-KWQFWETISA-N	1	1	303.322	1.328	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@H]1C1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000414778116	224392807	/nfs/dbraw/zinc/39/28/07/224392807.db2.gz	GDDRGBDVKCXDGX-CVEARBPZSA-N	1	1	305.378	1.923	20	5		DDBDMO
[NH3+]C[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC12CCOCC2	ZINC000414796995	224396535	/nfs/dbraw/zinc/39/65/35/224396535.db2.gz	YMTPBLMFGVCPLT-AWEZNQCLSA-N	1	1	305.378	1.782	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000444348972	533399742	/nfs/dbraw/zinc/39/97/42/533399742.db2.gz	CPIADANUQANLFB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000444348972	533399750	/nfs/dbraw/zinc/39/97/50/533399750.db2.gz	CPIADANUQANLFB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2[C@@H]2CCCOC2)c1	ZINC000569453280	304355145	/nfs/dbraw/zinc/35/51/45/304355145.db2.gz	UVMIDDYHOWZRER-BPLDGKMQSA-N	1	1	324.381	1.043	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[N@H+](C(C)C)CC1	ZINC000068775377	406663289	/nfs/dbraw/zinc/66/32/89/406663289.db2.gz	KAWJSZWKMDZUOZ-UHFFFAOYSA-N	1	1	323.397	1.433	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(CO)CC1	ZINC000071955887	406869906	/nfs/dbraw/zinc/86/99/06/406869906.db2.gz	BFUSLIQCKUQGRC-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H]1CCCO1	ZINC000076299729	406962404	/nfs/dbraw/zinc/96/24/04/406962404.db2.gz	JACNUHYUQQGZNZ-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H]1CCCO1	ZINC000076299729	406962405	/nfs/dbraw/zinc/96/24/05/406962405.db2.gz	JACNUHYUQQGZNZ-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC(C)[C@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000066498404	407251834	/nfs/dbraw/zinc/25/18/34/407251834.db2.gz	ABKXUSBYBPXQNZ-HNNXBMFYSA-N	1	1	321.377	1.820	20	5		DDBDMO
CC(C)[C@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000066498404	407251836	/nfs/dbraw/zinc/25/18/36/407251836.db2.gz	ABKXUSBYBPXQNZ-HNNXBMFYSA-N	1	1	321.377	1.820	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000102332212	407321701	/nfs/dbraw/zinc/32/17/01/407321701.db2.gz	VQGWXXKMWYQUGJ-LBPRGKRZSA-N	1	1	323.397	1.517	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000123246325	407323902	/nfs/dbraw/zinc/32/39/02/407323902.db2.gz	WHTUENXVUYFUOZ-VXGBXAGGSA-N	1	1	323.397	1.468	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000067709386	407281785	/nfs/dbraw/zinc/28/17/85/407281785.db2.gz	MQWUQHRQYJEQOQ-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@](C)(O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000124919844	407374147	/nfs/dbraw/zinc/37/41/47/407374147.db2.gz	SCJZIDPGACAHQQ-HNNXBMFYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@](C)(O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000124919844	407374148	/nfs/dbraw/zinc/37/41/48/407374148.db2.gz	SCJZIDPGACAHQQ-HNNXBMFYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000107887212	407381275	/nfs/dbraw/zinc/38/12/75/407381275.db2.gz	QGOROFAZHSPSAT-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000107887212	407381276	/nfs/dbraw/zinc/38/12/76/407381276.db2.gz	QGOROFAZHSPSAT-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000107887212	407381277	/nfs/dbraw/zinc/38/12/77/407381277.db2.gz	QGOROFAZHSPSAT-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000126236859	407409132	/nfs/dbraw/zinc/40/91/32/407409132.db2.gz	UMQOGJQANOALJJ-WDEREUQCSA-N	1	1	323.397	1.487	20	5		DDBDMO
CC(C)(C)C[N@@H+](CCCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000112599424	407433480	/nfs/dbraw/zinc/43/34/80/407433480.db2.gz	TVRNALKHOCTFHZ-UHFFFAOYSA-N	1	1	323.393	1.924	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1	ZINC000185765671	407497487	/nfs/dbraw/zinc/49/74/87/407497487.db2.gz	WVRYESJCWQQFMA-OUKQBFOZSA-N	1	1	321.377	1.693	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000266543047	407551993	/nfs/dbraw/zinc/55/19/93/407551993.db2.gz	QWAWGEZLDOUFMY-LBPRGKRZSA-N	1	1	310.350	1.951	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000178759863	407590371	/nfs/dbraw/zinc/59/03/71/407590371.db2.gz	HBZNDXINLIZGQR-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@](O)(C(F)(F)F)C1	ZINC000266881638	407660227	/nfs/dbraw/zinc/66/02/27/407660227.db2.gz	XNZZCELUIMIMLW-GFCCVEGCSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@](O)(C(F)(F)F)C1	ZINC000266881638	407660235	/nfs/dbraw/zinc/66/02/35/407660235.db2.gz	XNZZCELUIMIMLW-GFCCVEGCSA-N	1	1	320.267	1.973	20	5		DDBDMO
CCOCC[NH+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000267065276	407736673	/nfs/dbraw/zinc/73/66/73/407736673.db2.gz	UTBBMKBCUNPPJH-UHFFFAOYSA-N	1	1	311.357	1.888	20	5		DDBDMO
C[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000187129166	407820550	/nfs/dbraw/zinc/82/05/50/407820550.db2.gz	WMZXDRJGAZQYTH-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000187129166	407820555	/nfs/dbraw/zinc/82/05/55/407820555.db2.gz	WMZXDRJGAZQYTH-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000173399873	407878181	/nfs/dbraw/zinc/87/81/81/407878181.db2.gz	VAEBQHUEWHQDFD-KGLIPLIRSA-N	1	1	306.410	1.881	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000268245213	407967614	/nfs/dbraw/zinc/96/76/14/407967614.db2.gz	VYBAKZSZCWKZTC-JOYOIKCWSA-N	1	1	321.381	1.483	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000272551636	407978103	/nfs/dbraw/zinc/97/81/03/407978103.db2.gz	YZHHRYHZBYRZKB-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000174330764	407933225	/nfs/dbraw/zinc/93/32/25/407933225.db2.gz	SWXZEWPEEFRXMD-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000174330764	407933227	/nfs/dbraw/zinc/93/32/27/407933227.db2.gz	SWXZEWPEEFRXMD-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000272562888	407984562	/nfs/dbraw/zinc/98/45/62/407984562.db2.gz	UNRDILDCLUKAFC-OCCSQVGLSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(C)(CO)CO	ZINC000135885516	408060393	/nfs/dbraw/zinc/06/03/93/408060393.db2.gz	JFNNSJJXTDHAEI-UHFFFAOYSA-N	1	1	312.366	1.286	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000245872941	408087691	/nfs/dbraw/zinc/08/76/91/408087691.db2.gz	HEQZTKKFBGNFQS-MNOVXSKESA-N	1	1	309.370	1.179	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1(CO)CC1	ZINC000190007275	408145756	/nfs/dbraw/zinc/14/57/56/408145756.db2.gz	HTMDIRMISPXBJG-UHFFFAOYSA-N	1	1	308.334	1.666	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1(CO)CC1	ZINC000190007275	408145758	/nfs/dbraw/zinc/14/57/58/408145758.db2.gz	HTMDIRMISPXBJG-UHFFFAOYSA-N	1	1	308.334	1.666	20	5		DDBDMO
CCC[N@@H+](CCO)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000121446486	408214899	/nfs/dbraw/zinc/21/48/99/408214899.db2.gz	SEMHXZOYRCRLOU-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
Nc1nc(N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ncc1[N+](=O)[O-]	ZINC000269427724	408305771	/nfs/dbraw/zinc/30/57/71/408305771.db2.gz	OJQKNFJRHJVVPE-JQWIXIFHSA-N	1	1	318.381	1.420	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000269439045	408310773	/nfs/dbraw/zinc/31/07/73/408310773.db2.gz	DCXBPYUYZNTRRR-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000183208503	408354043	/nfs/dbraw/zinc/35/40/43/408354043.db2.gz	DSAWPCPXUKTZTM-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(CN1CCC[N@H+](C2CC2)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000172346410	162270624	/nfs/dbraw/zinc/27/06/24/162270624.db2.gz	UMHQVIVHYNBRFR-UHFFFAOYSA-N	1	1	318.377	1.703	20	5		DDBDMO
C[NH+](C)Cc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1	ZINC000159150735	408385991	/nfs/dbraw/zinc/38/59/91/408385991.db2.gz	GNBFSYZWIMULHB-UHFFFAOYSA-N	1	1	303.322	1.310	20	5		DDBDMO
C[C@@H](O)[C@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475398	408508172	/nfs/dbraw/zinc/50/81/72/408508172.db2.gz	YPJSBOZDQBIYQZ-IUODEOHRSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@@H](O)[C@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475398	408508175	/nfs/dbraw/zinc/50/81/75/408508175.db2.gz	YPJSBOZDQBIYQZ-IUODEOHRSA-N	1	1	321.377	1.793	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000183950526	408513969	/nfs/dbraw/zinc/51/39/69/408513969.db2.gz	FGLQJWQEVYBOTN-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)(C)O	ZINC000265155464	408564392	/nfs/dbraw/zinc/56/43/92/408564392.db2.gz	UMMUZBGQBNFFOV-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCOC[C@H]1C1CC1	ZINC000248440584	408566868	/nfs/dbraw/zinc/56/68/68/408566868.db2.gz	DCFFUNWRYHJCRQ-HIFRSBDPSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCOC[C@H]1C1CC1	ZINC000248440584	408566876	/nfs/dbraw/zinc/56/68/76/408566876.db2.gz	DCFFUNWRYHJCRQ-HIFRSBDPSA-N	1	1	322.361	1.445	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177154586	408536674	/nfs/dbraw/zinc/53/66/74/408536674.db2.gz	XZBJJXOBUOCYFP-MWLCHTKSSA-N	1	1	304.350	1.532	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000162380457	408695433	/nfs/dbraw/zinc/69/54/33/408695433.db2.gz	SZSKJWKDQGRHES-ZDUSSCGKSA-N	1	1	305.378	1.904	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194058913	408761127	/nfs/dbraw/zinc/76/11/27/408761127.db2.gz	QSNILOWKNBHATI-SECBINFHSA-N	1	1	310.310	1.317	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194058913	408761132	/nfs/dbraw/zinc/76/11/32/408761132.db2.gz	QSNILOWKNBHATI-SECBINFHSA-N	1	1	310.310	1.317	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000265733793	408761959	/nfs/dbraw/zinc/76/19/59/408761959.db2.gz	AJJBRIDONRNKRX-NSHDSACASA-N	1	1	308.334	1.930	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290796091	408834504	/nfs/dbraw/zinc/83/45/04/408834504.db2.gz	OXZPUSXUKRAAAE-NSHDSACASA-N	1	1	321.381	1.257	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000285742685	408854551	/nfs/dbraw/zinc/85/45/51/408854551.db2.gz	LBPORQYPDAGMDM-MFKMUULPSA-N	1	1	319.365	1.407	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCC(F)(F)[C@@H](CO)C2)cc1	ZINC000291624207	408896622	/nfs/dbraw/zinc/89/66/22/408896622.db2.gz	CWUHZYBOZLTKIO-LLVKDONJSA-N	1	1	316.304	1.923	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000277398218	408933367	/nfs/dbraw/zinc/93/33/67/408933367.db2.gz	BDSAUYFMYHYCIM-LBPRGKRZSA-N	1	1	321.381	1.383	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000291992232	408957551	/nfs/dbraw/zinc/95/75/51/408957551.db2.gz	WXKLQIDYYJDNME-UONOGXRCSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCNC1=O	ZINC000282178782	409005787	/nfs/dbraw/zinc/00/57/87/409005787.db2.gz	VPHUGUMMVZRXPQ-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1(CO)CCC1	ZINC000292264933	409013359	/nfs/dbraw/zinc/01/33/59/409013359.db2.gz	ZBESQVFEAPYWCI-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1(CO)CCC1	ZINC000292264933	409013360	/nfs/dbraw/zinc/01/33/60/409013360.db2.gz	ZBESQVFEAPYWCI-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](OCc3ccncc3)C2)n1	ZINC000287639385	409068747	/nfs/dbraw/zinc/06/87/47/409068747.db2.gz	GBRKRXPOJCQONG-AWEZNQCLSA-N	1	1	317.349	1.477	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000283773303	409213874	/nfs/dbraw/zinc/21/38/74/409213874.db2.gz	PQEHCUIKHRTBKU-OAHLLOKOSA-N	1	1	312.366	1.348	20	5		DDBDMO
COC(=O)c1cc(C)nc(N(C)[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000283935751	409242284	/nfs/dbraw/zinc/24/22/84/409242284.db2.gz	XUBKKAVSRQEUJC-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000280290279	409286022	/nfs/dbraw/zinc/28/60/22/409286022.db2.gz	RDYLKHPDMVJPMK-UHFFFAOYSA-N	1	1	307.354	1.433	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000280290279	409286024	/nfs/dbraw/zinc/28/60/24/409286024.db2.gz	RDYLKHPDMVJPMK-UHFFFAOYSA-N	1	1	307.354	1.433	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21	ZINC000284887863	409369053	/nfs/dbraw/zinc/36/90/53/409369053.db2.gz	GWNNXUMCCNJIDR-KBPBESRZSA-N	1	1	317.349	1.380	20	5		DDBDMO
C[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000280537985	409347772	/nfs/dbraw/zinc/34/77/72/409347772.db2.gz	PLMLNRRPYFNXOW-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000280537985	409347781	/nfs/dbraw/zinc/34/77/81/409347781.db2.gz	PLMLNRRPYFNXOW-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1	ZINC000285390753	409424573	/nfs/dbraw/zinc/42/45/73/409424573.db2.gz	NXXJLDZYXQMSML-GXTWGEPZSA-N	1	1	320.353	1.103	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2c2cc[nH]n2)c1	ZINC000285390753	409424579	/nfs/dbraw/zinc/42/45/79/409424579.db2.gz	NXXJLDZYXQMSML-GXTWGEPZSA-N	1	1	320.353	1.103	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331513245	409587696	/nfs/dbraw/zinc/58/76/96/409587696.db2.gz	MZHHIBLWVQVJGP-JTQLQIEISA-N	1	1	305.334	1.570	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000354008342	409597753	/nfs/dbraw/zinc/59/77/53/409597753.db2.gz	SINDALPGBYZFNW-LLVKDONJSA-N	1	1	309.370	1.079	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2ccccc2)c1	ZINC000304339052	409610008	/nfs/dbraw/zinc/61/00/08/409610008.db2.gz	PGALAKOWPHARFT-HOTGVXAUSA-N	1	1	316.361	1.989	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356793986	409611118	/nfs/dbraw/zinc/61/11/18/409611118.db2.gz	LWBVGLBWLPTQQB-QWRGUYRKSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356793986	409611125	/nfs/dbraw/zinc/61/11/25/409611125.db2.gz	LWBVGLBWLPTQQB-QWRGUYRKSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCC(=O)N1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000305157871	409706663	/nfs/dbraw/zinc/70/66/63/409706663.db2.gz	DBROKMZIJFAEAH-OAHLLOKOSA-N	1	1	321.377	1.573	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000305157871	409706672	/nfs/dbraw/zinc/70/66/72/409706672.db2.gz	DBROKMZIJFAEAH-OAHLLOKOSA-N	1	1	321.377	1.573	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)c1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000342788904	409907841	/nfs/dbraw/zinc/90/78/41/409907841.db2.gz	NYJOYXYCWNNUIR-NSHDSACASA-N	1	1	306.366	1.614	20	5		DDBDMO
C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000354521309	409915023	/nfs/dbraw/zinc/91/50/23/409915023.db2.gz	NHZDAZDFWUSWHK-WCQYABFASA-N	1	1	315.333	1.146	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000332096657	409876745	/nfs/dbraw/zinc/87/67/45/409876745.db2.gz	OIPIUKAXRCSUIW-UHFFFAOYSA-N	1	1	317.349	1.751	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Nc3ccncc3[N+](=O)[O-])C2)C1	ZINC000297855308	410028476	/nfs/dbraw/zinc/02/84/76/410028476.db2.gz	TXIKWKJAJGQPOZ-AWEZNQCLSA-N	1	1	305.338	1.549	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000332272981	410032276	/nfs/dbraw/zinc/03/22/76/410032276.db2.gz	PYJLSUGWGIQJPY-LLVKDONJSA-N	1	1	316.361	1.781	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000332272981	410032278	/nfs/dbraw/zinc/03/22/78/410032278.db2.gz	PYJLSUGWGIQJPY-LLVKDONJSA-N	1	1	316.361	1.781	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC[C@@H](C)C1	ZINC000332355525	410088373	/nfs/dbraw/zinc/08/83/73/410088373.db2.gz	PVAOXFIMSDRNFB-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCOC[C@@H](C)C1	ZINC000332355525	410088381	/nfs/dbraw/zinc/08/83/81/410088381.db2.gz	PVAOXFIMSDRNFB-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@H]1C	ZINC000346695005	410091154	/nfs/dbraw/zinc/09/11/54/410091154.db2.gz	XRTIGVQTGIDDNE-GXFFZTMASA-N	1	1	308.334	1.987	20	5		DDBDMO
C[C@@H]1C[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](C)N1C	ZINC000339632120	410343873	/nfs/dbraw/zinc/34/38/73/410343873.db2.gz	WSMZFLLBZJAREM-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343451721	410463345	/nfs/dbraw/zinc/46/33/45/410463345.db2.gz	OLEBVOQRUXOEFW-QWHCGFSZSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000343550615	410525680	/nfs/dbraw/zinc/52/56/80/410525680.db2.gz	CCXJOILHUVPQTH-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343609416	410568099	/nfs/dbraw/zinc/56/80/99/410568099.db2.gz	SJUUGEFOEVFGRD-DGCLKSJQSA-N	1	1	306.366	1.877	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000343572767	410541440	/nfs/dbraw/zinc/54/14/40/410541440.db2.gz	PIVGJHPBUVPUPD-AWEZNQCLSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@H]1COCCN1CC[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352570319	410666618	/nfs/dbraw/zinc/66/66/18/410666618.db2.gz	FXWNAMSRGQLEBP-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1(S(C)(=O)=O)CC1	ZINC000353051132	410760525	/nfs/dbraw/zinc/76/05/25/410760525.db2.gz	XQAIAZJSMJQUOU-QMMMGPOBSA-N	1	1	304.393	1.712	20	5		DDBDMO
Cn1[nH]c([C@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000340216324	410764463	/nfs/dbraw/zinc/76/44/63/410764463.db2.gz	YZIAOXPMKHBZSF-CYBMUJFWSA-N	1	1	316.365	1.515	20	5		DDBDMO
Cn1[nH]c([C@H]2CCC[N@H+]2CCc2ccc([N+](=O)[O-])cc2)nc1=N	ZINC000340216324	410764473	/nfs/dbraw/zinc/76/44/73/410764473.db2.gz	YZIAOXPMKHBZSF-CYBMUJFWSA-N	1	1	316.365	1.515	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600202	410814482	/nfs/dbraw/zinc/81/44/82/410814482.db2.gz	FQIZJXFWBXMKHV-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600202	410814490	/nfs/dbraw/zinc/81/44/90/410814490.db2.gz	FQIZJXFWBXMKHV-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600202	410814493	/nfs/dbraw/zinc/81/44/93/410814493.db2.gz	FQIZJXFWBXMKHV-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000330600202	410814500	/nfs/dbraw/zinc/81/45/00/410814500.db2.gz	FQIZJXFWBXMKHV-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000353236586	410871682	/nfs/dbraw/zinc/87/16/82/410871682.db2.gz	SWFCGUJCGKVMOR-FZMZJTMJSA-N	1	1	307.350	1.667	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000344044941	410916827	/nfs/dbraw/zinc/91/68/27/410916827.db2.gz	XVGBWYJJIGANLG-TUKIKUTGSA-N	1	1	319.361	1.626	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC[N@H+]1C	ZINC000331135296	410969663	/nfs/dbraw/zinc/96/96/63/410969663.db2.gz	KHKZBGYDEBFGLC-LBPRGKRZSA-N	1	1	308.338	1.108	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1(O)CCC1	ZINC000353465497	411007167	/nfs/dbraw/zinc/00/71/67/411007167.db2.gz	FCYPCRFPIWNIGQ-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399690	411010899	/nfs/dbraw/zinc/01/08/99/411010899.db2.gz	YMXCIWFECXCOBX-VXGBXAGGSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399690	411010905	/nfs/dbraw/zinc/01/09/05/411010905.db2.gz	YMXCIWFECXCOBX-VXGBXAGGSA-N	1	1	305.334	1.657	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000331197236	411011306	/nfs/dbraw/zinc/01/13/06/411011306.db2.gz	OCNYOQCGKTYBCF-LBPRGKRZSA-N	1	1	307.350	1.445	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000331197236	411011308	/nfs/dbraw/zinc/01/13/08/411011308.db2.gz	OCNYOQCGKTYBCF-LBPRGKRZSA-N	1	1	307.350	1.445	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1C	ZINC000353490960	411028620	/nfs/dbraw/zinc/02/86/20/411028620.db2.gz	LOKGZRXUJWUTON-QWRGUYRKSA-N	1	1	321.381	1.517	20	5		DDBDMO
NC(=O)NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000130689636	196101454	/nfs/dbraw/zinc/10/14/54/196101454.db2.gz	COHHUYOKVVQCAR-UHFFFAOYSA-N	1	1	306.322	1.144	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H](C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC000134066229	196358431	/nfs/dbraw/zinc/35/84/31/196358431.db2.gz	IBGZSPCMMYGAPS-ZDUSSCGKSA-N	1	1	321.377	1.601	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)n1	ZINC000191678709	222107047	/nfs/dbraw/zinc/10/70/47/222107047.db2.gz	WECAAVLCWGPBQZ-NEPJUHHUSA-N	1	1	321.381	1.368	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000367825320	418640601	/nfs/dbraw/zinc/64/06/01/418640601.db2.gz	JJGLHMIUEKDREC-GFCCVEGCSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000361408894	418646343	/nfs/dbraw/zinc/64/63/43/418646343.db2.gz	QRPMYAUKBKGVBV-GFCCVEGCSA-N	1	1	318.333	1.990	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000361408894	418646345	/nfs/dbraw/zinc/64/63/45/418646345.db2.gz	QRPMYAUKBKGVBV-GFCCVEGCSA-N	1	1	318.333	1.990	20	5		DDBDMO
O=C1NCCN1[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000361309790	418623612	/nfs/dbraw/zinc/62/36/12/418623612.db2.gz	MTTVHTNQIUPWCJ-CQSZACIVSA-N	1	1	304.350	1.584	20	5		DDBDMO
O=C1NCCN1[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000361309790	418623614	/nfs/dbraw/zinc/62/36/14/418623614.db2.gz	MTTVHTNQIUPWCJ-CQSZACIVSA-N	1	1	304.350	1.584	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCC[N@H+]([C@H](C)CO)CC1	ZINC000375502215	418651794	/nfs/dbraw/zinc/65/17/94/418651794.db2.gz	RFOYOUUEHFERSA-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000375668208	418670841	/nfs/dbraw/zinc/67/08/41/418670841.db2.gz	DNOMXMNIDZOPBW-RRFJBIMHSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000375668208	418670843	/nfs/dbraw/zinc/67/08/43/418670843.db2.gz	DNOMXMNIDZOPBW-RRFJBIMHSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000375668208	418670845	/nfs/dbraw/zinc/67/08/45/418670845.db2.gz	DNOMXMNIDZOPBW-RRFJBIMHSA-N	1	1	303.362	1.290	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@](C)(C(N)=O)C1	ZINC000361552658	418676603	/nfs/dbraw/zinc/67/66/03/418676603.db2.gz	LVBZEPSLWICOKO-HNNXBMFYSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000361552658	418676604	/nfs/dbraw/zinc/67/66/04/418676604.db2.gz	LVBZEPSLWICOKO-HNNXBMFYSA-N	1	1	320.349	1.039	20	5		DDBDMO
CCCNC(=O)CCC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000411480158	418907995	/nfs/dbraw/zinc/90/79/95/418907995.db2.gz	NRWNRMLUUJVMIT-UHFFFAOYSA-N	1	1	306.366	1.654	20	5		DDBDMO
CCCNC(=O)CCC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000411480158	418907997	/nfs/dbraw/zinc/90/79/97/418907997.db2.gz	NRWNRMLUUJVMIT-UHFFFAOYSA-N	1	1	306.366	1.654	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1CCO	ZINC000426236888	419417101	/nfs/dbraw/zinc/41/71/01/419417101.db2.gz	KHAXXHFZYIQLHJ-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1CCO	ZINC000426236888	419417113	/nfs/dbraw/zinc/41/71/13/419417113.db2.gz	KHAXXHFZYIQLHJ-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
CCn1nccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000425975838	419376432	/nfs/dbraw/zinc/37/64/32/419376432.db2.gz	HTISBXOYWHDJOP-UHFFFAOYSA-N	1	1	304.354	1.845	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420996435	419432867	/nfs/dbraw/zinc/43/28/67/419432867.db2.gz	ATNUYQRECVNQAN-RISCZKNCSA-N	1	1	307.350	1.769	20	5		DDBDMO
CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCC[N@H+]1C	ZINC000421000179	419433152	/nfs/dbraw/zinc/43/31/52/419433152.db2.gz	KANZSJACSKSMHN-CABCVRRESA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000179	419433157	/nfs/dbraw/zinc/43/31/57/419433157.db2.gz	KANZSJACSKSMHN-CABCVRRESA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421000179	419433159	/nfs/dbraw/zinc/43/31/59/419433159.db2.gz	KANZSJACSKSMHN-CABCVRRESA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](CO)[C@@H]1C	ZINC000412072594	419624347	/nfs/dbraw/zinc/62/43/47/419624347.db2.gz	HJLUJOKWROZUNS-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](CO)[C@@H]1C	ZINC000412072594	419624354	/nfs/dbraw/zinc/62/43/54/419624354.db2.gz	HJLUJOKWROZUNS-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1	ZINC000421706657	419692115	/nfs/dbraw/zinc/69/21/15/419692115.db2.gz	VKMUPIMSJYAIFF-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1ccnn1Cc1cccc(C[NH+]2CCOCC2)c1	ZINC000421842866	419747207	/nfs/dbraw/zinc/74/72/07/419747207.db2.gz	LTHTZWQLDXZGEG-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1Cc1ccc(C[NH+]2CCOCC2)cc1	ZINC000421842333	419748123	/nfs/dbraw/zinc/74/81/23/419748123.db2.gz	KSDFEOVOHYKSGO-UHFFFAOYSA-N	1	1	316.361	1.980	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000432249307	229090535	/nfs/dbraw/zinc/09/05/35/229090535.db2.gz	CUTUUKFJVVFKQQ-STQMWFEESA-N	1	1	321.377	1.833	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)C1	ZINC000415631666	420129354	/nfs/dbraw/zinc/12/93/54/420129354.db2.gz	NJXVXLLVCKNTFZ-ZDUSSCGKSA-N	1	1	314.292	1.899	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4nnc[nH]4)C3)nc2c1	ZINC000425554810	420417078	/nfs/dbraw/zinc/41/70/78/420417078.db2.gz	WSWWOTDRWZDGBC-SECBINFHSA-N	1	1	314.305	1.844	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)nc2c1	ZINC000425554810	420417079	/nfs/dbraw/zinc/41/70/79/420417079.db2.gz	WSWWOTDRWZDGBC-SECBINFHSA-N	1	1	314.305	1.844	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H](CO)[C@@H]1CCCO1	ZINC000447911288	420816529	/nfs/dbraw/zinc/81/65/29/420816529.db2.gz	ZMWAQJXWMDWBER-AAEUAGOBSA-N	1	1	300.742	1.878	20	5		DDBDMO
CC[N@H+]1CC[C@H](NC(=O)/C=C/c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000493700484	420919437	/nfs/dbraw/zinc/91/94/37/420919437.db2.gz	XREIQTVPRSKORQ-BPJJOFIESA-N	1	1	307.325	1.958	20	5		DDBDMO
CNc1nc(C(=O)N2CC[NH+](C(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000454588156	420887580	/nfs/dbraw/zinc/88/75/80/420887580.db2.gz	HPMKVOWZONZBJT-UHFFFAOYSA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(-n2ccnc2)c1	ZINC000448975277	420926328	/nfs/dbraw/zinc/92/63/28/420926328.db2.gz	GVXLYFCDEGSCSP-UHFFFAOYSA-N	1	1	317.349	1.462	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455625955	421045410	/nfs/dbraw/zinc/04/54/10/421045410.db2.gz	OOSWVTIMYLNURX-LLVKDONJSA-N	1	1	321.381	1.636	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488767295	421113253	/nfs/dbraw/zinc/11/32/53/421113253.db2.gz	VTVTVGZCRIXWSI-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488767295	421113256	/nfs/dbraw/zinc/11/32/56/421113256.db2.gz	VTVTVGZCRIXWSI-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1CCO	ZINC000456216421	421124297	/nfs/dbraw/zinc/12/42/97/421124297.db2.gz	VHIWXJNPXPEVCX-BETUJISGSA-N	1	1	321.377	1.051	20	5		DDBDMO
Nc1c(F)c(NC[C@@H]2CCC[N@H+]2CCCO)ccc1[N+](=O)[O-]	ZINC000450590407	421213320	/nfs/dbraw/zinc/21/33/20/421213320.db2.gz	DREQMIUMMJHKAI-JTQLQIEISA-N	1	1	312.345	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+]2CCCO)c1	ZINC000450593998	421214360	/nfs/dbraw/zinc/21/43/60/421214360.db2.gz	JWWUYSGXEGVKEX-LBPRGKRZSA-N	1	1	309.366	1.862	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000525805301	421302631	/nfs/dbraw/zinc/30/26/31/421302631.db2.gz	KFCSYMZHRNAVHR-SNVBAGLBSA-N	1	1	321.333	1.395	20	5		DDBDMO
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)c1c[nH]nc1[N+](=O)[O-]	ZINC000554835946	421662717	/nfs/dbraw/zinc/66/27/17/421662717.db2.gz	RYDSPINPLVTZHL-LLVKDONJSA-N	1	1	319.321	1.478	20	5		DDBDMO
CCn1cc(C[N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cn1	ZINC000535585016	421705569	/nfs/dbraw/zinc/70/55/69/421705569.db2.gz	FNROCVHOCVJLCI-UHFFFAOYSA-N	1	1	305.338	1.105	20	5		DDBDMO
CCn1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cn1	ZINC000535585016	421705571	/nfs/dbraw/zinc/70/55/71/421705571.db2.gz	FNROCVHOCVJLCI-UHFFFAOYSA-N	1	1	305.338	1.105	20	5		DDBDMO
COC(=O)c1cnc(NC[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000572090480	421764513	/nfs/dbraw/zinc/76/45/13/421764513.db2.gz	LEQJCYNAQOXHNM-JTQLQIEISA-N	1	1	320.349	1.673	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+]3CCOC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000543479538	421838391	/nfs/dbraw/zinc/83/83/91/421838391.db2.gz	FOMPBDGOGJSGCW-CYBMUJFWSA-N	1	1	307.350	1.514	20	5		DDBDMO
CCOc1cc(N2CC[N@H+]3CCOC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000543479538	421838392	/nfs/dbraw/zinc/83/83/92/421838392.db2.gz	FOMPBDGOGJSGCW-CYBMUJFWSA-N	1	1	307.350	1.514	20	5		DDBDMO
CC[C@]1(O)CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000602983651	422440529	/nfs/dbraw/zinc/44/05/29/422440529.db2.gz	PAQWYFGYFVSFIA-INIZCTEOSA-N	1	1	321.377	1.795	20	5		DDBDMO
CC[C@]1(O)CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000602983651	422440533	/nfs/dbraw/zinc/44/05/33/422440533.db2.gz	PAQWYFGYFVSFIA-INIZCTEOSA-N	1	1	321.377	1.795	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCCC[C@H]1CCO	ZINC000342070547	271290370	/nfs/dbraw/zinc/29/03/70/271290370.db2.gz	WRPSCGQBBWGEDU-ZDUSSCGKSA-N	1	1	309.366	1.384	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)Nc1ccncc1)c1ccccc1[N+](=O)[O-]	ZINC000342287101	271367199	/nfs/dbraw/zinc/36/71/99/271367199.db2.gz	WWVNKYRRXKULEH-LLVKDONJSA-N	1	1	300.318	1.701	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000413479670	274017262	/nfs/dbraw/zinc/01/72/62/274017262.db2.gz	QMQVAENZKXKZHV-UHFFFAOYSA-N	1	1	323.393	1.687	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+](Cc1ccccn1)C1CC1	ZINC000180859861	275044109	/nfs/dbraw/zinc/04/41/09/275044109.db2.gz	WMIGAVJBUKMJBS-UHFFFAOYSA-N	1	1	314.345	1.816	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1ccccn1)C1CC1	ZINC000180859861	275044110	/nfs/dbraw/zinc/04/41/10/275044110.db2.gz	WMIGAVJBUKMJBS-UHFFFAOYSA-N	1	1	314.345	1.816	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000331216404	277389577	/nfs/dbraw/zinc/38/95/77/277389577.db2.gz	VVYBLNLRTWBHDE-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@@H+](C)C[C@@H]1C	ZINC000331216404	277389579	/nfs/dbraw/zinc/38/95/79/277389579.db2.gz	VVYBLNLRTWBHDE-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+](C)C	ZINC000055171824	280897995	/nfs/dbraw/zinc/89/79/95/280897995.db2.gz	AZBFQMIFQAAOQM-ZDUSSCGKSA-N	1	1	318.333	1.924	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2csc([N+](=O)[O-])c2)CCOC1	ZINC000361740258	299927768	/nfs/dbraw/zinc/92/77/68/299927768.db2.gz	HBMUBVIUEBNYPZ-LBPRGKRZSA-N	1	1	300.336	1.468	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CCc2nc[nH]c2C1	ZINC000357972102	299037471	/nfs/dbraw/zinc/03/74/71/299037471.db2.gz	HZQPWHBNDBSDOH-SNVBAGLBSA-N	1	1	318.308	1.673	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362073130	300000421	/nfs/dbraw/zinc/00/04/21/300000421.db2.gz	UHYUGJWVKWSEHX-WDEREUQCSA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362073130	300000426	/nfs/dbraw/zinc/00/04/26/300000426.db2.gz	UHYUGJWVKWSEHX-WDEREUQCSA-N	1	1	323.349	1.102	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+](C2CC2)CC1	ZINC000363628382	300288921	/nfs/dbraw/zinc/28/89/21/300288921.db2.gz	PPTRIPQWDQLIPX-UHFFFAOYSA-N	1	1	319.361	1.670	20	5		DDBDMO
COc1cccc(N2CC[NH+]([C@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000363697532	300298171	/nfs/dbraw/zinc/29/81/71/300298171.db2.gz	FLKYSOKFAQLASL-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H]3COC[C@H]32)c1	ZINC000368519557	301047214	/nfs/dbraw/zinc/04/72/14/301047214.db2.gz	QUANIECLBTVHRC-DUVNUKRYSA-N	1	1	322.361	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]2CCC[C@H]2O1	ZINC000369181688	301140945	/nfs/dbraw/zinc/14/09/45/301140945.db2.gz	AWCSVNZQWXNIPC-ZIAGYGMSSA-N	1	1	321.377	1.788	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)n1	ZINC000370654373	301376413	/nfs/dbraw/zinc/37/64/13/301376413.db2.gz	RYHNIAWPKBXTFQ-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])c1	ZINC000377331890	302170599	/nfs/dbraw/zinc/17/05/99/302170599.db2.gz	UTULODKKEFECGV-VIFPVBQESA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000377331890	302170601	/nfs/dbraw/zinc/17/06/01/302170601.db2.gz	UTULODKKEFECGV-VIFPVBQESA-N	1	1	317.305	1.469	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000377567106	302193779	/nfs/dbraw/zinc/19/37/79/302193779.db2.gz	YFYGBXXBKJBZNV-LBPRGKRZSA-N	1	1	313.304	1.593	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000356815960	306864355	/nfs/dbraw/zinc/86/43/55/306864355.db2.gz	DGNZLBSDWDLPQQ-UHFFFAOYSA-N	1	1	303.322	1.905	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000531310881	303239440	/nfs/dbraw/zinc/23/94/40/303239440.db2.gz	PTRSZLBNUAAEDT-UHFFFAOYSA-N	1	1	323.393	1.994	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21	ZINC000532873514	303300290	/nfs/dbraw/zinc/30/02/90/303300290.db2.gz	PCRBDDJMHNKITI-AAEUAGOBSA-N	1	1	306.366	1.490	20	5		DDBDMO
Cc1c(C[NH+]2CCC(S(N)(=O)=O)CC2)cccc1[N+](=O)[O-]	ZINC000361744736	307005082	/nfs/dbraw/zinc/00/50/82/307005082.db2.gz	OFINKEOZGSGFSE-UHFFFAOYSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](C3CCN(C)CC3)C2)n1	ZINC000363779154	307035680	/nfs/dbraw/zinc/03/56/80/307035680.db2.gz	CGYYRDNVFCJRSR-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)n1	ZINC000363779154	307035681	/nfs/dbraw/zinc/03/56/81/307035681.db2.gz	CGYYRDNVFCJRSR-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000364755328	307050471	/nfs/dbraw/zinc/05/04/71/307050471.db2.gz	PSKYWIGMEZPYDL-KCXAZCMYSA-N	1	1	317.389	1.993	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000365027811	307056860	/nfs/dbraw/zinc/05/68/60/307056860.db2.gz	QLAGKGYJYZPBFP-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000365027811	307056861	/nfs/dbraw/zinc/05/68/61/307056861.db2.gz	QLAGKGYJYZPBFP-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@H](O)C3(CC3)C2)c2c(c1)COCO2	ZINC000373512581	307189474	/nfs/dbraw/zinc/18/94/74/307189474.db2.gz	LSCRDMDUAMECCQ-ZDUSSCGKSA-N	1	1	306.318	1.418	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@H](O)C3(CC3)C2)c2c(c1)COCO2	ZINC000373512581	307189475	/nfs/dbraw/zinc/18/94/75/307189475.db2.gz	LSCRDMDUAMECCQ-ZDUSSCGKSA-N	1	1	306.318	1.418	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608739	307192092	/nfs/dbraw/zinc/19/20/92/307192092.db2.gz	DTVBFYPHPNCEIB-YQQAZPJKSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1	ZINC000373608739	307192093	/nfs/dbraw/zinc/19/20/93/307192093.db2.gz	DTVBFYPHPNCEIB-YQQAZPJKSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608739	307192094	/nfs/dbraw/zinc/19/20/94/307192094.db2.gz	DTVBFYPHPNCEIB-YQQAZPJKSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421021459	307300782	/nfs/dbraw/zinc/30/07/82/307300782.db2.gz	OBYSYWSVYKWLTO-FRRDWIJNSA-N	1	1	310.350	1.180	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)S(C)(=O)=O	ZINC000575981225	308284346	/nfs/dbraw/zinc/28/43/46/308284346.db2.gz	BWHYDSUZAGKNHD-VIFPVBQESA-N	1	1	302.352	1.126	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2c(OC)cccc2[N+](=O)[O-])CC1	ZINC000582974829	337225112	/nfs/dbraw/zinc/22/51/12/337225112.db2.gz	JGBUKGUXWOEBFK-UHFFFAOYSA-N	1	1	322.365	1.226	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000421023575	484112509	/nfs/dbraw/zinc/11/25/09/484112509.db2.gz	RJZQLSHHDFXYTO-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000421023575	484112514	/nfs/dbraw/zinc/11/25/14/484112514.db2.gz	RJZQLSHHDFXYTO-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000575474893	484351730	/nfs/dbraw/zinc/35/17/30/484351730.db2.gz	KJZOYGYPTBENIY-LLVKDONJSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000575474893	484351733	/nfs/dbraw/zinc/35/17/33/484351733.db2.gz	KJZOYGYPTBENIY-LLVKDONJSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000330922067	527806468	/nfs/dbraw/zinc/80/64/68/527806468.db2.gz	AYAHLIBBVRQIFP-LBPRGKRZSA-N	1	1	323.397	1.327	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1	ZINC000026256871	536307322	/nfs/dbraw/zinc/30/73/22/536307322.db2.gz	AWEFEQJUINBCJZ-UHFFFAOYSA-N	1	1	317.349	1.789	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cn1	ZINC000026256859	536307780	/nfs/dbraw/zinc/30/77/80/536307780.db2.gz	MCHXDGASITYSET-UHFFFAOYSA-N	1	1	317.349	1.789	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000797525084	700013219	/nfs/dbraw/zinc/01/32/19/700013219.db2.gz	AKODOWSXMQAENN-DZGCQCFKSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[C@H]1CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000777494326	698195581	/nfs/dbraw/zinc/19/55/81/698195581.db2.gz	GCKZRFHVWLNVDT-NSHDSACASA-N	1	1	324.406	1.290	20	5		DDBDMO
C[C@H]1CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000777494326	698195582	/nfs/dbraw/zinc/19/55/82/698195582.db2.gz	GCKZRFHVWLNVDT-NSHDSACASA-N	1	1	324.406	1.290	20	5		DDBDMO
O=C1Nc2ccccc2[C@]12CC[N@@H+](Cn1nccc1[N+](=O)[O-])C2	ZINC000777557299	698201805	/nfs/dbraw/zinc/20/18/05/698201805.db2.gz	QEYGWVFUZGXWKG-OAHLLOKOSA-N	1	1	313.317	1.345	20	5		DDBDMO
O=C1Nc2ccccc2[C@]12CC[N@H+](Cn1nccc1[N+](=O)[O-])C2	ZINC000777557299	698201806	/nfs/dbraw/zinc/20/18/06/698201806.db2.gz	QEYGWVFUZGXWKG-OAHLLOKOSA-N	1	1	313.317	1.345	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000778786661	698368636	/nfs/dbraw/zinc/36/86/36/698368636.db2.gz	AHRVGQHYSWFVSG-UHFFFAOYSA-N	1	1	321.337	1.710	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000793934059	699787935	/nfs/dbraw/zinc/78/79/35/699787935.db2.gz	WPBVHJPEZPHEFG-OLZOCXBDSA-N	1	1	318.377	1.417	20	5		DDBDMO
C[N@H+](C[C@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794633936	699820155	/nfs/dbraw/zinc/82/01/55/699820155.db2.gz	XDTSYDQGGBJXPE-SNVBAGLBSA-N	1	1	307.306	1.429	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794633936	699820159	/nfs/dbraw/zinc/82/01/59/699820159.db2.gz	XDTSYDQGGBJXPE-SNVBAGLBSA-N	1	1	307.306	1.429	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000796578718	699940155	/nfs/dbraw/zinc/94/01/55/699940155.db2.gz	JXQYSNFJMUYYFS-GLQYFDAESA-N	1	1	310.350	1.100	20	5		DDBDMO
COCC1(O)CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1	ZINC000758377270	700701969	/nfs/dbraw/zinc/70/19/69/700701969.db2.gz	VNFZQZKCQKSEIG-UHFFFAOYSA-N	1	1	320.349	1.375	20	5		DDBDMO
Cn1cc([C@H](CO)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cn1	ZINC000761527183	700862774	/nfs/dbraw/zinc/86/27/74/700862774.db2.gz	NUGYAISTMXUUFZ-LBPRGKRZSA-N	1	1	310.741	1.805	20	5		DDBDMO
C[C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000804477496	701193330	/nfs/dbraw/zinc/19/33/30/701193330.db2.gz	VCVBYSVBIAGIMS-LLVKDONJSA-N	1	1	324.337	1.883	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@H]1C[N@H+](C)CCO1	ZINC000770474557	701279519	/nfs/dbraw/zinc/27/95/19/701279519.db2.gz	BLXWGIBIDQMIGU-GZMMTYOYSA-N	1	1	307.310	1.262	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@H]1C[N@@H+](C)CCO1	ZINC000770474557	701279520	/nfs/dbraw/zinc/27/95/20/701279520.db2.gz	BLXWGIBIDQMIGU-GZMMTYOYSA-N	1	1	307.310	1.262	20	5		DDBDMO
O=C1N[C@H]2C[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]2CO1	ZINC000830917411	706602292	/nfs/dbraw/zinc/60/22/92/706602292.db2.gz	XVJIOYUVBHCPAF-XBFCOCLRSA-N	1	1	321.333	1.059	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H](C)CO	ZINC000839609286	701752700	/nfs/dbraw/zinc/75/27/00/701752700.db2.gz	HXHURRNBYZBJFZ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H](C)CO	ZINC000839609286	701752706	/nfs/dbraw/zinc/75/27/06/701752706.db2.gz	HXHURRNBYZBJFZ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CN(C[C@@H]1CCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867945230	701846869	/nfs/dbraw/zinc/84/68/69/701846869.db2.gz	BANUTZZDIYCQNI-XHDPSFHLSA-N	1	1	307.350	1.264	20	5		DDBDMO
Nc1ccc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000810850733	701862371	/nfs/dbraw/zinc/86/23/71/701862371.db2.gz	NXBIWAGIPBWRCM-VXGBXAGGSA-N	1	1	305.334	1.961	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1	ZINC000811781523	702058305	/nfs/dbraw/zinc/05/83/05/702058305.db2.gz	DEBWTBAETGNFQA-CQSZACIVSA-N	1	1	313.361	1.886	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@H+]1CCCN2c3ccccc3C[C@@H]2C1	ZINC000811781523	702058311	/nfs/dbraw/zinc/05/83/11/702058311.db2.gz	DEBWTBAETGNFQA-CQSZACIVSA-N	1	1	313.361	1.886	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4sccn4c3[N+](=O)[O-])CC[C@H]21	ZINC000866207483	706648985	/nfs/dbraw/zinc/64/89/85/706648985.db2.gz	PMBFWAWYQMDZMM-NXEZZACHSA-N	1	1	307.379	1.834	20	5		DDBDMO
CC(C)(CCc1noc([C@@H]2CCn3c[nH+]cc3C2)n1)[N+](=O)[O-]	ZINC000812812493	702246535	/nfs/dbraw/zinc/24/65/35/702246535.db2.gz	JMVCBWFGYHVNQN-SNVBAGLBSA-N	1	1	305.338	1.984	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1	ZINC000817369798	702356649	/nfs/dbraw/zinc/35/66/49/702356649.db2.gz	CKVRLOHFHLVLCW-NSHDSACASA-N	1	1	317.349	1.278	20	5		DDBDMO
C[C@H]1C[C@H]([NH3+])CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000846709026	703322191	/nfs/dbraw/zinc/32/21/91/703322191.db2.gz	XWOTVLNTZIQZBE-WDEREUQCSA-N	1	1	324.356	1.874	20	5		DDBDMO
CNc1nccc(C(=O)NCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000848373716	703544529	/nfs/dbraw/zinc/54/45/29/703544529.db2.gz	JJYRKYYHQIJQRT-JTQLQIEISA-N	1	1	307.354	1.246	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC(=S)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc1	ZINC000848650488	703571906	/nfs/dbraw/zinc/57/19/06/703571906.db2.gz	OLOAPAZYSXOVTM-QWHCGFSZSA-N	1	1	322.390	1.042	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](CO)[C@H](CO)C2)ccc1[N+](=O)[O-]	ZINC000879695739	706763460	/nfs/dbraw/zinc/76/34/60/706763460.db2.gz	OKIPPFQLLIXTDP-BETUJISGSA-N	1	1	310.350	1.026	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000852569052	704076959	/nfs/dbraw/zinc/07/69/59/704076959.db2.gz	AKKSLMLRDSBZES-CYBMUJFWSA-N	1	1	311.338	1.258	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCc3[nH]cnc3C2)cc1	ZINC000819321832	704107204	/nfs/dbraw/zinc/10/72/04/704107204.db2.gz	OGRPXRRHNZKITM-IAQYHMDHSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2nnc(C3CC3)[nH]2)cc1	ZINC000819342252	704110533	/nfs/dbraw/zinc/11/05/33/704110533.db2.gz	YNPDBGLEUMGIMM-GFCCVEGCSA-N	1	1	303.322	1.414	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(F)c1	ZINC000853966107	704341613	/nfs/dbraw/zinc/34/16/13/704341613.db2.gz	OSYGOKOHBUXAAJ-CYBMUJFWSA-N	1	1	309.341	1.769	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000860176994	705123863	/nfs/dbraw/zinc/12/38/63/705123863.db2.gz	LFPMQRHCWIYUGN-HZPDHXFCSA-N	1	1	321.377	1.619	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)n1	ZINC000874827017	705184924	/nfs/dbraw/zinc/18/49/24/705184924.db2.gz	AGNBGIWHFWJHRN-WDEREUQCSA-N	1	1	307.354	1.120	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297892	705970540	/nfs/dbraw/zinc/97/05/40/705970540.db2.gz	HNVKQNOYTMYAAQ-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297892	705970542	/nfs/dbraw/zinc/97/05/42/705970542.db2.gz	HNVKQNOYTMYAAQ-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297892	705970543	/nfs/dbraw/zinc/97/05/43/705970543.db2.gz	HNVKQNOYTMYAAQ-WDEREUQCSA-N	1	1	321.381	1.608	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC[C@H]21	ZINC000827300687	705971824	/nfs/dbraw/zinc/97/18/24/705971824.db2.gz	NCAPKWQUKMILIL-GXFFZTMASA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827331137	705977464	/nfs/dbraw/zinc/97/74/64/705977464.db2.gz	WSHUUTLNZSDACW-GWCFXTLKSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000827373156	705988224	/nfs/dbraw/zinc/98/82/24/705988224.db2.gz	GWWIERAYORVNBO-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000863833112	706024771	/nfs/dbraw/zinc/02/47/71/706024771.db2.gz	JMLCEEONKNTJDG-JTQLQIEISA-N	1	1	313.741	1.045	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](C2(C)OCCO2)C1	ZINC000878406887	706379402	/nfs/dbraw/zinc/37/94/02/706379402.db2.gz	FWJCGXXYZJUEEL-CYBMUJFWSA-N	1	1	324.381	1.575	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@@H](C(F)(F)F)O1	ZINC000880059588	706866611	/nfs/dbraw/zinc/86/66/11/706866611.db2.gz	JKGZKGXQDKMUFS-KOLCDFICSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@@H](C(F)(F)F)O1	ZINC000880059588	706866613	/nfs/dbraw/zinc/86/66/13/706866613.db2.gz	JKGZKGXQDKMUFS-KOLCDFICSA-N	1	1	322.287	1.833	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](CF)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000880296491	706931809	/nfs/dbraw/zinc/93/18/09/706931809.db2.gz	BBXUTEXMNSHMDH-NSHDSACASA-N	1	1	307.325	1.775	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](CF)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000880296491	706931812	/nfs/dbraw/zinc/93/18/12/706931812.db2.gz	BBXUTEXMNSHMDH-NSHDSACASA-N	1	1	307.325	1.775	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000880438330	706976347	/nfs/dbraw/zinc/97/63/47/706976347.db2.gz	BTYGBJXWSKVZKP-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000880438330	706976348	/nfs/dbraw/zinc/97/63/48/706976348.db2.gz	BTYGBJXWSKVZKP-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCO[C@@H](C(F)F)CC2)c1	ZINC000872271345	707358310	/nfs/dbraw/zinc/35/83/10/707358310.db2.gz	NSPFZMJJCOXLJG-CHWSQXEVSA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCO[C@@H](C(F)F)CC2)c1	ZINC000872271345	707358315	/nfs/dbraw/zinc/35/83/15/707358315.db2.gz	NSPFZMJJCOXLJG-CHWSQXEVSA-N	1	1	316.304	1.984	20	5		DDBDMO
C[N@@H+](CCNc1ccc(Cl)cc1[N+](=O)[O-])CCOCCO	ZINC000882951622	707867435	/nfs/dbraw/zinc/86/74/35/707867435.db2.gz	NKTSNCOBCLYMDV-UHFFFAOYSA-N	1	1	317.773	1.601	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1	ZINC000838906368	708000969	/nfs/dbraw/zinc/00/09/69/708000969.db2.gz	LMUXTTUQGURKRV-GASCZTMLSA-N	1	1	320.345	1.544	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000896670576	708113688	/nfs/dbraw/zinc/11/36/88/708113688.db2.gz	PBJISKWMSXTTRS-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897218461	708256437	/nfs/dbraw/zinc/25/64/37/708256437.db2.gz	CUFOEWYKWTUBCP-STQMWFEESA-N	1	1	323.397	1.155	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c1	ZINC000897218132	708256677	/nfs/dbraw/zinc/25/66/77/708256677.db2.gz	BCLCBHKBTOAKAM-UONOGXRCSA-N	1	1	321.377	1.639	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC000884823974	708387680	/nfs/dbraw/zinc/38/76/80/708387680.db2.gz	MJSLWMFMSMGQLP-UHFFFAOYSA-N	1	1	307.272	1.950	20	5		DDBDMO
O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])CN1	ZINC000886098679	708697970	/nfs/dbraw/zinc/69/79/70/708697970.db2.gz	PKHFKEMSRIYGQE-STQMWFEESA-N	1	1	304.350	1.480	20	5		DDBDMO
C[NH+](C)[C@@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C12CCC2	ZINC000898835479	708884087	/nfs/dbraw/zinc/88/40/87/708884087.db2.gz	NPGAMDHQBBQGDL-ZIAGYGMSSA-N	1	1	319.361	1.903	20	5		DDBDMO
Cc1ccc(NC(=O)C2C[NH+]([C@H]3CCOC3)C2)cc1[N+](=O)[O-]	ZINC000899910885	709235146	/nfs/dbraw/zinc/23/51/46/709235146.db2.gz	KUPBOADZPBIPDN-ZDUSSCGKSA-N	1	1	305.334	1.562	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccnc(NC)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000910273649	709857221	/nfs/dbraw/zinc/85/72/21/709857221.db2.gz	KBFMWMNHJHPGRK-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
CN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000893264674	710582470	/nfs/dbraw/zinc/58/24/70/710582470.db2.gz	GOSGQAVRVOXNNL-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000928438153	713195837	/nfs/dbraw/zinc/19/58/37/713195837.db2.gz	SQQVRENQUJVQMG-WCQYABFASA-N	1	1	307.350	1.491	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOC(=O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000893392683	710633779	/nfs/dbraw/zinc/63/37/79/710633779.db2.gz	HTXZALWVBPFFOU-LBPRGKRZSA-N	1	1	308.334	1.862	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)C1C[NH+]([C@@H]2CCOC2)C1	ZINC000911502686	710826230	/nfs/dbraw/zinc/82/62/30/710826230.db2.gz	SMPRJIHFHBWBGL-GFCCVEGCSA-N	1	1	320.349	1.296	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639647	710834815	/nfs/dbraw/zinc/83/48/15/710834815.db2.gz	QQBZDNZCGVXUPG-KGLIPLIRSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639647	710834816	/nfs/dbraw/zinc/83/48/16/710834816.db2.gz	QQBZDNZCGVXUPG-KGLIPLIRSA-N	1	1	317.349	1.920	20	5		DDBDMO
CCNc1ccc(C(=O)NC[C@H]2CC[N@H+]2CC)cc1[N+](=O)[O-]	ZINC000893872821	710867674	/nfs/dbraw/zinc/86/76/74/710867674.db2.gz	WMJZUPMFQCTJOO-GFCCVEGCSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)[C@H]2C1	ZINC000893939062	710893117	/nfs/dbraw/zinc/89/31/17/710893117.db2.gz	HFDVBUMDOKJOLS-ABAIWWIYSA-N	1	1	316.361	1.620	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000894179744	711002547	/nfs/dbraw/zinc/00/25/47/711002547.db2.gz	YANBDICPVNTUNK-UHFFFAOYSA-N	1	1	309.370	1.019	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1c2ccccc2ncc1[N+](=O)[O-]	ZINC000894591712	711199049	/nfs/dbraw/zinc/19/90/49/711199049.db2.gz	UNPJIFFGDJLVMM-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895249674	711466045	/nfs/dbraw/zinc/46/60/45/711466045.db2.gz	WOFKARMZULHBHF-RYUDHWBXSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1CN(C)CC[N@@H+]1C	ZINC000895249674	711466050	/nfs/dbraw/zinc/46/60/50/711466050.db2.gz	WOFKARMZULHBHF-RYUDHWBXSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1CN(C)CC[N@H+]1C	ZINC000895249674	711466053	/nfs/dbraw/zinc/46/60/53/711466053.db2.gz	WOFKARMZULHBHF-RYUDHWBXSA-N	1	1	318.381	1.289	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@H]1CC[N@H+]1C1CCOCC1	ZINC000896526577	711739145	/nfs/dbraw/zinc/73/91/45/711739145.db2.gz	YZMAVFPNUNNRKB-GFCCVEGCSA-N	1	1	322.365	1.664	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000917789287	713514054	/nfs/dbraw/zinc/51/40/54/713514054.db2.gz	MLOUYNZUJNVMGO-RISCZKNCSA-N	1	1	322.365	1.365	20	5		DDBDMO
C[C@H]1C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459851	714102727	/nfs/dbraw/zinc/10/27/27/714102727.db2.gz	BEZZIGKDRYGVHU-IINYFYTJSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459851	714102729	/nfs/dbraw/zinc/10/27/29/714102729.db2.gz	BEZZIGKDRYGVHU-IINYFYTJSA-N	1	1	302.334	1.971	20	5		DDBDMO
O=[N+]([O-])c1cc(CNC[C@H]2CC[N@@H+]2C2CCOCC2)cs1	ZINC000922950106	714195302	/nfs/dbraw/zinc/19/53/02/714195302.db2.gz	CFACEEZLSAMTDE-CYBMUJFWSA-N	1	1	311.407	1.999	20	5		DDBDMO
O=[N+]([O-])c1cc(CNC[C@H]2CC[N@H+]2C2CCOCC2)cs1	ZINC000922950106	714195305	/nfs/dbraw/zinc/19/53/05/714195305.db2.gz	CFACEEZLSAMTDE-CYBMUJFWSA-N	1	1	311.407	1.999	20	5		DDBDMO
CC(C)(C)NC(=O)[C@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000932439103	714331623	/nfs/dbraw/zinc/33/16/23/714331623.db2.gz	FDVZOKGQOGYCIX-GFCCVEGCSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)(C)NC(=O)[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000932439103	714331624	/nfs/dbraw/zinc/33/16/24/714331624.db2.gz	FDVZOKGQOGYCIX-GFCCVEGCSA-N	1	1	309.370	1.170	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCn3nc(C4CC4)cc3C2)c1	ZINC000932607184	714366471	/nfs/dbraw/zinc/36/64/71/714366471.db2.gz	MBUZNEIOSCXONK-UHFFFAOYSA-N	1	1	302.338	1.381	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCn3nc(C4CC4)cc3C2)c1	ZINC000932607184	714366473	/nfs/dbraw/zinc/36/64/73/714366473.db2.gz	MBUZNEIOSCXONK-UHFFFAOYSA-N	1	1	302.338	1.381	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000932646847	714374634	/nfs/dbraw/zinc/37/46/34/714374634.db2.gz	UTYMGRMWIGRXTA-GXTWGEPZSA-N	1	1	308.334	1.513	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(C)CC[N@@H+](C)CC1	ZINC000933998616	714719462	/nfs/dbraw/zinc/71/94/62/714719462.db2.gz	LLKPLCJPAWZCIO-AWEZNQCLSA-N	1	1	306.410	1.835	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117635	714746161	/nfs/dbraw/zinc/74/61/61/714746161.db2.gz	HROOBCPPKROSOL-LSDHHAIUSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117635	714746165	/nfs/dbraw/zinc/74/61/65/714746165.db2.gz	HROOBCPPKROSOL-LSDHHAIUSA-N	1	1	319.361	1.593	20	5		DDBDMO
C[C@]12CSC[C@H]1C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000934772767	714898462	/nfs/dbraw/zinc/89/84/62/714898462.db2.gz	JBQSBNQIGDZVIB-DOMZBBRYSA-N	1	1	321.402	1.879	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C)C2)cc1OC	ZINC001167278582	732888100	/nfs/dbraw/zinc/88/81/00/732888100.db2.gz	NGDCRIKJFNOAOA-VIFPVBQESA-N	1	1	309.322	1.506	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc2cc(F)cc([N+](=O)[O-])c2n1	ZINC001167355258	733281942	/nfs/dbraw/zinc/28/19/42/733281942.db2.gz	XXGPCATZQDVURI-UHFFFAOYSA-N	1	1	314.280	1.406	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC001167358463	733288795	/nfs/dbraw/zinc/28/87/95/733288795.db2.gz	UDTSEPQREYPOCY-UHFFFAOYSA-N	1	1	313.239	1.737	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001211587825	735069987	/nfs/dbraw/zinc/06/99/87/735069987.db2.gz	ZBGLQCAKIKNWQH-JTQLQIEISA-N	1	1	322.300	1.097	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001211587825	735069990	/nfs/dbraw/zinc/06/99/90/735069990.db2.gz	ZBGLQCAKIKNWQH-JTQLQIEISA-N	1	1	322.300	1.097	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CC3CCC3)C2)CC1	ZINC001035704356	751790840	/nfs/dbraw/zinc/79/08/40/751790840.db2.gz	KRQJKAJVEYURNZ-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
Cc1ncccc1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001002782134	743423732	/nfs/dbraw/zinc/42/37/32/743423732.db2.gz	IMXJDDJWPSFNJV-HUUCEWRRSA-N	1	1	318.377	1.136	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)c1ccc[nH]1	ZINC001031543678	746990866	/nfs/dbraw/zinc/99/08/66/746990866.db2.gz	FXZIWRLYMKSUGQ-UHFFFAOYSA-N	1	1	314.345	1.785	20	5		DDBDMO
CCc1cccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001031661817	747336760	/nfs/dbraw/zinc/33/67/60/747336760.db2.gz	ISSOCRPNZRJOGQ-HZPDHXFCSA-N	1	1	317.389	1.462	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCCCCF)CC1	ZINC001200472919	748265586	/nfs/dbraw/zinc/26/55/86/748265586.db2.gz	UQSMSBAGYUUNMZ-CHWSQXEVSA-N	1	1	301.362	1.372	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)on1	ZINC001034642531	750624919	/nfs/dbraw/zinc/62/49/19/750624919.db2.gz	DLADSYVURBIJIT-HBJVGIJOSA-N	1	1	322.365	1.165	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2cccnc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034643389	750625420	/nfs/dbraw/zinc/62/54/20/750625420.db2.gz	NLLYJFKQJBOUPE-KBUPBQIOSA-N	1	1	318.377	1.264	20	5		DDBDMO
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169007212	762174923	/nfs/dbraw/zinc/17/49/23/762174923.db2.gz	LWUCKTKQSZHBRU-BYNSBNAKSA-N	1	1	317.389	1.713	20	5		DDBDMO
Cc1cnc(CN)n1-c1ccc([N+](=O)[O-])c(OCC[NH+](C)C)c1	ZINC001169028887	762185630	/nfs/dbraw/zinc/18/56/30/762185630.db2.gz	JXSHGXKCKIPMNU-UHFFFAOYSA-N	1	1	319.365	1.488	20	5		DDBDMO
O=C(c1ccco1)N1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169037075	762192580	/nfs/dbraw/zinc/19/25/80/762192580.db2.gz	IOZMOAPQUFWNIL-UONOGXRCSA-N	1	1	321.377	1.873	20	5		DDBDMO
COc1cccnc1O[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169050671	762206774	/nfs/dbraw/zinc/20/67/74/762206774.db2.gz	CHCYGVHIMOSZOM-MGPQQGTHSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CCC2CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139092	760613095	/nfs/dbraw/zinc/61/30/95/760613095.db2.gz	QDVNVDLQOVONRG-KBUPBQIOSA-N	1	1	309.410	1.859	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCNC(=O)CC2)c([N+](=O)[O-])c1	ZINC001170328676	766254015	/nfs/dbraw/zinc/25/40/15/766254015.db2.gz	LIYZEEMTGQCZCH-LLVKDONJSA-N	1	1	307.350	1.356	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCNC(=O)CC2)c([N+](=O)[O-])c1	ZINC001170328676	766254019	/nfs/dbraw/zinc/25/40/19/766254019.db2.gz	LIYZEEMTGQCZCH-LLVKDONJSA-N	1	1	307.350	1.356	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](O)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC001170334408	766256561	/nfs/dbraw/zinc/25/65/61/766256561.db2.gz	DGUXSSZQEXHVRR-DETPVDSQSA-N	1	1	324.377	1.210	20	5		DDBDMO
[NH3+]Cc1ncn(-c2nc(Cl)nc3ccc([N+](=O)[O-])cc32)n1	ZINC001157928115	767334201	/nfs/dbraw/zinc/33/42/01/767334201.db2.gz	BGUFAKNRFVWVDL-UHFFFAOYSA-N	1	1	305.685	1.231	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1cccc(F)c1[N+](=O)[O-]	ZINC001093642136	774940431	/nfs/dbraw/zinc/94/04/31/774940431.db2.gz	MRHNXEAVBGGMOT-UHFFFAOYSA-N	1	1	321.312	1.467	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](N2CCOCC2)C1	ZINC001173227590	777062554	/nfs/dbraw/zinc/06/25/54/777062554.db2.gz	RCKIUXRDKGIMCO-YOEHRIQHSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CCNC(=O)[C@@H]2C1	ZINC001173235447	777064711	/nfs/dbraw/zinc/06/47/11/777064711.db2.gz	XENVBRJAJUWXLR-CORIIIEPSA-N	1	1	303.362	1.594	20	5		DDBDMO
CC(C)[NH2+]CC(C)(C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001101541641	777232292	/nfs/dbraw/zinc/23/22/92/777232292.db2.gz	OZTKHXPCPGOYQW-ZIAGYGMSSA-N	1	1	311.426	1.914	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2cnc(N)c([N+](=O)[O-])c2)C(C)(C)C1	ZINC001178860298	779215004	/nfs/dbraw/zinc/21/50/04/779215004.db2.gz	AAKIRMXOVBTIJT-LLVKDONJSA-N	1	1	307.354	1.032	20	5		DDBDMO
CS[C@@H]1CC[C@@H]([N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC001116150368	780479944	/nfs/dbraw/zinc/47/99/44/780479944.db2.gz	NSIRQVHNMORPOP-RAIGVLPGSA-N	1	1	314.411	1.368	20	5		DDBDMO
CC[N@H+]1CCCN(c2nnc(C[N+](=O)[O-])n2CC(C)C)CC1	ZINC001343629530	839838684	/nfs/dbraw/zinc/83/86/84/839838684.db2.gz	CUAONRHEHNFTTH-UHFFFAOYSA-N	1	1	310.402	1.243	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001155197978	861830670	/nfs/dbraw/zinc/83/06/70/861830670.db2.gz	ZJXVJLVBVZJFAH-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001155197978	861830683	/nfs/dbraw/zinc/83/06/83/861830683.db2.gz	ZJXVJLVBVZJFAH-LLVKDONJSA-N	1	1	302.334	1.886	20	5		DDBDMO
CC[C@H]1[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021506	850518019	/nfs/dbraw/zinc/51/80/19/850518019.db2.gz	LGKQCJPNRMFIDS-AYDFFVQHSA-N	1	1	309.410	1.955	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001122030807	858667847	/nfs/dbraw/zinc/66/78/47/858667847.db2.gz	GMAZHVWVUMSMRI-AWEZNQCLSA-N	1	1	304.350	1.367	20	5		DDBDMO
CSc1nc(Cl)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C)C2)n1	ZINC001156576296	863160907	/nfs/dbraw/zinc/16/09/07/863160907.db2.gz	UYSQKEZNDNWMDN-LURJTMIESA-N	1	1	303.775	1.876	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC001331052078	864805753	/nfs/dbraw/zinc/80/57/53/864805753.db2.gz	TVSFCQGFYAGMDX-PHIMTYICSA-N	1	1	319.390	1.900	20	5		DDBDMO
COc1cc(C)nc(N2CC([N@@H+](C)[C@H]3CCOC3)C2)c1[N+](=O)[O-]	ZINC001158731744	864867191	/nfs/dbraw/zinc/86/71/91/864867191.db2.gz	XCDCZZDVROYCDE-NSHDSACASA-N	1	1	322.365	1.216	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@H]2CC[N@H+](C3CCC3)C2)c([N+](=O)[O-])c1	ZINC001161177253	866428090	/nfs/dbraw/zinc/42/80/90/866428090.db2.gz	LMOCNBOGSHBWNM-VIFPVBQESA-N	1	1	307.310	1.937	20	5		DDBDMO
O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ncc[nH]1	ZINC001321052233	867265828	/nfs/dbraw/zinc/26/58/28/867265828.db2.gz	CWYIFKUFHFDVGC-OWOJBTEDSA-N	1	1	321.362	1.455	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2cc3cccnc3c([N+](=O)[O-])c2)C1	ZINC001162689390	867736763	/nfs/dbraw/zinc/73/67/63/867736763.db2.gz	FILYUIMRDNKPCC-CYBMUJFWSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2cc3cccnc3c([N+](=O)[O-])c2)C1	ZINC001162689390	867736777	/nfs/dbraw/zinc/73/67/77/867736777.db2.gz	FILYUIMRDNKPCC-CYBMUJFWSA-N	1	1	302.334	1.886	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162690169	867739160	/nfs/dbraw/zinc/73/91/60/867739160.db2.gz	TWVKZBSWVMJOPM-ZDUSSCGKSA-N	1	1	323.349	1.053	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162690169	867739172	/nfs/dbraw/zinc/73/91/72/867739172.db2.gz	TWVKZBSWVMJOPM-ZDUSSCGKSA-N	1	1	323.349	1.053	20	5		DDBDMO
COc1nc(NCC[C@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-]	ZINC001162808974	867840637	/nfs/dbraw/zinc/84/06/37/867840637.db2.gz	ZPZYKNNTRBBRTC-MRVPVSSYSA-N	1	1	317.296	1.440	20	5		DDBDMO
CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1ccc([N+](=O)[O-])c(N)n1	ZINC001162875397	867889274	/nfs/dbraw/zinc/88/92/74/867889274.db2.gz	CBUVXFUKLWRRMA-LBPRGKRZSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)C[NH2+]CCN(Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001325691041	868256800	/nfs/dbraw/zinc/25/68/00/868256800.db2.gz	YOHZLRYXSXHZGR-HZPDHXFCSA-N	1	1	319.405	1.926	20	5		DDBDMO
COc1nc(N[C@@H]2CC[N@H+](C(C)C)C[C@@H]2C)ncc1[N+](=O)[O-]	ZINC001163357056	868390889	/nfs/dbraw/zinc/39/08/89/868390889.db2.gz	ITRMAYHJJDYVSA-WDEREUQCSA-N	1	1	309.370	1.924	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@](C)(CO)C2)ncc1[N+](=O)[O-]	ZINC001164147033	868971347	/nfs/dbraw/zinc/97/13/47/868971347.db2.gz	KURRGAUPYLRCJQ-DRDHIDPGSA-N	1	1	306.366	1.731	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC001337837311	869652790	/nfs/dbraw/zinc/65/27/90/869652790.db2.gz	ZXRKZUFYVVHDNO-BFHYXJOUSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(C(=O)c4c[nH]nc4[N+](=O)[O-])C[C@]2(C1)CCCC3	ZINC001339370268	870465476	/nfs/dbraw/zinc/46/54/76/870465476.db2.gz	RCTZVXVTRIFYOT-GASCZTMLSA-N	1	1	319.365	1.266	20	5		DDBDMO
Cn1c(C[N+](=O)[O-])nnc1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC001339553453	870551989	/nfs/dbraw/zinc/55/19/89/870551989.db2.gz	OKRCWAWNDRWBSE-AAEUAGOBSA-N	1	1	320.397	1.045	20	5		DDBDMO
CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[NH+](C2CC2)CC1	ZINC001344479188	873018766	/nfs/dbraw/zinc/01/87/66/873018766.db2.gz	PAFUHWLJXUOLKJ-LBPRGKRZSA-N	1	1	322.413	1.556	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891824	874300156	/nfs/dbraw/zinc/30/01/56/874300156.db2.gz	VNQDRCAGKMQEMJ-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891824	874300168	/nfs/dbraw/zinc/30/01/68/874300168.db2.gz	VNQDRCAGKMQEMJ-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C	ZINC001351177305	876101058	/nfs/dbraw/zinc/10/10/58/876101058.db2.gz	PIRHQYMHAUDIHI-RYUDHWBXSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cc1nc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C2(C)C)ncc1[N+](=O)[O-]	ZINC001353016534	877070439	/nfs/dbraw/zinc/07/04/39/877070439.db2.gz	DQIMMBYPVMVPMI-CHWSQXEVSA-N	1	1	321.381	1.604	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2nnc(C[N+](=O)[O-])n2CC(C)C)C[C@@H]1C	ZINC001358057079	880310706	/nfs/dbraw/zinc/31/07/06/880310706.db2.gz	HAQALPNFXSKUHY-QWHCGFSZSA-N	1	1	324.429	1.630	20	5		DDBDMO
O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1ccc3[nH+]ccn3c1)C2	ZINC001233756027	887282573	/nfs/dbraw/zinc/28/25/73/887282573.db2.gz	VZLXQKLYIDXYIQ-JTQLQIEISA-N	1	1	301.262	1.279	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565893	896504812	/nfs/dbraw/zinc/50/48/12/896504812.db2.gz	QUFBCPSGGQNBAJ-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565893	896504822	/nfs/dbraw/zinc/50/48/22/896504822.db2.gz	QUFBCPSGGQNBAJ-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCC[C@H](n3cncn3)C1)C2	ZINC001254604342	896527284	/nfs/dbraw/zinc/52/72/84/896527284.db2.gz	VUOYQSNAEDPGDC-HOTGVXAUSA-N	1	1	313.361	1.991	20	5		DDBDMO
CCN1C[C@@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1	ZINC001254610654	896530116	/nfs/dbraw/zinc/53/01/16/896530116.db2.gz	MGUOIRDTPNIZHY-UXLLHSPISA-N	1	1	301.390	1.946	20	5		DDBDMO
CCN1C[C@@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1	ZINC001254610654	896530127	/nfs/dbraw/zinc/53/01/27/896530127.db2.gz	MGUOIRDTPNIZHY-UXLLHSPISA-N	1	1	301.390	1.946	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000451735505	529388878	/nfs/dbraw/zinc/38/88/78/529388878.db2.gz	YHRAJKWSHVWHMP-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H]([N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)O	ZINC000451357594	231075170	/nfs/dbraw/zinc/07/51/70/231075170.db2.gz	DPHARPFYCGAPOD-WCQYABFASA-N	1	1	312.366	1.426	20	5		DDBDMO
CSC[C@@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000249464844	282158164	/nfs/dbraw/zinc/15/81/64/282158164.db2.gz	QANAIYGPYLXJFD-PWSUYJOCSA-N	1	1	312.395	1.200	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[NH+]([C@@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000296740491	529466275	/nfs/dbraw/zinc/46/62/75/529466275.db2.gz	AOLOHBZIJXTDIW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+]([C@@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000296740491	529466280	/nfs/dbraw/zinc/46/62/80/529466280.db2.gz	AOLOHBZIJXTDIW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072363	231291257	/nfs/dbraw/zinc/29/12/57/231291257.db2.gz	WOWDKWGVMPHBNU-GRYCIOLGSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072363	231291263	/nfs/dbraw/zinc/29/12/63/231291263.db2.gz	WOWDKWGVMPHBNU-GRYCIOLGSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+]1C	ZINC000090551640	185302848	/nfs/dbraw/zinc/30/28/48/185302848.db2.gz	NNRGUYRPHWFPJU-QWHCGFSZSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@H]1C[C@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551640	185302849	/nfs/dbraw/zinc/30/28/49/185302849.db2.gz	NNRGUYRPHWFPJU-QWHCGFSZSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551640	185302850	/nfs/dbraw/zinc/30/28/50/185302850.db2.gz	NNRGUYRPHWFPJU-QWHCGFSZSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000412382646	529797357	/nfs/dbraw/zinc/79/73/57/529797357.db2.gz	WVEZGGJPCSZJTJ-BVUBDWEXSA-N	1	1	315.373	1.861	20	5		DDBDMO
C[N@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H](O)C(F)(F)F	ZINC000305789354	529928274	/nfs/dbraw/zinc/92/82/74/529928274.db2.gz	ZMDPIFANXRECCK-NSHDSACASA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H](O)C(F)(F)F	ZINC000305789354	529928275	/nfs/dbraw/zinc/92/82/75/529928275.db2.gz	ZMDPIFANXRECCK-NSHDSACASA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000458192871	530054636	/nfs/dbraw/zinc/05/46/36/530054636.db2.gz	PHSZNIRWQYUYOC-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](O)CC1	ZINC000293025977	282361277	/nfs/dbraw/zinc/36/12/77/282361277.db2.gz	FVSVUIIQRSXRBT-OLZOCXBDSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)n1	ZINC000286752881	219147448	/nfs/dbraw/zinc/14/74/48/219147448.db2.gz	YVELIWOYXVZFRK-ZJUUUORDSA-N	1	1	322.287	1.284	20	5		DDBDMO
CN(C(=O)C[N@@H+]1C[C@@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000279783858	215143831	/nfs/dbraw/zinc/14/38/31/215143831.db2.gz	NUELTBOJYZHJQD-CYBMUJFWSA-N	1	1	307.350	1.260	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000279783858	215143834	/nfs/dbraw/zinc/14/38/34/215143834.db2.gz	NUELTBOJYZHJQD-CYBMUJFWSA-N	1	1	307.350	1.260	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000279795116	215152454	/nfs/dbraw/zinc/15/24/54/215152454.db2.gz	DPSVVBSDYMYAOU-UHFFFAOYSA-N	1	1	319.317	1.315	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H](C)C[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000150730685	186061038	/nfs/dbraw/zinc/06/10/38/186061038.db2.gz	QOUMYLCGEFQBTB-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
CC[NH+]1CCN(c2ccc(C(=O)NC(C)C)cc2[N+](=O)[O-])CC1	ZINC000028707095	352231612	/nfs/dbraw/zinc/23/16/12/352231612.db2.gz	VOJOXEKHURHOHZ-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
COc1ccc(C(=O)NCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000052192733	352604559	/nfs/dbraw/zinc/60/45/59/352604559.db2.gz	YNSMZYFGRWWYBX-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
COCC[N@H+](C)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000054355566	352689240	/nfs/dbraw/zinc/68/92/40/352689240.db2.gz	ZMILGEICMGQPKM-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
COCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000054355566	352689241	/nfs/dbraw/zinc/68/92/41/352689241.db2.gz	ZMILGEICMGQPKM-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)N(C)C	ZINC000056493674	352775329	/nfs/dbraw/zinc/77/53/29/352775329.db2.gz	BXZGLPBLJBNQRI-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
COc1cc(OCC(=O)NCC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000066923943	353025916	/nfs/dbraw/zinc/02/59/16/353025916.db2.gz	ANSNQFXRGPFQIE-UHFFFAOYSA-N	1	1	323.349	1.193	20	5		DDBDMO
C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCN(C)CC1	ZINC000173390547	198209175	/nfs/dbraw/zinc/20/91/75/198209175.db2.gz	NLXSAWLBIPJLLC-KGLIPLIRSA-N	1	1	306.410	1.881	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000067703312	353063720	/nfs/dbraw/zinc/06/37/20/353063720.db2.gz	DPLVMRLCLLUMMM-LBPRGKRZSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[N@H+](C(C)C)CC1	ZINC000068777284	353129346	/nfs/dbraw/zinc/12/93/46/353129346.db2.gz	IWUOWCKZLAANKW-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@@H]2CS(N)(=O)=O)cccc1[N+](=O)[O-]	ZINC000074316761	353306497	/nfs/dbraw/zinc/30/64/97/353306497.db2.gz	MCKTXSDGQWJDLF-GFCCVEGCSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@@H]2CS(N)(=O)=O)cccc1[N+](=O)[O-]	ZINC000074316761	353306500	/nfs/dbraw/zinc/30/65/00/353306500.db2.gz	MCKTXSDGQWJDLF-GFCCVEGCSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1cc(N(C)CCC[NH+]2CCN(C)CC2)ncc1[N+](=O)[O-]	ZINC000074750100	353328353	/nfs/dbraw/zinc/32/83/53/353328353.db2.gz	WTPUNDBBWJDCKH-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
Nc1nc(NCCc2cn3c([nH+]2)CCCC3)ncc1[N+](=O)[O-]	ZINC000076267887	353410008	/nfs/dbraw/zinc/41/00/08/353410008.db2.gz	KLMKKPVGZFVPIA-UHFFFAOYSA-N	1	1	303.326	1.154	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000078333224	353511201	/nfs/dbraw/zinc/51/12/01/353511201.db2.gz	RILNJIDBPDPUGD-UHFFFAOYSA-N	1	1	303.322	1.701	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000080441103	353608935	/nfs/dbraw/zinc/60/89/35/353608935.db2.gz	VFZYMSKBJSTRFK-KGLIPLIRSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccccc2)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000084259677	353719300	/nfs/dbraw/zinc/71/93/00/353719300.db2.gz	CBXNSHIHRSKCQV-HZPDHXFCSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000093333208	353895720	/nfs/dbraw/zinc/89/57/20/353895720.db2.gz	PSOCEUPQLBYMFR-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000093333208	353895722	/nfs/dbraw/zinc/89/57/22/353895722.db2.gz	PSOCEUPQLBYMFR-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H](O)C1CC1	ZINC000305268299	354470027	/nfs/dbraw/zinc/47/00/27/354470027.db2.gz	ZIFYFSVNYIZTMC-CQSZACIVSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305268299	354470030	/nfs/dbraw/zinc/47/00/30/354470030.db2.gz	ZIFYFSVNYIZTMC-CQSZACIVSA-N	1	1	307.350	1.544	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000588810196	354938003	/nfs/dbraw/zinc/93/80/03/354938003.db2.gz	WOZXAGDNWDCBAN-CYBMUJFWSA-N	1	1	323.397	1.421	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)cc([N+](=O)[O-])c1	ZINC000588830342	354940198	/nfs/dbraw/zinc/94/01/98/354940198.db2.gz	XXOSGUDASVGQJY-HNNXBMFYSA-N	1	1	318.377	1.023	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000590045622	355043563	/nfs/dbraw/zinc/04/35/63/355043563.db2.gz	SKKDWERJXVPTKH-LNSITVRQSA-N	1	1	303.362	1.861	20	5		DDBDMO
CCOc1cc(C[N@@H+](C[C@H](C)O)[C@@H](C)CO)ccc1[N+](=O)[O-]	ZINC000276972772	213210751	/nfs/dbraw/zinc/21/07/51/213210751.db2.gz	XFELUBQVIIKZMC-RYUDHWBXSA-N	1	1	312.366	1.557	20	5		DDBDMO
CC[C@H]1COC(C)(C)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000593058446	355782934	/nfs/dbraw/zinc/78/29/34/355782934.db2.gz	MFFZKZYJXOIWHI-LBPRGKRZSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@H]1COC(C)(C)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000593058446	355782936	/nfs/dbraw/zinc/78/29/36/355782936.db2.gz	MFFZKZYJXOIWHI-LBPRGKRZSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H](CC)CO1	ZINC000593060284	355783659	/nfs/dbraw/zinc/78/36/59/355783659.db2.gz	ZYKUJZVPGOESJM-MRVWCRGKSA-N	1	1	312.370	1.042	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000593108851	355800864	/nfs/dbraw/zinc/80/08/64/355800864.db2.gz	DRABRPAREPFKRF-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000593108851	355800866	/nfs/dbraw/zinc/80/08/66/355800866.db2.gz	DRABRPAREPFKRF-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@@H]1Cc1ccccc1	ZINC000593503347	355905529	/nfs/dbraw/zinc/90/55/29/355905529.db2.gz	IJLVTUFJJALWPH-AWEZNQCLSA-N	1	1	315.377	1.691	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000593588730	355935164	/nfs/dbraw/zinc/93/51/64/355935164.db2.gz	LXBKQCNUTCIOFL-IAQYHMDHSA-N	1	1	321.352	1.829	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593679839	355964760	/nfs/dbraw/zinc/96/47/60/355964760.db2.gz	MWJKRRGYKLRDAX-SJDLMVEWSA-N	1	1	303.362	1.359	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000593991707	356081159	/nfs/dbraw/zinc/08/11/59/356081159.db2.gz	JAMVJJOKAFLGAC-CQSZACIVSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000594063066	356103297	/nfs/dbraw/zinc/10/32/97/356103297.db2.gz	IGXQALUFLNGGLL-DGCLKSJQSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1	ZINC000594569034	356252025	/nfs/dbraw/zinc/25/20/25/356252025.db2.gz	XTUIJDHYFLKTKS-OAHLLOKOSA-N	1	1	304.350	1.771	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1	ZINC000594571556	356252547	/nfs/dbraw/zinc/25/25/47/356252547.db2.gz	QREGUCLXLOXUEE-CYBMUJFWSA-N	1	1	304.350	1.771	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)C[NH+]1CC(C)(C)C1	ZINC000565207328	304052770	/nfs/dbraw/zinc/05/27/70/304052770.db2.gz	ZKNSVKQLTJBPPV-UHFFFAOYSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CS1(=O)=O	ZINC000594976969	356367014	/nfs/dbraw/zinc/36/70/14/356367014.db2.gz	RGECIYWDELVJQY-ONGXEEELSA-N	1	1	316.354	1.789	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000595446558	356495581	/nfs/dbraw/zinc/49/55/81/356495581.db2.gz	MDDYBXVNNXUSEW-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CCN(c2[nH]cc[nH+]2)CC1	ZINC000595465372	356503207	/nfs/dbraw/zinc/50/32/07/356503207.db2.gz	MKWJRKXPBKYADT-UHFFFAOYSA-N	1	1	305.313	1.779	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000081555453	192291316	/nfs/dbraw/zinc/29/13/16/192291316.db2.gz	UDQQFZHOAYQJST-LLVKDONJSA-N	1	1	322.365	1.156	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595742438	356631172	/nfs/dbraw/zinc/63/11/72/356631172.db2.gz	GMDNDLJIJKUQOS-UTUOFQBUSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H]1CCO	ZINC000595706887	356617036	/nfs/dbraw/zinc/61/70/36/356617036.db2.gz	YEYWJSSLLYJQPZ-OCCSQVGLSA-N	1	1	309.366	1.239	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000595768241	356644780	/nfs/dbraw/zinc/64/47/80/356644780.db2.gz	FWCWDMJZQBLPDO-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@@]2(O)C[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000595759566	356640637	/nfs/dbraw/zinc/64/06/37/356640637.db2.gz	WVJOOFVTMBOKQN-XHDPSFHLSA-N	1	1	305.334	1.014	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@]2(O)C[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000595759566	356640640	/nfs/dbraw/zinc/64/06/40/356640640.db2.gz	WVJOOFVTMBOKQN-XHDPSFHLSA-N	1	1	305.334	1.014	20	5		DDBDMO
CC(C)NC(=O)[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000595851957	356678821	/nfs/dbraw/zinc/67/88/21/356678821.db2.gz	XDSVTKUGPDMXES-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[N@H+](CC1=CCSC1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595887554	356691829	/nfs/dbraw/zinc/69/18/29/356691829.db2.gz	FSHRGEMUCLUONC-UHFFFAOYSA-N	1	1	307.375	1.799	20	5		DDBDMO
C[N@@H+](CC1=CCSC1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595887554	356691836	/nfs/dbraw/zinc/69/18/36/356691836.db2.gz	FSHRGEMUCLUONC-UHFFFAOYSA-N	1	1	307.375	1.799	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C2	ZINC000597709975	357296354	/nfs/dbraw/zinc/29/63/54/357296354.db2.gz	FLWCXBHYNRBZHP-OAHLLOKOSA-N	1	1	320.349	1.253	20	5		DDBDMO
NC(=O)c1ccnc(NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000599163073	357834729	/nfs/dbraw/zinc/83/47/29/357834729.db2.gz	ATCHAGJVUDDUOQ-LLVKDONJSA-N	1	1	319.365	1.518	20	5		DDBDMO
CCOC(=O)C[C@@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000599404967	357924092	/nfs/dbraw/zinc/92/40/92/357924092.db2.gz	OMUCAOFIQDTGEF-CQSZACIVSA-N	1	1	310.350	1.383	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)Nc1ccccc1[N+](=O)[O-]	ZINC000599681350	358022819	/nfs/dbraw/zinc/02/28/19/358022819.db2.gz	NRJLNRSFURFSSP-PSOPSSQASA-N	1	1	305.334	1.379	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)Nc1ccccc1[N+](=O)[O-]	ZINC000599681350	358022822	/nfs/dbraw/zinc/02/28/22/358022822.db2.gz	NRJLNRSFURFSSP-PSOPSSQASA-N	1	1	305.334	1.379	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]([N@H+]3CC[C@H](O)C3)C2)c1	ZINC000599939517	358086432	/nfs/dbraw/zinc/08/64/32/358086432.db2.gz	WCQSNWKSFXQUOO-OLZOCXBDSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000600315510	358193994	/nfs/dbraw/zinc/19/39/94/358193994.db2.gz	ULSKKJRMNYOBSY-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
CCN(C)C(=O)[C@@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601153518	358424153	/nfs/dbraw/zinc/42/41/53/358424153.db2.gz	YTZSFHSIKZECCO-SNVBAGLBSA-N	1	1	302.334	1.844	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@@H](CO)C1	ZINC000601979247	358763957	/nfs/dbraw/zinc/76/39/57/358763957.db2.gz	BODVGRNJWAMGAQ-GFCCVEGCSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@@H](CO)C1	ZINC000601979247	358763961	/nfs/dbraw/zinc/76/39/61/358763961.db2.gz	BODVGRNJWAMGAQ-GFCCVEGCSA-N	1	1	302.334	1.256	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](Cn2ccnn2)C1	ZINC000602797806	359199287	/nfs/dbraw/zinc/19/92/87/359199287.db2.gz	DOBVEGQYLQRIPK-CYBMUJFWSA-N	1	1	319.369	1.103	20	5		DDBDMO
CN(CC1CC1)C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602962124	359325090	/nfs/dbraw/zinc/32/50/90/359325090.db2.gz	HTIWFGDMMXAXOX-INIZCTEOSA-N	1	1	321.377	1.260	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCCO)C1CC1	ZINC000609846193	360355217	/nfs/dbraw/zinc/35/52/17/360355217.db2.gz	ZCAPXHKVJCNCTR-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCCO)C1CC1	ZINC000609846193	360355225	/nfs/dbraw/zinc/35/52/25/360355225.db2.gz	ZCAPXHKVJCNCTR-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
Cc1cnc(N[C@H]2CC[N@@H+](C3CCN(C)CC3)C2)c([N+](=O)[O-])c1	ZINC000610284014	360408532	/nfs/dbraw/zinc/40/85/32/360408532.db2.gz	YNDDSZDYEABKAX-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1cnc(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)c([N+](=O)[O-])c1	ZINC000610284014	360408536	/nfs/dbraw/zinc/40/85/36/360408536.db2.gz	YNDDSZDYEABKAX-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Nc2ccncc2[N+](=O)[O-])C[C@H]1C	ZINC000359027168	299311058	/nfs/dbraw/zinc/31/10/58/299311058.db2.gz	NAHPDXIYIUGYBF-MNOVXSKESA-N	1	1	307.354	1.358	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000611033065	360608342	/nfs/dbraw/zinc/60/83/42/360608342.db2.gz	SWUBZSDIZPKKBX-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@H](NS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000611033065	360608347	/nfs/dbraw/zinc/60/83/47/360608347.db2.gz	SWUBZSDIZPKKBX-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
CCOC(=O)C[C@H](O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000611237144	360672744	/nfs/dbraw/zinc/67/27/44/360672744.db2.gz	ABZVBMOEDKMAOV-HNNXBMFYSA-N	1	1	322.361	1.873	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000612030668	360895066	/nfs/dbraw/zinc/89/50/66/360895066.db2.gz	WIWJMUGNOLWRJS-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[N@H+](C1CC(O)C1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000612741059	361129779	/nfs/dbraw/zinc/12/97/79/361129779.db2.gz	ZKZLFYRTERGFDY-RUXDESIVSA-N	1	1	305.334	1.155	20	5		DDBDMO
C[N@@H+](C1CC(O)C1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000612741059	361129781	/nfs/dbraw/zinc/12/97/81/361129781.db2.gz	ZKZLFYRTERGFDY-RUXDESIVSA-N	1	1	305.334	1.155	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000194632428	201265999	/nfs/dbraw/zinc/26/59/99/201265999.db2.gz	WTYVKCHSCUIKMR-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)CN1	ZINC000619077475	363888178	/nfs/dbraw/zinc/88/81/78/363888178.db2.gz	HKOHEUFVBHZWMF-OICCZTGUSA-N	1	1	301.346	1.820	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252420	363945777	/nfs/dbraw/zinc/94/57/77/363945777.db2.gz	KYKRSZAHBNJPOE-ZJUUUORDSA-N	1	1	313.354	1.915	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)cccc1[N+](=O)[O-]	ZINC000619873381	364170402	/nfs/dbraw/zinc/17/04/02/364170402.db2.gz	IIIDYFHGYCPEHA-CYBMUJFWSA-N	1	1	318.377	1.023	20	5		DDBDMO
C[C@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cn[nH]c1	ZINC000275137172	212143373	/nfs/dbraw/zinc/14/33/73/212143373.db2.gz	CTVRAGFRSXRFET-JTQLQIEISA-N	1	1	324.362	1.442	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@H]2C[NH2+]C[C@@H]2C1	ZINC000359276122	299391313	/nfs/dbraw/zinc/39/13/13/299391313.db2.gz	CJSTXIZJDLWXAY-CHWSQXEVSA-N	1	1	318.377	1.383	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000349898035	284099098	/nfs/dbraw/zinc/09/90/98/284099098.db2.gz	RWENRSGTFMYDGE-TXEJJXNPSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCCC[C@H]1C	ZINC000350014787	284132175	/nfs/dbraw/zinc/13/21/75/284132175.db2.gz	QMUXUGYLPUOYTD-MNOVXSKESA-N	1	1	321.381	1.565	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CCN(c2[nH]cc[nH+]2)CC1	ZINC000566416442	304152809	/nfs/dbraw/zinc/15/28/09/304152809.db2.gz	PILRIFQDCQDHJD-UHFFFAOYSA-N	1	1	317.349	1.649	20	5		DDBDMO
CC(C)[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200783	284308193	/nfs/dbraw/zinc/30/81/93/284308193.db2.gz	JOUNYNDRUJWCDV-ZBFHGGJFSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200783	284308194	/nfs/dbraw/zinc/30/81/94/284308194.db2.gz	JOUNYNDRUJWCDV-ZBFHGGJFSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CC[N@H+]1C[C@H](C)O	ZINC000266392091	205314465	/nfs/dbraw/zinc/31/44/65/205314465.db2.gz	OEAXAAZFFRTDEK-QWHCGFSZSA-N	1	1	323.393	1.885	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000267465601	206087956	/nfs/dbraw/zinc/08/79/56/206087956.db2.gz	RVBYTOZUBMSKCM-LLVKDONJSA-N	1	1	318.337	1.436	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1[C@H]1CCCOC1	ZINC000566970894	304190742	/nfs/dbraw/zinc/19/07/42/304190742.db2.gz	FTBPAXBKLFNIOO-DZGCQCFKSA-N	1	1	321.377	1.648	20	5		DDBDMO
CC[N@H+](CCO)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000267855047	206305529	/nfs/dbraw/zinc/30/55/29/206305529.db2.gz	DIMYOQKKXHQPKZ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CCO)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000267855047	206305531	/nfs/dbraw/zinc/30/55/31/206305531.db2.gz	DIMYOQKKXHQPKZ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCS(=O)(=O)C2)c(F)c1	ZINC000336830106	249241720	/nfs/dbraw/zinc/24/17/20/249241720.db2.gz	BLMVNUDDLQABRB-JTQLQIEISA-N	1	1	302.327	1.401	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cccc(C)c1[N+](=O)[O-]	ZINC000041423200	183190778	/nfs/dbraw/zinc/19/07/78/183190778.db2.gz	YQTYMTCHQVOUQL-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
CNc1c(C(=O)N2CC[NH+](C3CCC3)CC2)cccc1[N+](=O)[O-]	ZINC000336896634	249284459	/nfs/dbraw/zinc/28/44/59/249284459.db2.gz	OGOYVRRMSDWJKX-UHFFFAOYSA-N	1	1	318.377	1.947	20	5		DDBDMO
CNc1c(C(=O)NCC[NH+]2CCSCC2)cccc1[N+](=O)[O-]	ZINC000336867065	249274375	/nfs/dbraw/zinc/27/43/75/249274375.db2.gz	QYVBXEDXCLXCMR-UHFFFAOYSA-N	1	1	324.406	1.415	20	5		DDBDMO
COc1cc(N2CC[C@@H]3OCC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000285209727	218334853	/nfs/dbraw/zinc/33/48/53/218334853.db2.gz	WYZSXQOYXVBSFE-KGLIPLIRSA-N	1	1	307.350	1.513	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000340590701	251127811	/nfs/dbraw/zinc/12/78/11/251127811.db2.gz	GIXNUUIIVGICJX-CYBMUJFWSA-N	1	1	314.345	1.927	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939982	251290705	/nfs/dbraw/zinc/29/07/05/251290705.db2.gz	XTJUVCLSYINTFS-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939982	251290708	/nfs/dbraw/zinc/29/07/08/251290708.db2.gz	XTJUVCLSYINTFS-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1O	ZINC000341004210	251329735	/nfs/dbraw/zinc/32/97/35/251329735.db2.gz	AMLIPNGNJFPAGQ-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1O	ZINC000341004210	251329738	/nfs/dbraw/zinc/32/97/38/251329738.db2.gz	AMLIPNGNJFPAGQ-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@H]1[NH3+]	ZINC000269175278	207296453	/nfs/dbraw/zinc/29/64/53/207296453.db2.gz	BMJWXEPDFSPFTO-GZMMTYOYSA-N	1	1	303.322	1.280	20	5		DDBDMO
CCOC(=O)N[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157688802	197207935	/nfs/dbraw/zinc/20/79/35/197207935.db2.gz	UWWIKBYGZFZYJZ-NSHDSACASA-N	1	1	311.342	1.002	20	5		DDBDMO
CCOC(=O)N[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157688802	197207936	/nfs/dbraw/zinc/20/79/36/197207936.db2.gz	UWWIKBYGZFZYJZ-NSHDSACASA-N	1	1	311.342	1.002	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc2c(c1)OCO2	ZINC000157437548	197187187	/nfs/dbraw/zinc/18/71/87/197187187.db2.gz	NDJMQWKPDBQKPL-UHFFFAOYSA-N	1	1	304.306	1.652	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1ccc[nH]1	ZINC000090553168	285221196	/nfs/dbraw/zinc/22/11/96/285221196.db2.gz	OEXYANWFTKDWMP-CQSZACIVSA-N	1	1	302.334	1.922	20	5		DDBDMO
Cn1nccc1CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352705957	285242228	/nfs/dbraw/zinc/24/22/28/285242228.db2.gz	LWASTBWFVCCXNP-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
Cn1nccc1CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352705957	285242229	/nfs/dbraw/zinc/24/22/29/285242229.db2.gz	LWASTBWFVCCXNP-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)C[C@H]1COCCN1	ZINC000422711137	533222396	/nfs/dbraw/zinc/22/23/96/533222396.db2.gz	GRAUZRNZMPFUIJ-YPMHNXCESA-N	1	1	309.366	1.460	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000490640128	533312806	/nfs/dbraw/zinc/31/28/06/533312806.db2.gz	RSVOSTGBPXYDBS-HJWRWDBZSA-N	1	1	321.377	1.693	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000452065508	533677253	/nfs/dbraw/zinc/67/72/53/533677253.db2.gz	COODFZNKXOBVAJ-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000452065508	533677260	/nfs/dbraw/zinc/67/72/60/533677260.db2.gz	COODFZNKXOBVAJ-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2C(N)=O)cccc1[N+](=O)[O-]	ZINC000068369204	406636985	/nfs/dbraw/zinc/63/69/85/406636985.db2.gz	PAINXGIISWQYDO-ZDUSSCGKSA-N	1	1	320.349	1.182	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCS(=O)(=O)C2)c1	ZINC000069141068	406683739	/nfs/dbraw/zinc/68/37/39/406683739.db2.gz	JZMDMKMGNUAUIR-SNVBAGLBSA-N	1	1	318.782	1.915	20	5		DDBDMO
COCCCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000077359346	406986828	/nfs/dbraw/zinc/98/68/28/406986828.db2.gz	HKJMASIKHQSGPE-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000123963718	407344444	/nfs/dbraw/zinc/34/44/44/407344444.db2.gz	KFCVBOGQZZBZII-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCOC2)cccc1[N+](=O)[O-]	ZINC000106882102	407365227	/nfs/dbraw/zinc/36/52/27/407365227.db2.gz	IJFCKPXCOALEPL-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCN1CCOCC1	ZINC000112407458	407428901	/nfs/dbraw/zinc/42/89/01/407428901.db2.gz	DVERZKQONGQTAZ-UHFFFAOYSA-N	1	1	309.366	1.238	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1O	ZINC000271012741	407470529	/nfs/dbraw/zinc/47/05/29/407470529.db2.gz	ZWMNPPCSHVPJIQ-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1O	ZINC000271012741	407470536	/nfs/dbraw/zinc/47/05/36/407470536.db2.gz	ZWMNPPCSHVPJIQ-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000271375864	407659761	/nfs/dbraw/zinc/65/97/61/407659761.db2.gz	WPFUZZUGILPNHX-AWEZNQCLSA-N	1	1	306.366	1.655	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000115432796	407681636	/nfs/dbraw/zinc/68/16/36/407681636.db2.gz	NPEXMZSAIMIWHV-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000261984787	407702770	/nfs/dbraw/zinc/70/27/70/407702770.db2.gz	AVGVVOVSORCOSH-CZUORRHYSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000261984787	407702774	/nfs/dbraw/zinc/70/27/74/407702774.db2.gz	AVGVVOVSORCOSH-CZUORRHYSA-N	1	1	304.394	1.635	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCc3c(F)cccc3C2)c1	ZINC000152912811	407713275	/nfs/dbraw/zinc/71/32/75/407713275.db2.gz	DBQKFHXHLXHPHO-CYBMUJFWSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3c(F)cccc3C2)c1	ZINC000152912811	407713283	/nfs/dbraw/zinc/71/32/83/407713283.db2.gz	DBQKFHXHLXHPHO-CYBMUJFWSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCn3ccnc3)C2)nc1	ZINC000131884085	407756581	/nfs/dbraw/zinc/75/65/81/407756581.db2.gz	WXNDUIAWACCLGF-LBPRGKRZSA-N	1	1	302.338	1.373	20	5		DDBDMO
CC(C)[C@](C)(C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236673237	407745581	/nfs/dbraw/zinc/74/55/81/407745581.db2.gz	OLBWIPJUNHXECY-AWEZNQCLSA-N	1	1	305.338	1.574	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000272242301	407830331	/nfs/dbraw/zinc/83/03/31/407830331.db2.gz	XUHORKZOQHLCMZ-JTQLQIEISA-N	1	1	309.370	1.429	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000153599529	407856888	/nfs/dbraw/zinc/85/68/88/407856888.db2.gz	XZLWSHYLQXHSPL-OAHLLOKOSA-N	1	1	305.334	1.306	20	5		DDBDMO
C[N@@H+](CCOCC1CC1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000268118591	407899262	/nfs/dbraw/zinc/89/92/62/407899262.db2.gz	NKVCYIWJGIUSIX-OAHLLOKOSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[C@@H](CNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000118129259	407899667	/nfs/dbraw/zinc/89/96/67/407899667.db2.gz	HVSPGFSHJGWPNY-JTQLQIEISA-N	1	1	320.349	1.132	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](CC(C)(C)O)CC1	ZINC000172824321	407850922	/nfs/dbraw/zinc/85/09/22/407850922.db2.gz	LIHQKPDUUIDJMX-UHFFFAOYSA-N	1	1	311.386	1.013	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000268151151	407917113	/nfs/dbraw/zinc/91/71/13/407917113.db2.gz	UQUPASLZXMTSEW-XHDPSFHLSA-N	1	1	318.377	1.877	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2nn(C)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000272467538	407934163	/nfs/dbraw/zinc/93/41/63/407934163.db2.gz	WIABJMJPDXLUSI-MNOVXSKESA-N	1	1	309.370	1.131	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000154376844	408027879	/nfs/dbraw/zinc/02/78/79/408027879.db2.gz	IPAQUJKJTJLGBX-GXTWGEPZSA-N	1	1	308.334	1.513	20	5		DDBDMO
C[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)[C@@H](c2ccccc2)C1	ZINC000245838673	408074978	/nfs/dbraw/zinc/07/49/78/408074978.db2.gz	JFRZUXAAKHHOBU-MRXNPFEDSA-N	1	1	315.377	1.780	20	5		DDBDMO
C[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCC[C@H](C)C1	ZINC000245853958	408078254	/nfs/dbraw/zinc/07/82/54/408078254.db2.gz	DGUGWEBIWSYPPM-WDEREUQCSA-N	1	1	309.370	1.179	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000175267117	408091494	/nfs/dbraw/zinc/09/14/94/408091494.db2.gz	XGIOTJLJYDQQST-UHFFFAOYSA-N	1	1	324.381	1.362	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269301479	408260612	/nfs/dbraw/zinc/26/06/12/408260612.db2.gz	USIPWXOTPRHTAA-IINYFYTJSA-N	1	1	307.350	1.713	20	5		DDBDMO
C[C@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269301479	408260620	/nfs/dbraw/zinc/26/06/20/408260620.db2.gz	USIPWXOTPRHTAA-IINYFYTJSA-N	1	1	307.350	1.713	20	5		DDBDMO
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(F)(F)C[NH3+]	ZINC000190253592	408201616	/nfs/dbraw/zinc/20/16/16/408201616.db2.gz	CWLHQIZXACIOSH-MRVPVSSYSA-N	1	1	319.333	1.786	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](C)CO	ZINC000131843119	162024634	/nfs/dbraw/zinc/02/46/34/162024634.db2.gz	HYFSYQVTKTYMEF-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000190896228	408337600	/nfs/dbraw/zinc/33/76/00/408337600.db2.gz	UQBLICXTDQIMAN-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000247320480	408450448	/nfs/dbraw/zinc/45/04/48/408450448.db2.gz	SIUOQMCXZLWAGP-WCQYABFASA-N	1	1	318.377	1.733	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000183576400	408444263	/nfs/dbraw/zinc/44/42/63/408444263.db2.gz	IACFOOXPKRGZNF-UHFFFAOYSA-N	1	1	311.342	1.080	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1	ZINC000264438278	408487979	/nfs/dbraw/zinc/48/79/79/408487979.db2.gz	BJYCJJTYMZGVIA-GBXSZLQWSA-N	1	1	319.361	1.445	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177087980	408515774	/nfs/dbraw/zinc/51/57/74/408515774.db2.gz	LOLMANGLGOBSRZ-NEPJUHHUSA-N	1	1	319.361	1.715	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000270421239	408529611	/nfs/dbraw/zinc/52/96/11/408529611.db2.gz	GDVVUGMASBDFLJ-GXFFZTMASA-N	1	1	307.350	1.429	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@H]21	ZINC000248130205	408537277	/nfs/dbraw/zinc/53/72/77/408537277.db2.gz	OJFLDAZPXYRQNP-WCQYABFASA-N	1	1	318.377	1.733	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000192528862	408605512	/nfs/dbraw/zinc/60/55/12/408605512.db2.gz	NSUXNQQTATYPGL-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248697399	408617945	/nfs/dbraw/zinc/61/79/45/408617945.db2.gz	ARTFGOJESFOSBV-CRWXNKLISA-N	1	1	324.377	1.568	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H](C)CO	ZINC000248955378	408666912	/nfs/dbraw/zinc/66/69/12/408666912.db2.gz	QCZUFQJSBNLLME-CHWSQXEVSA-N	1	1	312.366	1.427	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000270848152	408707321	/nfs/dbraw/zinc/70/73/21/408707321.db2.gz	GGODDCBHAVZKGY-YWPYICTPSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000270848152	408707326	/nfs/dbraw/zinc/70/73/26/408707326.db2.gz	GGODDCBHAVZKGY-YWPYICTPSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@H](C)O)C[C@H]1C	ZINC000251947652	408790522	/nfs/dbraw/zinc/79/05/22/408790522.db2.gz	UJNKHPMKFFUXTK-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@H](C)O)C[C@H]1C	ZINC000251947652	408790525	/nfs/dbraw/zinc/79/05/25/408790525.db2.gz	UJNKHPMKFFUXTK-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])cc1F	ZINC000290945963	408855628	/nfs/dbraw/zinc/85/56/28/408855628.db2.gz	MCGCKPSVYFDHEJ-UHFFFAOYSA-N	1	1	321.312	1.792	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000277368847	408928341	/nfs/dbraw/zinc/92/83/41/408928341.db2.gz	CWCTUDUOHDYKCQ-LLVKDONJSA-N	1	1	323.349	1.054	20	5		DDBDMO
CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000291786632	408923796	/nfs/dbraw/zinc/92/37/96/408923796.db2.gz	GCSVZFBWGKJAMX-SNVBAGLBSA-N	1	1	319.365	1.930	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000291786632	408923797	/nfs/dbraw/zinc/92/37/97/408923797.db2.gz	GCSVZFBWGKJAMX-SNVBAGLBSA-N	1	1	319.365	1.930	20	5		DDBDMO
CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000291786632	408923800	/nfs/dbraw/zinc/92/38/00/408923800.db2.gz	GCSVZFBWGKJAMX-SNVBAGLBSA-N	1	1	319.365	1.930	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000194712288	163293883	/nfs/dbraw/zinc/29/38/83/163293883.db2.gz	PJYZLSJTGKKXSW-GFCCVEGCSA-N	1	1	306.366	1.607	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](CC2CC2)CC1	ZINC000277609425	408976389	/nfs/dbraw/zinc/97/63/89/408976389.db2.gz	PTADHGHCHHJEKH-UHFFFAOYSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)C1	ZINC000277791498	409013025	/nfs/dbraw/zinc/01/30/25/409013025.db2.gz	NJIXGLTXAXHXQR-VHSXEESVSA-N	1	1	321.337	1.022	20	5		DDBDMO
O=c1[n-]nc([C@H]2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)o1	ZINC000283912251	409237571	/nfs/dbraw/zinc/23/75/71/409237571.db2.gz	GCMXKRCZPFAPHK-NSHDSACASA-N	1	1	304.306	1.651	20	5		DDBDMO
O=c1[n-]nc([C@H]2CCCN(Cc3cccc([N+](=O)[O-])c3)C2)o1	ZINC000283912251	409237575	/nfs/dbraw/zinc/23/75/75/409237575.db2.gz	GCMXKRCZPFAPHK-NSHDSACASA-N	1	1	304.306	1.651	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1	ZINC000295273011	409409914	/nfs/dbraw/zinc/40/99/14/409409914.db2.gz	GZDQYZMAITWICJ-NSHDSACASA-N	1	1	318.377	1.733	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCNC(=O)CC1	ZINC000295309604	409427425	/nfs/dbraw/zinc/42/74/25/409427425.db2.gz	NDKHSRNLNHXCRU-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000317417114	164026973	/nfs/dbraw/zinc/02/69/73/164026973.db2.gz	YIWQBNGOTMTALC-QWRGUYRKSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000408371886	164310581	/nfs/dbraw/zinc/31/05/81/164310581.db2.gz	FXHIXPCNCAHPPI-GFCCVEGCSA-N	1	1	307.354	1.049	20	5		DDBDMO
COC[C@@]1(C)CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296906838	409696990	/nfs/dbraw/zinc/69/69/90/409696990.db2.gz	WALOIXWUGDGSFI-INIZCTEOSA-N	1	1	321.377	1.916	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296906838	409696996	/nfs/dbraw/zinc/69/69/96/409696996.db2.gz	WALOIXWUGDGSFI-INIZCTEOSA-N	1	1	321.377	1.916	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000354117692	409669705	/nfs/dbraw/zinc/66/97/05/409669705.db2.gz	HJPSVXRXXCGWQL-NSHDSACASA-N	1	1	320.349	1.263	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000354117692	409669716	/nfs/dbraw/zinc/66/97/16/409669716.db2.gz	HJPSVXRXXCGWQL-NSHDSACASA-N	1	1	320.349	1.263	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000356867444	409679402	/nfs/dbraw/zinc/67/94/02/409679402.db2.gz	YRBZYJRZROCSEU-WDEREUQCSA-N	1	1	309.341	1.827	20	5		DDBDMO
CC(C)(C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12)n1cc([N+](=O)[O-])cn1	ZINC000331663731	409747914	/nfs/dbraw/zinc/74/79/14/409747914.db2.gz	OSTXSGJXVVBHRF-CHWSQXEVSA-N	1	1	321.381	1.269	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000346144007	409819307	/nfs/dbraw/zinc/81/93/07/409819307.db2.gz	UCIWFUGLJSCOKH-QWRGUYRKSA-N	1	1	323.397	1.873	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)Nc3ccncc3[N+](=O)[O-])C2)C1	ZINC000297883135	410035596	/nfs/dbraw/zinc/03/55/96/410035596.db2.gz	VYUGSGFDBIFBLQ-OAHLLOKOSA-N	1	1	319.365	1.939	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1cccc(C(N)=O)c1[N+](=O)[O-])CC2	ZINC000342930292	410006381	/nfs/dbraw/zinc/00/63/81/410006381.db2.gz	HFZZGVLDCQMDOO-UHFFFAOYSA-N	1	1	318.377	1.758	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC[C@@H]1CC1CCC1	ZINC000339779712	410453886	/nfs/dbraw/zinc/45/38/86/410453886.db2.gz	XGRTVAHADKJEEF-HNNXBMFYSA-N	1	1	321.377	1.648	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@@H]1CC1CCC1	ZINC000339779712	410453892	/nfs/dbraw/zinc/45/38/92/410453892.db2.gz	XGRTVAHADKJEEF-HNNXBMFYSA-N	1	1	321.377	1.648	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](NC(N)=O)C1	ZINC000347361672	410495737	/nfs/dbraw/zinc/49/57/37/410495737.db2.gz	PWMBVKBYKCWAIX-LWMSPQMPSA-N	1	1	304.350	1.741	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CC[N@H+](C)C1	ZINC000343600608	410563931	/nfs/dbraw/zinc/56/39/31/410563931.db2.gz	DNECLYPHESCCPF-LLVKDONJSA-N	1	1	313.379	1.140	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CC[N@@H+](C)C1	ZINC000343600608	410563938	/nfs/dbraw/zinc/56/39/38/410563938.db2.gz	DNECLYPHESCCPF-LLVKDONJSA-N	1	1	313.379	1.140	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000299577851	410597106	/nfs/dbraw/zinc/59/71/06/410597106.db2.gz	CMROFYANZBABHR-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1	ZINC000334042911	410626225	/nfs/dbraw/zinc/62/62/25/410626225.db2.gz	ZXBBAYIHMVIKSX-QWRGUYRKSA-N	1	1	307.350	1.816	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000301430497	410719775	/nfs/dbraw/zinc/71/97/75/410719775.db2.gz	QEUQLFADGMXJQH-YPMHNXCESA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000330597689	410811452	/nfs/dbraw/zinc/81/14/52/410811452.db2.gz	SJQMLWYEKVHNTN-RYUDHWBXSA-N	1	1	307.350	1.525	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000343952821	410845184	/nfs/dbraw/zinc/84/51/84/410845184.db2.gz	BQQWCTUQONNCHW-SNVBAGLBSA-N	1	1	307.354	1.375	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1C	ZINC000331090876	410941763	/nfs/dbraw/zinc/94/17/63/410941763.db2.gz	HQMPBVHNIDDHKC-JTQLQIEISA-N	1	1	307.350	1.688	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1C	ZINC000331090876	410941770	/nfs/dbraw/zinc/94/17/70/410941770.db2.gz	HQMPBVHNIDDHKC-JTQLQIEISA-N	1	1	307.350	1.688	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@H]1C	ZINC000353490953	411028388	/nfs/dbraw/zinc/02/83/88/411028388.db2.gz	LOKGZRXUJWUTON-GHMZBOCLSA-N	1	1	321.381	1.517	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000373742218	418454696	/nfs/dbraw/zinc/45/46/96/418454696.db2.gz	OPLAMDZBEDBQRD-GFCCVEGCSA-N	1	1	311.357	1.622	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[NH+]([C@@H]3CCOC3)CC2)cc1F	ZINC000374858534	418570621	/nfs/dbraw/zinc/57/06/21/418570621.db2.gz	CPXWSYPIVISGNT-CYBMUJFWSA-N	1	1	309.341	1.640	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CCOc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000375034706	418592347	/nfs/dbraw/zinc/59/23/47/418592347.db2.gz	DDUATUHTINATFK-HIFRSBDPSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](O)C1(C)C	ZINC000361420905	418649823	/nfs/dbraw/zinc/64/98/23/418649823.db2.gz	QAXSHOGOBAIZDJ-ZDUSSCGKSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](O)C1(C)C	ZINC000361420905	418649825	/nfs/dbraw/zinc/64/98/25/418649825.db2.gz	QAXSHOGOBAIZDJ-ZDUSSCGKSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000361563069	418678449	/nfs/dbraw/zinc/67/84/49/418678449.db2.gz	FAFSMDULHGYLIK-AWEZNQCLSA-N	1	1	303.322	1.168	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000361563069	418678452	/nfs/dbraw/zinc/67/84/52/418678452.db2.gz	FAFSMDULHGYLIK-AWEZNQCLSA-N	1	1	303.322	1.168	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000387549063	418743492	/nfs/dbraw/zinc/74/34/92/418743492.db2.gz	AZBCDJHDDZYUCH-NSHDSACASA-N	1	1	306.366	1.637	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000362057540	418745663	/nfs/dbraw/zinc/74/56/63/418745663.db2.gz	LEZLKVIGXIMEKZ-LBPRGKRZSA-N	1	1	306.366	1.917	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[N@@H+]3CCOC[C@@H]3C1)CCN2	ZINC000365544871	418874206	/nfs/dbraw/zinc/87/42/06/418874206.db2.gz	IJPJDSFDLITJKK-NSHDSACASA-N	1	1	304.350	1.084	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[N@H+]3CCOC[C@@H]3C1)CCN2	ZINC000365544871	418874208	/nfs/dbraw/zinc/87/42/08/418874208.db2.gz	IJPJDSFDLITJKK-NSHDSACASA-N	1	1	304.350	1.084	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3[nH]cnc3C2)c([N+](=O)[O-])c1	ZINC000365614258	418883086	/nfs/dbraw/zinc/88/30/86/418883086.db2.gz	SFDGPOYPMCZMPE-JTQLQIEISA-N	1	1	317.305	1.873	20	5		DDBDMO
CCN(CC)C(=O)[C@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280828	418850741	/nfs/dbraw/zinc/85/07/41/418850741.db2.gz	GGUXTZHUNZNGBI-STQMWFEESA-N	1	1	323.397	1.685	20	5		DDBDMO
CCN(CC)C(=O)[C@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280828	418850744	/nfs/dbraw/zinc/85/07/44/418850744.db2.gz	GGUXTZHUNZNGBI-STQMWFEESA-N	1	1	323.397	1.685	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@]1(CO)CCOC1	ZINC000411511614	418910692	/nfs/dbraw/zinc/91/06/92/418910692.db2.gz	ZDUDCGUBPACXBA-HNNXBMFYSA-N	1	1	323.349	1.007	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000411616176	419363387	/nfs/dbraw/zinc/36/33/87/419363387.db2.gz	MJKWDGBLWRBLEQ-LSDHHAIUSA-N	1	1	303.362	1.909	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000425919105	419368015	/nfs/dbraw/zinc/36/80/15/419368015.db2.gz	ATZCXMNOHBSQQA-OAHLLOKOSA-N	1	1	308.334	1.808	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420940660	419369198	/nfs/dbraw/zinc/36/91/98/419369198.db2.gz	NAVSSGOONGCSGG-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420940660	419369204	/nfs/dbraw/zinc/36/92/04/419369204.db2.gz	NAVSSGOONGCSGG-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2C[C@@H](O)C[C@H]2c2ccccc2)n1	ZINC000411948334	419515871	/nfs/dbraw/zinc/51/58/71/419515871.db2.gz	PQNWEPGZLRNRRD-KBPBESRZSA-N	1	1	302.334	1.599	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000412029064	419572234	/nfs/dbraw/zinc/57/22/34/419572234.db2.gz	CKWOCFPCJRPCEB-RISCZKNCSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000412029064	419572240	/nfs/dbraw/zinc/57/22/40/419572240.db2.gz	CKWOCFPCJRPCEB-RISCZKNCSA-N	1	1	319.361	1.187	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CC(N)=O)CC1	ZINC000430203282	420090703	/nfs/dbraw/zinc/09/07/03/420090703.db2.gz	OHQQPIDLZFQCSO-UHFFFAOYSA-N	1	1	307.350	1.691	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000433748448	420253975	/nfs/dbraw/zinc/25/39/75/420253975.db2.gz	LCBQWOIFOLYZEF-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000433748448	420253977	/nfs/dbraw/zinc/25/39/77/420253977.db2.gz	LCBQWOIFOLYZEF-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000433748448	420253981	/nfs/dbraw/zinc/25/39/81/420253981.db2.gz	LCBQWOIFOLYZEF-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
[NH3+]C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCC1	ZINC000423943140	420278949	/nfs/dbraw/zinc/27/89/49/420278949.db2.gz	QNYIVRAANRGPJL-ZDUSSCGKSA-N	1	1	317.349	1.718	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H](C)[C@H](C[NH3+])C2)c1[N+](=O)[O-]	ZINC000424015908	420306913	/nfs/dbraw/zinc/30/69/13/420306913.db2.gz	NIMYRURNZZBLPF-NXEZZACHSA-N	1	1	309.370	1.327	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3c(C(N)=O)cccc3[N+](=O)[O-])C2)C1	ZINC000420645852	420340449	/nfs/dbraw/zinc/34/04/49/420340449.db2.gz	ZMHJPEYGBHLERZ-INIZCTEOSA-N	1	1	318.377	1.616	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444688247	230121734	/nfs/dbraw/zinc/12/17/34/230121734.db2.gz	IXNNWQYUAJKGKC-QWRGUYRKSA-N	1	1	303.366	1.996	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@H](c3nnc[nH]3)C2)c1	ZINC000425541167	420414498	/nfs/dbraw/zinc/41/44/98/420414498.db2.gz	FYOXRMFKCNLBJI-LLVKDONJSA-N	1	1	303.322	1.581	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)/C=C\c2ccccc2[N+](=O)[O-])CC1	ZINC000492363580	420535514	/nfs/dbraw/zinc/53/55/14/420535514.db2.gz	GZNUUDTXKBZPGZ-SREVYHEPSA-N	1	1	301.346	1.986	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000492624887	420610546	/nfs/dbraw/zinc/61/05/46/420610546.db2.gz	URFAOCUKTSOITI-SREVYHEPSA-N	1	1	307.350	1.038	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1	ZINC000457121481	420620722	/nfs/dbraw/zinc/62/07/22/420620722.db2.gz	OLIPQTDHTFFIED-ZDUSSCGKSA-N	1	1	323.397	1.431	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(CNc3[nH+]cnc4[nH]ccc43)nc2c1	ZINC000443956299	420753748	/nfs/dbraw/zinc/75/37/48/420753748.db2.gz	AUOPVRYHVKMVMD-UHFFFAOYSA-N	1	1	309.289	2.355	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000561147315	421308880	/nfs/dbraw/zinc/30/88/80/421308880.db2.gz	LSQQBNPFQVFXIR-LBPRGKRZSA-N	1	1	321.377	1.699	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000548082574	421397377	/nfs/dbraw/zinc/39/73/77/421397377.db2.gz	UJGNIASOUUCEJS-UHFFFAOYSA-N	1	1	315.333	1.106	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2ccccc2C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000548082574	421397380	/nfs/dbraw/zinc/39/73/80/421397380.db2.gz	UJGNIASOUUCEJS-UHFFFAOYSA-N	1	1	315.333	1.106	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000531482989	421635249	/nfs/dbraw/zinc/63/52/49/421635249.db2.gz	JXPUARZCZCYKNO-JQWIXIFHSA-N	1	1	318.377	1.992	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](OC(F)F)C1	ZINC000555070242	421668571	/nfs/dbraw/zinc/66/85/71/421668571.db2.gz	AAXHEOIHZPKQEA-JTQLQIEISA-N	1	1	303.265	1.070	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](OC(F)F)C1	ZINC000555070242	421668572	/nfs/dbraw/zinc/66/85/72/421668572.db2.gz	AAXHEOIHZPKQEA-JTQLQIEISA-N	1	1	303.265	1.070	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000558756534	421825035	/nfs/dbraw/zinc/82/50/35/421825035.db2.gz	GRAONBGMRCDRHV-OLZOCXBDSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000572301297	421776663	/nfs/dbraw/zinc/77/66/63/421776663.db2.gz	ASCGHSFVYGHJLO-GFCCVEGCSA-N	1	1	303.362	1.821	20	5		DDBDMO
COc1nccnc1C[NH2+]CCOc1ccc([N+](=O)[O-])cc1	ZINC000574838104	422193899	/nfs/dbraw/zinc/19/38/99/422193899.db2.gz	HCPHCCQUVAEDNW-UHFFFAOYSA-N	1	1	304.306	1.562	20	5		DDBDMO
O=C(N[C@@H]1C[NH2+]CC[C@@H]1c1ccccc1)c1n[nH]cc1[N+](=O)[O-]	ZINC000595966692	422359668	/nfs/dbraw/zinc/35/96/68/422359668.db2.gz	LMFKAKXKKPHEIX-VXGBXAGGSA-N	1	1	315.333	1.193	20	5		DDBDMO
Nc1ccc(NC[C@@H]2CC[N@H+]2Cc2ccccc2)nc1[N+](=O)[O-]	ZINC000596559444	422380191	/nfs/dbraw/zinc/38/01/91/422380191.db2.gz	YPNIWIAOKYUXQH-ZDUSSCGKSA-N	1	1	313.361	2.258	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCO1	ZINC000344436033	272027039	/nfs/dbraw/zinc/02/70/39/272027039.db2.gz	PENZSQJQANXWGD-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
CCCN(CC[NH+](C)C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000344860467	272130243	/nfs/dbraw/zinc/13/02/43/272130243.db2.gz	SAMHHPPRZVBCFV-UHFFFAOYSA-N	1	1	311.386	1.855	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000330559662	279309482	/nfs/dbraw/zinc/30/94/82/279309482.db2.gz	HJIUFEVWOKUZIO-VXGBXAGGSA-N	1	1	308.382	1.784	20	5		DDBDMO
Cn1cc[nH+]c1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O	ZINC000130781090	281394092	/nfs/dbraw/zinc/39/40/92/281394092.db2.gz	VPQKHHSPPNGJHO-UHFFFAOYSA-N	1	1	301.262	1.193	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+](CCO)C2CCCCC2)c([N+](=O)[O-])c1	ZINC000120770290	295179392	/nfs/dbraw/zinc/17/93/92/295179392.db2.gz	FHTRXALALXUJQO-UHFFFAOYSA-N	1	1	321.377	1.821	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)CC[NH+]1CCOCC1	ZINC000358038406	299054093	/nfs/dbraw/zinc/05/40/93/299054093.db2.gz	FZPAZLTWGJLOMG-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1noc([C@@H]2CCC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n1	ZINC000363322229	300250970	/nfs/dbraw/zinc/25/09/70/300250970.db2.gz	BLYKQXZWTXRHTO-SNVBAGLBSA-N	1	1	306.326	1.399	20	5		DDBDMO
Cc1noc([C@@H]2CCC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n1	ZINC000363322229	300250974	/nfs/dbraw/zinc/25/09/74/300250974.db2.gz	BLYKQXZWTXRHTO-SNVBAGLBSA-N	1	1	306.326	1.399	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000363326031	300251891	/nfs/dbraw/zinc/25/18/91/300251891.db2.gz	ORSOYLUNXNIMJO-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000364037513	300337310	/nfs/dbraw/zinc/33/73/10/300337310.db2.gz	AUDMSVYTBQDMMM-QWHCGFSZSA-N	1	1	321.381	1.233	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](OCC3CC3)C2)c1	ZINC000364451247	300398782	/nfs/dbraw/zinc/39/87/82/300398782.db2.gz	XOMNTTZCINUWGM-GJZGRUSLSA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1	ZINC000364451249	300399121	/nfs/dbraw/zinc/39/91/21/300399121.db2.gz	XOMNTTZCINUWGM-LSDHHAIUSA-N	1	1	324.381	1.043	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(OC[C@@H]2CCCO2)CC1	ZINC000370236438	301300115	/nfs/dbraw/zinc/30/01/15/301300115.db2.gz	RCEPAPPMULVAHJ-ZDUSSCGKSA-N	1	1	324.381	1.488	20	5		DDBDMO
COCCC[N@H+]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000377489980	302184459	/nfs/dbraw/zinc/18/44/59/302184459.db2.gz	OWTPRHIGCTTXRI-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]12	ZINC000377655908	302205269	/nfs/dbraw/zinc/20/52/69/302205269.db2.gz	RCVKYVSHQWBVNC-JQWIXIFHSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]12	ZINC000377655908	302205272	/nfs/dbraw/zinc/20/52/72/302205272.db2.gz	RCVKYVSHQWBVNC-JQWIXIFHSA-N	1	1	309.753	1.816	20	5		DDBDMO
Cn1ccnc1[C@H]1C[NH2+]CCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000261788435	303009141	/nfs/dbraw/zinc/00/91/41/303009141.db2.gz	UEISECTUAZENFF-CYBMUJFWSA-N	1	1	315.333	1.115	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000531143181	303232764	/nfs/dbraw/zinc/23/27/64/303232764.db2.gz	QEXJAYAZUAPYJQ-CYBMUJFWSA-N	1	1	304.350	1.674	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(CCO)CC1	ZINC000532555818	303290183	/nfs/dbraw/zinc/29/01/83/303290183.db2.gz	CRDAMEVSUSAHNA-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000534268085	303328430	/nfs/dbraw/zinc/32/84/30/303328430.db2.gz	CJRJHYQTTBRLPG-UHFFFAOYSA-N	1	1	309.370	1.510	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000538350453	303384205	/nfs/dbraw/zinc/38/42/05/303384205.db2.gz	KAYVMFOPYLXFFF-UHFFFAOYSA-N	1	1	319.317	1.315	20	5		DDBDMO
CNC(=O)CN1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830506	307110982	/nfs/dbraw/zinc/11/09/82/307110982.db2.gz	QWFYZDPRXKXGQD-ZDUSSCGKSA-N	1	1	320.393	1.410	20	5		DDBDMO
CNC(=O)CN1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830506	307110983	/nfs/dbraw/zinc/11/09/83/307110983.db2.gz	QWFYZDPRXKXGQD-ZDUSSCGKSA-N	1	1	320.393	1.410	20	5		DDBDMO
CNC(=O)C[N@@H+]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830506	307110984	/nfs/dbraw/zinc/11/09/84/307110984.db2.gz	QWFYZDPRXKXGQD-ZDUSSCGKSA-N	1	1	320.393	1.410	20	5		DDBDMO
CNC(=O)C[N@H+]1CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000368830506	307110985	/nfs/dbraw/zinc/11/09/85/307110985.db2.gz	QWFYZDPRXKXGQD-ZDUSSCGKSA-N	1	1	320.393	1.410	20	5		DDBDMO
CSC[C@H](O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372294465	307167702	/nfs/dbraw/zinc/16/77/02/307167702.db2.gz	JNMAYJPFDUZMTI-CMPLNLGQSA-N	1	1	300.384	1.152	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(c2cnc[nH]2)CC1	ZINC000372750395	307174628	/nfs/dbraw/zinc/17/46/28/307174628.db2.gz	ZFFRHVARIUESQH-UHFFFAOYSA-N	1	1	315.333	1.920	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC12CCC2	ZINC000373175649	307181075	/nfs/dbraw/zinc/18/10/75/307181075.db2.gz	ANLBMMHJLVXJDV-NSHDSACASA-N	1	1	308.338	1.066	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000375202160	307218539	/nfs/dbraw/zinc/21/85/39/307218539.db2.gz	PIFTZCLCIREEPA-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC3(CCC[N@@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000375202160	307218540	/nfs/dbraw/zinc/21/85/40/307218540.db2.gz	PIFTZCLCIREEPA-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC3(CCC[N@H+]3C)CC2)c1[N+](=O)[O-]	ZINC000375202160	307218541	/nfs/dbraw/zinc/21/85/41/307218541.db2.gz	PIFTZCLCIREEPA-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
C[N@@H+](CCCCCO)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000434682859	307304284	/nfs/dbraw/zinc/30/42/84/307304284.db2.gz	BGKVUGTYPHSPOR-OAHLLOKOSA-N	1	1	321.377	1.795	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+]C[C@H]1c1ccncc1	ZINC000576977166	308353736	/nfs/dbraw/zinc/35/37/36/308353736.db2.gz	HLWJITCVPDHQRI-NSHDSACASA-N	1	1	302.290	1.370	20	5		DDBDMO
CO[C@@H]1COC[C@H]1[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000579954052	308569293	/nfs/dbraw/zinc/56/92/93/308569293.db2.gz	ZNFCFRXEXCGENW-ZKYQVNSYSA-N	1	1	323.349	1.234	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](n3cncn3)C2)c1	ZINC000372370477	483932222	/nfs/dbraw/zinc/93/22/22/483932222.db2.gz	UBSAKUIZRVSRHK-KGLIPLIRSA-N	1	1	303.322	1.167	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@H+]2CCCO)c1	ZINC000452363779	534318082	/nfs/dbraw/zinc/31/80/82/534318082.db2.gz	MDNSZGZSKIRVDO-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000155591536	696950334	/nfs/dbraw/zinc/95/03/34/696950334.db2.gz	DIFXFPSRAUGFEX-UWVGGRQHSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1COCCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000772819343	697681573	/nfs/dbraw/zinc/68/15/73/697681573.db2.gz	AUOGYKOXRBFAIE-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1COCCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000772819343	697681575	/nfs/dbraw/zinc/68/15/75/697681575.db2.gz	AUOGYKOXRBFAIE-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
COCC1=CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1	ZINC000774643300	697906355	/nfs/dbraw/zinc/90/63/55/697906355.db2.gz	GNUIFSNEOPOHFN-UHFFFAOYSA-N	1	1	317.349	1.884	20	5		DDBDMO
COCC1=CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1	ZINC000774643300	697906356	/nfs/dbraw/zinc/90/63/56/697906356.db2.gz	GNUIFSNEOPOHFN-UHFFFAOYSA-N	1	1	317.349	1.884	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1(C(N)=O)CCCC1	ZINC000776593886	698124244	/nfs/dbraw/zinc/12/42/44/698124244.db2.gz	PCJQCKGWYJGRCC-CYBMUJFWSA-N	1	1	307.350	1.358	20	5		DDBDMO
COc1ccc(CN2CC[C@H](N3CC[NH2+]CC3)C2)cc1[N+](=O)[O-]	ZINC000261938689	698445800	/nfs/dbraw/zinc/44/58/00/698445800.db2.gz	UJVQDNALNCESBM-AWEZNQCLSA-N	1	1	320.393	1.083	20	5		DDBDMO
CN(C)c1cc[nH+]c(N2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000784521700	698944516	/nfs/dbraw/zinc/94/45/16/698944516.db2.gz	GVDPMXPOBUBOKZ-UHFFFAOYSA-N	1	1	317.353	1.489	20	5		DDBDMO
CCOCC[NH+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1	ZINC000729920867	699492017	/nfs/dbraw/zinc/49/20/17/699492017.db2.gz	PFKQRHSYEJOVJJ-UHFFFAOYSA-N	1	1	319.365	1.401	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000733171658	699582096	/nfs/dbraw/zinc/58/20/96/699582096.db2.gz	STNFYIIXJMOFRQ-UHFFFAOYSA-N	1	1	308.382	1.731	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)OCCC[NH+]1CCOCC1	ZINC000735891707	699708907	/nfs/dbraw/zinc/70/89/07/699708907.db2.gz	CIDOXQLJHNJIRE-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
C[C@H]1CN(C(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])CCO1	ZINC000795222964	699852637	/nfs/dbraw/zinc/85/26/37/699852637.db2.gz	VAAAOFRIKZWVGK-LBPRGKRZSA-N	1	1	321.377	1.667	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@@H]1C	ZINC000801930505	700356477	/nfs/dbraw/zinc/35/64/77/700356477.db2.gz	CFXQASFROQVIGS-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@@H]1C	ZINC000801930505	700356479	/nfs/dbraw/zinc/35/64/79/700356479.db2.gz	CFXQASFROQVIGS-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758286000	700696541	/nfs/dbraw/zinc/69/65/41/700696541.db2.gz	RBFCQABBVYGADP-QWRGUYRKSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](C)[C@@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758286000	700696542	/nfs/dbraw/zinc/69/65/42/700696542.db2.gz	RBFCQABBVYGADP-QWRGUYRKSA-N	1	1	309.341	2.000	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1	ZINC000769636144	701250899	/nfs/dbraw/zinc/25/08/99/701250899.db2.gz	WYLPKMRAJDQSJQ-OUKQBFOZSA-N	1	1	321.377	1.429	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)c1	ZINC000839662243	701769755	/nfs/dbraw/zinc/76/97/55/701769755.db2.gz	BKJLBXHVRVZDOR-LQKXBSAESA-N	1	1	306.362	1.721	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000866112528	706621892	/nfs/dbraw/zinc/62/18/92/706621892.db2.gz	DYPGYHLAIXDIOF-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000812336268	702160305	/nfs/dbraw/zinc/16/03/05/702160305.db2.gz	VZUJMCYKGBJLNI-NEPJUHHUSA-N	1	1	318.377	1.509	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3cc(F)c([N+](=O)[O-])cc3CO)CC[C@H]21	ZINC000866209020	706649223	/nfs/dbraw/zinc/64/92/23/706649223.db2.gz	NEVSYRSBRFUYLY-GXFFZTMASA-N	1	1	309.341	1.757	20	5		DDBDMO
CO[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000879322298	706649687	/nfs/dbraw/zinc/64/96/87/706649687.db2.gz	JGCPUVOPSIPDPY-MFKMUULPSA-N	1	1	307.350	1.693	20	5		DDBDMO
CNC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000879334832	706653362	/nfs/dbraw/zinc/65/33/62/706653362.db2.gz	NQCVVOARICHBPF-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
CSCC[C@H]([NH3+])c1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1	ZINC000843222051	702844885	/nfs/dbraw/zinc/84/48/85/702844885.db2.gz	OTRWWLLFMGCKNU-ZETCQYMHSA-N	1	1	312.355	1.440	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000879574459	706723558	/nfs/dbraw/zinc/72/35/58/706723558.db2.gz	AAQVEZOWIHEPMO-KGLIPLIRSA-N	1	1	318.377	1.220	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H](Cn3ccnn3)C2)c1	ZINC000852314407	704008160	/nfs/dbraw/zinc/00/81/60/704008160.db2.gz	SKLMQWZKHGTNQG-IUODEOHRSA-N	1	1	317.349	1.242	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@](O)(C3CC3)C2)cc1	ZINC000852500767	704064118	/nfs/dbraw/zinc/06/41/18/704064118.db2.gz	DKDYKZIVGDFEFH-JKSUJKDBSA-N	1	1	306.362	1.865	20	5		DDBDMO
CCC[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870911414	704165341	/nfs/dbraw/zinc/16/53/41/704165341.db2.gz	WDHOJYJLLRSPSC-GDBMZVCRSA-N	1	1	321.377	1.796	20	5		DDBDMO
CN(C[C@@H]1CCCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870922635	704170045	/nfs/dbraw/zinc/17/00/45/704170045.db2.gz	KQJWVWKAPSWVJP-LRDDRELGSA-N	1	1	321.377	1.654	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000871151916	704231158	/nfs/dbraw/zinc/23/11/58/704231158.db2.gz	GCSJLHXMTYFZHA-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cc1	ZINC000871188496	704240679	/nfs/dbraw/zinc/24/06/79/704240679.db2.gz	QAKIADHBLYIWOI-RBSFLKMASA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC000871188496	704240681	/nfs/dbraw/zinc/24/06/81/704240681.db2.gz	QAKIADHBLYIWOI-RBSFLKMASA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC000871188496	704240683	/nfs/dbraw/zinc/24/06/83/704240683.db2.gz	QAKIADHBLYIWOI-RBSFLKMASA-N	1	1	303.362	1.351	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000880304419	706934815	/nfs/dbraw/zinc/93/48/15/706934815.db2.gz	ZBYNYGHSROJGAJ-SNVBAGLBSA-N	1	1	308.260	1.445	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000880304419	706934819	/nfs/dbraw/zinc/93/48/19/706934819.db2.gz	ZBYNYGHSROJGAJ-SNVBAGLBSA-N	1	1	308.260	1.445	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000821782349	704805666	/nfs/dbraw/zinc/80/56/66/704805666.db2.gz	XIOQGUOYTKPXFP-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@H+](CCO)[C@H](C)C1	ZINC000822155883	704886496	/nfs/dbraw/zinc/88/64/96/704886496.db2.gz	QTZTVJUIXNXBFT-GFCCVEGCSA-N	1	1	321.377	1.350	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000822155883	704886500	/nfs/dbraw/zinc/88/65/00/704886500.db2.gz	QTZTVJUIXNXBFT-GFCCVEGCSA-N	1	1	321.377	1.350	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842039	705196629	/nfs/dbraw/zinc/19/66/29/705196629.db2.gz	ZNFYMKGSWSYDER-QWRGUYRKSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874842039	705196633	/nfs/dbraw/zinc/19/66/33/705196633.db2.gz	ZNFYMKGSWSYDER-QWRGUYRKSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842039	705196636	/nfs/dbraw/zinc/19/66/36/705196636.db2.gz	ZNFYMKGSWSYDER-QWRGUYRKSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCCN(C(=O)Cn1c(C)ncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000823500095	705256185	/nfs/dbraw/zinc/25/61/85/705256185.db2.gz	UPURNWSOZZZJIO-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828338623	706163022	/nfs/dbraw/zinc/16/30/22/706163022.db2.gz	PQGFHSAWHXGOOQ-GYSYKLTISA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000828338623	706163024	/nfs/dbraw/zinc/16/30/24/706163024.db2.gz	PQGFHSAWHXGOOQ-GYSYKLTISA-N	1	1	307.350	1.179	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@@H]2CCCC[N@@H+]2CCO)nc2ccccn21	ZINC000828461294	706184322	/nfs/dbraw/zinc/18/43/22/706184322.db2.gz	RINPJDQMMKUOJL-LBPRGKRZSA-N	1	1	319.365	1.501	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H](O)[C@@H](O)C3)o2)c1	ZINC000877748401	706198041	/nfs/dbraw/zinc/19/80/41/706198041.db2.gz	AOXVMOKFOTUQQR-CABCVRRESA-N	1	1	318.329	1.782	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@@H]21	ZINC000836849705	707529316	/nfs/dbraw/zinc/52/93/16/707529316.db2.gz	PUPXUGUFNURNTL-OQPBUACISA-N	1	1	308.313	1.092	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000882483475	707654165	/nfs/dbraw/zinc/65/41/65/707654165.db2.gz	BGYXGWGPFYHXRA-CYBMUJFWSA-N	1	1	317.349	1.155	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000882486540	707656927	/nfs/dbraw/zinc/65/69/27/707656927.db2.gz	STUVILOQGNMRCT-GFCCVEGCSA-N	1	1	309.370	1.009	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1	ZINC000882491637	707662134	/nfs/dbraw/zinc/66/21/34/707662134.db2.gz	KDIDIKQXPHSANY-GFCCVEGCSA-N	1	1	307.350	1.736	20	5		DDBDMO
CN1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000897854963	708470692	/nfs/dbraw/zinc/47/06/92/708470692.db2.gz	QGYPUWYMLCGSMU-ALCCZGGFSA-N	1	1	318.421	1.787	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886012518	708681612	/nfs/dbraw/zinc/68/16/12/708681612.db2.gz	JMDFKUVQZZPPQY-UHFFFAOYSA-N	1	1	308.382	1.268	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCOC2(CCOCC2)CC1	ZINC000886138435	708703487	/nfs/dbraw/zinc/70/34/87/708703487.db2.gz	KJASAPGXXSKTGI-UHFFFAOYSA-N	1	1	307.350	1.761	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCOC2(CCOCC2)CC1	ZINC000886138435	708703488	/nfs/dbraw/zinc/70/34/88/708703488.db2.gz	KJASAPGXXSKTGI-UHFFFAOYSA-N	1	1	307.350	1.761	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202722	708714057	/nfs/dbraw/zinc/71/40/57/708714057.db2.gz	CKGMAGXJXYAMCP-GXTWGEPZSA-N	1	1	306.366	1.285	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886202722	708714059	/nfs/dbraw/zinc/71/40/59/708714059.db2.gz	CKGMAGXJXYAMCP-GXTWGEPZSA-N	1	1	306.366	1.285	20	5		DDBDMO
C[C@H](CNC(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000887399068	709036627	/nfs/dbraw/zinc/03/66/27/709036627.db2.gz	MBGMKGZHPLNGQO-HSMVNMDESA-N	1	1	321.377	1.270	20	5		DDBDMO
Cc1cc(C(=O)N2CCN(C)CC[N@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000888999185	709428797	/nfs/dbraw/zinc/42/87/97/709428797.db2.gz	YFQWPEIDIIJGBF-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC)C[C@H]2C)n1	ZINC000910279789	709862078	/nfs/dbraw/zinc/86/20/78/709862078.db2.gz	NCCTXQRPUDQRJA-LLVKDONJSA-N	1	1	309.370	1.368	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928435442	713194930	/nfs/dbraw/zinc/19/49/30/713194930.db2.gz	GOTSLOXNZUWBCY-SKDRFNHKSA-N	1	1	313.304	1.895	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000928455744	713204545	/nfs/dbraw/zinc/20/45/45/713204545.db2.gz	UMMYINBGMWZOOQ-GXFFZTMASA-N	1	1	306.366	1.483	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000928459990	713206330	/nfs/dbraw/zinc/20/63/30/713206330.db2.gz	YYGSZSDOSAXUHI-GWCFXTLKSA-N	1	1	317.349	1.153	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)C1	ZINC000911473113	710813008	/nfs/dbraw/zinc/81/30/08/710813008.db2.gz	QVOAZVFUMXUAGK-VIFPVBQESA-N	1	1	313.304	1.831	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccncc1)c1c([N+](=O)[O-])cnn1C	ZINC000894372897	711092208	/nfs/dbraw/zinc/09/22/08/711092208.db2.gz	UJXGSAPLUKVLRP-UHFFFAOYSA-N	1	1	318.381	1.682	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000928569199	713232563	/nfs/dbraw/zinc/23/25/63/713232563.db2.gz	LDWGGRIDMRZSHD-ZDUSSCGKSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000928569199	713232566	/nfs/dbraw/zinc/23/25/66/713232566.db2.gz	LDWGGRIDMRZSHD-ZDUSSCGKSA-N	1	1	315.333	1.214	20	5		DDBDMO
COC(=O)Cc1ccc(NCCn2cc[nH+]c2C)c([N+](=O)[O-])c1	ZINC000895114813	711419588	/nfs/dbraw/zinc/41/95/88/711419588.db2.gz	JEYSWNBZUGMRKT-UHFFFAOYSA-N	1	1	318.333	1.927	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CCC([C@H](C)O)CC2)c1[N+](=O)[O-]	ZINC000895815921	711615144	/nfs/dbraw/zinc/61/51/44/711615144.db2.gz	ORPXYRIYQXHMNJ-JTQLQIEISA-N	1	1	310.350	1.902	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[N@H+]3CCCC[C@H]3C2)nc2ccccn21	ZINC000917059423	713480280	/nfs/dbraw/zinc/48/02/80/713480280.db2.gz	YPFZBMCDQSEMDJ-LBPRGKRZSA-N	1	1	301.350	1.917	20	5		DDBDMO
COc1cc(NC2CC[NH+](CC[N+](=O)[O-])CC2)cc(OC)c1	ZINC000930016833	713736570	/nfs/dbraw/zinc/73/65/70/713736570.db2.gz	FHQXTGBRPKDKHT-UHFFFAOYSA-N	1	1	309.366	1.857	20	5		DDBDMO
CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC[NH2+]CC1	ZINC000923279033	714295132	/nfs/dbraw/zinc/29/51/32/714295132.db2.gz	BBQNXTZYOGPBII-ZDUSSCGKSA-N	1	1	309.366	1.018	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000923316461	714309702	/nfs/dbraw/zinc/30/97/02/714309702.db2.gz	UYPYRRLXQDCSDC-NWDGAFQWSA-N	1	1	304.350	1.486	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000932648672	714376304	/nfs/dbraw/zinc/37/63/04/714376304.db2.gz	ZOGASRYZLCEIQH-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
Cn1cc(CN2CCC([C@H]3CCC[NH2+]CC3)CC2)c([N+](=O)[O-])n1	ZINC000923505350	714382889	/nfs/dbraw/zinc/38/28/89/714382889.db2.gz	BTGCDINGNONGSD-ZDUSSCGKSA-N	1	1	321.425	1.930	20	5		DDBDMO
Cc1ccc(CNC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000923910128	714488173	/nfs/dbraw/zinc/48/81/73/714488173.db2.gz	JLDIKBRDZCQZHY-YPMHNXCESA-N	1	1	306.366	1.795	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@H]1C[C@H]1CCOC1	ZINC000933675769	714645970	/nfs/dbraw/zinc/64/59/70/714645970.db2.gz	OFIKESHARHOTQV-ZIAGYGMSSA-N	1	1	324.381	1.227	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@H]1C[C@H]1CCOC1	ZINC000933675769	714645971	/nfs/dbraw/zinc/64/59/71/714645971.db2.gz	OFIKESHARHOTQV-ZIAGYGMSSA-N	1	1	324.381	1.227	20	5		DDBDMO
C/C(=C\C(=O)NC[C@@H]1C[C@H](O)C[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000924982051	714714903	/nfs/dbraw/zinc/71/49/03/714714903.db2.gz	OPLBNAWKSQZRGY-LBXBEFBNSA-N	1	1	319.361	1.179	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000925422596	714851594	/nfs/dbraw/zinc/85/15/94/714851594.db2.gz	ZZWOADTWQXPCAH-GFCCVEGCSA-N	1	1	320.349	1.072	20	5		DDBDMO
CC(C)CC[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589338	718844491	/nfs/dbraw/zinc/84/44/91/718844491.db2.gz	SZHXDZOQWRKZKD-QKPAOTATSA-N	1	1	323.437	1.868	20	5		DDBDMO
CC(C)CC[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589338	718844494	/nfs/dbraw/zinc/84/44/94/718844494.db2.gz	SZHXDZOQWRKZKD-QKPAOTATSA-N	1	1	323.437	1.868	20	5		DDBDMO
CC(C)CC[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589338	718844499	/nfs/dbraw/zinc/84/44/99/718844499.db2.gz	SZHXDZOQWRKZKD-QKPAOTATSA-N	1	1	323.437	1.868	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4c(cccc4[N+](=O)[O-])n3)C[C@H]21	ZINC001164666133	719391345	/nfs/dbraw/zinc/39/13/45/719391345.db2.gz	JJVUPWXEAOJVJT-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
COC(=O)c1ccnc(N2CCc3[nH+]ccn3CC2)c1[N+](=O)[O-]	ZINC001167182214	732809676	/nfs/dbraw/zinc/80/96/76/732809676.db2.gz	JIVSFCKNAKUXPP-UHFFFAOYSA-N	1	1	317.305	1.036	20	5		DDBDMO
O=C(CC1CC1)N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC001025649151	736808674	/nfs/dbraw/zinc/80/86/74/736808674.db2.gz	DSTLKAPDTXOJHS-HALDLXJZSA-N	1	1	315.373	1.941	20	5		DDBDMO
O=C(CC1CC1)N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC001025649168	736808748	/nfs/dbraw/zinc/80/87/48/736808748.db2.gz	QNGQZUQAHYYCMK-QLPKVWCKSA-N	1	1	315.373	1.941	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](c2nn[nH]n2)C1	ZINC001197295840	747123538	/nfs/dbraw/zinc/12/35/38/747123538.db2.gz	INRIEEHDIKZKRZ-SNVBAGLBSA-N	1	1	304.310	1.106	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](c2nn[nH]n2)C1	ZINC001197295840	747123544	/nfs/dbraw/zinc/12/35/44/747123544.db2.gz	INRIEEHDIKZKRZ-SNVBAGLBSA-N	1	1	304.310	1.106	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](CO)[C@H](CCO)C2)ccc1[N+](=O)[O-]	ZINC001198755068	747599863	/nfs/dbraw/zinc/59/98/63/747599863.db2.gz	XGCAVCLQPDNHCO-KGLIPLIRSA-N	1	1	324.377	1.416	20	5		DDBDMO
CN1C[C@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)CC1=O	ZINC001168725893	747981229	/nfs/dbraw/zinc/98/12/29/747981229.db2.gz	HYSBRLIOMMWUQV-NSHDSACASA-N	1	1	318.377	1.473	20	5		DDBDMO
CN1C[C@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)CC1=O	ZINC001168725893	747981232	/nfs/dbraw/zinc/98/12/32/747981232.db2.gz	HYSBRLIOMMWUQV-NSHDSACASA-N	1	1	318.377	1.473	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)CS(C)(=O)=O	ZINC001200471545	748265598	/nfs/dbraw/zinc/26/55/98/748265598.db2.gz	NQNYFYZHBNHWBQ-JTQLQIEISA-N	1	1	316.379	1.516	20	5		DDBDMO
CCOC[C@H]1Cn2nccc2C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169025780	762203123	/nfs/dbraw/zinc/20/31/23/762203123.db2.gz	UWQQZUWGWUMIDE-KFWWJZLASA-N	1	1	322.409	1.797	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCC[C@H](Oc3ncccn3)C2)C1	ZINC001169053136	762207762	/nfs/dbraw/zinc/20/77/62/762207762.db2.gz	HQHGIWFPRMVVCW-RDBSUJKOSA-N	1	1	306.366	1.765	20	5		DDBDMO
COc1cc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)ccn1	ZINC001169056368	762211345	/nfs/dbraw/zinc/21/13/45/762211345.db2.gz	SLESEXBMHIKDRB-VNHYZAJKSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1)C1CCC1	ZINC001169057440	762211363	/nfs/dbraw/zinc/21/13/63/762211363.db2.gz	VIOXNHDUPCBKPX-NWANDNLSSA-N	1	1	309.410	1.813	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1CO	ZINC000828725190	759755591	/nfs/dbraw/zinc/75/55/91/759755591.db2.gz	RHRHIORXCJIEBH-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1CO	ZINC000828725190	759755597	/nfs/dbraw/zinc/75/55/97/759755597.db2.gz	RHRHIORXCJIEBH-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CC2CC(F)(F)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086084300	760944584	/nfs/dbraw/zinc/94/45/84/760944584.db2.gz	LMJRTKWALNSUDE-SASUGWTJSA-N	1	1	317.336	1.181	20	5		DDBDMO
C[NH+](C)C1(C(=O)NCCNCc2ccccc2[N+](=O)[O-])CCC1	ZINC001129357532	762869529	/nfs/dbraw/zinc/86/95/29/762869529.db2.gz	NTFBWHWTMPKBRH-UHFFFAOYSA-N	1	1	320.393	1.285	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC001170354407	766260651	/nfs/dbraw/zinc/26/06/51/766260651.db2.gz	KUXFFEQXLMAXRJ-FZMZJTMJSA-N	1	1	321.377	1.745	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ncc(F)c(C)c2[N+](=O)[O-])CC[NH2+]C1	ZINC001170514053	767726821	/nfs/dbraw/zinc/72/68/21/767726821.db2.gz	OMHGFEGNGLRFPY-UHFFFAOYSA-N	1	1	324.312	1.660	20	5		DDBDMO
O=C(NC[C@H]1CC[C@H](C[NH2+]CC2CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048607888	769578027	/nfs/dbraw/zinc/57/80/27/769578027.db2.gz	QIVNPSCHVCEHFK-KBUPBQIOSA-N	1	1	309.410	1.574	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001136325777	771938064	/nfs/dbraw/zinc/93/80/64/771938064.db2.gz	IPUSOESMQJDWTD-SNVBAGLBSA-N	1	1	317.349	1.748	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001093771115	775068208	/nfs/dbraw/zinc/06/82/08/775068208.db2.gz	YFCNPVVLGYAUQB-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CCNC(=O)C[N@H+](C)C(C)C	ZINC001100149708	775734879	/nfs/dbraw/zinc/73/48/79/775734879.db2.gz	MLHKSZBSQOKABT-UHFFFAOYSA-N	1	1	323.397	1.191	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CC1	ZINC001110158318	775974096	/nfs/dbraw/zinc/97/40/96/775974096.db2.gz	GLDTYQRYBPMKMN-UHFFFAOYSA-N	1	1	321.381	1.391	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCO[C@@H](CO)C1)CC2	ZINC001172902803	776915857	/nfs/dbraw/zinc/91/58/57/776915857.db2.gz	CRIBLMPUUYPQDC-GDBMZVCRSA-N	1	1	306.362	1.535	20	5		DDBDMO
C[C@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907534	776918179	/nfs/dbraw/zinc/91/81/79/776918179.db2.gz	GXQVGZYIALVFLJ-SMDDNHRTSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907534	776918188	/nfs/dbraw/zinc/91/81/88/776918188.db2.gz	GXQVGZYIALVFLJ-SMDDNHRTSA-N	1	1	303.362	1.663	20	5		DDBDMO
NC(=O)[C@@H]1C[C@H](F)C[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172912886	776942863	/nfs/dbraw/zinc/94/28/63/776942863.db2.gz	CGPXEKBKCLDTLO-YDHLFZDLSA-N	1	1	321.352	1.740	20	5		DDBDMO
NC(=O)[C@@H]1C[C@H](F)C[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172912886	776942868	/nfs/dbraw/zinc/94/28/68/776942868.db2.gz	CGPXEKBKCLDTLO-YDHLFZDLSA-N	1	1	321.352	1.740	20	5		DDBDMO
Cc1nnc2n1CC[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2	ZINC001173228840	777062345	/nfs/dbraw/zinc/06/23/45/777062345.db2.gz	ZFGPHOOZPIHMCV-NSHDSACASA-N	1	1	301.350	1.942	20	5		DDBDMO
Cc1nnc2n1CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2	ZINC001173228840	777062347	/nfs/dbraw/zinc/06/23/47/777062347.db2.gz	ZFGPHOOZPIHMCV-NSHDSACASA-N	1	1	301.350	1.942	20	5		DDBDMO
Cc1n[nH]cc1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC001175183105	777712972	/nfs/dbraw/zinc/71/29/72/777712972.db2.gz	GMDPDELLTYBGCN-ZDUSSCGKSA-N	1	1	320.349	1.498	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC001176734414	778223242	/nfs/dbraw/zinc/22/32/42/778223242.db2.gz	ASMOFBVHFAMETB-UHFFFAOYSA-N	1	1	306.322	1.694	20	5		DDBDMO
O=C(NCCCCCC[NH2+]Cc1ccon1)[C@@H]1CC1[N+](=O)[O-]	ZINC001178458672	779059105	/nfs/dbraw/zinc/05/91/05/779059105.db2.gz	RNDLHUQSZXCLCH-CHWSQXEVSA-N	1	1	310.354	1.106	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2cn(-c3cccc([N+](=O)[O-])c3)nn2)o1	ZINC001117229110	780692259	/nfs/dbraw/zinc/69/22/59/780692259.db2.gz	NUDQPGMZCNXWQT-UHFFFAOYSA-N	1	1	315.293	1.287	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCN(C)c1ccccc1[N+](=O)[O-]	ZINC001105441838	844397991	/nfs/dbraw/zinc/39/79/91/844397991.db2.gz	NGPCBFRMAVKDNE-UHFFFAOYSA-N	1	1	322.409	1.831	20	5		DDBDMO
CC(C)[C@H]1CN(c2nnc(C[N+](=O)[O-])n2CC2CC2)CC[N@H+]1C	ZINC001123413224	859224602	/nfs/dbraw/zinc/22/46/02/859224602.db2.gz	NTMKQRSWKGHYHV-CYBMUJFWSA-N	1	1	322.413	1.241	20	5		DDBDMO
C[C@@H](c1nnc(N2CC[N@@H+](C)C(C)(C)C2)n1CC1CC1)[N+](=O)[O-]	ZINC001123415782	859225971	/nfs/dbraw/zinc/22/59/71/859225971.db2.gz	UTWPJLCXBMSDOV-NSHDSACASA-N	1	1	322.413	1.556	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H]2C[N@@H+]3CCN2C[C@@H]3C)cc1[N+](=O)[O-]	ZINC001123474144	859251175	/nfs/dbraw/zinc/25/11/75/859251175.db2.gz	YRWUPTCNQVKGHP-FZMZJTMJSA-N	1	1	304.350	1.230	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1C[N@@H+]2CCN1C[C@H]2C	ZINC001123879897	859452746	/nfs/dbraw/zinc/45/27/46/859452746.db2.gz	JVSVCNQCEQGZSZ-RISCZKNCSA-N	1	1	318.377	1.538	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCC(=O)OCc2ccc([N+](=O)[O-])cc2)C1	ZINC001224986731	881624605	/nfs/dbraw/zinc/62/46/05/881624605.db2.gz	JTOYNSIIANSEKB-AWEZNQCLSA-N	1	1	308.334	1.749	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)C1	ZINC001156580092	863162973	/nfs/dbraw/zinc/16/29/73/863162973.db2.gz	DEXJNVGVDFIKSJ-ZETCQYMHSA-N	1	1	306.700	1.986	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1ncc([N+](=O)[O-])c(C)c1C	ZINC001159452177	865307478	/nfs/dbraw/zinc/30/74/78/865307478.db2.gz	DRZWSLKECOLNBR-UHFFFAOYSA-N	1	1	320.349	1.829	20	5		DDBDMO
Nc1cc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160724732	866072940	/nfs/dbraw/zinc/07/29/40/866072940.db2.gz	MPNNEKLYBHRDQP-RYUDHWBXSA-N	1	1	307.354	1.237	20	5		DDBDMO
O=c1cc[nH]c(O[C@H]2CC[C@@H]([NH+]3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC001225664279	881966405	/nfs/dbraw/zinc/96/64/05/881966405.db2.gz	MDGZHQSJZFTQLE-TXEJJXNPSA-N	1	1	323.349	1.718	20	5		DDBDMO
CN(C(=O)C[N@@H+]1C2CCC1(CO)CC2)c1ccc([N+](=O)[O-])cc1	ZINC001333276503	866581197	/nfs/dbraw/zinc/58/11/97/866581197.db2.gz	MXEQYEVVPOINRR-UHFFFAOYSA-N	1	1	319.361	1.547	20	5		DDBDMO
CN(C(=O)C[N@H+]1C2CCC1(CO)CC2)c1ccc([N+](=O)[O-])cc1	ZINC001333276503	866581206	/nfs/dbraw/zinc/58/12/06/866581206.db2.gz	MXEQYEVVPOINRR-UHFFFAOYSA-N	1	1	319.361	1.547	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCOCC1	ZINC001320564457	866835579	/nfs/dbraw/zinc/83/55/79/866835579.db2.gz	ZPTZOKVVANJNEB-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCOCC1	ZINC001320564457	866835590	/nfs/dbraw/zinc/83/55/90/866835590.db2.gz	ZPTZOKVVANJNEB-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
CN1CC[NH+](CCCNc2c(Cl)nccc2[N+](=O)[O-])CC1	ZINC001161703668	866909736	/nfs/dbraw/zinc/90/97/36/866909736.db2.gz	KMTTYSHEYSJXBP-UHFFFAOYSA-N	1	1	313.789	1.693	20	5		DDBDMO
COc1c(O)ccc(CN2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC001335542095	868373261	/nfs/dbraw/zinc/37/32/61/868373261.db2.gz	CVVUBXSWVMZELW-MRXNPFEDSA-N	1	1	321.377	1.837	20	5		DDBDMO
COc1c(O)ccc(CN2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC001335542094	868373684	/nfs/dbraw/zinc/37/36/84/868373684.db2.gz	CVVUBXSWVMZELW-INIZCTEOSA-N	1	1	321.377	1.837	20	5		DDBDMO
C[C@H](C[NH+](C)C)Oc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC001226061418	882184329	/nfs/dbraw/zinc/18/43/29/882184329.db2.gz	IRQAEESHARCGLX-SECBINFHSA-N	1	1	302.352	1.327	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2C[C@H](CO)C[C@H](F)C2)ncc1[N+](=O)[O-]	ZINC001164050493	868913475	/nfs/dbraw/zinc/91/34/75/868913475.db2.gz	NQMPFZPBEYOJJB-WTQORWENSA-N	1	1	324.356	1.679	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001164055810	868916852	/nfs/dbraw/zinc/91/68/52/868916852.db2.gz	FOJQLLLAXDRWKX-YJLKIPLNSA-N	1	1	306.366	1.729	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC001337836246	869651260	/nfs/dbraw/zinc/65/12/60/869651260.db2.gz	OTYUDNUGSJGCBD-GLQYFDAESA-N	1	1	319.361	1.430	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)CCCOC	ZINC001339446889	870501882	/nfs/dbraw/zinc/50/18/82/870501882.db2.gz	FQUMHWIMSSKPLR-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N1CC[N@H+](C2CCC2)C[C@@H](C)C1	ZINC001340112924	870897010	/nfs/dbraw/zinc/89/70/10/870897010.db2.gz	IJJKCDFFKUBWGX-GFCCVEGCSA-N	1	1	322.413	1.385	20	5		DDBDMO
COCCCC[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001318953867	872366562	/nfs/dbraw/zinc/36/65/62/872366562.db2.gz	WCRJCDNDLZOQKA-AAVRWANBSA-N	1	1	313.398	1.095	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC001206552368	872434734	/nfs/dbraw/zinc/43/47/34/872434734.db2.gz	JDPDCIJGROCWFT-GHMZBOCLSA-N	1	1	307.306	1.318	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC001206552368	872434745	/nfs/dbraw/zinc/43/47/45/872434745.db2.gz	JDPDCIJGROCWFT-GHMZBOCLSA-N	1	1	307.306	1.318	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCCO[C@H](C)C1	ZINC001343018562	872469591	/nfs/dbraw/zinc/46/95/91/872469591.db2.gz	ABXKYYLTUQNBLD-GFCCVEGCSA-N	1	1	324.381	1.911	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2[nH]c(=O)nc3ccc([N+](=O)[O-])cc32)C1	ZINC001227094963	882828542	/nfs/dbraw/zinc/82/85/42/882828542.db2.gz	GQSNKWOYKRIGEO-JTQLQIEISA-N	1	1	304.306	1.717	20	5		DDBDMO
C[N@@H+]1CCO[C@H](COCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC001222928749	880748249	/nfs/dbraw/zinc/74/82/49/880748249.db2.gz	JCDFARUKGZTEOD-NSHDSACASA-N	1	1	307.306	1.583	20	5		DDBDMO
C[N@H+]1CCO[C@H](COCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC001222928749	880748260	/nfs/dbraw/zinc/74/82/60/880748260.db2.gz	JCDFARUKGZTEOD-NSHDSACASA-N	1	1	307.306	1.583	20	5		DDBDMO
Cc1nc(O[C@H]2[C@@H]3CCC[C@H]2C[N@@H+](C)C3)c([N+](=O)[O-])c(=O)[nH]1	ZINC001229378386	883952351	/nfs/dbraw/zinc/95/23/51/883952351.db2.gz	LGPROPQCHRJJTK-IAZYJMLFSA-N	1	1	308.338	1.508	20	5		DDBDMO
Cc1nc(O[C@H]2[C@@H]3CCC[C@H]2C[N@H+](C)C3)c([N+](=O)[O-])c(=O)[nH]1	ZINC001229378386	883952355	/nfs/dbraw/zinc/95/23/55/883952355.db2.gz	LGPROPQCHRJJTK-IAZYJMLFSA-N	1	1	308.338	1.508	20	5		DDBDMO
CC(C)(C(=O)N1CCC[N@H+]2CCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC001251498074	894714872	/nfs/dbraw/zinc/71/48/72/894714872.db2.gz	GTJMBIYMTZQVNL-LBPRGKRZSA-N	1	1	321.381	1.223	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC001254011235	896210474	/nfs/dbraw/zinc/21/04/74/896210474.db2.gz	YFWBWYUKJWHYND-MRXNPFEDSA-N	1	1	322.361	1.960	20	5		DDBDMO
C[C@@]1(CO)CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC001254011235	896210486	/nfs/dbraw/zinc/21/04/86/896210486.db2.gz	YFWBWYUKJWHYND-MRXNPFEDSA-N	1	1	322.361	1.960	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC001254011234	896210962	/nfs/dbraw/zinc/21/09/62/896210962.db2.gz	YFWBWYUKJWHYND-INIZCTEOSA-N	1	1	322.361	1.960	20	5		DDBDMO
C[C@]1(CO)CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC001254011234	896210973	/nfs/dbraw/zinc/21/09/73/896210973.db2.gz	YFWBWYUKJWHYND-INIZCTEOSA-N	1	1	322.361	1.960	20	5		DDBDMO
C[C@@]1(CO)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001254545139	896496429	/nfs/dbraw/zinc/49/64/29/896496429.db2.gz	JEBJSZLTNZEBCX-CZUORRHYSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](O)[C@@](C)(CO)C1	ZINC001254553822	896499482	/nfs/dbraw/zinc/49/94/82/896499482.db2.gz	ZQALIKTUIKTVQP-UHOFOFEASA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@]1(CO)C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[C@@H]1O	ZINC001254593354	896521733	/nfs/dbraw/zinc/52/17/33/896521733.db2.gz	LILUJHRMWPUFED-OWCLPIDISA-N	1	1	306.362	1.127	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@H](N3CCOCC3)C1)C2	ZINC001254601426	896524555	/nfs/dbraw/zinc/52/45/55/896524555.db2.gz	ZSBKLWOGNIYUIX-IRXDYDNUSA-N	1	1	317.389	1.469	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C)[C@H]1CO	ZINC000305706024	231022886	/nfs/dbraw/zinc/02/28/86/231022886.db2.gz	CVNOBPXPYNZQAL-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C)[C@H]1CO	ZINC000305706024	231022889	/nfs/dbraw/zinc/02/28/89/231022889.db2.gz	CVNOBPXPYNZQAL-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000305857350	231076107	/nfs/dbraw/zinc/07/61/07/231076107.db2.gz	KZGIXOGBDIVWGV-HUBLWGQQSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000495202229	529575940	/nfs/dbraw/zinc/57/59/40/529575940.db2.gz	NRUVBGWANVSHDH-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000495202229	529575943	/nfs/dbraw/zinc/57/59/43/529575943.db2.gz	NRUVBGWANVSHDH-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000286619389	219087059	/nfs/dbraw/zinc/08/70/59/219087059.db2.gz	SAXOMYHUZFNKBH-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
CCc1nn(C)c(N[C@H]2CCc3[nH+]c(C)cn3C2)c1[N+](=O)[O-]	ZINC000302611747	529767788	/nfs/dbraw/zinc/76/77/88/529767788.db2.gz	BQPLEMJMQHCAMJ-JTQLQIEISA-N	1	1	304.354	1.823	20	5		DDBDMO
CCc1ccc(C(=O)NC[C@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000266883386	282303503	/nfs/dbraw/zinc/30/35/03/282303503.db2.gz	COYXFXMQPAGRHS-AWEZNQCLSA-N	1	1	320.393	1.133	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](CCO)C[C@@H]1C	ZINC000457136983	232000294	/nfs/dbraw/zinc/00/02/94/232000294.db2.gz	VHCVMIUMXNTKDR-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](CCO)C[C@@H]1C	ZINC000457136983	232000298	/nfs/dbraw/zinc/00/02/98/232000298.db2.gz	VHCVMIUMXNTKDR-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC1	ZINC000413029997	530053524	/nfs/dbraw/zinc/05/35/24/530053524.db2.gz	UHFGSZOGMTVGKD-LSDHHAIUSA-N	1	1	303.362	1.862	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1CCO)c1ccc([N+](=O)[O-])s1	ZINC000331327394	233083599	/nfs/dbraw/zinc/08/35/99/233083599.db2.gz	NGJYZJNVWJJGLX-JTQLQIEISA-N	1	1	313.379	1.233	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CCO)c1ccc([N+](=O)[O-])s1	ZINC000331327394	233083607	/nfs/dbraw/zinc/08/36/07/233083607.db2.gz	NGJYZJNVWJJGLX-JTQLQIEISA-N	1	1	313.379	1.233	20	5		DDBDMO
C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)N1CCCC1	ZINC000046037036	352433833	/nfs/dbraw/zinc/43/38/33/352433833.db2.gz	ZTSCONZWPZNFBL-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)N1CCCC1	ZINC000046037036	352433841	/nfs/dbraw/zinc/43/38/41/352433841.db2.gz	ZTSCONZWPZNFBL-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2ccc([N+](=O)[O-])o2)C[C@H](C)O1	ZINC000047669903	352507434	/nfs/dbraw/zinc/50/74/34/352507434.db2.gz	CICVTNUZSVFCBY-PHIMTYICSA-N	1	1	311.338	1.417	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000058274262	352841535	/nfs/dbraw/zinc/84/15/35/352841535.db2.gz	GPKUTIGHPCURFK-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@@H]1C	ZINC000065780294	352962927	/nfs/dbraw/zinc/96/29/27/352962927.db2.gz	TUWAYWZQIUKYRJ-QWHCGFSZSA-N	1	1	323.397	1.561	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC000066924332	353026138	/nfs/dbraw/zinc/02/61/38/353026138.db2.gz	AIZYEHQZYJTQLD-UHFFFAOYSA-N	1	1	306.366	1.607	20	5		DDBDMO
Cc1cc(N2CCN(c3[nH+]ccn3C)CC2)ccc1[N+](=O)[O-]	ZINC000075053090	353345154	/nfs/dbraw/zinc/34/51/54/353345154.db2.gz	VSYANZKLBUIUHA-UHFFFAOYSA-N	1	1	301.350	1.963	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccccc2)C2CC2)c1	ZINC000174715848	198373763	/nfs/dbraw/zinc/37/37/63/198373763.db2.gz	BTRPZOLFKTVCCP-MRXNPFEDSA-N	1	1	316.361	1.817	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1	ZINC000078523759	353520475	/nfs/dbraw/zinc/52/04/75/353520475.db2.gz	ARSVCAWDEXPHCO-CQSZACIVSA-N	1	1	321.377	1.690	20	5		DDBDMO
C[C@H](CNc1ccc(C(N)=O)cc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000077995645	353500734	/nfs/dbraw/zinc/50/07/34/353500734.db2.gz	QFAQRGOPRPFSCO-LLVKDONJSA-N	1	1	322.365	1.074	20	5		DDBDMO
Cc1ccnc(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145249	353791613	/nfs/dbraw/zinc/79/16/13/353791613.db2.gz	FQNFOHSQIWESEZ-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccnc(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000090145249	353791615	/nfs/dbraw/zinc/79/16/15/353791615.db2.gz	FQNFOHSQIWESEZ-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[NH+](Cc2ccccc2)CC1	ZINC000355801745	291012901	/nfs/dbraw/zinc/01/29/01/291012901.db2.gz	OBXXBXOMGGKELO-UHFFFAOYSA-N	1	1	315.377	1.646	20	5		DDBDMO
Nc1c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc(F)cc1[N+](=O)[O-]	ZINC000141453852	354140156	/nfs/dbraw/zinc/14/01/56/354140156.db2.gz	HBJNVCXFCWWYPV-LLVKDONJSA-N	1	1	322.340	1.626	20	5		DDBDMO
COc1ccc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157631221	354225995	/nfs/dbraw/zinc/22/59/95/354225995.db2.gz	HFBKPJABSVGMIS-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157631221	354225996	/nfs/dbraw/zinc/22/59/96/354225996.db2.gz	HFBKPJABSVGMIS-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346192520	283017550	/nfs/dbraw/zinc/01/75/50/283017550.db2.gz	NLMHDWPAINVCFG-AXFHLTTASA-N	1	1	307.354	1.120	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H](CO)CC2)c([N+](=O)[O-])c1	ZINC000293092927	354454074	/nfs/dbraw/zinc/45/40/74/354454074.db2.gz	KMLIRUHSONPMPN-NSHDSACASA-N	1	1	307.350	1.288	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000317784204	354512732	/nfs/dbraw/zinc/51/27/32/354512732.db2.gz	XWFFGYKTDCAADJ-NSHDSACASA-N	1	1	303.322	1.281	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000317784204	354512734	/nfs/dbraw/zinc/51/27/34/354512734.db2.gz	XWFFGYKTDCAADJ-NSHDSACASA-N	1	1	303.322	1.281	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCCN1CCC[N@@H+](C)CC1	ZINC000588816018	354938575	/nfs/dbraw/zinc/93/85/75/354938575.db2.gz	KVOKFEJDBSHHJB-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCC[N@@H+]1CCCN(C)CC1	ZINC000588816018	354938577	/nfs/dbraw/zinc/93/85/77/354938577.db2.gz	KVOKFEJDBSHHJB-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCC[N@H+]1CCCN(C)CC1	ZINC000588816018	354938578	/nfs/dbraw/zinc/93/85/78/354938578.db2.gz	KVOKFEJDBSHHJB-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)C2)C1	ZINC000590141908	355053098	/nfs/dbraw/zinc/05/30/98/355053098.db2.gz	IKWCJWCYWIVQRG-MRXNPFEDSA-N	1	1	320.393	1.591	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]([NH+](C)C)[C@H]2C)c1[N+](=O)[O-]	ZINC000590403652	355086223	/nfs/dbraw/zinc/08/62/23/355086223.db2.gz	LLZRDAJUGYRHRW-ZJUUUORDSA-N	1	1	309.370	1.606	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000590443430	355097222	/nfs/dbraw/zinc/09/72/22/355097222.db2.gz	IRCCTHOBQYUGRL-BXUZGUMPSA-N	1	1	305.334	1.136	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590447418	355099544	/nfs/dbraw/zinc/09/95/44/355099544.db2.gz	XDCSNEKQAIPBIM-CMPLNLGQSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)cn1	ZINC000590685649	355146973	/nfs/dbraw/zinc/14/69/73/355146973.db2.gz	HYNULAHNTKCNMM-AWEZNQCLSA-N	1	1	306.366	1.681	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000591505191	355322310	/nfs/dbraw/zinc/32/23/10/355322310.db2.gz	DOKXVNXAAOMFOI-NEPJUHHUSA-N	1	1	322.361	1.816	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([C@H]3CCC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256421	355548609	/nfs/dbraw/zinc/54/86/09/355548609.db2.gz	YYVKIUTXUBTMKW-RYUDHWBXSA-N	1	1	321.381	1.478	20	5		DDBDMO
CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1	ZINC000592833240	355707674	/nfs/dbraw/zinc/70/76/74/355707674.db2.gz	XKDAVOJZALXMDM-CQSZACIVSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593006568	355767437	/nfs/dbraw/zinc/76/74/37/355767437.db2.gz	GQLGSIVLYSLKHA-UHFFFAOYSA-N	1	1	324.333	1.766	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593006568	355767442	/nfs/dbraw/zinc/76/74/42/355767442.db2.gz	GQLGSIVLYSLKHA-UHFFFAOYSA-N	1	1	324.333	1.766	20	5		DDBDMO
CN(CC[NH+]1CCCCC1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000593883549	356040716	/nfs/dbraw/zinc/04/07/16/356040716.db2.gz	OLXWWCIRSUEDHN-UHFFFAOYSA-N	1	1	307.350	1.858	20	5		DDBDMO
C[C@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[NH+]1CC(C)C1	ZINC000594360113	356182250	/nfs/dbraw/zinc/18/22/50/356182250.db2.gz	DKNGJRPVYKRVCT-GFCCVEGCSA-N	1	1	319.361	1.656	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594600570	356261014	/nfs/dbraw/zinc/26/10/14/356261014.db2.gz	MFEFLQSWRUFQBP-QWHCGFSZSA-N	1	1	319.365	1.518	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373218	356469372	/nfs/dbraw/zinc/46/93/72/356469372.db2.gz	YPFNLAJVTUIKPC-WCQYABFASA-N	1	1	319.365	1.097	20	5		DDBDMO
CCN1CC[C@@H]([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373218	356469377	/nfs/dbraw/zinc/46/93/77/356469377.db2.gz	YPFNLAJVTUIKPC-WCQYABFASA-N	1	1	319.365	1.097	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000595477493	356509642	/nfs/dbraw/zinc/50/96/42/356509642.db2.gz	UOUQAPAHMKRUCZ-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1COCCO1	ZINC000595742126	356631206	/nfs/dbraw/zinc/63/12/06/356631206.db2.gz	ODPMDWFNFBDSCN-AWEZNQCLSA-N	1	1	324.333	1.309	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1COCCO1	ZINC000595742126	356631207	/nfs/dbraw/zinc/63/12/07/356631207.db2.gz	ODPMDWFNFBDSCN-AWEZNQCLSA-N	1	1	324.333	1.309	20	5		DDBDMO
C[C@@H]1COC2(CCCC2)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000595816418	356662274	/nfs/dbraw/zinc/66/22/74/356662274.db2.gz	WZMKQJBKGLOCLA-OCCSQVGLSA-N	1	1	324.381	1.186	20	5		DDBDMO
COC[C@]1(C(=O)OC)CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000595801186	356656554	/nfs/dbraw/zinc/65/65/54/356656554.db2.gz	FHEWYVADZLWAJG-INIZCTEOSA-N	1	1	322.361	1.791	20	5		DDBDMO
COC[C@]1(C(=O)OC)CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000595801186	356656557	/nfs/dbraw/zinc/65/65/57/356656557.db2.gz	FHEWYVADZLWAJG-INIZCTEOSA-N	1	1	322.361	1.791	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@@H]1C	ZINC000596176409	356803061	/nfs/dbraw/zinc/80/30/61/356803061.db2.gz	FVCYCRMVWFQOGI-WDEREUQCSA-N	1	1	306.366	1.613	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@H]2C1	ZINC000596189727	356806916	/nfs/dbraw/zinc/80/69/16/356806916.db2.gz	QGHLRECYVULPHF-YGRLFVJLSA-N	1	1	304.350	1.224	20	5		DDBDMO
Cc1nn(C)c(N[C@@H](C)C[N@H+](C)CCCN(C)C)c1[N+](=O)[O-]	ZINC000596364583	356864318	/nfs/dbraw/zinc/86/43/18/356864318.db2.gz	PAAVRFNCBXJUDU-NSHDSACASA-N	1	1	312.418	1.321	20	5		DDBDMO
Cc1nn(C)c(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1[N+](=O)[O-]	ZINC000596364583	356864320	/nfs/dbraw/zinc/86/43/20/356864320.db2.gz	PAAVRFNCBXJUDU-NSHDSACASA-N	1	1	312.418	1.321	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597859015	357360861	/nfs/dbraw/zinc/36/08/61/357360861.db2.gz	PYBRHMJKHBMVGF-JTQLQIEISA-N	1	1	309.370	1.239	20	5		DDBDMO
CCN(C(=O)c1cccc([N+](=O)[O-])c1OC)[C@@H]1CC[N@@H+](C)C1	ZINC000597943935	357392845	/nfs/dbraw/zinc/39/28/45/357392845.db2.gz	BCAISPCHHSAIES-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598220995	357497533	/nfs/dbraw/zinc/49/75/33/357497533.db2.gz	SZSJEJXPOOVWLF-SNVBAGLBSA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598220995	357497536	/nfs/dbraw/zinc/49/75/36/357497536.db2.gz	SZSJEJXPOOVWLF-SNVBAGLBSA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598220995	357497543	/nfs/dbraw/zinc/49/75/43/357497543.db2.gz	SZSJEJXPOOVWLF-SNVBAGLBSA-N	1	1	307.354	1.455	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)CC1(O)CCC1	ZINC000599412155	357925881	/nfs/dbraw/zinc/92/58/81/357925881.db2.gz	GIKYEOLAKLQVRX-CQSZACIVSA-N	1	1	308.378	1.735	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1C[C@@H](CO)[C@H](CO)C1	ZINC000599531343	357964757	/nfs/dbraw/zinc/96/47/57/357964757.db2.gz	SYWBHMBENMPIHT-KBPBESRZSA-N	1	1	324.377	1.415	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599624096	357996459	/nfs/dbraw/zinc/99/64/59/357996459.db2.gz	PFTKEMMCNOAEOF-VBNZEHGJSA-N	1	1	308.378	1.969	20	5		DDBDMO
COC(=O)[C@](C)(NC[C@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000599648752	358006371	/nfs/dbraw/zinc/00/63/71/358006371.db2.gz	FAWVWPIHGPCJBM-GDBMZVCRSA-N	1	1	321.377	1.667	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)n1	ZINC000600315271	358194180	/nfs/dbraw/zinc/19/41/80/358194180.db2.gz	QVWDRXAJJYEMJL-LLVKDONJSA-N	1	1	309.370	1.273	20	5		DDBDMO
CCOc1ccc([C@H](C)NC[C@@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000600710235	358290864	/nfs/dbraw/zinc/29/08/64/358290864.db2.gz	MUAJAHXTJXTOAZ-WCQYABFASA-N	1	1	309.366	1.633	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C2CN(c3ccncn3)C2)c(F)c1	ZINC000601157831	358425914	/nfs/dbraw/zinc/42/59/14/358425914.db2.gz	GSLAJGSSXQSQAC-UHFFFAOYSA-N	1	1	303.297	1.502	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601775616	358689989	/nfs/dbraw/zinc/68/99/89/358689989.db2.gz	GMVPMGCBAMOCIP-OAHLLOKOSA-N	1	1	309.366	1.260	20	5		DDBDMO
CCCNC(=O)C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602437471	358975457	/nfs/dbraw/zinc/97/54/57/358975457.db2.gz	YPPQVCORUAFDJL-UHFFFAOYSA-N	1	1	309.370	1.067	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602476385	359003962	/nfs/dbraw/zinc/00/39/62/359003962.db2.gz	MJJIZRIVVLQPIJ-SNVBAGLBSA-N	1	1	310.354	1.492	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602476385	359003966	/nfs/dbraw/zinc/00/39/66/359003966.db2.gz	MJJIZRIVVLQPIJ-SNVBAGLBSA-N	1	1	310.354	1.492	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)[C@@H]2C1	ZINC000602673578	359117661	/nfs/dbraw/zinc/11/76/61/359117661.db2.gz	WAVQSHPJGFRCTJ-GXFFZTMASA-N	1	1	302.334	1.872	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](n2ccnc2)C1	ZINC000602771580	359178950	/nfs/dbraw/zinc/17/89/50/359178950.db2.gz	FLFZTIUSGSAYHZ-CYBMUJFWSA-N	1	1	304.354	1.633	20	5		DDBDMO
COC(=O)[C@]1(C)CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602843903	359232515	/nfs/dbraw/zinc/23/25/15/359232515.db2.gz	LEGOTHFWKFPEIH-CQSZACIVSA-N	1	1	310.354	1.375	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@H](OC)C[C@]2(C)CO)cc1[N+](=O)[O-]	ZINC000602963872	359328021	/nfs/dbraw/zinc/32/80/21/359328021.db2.gz	JLEQPQOAGDOFCA-IUODEOHRSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC1(C)[C@H](Nc2ccc([N+](=O)[O-])cn2)C[C@@H]1[NH+]1CCOCC1	ZINC000603397052	359614479	/nfs/dbraw/zinc/61/44/79/359614479.db2.gz	JLXYIIWSUFYJGA-OLZOCXBDSA-N	1	1	306.366	1.901	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)CC[C@@H]21	ZINC000187194739	200075459	/nfs/dbraw/zinc/07/54/59/200075459.db2.gz	DMBWAIRPECDWNB-JQWIXIFHSA-N	1	1	320.349	1.252	20	5		DDBDMO
CO[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@@H]1C	ZINC000189330496	200383477	/nfs/dbraw/zinc/38/34/77/200383477.db2.gz	FWNVTPSLKZWTNH-HZMBPMFUSA-N	1	1	307.350	1.551	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1)C(C)C	ZINC000609045017	360257954	/nfs/dbraw/zinc/25/79/54/360257954.db2.gz	QGAWZIDDZAUDDH-UHFFFAOYSA-N	1	1	323.393	1.992	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000610208767	360391037	/nfs/dbraw/zinc/39/10/37/360391037.db2.gz	KRPRCMCVDQXJMO-DGCLKSJQSA-N	1	1	321.377	1.745	20	5		DDBDMO
Cc1nccc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000610447557	360438650	/nfs/dbraw/zinc/43/86/50/360438650.db2.gz	XIOWDHRTZQULRN-ZDUSSCGKSA-N	1	1	316.365	1.769	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CCn1ccc([N+](=O)[O-])n1)C1CCCCC1	ZINC000610484795	360447322	/nfs/dbraw/zinc/44/73/22/360447322.db2.gz	KHWLRTKOQWUORG-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)C1CCCCC1	ZINC000610484795	360447328	/nfs/dbraw/zinc/44/73/28/360447328.db2.gz	KHWLRTKOQWUORG-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
CCNC(=O)C[N@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000610367968	360422761	/nfs/dbraw/zinc/42/27/61/360422761.db2.gz	SOCUXGQDXUWIBY-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000610367968	360422766	/nfs/dbraw/zinc/42/27/66/360422766.db2.gz	SOCUXGQDXUWIBY-UHFFFAOYSA-N	1	1	311.338	1.050	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1cn(C)nn1	ZINC000611973560	360877461	/nfs/dbraw/zinc/87/74/61/360877461.db2.gz	RFMLZPGJZYNLNE-JTQLQIEISA-N	1	1	318.337	1.230	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)ccc1[N+](=O)[O-]	ZINC000359058416	299316417	/nfs/dbraw/zinc/31/64/17/299316417.db2.gz	WYNACLBOMOERFV-NSHDSACASA-N	1	1	306.366	1.680	20	5		DDBDMO
Cc1cc(N2CC[N@H+](C[C@H](C)O)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000292713157	223213014	/nfs/dbraw/zinc/21/30/14/223213014.db2.gz	SVHQUAJLFACGAS-NEPJUHHUSA-N	1	1	311.357	1.934	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000281462140	216317127	/nfs/dbraw/zinc/31/71/27/216317127.db2.gz	RHFRMQZCMFXGOA-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000281462140	216317130	/nfs/dbraw/zinc/31/71/30/216317130.db2.gz	RHFRMQZCMFXGOA-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000619578160	364070990	/nfs/dbraw/zinc/07/09/90/364070990.db2.gz	AZYZTKRUBVPFSB-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113757	212129565	/nfs/dbraw/zinc/12/95/65/212129565.db2.gz	YQSWSUDAAPESPW-XHDPSFHLSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113757	212129567	/nfs/dbraw/zinc/12/95/67/212129567.db2.gz	YQSWSUDAAPESPW-XHDPSFHLSA-N	1	1	319.361	1.857	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000282271329	216873630	/nfs/dbraw/zinc/87/36/30/216873630.db2.gz	HPWSVYHUXSHRAZ-AEGPPILISA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000275043829	212089884	/nfs/dbraw/zinc/08/98/84/212089884.db2.gz	YMCJDXKWXPGWCZ-SNVBAGLBSA-N	1	1	300.318	1.797	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000275043829	212089886	/nfs/dbraw/zinc/08/98/86/212089886.db2.gz	YMCJDXKWXPGWCZ-SNVBAGLBSA-N	1	1	300.318	1.797	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1(C(N)=O)CCCC1	ZINC000093212064	193216984	/nfs/dbraw/zinc/21/69/84/193216984.db2.gz	ATQDJWWAAABLSQ-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])NCC[NH+]1CCSCC1	ZINC000264808903	204173924	/nfs/dbraw/zinc/17/39/24/204173924.db2.gz	OONAHVWZDAAFHJ-UHFFFAOYSA-N	1	1	324.406	1.172	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)c1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000266231238	205201976	/nfs/dbraw/zinc/20/19/76/205201976.db2.gz	JMOIBSAMUURWQI-LLVKDONJSA-N	1	1	321.381	1.399	20	5		DDBDMO
C[C@@H]1c2ccsc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266382017	205305623	/nfs/dbraw/zinc/30/56/23/205305623.db2.gz	AYSUYPNZTOOVQW-ZYHUDNBSSA-N	1	1	322.390	1.833	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c(N)c([N+](=O)[O-])c1	ZINC000267365958	206015465	/nfs/dbraw/zinc/01/54/65/206015465.db2.gz	XHZBLBNREQWVGU-QWHCGFSZSA-N	1	1	318.377	1.842	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000121124599	248270632	/nfs/dbraw/zinc/27/06/32/248270632.db2.gz	WPZVXRQXTAEJLT-WFASDCNBSA-N	1	1	321.377	1.772	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000273927769	211181845	/nfs/dbraw/zinc/18/18/45/211181845.db2.gz	FDVOHMWQQDBROA-ZDUSSCGKSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000273927769	211181848	/nfs/dbraw/zinc/18/18/48/211181848.db2.gz	FDVOHMWQQDBROA-ZDUSSCGKSA-N	1	1	304.350	1.631	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000285244886	218349936	/nfs/dbraw/zinc/34/99/36/218349936.db2.gz	CARKFRSAMJYRSB-RWMBFGLXSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000066140445	184392482	/nfs/dbraw/zinc/39/24/82/184392482.db2.gz	MJQMYAVUEWNTBH-NSHDSACASA-N	1	1	311.386	1.336	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+](C2CC2)[C@@H]2CCS(=O)(=O)C2)cc1	ZINC000264580159	285110615	/nfs/dbraw/zinc/11/06/15/285110615.db2.gz	CBESRBKEPVCGJY-OAHLLOKOSA-N	1	1	324.402	1.789	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+](C2CC2)[C@@H]2CCS(=O)(=O)C2)cc1	ZINC000264580159	285110616	/nfs/dbraw/zinc/11/06/16/285110616.db2.gz	CBESRBKEPVCGJY-OAHLLOKOSA-N	1	1	324.402	1.789	20	5		DDBDMO
COc1cc(C[N@@H+]2CCSC[C@@H]2CCO)ccc1[N+](=O)[O-]	ZINC000352546439	285131349	/nfs/dbraw/zinc/13/13/49/285131349.db2.gz	VFUPNSNYDDVRBJ-LBPRGKRZSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1cc(C[N@H+]2CCSC[C@@H]2CCO)ccc1[N+](=O)[O-]	ZINC000352546439	285131351	/nfs/dbraw/zinc/13/13/51/285131351.db2.gz	VFUPNSNYDDVRBJ-LBPRGKRZSA-N	1	1	312.391	1.903	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000452102746	533136408	/nfs/dbraw/zinc/13/64/08/533136408.db2.gz	LCHQKLZGTLFAJK-LBPRGKRZSA-N	1	1	321.377	1.942	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000444750489	533171768	/nfs/dbraw/zinc/17/17/68/533171768.db2.gz	DXXDWRKXOGSZBE-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000295848886	533528540	/nfs/dbraw/zinc/52/85/40/533528540.db2.gz	DHSAYSQDUCSHKB-AOOOYVTPSA-N	1	1	323.324	1.376	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000013694383	406866658	/nfs/dbraw/zinc/86/66/58/406866658.db2.gz	JUNBJUFFHAJXSC-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000026711241	406905607	/nfs/dbraw/zinc/90/56/07/406905607.db2.gz	RNABSOVOMPQBII-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000026711241	406905610	/nfs/dbraw/zinc/90/56/10/406905610.db2.gz	RNABSOVOMPQBII-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
CO[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000076345961	406965815	/nfs/dbraw/zinc/96/58/15/406965815.db2.gz	SRGIAYKIRHBLMQ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000076345961	406965817	/nfs/dbraw/zinc/96/58/17/406965817.db2.gz	SRGIAYKIRHBLMQ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
COc1cc(C(=O)NCCC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000101627873	407313044	/nfs/dbraw/zinc/31/30/44/407313044.db2.gz	QXKYOOXJQFPNNN-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000103284075	407335780	/nfs/dbraw/zinc/33/57/80/407335780.db2.gz	ILKCSPUSYCBXHT-VXGBXAGGSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000103283671	407336086	/nfs/dbraw/zinc/33/60/86/407336086.db2.gz	ROGFRWFIJNZMQZ-QWHCGFSZSA-N	1	1	321.377	1.950	20	5		DDBDMO
Nc1ccc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000108783147	407390266	/nfs/dbraw/zinc/39/02/66/407390266.db2.gz	DOLUTBXXIPAMOS-SNVBAGLBSA-N	1	1	304.350	1.391	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000125636668	407394281	/nfs/dbraw/zinc/39/42/81/407394281.db2.gz	AHDPXVWDWSREPR-NSHDSACASA-N	1	1	314.345	1.825	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000113225732	407478333	/nfs/dbraw/zinc/47/83/33/407478333.db2.gz	ZJLFGGFCYWXNAQ-NWDGAFQWSA-N	1	1	321.381	1.222	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000266608774	407577615	/nfs/dbraw/zinc/57/76/15/407577615.db2.gz	VRUVQVMHBMKPBC-UHFFFAOYSA-N	1	1	320.353	1.595	20	5		DDBDMO
C[C@@H]1C[C@@H](C[NH3+])CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000261693761	407581800	/nfs/dbraw/zinc/58/18/00/407581800.db2.gz	IUGYHNRMWCWOSX-BDAKNGLRSA-N	1	1	303.322	1.280	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C[C@@H]1CCC[N@@H+](C)C1	ZINC000151962193	407533473	/nfs/dbraw/zinc/53/34/73/407533473.db2.gz	PZIKDKLHIZQRIB-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000266464775	407540813	/nfs/dbraw/zinc/54/08/13/407540813.db2.gz	ANTVJYIWWLQXLU-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@@H]1C[N@@H+]2CCC[C@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464775	407540819	/nfs/dbraw/zinc/54/08/19/407540819.db2.gz	ANTVJYIWWLQXLU-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464775	407540823	/nfs/dbraw/zinc/54/08/23/407540823.db2.gz	ANTVJYIWWLQXLU-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1	ZINC000266744935	407620959	/nfs/dbraw/zinc/62/09/59/407620959.db2.gz	FWIIPMGVMPSAAU-UHFFFAOYSA-N	1	1	306.366	1.484	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1	ZINC000115443610	407682164	/nfs/dbraw/zinc/68/21/64/407682164.db2.gz	PPMAYMYLUVEZFZ-GFCCVEGCSA-N	1	1	306.366	1.712	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21	ZINC000117259848	407817765	/nfs/dbraw/zinc/81/77/65/407817765.db2.gz	VOCBFXJQZAAZSS-UHFFFAOYSA-N	1	1	318.333	1.118	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000245715110	408050675	/nfs/dbraw/zinc/05/06/75/408050675.db2.gz	NXDVFILTVWYRNR-ZYHUDNBSSA-N	1	1	306.366	1.636	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272577424	407992434	/nfs/dbraw/zinc/99/24/34/407992434.db2.gz	GJQORMICQLVFOZ-IUODEOHRSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@@H](C(=O)N1CCc2ccc([N+](=O)[O-])cc21)N1CC[NH+](C)CC1	ZINC000182779260	408249403	/nfs/dbraw/zinc/24/94/03/408249403.db2.gz	DFGDETZCCSEJPC-LBPRGKRZSA-N	1	1	318.377	1.120	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000269451263	408314618	/nfs/dbraw/zinc/31/46/18/408314618.db2.gz	GILOLGJBIFUTGS-LLVKDONJSA-N	1	1	323.397	1.855	20	5		DDBDMO
CC[N@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1	ZINC000269451263	408314624	/nfs/dbraw/zinc/31/46/24/408314624.db2.gz	GILOLGJBIFUTGS-LLVKDONJSA-N	1	1	323.397	1.855	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1	ZINC000269451263	408314627	/nfs/dbraw/zinc/31/46/27/408314627.db2.gz	GILOLGJBIFUTGS-LLVKDONJSA-N	1	1	323.397	1.855	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000269379622	408289069	/nfs/dbraw/zinc/28/90/69/408289069.db2.gz	JBFIKGUPCVGDTL-LLVKDONJSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000269379622	408289074	/nfs/dbraw/zinc/28/90/74/408289074.db2.gz	JBFIKGUPCVGDTL-LLVKDONJSA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269432741	408307602	/nfs/dbraw/zinc/30/76/02/408307602.db2.gz	CIWNUFWVEGQKAL-GXSJLCMTSA-N	1	1	321.381	1.654	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)CO	ZINC000190874305	408335045	/nfs/dbraw/zinc/33/50/45/408335045.db2.gz	WGOCPRNAGCYJAW-UWVGGRQHSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)CO	ZINC000190874305	408335049	/nfs/dbraw/zinc/33/50/49/408335049.db2.gz	WGOCPRNAGCYJAW-UWVGGRQHSA-N	1	1	302.758	1.812	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000134916911	162089980	/nfs/dbraw/zinc/08/99/80/162089980.db2.gz	KSAGSJCWHRTRND-CJNGLKHVSA-N	1	1	319.409	1.740	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@H]21	ZINC000247104516	408409145	/nfs/dbraw/zinc/40/91/45/408409145.db2.gz	SOPMXKQHYALAQB-QWHCGFSZSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000270421241	408529452	/nfs/dbraw/zinc/52/94/52/408529452.db2.gz	GDVVUGMASBDFLJ-ZWNOBZJWSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177198719	408549725	/nfs/dbraw/zinc/54/97/25/408549725.db2.gz	SKEKEJPYNHMTPE-RYUDHWBXSA-N	1	1	319.361	1.715	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+](CCO)C1CCC1	ZINC000275920617	408720011	/nfs/dbraw/zinc/72/00/11/408720011.db2.gz	ZHBWHZMZGCSSFV-ZDUSSCGKSA-N	1	1	310.350	1.181	20	5		DDBDMO
COc1ccc(OCC[N@@H+](CCO)C2CCC2)c([N+](=O)[O-])c1	ZINC000275819345	408687601	/nfs/dbraw/zinc/68/76/01/408687601.db2.gz	JGKVYBSIMWXLSG-UHFFFAOYSA-N	1	1	310.350	1.829	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@@H]1C	ZINC000251604252	408781738	/nfs/dbraw/zinc/78/17/38/408781738.db2.gz	FWNVTPSLKZWTNH-IINYFYTJSA-N	1	1	307.350	1.551	20	5		DDBDMO
C[N@@H+]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000193868021	408750706	/nfs/dbraw/zinc/75/07/06/408750706.db2.gz	BPNRGAYKYROOIS-UHFFFAOYSA-N	1	1	317.342	1.060	20	5		DDBDMO
C[N@H+]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000193868021	408750708	/nfs/dbraw/zinc/75/07/08/408750708.db2.gz	BPNRGAYKYROOIS-UHFFFAOYSA-N	1	1	317.342	1.060	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])n[nH]1)[N@@H+](C)Cc1ccccc1	ZINC000285845344	408875465	/nfs/dbraw/zinc/87/54/65/408875465.db2.gz	HUEHMKNQMVPUBP-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290796089	408834647	/nfs/dbraw/zinc/83/46/47/408834647.db2.gz	OXZPUSXUKRAAAE-LLVKDONJSA-N	1	1	321.381	1.257	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000276411089	408852229	/nfs/dbraw/zinc/85/22/29/408852229.db2.gz	RRUVDDXPKGWLRN-UHFFFAOYSA-N	1	1	316.361	1.827	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)[C@H](C)C1	ZINC000188792545	163070542	/nfs/dbraw/zinc/07/05/42/163070542.db2.gz	PPKAVXKEHMHQJX-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000188792545	163070543	/nfs/dbraw/zinc/07/05/43/163070543.db2.gz	PPKAVXKEHMHQJX-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCCC[N@H+](C)CCN(C)C	ZINC000293405267	409106188	/nfs/dbraw/zinc/10/61/88/409106188.db2.gz	MVCCVHAURGXRHH-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCCCN(C)CC[NH+](C)C	ZINC000293405267	409106192	/nfs/dbraw/zinc/10/61/92/409106192.db2.gz	MVCCVHAURGXRHH-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@]3(CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000289190800	409231300	/nfs/dbraw/zinc/23/13/00/409231300.db2.gz	IXMHNZSEULSLSI-OAHLLOKOSA-N	1	1	321.381	1.486	20	5		DDBDMO
CC(C)(CCC(=O)NCC[N@H+]1CCc2ccccc2C1)[N+](=O)[O-]	ZINC000294186827	409256680	/nfs/dbraw/zinc/25/66/80/409256680.db2.gz	AXCSYWULBQCGCA-UHFFFAOYSA-N	1	1	319.405	1.996	20	5		DDBDMO
COc1c(C)cnc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)c1C	ZINC000295110656	409326660	/nfs/dbraw/zinc/32/66/60/409326660.db2.gz	HPPQLAUHRRGHNS-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
COc1c(C)c[nH+]c(CN(C)CCn2ccc([N+](=O)[O-])n2)c1C	ZINC000295110656	409326674	/nfs/dbraw/zinc/32/66/74/409326674.db2.gz	HPPQLAUHRRGHNS-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000296094260	409426777	/nfs/dbraw/zinc/42/67/77/409426777.db2.gz	DEEQKEVEFOYANT-INIZCTEOSA-N	1	1	322.361	1.649	20	5		DDBDMO
COC[C@]1(C)CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296906843	409696637	/nfs/dbraw/zinc/69/66/37/409696637.db2.gz	WALOIXWUGDGSFI-MRXNPFEDSA-N	1	1	321.377	1.916	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296906843	409696646	/nfs/dbraw/zinc/69/66/46/409696646.db2.gz	WALOIXWUGDGSFI-MRXNPFEDSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(C)C[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000305052865	409661910	/nfs/dbraw/zinc/66/19/10/409661910.db2.gz	NHUSBRMWLRWMLF-DZGCQCFKSA-N	1	1	310.398	1.910	20	5		DDBDMO
C[C@@H]1[C@H](C)N(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000357041242	409809758	/nfs/dbraw/zinc/80/97/58/409809758.db2.gz	QMAHKHJNKVKHEN-MNOVXSKESA-N	1	1	306.366	1.218	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@@H]2C)n1	ZINC000332027115	409815435	/nfs/dbraw/zinc/81/54/35/409815435.db2.gz	UHCQXTOZBHWWMH-RYUDHWBXSA-N	1	1	321.381	1.510	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@@H]2C)n1	ZINC000332027115	409815442	/nfs/dbraw/zinc/81/54/42/409815442.db2.gz	UHCQXTOZBHWWMH-RYUDHWBXSA-N	1	1	321.381	1.510	20	5		DDBDMO
CCC[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@H+]1CCOC	ZINC000346650304	410058961	/nfs/dbraw/zinc/05/89/61/410058961.db2.gz	GLWCVTISFIXVIT-CQSZACIVSA-N	1	1	308.382	1.927	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000357624728	410142558	/nfs/dbraw/zinc/14/25/58/410142558.db2.gz	BMZVOJLEUDUIBD-GFCCVEGCSA-N	1	1	307.350	1.435	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)[C@H](C(C)C)C2)n1	ZINC000343224018	410248979	/nfs/dbraw/zinc/24/89/79/410248979.db2.gz	IDWNFSHMZGGLDR-ZDUSSCGKSA-N	1	1	322.365	1.553	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000351773562	410223255	/nfs/dbraw/zinc/22/32/55/410223255.db2.gz	HFFCSLWHRYPXEV-JOYOIKCWSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000351773562	410223261	/nfs/dbraw/zinc/22/32/61/410223261.db2.gz	HFFCSLWHRYPXEV-JOYOIKCWSA-N	1	1	304.306	1.457	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000299208603	410568389	/nfs/dbraw/zinc/56/83/89/410568389.db2.gz	ASLHVPPNPNNHBI-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000343568386	410539185	/nfs/dbraw/zinc/53/91/85/410539185.db2.gz	KRGJYNYPXXAZLV-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000352201194	410546053	/nfs/dbraw/zinc/54/60/53/410546053.db2.gz	DTBGCEAGJXVXBV-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CCCOC2)c([N+](=O)[O-])c1	ZINC000352201194	410546061	/nfs/dbraw/zinc/54/60/61/410546061.db2.gz	DTBGCEAGJXVXBV-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000343580958	410549886	/nfs/dbraw/zinc/54/98/86/410549886.db2.gz	XYYLRHIMFQBWQE-LLVKDONJSA-N	1	1	324.356	1.920	20	5		DDBDMO
CCOc1cc(N2CC[C@H]3OCC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000579935190	422859002	/nfs/dbraw/zinc/85/90/02/422859002.db2.gz	PYMQBFCQTDSNTL-LSDHHAIUSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000355678133	410637054	/nfs/dbraw/zinc/63/70/54/410637054.db2.gz	ICMIHNDPEXSMJP-OAHLLOKOSA-N	1	1	321.333	1.159	20	5		DDBDMO
CN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@H+](C2CC2)C1	ZINC000355875730	410713261	/nfs/dbraw/zinc/71/32/61/410713261.db2.gz	CVXUDNPZHOULKZ-NSHDSACASA-N	1	1	304.350	1.486	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCC[N@H+]1C	ZINC000355924338	410736809	/nfs/dbraw/zinc/73/68/09/410736809.db2.gz	ZBDOFTHHXBSYOZ-CABZTGNLSA-N	1	1	317.349	1.684	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000301234098	410681774	/nfs/dbraw/zinc/68/17/74/410681774.db2.gz	GUXYDRWVNZPVHD-JTQLQIEISA-N	1	1	307.354	1.375	20	5		DDBDMO
C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C1(S(C)(=O)=O)CC1	ZINC000353051131	410760562	/nfs/dbraw/zinc/76/05/62/410760562.db2.gz	XQAIAZJSMJQUOU-MRVPVSSYSA-N	1	1	304.393	1.712	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343914969	410804962	/nfs/dbraw/zinc/80/49/62/410804962.db2.gz	WJUIARQZKPMYLV-DOMZBBRYSA-N	1	1	320.393	1.919	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000330675934	410869137	/nfs/dbraw/zinc/86/91/37/410869137.db2.gz	SVRUPTFWEWPPMD-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000330675934	410869146	/nfs/dbraw/zinc/86/91/46/410869146.db2.gz	SVRUPTFWEWPPMD-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@@H+](C)C[C@@H]2C)c1	ZINC000330689940	410880223	/nfs/dbraw/zinc/88/02/23/410880223.db2.gz	WDUCOQVSXWDZHM-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)C[C@@H]2C)c1	ZINC000330689940	410880229	/nfs/dbraw/zinc/88/02/29/410880229.db2.gz	WDUCOQVSXWDZHM-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@]1(CO)CCOC1	ZINC000330894256	410905005	/nfs/dbraw/zinc/90/50/05/410905005.db2.gz	JYGXMPNATUHKGV-CYBMUJFWSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@]1(CO)CCOC1	ZINC000330894256	410905007	/nfs/dbraw/zinc/90/50/07/410905007.db2.gz	JYGXMPNATUHKGV-CYBMUJFWSA-N	1	1	300.742	1.831	20	5		DDBDMO
CC[N@@H+]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000359947267	410965199	/nfs/dbraw/zinc/96/51/99/410965199.db2.gz	ZSPUINYWDHOQSN-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+]1CC[C@H](NS(=O)(=O)c2ccc(C)cc2[N+](=O)[O-])C1	ZINC000359947267	410965204	/nfs/dbraw/zinc/96/52/04/410965204.db2.gz	ZSPUINYWDHOQSN-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000344117210	410966149	/nfs/dbraw/zinc/96/61/49/410966149.db2.gz	BLLUILYXXDOUDF-VNHYZAJKSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CO)C[C@H]1C	ZINC000344143396	410988179	/nfs/dbraw/zinc/98/81/79/410988179.db2.gz	BQBAGPBVVZNXQB-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](CO)C[C@H]1C	ZINC000344143396	410988184	/nfs/dbraw/zinc/98/81/84/410988184.db2.gz	BQBAGPBVVZNXQB-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](O)CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000353520544	411046651	/nfs/dbraw/zinc/04/66/51/411046651.db2.gz	PMLJMNZEVFRHLV-BXUZGUMPSA-N	1	1	304.350	1.778	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000331430495	411087460	/nfs/dbraw/zinc/08/74/60/411087460.db2.gz	CDGQKCSYECETFG-GWCFXTLKSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000356649967	411117084	/nfs/dbraw/zinc/11/70/84/411117084.db2.gz	QVECLKRYNHQMAN-JTQLQIEISA-N	1	1	310.354	1.546	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000353765114	411125394	/nfs/dbraw/zinc/12/53/94/411125394.db2.gz	GIJMQPCQSQUTCD-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@@H]1CC[N@H+](C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000353765114	411125396	/nfs/dbraw/zinc/12/53/96/411125396.db2.gz	GIJMQPCQSQUTCD-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000353765114	411125399	/nfs/dbraw/zinc/12/53/99/411125399.db2.gz	GIJMQPCQSQUTCD-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@@H]3CCSC3)CC2)n1	ZINC000366299025	418453441	/nfs/dbraw/zinc/45/34/41/418453441.db2.gz	SUOJBIIHXDKYER-GFCCVEGCSA-N	1	1	308.407	1.926	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN([C@H]3CCOC3)CC2)cc1	ZINC000366514972	418483572	/nfs/dbraw/zinc/48/35/72/418483572.db2.gz	LACOSYCDSUBFQE-INIZCTEOSA-N	1	1	305.378	1.544	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@@H]21	ZINC000374821231	418565311	/nfs/dbraw/zinc/56/53/11/418565311.db2.gz	DYRXLKABHMWOTP-XPTSAGLGSA-N	1	1	322.340	1.482	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000361027804	418568812	/nfs/dbraw/zinc/56/88/12/418568812.db2.gz	ZUFJEMGAWFFTDD-WPRPVWTQSA-N	1	1	303.322	1.892	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000361035523	418571178	/nfs/dbraw/zinc/57/11/78/418571178.db2.gz	NWHVANVFSOLSMD-LBPRGKRZSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000361035523	418571181	/nfs/dbraw/zinc/57/11/81/418571181.db2.gz	NWHVANVFSOLSMD-LBPRGKRZSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH2+]C[C@@H]1C[C@H](F)CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000366933671	418540629	/nfs/dbraw/zinc/54/06/29/418540629.db2.gz	LVTLCOPWIYAVCY-WPRPVWTQSA-N	1	1	321.312	1.243	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000374892426	418574492	/nfs/dbraw/zinc/57/44/92/418574492.db2.gz	HVMUGERGGRYLGX-UHFFFAOYSA-N	1	1	321.381	1.268	20	5		DDBDMO
Cc1cc(S(=O)(=O)NCC[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC000188141579	222007858	/nfs/dbraw/zinc/00/78/58/222007858.db2.gz	AITCLWNFZYWQIH-UHFFFAOYSA-N	1	1	315.395	1.522	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCC[N@H+]2CCCC[C@H]2C)n1	ZINC000191758256	222108598	/nfs/dbraw/zinc/10/85/98/222108598.db2.gz	XMAHFNPZSNKWDS-GFCCVEGCSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000375025229	418589778	/nfs/dbraw/zinc/58/97/78/418589778.db2.gz	YNFVPYGAQJSDTH-ZFWWWQNUSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000375031285	418592389	/nfs/dbraw/zinc/59/23/89/418592389.db2.gz	NPCGQTGCLAWNHP-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](O)C1(C)C	ZINC000361420459	418648974	/nfs/dbraw/zinc/64/89/74/418648974.db2.gz	NORSSFFMCPMNDR-CYBMUJFWSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](O)C1(C)C	ZINC000361420459	418648975	/nfs/dbraw/zinc/64/89/75/418648975.db2.gz	NORSSFFMCPMNDR-CYBMUJFWSA-N	1	1	307.350	1.687	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ncnc2cccc([N+](=O)[O-])c21	ZINC000347436680	418639002	/nfs/dbraw/zinc/63/90/02/418639002.db2.gz	UBTODSNSMPCFQQ-UHFFFAOYSA-N	1	1	319.365	1.918	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000357772220	418651997	/nfs/dbraw/zinc/65/19/97/418651997.db2.gz	AFSTYQCYLFNDKH-NSHDSACASA-N	1	1	306.370	2.170	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000361707608	418700109	/nfs/dbraw/zinc/70/01/09/418700109.db2.gz	WMAVSOZLDNEYQR-NEPJUHHUSA-N	1	1	306.366	1.490	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](C)[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000362055744	418745660	/nfs/dbraw/zinc/74/56/60/418745660.db2.gz	NHJIIEZLYDTUFR-WCFLWFBJSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@@H]1n1ccnc1	ZINC000371324962	418779806	/nfs/dbraw/zinc/77/98/06/418779806.db2.gz	BLOWXHVWFZAVOA-RYUDHWBXSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@@H]1n1ccnc1	ZINC000371324962	418779809	/nfs/dbraw/zinc/77/98/09/418779809.db2.gz	BLOWXHVWFZAVOA-RYUDHWBXSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000371544169	418799555	/nfs/dbraw/zinc/79/95/55/418799555.db2.gz	DPLVYQAWWQXUDN-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+]3CCOC[C@H]3C2)c1[N+](=O)[O-]	ZINC000364932568	418823430	/nfs/dbraw/zinc/82/34/30/418823430.db2.gz	HIRKWORSTDBAGX-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
CCOc1cccc(N2CC[N@H+]3CCOC[C@H]3C2)c1[N+](=O)[O-]	ZINC000364932568	418823434	/nfs/dbraw/zinc/82/34/34/418823434.db2.gz	HIRKWORSTDBAGX-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@H]2C[N@@H+](C3CC3)CCO2)c2nonc21	ZINC000365162519	418841516	/nfs/dbraw/zinc/84/15/16/418841516.db2.gz	BEEXRYWHUIQHDL-JTQLQIEISA-N	1	1	319.321	1.406	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@H]2C[N@H+](C3CC3)CCO2)c2nonc21	ZINC000365162519	418841519	/nfs/dbraw/zinc/84/15/19/418841519.db2.gz	BEEXRYWHUIQHDL-JTQLQIEISA-N	1	1	319.321	1.406	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H](CC)O1	ZINC000420960102	419384747	/nfs/dbraw/zinc/38/47/47/419384747.db2.gz	RCCAWLUXPIEGAV-MCIONIFRSA-N	1	1	312.370	1.042	20	5		DDBDMO
COC(=O)[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000411902312	419459396	/nfs/dbraw/zinc/45/93/96/419459396.db2.gz	HWZDNIBMBYZMPH-ZDUSSCGKSA-N	1	1	307.350	1.131	20	5		DDBDMO
COC(=O)[C@@]1(C)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000412065337	419613641	/nfs/dbraw/zinc/61/36/41/419613641.db2.gz	KRBCHJIJZFHECA-HNNXBMFYSA-N	1	1	323.349	1.032	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)n1	ZINC000427594976	419689430	/nfs/dbraw/zinc/68/94/30/419689430.db2.gz	BSFTXJJTWJRXHB-LLVKDONJSA-N	1	1	307.354	1.120	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@H]3CNCCO3)o2)c1	ZINC000415095711	419940990	/nfs/dbraw/zinc/94/09/90/419940990.db2.gz	NTDHKMWCJDVLEJ-OAHLLOKOSA-N	1	1	317.345	1.933	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000416304216	420321103	/nfs/dbraw/zinc/32/11/03/420321103.db2.gz	YRTXKVJVWFEWJT-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000416304216	420321107	/nfs/dbraw/zinc/32/11/07/420321107.db2.gz	YRTXKVJVWFEWJT-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[NH+](C)CCSc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000302689671	230352945	/nfs/dbraw/zinc/35/29/45/230352945.db2.gz	ZCGZYFCLYZPFIE-UHFFFAOYSA-N	1	1	304.393	1.652	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)Nc2ccc([N+](=O)[O-])nc2)CC1	ZINC000450920814	420562027	/nfs/dbraw/zinc/56/20/27/420562027.db2.gz	BDUHJCGZBGGUOI-UHFFFAOYSA-N	1	1	307.398	1.818	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1c(Cl)cccc1[N+](=O)[O-]	ZINC000452121881	420621841	/nfs/dbraw/zinc/62/18/41/420621841.db2.gz	GZWMJFQRBIJJHY-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(N(C)C)no1	ZINC000449257989	420977941	/nfs/dbraw/zinc/97/79/41/420977941.db2.gz	NYQXMQCTRHNPIV-JTQLQIEISA-N	1	1	305.338	1.765	20	5		DDBDMO
COc1ccc(CNC[C@H]2CCC[N@@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449390792	421004574	/nfs/dbraw/zinc/00/45/74/421004574.db2.gz	WVPKZKXSNPGFHO-CQSZACIVSA-N	1	1	323.393	1.540	20	5		DDBDMO
COc1ccc(CNC[C@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449390792	421004576	/nfs/dbraw/zinc/00/45/76/421004576.db2.gz	WVPKZKXSNPGFHO-CQSZACIVSA-N	1	1	323.393	1.540	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000449539488	421023229	/nfs/dbraw/zinc/02/32/29/421023229.db2.gz	WACIFKDMKGMLBY-OKILXGFUSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](C)N(CCO)[C@@H](C)C1	ZINC000449539488	421023231	/nfs/dbraw/zinc/02/32/31/421023231.db2.gz	WACIFKDMKGMLBY-OKILXGFUSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C)N(CCO)[C@@H](C)C1	ZINC000449539488	421023234	/nfs/dbraw/zinc/02/32/34/421023234.db2.gz	WACIFKDMKGMLBY-OKILXGFUSA-N	1	1	307.394	1.790	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@@H+]2CC=CCC2)ccc1[N+](=O)[O-]	ZINC000456022154	421089469	/nfs/dbraw/zinc/08/94/69/421089469.db2.gz	IJTMQAAHKVEOEH-UHFFFAOYSA-N	1	1	305.338	1.023	20	5		DDBDMO
Cc1cc(F)ccc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000488014530	421064172	/nfs/dbraw/zinc/06/41/72/421064172.db2.gz	ZBEDDJMRCWEWRA-OAHLLOKOSA-N	1	1	322.340	1.732	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+]2CCCO)c(Cl)c1	ZINC000450599218	421215763	/nfs/dbraw/zinc/21/57/63/421215763.db2.gz	SEFCRZFVKLZQAE-JTQLQIEISA-N	1	1	314.773	1.902	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1nccc(C)c1[N+](=O)[O-])C(C)C	ZINC000450605047	421216536	/nfs/dbraw/zinc/21/65/36/421216536.db2.gz	YGIDHOREOXUVAU-LBPRGKRZSA-N	1	1	324.381	1.887	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CCCC[N@H+]2CCO)n1	ZINC000450609719	421217676	/nfs/dbraw/zinc/21/76/76/421217676.db2.gz	FZSZMAYFWBSXJI-ZDUSSCGKSA-N	1	1	308.382	1.865	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000525802641	421303447	/nfs/dbraw/zinc/30/34/47/421303447.db2.gz	YTPFSXFTEOFNOK-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000525802641	421303448	/nfs/dbraw/zinc/30/34/48/421303448.db2.gz	YTPFSXFTEOFNOK-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000562351222	421355484	/nfs/dbraw/zinc/35/54/84/421355484.db2.gz	SBNFYAHJSSFMEV-MRXNPFEDSA-N	1	1	318.377	1.832	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000562850367	421420442	/nfs/dbraw/zinc/42/04/42/421420442.db2.gz	QSZMQSGRAOPNJX-GFCCVEGCSA-N	1	1	320.349	1.086	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000562850367	421420446	/nfs/dbraw/zinc/42/04/46/421420446.db2.gz	QSZMQSGRAOPNJX-GFCCVEGCSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](CCO)C[C@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965933	421431724	/nfs/dbraw/zinc/43/17/24/421431724.db2.gz	QFJRQASTGQOUDI-OLZOCXBDSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](CCO)C[C@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965933	421431727	/nfs/dbraw/zinc/43/17/27/421431727.db2.gz	QFJRQASTGQOUDI-OLZOCXBDSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000549189196	421496851	/nfs/dbraw/zinc/49/68/51/421496851.db2.gz	BEUGNSLVFWJYBU-WDEREUQCSA-N	1	1	321.381	1.701	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3CC[N@H+](C4CC4)C3)c21	ZINC000566530358	421607102	/nfs/dbraw/zinc/60/71/02/421607102.db2.gz	PRMPWZMAXKUPMJ-NSHDSACASA-N	1	1	313.361	2.434	20	5		DDBDMO
CN1C[C@@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC1=O	ZINC000518790860	421666864	/nfs/dbraw/zinc/66/68/64/421666864.db2.gz	PJZJBOZVDANUIY-NSHDSACASA-N	1	1	317.349	1.524	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC1=O	ZINC000518790860	421666867	/nfs/dbraw/zinc/66/68/67/421666867.db2.gz	PJZJBOZVDANUIY-NSHDSACASA-N	1	1	317.349	1.524	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000571281470	421702546	/nfs/dbraw/zinc/70/25/46/421702546.db2.gz	ZKUYRDAOHXXDFU-OCCSQVGLSA-N	1	1	305.334	1.305	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000556724985	421727253	/nfs/dbraw/zinc/72/72/53/421727253.db2.gz	ZGMBLVAOEIUGBU-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000558764592	421824831	/nfs/dbraw/zinc/82/48/31/421824831.db2.gz	HMHBATUQMGNQQK-NSHDSACASA-N	1	1	309.370	1.416	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000557418464	421770305	/nfs/dbraw/zinc/77/03/05/421770305.db2.gz	CSFQOPXABYETIL-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000521300912	421781184	/nfs/dbraw/zinc/78/11/84/421781184.db2.gz	GKEIASKKCOPTKE-CQSZACIVSA-N	1	1	305.378	1.998	20	5		DDBDMO
Cc1cc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000594590792	422352380	/nfs/dbraw/zinc/35/23/80/422352380.db2.gz	BUVDTJWJZDQZEN-UPJWGTAASA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1cc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000594590792	422352385	/nfs/dbraw/zinc/35/23/85/422352385.db2.gz	BUVDTJWJZDQZEN-UPJWGTAASA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCCN1CCC[N@H+](C)CC1	ZINC000611296599	422474734	/nfs/dbraw/zinc/47/47/34/422474734.db2.gz	CPZJRNRIHOKTAP-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCCN(C)CC1	ZINC000611296599	422474738	/nfs/dbraw/zinc/47/47/38/422474738.db2.gz	CPZJRNRIHOKTAP-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCC[N@@H+]1CCCN(C)CC1	ZINC000611296599	422474741	/nfs/dbraw/zinc/47/47/41/422474741.db2.gz	CPZJRNRIHOKTAP-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000345328975	272220873	/nfs/dbraw/zinc/22/08/73/272220873.db2.gz	VEJKXJXFHXAEQJ-RYUDHWBXSA-N	1	1	306.366	1.606	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2c([N+](=O)[O-])c(C)nn2C)C1	ZINC000345593300	272287579	/nfs/dbraw/zinc/28/75/79/272287579.db2.gz	MWJZELKJMAVLQA-LLVKDONJSA-N	1	1	309.370	1.098	20	5		DDBDMO
CC(=O)[C@](C)(O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000330830395	273495413	/nfs/dbraw/zinc/49/54/13/273495413.db2.gz	JNYINTUVRINJDD-OAHLLOKOSA-N	1	1	307.350	1.057	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@H](C)C1	ZINC000275372752	274272398	/nfs/dbraw/zinc/27/23/98/274272398.db2.gz	NSTMBWMPTMBHEY-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@H](C)C1	ZINC000275372752	274272400	/nfs/dbraw/zinc/27/24/00/274272400.db2.gz	NSTMBWMPTMBHEY-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000272732963	276041345	/nfs/dbraw/zinc/04/13/45/276041345.db2.gz	BYTNESJMNKSLBU-JTQLQIEISA-N	1	1	321.381	1.822	20	5		DDBDMO
C[C@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000357965273	299034817	/nfs/dbraw/zinc/03/48/17/299034817.db2.gz	QTTVCIBXTITYGH-WDEREUQCSA-N	1	1	309.370	1.321	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000364210743	300358071	/nfs/dbraw/zinc/35/80/71/300358071.db2.gz	FUQCMBKSISCLDA-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C[C@@H]21	ZINC000368596589	301061563	/nfs/dbraw/zinc/06/15/63/301061563.db2.gz	VMBVMCJIFIDKHT-HZMBPMFUSA-N	1	1	304.350	1.343	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000368835963	301093984	/nfs/dbraw/zinc/09/39/84/301093984.db2.gz	VWSTWQHUSVTRLG-CQSZACIVSA-N	1	1	307.350	1.120	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCN2CCOC[C@H]2C1	ZINC000368835963	301093987	/nfs/dbraw/zinc/09/39/87/301093987.db2.gz	VWSTWQHUSVTRLG-CQSZACIVSA-N	1	1	307.350	1.120	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000369535743	301196008	/nfs/dbraw/zinc/19/60/08/301196008.db2.gz	CDAZQCPDSRIJDA-UKRRQHHQSA-N	1	1	324.381	1.451	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC[N@@H+](CC(C)(C)O)CC1	ZINC000370421895	301335580	/nfs/dbraw/zinc/33/55/80/301335580.db2.gz	PVFROLWNQOUUIQ-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NCc1c[nH+]c2n1CCCC2	ZINC000375389467	301930115	/nfs/dbraw/zinc/93/01/15/301930115.db2.gz	RPXUCJJVSIEELQ-UHFFFAOYSA-N	1	1	314.345	1.987	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC3(CCOCC3)C2)c1	ZINC000376223751	302052047	/nfs/dbraw/zinc/05/20/47/302052047.db2.gz	CEEJUERDDHHJCC-CQSZACIVSA-N	1	1	324.381	1.045	20	5		DDBDMO
O=C(N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1cc([N+](=O)[O-])c[nH]1	ZINC000531918228	303266038	/nfs/dbraw/zinc/26/60/38/303266038.db2.gz	APWQKZBWFCKHIR-OCCSQVGLSA-N	1	1	322.365	1.296	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1	ZINC000367549474	307097085	/nfs/dbraw/zinc/09/70/85/307097085.db2.gz	KLNFEUZAKCWXDK-UHFFFAOYSA-N	1	1	309.370	1.132	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)n1	ZINC000373164191	307180687	/nfs/dbraw/zinc/18/06/87/307180687.db2.gz	DBUGOYITADFACY-JTQLQIEISA-N	1	1	307.354	1.075	20	5		DDBDMO
[NH3+]Cc1nc(C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)cs1	ZINC000564729116	308004084	/nfs/dbraw/zinc/00/40/84/308004084.db2.gz	ZKSQFERTENKJKB-UHFFFAOYSA-N	1	1	319.346	1.104	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000488728934	484215330	/nfs/dbraw/zinc/21/53/30/484215330.db2.gz	IVLIYSNHWQLVRT-YRGRVCCFSA-N	1	1	310.350	1.037	20	5		DDBDMO
COC(=O)c1ccc(OC[C@H](O)C[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000589583754	490359299	/nfs/dbraw/zinc/35/92/99/490359299.db2.gz	UMPARBKBZQQRTN-LLVKDONJSA-N	1	1	324.333	1.215	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000295641930	533764132	/nfs/dbraw/zinc/76/41/32/533764132.db2.gz	YNCGQDDXNPYBKN-GFCCVEGCSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CCCC[N@H+]2CCO)ccc1[N+](=O)[O-]	ZINC000452387917	534058083	/nfs/dbraw/zinc/05/80/83/534058083.db2.gz	IGRRYVFBYPVOES-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CC[C@H](F)C1	ZINC000451197871	534325947	/nfs/dbraw/zinc/32/59/47/534325947.db2.gz	ONRDZYRVKPIYJQ-JTQLQIEISA-N	1	1	309.297	1.937	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@H](F)C1	ZINC000451197871	534325952	/nfs/dbraw/zinc/32/59/52/534325952.db2.gz	ONRDZYRVKPIYJQ-JTQLQIEISA-N	1	1	309.297	1.937	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](CCCNc2sccc2[N+](=O)[O-])C1	ZINC000302005399	534449797	/nfs/dbraw/zinc/44/97/97/534449797.db2.gz	UONNHDRLQGKZFB-JTQLQIEISA-N	1	1	312.395	1.656	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+](CCO)Cc2cccc(F)c2)c1	ZINC000494231404	534889217	/nfs/dbraw/zinc/88/92/17/534889217.db2.gz	ROCPWERZWOZSHN-UHFFFAOYSA-N	1	1	308.313	1.425	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000490300044	528719666	/nfs/dbraw/zinc/71/96/66/528719666.db2.gz	NXDYUWPSOFCHHW-ZDUSSCGKSA-N	1	1	323.397	1.325	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000444943755	528933675	/nfs/dbraw/zinc/93/36/75/528933675.db2.gz	PQERVJMTEJPNMO-UHFFFAOYSA-N	1	1	321.381	1.655	20	5		DDBDMO
CCN(CC)C(=O)C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000748819257	700136767	/nfs/dbraw/zinc/13/67/67/700136767.db2.gz	BWKHVTHIMWCBDU-UHFFFAOYSA-N	1	1	323.349	1.324	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](n3cncn3)C2)cc1	ZINC000776879247	698145187	/nfs/dbraw/zinc/14/51/87/698145187.db2.gz	SKVWYKBZUYXXPZ-ZIAGYGMSSA-N	1	1	303.322	1.167	20	5		DDBDMO
C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000778295538	698257983	/nfs/dbraw/zinc/25/79/83/698257983.db2.gz	QRBZYAUOVZVNFY-SWHYSGLUSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000778295538	698257985	/nfs/dbraw/zinc/25/79/85/698257985.db2.gz	QRBZYAUOVZVNFY-SWHYSGLUSA-N	1	1	307.350	1.214	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@H]3C[C@@]3(CO)C2)c2c(c1)COCO2	ZINC000782607979	698749091	/nfs/dbraw/zinc/74/90/91/698749091.db2.gz	XCDXNHDBDPSXIH-DOMZBBRYSA-N	1	1	306.318	1.276	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@H]3C[C@@]3(CO)C2)c2c(c1)COCO2	ZINC000782607979	698749094	/nfs/dbraw/zinc/74/90/94/698749094.db2.gz	XCDXNHDBDPSXIH-DOMZBBRYSA-N	1	1	306.318	1.276	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000750885135	700254288	/nfs/dbraw/zinc/25/42/88/700254288.db2.gz	ZNGCPJBYCZJBMJ-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@@H]1C	ZINC000787237363	699198833	/nfs/dbraw/zinc/19/88/33/699198833.db2.gz	FTZVOTUFUCVZTN-ZWNOBZJWSA-N	1	1	318.333	1.785	20	5		DDBDMO
Cc1c(CO)cc([N+](=O)[O-])c(NCC[N@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000732567182	699562712	/nfs/dbraw/zinc/56/27/12/699562712.db2.gz	CTMPXSKEIFDPAH-UHFFFAOYSA-N	1	1	324.337	1.810	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])[C@@H](CO)c1cccc(Br)c1	ZINC000791053801	699608996	/nfs/dbraw/zinc/60/89/96/699608996.db2.gz	HGOTYGRQKUDKOW-NSHDSACASA-N	1	1	303.156	1.691	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])[C@@H](CO)c1cccc(Br)c1	ZINC000791053801	699608994	/nfs/dbraw/zinc/60/89/94/699608994.db2.gz	HGOTYGRQKUDKOW-NSHDSACASA-N	1	1	303.156	1.691	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000794981451	699839802	/nfs/dbraw/zinc/83/98/02/699839802.db2.gz	DERUTPLJMXCEIV-WDNDVIMCSA-N	1	1	306.318	1.324	20	5		DDBDMO
C[C@@H]1CN(C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])CCO1	ZINC000796115268	699913179	/nfs/dbraw/zinc/91/31/79/699913179.db2.gz	WKVJCCAKWCELIJ-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@@H]1CN(C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CCO1	ZINC000796115268	699913180	/nfs/dbraw/zinc/91/31/80/699913180.db2.gz	WKVJCCAKWCELIJ-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
O=C1NCC2(CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)O1	ZINC000801547804	700319186	/nfs/dbraw/zinc/31/91/86/700319186.db2.gz	ZOQXYUQWYULXLP-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
CO[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000751948067	700329777	/nfs/dbraw/zinc/32/97/77/700329777.db2.gz	XDHTXQPFCMLQQT-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000751948067	700329782	/nfs/dbraw/zinc/32/97/82/700329782.db2.gz	XDHTXQPFCMLQQT-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000753951469	700470942	/nfs/dbraw/zinc/47/09/42/700470942.db2.gz	VJGYJYQEDOVFNI-AWEZNQCLSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000753951469	700470943	/nfs/dbraw/zinc/47/09/43/700470943.db2.gz	VJGYJYQEDOVFNI-AWEZNQCLSA-N	1	1	308.334	1.861	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000763112324	700926009	/nfs/dbraw/zinc/92/60/09/700926009.db2.gz	IHDMSGHDHMLNEY-UHFFFAOYSA-N	1	1	304.306	1.929	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406643	701318960	/nfs/dbraw/zinc/31/89/60/701318960.db2.gz	PDVKGQFKAGFYLB-MNOVXSKESA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406643	701318961	/nfs/dbraw/zinc/31/89/61/701318961.db2.gz	PDVKGQFKAGFYLB-MNOVXSKESA-N	1	1	306.366	1.650	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)OCCn1cc[nH+]c1C	ZINC000771869512	701335020	/nfs/dbraw/zinc/33/50/20/701335020.db2.gz	CFSXOGABTXCCDI-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH2+]C[C@@H]3CCCO3)n2)s1	ZINC000843218851	702844116	/nfs/dbraw/zinc/84/41/16/702844116.db2.gz	GROYKTKMHNUFRJ-QMMMGPOBSA-N	1	1	310.335	1.975	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000869782403	703851735	/nfs/dbraw/zinc/85/17/35/703851735.db2.gz	MEENGOYVSRRAKV-JTQLQIEISA-N	1	1	313.379	1.231	20	5		DDBDMO
COC/C=C\C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000870377091	704014890	/nfs/dbraw/zinc/01/48/90/704014890.db2.gz	GWKXIWXANVUAEG-BYPUDFOVSA-N	1	1	320.345	1.915	20	5		DDBDMO
COC/C=C\C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000870377091	704014895	/nfs/dbraw/zinc/01/48/95/704014895.db2.gz	GWKXIWXANVUAEG-BYPUDFOVSA-N	1	1	320.345	1.915	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000852495440	704062360	/nfs/dbraw/zinc/06/23/60/704062360.db2.gz	KXFFXVZGFSMXHA-VHDGCEQUSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2CCc3cn[nH]c3C2)c1	ZINC000819155074	704077650	/nfs/dbraw/zinc/07/76/50/704077650.db2.gz	OKXGSMGTSRQLQO-WFASDCNBSA-N	1	1	302.334	1.498	20	5		DDBDMO
C[C@H](C[C@H]1CCCC[N@H+]1C)OC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000870786394	704131953	/nfs/dbraw/zinc/13/19/53/704131953.db2.gz	WHMOJTVPMRIXPL-GHMZBOCLSA-N	1	1	310.354	1.748	20	5		DDBDMO
Nc1ccc(N2CCC([N@H+]3CCCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000853688502	704299863	/nfs/dbraw/zinc/29/98/63/704299863.db2.gz	PGCPSMUXKSYFSU-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2cc(C)cc([N+](=O)[O-])c2)no1	ZINC000823270917	705189891	/nfs/dbraw/zinc/18/98/91/705189891.db2.gz	XYNNHTUNEOQRSE-NSHDSACASA-N	1	1	320.305	1.906	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000824964402	705567883	/nfs/dbraw/zinc/56/78/83/705567883.db2.gz	VWNOIOZLDZVTJC-AWEZNQCLSA-N	1	1	309.366	1.475	20	5		DDBDMO
CN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000825844530	705736422	/nfs/dbraw/zinc/73/64/22/705736422.db2.gz	MCYCXIWNSHGNLL-HUUCEWRRSA-N	1	1	319.361	1.323	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000826995122	705908332	/nfs/dbraw/zinc/90/83/32/705908332.db2.gz	QTXSUZQIPPIELQ-CYBMUJFWSA-N	1	1	305.334	1.930	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000826995122	705908334	/nfs/dbraw/zinc/90/83/34/705908334.db2.gz	QTXSUZQIPPIELQ-CYBMUJFWSA-N	1	1	305.334	1.930	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000827675020	706047238	/nfs/dbraw/zinc/04/72/38/706047238.db2.gz	NHDQVPLWNOXMCS-FZMZJTMJSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000827675020	706047239	/nfs/dbraw/zinc/04/72/39/706047239.db2.gz	NHDQVPLWNOXMCS-FZMZJTMJSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cn1cc(C[N@H+](C)C[C@](C)(O)c2ccccc2)c([N+](=O)[O-])n1	ZINC000877599247	706154564	/nfs/dbraw/zinc/15/45/64/706154564.db2.gz	SEDSVQLKVZKDOX-HNNXBMFYSA-N	1	1	304.350	1.668	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@](C)(O)c2ccccc2)c([N+](=O)[O-])n1	ZINC000877599247	706154566	/nfs/dbraw/zinc/15/45/66/706154566.db2.gz	SEDSVQLKVZKDOX-HNNXBMFYSA-N	1	1	304.350	1.668	20	5		DDBDMO
CC1(C)C[C@H](O)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000877754132	706200078	/nfs/dbraw/zinc/20/00/78/706200078.db2.gz	WTMBMXUPXRUMFQ-LBPRGKRZSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC1(C)C[C@H](O)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000877754132	706200080	/nfs/dbraw/zinc/20/00/80/706200080.db2.gz	WTMBMXUPXRUMFQ-LBPRGKRZSA-N	1	1	322.361	1.959	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000865998995	706589593	/nfs/dbraw/zinc/58/95/93/706589593.db2.gz	VQSYFLNACKDAHG-NSHDSACASA-N	1	1	309.366	1.861	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1	ZINC000880169731	706899394	/nfs/dbraw/zinc/89/93/94/706899394.db2.gz	ZGVRCHDNRGXRKW-CQSZACIVSA-N	1	1	319.361	1.373	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000833458975	707008624	/nfs/dbraw/zinc/00/86/24/707008624.db2.gz	RIGODNAOMYOISR-GDBMZVCRSA-N	1	1	319.361	1.182	20	5		DDBDMO
CN1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@@H+](C)CC1	ZINC000897095993	708229016	/nfs/dbraw/zinc/22/90/16/708229016.db2.gz	YKYSOGAKZPFNAB-UHFFFAOYSA-N	1	1	318.381	1.155	20	5		DDBDMO
Cc1ccnc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222611	708259897	/nfs/dbraw/zinc/25/98/97/708259897.db2.gz	WEXNUHHKLXNZFT-STQMWFEESA-N	1	1	306.366	1.334	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000897222715	708260530	/nfs/dbraw/zinc/26/05/30/708260530.db2.gz	XANUFHXQVMLLHZ-CHWSQXEVSA-N	1	1	309.341	1.769	20	5		DDBDMO
O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885956116	708670907	/nfs/dbraw/zinc/67/09/07/708670907.db2.gz	JDUDKTOKEVNENP-CQSZACIVSA-N	1	1	318.377	1.728	20	5		DDBDMO
O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885956116	708670908	/nfs/dbraw/zinc/67/09/08/708670908.db2.gz	JDUDKTOKEVNENP-CQSZACIVSA-N	1	1	318.377	1.728	20	5		DDBDMO
O=C1CCCN1C[C@@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886006452	708680447	/nfs/dbraw/zinc/68/04/47/708680447.db2.gz	RNAMWAIJCAADHY-AWEZNQCLSA-N	1	1	318.377	1.967	20	5		DDBDMO
O=C1CCCN1C[C@@H]1CCCC[N@@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886006452	708680450	/nfs/dbraw/zinc/68/04/50/708680450.db2.gz	RNAMWAIJCAADHY-AWEZNQCLSA-N	1	1	318.377	1.967	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](c3ncccn3)C2)n1	ZINC000886681122	708812816	/nfs/dbraw/zinc/81/28/16/708812816.db2.gz	SLSWNTSDWOPUBX-GFCCVEGCSA-N	1	1	302.338	1.461	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090932	713126194	/nfs/dbraw/zinc/12/61/94/713126194.db2.gz	BJPIUVKPLGRILA-ONGXEEELSA-N	1	1	310.379	1.233	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090932	713126197	/nfs/dbraw/zinc/12/61/97/713126197.db2.gz	BJPIUVKPLGRILA-ONGXEEELSA-N	1	1	310.379	1.233	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000928093323	713127334	/nfs/dbraw/zinc/12/73/34/713127334.db2.gz	BWEZXWBDDKIEJL-JQWIXIFHSA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000928093323	713127336	/nfs/dbraw/zinc/12/73/36/713127336.db2.gz	BWEZXWBDDKIEJL-JQWIXIFHSA-N	1	1	324.406	1.243	20	5		DDBDMO
CC(C)(CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000912951547	713133509	/nfs/dbraw/zinc/13/35/09/713133509.db2.gz	RGBWDCLJWRWGEP-UHFFFAOYSA-N	1	1	322.365	1.221	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C	ZINC000928438646	713195843	/nfs/dbraw/zinc/19/58/43/713195843.db2.gz	GVYAKOOSOLDLNT-GWCFXTLKSA-N	1	1	314.345	1.965	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000893941491	710893875	/nfs/dbraw/zinc/89/38/75/710893875.db2.gz	SDWBHYGDQJPRLP-SMDDNHRTSA-N	1	1	304.350	1.095	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@H]12	ZINC000902906046	710953398	/nfs/dbraw/zinc/95/33/98/710953398.db2.gz	RKCDXWKPFIFWPG-WCQYABFASA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12	ZINC000902906046	710953403	/nfs/dbraw/zinc/95/34/03/710953403.db2.gz	RKCDXWKPFIFWPG-WCQYABFASA-N	1	1	324.406	1.243	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000928565723	713230831	/nfs/dbraw/zinc/23/08/31/713230831.db2.gz	BIWCEQSBJOSXQU-CQSZACIVSA-N	1	1	306.366	1.607	20	5		DDBDMO
COc1cc(N(C)CC[N@@H+](C)CCO)c(Cl)cc1[N+](=O)[O-]	ZINC000894590760	711198389	/nfs/dbraw/zinc/19/83/89/711198389.db2.gz	LDPSRESKEDHXSS-UHFFFAOYSA-N	1	1	317.773	1.617	20	5		DDBDMO
C[N@H+]1CCN(c2nccc3ccc([N+](=O)[O-])cc32)C[C@H]1CO	ZINC000894884681	711307790	/nfs/dbraw/zinc/30/77/90/711307790.db2.gz	ILWHZOSWLIMZQZ-ZDUSSCGKSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@H]1CO	ZINC000894886092	711308990	/nfs/dbraw/zinc/30/89/90/711308990.db2.gz	ULVVCPUQDFQSPB-LBPRGKRZSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@H]1CO	ZINC000894886092	711308994	/nfs/dbraw/zinc/30/89/94/711308994.db2.gz	ULVVCPUQDFQSPB-LBPRGKRZSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@@H+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])C[C@H]1CO	ZINC000894886955	711309012	/nfs/dbraw/zinc/30/90/12/711309012.db2.gz	XUXJICKEPUKWKN-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])C[C@H]1CO	ZINC000894886955	711309015	/nfs/dbraw/zinc/30/90/15/711309015.db2.gz	XUXJICKEPUKWKN-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@H]2Cc3c[nH+]cn3C2)c([N+](=O)[O-])c1	ZINC000894996028	711356775	/nfs/dbraw/zinc/35/67/75/711356775.db2.gz	IYASMIWNUOIOCP-NSHDSACASA-N	1	1	316.317	1.544	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000913538591	713249308	/nfs/dbraw/zinc/24/93/08/713249308.db2.gz	FBZXNMBONSOCOM-QZERPFSJSA-N	1	1	301.346	1.913	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3)C[C@H]21	ZINC000895188096	711448662	/nfs/dbraw/zinc/44/86/62/711448662.db2.gz	XTTYICLKPYISAS-NHAGDIPZSA-N	1	1	313.361	1.871	20	5		DDBDMO
C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895249501	711465512	/nfs/dbraw/zinc/46/55/12/711465512.db2.gz	UVQBBJUJDQHKMM-ZANVPECISA-N	1	1	314.336	1.919	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1NCC[N@@H+]1CCC2(C1)OCCO2	ZINC000895253668	711467567	/nfs/dbraw/zinc/46/75/67/711467567.db2.gz	IZPXRBLSGRYPQC-UHFFFAOYSA-N	1	1	311.313	1.595	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1NCC[N@H+]1CCC2(C1)OCCO2	ZINC000895253668	711467569	/nfs/dbraw/zinc/46/75/69/711467569.db2.gz	IZPXRBLSGRYPQC-UHFFFAOYSA-N	1	1	311.313	1.595	20	5		DDBDMO
Cc1ccnc(NC[C@H]2CC[N@H+]2C2CCOCC2)c1[N+](=O)[O-]	ZINC000896517474	711736821	/nfs/dbraw/zinc/73/68/21/711736821.db2.gz	GLBDMMNOEJRXKV-CYBMUJFWSA-N	1	1	306.366	1.963	20	5		DDBDMO
CN1CCN(CCC[NH2+]CC[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000905033720	711914342	/nfs/dbraw/zinc/91/43/42/711914342.db2.gz	HFRFKCXLWIYIIY-MRXNPFEDSA-N	1	1	306.410	1.232	20	5		DDBDMO
O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccccc1C(F)(F)F	ZINC000905217726	711971997	/nfs/dbraw/zinc/97/19/97/711971997.db2.gz	FJPGKDGWJOPXNF-SNVBAGLBSA-N	1	1	317.267	1.677	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC[N+](=O)[O-])C1)OCc1ccccc1	ZINC000930284976	713793722	/nfs/dbraw/zinc/79/37/22/713793722.db2.gz	KAGRYUWQPMAFOJ-OAHLLOKOSA-N	1	1	321.377	1.902	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+](CC[N+](=O)[O-])C1)OCc1ccccc1	ZINC000930284976	713793724	/nfs/dbraw/zinc/79/37/24/713793724.db2.gz	KAGRYUWQPMAFOJ-OAHLLOKOSA-N	1	1	321.377	1.902	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000921681052	713841119	/nfs/dbraw/zinc/84/11/19/713841119.db2.gz	PPKIZLWIFJQNTH-SMDDNHRTSA-N	1	1	306.366	1.529	20	5		DDBDMO
COc1ccc(NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000930770385	713916169	/nfs/dbraw/zinc/91/61/69/713916169.db2.gz	WOJZUFSSDSCPJA-GXSJLCMTSA-N	1	1	308.338	1.818	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CNC[C@H]1CC[N@@H+]1C1CCOCC1	ZINC000922951787	714195978	/nfs/dbraw/zinc/19/59/78/714195978.db2.gz	RVRVTTIZIIGCLZ-OAHLLOKOSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CNC[C@H]1CC[N@H+]1C1CCOCC1	ZINC000922951787	714195979	/nfs/dbraw/zinc/19/59/79/714195979.db2.gz	RVRVTTIZIIGCLZ-OAHLLOKOSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000932644233	714373712	/nfs/dbraw/zinc/37/37/12/714373712.db2.gz	HKPUXNHGSIEVEU-GXTWGEPZSA-N	1	1	308.334	1.513	20	5		DDBDMO
Cn1cc(CN2CCC([C@@H]3CCC[NH2+]CC3)CC2)c([N+](=O)[O-])n1	ZINC000923505348	714383017	/nfs/dbraw/zinc/38/30/17/714383017.db2.gz	BTGCDINGNONGSD-CYBMUJFWSA-N	1	1	321.425	1.930	20	5		DDBDMO
C[C@]12C[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C[C@H]1[C@H]1C=C[C@@H]2C1	ZINC000933705250	714652232	/nfs/dbraw/zinc/65/22/32/714652232.db2.gz	YLHKBCFTWRHOJX-UICACZKSSA-N	1	1	315.373	1.901	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2C2OCCO2)c1	ZINC000933910134	714699830	/nfs/dbraw/zinc/69/98/30/714699830.db2.gz	SFYMNDXFLNDUHJ-CQSZACIVSA-N	1	1	308.334	1.811	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H](O)[C@@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580224	714857899	/nfs/dbraw/zinc/85/78/99/714857899.db2.gz	XDEASSXBUQIEQA-STQMWFEESA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@H](O)[C@@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580224	714857901	/nfs/dbraw/zinc/85/79/01/714857901.db2.gz	XDEASSXBUQIEQA-STQMWFEESA-N	1	1	311.313	1.328	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000935429749	715053141	/nfs/dbraw/zinc/05/31/41/715053141.db2.gz	FJEUQCISPZCDKZ-GJZGRUSLSA-N	1	1	321.377	1.129	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)C[C@H]21	ZINC000347409206	719475088	/nfs/dbraw/zinc/47/50/88/719475088.db2.gz	GYAWUDBSYJFAFF-CHWSQXEVSA-N	1	1	315.333	1.057	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1N1CC2(C1)CC[N@@H+](CC1CC1)C2	ZINC001164768091	721296017	/nfs/dbraw/zinc/29/60/17/721296017.db2.gz	FGQNMNLOGARUAG-UHFFFAOYSA-N	1	1	303.366	1.494	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CCc3[nH+]ccn3CC2)n1	ZINC001167182316	732809522	/nfs/dbraw/zinc/80/95/22/732809522.db2.gz	RJEDNTZVGYGEOU-UHFFFAOYSA-N	1	1	317.305	1.036	20	5		DDBDMO
COc1nc(NCC[NH+]2CCSCC2)nc(C)c1[N+](=O)[O-]	ZINC001167833088	738957139	/nfs/dbraw/zinc/95/71/39/738957139.db2.gz	YQIKHIKDRBKMSX-UHFFFAOYSA-N	1	1	313.383	1.163	20	5		DDBDMO
Cc1coc(C)c1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001126580288	741059266	/nfs/dbraw/zinc/05/92/66/741059266.db2.gz	UMIXYGAPILHFNA-UHFFFAOYSA-N	1	1	321.337	1.058	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)c1ccn[nH]1	ZINC001031557866	747029851	/nfs/dbraw/zinc/02/98/51/747029851.db2.gz	JKKMRYGBCUHYFP-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCn1cnnc1	ZINC001197458643	747179469	/nfs/dbraw/zinc/17/94/69/747179469.db2.gz	KMNSCUVRAZXQKW-LLVKDONJSA-N	1	1	318.337	1.145	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCn1cnnc1	ZINC001197458643	747179472	/nfs/dbraw/zinc/17/94/72/747179472.db2.gz	KMNSCUVRAZXQKW-LLVKDONJSA-N	1	1	318.337	1.145	20	5		DDBDMO
Cc1cccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001031661953	747336666	/nfs/dbraw/zinc/33/66/66/747336666.db2.gz	OEAAVZARBAGJJB-HUUCEWRRSA-N	1	1	303.362	1.208	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccsc2)CC1	ZINC001005381493	749931745	/nfs/dbraw/zinc/93/17/45/749931745.db2.gz	LQZKXKUPXPQCDC-ZIAGYGMSSA-N	1	1	323.418	1.836	20	5		DDBDMO
CCOC(=O)[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CCOCC1	ZINC001168977385	762147120	/nfs/dbraw/zinc/14/71/20/762147120.db2.gz	BDBHWWROLXYGIF-MRVWCRGKSA-N	1	1	314.382	1.380	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CCCN(c3ncccn3)CC2)C1	ZINC001169036157	762191653	/nfs/dbraw/zinc/19/16/53/762191653.db2.gz	NGALCJUFXDFBQD-KBPBESRZSA-N	1	1	305.382	1.434	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169022240	762200645	/nfs/dbraw/zinc/20/06/45/762200645.db2.gz	RDIJWWVYPTYAHZ-MELADBBJSA-N	1	1	308.382	1.407	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169022240	762200649	/nfs/dbraw/zinc/20/06/49/762200649.db2.gz	RDIJWWVYPTYAHZ-MELADBBJSA-N	1	1	308.382	1.407	20	5		DDBDMO
O=C([C@@H]1CCCC[N@@H+]1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1)N1CCCC1	ZINC001169024991	762202489	/nfs/dbraw/zinc/20/24/89/762202489.db2.gz	IKACOTZHJRNTKI-KFWWJZLASA-N	1	1	309.410	1.909	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001097203795	756973701	/nfs/dbraw/zinc/97/37/01/756973701.db2.gz	XAYLIBCXLWURNG-OKILXGFUSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001020139366	760614050	/nfs/dbraw/zinc/61/40/50/760614050.db2.gz	ZIVPQDLASROERU-KBUPBQIOSA-N	1	1	303.362	1.397	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cs1	ZINC001086363467	761492446	/nfs/dbraw/zinc/49/24/46/761492446.db2.gz	VWOWVDVOMRNJMQ-FMKGYKFTSA-N	1	1	323.418	1.706	20	5		DDBDMO
O=C(NC1(C2CC[NH+](CCC3CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000151411	761544150	/nfs/dbraw/zinc/54/41/50/761544150.db2.gz	VLNMDCPMDOSCGX-HUUCEWRRSA-N	1	1	321.421	1.813	20	5		DDBDMO
CC(C)CC[NH+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001050518560	763695373	/nfs/dbraw/zinc/69/53/73/763695373.db2.gz	BWSWBGICSNVRBQ-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
COc1ccc(C[C@@H](C)N2C[C@@H]3C[C@H]2C[N@H+]3C)c([N+](=O)[O-])c1	ZINC001170354415	766261659	/nfs/dbraw/zinc/26/16/59/766261659.db2.gz	KWEOFSBBEJTLCJ-XBFCOCLRSA-N	1	1	305.378	1.923	20	5		DDBDMO
CC(=O)Nc1ccc(-n2[nH]c(=O)c(CC[NH3+])c2C)cc1[N+](=O)[O-]	ZINC001170342129	766274749	/nfs/dbraw/zinc/27/47/49/766274749.db2.gz	AEWXPLABRUJOTL-UHFFFAOYSA-N	1	1	319.321	1.254	20	5		DDBDMO
CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1c([N+](=O)[O-])ncn1C	ZINC001048489267	769446393	/nfs/dbraw/zinc/44/63/93/769446393.db2.gz	IFGPRPDYABGLDO-CLLJXQQHSA-N	1	1	321.381	1.207	20	5		DDBDMO
CC[C@](N)(CO)Nc1ccc([N+](=O)[O-])c(OCC[NH+](C)C)c1	ZINC001170863054	771774148	/nfs/dbraw/zinc/77/41/48/771774148.db2.gz	LNFRIWZAAFARKE-CQSZACIVSA-N	1	1	312.370	1.004	20	5		DDBDMO
O=C1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCN1	ZINC001172906400	776917058	/nfs/dbraw/zinc/91/70/58/776917058.db2.gz	XQBSTTHIZSYPLK-CQSZACIVSA-N	1	1	303.362	1.664	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101875467	777633342	/nfs/dbraw/zinc/63/33/42/777633342.db2.gz	XOYJDUAUWIRRFQ-UHFFFAOYSA-N	1	1	318.337	1.065	20	5		DDBDMO
C[C@](CO)([NH2+]Cc1ccnc(N)c1)c1cccc([N+](=O)[O-])c1	ZINC001175322373	777750645	/nfs/dbraw/zinc/75/06/45/777750645.db2.gz	CHLBPYAMKBIFBZ-OAHLLOKOSA-N	1	1	302.334	1.569	20	5		DDBDMO
COC[C@H](O)C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-]	ZINC001178571300	779105634	/nfs/dbraw/zinc/10/56/34/779105634.db2.gz	NSUQUSXMJMQFMR-MRVPVSSYSA-N	1	1	319.155	1.454	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001116491562	780514760	/nfs/dbraw/zinc/51/47/60/780514760.db2.gz	UITGZBNXQJEUAI-BXUZGUMPSA-N	1	1	307.350	1.216	20	5		DDBDMO
COC(=O)c1cnc(NCCn2cc[nH+]c2C)c([N+](=O)[O-])c1	ZINC001156006943	862625950	/nfs/dbraw/zinc/62/59/50/862625950.db2.gz	HEFJVYBJDIBCAX-UHFFFAOYSA-N	1	1	305.294	1.393	20	5		DDBDMO
COc1nc(N[C@H]2CC[N@H+](C3CCC3)C2)nc(OC)c1[N+](=O)[O-]	ZINC001161177734	859979378	/nfs/dbraw/zinc/97/93/78/859979378.db2.gz	SMGNFEVBFCHPOB-VIFPVBQESA-N	1	1	323.353	1.441	20	5		DDBDMO
CN1CC[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1=O	ZINC001156508079	863111297	/nfs/dbraw/zinc/11/12/97/863111297.db2.gz	JUZJFUACAVSJOB-MALLOTDXSA-N	1	1	305.338	1.165	20	5		DDBDMO
Cc1ccc(C)c(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157760341	864111106	/nfs/dbraw/zinc/11/11/06/864111106.db2.gz	CWYRIYCQZNIGBE-HUUCEWRRSA-N	1	1	305.378	1.565	20	5		DDBDMO
C[NH+](C)Cc1ncccc1O[C@@H](C[N+](=O)[O-])c1cccnc1	ZINC001225276893	881756935	/nfs/dbraw/zinc/75/69/35/881756935.db2.gz	BNVPRQSNWCMMDU-HNNXBMFYSA-N	1	1	302.334	1.935	20	5		DDBDMO
Cc1nnc(CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)o1	ZINC001161712912	866926790	/nfs/dbraw/zinc/92/67/90/866926790.db2.gz	BFVKTXPKGFPDFZ-SNAWJCMRSA-N	1	1	304.310	1.826	20	5		DDBDMO
COc1c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC001321043545	867257749	/nfs/dbraw/zinc/25/77/49/867257749.db2.gz	SSDMQDCDWKYZBJ-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC001324437767	867280925	/nfs/dbraw/zinc/28/09/25/867280925.db2.gz	BXZIUFYWYHXUNM-GJZGRUSLSA-N	1	1	319.361	1.325	20	5		DDBDMO
CCCC[C@H](Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(N)=O	ZINC001162282462	867406283	/nfs/dbraw/zinc/40/62/83/867406283.db2.gz	VTNPLPHXPNGABB-GUOLPTJISA-N	1	1	321.381	1.978	20	5		DDBDMO
Cn1nnnc1C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC001336843046	869178523	/nfs/dbraw/zinc/17/85/23/869178523.db2.gz	QKSZHHLAVVEVMI-UHFFFAOYSA-N	1	1	320.328	1.637	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@@H]3COC[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC001165269973	869481734	/nfs/dbraw/zinc/48/17/34/869481734.db2.gz	ZJKQUQNYGDUGGP-JRFBKZHLSA-N	1	1	318.377	1.995	20	5		DDBDMO
COC(=O)N1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC001338246558	869882467	/nfs/dbraw/zinc/88/24/67/869882467.db2.gz	GQIMHRXUKISMAA-UHFFFAOYSA-N	1	1	323.349	1.748	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC001338246558	869882481	/nfs/dbraw/zinc/88/24/81/869882481.db2.gz	GQIMHRXUKISMAA-UHFFFAOYSA-N	1	1	323.349	1.748	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC001339318229	870444102	/nfs/dbraw/zinc/44/41/02/870444102.db2.gz	SPVRSVWKEFGSQB-RWMBFGLXSA-N	1	1	319.361	1.673	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)CC[N@H+]1C	ZINC001302600323	871074674	/nfs/dbraw/zinc/07/46/74/871074674.db2.gz	AYBYDPBOJBLTRN-MRVPVSSYSA-N	1	1	315.761	1.384	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4nn[nH]n4)C3)nc2c1	ZINC001308035713	871465784	/nfs/dbraw/zinc/46/57/84/871465784.db2.gz	RULSHLPCYRZOIF-MRVPVSSYSA-N	1	1	315.293	1.239	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CC[C@@H](c4nn[nH]n4)C3)nc2c1	ZINC001308035713	871465790	/nfs/dbraw/zinc/46/57/90/871465790.db2.gz	RULSHLPCYRZOIF-MRVPVSSYSA-N	1	1	315.293	1.239	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC[C@H](C)C1	ZINC001318812831	872284577	/nfs/dbraw/zinc/28/45/77/872284577.db2.gz	GKXFWXGWZHEBPG-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
CC(C)Cn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](C)C(C)(C)C1	ZINC001347610107	874209925	/nfs/dbraw/zinc/20/99/25/874209925.db2.gz	BPOLUPLRXZOPJA-LBPRGKRZSA-N	1	1	324.429	1.802	20	5		DDBDMO
CC(C)(C(=O)NCC[NH+]1CC=CC1)c1ccccc1[N+](=O)[O-]	ZINC001347803094	874277519	/nfs/dbraw/zinc/27/75/19/874277519.db2.gz	OPPCZHHECBDLAA-UHFFFAOYSA-N	1	1	303.362	1.860	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC001348031229	874339330	/nfs/dbraw/zinc/33/93/30/874339330.db2.gz	IQROKTLJSHSKOU-MWLCHTKSSA-N	1	1	302.338	1.532	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3nc4c(cccc4[N+](=O)[O-])o3)[C@H]1CC(=O)C2	ZINC001227237081	882925319	/nfs/dbraw/zinc/92/53/19/882925319.db2.gz	CXVVKDLJEIZCCS-RLCGTCKNSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nc4c(cccc4[N+](=O)[O-])o3)[C@H]1CC(=O)C2	ZINC001227237081	882925335	/nfs/dbraw/zinc/92/53/35/882925335.db2.gz	CXVVKDLJEIZCCS-RLCGTCKNSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[C@@H](C(=O)OCc1cn(C)nc1[N+](=O)[O-])[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC001349972667	875483820	/nfs/dbraw/zinc/48/38/20/875483820.db2.gz	WZADWBDAQNETCY-AXFHLTTASA-N	1	1	310.354	1.633	20	5		DDBDMO
CC(C)OCCC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001227258981	882939625	/nfs/dbraw/zinc/93/96/25/882939625.db2.gz	ZOLVKAQUZLRDGZ-ZIAGYGMSSA-N	1	1	313.398	1.047	20	5		DDBDMO
COC(=O)[C@H](O[C@@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC001223644520	881039219	/nfs/dbraw/zinc/03/92/19/881039219.db2.gz	VHJWCLKWPXEDKR-BXUZGUMPSA-N	1	1	308.334	1.920	20	5		DDBDMO
COc1cccc(COCC[N@@H+]2CC[C@@H](OC)C2)c1[N+](=O)[O-]	ZINC001223811884	881107024	/nfs/dbraw/zinc/10/70/24/881107024.db2.gz	XDYPEMPDTQQWKD-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[N@H+]1CCC[C@H](Oc2n[nH]c(=O)c3ccc([N+](=O)[O-])cc32)C1	ZINC001229365109	883947302	/nfs/dbraw/zinc/94/73/02/883947302.db2.gz	RDQPMTDMOCXZGN-JTQLQIEISA-N	1	1	304.306	1.717	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@@H](C)Oc1[nH+][nH]cc2nncc1-2	ZINC001230900241	885027133	/nfs/dbraw/zinc/02/71/33/885027133.db2.gz	FYBTYPYSOCGVKM-SSDOTTSWSA-N	1	1	303.282	1.234	20	5		DDBDMO
COc1cc(N2CCC([N@H+](C)C[C@H](C)N)CC2)ccc1[N+](=O)[O-]	ZINC001246982464	893055284	/nfs/dbraw/zinc/05/52/84/893055284.db2.gz	VRQPYLAFZWSKDS-LBPRGKRZSA-N	1	1	322.409	1.851	20	5		DDBDMO
COc1cc(N2CCC([N@@H+](C)C[C@H](C)N)CC2)ccc1[N+](=O)[O-]	ZINC001246982464	893055305	/nfs/dbraw/zinc/05/53/05/893055305.db2.gz	VRQPYLAFZWSKDS-LBPRGKRZSA-N	1	1	322.409	1.851	20	5		DDBDMO
C[N@@H+](CCN1CCOCC1)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254599663	896523939	/nfs/dbraw/zinc/52/39/39/896523939.db2.gz	OFHWZAYEFUHVMX-INIZCTEOSA-N	1	1	305.378	1.326	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCCC3(C1)OCCO3)C2	ZINC001254602382	896526357	/nfs/dbraw/zinc/52/63/57/896526357.db2.gz	FEYNJGRFGKTPLU-OAHLLOKOSA-N	1	1	304.346	1.901	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC001261510243	899612514	/nfs/dbraw/zinc/61/25/14/899612514.db2.gz	SCMLMINJMVXOKP-AWEZNQCLSA-N	1	1	321.352	1.973	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)NCc3ccccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC001263067932	900480679	/nfs/dbraw/zinc/48/06/79/900480679.db2.gz	ACIKCYSPHOXWOY-CJNGLKHVSA-N	1	1	318.377	1.688	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC001263996117	900865208	/nfs/dbraw/zinc/86/52/08/900865208.db2.gz	STGZXTBJEIJNCO-CYUUQNCZSA-N	1	1	319.361	1.085	20	5		DDBDMO
CC(C)(C)CCC[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001316631068	908416168	/nfs/dbraw/zinc/41/61/68/908416168.db2.gz	RIRRWBQEVQFGBW-AAVRWANBSA-N	1	1	311.426	1.962	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000249478136	282158989	/nfs/dbraw/zinc/15/89/89/282158989.db2.gz	AKILFUQAIZUYFN-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC000444257502	529465054	/nfs/dbraw/zinc/46/50/54/529465054.db2.gz	DKKHMQNZYACXJE-LLVKDONJSA-N	1	1	307.354	1.047	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000295611722	529504206	/nfs/dbraw/zinc/50/42/06/529504206.db2.gz	DEXGORMKOFCEOI-JTQLQIEISA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)cccc1[N+](=O)[O-]	ZINC000452353503	231358221	/nfs/dbraw/zinc/35/82/21/231358221.db2.gz	UPSHHOQMHJLESM-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC(C)(C)C[N@@H+](CCCO)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090529636	185300727	/nfs/dbraw/zinc/30/07/27/185300727.db2.gz	RESPYIPAROTNFD-UHFFFAOYSA-N	1	1	311.382	1.487	20	5		DDBDMO
CCOC(=O)[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090552549	185302668	/nfs/dbraw/zinc/30/26/68/185302668.db2.gz	WWEADVNLVZWENF-LBPRGKRZSA-N	1	1	323.349	1.032	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000255640748	282271769	/nfs/dbraw/zinc/27/17/69/282271769.db2.gz	TYDHVVOLCGIPTR-XHPSBEMXSA-N	1	1	301.346	1.915	20	5		DDBDMO
C[N@H+](Cc1cccnc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000299352075	530006203	/nfs/dbraw/zinc/00/62/03/530006203.db2.gz	AHLWKJXPERRNTK-OAHLLOKOSA-N	1	1	317.345	1.862	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@H](O)CC1	ZINC000293025984	282361311	/nfs/dbraw/zinc/36/13/11/282361311.db2.gz	FVSVUIIQRSXRBT-STQMWFEESA-N	1	1	310.350	1.181	20	5		DDBDMO
CC1=CC[N@@H+](CCNc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000358341118	299125323	/nfs/dbraw/zinc/12/53/23/299125323.db2.gz	HPTZBMKFADPCQL-UHFFFAOYSA-N	1	1	304.350	1.758	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000272621874	210023051	/nfs/dbraw/zinc/02/30/51/210023051.db2.gz	UVHHPDIMZDTJPU-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(NCCC[NH+]1CCCCC1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272614322	210015033	/nfs/dbraw/zinc/01/50/33/210015033.db2.gz	RVQNUXXSJXNLJQ-UHFFFAOYSA-N	1	1	307.350	1.906	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000272609438	210009321	/nfs/dbraw/zinc/00/93/21/210009321.db2.gz	SDKVKSJVSJUMLD-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(CC(=O)NCC[N@@H+]2CC=CCC2)cccc1[N+](=O)[O-]	ZINC000279910599	215228876	/nfs/dbraw/zinc/22/88/76/215228876.db2.gz	FJRSNGHWPQYCLV-UHFFFAOYSA-N	1	1	303.362	1.824	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@H]2C(N)=O)ncc1[N+](=O)[O-]	ZINC000266851792	186359025	/nfs/dbraw/zinc/35/90/25/186359025.db2.gz	RFQKWIGISGMCSF-NSHDSACASA-N	1	1	307.354	1.050	20	5		DDBDMO
CNc1ccc(C(=O)NCCC[N@@H+](C)CCOC)cc1[N+](=O)[O-]	ZINC000041423271	352307254	/nfs/dbraw/zinc/30/72/54/352307254.db2.gz	YSBJFTLKGRNYRH-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
CCNC(=O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665094	191211477	/nfs/dbraw/zinc/21/14/77/191211477.db2.gz	CCOAJPLKMIWBFW-NSHDSACASA-N	1	1	307.354	1.002	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000072986873	191265787	/nfs/dbraw/zinc/26/57/87/191265787.db2.gz	AVNOIIBWGRTLRJ-SMDDNHRTSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000072986873	191265789	/nfs/dbraw/zinc/26/57/89/191265789.db2.gz	AVNOIIBWGRTLRJ-SMDDNHRTSA-N	1	1	307.350	1.493	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000072713777	353210851	/nfs/dbraw/zinc/21/08/51/353210851.db2.gz	HHDYVPXUJRPYAC-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000072713777	353210854	/nfs/dbraw/zinc/21/08/54/353210854.db2.gz	HHDYVPXUJRPYAC-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@@H+](Cc1c(F)cccc1[N+](=O)[O-])C2	ZINC000072832171	353220082	/nfs/dbraw/zinc/22/00/82/353220082.db2.gz	WTLYIHFJKBJXEQ-HNNXBMFYSA-N	1	1	307.325	1.836	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@H+](Cc1c(F)cccc1[N+](=O)[O-])C2	ZINC000072832171	353220085	/nfs/dbraw/zinc/22/00/85/353220085.db2.gz	WTLYIHFJKBJXEQ-HNNXBMFYSA-N	1	1	307.325	1.836	20	5		DDBDMO
C[N@H+](Cc1ccccc1F)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174655784	198365174	/nfs/dbraw/zinc/36/51/74/198365174.db2.gz	ASKIYJOPALFYLA-ZDUSSCGKSA-N	1	1	308.313	1.423	20	5		DDBDMO
CCCC(=O)NC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000174841116	198392491	/nfs/dbraw/zinc/39/24/91/198392491.db2.gz	FOOUMIHTMAYTJY-ZDUSSCGKSA-N	1	1	323.397	1.420	20	5		DDBDMO
Cc1cc(N2CCCC[C@H]2C[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000080605365	353617776	/nfs/dbraw/zinc/61/77/76/353617776.db2.gz	KIHVQEVFZOYEHL-AWEZNQCLSA-N	1	1	320.393	1.989	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)CN1CCOCC1	ZINC000083245273	353708778	/nfs/dbraw/zinc/70/87/78/353708778.db2.gz	ZKFPPDTWCDGLCT-KGLIPLIRSA-N	1	1	323.393	1.281	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000093333451	353895364	/nfs/dbraw/zinc/89/53/64/353895364.db2.gz	ILPWCNORGBGEOA-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000093333451	353895367	/nfs/dbraw/zinc/89/53/67/353895367.db2.gz	ILPWCNORGBGEOA-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000142016684	354143507	/nfs/dbraw/zinc/14/35/07/354143507.db2.gz	JSSYBNYWENUBOJ-LBPRGKRZSA-N	1	1	304.350	1.609	20	5		DDBDMO
Nc1ccc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000142256813	354144347	/nfs/dbraw/zinc/14/43/47/354144347.db2.gz	KYJHIUBYIVXTPU-GFCCVEGCSA-N	1	1	304.350	1.487	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CO)CC1	ZINC000293253726	354454775	/nfs/dbraw/zinc/45/47/75/354454775.db2.gz	UBZSOAFOXWTKCS-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CO)CC1	ZINC000293253726	354454779	/nfs/dbraw/zinc/45/47/79/354454779.db2.gz	UBZSOAFOXWTKCS-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@](CO)(OC)C1	ZINC000401789581	354667186	/nfs/dbraw/zinc/66/71/86/354667186.db2.gz	VRDBDKKOTNWLNF-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@](CO)(OC)C1	ZINC000401789581	354667187	/nfs/dbraw/zinc/66/71/87/354667187.db2.gz	VRDBDKKOTNWLNF-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000587862311	354886361	/nfs/dbraw/zinc/88/63/61/354886361.db2.gz	ZYLVHXOSICBFEU-OCCSQVGLSA-N	1	1	309.341	1.769	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1	ZINC000346292086	283058377	/nfs/dbraw/zinc/05/83/77/283058377.db2.gz	AZGNKBRZTKIUHA-MRXNPFEDSA-N	1	1	321.352	1.831	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@H]2CN1c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000589574575	355002161	/nfs/dbraw/zinc/00/21/61/355002161.db2.gz	BNBTUNTVSHIXCL-MNOVXSKESA-N	1	1	319.365	1.152	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000589497769	354996675	/nfs/dbraw/zinc/99/66/75/354996675.db2.gz	APWFZJLGSMQYJC-LBPRGKRZSA-N	1	1	321.377	1.907	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000590010570	355040137	/nfs/dbraw/zinc/04/01/37/355040137.db2.gz	PDPQJENEMDJWFL-FZMZJTMJSA-N	1	1	304.350	1.169	20	5		DDBDMO
COC(=O)COc1ccc(C[NH+]2CC(C3CC3)C2)cc1[N+](=O)[O-]	ZINC000589736761	355017649	/nfs/dbraw/zinc/01/76/49/355017649.db2.gz	JIKPYURMENZQSK-UHFFFAOYSA-N	1	1	320.345	1.988	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)[C@H]2C1	ZINC000590446513	355099126	/nfs/dbraw/zinc/09/91/26/355099126.db2.gz	WBWYIZYCOOEZEF-RISCZKNCSA-N	1	1	323.780	1.953	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590446551	355099668	/nfs/dbraw/zinc/09/96/68/355099668.db2.gz	UJAAVCQKXDYSIK-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000592196508	355533455	/nfs/dbraw/zinc/53/34/55/355533455.db2.gz	CBXZXDGZKCIPFD-OLZOCXBDSA-N	1	1	308.334	1.259	20	5		DDBDMO
CCCN(C(=O)c1nn(CC)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592829529	355705774	/nfs/dbraw/zinc/70/57/74/355705774.db2.gz	PXAUPDBGVILBPO-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC([N@@H+]3CC[C@@H](O)C3)C1)CCCC2	ZINC000593503944	355905772	/nfs/dbraw/zinc/90/57/72/355905772.db2.gz	NHLLIXKXYJLILV-CYBMUJFWSA-N	1	1	318.377	1.124	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC([N@H+]3CC[C@@H](O)C3)C1)CCCC2	ZINC000593503944	355905773	/nfs/dbraw/zinc/90/57/73/355905773.db2.gz	NHLLIXKXYJLILV-CYBMUJFWSA-N	1	1	318.377	1.124	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593578991	355933118	/nfs/dbraw/zinc/93/31/18/355933118.db2.gz	RQBUIIFUODOSOX-QWRGUYRKSA-N	1	1	309.341	1.827	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C(C)(C)C1	ZINC000593876136	356036186	/nfs/dbraw/zinc/03/61/86/356036186.db2.gz	ONQBZINNWMQJFM-UHFFFAOYSA-N	1	1	310.354	1.106	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C(C)(C)C1	ZINC000593876136	356036191	/nfs/dbraw/zinc/03/61/91/356036191.db2.gz	ONQBZINNWMQJFM-UHFFFAOYSA-N	1	1	310.354	1.106	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000594617035	356267369	/nfs/dbraw/zinc/26/73/69/356267369.db2.gz	ZLVXERSBHYTLKY-JTQLQIEISA-N	1	1	308.334	1.711	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1CC1	ZINC000594617035	356267372	/nfs/dbraw/zinc/26/73/72/356267372.db2.gz	ZLVXERSBHYTLKY-JTQLQIEISA-N	1	1	308.334	1.711	20	5		DDBDMO
Cc1[nH+]c2c(n1CCO)CC[C@@H](Nc1ncccc1[N+](=O)[O-])C2	ZINC000594873863	356346469	/nfs/dbraw/zinc/34/64/69/356346469.db2.gz	OFCXOMQMBAALMR-LLVKDONJSA-N	1	1	317.349	1.456	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2CC[NH+](CCc3cn[nH]n3)CC2)cc1	ZINC000595329741	356450720	/nfs/dbraw/zinc/45/07/20/356450720.db2.gz	BVMKLPWPZPBATH-UHFFFAOYSA-N	1	1	317.349	1.799	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595494872	356517667	/nfs/dbraw/zinc/51/76/67/356517667.db2.gz	CMSZEHUVAJISER-LBPRGKRZSA-N	1	1	310.354	1.629	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595494872	356517670	/nfs/dbraw/zinc/51/76/70/356517670.db2.gz	CMSZEHUVAJISER-LBPRGKRZSA-N	1	1	310.354	1.629	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1[N+](=O)[O-]	ZINC000595528217	356534450	/nfs/dbraw/zinc/53/44/50/356534450.db2.gz	PYZVJSDWAHZNQM-UTUOFQBUSA-N	1	1	311.338	1.253	20	5		DDBDMO
C[C@H]1COC2(CCC2)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595683296	356608550	/nfs/dbraw/zinc/60/85/50/356608550.db2.gz	WKMXAJAEDLSMMM-LBPRGKRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@H]1COC2(CCC2)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595683296	356608554	/nfs/dbraw/zinc/60/85/54/356608554.db2.gz	WKMXAJAEDLSMMM-LBPRGKRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@H]2COC[C@@]2(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000595756458	356638484	/nfs/dbraw/zinc/63/84/84/356638484.db2.gz	GGPQELHCEMFEBK-BLLLJJGKSA-N	1	1	319.361	1.526	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595836581	356671662	/nfs/dbraw/zinc/67/16/62/356671662.db2.gz	WTHODXSOAQQDCG-OLZOCXBDSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595836581	356671664	/nfs/dbraw/zinc/67/16/64/356671664.db2.gz	WTHODXSOAQQDCG-OLZOCXBDSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595871946	356686691	/nfs/dbraw/zinc/68/66/91/356686691.db2.gz	IXWCYTFQLSDQEG-BMIGLBTASA-N	1	1	307.350	1.144	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H](C3CC[NH2+]CC3)C2)c1[N+](=O)[O-]	ZINC000595935837	356711744	/nfs/dbraw/zinc/71/17/44/356711744.db2.gz	WBIMUMFRVSLZOU-GFCCVEGCSA-N	1	1	321.381	1.478	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596163183	356797827	/nfs/dbraw/zinc/79/78/27/356797827.db2.gz	QDQGZGPQBRBEEW-RNCFNFMXSA-N	1	1	304.350	1.588	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CCC(CO)(CO)C2)cc1[N+](=O)[O-]	ZINC000597218058	357097481	/nfs/dbraw/zinc/09/74/81/357097481.db2.gz	GIBOPDLPIKOLFP-UHFFFAOYSA-N	1	1	308.378	1.895	20	5		DDBDMO
CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597945617	357394126	/nfs/dbraw/zinc/39/41/26/357394126.db2.gz	JXKBXNZHCYLSJP-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000598647126	357668655	/nfs/dbraw/zinc/66/86/55/357668655.db2.gz	BUTVSAKFMWVEFV-OLZOCXBDSA-N	1	1	324.377	1.933	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)c1	ZINC000599631897	357999055	/nfs/dbraw/zinc/99/90/55/357999055.db2.gz	DWLWQOPWDGJMHT-ZCCHDVMBSA-N	1	1	324.402	1.959	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)n1	ZINC000600229969	358163156	/nfs/dbraw/zinc/16/31/56/358163156.db2.gz	MFWIODXSOJTAKM-LBPRGKRZSA-N	1	1	321.381	1.465	20	5		DDBDMO
Nc1c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-]	ZINC000600474578	358234796	/nfs/dbraw/zinc/23/47/96/358234796.db2.gz	YZZPAVIUFPFLPJ-LBPRGKRZSA-N	1	1	318.377	1.924	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000600808287	358320204	/nfs/dbraw/zinc/32/02/04/358320204.db2.gz	KNBQDRMXMPJFOQ-VIFPVBQESA-N	1	1	313.741	1.045	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNc2ncc(F)cc2[N+](=O)[O-])C1	ZINC000601101230	358402753	/nfs/dbraw/zinc/40/27/53/358402753.db2.gz	UPIAJOCKLFIRBA-LBPRGKRZSA-N	1	1	312.345	1.898	20	5		DDBDMO
C[C@@H](O)[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601176307	358434721	/nfs/dbraw/zinc/43/47/21/358434721.db2.gz	USUQYTQOSAPINB-MEBBXXQBSA-N	1	1	303.318	1.729	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C[C@@H]2C1	ZINC000601185151	358438146	/nfs/dbraw/zinc/43/81/46/358438146.db2.gz	PEDDUJCPVSNQKN-MNOVXSKESA-N	1	1	304.350	1.082	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(C)([NH+]3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000601739848	358673295	/nfs/dbraw/zinc/67/32/95/358673295.db2.gz	PYPGBZZYANVXTC-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000602143169	358843101	/nfs/dbraw/zinc/84/31/01/358843101.db2.gz	RIVSSEKLGHGIIR-HNNXBMFYSA-N	1	1	319.361	1.669	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])n1	ZINC000602837065	359228135	/nfs/dbraw/zinc/22/81/35/359228135.db2.gz	SSLCJSSRUCPKKP-MJBXVCDLSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@H](C2CCC2)C1	ZINC000602843256	359231706	/nfs/dbraw/zinc/23/17/06/359231706.db2.gz	ZLUOECNMCCAGHE-CQSZACIVSA-N	1	1	308.382	1.848	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C1CC1	ZINC000602869366	359252965	/nfs/dbraw/zinc/25/29/65/359252965.db2.gz	JORHITMDPBYIKP-QWHCGFSZSA-N	1	1	322.365	1.231	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602820571	359216017	/nfs/dbraw/zinc/21/60/17/359216017.db2.gz	GTRVUIILGWYCTH-GFCCVEGCSA-N	1	1	323.397	1.013	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@@H]1CC1CCC1	ZINC000602830975	359222563	/nfs/dbraw/zinc/22/25/63/359222563.db2.gz	DNDYQFLUYXYZME-AWEZNQCLSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@@H]1CC1CCC1	ZINC000602830975	359222567	/nfs/dbraw/zinc/22/25/67/359222567.db2.gz	DNDYQFLUYXYZME-AWEZNQCLSA-N	1	1	308.382	1.991	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCn2cc(C[NH+]3CCCC3)nn2)cc1	ZINC000603201462	359476717	/nfs/dbraw/zinc/47/67/17/359476717.db2.gz	OFEBVRIBSCKIGZ-UHFFFAOYSA-N	1	1	317.349	1.861	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@@H+]2CCOC[C@@H]2C)CC1	ZINC000603402028	359617768	/nfs/dbraw/zinc/61/77/68/359617768.db2.gz	LNTLALXWOAPWBU-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
CC1(C)[C@H](Nc2ccc([N+](=O)[O-])nc2)C[C@@H]1[NH+]1CCOCC1	ZINC000603407690	359621579	/nfs/dbraw/zinc/62/15/79/359621579.db2.gz	SPOXAQZFCVGVCK-OLZOCXBDSA-N	1	1	306.366	1.901	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000604278203	359731929	/nfs/dbraw/zinc/73/19/29/359731929.db2.gz	SMMSNAHAYKZONE-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000604278203	359731932	/nfs/dbraw/zinc/73/19/32/359731932.db2.gz	SMMSNAHAYKZONE-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000604278112	359731943	/nfs/dbraw/zinc/73/19/43/359731943.db2.gz	HQHKMXZLOPSYGZ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N[C@@H]1CCC[N@H+](C)C1	ZINC000604278112	359731946	/nfs/dbraw/zinc/73/19/46/359731946.db2.gz	HQHKMXZLOPSYGZ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CNc1ccc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000609413055	360305397	/nfs/dbraw/zinc/30/53/97/360305397.db2.gz	ZNHRUGUACHGFFR-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611088225	360620000	/nfs/dbraw/zinc/62/00/00/360620000.db2.gz	KHSBLFOABVWZON-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
COc1cc(C[NH+]2CCC(NC(C)=O)CC2)ccc1[N+](=O)[O-]	ZINC000611515409	360743058	/nfs/dbraw/zinc/74/30/58/360743058.db2.gz	DDFUUPNLEVRZFN-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000194162509	201188170	/nfs/dbraw/zinc/18/81/70/201188170.db2.gz	SXEVHHWPLAGJQU-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000194162509	201188171	/nfs/dbraw/zinc/18/81/71/201188171.db2.gz	SXEVHHWPLAGJQU-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000579422463	422764341	/nfs/dbraw/zinc/76/43/41/422764341.db2.gz	RKXDSZADPBWGNR-LBPRGKRZSA-N	1	1	309.366	1.393	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619253549	363946610	/nfs/dbraw/zinc/94/66/10/363946610.db2.gz	YTAIDAHXHDPLKB-LSDHHAIUSA-N	1	1	321.352	1.782	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CCC[N@H+](C)C2)c1	ZINC000619583489	364071604	/nfs/dbraw/zinc/07/16/04/364071604.db2.gz	PFABUTWZUHWVCO-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000619473975	364028339	/nfs/dbraw/zinc/02/83/39/364028339.db2.gz	KRECUWJJKNRQJM-CYBMUJFWSA-N	1	1	323.397	1.421	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2	ZINC000274978548	212055581	/nfs/dbraw/zinc/05/55/81/212055581.db2.gz	LVRONHBAQJYIMP-UHFFFAOYSA-N	1	1	316.317	1.115	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)[C@H](C)C1	ZINC000288317835	220080560	/nfs/dbraw/zinc/08/05/60/220080560.db2.gz	HUTIERCHTYGXCI-LLVKDONJSA-N	1	1	323.397	1.351	20	5		DDBDMO
C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266416828	205331508	/nfs/dbraw/zinc/33/15/08/205331508.db2.gz	HORHLHQYLUZQQV-XHDPSFHLSA-N	1	1	322.340	1.984	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000266550818	205428006	/nfs/dbraw/zinc/42/80/06/205428006.db2.gz	UGWKRIPEWFIKMX-GFCCVEGCSA-N	1	1	323.349	1.193	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000266550818	205428011	/nfs/dbraw/zinc/42/80/11/205428011.db2.gz	UGWKRIPEWFIKMX-GFCCVEGCSA-N	1	1	323.349	1.193	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000104970028	194060262	/nfs/dbraw/zinc/06/02/62/194060262.db2.gz	FBKORCAFOSWFLL-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](O)C[C@H]1C	ZINC000340904204	251267050	/nfs/dbraw/zinc/26/70/50/251267050.db2.gz	JAGOJEHLMOKFGU-ZYHUDNBSSA-N	1	1	323.349	1.387	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000064570253	184299995	/nfs/dbraw/zinc/29/99/95/184299995.db2.gz	DJAACYNUJAUQPW-UHFFFAOYSA-N	1	1	323.349	1.443	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000064570253	184299996	/nfs/dbraw/zinc/29/99/96/184299996.db2.gz	DJAACYNUJAUQPW-UHFFFAOYSA-N	1	1	323.349	1.443	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000119856306	195049635	/nfs/dbraw/zinc/04/96/35/195049635.db2.gz	LZDSXWDIFKBHCT-OLZOCXBDSA-N	1	1	312.391	1.772	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@H]1n1ccnc1	ZINC000120202023	195118771	/nfs/dbraw/zinc/11/87/71/195118771.db2.gz	XHRZIOTYENHYSJ-OCCSQVGLSA-N	1	1	304.354	1.571	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)n1	ZINC000567999831	304261008	/nfs/dbraw/zinc/26/10/08/304261008.db2.gz	QXGPTMBCBGOSDU-YOGCLGLASA-N	1	1	321.381	1.556	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1CO	ZINC000298134942	533139006	/nfs/dbraw/zinc/13/90/06/533139006.db2.gz	NVABQJQNCSTDFI-LBPRGKRZSA-N	1	1	323.349	1.389	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000154790504	196992535	/nfs/dbraw/zinc/99/25/35/196992535.db2.gz	FHNPWBRMICQDSH-LLVKDONJSA-N	1	1	322.365	1.380	20	5		DDBDMO
COCCCNC(=O)[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000271646966	209093106	/nfs/dbraw/zinc/09/31/06/209093106.db2.gz	TYLHWYRXVLBWPM-RYUDHWBXSA-N	1	1	309.366	1.787	20	5		DDBDMO
C[C@@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C[NH+](C)C	ZINC001120489018	781979597	/nfs/dbraw/zinc/97/95/97/781979597.db2.gz	MEGIXRQYSVWZEM-QWHCGFSZSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@@H](C[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-])CN(C)C	ZINC001120489018	781979604	/nfs/dbraw/zinc/97/96/04/781979604.db2.gz	MEGIXRQYSVWZEM-QWHCGFSZSA-N	1	1	311.382	1.122	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000451565646	533409846	/nfs/dbraw/zinc/40/98/46/533409846.db2.gz	LMYGYWPNHWHDKR-SWLSCSKDSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000451565646	533409852	/nfs/dbraw/zinc/40/98/52/533409852.db2.gz	LMYGYWPNHWHDKR-SWLSCSKDSA-N	1	1	321.377	1.914	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1	ZINC000360993555	299788804	/nfs/dbraw/zinc/78/88/04/299788804.db2.gz	CEEMJMYTMUQVEA-ZDUSSCGKSA-N	1	1	321.377	1.690	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCO[C@@H](C)C1	ZINC000026342656	406903638	/nfs/dbraw/zinc/90/36/38/406903638.db2.gz	UPLSZAHTRKBUEP-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C)C1	ZINC000026342656	406903641	/nfs/dbraw/zinc/90/36/41/406903641.db2.gz	UPLSZAHTRKBUEP-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[NH+](Cc2cccs2)CC1	ZINC000029843204	406927509	/nfs/dbraw/zinc/92/75/09/406927509.db2.gz	DDYMXMZLLHCMNL-UHFFFAOYSA-N	1	1	307.379	1.712	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)NCCC[NH+]1CCOCC1	ZINC000086964344	407114013	/nfs/dbraw/zinc/11/40/13/407114013.db2.gz	FYAFXSUWMLLCAP-UHFFFAOYSA-N	1	1	321.377	1.366	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123191653	407322492	/nfs/dbraw/zinc/32/24/92/407322492.db2.gz	LUXHWLWXCDWBQL-RISCZKNCSA-N	1	1	320.393	1.608	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000067292760	407270742	/nfs/dbraw/zinc/27/07/42/407270742.db2.gz	UIIVEMZYTREJQV-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@](C)(O)C1	ZINC000123947187	407343711	/nfs/dbraw/zinc/34/37/11/407343711.db2.gz	VCVGDZGAPWNQLO-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@](C)(O)C1	ZINC000123947187	407343713	/nfs/dbraw/zinc/34/37/13/407343713.db2.gz	VCVGDZGAPWNQLO-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cc(C[N@H+](C)CCn2cccn2)c([N+](=O)[O-])cc1OC	ZINC000125281165	407384281	/nfs/dbraw/zinc/38/42/81/407384281.db2.gz	FAKZERDVQCTHPN-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCn2cccn2)c([N+](=O)[O-])cc1OC	ZINC000125281165	407384283	/nfs/dbraw/zinc/38/42/83/407384283.db2.gz	FAKZERDVQCTHPN-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])cc1OC	ZINC000271038720	407481022	/nfs/dbraw/zinc/48/10/22/407481022.db2.gz	MJLVXMNXHDERHN-LLVKDONJSA-N	1	1	324.381	1.270	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)Cn2ccc([N+](=O)[O-])n2)[nH+]c1	ZINC000127762771	407460301	/nfs/dbraw/zinc/46/03/01/407460301.db2.gz	XZQZNZIPIWPGDM-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc(OC)c(OC)c([N+](=O)[O-])c1	ZINC000265921051	407512361	/nfs/dbraw/zinc/51/23/61/407512361.db2.gz	BYPPPRQGLAQWHS-UHFFFAOYSA-N	1	1	311.338	1.294	20	5		DDBDMO
C[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000171248589	407639925	/nfs/dbraw/zinc/63/99/25/407639925.db2.gz	XGOVJWSVOQPHTO-CYBMUJFWSA-N	1	1	320.393	1.189	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000115716897	407703922	/nfs/dbraw/zinc/70/39/22/407703922.db2.gz	ZVPFZAPJUWFYPQ-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000115716897	407703925	/nfs/dbraw/zinc/70/39/25/407703925.db2.gz	ZVPFZAPJUWFYPQ-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000152995815	407730626	/nfs/dbraw/zinc/73/06/26/407730626.db2.gz	DWWHCTPMIMPWSH-WFASDCNBSA-N	1	1	321.377	1.793	20	5		DDBDMO
CCCc1[nH]nc(C(=O)Nc2cc[nH+]c(N(C)C)c2)c1[N+](=O)[O-]	ZINC000267123997	407758267	/nfs/dbraw/zinc/75/82/67/407758267.db2.gz	BCJPGWLMJCGOGL-UHFFFAOYSA-N	1	1	318.337	1.984	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000268147760	407912866	/nfs/dbraw/zinc/91/28/66/407912866.db2.gz	FKWCDIKLEIEZFC-YMTOWFKASA-N	1	1	307.325	1.946	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000187298920	407843142	/nfs/dbraw/zinc/84/31/42/407843142.db2.gz	LUKSVFFKQPLLRU-YBJDMEARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000187298920	407843150	/nfs/dbraw/zinc/84/31/50/407843150.db2.gz	LUKSVFFKQPLLRU-YBJDMEARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[NH2+]CC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000262878590	407961410	/nfs/dbraw/zinc/96/14/10/407961410.db2.gz	VRYIFOJOOFWTRW-GZMMTYOYSA-N	1	1	303.322	1.199	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000245404340	407964188	/nfs/dbraw/zinc/96/41/88/407964188.db2.gz	OWUCDDOSKZKTFU-GXTWGEPZSA-N	1	1	310.350	1.445	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000272451597	407926938	/nfs/dbraw/zinc/92/69/38/407926938.db2.gz	NPPYYGUIWXXNMR-VXGBXAGGSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@@H]1CCCC[C@@H]1O	ZINC000272451903	407929115	/nfs/dbraw/zinc/92/91/15/407929115.db2.gz	CHDQCEJBJNBSJL-JSGCOSHPSA-N	1	1	309.366	1.239	20	5		DDBDMO
CNC(=O)CC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000175015159	408029060	/nfs/dbraw/zinc/02/90/60/408029060.db2.gz	VELYJOKWIYQNDN-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
CC[C@]1(C)C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000135583225	408034094	/nfs/dbraw/zinc/03/40/94/408034094.db2.gz	PQJGGUFQXFTFKV-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000135583225	408034098	/nfs/dbraw/zinc/03/40/98/408034098.db2.gz	PQJGGUFQXFTFKV-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC[C@](C)(O)C[NH+]1CCOCC1	ZINC000135305432	408002532	/nfs/dbraw/zinc/00/25/32/408002532.db2.gz	GPCLNAOTAWZSJO-HNNXBMFYSA-N	1	1	309.366	1.398	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2[nH]nc(CC)c2[N+](=O)[O-])C1	ZINC000175329021	408107211	/nfs/dbraw/zinc/10/72/11/408107211.db2.gz	VJLSKAAYZKPQLT-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])C1	ZINC000175329021	408107217	/nfs/dbraw/zinc/10/72/17/408107217.db2.gz	VJLSKAAYZKPQLT-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])C1	ZINC000175329021	408107221	/nfs/dbraw/zinc/10/72/21/408107221.db2.gz	VJLSKAAYZKPQLT-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488368	408326652	/nfs/dbraw/zinc/32/66/52/408326652.db2.gz	YCYXKXZYWNMJAA-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000269488368	408326656	/nfs/dbraw/zinc/32/66/56/408326656.db2.gz	YCYXKXZYWNMJAA-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
COCC[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccnc1	ZINC000191123407	408373670	/nfs/dbraw/zinc/37/36/70/408373670.db2.gz	AOLUPWVQPAQUKK-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccnc1	ZINC000191123407	408373674	/nfs/dbraw/zinc/37/36/74/408373674.db2.gz	AOLUPWVQPAQUKK-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CC[NH+](CCO)CC1	ZINC000191339734	408411328	/nfs/dbraw/zinc/41/13/28/408411328.db2.gz	TUIFELATIVGBAO-UHFFFAOYSA-N	1	1	322.365	1.353	20	5		DDBDMO
C[C@@H]1c2cccn2CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000247559684	408493103	/nfs/dbraw/zinc/49/31/03/408493103.db2.gz	QQTRBHWTYFGOKQ-DGCLKSJQSA-N	1	1	305.338	1.031	20	5		DDBDMO
C[C@@H]1c2cccn2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000247559684	408493108	/nfs/dbraw/zinc/49/31/08/408493108.db2.gz	QQTRBHWTYFGOKQ-DGCLKSJQSA-N	1	1	305.338	1.031	20	5		DDBDMO
CN1CC[NH+](CCCn2cc(Cl)cc([N+](=O)[O-])c2=O)CC1	ZINC000274727664	408512125	/nfs/dbraw/zinc/51/21/25/408512125.db2.gz	HLVXKYSXJGWFGK-UHFFFAOYSA-N	1	1	314.773	1.047	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177128902	408527383	/nfs/dbraw/zinc/52/73/83/408527383.db2.gz	KQFOATOKPVTRCR-YPMHNXCESA-N	1	1	303.362	1.879	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000247458147	408472183	/nfs/dbraw/zinc/47/21/83/408472183.db2.gz	QUFUXUDOBALSOL-AAEUAGOBSA-N	1	1	323.397	1.288	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000177821789	408724437	/nfs/dbraw/zinc/72/44/37/408724437.db2.gz	ZNNOLYGSQZDMJP-NEPJUHHUSA-N	1	1	321.381	1.336	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000249142189	408700443	/nfs/dbraw/zinc/70/04/43/408700443.db2.gz	QZVOVBDFJQJIKV-PWSUYJOCSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000249142189	408700446	/nfs/dbraw/zinc/70/04/46/408700446.db2.gz	QZVOVBDFJQJIKV-PWSUYJOCSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000249142189	408700450	/nfs/dbraw/zinc/70/04/50/408700450.db2.gz	QZVOVBDFJQJIKV-PWSUYJOCSA-N	1	1	323.397	1.683	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](CN3CCOCC3)C2)cc1F	ZINC000276288051	408829058	/nfs/dbraw/zinc/82/90/58/408829058.db2.gz	HDFFUVQXHVMMOJ-CQSZACIVSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H](C[NH+]3CCOCC3)C2)cc1F	ZINC000276288051	408829059	/nfs/dbraw/zinc/82/90/59/408829059.db2.gz	HDFFUVQXHVMMOJ-CQSZACIVSA-N	1	1	323.368	1.888	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)c1ncc([N+](=O)[O-])c(N)n1	ZINC000286390906	408975704	/nfs/dbraw/zinc/97/57/04/408975704.db2.gz	MPMIPAMOZRLFRK-UHFFFAOYSA-N	1	1	320.353	1.518	20	5		DDBDMO
Nc1c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cccc1[N+](=O)[O-]	ZINC000277610460	408976442	/nfs/dbraw/zinc/97/64/42/408976442.db2.gz	VFTQPMXPGQPLQU-GFCCVEGCSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000292280667	409015779	/nfs/dbraw/zinc/01/57/79/409015779.db2.gz	BQVYNTCAFPWMCX-FZMZJTMJSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000292280667	409015780	/nfs/dbraw/zinc/01/57/80/409015780.db2.gz	BQVYNTCAFPWMCX-FZMZJTMJSA-N	1	1	319.361	1.329	20	5		DDBDMO
Cc1cc(N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)c(F)cc1[N+](=O)[O-]	ZINC000292701791	409040015	/nfs/dbraw/zinc/04/00/15/409040015.db2.gz	SBOMCNDSZACXGE-HUUCEWRRSA-N	1	1	309.341	1.952	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)n1	ZINC000287723351	409082613	/nfs/dbraw/zinc/08/26/13/409082613.db2.gz	FKUQSNPAWRNZQE-UWVGGRQHSA-N	1	1	320.349	1.814	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280301331	409288053	/nfs/dbraw/zinc/28/80/53/409288053.db2.gz	FTKIORFUJPQEIM-WQVCFCJDSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280301331	409288056	/nfs/dbraw/zinc/28/80/56/409288056.db2.gz	FTKIORFUJPQEIM-WQVCFCJDSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC(C)(C)CO	ZINC000295173069	409357164	/nfs/dbraw/zinc/35/71/64/409357164.db2.gz	GXTHPNJLHZGKKC-UHFFFAOYSA-N	1	1	321.377	1.434	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC(C)(C)CO	ZINC000295173069	409357170	/nfs/dbraw/zinc/35/71/70/409357170.db2.gz	GXTHPNJLHZGKKC-UHFFFAOYSA-N	1	1	321.377	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@H+](C)CCN(C)C)c1	ZINC000290368076	409376975	/nfs/dbraw/zinc/37/69/75/409376975.db2.gz	ATWLTIYXFVBPIR-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCCCN(C)CC[NH+](C)C)c1	ZINC000290368076	409376985	/nfs/dbraw/zinc/37/69/85/409376985.db2.gz	ATWLTIYXFVBPIR-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1sc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000295240931	409394515	/nfs/dbraw/zinc/39/45/15/409394515.db2.gz	PCNFOQOTHCRVEJ-GFCCVEGCSA-N	1	1	301.343	1.738	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1C[C@@H](OC)C1	ZINC000285474121	409458523	/nfs/dbraw/zinc/45/85/23/409458523.db2.gz	VGYVMWAZPLKGKC-TXEJJXNPSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1C[C@@H](OC)C1	ZINC000285474121	409458526	/nfs/dbraw/zinc/45/85/26/409458526.db2.gz	VGYVMWAZPLKGKC-TXEJJXNPSA-N	1	1	323.349	1.651	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2c(C)cccc2[N+](=O)[O-])[N@@H+](C)C1	ZINC000285185034	409401814	/nfs/dbraw/zinc/40/18/14/409401814.db2.gz	VTMUTEZGXZWDFE-STQMWFEESA-N	1	1	321.377	1.694	20	5		DDBDMO
CS[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296120951	409437620	/nfs/dbraw/zinc/43/76/20/409437620.db2.gz	FNKLHGLBFALPDJ-ZDUSSCGKSA-N	1	1	309.391	1.995	20	5		DDBDMO
CS[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000296120951	409437624	/nfs/dbraw/zinc/43/76/24/409437624.db2.gz	FNKLHGLBFALPDJ-ZDUSSCGKSA-N	1	1	309.391	1.995	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000317844505	164028479	/nfs/dbraw/zinc/02/84/79/164028479.db2.gz	YAJXIMXGAIDACF-QWRGUYRKSA-N	1	1	309.370	1.166	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@H](O)C1(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000361425499	164153999	/nfs/dbraw/zinc/15/39/99/164153999.db2.gz	GZIRJMMRLSRWJD-ZDUSSCGKSA-N	1	1	307.350	1.403	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H](O)C1(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000361425499	164154001	/nfs/dbraw/zinc/15/40/01/164154001.db2.gz	GZIRJMMRLSRWJD-ZDUSSCGKSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3csc([N+](=O)[O-])c3)[C@H]2C1	ZINC000285592930	409503023	/nfs/dbraw/zinc/50/30/23/409503023.db2.gz	CALDFNMWFSPXNF-WDEREUQCSA-N	1	1	311.363	1.201	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881925	409685726	/nfs/dbraw/zinc/68/57/26/409685726.db2.gz	PEFAAVVSPYXNIO-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881925	409685728	/nfs/dbraw/zinc/68/57/28/409685728.db2.gz	PEFAAVVSPYXNIO-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881925	409685735	/nfs/dbraw/zinc/68/57/35/409685735.db2.gz	PEFAAVVSPYXNIO-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356881925	409685739	/nfs/dbraw/zinc/68/57/39/409685739.db2.gz	PEFAAVVSPYXNIO-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000356883937	409687546	/nfs/dbraw/zinc/68/75/46/409687546.db2.gz	QOZPOKXFFUTXNZ-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000356883937	409687556	/nfs/dbraw/zinc/68/75/56/409687556.db2.gz	QOZPOKXFFUTXNZ-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000357281964	409955180	/nfs/dbraw/zinc/95/51/80/409955180.db2.gz	INUCRGSWYZMBDB-UHFFFAOYSA-N	1	1	305.338	1.648	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000332215348	409983188	/nfs/dbraw/zinc/98/31/88/409983188.db2.gz	IEPYOVBVQGYVHY-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000324475720	409927544	/nfs/dbraw/zinc/92/75/44/409927544.db2.gz	FFXSXINBBXHEFF-JTQLQIEISA-N	1	1	324.356	1.776	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CCC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000342835808	409937812	/nfs/dbraw/zinc/93/78/12/409937812.db2.gz	QOPXAQBAOVVKHY-JQWIXIFHSA-N	1	1	322.365	1.979	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC[N@H+](C)CC1	ZINC000298108070	410118461	/nfs/dbraw/zinc/11/84/61/410118461.db2.gz	OQFBTTACRHFJEL-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCN(C)CC1	ZINC000298108070	410118467	/nfs/dbraw/zinc/11/84/67/410118467.db2.gz	OQFBTTACRHFJEL-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCN(C)CC1	ZINC000298108070	410118470	/nfs/dbraw/zinc/11/84/70/410118470.db2.gz	OQFBTTACRHFJEL-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000299208602	410568056	/nfs/dbraw/zinc/56/80/56/410568056.db2.gz	ASLHVPPNPNNHBI-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H](C)O	ZINC000352224156	410563002	/nfs/dbraw/zinc/56/30/02/410563002.db2.gz	ZGONITMWYMWADH-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337299227	410698020	/nfs/dbraw/zinc/69/80/20/410698020.db2.gz	MGDUOFBPHNPWIR-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337299227	410698025	/nfs/dbraw/zinc/69/80/25/410698025.db2.gz	MGDUOFBPHNPWIR-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C)CC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337299227	410698030	/nfs/dbraw/zinc/69/80/30/410698030.db2.gz	MGDUOFBPHNPWIR-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(CC[N@H+](CCO)CC1CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000337340848	410721948	/nfs/dbraw/zinc/72/19/48/410721948.db2.gz	UDIXZJXDHDSTOE-UHFFFAOYSA-N	1	1	307.350	1.628	20	5		DDBDMO
C[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000302401065	410842751	/nfs/dbraw/zinc/84/27/51/410842751.db2.gz	JXXBVDFFEWCDHN-VIFPVBQESA-N	1	1	300.746	1.146	20	5		DDBDMO
C[C@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302401065	410842754	/nfs/dbraw/zinc/84/27/54/410842754.db2.gz	JXXBVDFFEWCDHN-VIFPVBQESA-N	1	1	300.746	1.146	20	5		DDBDMO
CC[NH+]1CCN(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000331161653	410989024	/nfs/dbraw/zinc/98/90/24/410989024.db2.gz	XDARLWRMPMEQQT-UHFFFAOYSA-N	1	1	313.304	1.580	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC[C@@H]2C)n1	ZINC000331209012	411021108	/nfs/dbraw/zinc/02/11/08/411021108.db2.gz	QBQFQONQAIEBOI-NSHDSACASA-N	1	1	309.370	1.415	20	5		DDBDMO
Cc1c(CNC(=O)C[N@H+](C)[C@@H]2CCSC2)cccc1[N+](=O)[O-]	ZINC000360529599	418457043	/nfs/dbraw/zinc/45/70/43/418457043.db2.gz	RJWHICUKICXYSA-CYBMUJFWSA-N	1	1	323.418	1.957	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000366761189	418513954	/nfs/dbraw/zinc/51/39/54/418513954.db2.gz	RIFXXBQQBDPOCS-NSHDSACASA-N	1	1	300.322	1.566	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](Nc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000366761189	418513956	/nfs/dbraw/zinc/51/39/56/418513956.db2.gz	RIFXXBQQBDPOCS-NSHDSACASA-N	1	1	300.322	1.566	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1	ZINC000374387553	418525977	/nfs/dbraw/zinc/52/59/77/418525977.db2.gz	BMJJYZXWCHCHJB-OFQRWUPVSA-N	1	1	306.362	1.987	20	5		DDBDMO
COc1cccc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000194462085	418543917	/nfs/dbraw/zinc/54/39/17/418543917.db2.gz	GTLDMZAERZSTKV-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000291044086	222093765	/nfs/dbraw/zinc/09/37/65/222093765.db2.gz	WWLUOOFPPSIGFJ-LLVKDONJSA-N	1	1	311.386	1.336	20	5		DDBDMO
CCC[C@@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@@H+]1CCOC	ZINC000192517569	222129895	/nfs/dbraw/zinc/12/98/95/222129895.db2.gz	QTVJZQOVWAHUQW-LLVKDONJSA-N	1	1	314.411	1.988	20	5		DDBDMO
CCC[C@@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@H+]1CCOC	ZINC000192517569	222129897	/nfs/dbraw/zinc/12/98/97/222129897.db2.gz	QTVJZQOVWAHUQW-LLVKDONJSA-N	1	1	314.411	1.988	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000361125880	418587917	/nfs/dbraw/zinc/58/79/17/418587917.db2.gz	UMGIWETTYCSOGX-NSHDSACASA-N	1	1	304.350	1.487	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](O)C2(C)C)c([N+](=O)[O-])c1	ZINC000361420923	418649947	/nfs/dbraw/zinc/64/99/47/418649947.db2.gz	QECWKSOVMSGMPZ-CQSZACIVSA-N	1	1	310.350	1.827	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)CC[N@H+]1C	ZINC000342362619	418627928	/nfs/dbraw/zinc/62/79/28/418627928.db2.gz	QRSDBNNVDMDYND-ZJUUUORDSA-N	1	1	317.349	2.138	20	5		DDBDMO
CO[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000361361759	418634178	/nfs/dbraw/zinc/63/41/78/418634178.db2.gz	LEOWYXGZNRKKCI-LBPRGKRZSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000361361759	418634179	/nfs/dbraw/zinc/63/41/79/418634179.db2.gz	LEOWYXGZNRKKCI-LBPRGKRZSA-N	1	1	304.306	1.866	20	5		DDBDMO
COc1cc(C[N@@H+](CCO)[C@@H]2CCO[C@H]2C)ccc1[N+](=O)[O-]	ZINC000361585429	418686542	/nfs/dbraw/zinc/68/65/42/418686542.db2.gz	IIPOHVDRKVSNAG-WCQYABFASA-N	1	1	310.350	1.575	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(S(N)(=O)=O)CC1	ZINC000361744171	418704581	/nfs/dbraw/zinc/70/45/81/418704581.db2.gz	MGWVXCOUINEDQL-SNVBAGLBSA-N	1	1	313.379	1.409	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CC[N@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000408471312	418805097	/nfs/dbraw/zinc/80/50/97/418805097.db2.gz	WVOLWAAHWZLQNW-VHSXEESVSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000408471312	418805098	/nfs/dbraw/zinc/80/50/98/418805098.db2.gz	WVOLWAAHWZLQNW-VHSXEESVSA-N	1	1	307.354	1.217	20	5		DDBDMO
CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[N@H+]1C	ZINC000420994804	419432098	/nfs/dbraw/zinc/43/20/98/419432098.db2.gz	CQVSQESLCBRAPC-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000411909233	419469622	/nfs/dbraw/zinc/46/96/22/419469622.db2.gz	JOLQLCPTIVIZOM-SWHYSGLUSA-N	1	1	323.349	1.003	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000411909233	419469632	/nfs/dbraw/zinc/46/96/32/419469632.db2.gz	JOLQLCPTIVIZOM-SWHYSGLUSA-N	1	1	323.349	1.003	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000412039624	419583789	/nfs/dbraw/zinc/58/37/89/419583789.db2.gz	QCBAGQNWARKFBT-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000412039624	419583795	/nfs/dbraw/zinc/58/37/95/419583795.db2.gz	QCBAGQNWARKFBT-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CO)C1	ZINC000298650412	228678017	/nfs/dbraw/zinc/67/80/17/228678017.db2.gz	YBKBZFDMGJWLAV-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CO)C1	ZINC000298650412	228678020	/nfs/dbraw/zinc/67/80/20/228678020.db2.gz	YBKBZFDMGJWLAV-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](CC)C[C@H]2C)n1	ZINC000427393467	419653827	/nfs/dbraw/zinc/65/38/27/419653827.db2.gz	ZZDSLKBDXISRBV-WDEREUQCSA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@H]2C)n1	ZINC000427393467	419653837	/nfs/dbraw/zinc/65/38/37/419653837.db2.gz	ZZDSLKBDXISRBV-WDEREUQCSA-N	1	1	309.370	1.366	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000427790020	419734610	/nfs/dbraw/zinc/73/46/10/419734610.db2.gz	QSOVUCCYUIXNAY-PHIMTYICSA-N	1	1	304.350	1.270	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000428441567	419866952	/nfs/dbraw/zinc/86/69/52/419866952.db2.gz	WQAASDVLUJKEDT-OAHLLOKOSA-N	1	1	310.350	1.959	20	5		DDBDMO
Cc1nn(C)c(NCCC[N@H+]2CCCO[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000432863583	229134022	/nfs/dbraw/zinc/13/40/22/229134022.db2.gz	BAQRXEHSQNWHQZ-NSHDSACASA-N	1	1	311.386	1.550	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299578654	229226930	/nfs/dbraw/zinc/22/69/30/229226930.db2.gz	XEDPTULILQQYAX-OUAUKWLOSA-N	1	1	323.397	1.723	20	5		DDBDMO
CSC[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000429295843	419998368	/nfs/dbraw/zinc/99/83/68/419998368.db2.gz	BGXDXQPPLUGMSP-YPMHNXCESA-N	1	1	314.411	1.227	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CC(N)=O)C1	ZINC000430236367	420094018	/nfs/dbraw/zinc/09/40/18/420094018.db2.gz	HDVAOFPZJAVJRA-LLVKDONJSA-N	1	1	307.350	1.691	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)CN1CCOCC1	ZINC000430232246	420094772	/nfs/dbraw/zinc/09/47/72/420094772.db2.gz	LPYSAKJUQBCELL-ZDUSSCGKSA-N	1	1	323.393	1.756	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](C)CN1CCOCC1	ZINC000430232246	420094776	/nfs/dbraw/zinc/09/47/76/420094776.db2.gz	LPYSAKJUQBCELL-ZDUSSCGKSA-N	1	1	323.393	1.756	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC(F)(F)C[NH3+]	ZINC000415485291	420086002	/nfs/dbraw/zinc/08/60/02/420086002.db2.gz	PJDCVYDJPCTSFD-UHFFFAOYSA-N	1	1	302.281	1.927	20	5		DDBDMO
CC1(C)C[C@@H](NC[C@H]2C[NH2+]CCO2)c2cc([N+](=O)[O-])ccc21	ZINC000423580173	420086901	/nfs/dbraw/zinc/08/69/01/420086901.db2.gz	XHTIRRHKOZJKPL-IUODEOHRSA-N	1	1	305.378	1.895	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000430207016	420089828	/nfs/dbraw/zinc/08/98/28/420089828.db2.gz	YGKQBPSLLGBAAU-UHFFFAOYSA-N	1	1	316.317	1.657	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000430207016	420089831	/nfs/dbraw/zinc/08/98/31/420089831.db2.gz	YGKQBPSLLGBAAU-UHFFFAOYSA-N	1	1	316.317	1.657	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000433847086	420255079	/nfs/dbraw/zinc/25/50/79/420255079.db2.gz	CMMMJRVOHNNBAT-MNOVXSKESA-N	1	1	321.381	1.798	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3c(C(N)=O)cccc3[N+](=O)[O-])C2)C1	ZINC000420644193	420340206	/nfs/dbraw/zinc/34/02/06/420340206.db2.gz	WPTKCXMHFVYUJP-HNNXBMFYSA-N	1	1	304.350	1.226	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000420824936	420404527	/nfs/dbraw/zinc/40/45/27/420404527.db2.gz	YDDUSOHYZVWGMI-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1cc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000302487353	230264590	/nfs/dbraw/zinc/26/45/90/230264590.db2.gz	IVJGABCLFKNWML-LBPRGKRZSA-N	1	1	308.382	1.580	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000444270534	420756091	/nfs/dbraw/zinc/75/60/91/420756091.db2.gz	RJTVFAQAWGNVMA-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(NCC[N@H+]3CCCOCC3)c21	ZINC000445659498	420761205	/nfs/dbraw/zinc/76/12/05/420761205.db2.gz	GBHSCYPKNHMPOQ-UHFFFAOYSA-N	1	1	317.349	1.672	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@H+]1CCO	ZINC000454324373	420838185	/nfs/dbraw/zinc/83/81/85/420838185.db2.gz	OHJGRELNBSZCOL-TXEJJXNPSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC000454324373	420838189	/nfs/dbraw/zinc/83/81/89/420838189.db2.gz	OHJGRELNBSZCOL-TXEJJXNPSA-N	1	1	322.365	1.514	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000449522428	421022216	/nfs/dbraw/zinc/02/22/16/421022216.db2.gz	KTPROPGWHCEDRA-HLIIYUEKSA-N	1	1	315.329	1.203	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000455480938	421022406	/nfs/dbraw/zinc/02/24/06/421022406.db2.gz	QNMQDQJNUZWJNU-JTQLQIEISA-N	1	1	307.354	1.246	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000488721176	421108499	/nfs/dbraw/zinc/10/84/99/421108499.db2.gz	RNJVJSBHPMSJNV-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
COCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000490069521	421187773	/nfs/dbraw/zinc/18/77/73/421187773.db2.gz	VBXFTKZJVPIDLB-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1C[NH+]2CCN1CC2	ZINC000450391833	421191992	/nfs/dbraw/zinc/19/19/92/421191992.db2.gz	NNLXNROHKPFATH-LBPRGKRZSA-N	1	1	313.361	1.555	20	5		DDBDMO
COc1cccc(NC[C@@H]2CCC[N@H+]2CCCO)c1[N+](=O)[O-]	ZINC000450588330	421213213	/nfs/dbraw/zinc/21/32/13/421213213.db2.gz	AXMIUHQNTLXGLY-LBPRGKRZSA-N	1	1	309.366	1.862	20	5		DDBDMO
COc1ccc(CC(=O)N2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000524444346	421260830	/nfs/dbraw/zinc/26/08/30/421260830.db2.gz	GSVSSSNCXHGSNO-UHFFFAOYSA-N	1	1	307.350	1.310	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccc2ncccc2c1[N+](=O)[O-]	ZINC000562705930	421403019	/nfs/dbraw/zinc/40/30/19/421403019.db2.gz	CVANVLJFIBJGNR-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])c1ccco1	ZINC000548384209	421431309	/nfs/dbraw/zinc/43/13/09/421431309.db2.gz	DGKODOJHLINPGH-JTQLQIEISA-N	1	1	319.321	1.198	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]nc1[N+](=O)[O-])Cc1ccccc1	ZINC000548411965	421435511	/nfs/dbraw/zinc/43/55/11/421435511.db2.gz	QTVXWBOVPKFNIK-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1c[nH]nc1[N+](=O)[O-])Cc1ccccc1	ZINC000548407895	421435937	/nfs/dbraw/zinc/43/59/37/421435937.db2.gz	XOHRKMGTUPNGKR-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[N@H+]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551038775	421526574	/nfs/dbraw/zinc/52/65/74/421526574.db2.gz	DDKKBKYNUHRGHA-CYBMUJFWSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551038775	421526576	/nfs/dbraw/zinc/52/65/76/421526576.db2.gz	DDKKBKYNUHRGHA-CYBMUJFWSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551038775	421526578	/nfs/dbraw/zinc/52/65/78/421526578.db2.gz	DDKKBKYNUHRGHA-CYBMUJFWSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOCC3CCC3)CC2)cn1	ZINC000563616836	421527933	/nfs/dbraw/zinc/52/79/33/421527933.db2.gz	ZFWWOILPYKYYMR-UHFFFAOYSA-N	1	1	320.393	1.929	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC2(CC[NH2+]2)CC1	ZINC000563886388	421552444	/nfs/dbraw/zinc/55/24/44/421552444.db2.gz	VUNWPUICHYLXSE-UHFFFAOYSA-N	1	1	315.333	1.439	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000532639713	421662379	/nfs/dbraw/zinc/66/23/79/421662379.db2.gz	WUZFQEIABUDDDR-UHFFFAOYSA-N	1	1	305.338	1.601	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000558984008	421828314	/nfs/dbraw/zinc/82/83/14/421828314.db2.gz	IYARFIJJSWVZKB-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000558984008	421828315	/nfs/dbraw/zinc/82/83/15/421828315.db2.gz	IYARFIJJSWVZKB-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+]1C1CC1	ZINC000572313320	421776570	/nfs/dbraw/zinc/77/65/70/421776570.db2.gz	KYOSWOWNWSYEAH-OAHLLOKOSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000557556170	421777889	/nfs/dbraw/zinc/77/78/89/421777889.db2.gz	VJOSZJDOWVELRN-ZDUSSCGKSA-N	1	1	314.345	1.979	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC[NH2+]C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000572782226	421863127	/nfs/dbraw/zinc/86/31/27/421863127.db2.gz	OPCHBIRWYNKCJL-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@H](C)C[NH+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000573697416	422003548	/nfs/dbraw/zinc/00/35/48/422003548.db2.gz	SWTQUTIBHGJOJS-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1C[C@@H](C)O	ZINC000574857979	422195044	/nfs/dbraw/zinc/19/50/44/422195044.db2.gz	OSHACRCQLAQGLC-GHMZBOCLSA-N	1	1	312.345	1.410	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1C[C@@H](C)O	ZINC000574857979	422195049	/nfs/dbraw/zinc/19/50/49/422195049.db2.gz	OSHACRCQLAQGLC-GHMZBOCLSA-N	1	1	312.345	1.410	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1C1CC1	ZINC000584383766	422299353	/nfs/dbraw/zinc/29/93/53/422299353.db2.gz	PEOQRFYKDGKYIK-VHSXEESVSA-N	1	1	302.338	1.675	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000586802184	422313849	/nfs/dbraw/zinc/31/38/49/422313849.db2.gz	OFIDMYLTYQQOAH-GFCCVEGCSA-N	1	1	303.322	1.894	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000586802184	422313853	/nfs/dbraw/zinc/31/38/53/422313853.db2.gz	OFIDMYLTYQQOAH-GFCCVEGCSA-N	1	1	303.322	1.894	20	5		DDBDMO
CC(=O)c1cc(N2CC[NH+](CCCO)CC2)ccc1[N+](=O)[O-]	ZINC000341852192	271222356	/nfs/dbraw/zinc/22/23/56/271222356.db2.gz	JJDHXWMYPXPRMY-UHFFFAOYSA-N	1	1	307.350	1.302	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000345995704	272385432	/nfs/dbraw/zinc/38/54/32/272385432.db2.gz	UKJCQTJZEKFKLP-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
CCOc1cccc(N2CC[NH+](CCOC)CC2)c1[N+](=O)[O-]	ZINC000184042867	273708989	/nfs/dbraw/zinc/70/89/89/273708989.db2.gz	KUICKNQGHITSIB-UHFFFAOYSA-N	1	1	309.366	1.762	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1	ZINC000323802949	274004362	/nfs/dbraw/zinc/00/43/62/274004362.db2.gz	GZXBTGRBYMLOCY-MRXNPFEDSA-N	1	1	319.361	1.913	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[NH+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000133539949	276300537	/nfs/dbraw/zinc/30/05/37/276300537.db2.gz	SSNYPNOZDMKVQM-UHFFFAOYSA-N	1	1	320.349	1.451	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@H](C)[NH+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000338785910	276300775	/nfs/dbraw/zinc/30/07/75/276300775.db2.gz	BVKBJFLJVQFFMA-QWRGUYRKSA-N	1	1	322.365	1.695	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cn2)C[C@@H]1Cc1ccccc1	ZINC000286374312	277115126	/nfs/dbraw/zinc/11/51/26/277115126.db2.gz	DGSYFXIGSBEANE-AWEZNQCLSA-N	1	1	313.361	1.748	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000332394030	277153398	/nfs/dbraw/zinc/15/33/98/277153398.db2.gz	WGXIXJWZDAEUKU-HOTGVXAUSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000408067308	278001005	/nfs/dbraw/zinc/00/10/05/278001005.db2.gz	BNZRVIHDUNNBKK-ZJUUUORDSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000408067308	278001006	/nfs/dbraw/zinc/00/10/06/278001006.db2.gz	BNZRVIHDUNNBKK-ZJUUUORDSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC[N@@H+](C)CCN[C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272525900	279033244	/nfs/dbraw/zinc/03/32/44/279033244.db2.gz	LXQJSOKPHORXSM-OAHLLOKOSA-N	1	1	317.393	1.959	20	5		DDBDMO
C[C@@H]1[C@H](C)N(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@@H+]1C	ZINC000332238809	279104204	/nfs/dbraw/zinc/10/42/04/279104204.db2.gz	UEXCPKNCNOOZAN-NEPJUHHUSA-N	1	1	321.377	1.986	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@H]2C[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000362588270	300103011	/nfs/dbraw/zinc/10/30/11/300103011.db2.gz	KHXCRGXFWCFQNU-ZYHUDNBSSA-N	1	1	307.350	1.417	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363052875	300204492	/nfs/dbraw/zinc/20/44/92/300204492.db2.gz	BFFUIIZGLKHCMK-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363052875	300204495	/nfs/dbraw/zinc/20/44/95/300204495.db2.gz	BFFUIIZGLKHCMK-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363052875	300204497	/nfs/dbraw/zinc/20/44/97/300204497.db2.gz	BFFUIIZGLKHCMK-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000363904172	300323796	/nfs/dbraw/zinc/32/37/96/300323796.db2.gz	LBUQBWLFSCICAU-ZWNOBZJWSA-N	1	1	319.365	1.128	20	5		DDBDMO
CCn1cc(C[N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000364328013	300377347	/nfs/dbraw/zinc/37/73/47/300377347.db2.gz	LKJRSKVGBCUHFG-CYBMUJFWSA-N	1	1	304.354	1.845	20	5		DDBDMO
CCn1cc(C[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000364328013	300377350	/nfs/dbraw/zinc/37/73/50/300377350.db2.gz	LKJRSKVGBCUHFG-CYBMUJFWSA-N	1	1	304.354	1.845	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000364395946	300389771	/nfs/dbraw/zinc/38/97/71/300389771.db2.gz	CEVOVUOLUANJJF-FPMFFAJLSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000364395946	300389774	/nfs/dbraw/zinc/38/97/74/300389774.db2.gz	CEVOVUOLUANJJF-FPMFFAJLSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000364395946	300389778	/nfs/dbraw/zinc/38/97/78/300389778.db2.gz	CEVOVUOLUANJJF-FPMFFAJLSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2cccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000368804892	301090184	/nfs/dbraw/zinc/09/01/84/301090184.db2.gz	JTJXZFHMJMFIFD-CHWSQXEVSA-N	1	1	309.391	1.494	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469403	301345674	/nfs/dbraw/zinc/34/56/74/301345674.db2.gz	CUEOTLHVBXFTEC-UQOMUDLDSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370469403	301345676	/nfs/dbraw/zinc/34/56/76/301345676.db2.gz	CUEOTLHVBXFTEC-UQOMUDLDSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469403	301345678	/nfs/dbraw/zinc/34/56/78/301345678.db2.gz	CUEOTLHVBXFTEC-UQOMUDLDSA-N	1	1	303.362	1.431	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+]3CCC[C@@H]3C2)c2nonc21	ZINC000377481552	302183617	/nfs/dbraw/zinc/18/36/17/302183617.db2.gz	MDOSRLPCIJVLIT-SNVBAGLBSA-N	1	1	303.322	1.806	20	5		DDBDMO
C[C@H]1C[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1C	ZINC000531441816	303245402	/nfs/dbraw/zinc/24/54/02/303245402.db2.gz	CWYXEIQKQVCLPK-WDMOLILDSA-N	1	1	317.345	1.815	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000532142869	303276862	/nfs/dbraw/zinc/27/68/62/303276862.db2.gz	FNNFUJCCBZUYPX-GFCCVEGCSA-N	1	1	306.366	1.794	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000532909337	303301672	/nfs/dbraw/zinc/30/16/72/303301672.db2.gz	FJRGVMMFGFAROE-LLVKDONJSA-N	1	1	323.397	1.901	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1CO	ZINC000362089712	307013774	/nfs/dbraw/zinc/01/37/74/307013774.db2.gz	VLDCSMQGTXSQKD-CMPLNLGQSA-N	1	1	318.333	1.705	20	5		DDBDMO
Cc1cnn(C2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)c1	ZINC000363567389	307031510	/nfs/dbraw/zinc/03/15/10/307031510.db2.gz	ZGCYNRCFRGJFNV-UHFFFAOYSA-N	1	1	304.354	1.670	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000371659985	307155577	/nfs/dbraw/zinc/15/55/77/307155577.db2.gz	KIQXWXCHRLSYGX-REBRKWNGSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000371659985	307155578	/nfs/dbraw/zinc/15/55/78/307155578.db2.gz	KIQXWXCHRLSYGX-REBRKWNGSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000371659985	307155579	/nfs/dbraw/zinc/15/55/79/307155579.db2.gz	KIQXWXCHRLSYGX-REBRKWNGSA-N	1	1	318.377	1.073	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccsc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000371664640	307155703	/nfs/dbraw/zinc/15/57/03/307155703.db2.gz	WJSVTCAFOVYNQP-STQMWFEESA-N	1	1	309.391	1.494	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3[N+](=O)[O-])C[C@@H]2[C@@H]1c1ccccc1	ZINC000377824621	307276500	/nfs/dbraw/zinc/27/65/00/307276500.db2.gz	UNSLJPGVCHRREJ-OWYFMNJBSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@H]2[C@@H]1c1ccccc1	ZINC000377824621	307276501	/nfs/dbraw/zinc/27/65/01/307276501.db2.gz	UNSLJPGVCHRREJ-OWYFMNJBSA-N	1	1	315.373	1.413	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@H]2[C@@H]1c1ccccc1	ZINC000377824621	307276502	/nfs/dbraw/zinc/27/65/02/307276502.db2.gz	UNSLJPGVCHRREJ-OWYFMNJBSA-N	1	1	315.373	1.413	20	5		DDBDMO
CC(C)(NC(=O)CC(F)(F)C[NH3+])c1ccc([N+](=O)[O-])cc1	ZINC000577227959	308372778	/nfs/dbraw/zinc/37/27/78/308372778.db2.gz	NSGBAAIUYUKOFJ-UHFFFAOYSA-N	1	1	301.293	1.930	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000577437247	308387997	/nfs/dbraw/zinc/38/79/97/308387997.db2.gz	NILBGSTYDIHPSV-CYBMUJFWSA-N	1	1	323.393	1.783	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1ncccn1	ZINC000584666083	337377833	/nfs/dbraw/zinc/37/78/33/337377833.db2.gz	JGTXNGRNSOSIOI-NSHDSACASA-N	1	1	315.333	1.892	20	5		DDBDMO
NC(=O)NC(=O)CC[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451544310	534382542	/nfs/dbraw/zinc/38/25/42/534382542.db2.gz	DSGSLGLXDQQQQS-LBPRGKRZSA-N	1	1	320.349	1.359	20	5		DDBDMO
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCC[N@@H+](C)C1	ZINC000156543246	523850610	/nfs/dbraw/zinc/85/06/10/523850610.db2.gz	WOPCRDPINVSIQE-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000331973059	527833493	/nfs/dbraw/zinc/83/34/93/527833493.db2.gz	LDGVTNTYGBTVCG-ZDUSSCGKSA-N	1	1	308.334	1.807	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000331973059	527833495	/nfs/dbraw/zinc/83/34/95/527833495.db2.gz	LDGVTNTYGBTVCG-ZDUSSCGKSA-N	1	1	308.334	1.807	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000452113997	529063689	/nfs/dbraw/zinc/06/36/89/529063689.db2.gz	JGHZCYWSYVLCPB-CYBMUJFWSA-N	1	1	308.382	1.171	20	5		DDBDMO
CC(C)(C[NH+]1CCOCC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000308664619	535079723	/nfs/dbraw/zinc/07/97/23/535079723.db2.gz	QACHZXWTNWZBPE-UHFFFAOYSA-N	1	1	319.365	1.994	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820665056	599589509	/nfs/dbraw/zinc/58/95/09/599589509.db2.gz	DLEOMGJHWNNZIY-RKDXNWHRSA-N	1	1	318.341	1.065	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)[C@@H](C)C2)c1	ZINC000798328743	700056694	/nfs/dbraw/zinc/05/66/94/700056694.db2.gz	AENPKPSCVLJHFG-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@@H+](C)[C@@H](C)C2)c1	ZINC000798328743	700056696	/nfs/dbraw/zinc/05/66/96/700056696.db2.gz	AENPKPSCVLJHFG-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
CC(C)[C@@H](C(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1)[NH+](C)C	ZINC000798824933	700099700	/nfs/dbraw/zinc/09/97/00/700099700.db2.gz	GPSQYFFFBYOIRY-AWEZNQCLSA-N	1	1	323.349	1.663	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000748355980	700113297	/nfs/dbraw/zinc/11/32/97/700113297.db2.gz	UFOMKUIZJXZUQJ-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000748355980	700113299	/nfs/dbraw/zinc/11/32/99/700113299.db2.gz	UFOMKUIZJXZUQJ-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
COC(=O)/C(C)=C/C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816047	700136442	/nfs/dbraw/zinc/13/64/42/700136442.db2.gz	CKOORCXASLVZPM-JVOXIWMLSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C(C)=C/C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816047	700136444	/nfs/dbraw/zinc/13/64/44/700136444.db2.gz	CKOORCXASLVZPM-JVOXIWMLSA-N	1	1	320.349	1.595	20	5		DDBDMO
CC1(C)CC(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC000983658448	697287003	/nfs/dbraw/zinc/28/70/03/697287003.db2.gz	WIPCMUIAESXHOQ-FMKGYKFTSA-N	1	1	309.410	1.572	20	5		DDBDMO
CC(=O)N1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274410	698091066	/nfs/dbraw/zinc/09/10/66/698091066.db2.gz	HLCLUBNEKIOESZ-OAHLLOKOSA-N	1	1	307.350	1.182	20	5		DDBDMO
CC(=O)N1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776274410	698091072	/nfs/dbraw/zinc/09/10/72/698091072.db2.gz	HLCLUBNEKIOESZ-OAHLLOKOSA-N	1	1	307.350	1.182	20	5		DDBDMO
CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000778202611	698248949	/nfs/dbraw/zinc/24/89/49/698248949.db2.gz	CZSPPAGYJMYGSF-NEPJUHHUSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000778202611	698248950	/nfs/dbraw/zinc/24/89/50/698248950.db2.gz	CZSPPAGYJMYGSF-NEPJUHHUSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC1(C)CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000781961621	698666447	/nfs/dbraw/zinc/66/64/47/698666447.db2.gz	CREDUZISZOYTGM-OAHLLOKOSA-N	1	1	323.393	1.017	20	5		DDBDMO
CC1(C)C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000781961621	698666452	/nfs/dbraw/zinc/66/64/52/698666452.db2.gz	CREDUZISZOYTGM-OAHLLOKOSA-N	1	1	323.393	1.017	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000781961621	698666454	/nfs/dbraw/zinc/66/64/54/698666454.db2.gz	CREDUZISZOYTGM-OAHLLOKOSA-N	1	1	323.393	1.017	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=S)Nc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000782401843	698721745	/nfs/dbraw/zinc/72/17/45/698721745.db2.gz	PZUWXUAAUMCNQO-PHIMTYICSA-N	1	1	306.391	1.785	20	5		DDBDMO
C[N@@H+]1CC[C@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000725827395	699335663	/nfs/dbraw/zinc/33/56/63/699335663.db2.gz	SOECFYCHSPBRRT-VIFPVBQESA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CC[C@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000725827395	699335665	/nfs/dbraw/zinc/33/56/65/699335665.db2.gz	SOECFYCHSPBRRT-VIFPVBQESA-N	1	1	319.770	1.231	20	5		DDBDMO
CC[N@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1	ZINC000726584588	699369161	/nfs/dbraw/zinc/36/91/61/699369161.db2.gz	GKJWSUFTVGYDLD-UHFFFAOYSA-N	1	1	318.333	1.805	20	5		DDBDMO
CC[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1	ZINC000726584588	699369164	/nfs/dbraw/zinc/36/91/64/699369164.db2.gz	GKJWSUFTVGYDLD-UHFFFAOYSA-N	1	1	318.333	1.805	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@](C)(O)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000794672390	699823188	/nfs/dbraw/zinc/82/31/88/699823188.db2.gz	LXIGLNDTQPJGFQ-HNNXBMFYSA-N	1	1	319.365	1.842	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@H+]2CCC[C@H]2C)cc1[N+](=O)[O-]	ZINC000742242115	699869975	/nfs/dbraw/zinc/86/99/75/699869975.db2.gz	YVJASPINEBNDMD-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)[nH+]1	ZINC000743463255	699913667	/nfs/dbraw/zinc/91/36/67/699913667.db2.gz	IDNGNZNKBQTKQP-UHFFFAOYSA-N	1	1	317.305	1.241	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)[C@H](C)C1	ZINC000761067597	700838232	/nfs/dbraw/zinc/83/82/32/700838232.db2.gz	FYWYKDJWQKISFF-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@@H]1C[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000768843153	701208756	/nfs/dbraw/zinc/20/87/56/701208756.db2.gz	RIAPOFMRZYXWAD-RKDXNWHRSA-N	1	1	319.408	1.417	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000770283717	701273524	/nfs/dbraw/zinc/27/35/24/701273524.db2.gz	OEWAGJBLFFJIHR-UHFFFAOYSA-N	1	1	319.408	1.371	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N1CC[NH+](CCCCO)CC1	ZINC000771917464	701336792	/nfs/dbraw/zinc/33/67/92/701336792.db2.gz	NFDZHJZUJCXKFR-UHFFFAOYSA-N	1	1	314.773	1.538	20	5		DDBDMO
COCCOCC[N@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000808238076	701510622	/nfs/dbraw/zinc/51/06/22/701510622.db2.gz	QYWJFPIBDYLUKZ-UHFFFAOYSA-N	1	1	322.365	1.805	20	5		DDBDMO
COCCOCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000808238076	701510623	/nfs/dbraw/zinc/51/06/23/701510623.db2.gz	QYWJFPIBDYLUKZ-UHFFFAOYSA-N	1	1	322.365	1.805	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCC(=O)N1	ZINC000839670014	701774590	/nfs/dbraw/zinc/77/45/90/701774590.db2.gz	REVCMAGDSHXZLG-HIFRSBDPSA-N	1	1	321.377	1.617	20	5		DDBDMO
CC[N@H+](CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000839960128	701878240	/nfs/dbraw/zinc/87/82/40/701878240.db2.gz	OYMRSBOHBSLDSC-HNNXBMFYSA-N	1	1	305.334	1.974	20	5		DDBDMO
CC[N@@H+](CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000839960128	701878247	/nfs/dbraw/zinc/87/82/47/701878247.db2.gz	OYMRSBOHBSLDSC-HNNXBMFYSA-N	1	1	305.334	1.974	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000840104484	701970651	/nfs/dbraw/zinc/97/06/51/701970651.db2.gz	MXELWQHNTFIAFV-HNNXBMFYSA-N	1	1	319.365	1.964	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C[C@@H]1C	ZINC000840123108	701981919	/nfs/dbraw/zinc/98/19/19/701981919.db2.gz	KRTSZPWPDZINSY-IINYFYTJSA-N	1	1	319.365	1.962	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)OCC[C@@H]1CCCC[N@@H+]1C	ZINC000840223451	702034602	/nfs/dbraw/zinc/03/46/02/702034602.db2.gz	JAIFDTPQFAWCRJ-LBPRGKRZSA-N	1	1	310.354	1.517	20	5		DDBDMO
CC[N@@H+](C[C@H](C)OC)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000812301455	702143929	/nfs/dbraw/zinc/14/39/29/702143929.db2.gz	HPPGDNCYVGZVJG-JTQLQIEISA-N	1	1	307.354	1.962	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1	ZINC000812338140	702161579	/nfs/dbraw/zinc/16/15/79/702161579.db2.gz	LLYHQJDDKWLDGI-NEPJUHHUSA-N	1	1	304.350	1.322	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccnc(F)c3)CC2)n1	ZINC000831455379	706710011	/nfs/dbraw/zinc/71/00/11/706710011.db2.gz	RQUXQDFUJGRWQD-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)[C@@H](C)C2)c1	ZINC000844314200	703011276	/nfs/dbraw/zinc/01/12/76/703011276.db2.gz	RYXZFKRJSDNEME-NSHDSACASA-N	1	1	307.350	1.517	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000879577506	706725008	/nfs/dbraw/zinc/72/50/08/706725008.db2.gz	JRKSOZRIZFNERO-VNQPRFMTSA-N	1	1	305.378	1.654	20	5		DDBDMO
CC(C)[C@H]1CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000879600433	706734036	/nfs/dbraw/zinc/73/40/36/706734036.db2.gz	DSZVMHCACQMVPF-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
C[N@H+]1CC[C@@H](CCOC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000847827863	703473901	/nfs/dbraw/zinc/47/39/01/703473901.db2.gz	YYYSGYPKYILLSW-NSHDSACASA-N	1	1	310.354	1.411	20	5		DDBDMO
O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000818585450	703931279	/nfs/dbraw/zinc/93/12/79/703931279.db2.gz	CQTHPRJXJTURED-VIFPVBQESA-N	1	1	319.695	1.927	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000819719808	704164514	/nfs/dbraw/zinc/16/45/14/704164514.db2.gz	HPVXAXNCPQCGBM-NWANDNLSSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000874843457	705198936	/nfs/dbraw/zinc/19/89/36/705198936.db2.gz	NMZLDTOULMOHFI-GJZGRUSLSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000825338286	705649255	/nfs/dbraw/zinc/64/92/55/705649255.db2.gz	NXBXCIBCJIUHIL-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000826594011	705821085	/nfs/dbraw/zinc/82/10/85/705821085.db2.gz	UEXVYINCDIRGNO-UHFFFAOYSA-N	1	1	311.386	1.336	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000828505310	706191483	/nfs/dbraw/zinc/19/14/83/706191483.db2.gz	MYOHPUFJPWLQFS-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000881846504	707391241	/nfs/dbraw/zinc/39/12/41/707391241.db2.gz	LNGNWQKKNJUSIN-ZDUSSCGKSA-N	1	1	318.377	1.993	20	5		DDBDMO
CCOC(=O)C[N@H+](CCn1c(C)ncc1[N+](=O)[O-])CC(C)C	ZINC000877999636	706261372	/nfs/dbraw/zinc/26/13/72/706261372.db2.gz	DRPULSUYPZGJHA-UHFFFAOYSA-N	1	1	312.370	1.621	20	5		DDBDMO
CCOC(=O)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC(C)C	ZINC000877999636	706261375	/nfs/dbraw/zinc/26/13/75/706261375.db2.gz	DRPULSUYPZGJHA-UHFFFAOYSA-N	1	1	312.370	1.621	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2cccc([N+](=O)[O-])c2C(C)=O)CC1	ZINC000882031320	707473049	/nfs/dbraw/zinc/47/30/49/707473049.db2.gz	CYCTVTMVHRZTLT-ZDUSSCGKSA-N	1	1	321.377	1.690	20	5		DDBDMO
C[C@@]1(C(F)(F)F)CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000880001594	706850192	/nfs/dbraw/zinc/85/01/92/706850192.db2.gz	RCJQICRFJDBYKI-GHMZBOCLSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCCO1	ZINC000880094873	706877273	/nfs/dbraw/zinc/87/72/73/706877273.db2.gz	MZSCYGMMOWYSQD-JHJVBQTASA-N	1	1	321.377	1.929	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000836948429	707553027	/nfs/dbraw/zinc/55/30/27/707553027.db2.gz	RFZWPUMJJBDNNX-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000882961771	707875114	/nfs/dbraw/zinc/87/51/14/707875114.db2.gz	XGWODFVGPYBEOF-LLVKDONJSA-N	1	1	304.350	1.986	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])O[C@H]1C[C@@H]([NH+]2CCOCC2)C1	ZINC000838912794	708002348	/nfs/dbraw/zinc/00/23/48/708002348.db2.gz	PGEOMUOSCPVETQ-OKILXGFUSA-N	1	1	320.345	1.544	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000883539952	708023986	/nfs/dbraw/zinc/02/39/86/708023986.db2.gz	ONCIZJKDBJECIP-AWEZNQCLSA-N	1	1	306.366	1.531	20	5		DDBDMO
O=C1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])CCCCCCN1	ZINC000886305429	708739183	/nfs/dbraw/zinc/73/91/83/708739183.db2.gz	HFNBVYICCMBHOS-UHFFFAOYSA-N	1	1	306.366	1.872	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403309	709037332	/nfs/dbraw/zinc/03/73/32/709037332.db2.gz	SZEOWTDITPDZOM-SWLSCSKDSA-N	1	1	321.377	1.535	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403309	709037336	/nfs/dbraw/zinc/03/73/36/709037336.db2.gz	SZEOWTDITPDZOM-SWLSCSKDSA-N	1	1	321.377	1.535	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)C[C@]2(C)C1	ZINC000887926309	709166213	/nfs/dbraw/zinc/16/62/13/709166213.db2.gz	DGYZEWSDECUMAS-BMIGLBTASA-N	1	1	307.325	1.758	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887928109	709167838	/nfs/dbraw/zinc/16/78/38/709167838.db2.gz	WKKBCOAZUWKYRQ-MEDUHNTESA-N	1	1	319.361	1.627	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000890078538	709738339	/nfs/dbraw/zinc/73/83/39/709738339.db2.gz	GWXCNNXIXFJCKZ-UHFFFAOYSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000913095972	713161900	/nfs/dbraw/zinc/16/19/00/713161900.db2.gz	ACVRCHDLJXGUKT-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095972	713161901	/nfs/dbraw/zinc/16/19/01/713161901.db2.gz	ACVRCHDLJXGUKT-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095972	713161903	/nfs/dbraw/zinc/16/19/03/713161903.db2.gz	ACVRCHDLJXGUKT-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000892418662	710434346	/nfs/dbraw/zinc/43/43/46/710434346.db2.gz	RZWLIUXWTUALKB-JSGCOSHPSA-N	1	1	304.350	1.440	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928435834	713194914	/nfs/dbraw/zinc/19/49/14/713194914.db2.gz	DEAFQGRXNCMFBS-NWDGAFQWSA-N	1	1	306.366	1.240	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000928453739	713204070	/nfs/dbraw/zinc/20/40/70/713204070.db2.gz	PVXJLFAKZKTQIB-MWLCHTKSSA-N	1	1	321.333	1.188	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640407	710835065	/nfs/dbraw/zinc/83/50/65/710835065.db2.gz	YNQFIRYNLAILAR-TZMCWYRMSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640407	710835070	/nfs/dbraw/zinc/83/50/70/710835070.db2.gz	YNQFIRYNLAILAR-TZMCWYRMSA-N	1	1	317.349	1.920	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@@H]12	ZINC000902906044	710953602	/nfs/dbraw/zinc/95/36/02/710953602.db2.gz	RKCDXWKPFIFWPG-AAEUAGOBSA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12	ZINC000902906044	710953605	/nfs/dbraw/zinc/95/36/05/710953605.db2.gz	RKCDXWKPFIFWPG-AAEUAGOBSA-N	1	1	324.406	1.243	20	5		DDBDMO
C[C@@H]1C[NH2+]C[C@H]1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000903445298	711129024	/nfs/dbraw/zinc/12/90/24/711129024.db2.gz	HYBSCTVDKBXXTI-FRRDWIJNSA-N	1	1	305.382	1.332	20	5		DDBDMO
C[C@@H]1C[NH2+]C[C@H]1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000903445298	711129025	/nfs/dbraw/zinc/12/90/25/711129025.db2.gz	HYBSCTVDKBXXTI-FRRDWIJNSA-N	1	1	305.382	1.332	20	5		DDBDMO
COC[C@H](CO)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000894620514	711219082	/nfs/dbraw/zinc/21/90/82/711219082.db2.gz	UVWISHLNGFFGQC-JTQLQIEISA-N	1	1	308.256	1.711	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894886090	711309292	/nfs/dbraw/zinc/30/92/92/711309292.db2.gz	ULVVCPUQDFQSPB-GFCCVEGCSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894886090	711309295	/nfs/dbraw/zinc/30/92/95/711309295.db2.gz	ULVVCPUQDFQSPB-GFCCVEGCSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000913535211	713248343	/nfs/dbraw/zinc/24/83/43/713248343.db2.gz	BUVPBRYHANBQQI-PHIMTYICSA-N	1	1	314.345	1.995	20	5		DDBDMO
COc1cc(C[NH2+]C[C@H]2CC(C)=NO2)c([N+](=O)[O-])cc1OC	ZINC000895310482	711480351	/nfs/dbraw/zinc/48/03/51/711480351.db2.gz	IBDPOICAAMDLOJ-LLVKDONJSA-N	1	1	309.322	1.866	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000918395945	713541446	/nfs/dbraw/zinc/54/14/46/713541446.db2.gz	VXPQYEYIZQAUCL-LLVKDONJSA-N	1	1	322.321	1.635	20	5		DDBDMO
Cc1[nH]c(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C)[nH+]1	ZINC000929171853	713561014	/nfs/dbraw/zinc/56/10/14/713561014.db2.gz	QJRRDXOTWMVLKP-UHFFFAOYSA-N	1	1	316.365	1.652	20	5		DDBDMO
Cn1ccc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000932136163	714268553	/nfs/dbraw/zinc/26/85/53/714268553.db2.gz	OXPIYTLEJBWOGQ-LBPRGKRZSA-N	1	1	304.354	1.404	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000923264463	714289258	/nfs/dbraw/zinc/28/92/58/714289258.db2.gz	QKCBZHTULDTZDI-QWHCGFSZSA-N	1	1	321.352	1.972	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000933222097	714540245	/nfs/dbraw/zinc/54/02/45/714540245.db2.gz	YRJIEWIWHKNGDV-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000933222097	714540246	/nfs/dbraw/zinc/54/02/46/714540246.db2.gz	YRJIEWIWHKNGDV-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CN1CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000933992662	714716877	/nfs/dbraw/zinc/71/68/77/714716877.db2.gz	IRXOHSKRFRNMJU-UHFFFAOYSA-N	1	1	310.373	1.413	20	5		DDBDMO
CO[C@@H]1CCOC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000934039738	714728686	/nfs/dbraw/zinc/72/86/86/714728686.db2.gz	ATYULQSGKZTTQD-VXGBXAGGSA-N	1	1	307.306	1.630	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000925419990	714850584	/nfs/dbraw/zinc/85/05/84/714850584.db2.gz	RZXWSFVEHBZHNA-LBPRGKRZSA-N	1	1	304.350	1.367	20	5		DDBDMO
COc1cc(C)nc(N2CCc3[nH+]ccn3CC2)c1[N+](=O)[O-]	ZINC001167181727	732809551	/nfs/dbraw/zinc/80/95/51/732809551.db2.gz	FURAEQUJMMGYJU-UHFFFAOYSA-N	1	1	303.322	1.566	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)[n+]([O-])c(N2CCc3[nH+]ccn3CC2)c1	ZINC001167182607	732810129	/nfs/dbraw/zinc/81/01/29/732810129.db2.gz	QHEPBTAQUOOJRW-UHFFFAOYSA-N	1	1	309.713	1.141	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2CCC(Cc3nn[nH]n3)CC2)c(F)c1	ZINC001197440104	747164995	/nfs/dbraw/zinc/16/49/95/747164995.db2.gz	VYUGTONXQQQDIF-UHFFFAOYSA-N	1	1	320.328	1.702	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2c1cnn2C	ZINC001169019490	762199961	/nfs/dbraw/zinc/19/99/61/762199961.db2.gz	ISKAINDYZWOEGU-MELADBBJSA-N	1	1	322.409	1.801	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169055298	762210139	/nfs/dbraw/zinc/21/01/39/762210139.db2.gz	PBRHVCPJGUSICP-YNEHKIRRSA-N	1	1	300.355	1.086	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@H+]1[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169055298	762210145	/nfs/dbraw/zinc/21/01/45/762210145.db2.gz	PBRHVCPJGUSICP-YNEHKIRRSA-N	1	1	300.355	1.086	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC001097203471	756970899	/nfs/dbraw/zinc/97/08/99/756970899.db2.gz	LPVBEKKKFYVWQE-TXEJJXNPSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCc1cccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001020138810	760613005	/nfs/dbraw/zinc/61/30/05/760613005.db2.gz	BKXSLBWOTFKFFI-KLHDSHLOSA-N	1	1	317.389	1.651	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CCCC1CC1	ZINC001132601002	769003397	/nfs/dbraw/zinc/00/33/97/769003397.db2.gz	XWUZWJNJRIWJAK-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2CNC(=O)[C@H]2C1	ZINC001173233654	777063523	/nfs/dbraw/zinc/06/35/23/777063523.db2.gz	LOPBLJNHFZVCOA-WHOFXGATSA-N	1	1	303.362	1.594	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001177044220	778406475	/nfs/dbraw/zinc/40/64/75/778406475.db2.gz	PYRMDUIGBRRLBD-IUODEOHRSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1nc(NC[C@H]2CC[N@H+]2C2CCOCC2)ncc1[N+](=O)[O-]	ZINC001120064186	781745095	/nfs/dbraw/zinc/74/50/95/781745095.db2.gz	CQTAFMAIWZMSNU-GFCCVEGCSA-N	1	1	307.354	1.358	20	5		DDBDMO
C[N@H+](CCNC(=O)[C@H]1[C@@H]2COC[C@@H]21)Cc1ccccc1[N+](=O)[O-]	ZINC001266311999	836101277	/nfs/dbraw/zinc/10/12/77/836101277.db2.gz	OSPPFUOJKWLORK-NHAGDIPZSA-N	1	1	319.361	1.035	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@H]1[C@@H]2COC[C@@H]21)Cc1ccccc1[N+](=O)[O-]	ZINC001266311999	836101280	/nfs/dbraw/zinc/10/12/80/836101280.db2.gz	OSPPFUOJKWLORK-NHAGDIPZSA-N	1	1	319.361	1.035	20	5		DDBDMO
Cc1nc(Cl)c([N+](=O)[O-])c(N2C[C@@H]3CCC[N@H+](C)[C@@H]3C2)n1	ZINC001157260243	863687680	/nfs/dbraw/zinc/68/76/80/863687680.db2.gz	INIQPVVXJDNMCV-VHSXEESVSA-N	1	1	311.773	1.877	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001157265910	863695276	/nfs/dbraw/zinc/69/52/76/863695276.db2.gz	LIBVLZJHMNBHNH-CMPLNLGQSA-N	1	1	320.349	1.307	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3nc(Cl)ncc3[N+](=O)[O-])C[C@H]2C1	ZINC001157688073	864044831	/nfs/dbraw/zinc/04/48/31/864044831.db2.gz	FIQMUPCDVJMYFD-AOOOYVTPSA-N	1	1	311.773	1.816	20	5		DDBDMO
CC[N@H+]1CCN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C(C)(C)C1	ZINC001158561708	864729204	/nfs/dbraw/zinc/72/92/04/864729204.db2.gz	MGZMVMDMUHKMTE-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
CCCCC[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001160106925	865679222	/nfs/dbraw/zinc/67/92/22/865679222.db2.gz	HEENLHRTNUQFQZ-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
CCCCC[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001160106925	865679231	/nfs/dbraw/zinc/67/92/31/865679231.db2.gz	HEENLHRTNUQFQZ-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
CCCCC[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001160106925	865679239	/nfs/dbraw/zinc/67/92/39/865679239.db2.gz	HEENLHRTNUQFQZ-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[N@@H+]2CCC[C@@H]2C1	ZINC001319941420	866394100	/nfs/dbraw/zinc/39/41/00/866394100.db2.gz	CFOQXEUBDQZACI-GFCCVEGCSA-N	1	1	305.334	1.611	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC001319941420	866394110	/nfs/dbraw/zinc/39/41/10/866394110.db2.gz	CFOQXEUBDQZACI-GFCCVEGCSA-N	1	1	305.334	1.611	20	5		DDBDMO
Cn1c[nH+]cc1CCCn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC001333282826	866589350	/nfs/dbraw/zinc/58/93/50/866589350.db2.gz	BWTJVLZLKMWNDY-UHFFFAOYSA-N	1	1	307.266	1.031	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CCc3cc(F)ccc3[N+](=O)[O-])C[C@@H]21	ZINC001333507090	866798194	/nfs/dbraw/zinc/79/81/94/866798194.db2.gz	GCJXFOZELQTWHT-DOMZBBRYSA-N	1	1	321.352	1.829	20	5		DDBDMO
COC(=O)c1cnc(N[C@@]2(C)CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001162341843	867477280	/nfs/dbraw/zinc/47/72/80/867477280.db2.gz	PGFAJDHGCMHYOP-AWEZNQCLSA-N	1	1	308.338	1.673	20	5		DDBDMO
Cc1nc(N2CC([C@H]([NH3+])C(=O)OC(C)(C)C)C2)ccc1[N+](=O)[O-]	ZINC001163117356	868115192	/nfs/dbraw/zinc/11/51/92/868115192.db2.gz	FPAJHQGXCRAJMR-ZDUSSCGKSA-N	1	1	322.365	1.403	20	5		DDBDMO
CN(C)[C@@H]1C[C@@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC001338553536	870043607	/nfs/dbraw/zinc/04/36/07/870043607.db2.gz	XUEVENUQZRSYCN-RBSFLKMASA-N	1	1	307.394	1.947	20	5		DDBDMO
Cn1ncc2c1CN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C2	ZINC001166762222	870230755	/nfs/dbraw/zinc/23/07/55/870230755.db2.gz	IMNVMPUEXAJXSU-SNAWJCMRSA-N	1	1	314.349	1.776	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC001339316051	870442102	/nfs/dbraw/zinc/44/21/02/870442102.db2.gz	GECHUHDHBHXLHO-LEWSCRJBSA-N	1	1	319.361	1.673	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC001311322774	871694126	/nfs/dbraw/zinc/69/41/26/871694126.db2.gz	LRFQIUIRUUCTRB-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC001311322774	871694131	/nfs/dbraw/zinc/69/41/31/871694131.db2.gz	LRFQIUIRUUCTRB-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[NH+]1CCN(c2cc(Nc3ccccc3[N+](=O)[O-])ncn2)CC1	ZINC001206144985	872085600	/nfs/dbraw/zinc/08/56/00/872085600.db2.gz	VQNQYRWNRBVNTO-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC[C@@H](C)C1	ZINC001318812830	872284895	/nfs/dbraw/zinc/28/48/95/872284895.db2.gz	GKXFWXGWZHEBPG-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
CS[C@H]1CC[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC001319451835	872635865	/nfs/dbraw/zinc/63/58/65/872635865.db2.gz	QQCUGUIIBJOVSI-YPMHNXCESA-N	1	1	311.407	1.972	20	5		DDBDMO
C[C@H](C[N+](C)(C)C)Oc1[nH]c(=O)nc2ccc([N+](=O)[O-])cc21	ZINC001227095901	882831679	/nfs/dbraw/zinc/83/16/79/882831679.db2.gz	MGDWHUKXWLAHRD-SECBINFHSA-O	1	1	307.330	1.717	20	5		DDBDMO
Cc1cc(NC(=O)NC[C@@H]2C[N@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC001350262738	875602408	/nfs/dbraw/zinc/60/24/08/875602408.db2.gz	RYAGIUWPVSILIX-CQSZACIVSA-N	1	1	321.381	1.271	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001227463221	883031701	/nfs/dbraw/zinc/03/17/01/883031701.db2.gz	ONHPYUGMIXMPTP-PXWWUCIGSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001227463221	883031721	/nfs/dbraw/zinc/03/17/21/883031721.db2.gz	ONHPYUGMIXMPTP-PXWWUCIGSA-N	1	1	321.289	1.686	20	5		DDBDMO
O=[N+]([O-])c1c[n+]([O-])ccc1O[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC001229454840	883992671	/nfs/dbraw/zinc/99/26/71/883992671.db2.gz	RGEWWXDICQYJOG-AWEZNQCLSA-N	1	1	315.329	1.882	20	5		DDBDMO
Cc1nc(O[C@H](C)C[N+](C)(C)C)c(Br)c(=O)[nH]1	ZINC001234569790	888107706	/nfs/dbraw/zinc/10/77/06/888107706.db2.gz	UIEILYWHIGBLEP-SSDOTTSWSA-O	1	1	305.196	1.727	20	5		DDBDMO
CCOCCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001235583595	888770644	/nfs/dbraw/zinc/77/06/44/888770644.db2.gz	MOKHWSWRQRTJMR-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+](C)CCN1CCN(C)CC1	ZINC001254558337	896502754	/nfs/dbraw/zinc/50/27/54/896502754.db2.gz	FSMRHXREEQUEGL-OAHLLOKOSA-N	1	1	320.437	1.705	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C)CCN1CCN(C)CC1	ZINC001254558337	896502762	/nfs/dbraw/zinc/50/27/62/896502762.db2.gz	FSMRHXREEQUEGL-OAHLLOKOSA-N	1	1	320.437	1.705	20	5		DDBDMO
[NH3+]CCCN1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254579037	896511713	/nfs/dbraw/zinc/51/17/13/896511713.db2.gz	PCPUHXQBRAAPOE-INIZCTEOSA-N	1	1	304.394	1.028	20	5		DDBDMO
CC(=O)N1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1C	ZINC001254606852	896528293	/nfs/dbraw/zinc/52/82/93/896528293.db2.gz	IQWMVIYCBAQFNT-BZNIZROVSA-N	1	1	303.362	1.615	20	5		DDBDMO
CC(=O)N1CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1C	ZINC001254606852	896528301	/nfs/dbraw/zinc/52/83/01/896528301.db2.gz	IQWMVIYCBAQFNT-BZNIZROVSA-N	1	1	303.362	1.615	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC001262653563	900287150	/nfs/dbraw/zinc/28/71/50/900287150.db2.gz	KOHXNOQTNKMFDQ-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)NCc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC001263074195	900482481	/nfs/dbraw/zinc/48/24/81/900482481.db2.gz	ZQSAPGJGYPWFFI-MJBXVCDLSA-N	1	1	318.377	1.734	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC001264948392	901357283	/nfs/dbraw/zinc/35/72/83/901357283.db2.gz	IPGSUDBXLLJFAG-UHFFFAOYSA-N	1	1	318.289	1.282	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181239158	199270253	/nfs/dbraw/zinc/27/02/53/199270253.db2.gz	CBGFFNIXSVFETC-UHFFFAOYSA-N	1	1	317.349	1.844	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@]3(CNC(=O)C3)C2)ccc1[N+](=O)[O-]	ZINC000278779449	214396608	/nfs/dbraw/zinc/39/66/08/214396608.db2.gz	DBNAGSRALJTOQX-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000452078489	231292442	/nfs/dbraw/zinc/29/24/42/231292442.db2.gz	DPBIPMVMPCERNM-CYBMUJFWSA-N	1	1	309.366	1.505	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)n1	ZINC000452173047	231324857	/nfs/dbraw/zinc/32/48/57/231324857.db2.gz	LVZPTVKMRNOAJE-LLVKDONJSA-N	1	1	321.381	1.368	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[N@@H+](C)C1	ZINC000301981077	529933020	/nfs/dbraw/zinc/93/30/20/529933020.db2.gz	IOXWGGWJCMXXIW-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000330850689	232112560	/nfs/dbraw/zinc/11/25/60/232112560.db2.gz	PQGRTNZXEBMZMW-SNVBAGLBSA-N	1	1	311.769	1.953	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000330850689	232112564	/nfs/dbraw/zinc/11/25/64/232112564.db2.gz	PQGRTNZXEBMZMW-SNVBAGLBSA-N	1	1	311.769	1.953	20	5		DDBDMO
C[NH+]1CCN(c2cc(CN3CCOCC3)ccc2[N+](=O)[O-])CC1	ZINC000615990692	362512238	/nfs/dbraw/zinc/51/22/38/362512238.db2.gz	VSRQYDCMPWPBIT-UHFFFAOYSA-N	1	1	320.393	1.179	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000272621868	210024089	/nfs/dbraw/zinc/02/40/89/210024089.db2.gz	UVHHPDIMZDTJPU-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](CO)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000279953843	215265962	/nfs/dbraw/zinc/26/59/62/215265962.db2.gz	YZUAVVRZDDGWPZ-GFCCVEGCSA-N	1	1	319.361	1.188	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](CO)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000279953843	215265965	/nfs/dbraw/zinc/26/59/65/215265965.db2.gz	YZUAVVRZDDGWPZ-GFCCVEGCSA-N	1	1	319.361	1.188	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000047268314	352488682	/nfs/dbraw/zinc/48/86/82/352488682.db2.gz	JNTCTNCQJGDGEI-GJZGRUSLSA-N	1	1	303.362	1.432	20	5		DDBDMO
COCC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1	ZINC000052940107	352633505	/nfs/dbraw/zinc/63/35/05/352633505.db2.gz	IZAREWHAWBXELK-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
COCC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1	ZINC000052940107	352633510	/nfs/dbraw/zinc/63/35/10/352633510.db2.gz	IZAREWHAWBXELK-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[NH+](CC)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000067952578	353076721	/nfs/dbraw/zinc/07/67/21/353076721.db2.gz	UHZIUACNTRUILL-UHFFFAOYSA-N	1	1	305.338	1.543	20	5		DDBDMO
O=C1[C@@H]([NH+]2CCC(CO)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000067377213	353046294	/nfs/dbraw/zinc/04/62/94/353046294.db2.gz	ZZLUJCLDZNPYMJ-HNNXBMFYSA-N	1	1	319.361	1.404	20	5		DDBDMO
C[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@@H](C)C1	ZINC000068118527	353090009	/nfs/dbraw/zinc/09/00/09/353090009.db2.gz	HDUTYEPVCRTIJZ-OLZOCXBDSA-N	1	1	323.397	1.418	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000174173048	198302068	/nfs/dbraw/zinc/30/20/68/198302068.db2.gz	DJKCXOSHIONTCT-ZDUSSCGKSA-N	1	1	319.361	1.389	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000174285277	198314934	/nfs/dbraw/zinc/31/49/34/198314934.db2.gz	FRZJXCDJLKYKBR-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@H]2CS(N)(=O)=O)cccc1[N+](=O)[O-]	ZINC000074316762	353306783	/nfs/dbraw/zinc/30/67/83/353306783.db2.gz	MCKTXSDGQWJDLF-LBPRGKRZSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@H]2CS(N)(=O)=O)cccc1[N+](=O)[O-]	ZINC000074316762	353306784	/nfs/dbraw/zinc/30/67/84/353306784.db2.gz	MCKTXSDGQWJDLF-LBPRGKRZSA-N	1	1	313.379	1.156	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@@H](C)O	ZINC000174590078	198356789	/nfs/dbraw/zinc/35/67/89/198356789.db2.gz	LNEYDDZGKZERDH-OCCSQVGLSA-N	1	1	321.377	1.512	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000174618406	198361082	/nfs/dbraw/zinc/36/10/82/198361082.db2.gz	FXMPYNZSXRJGBW-TZMCWYRMSA-N	1	1	321.377	1.512	20	5		DDBDMO
Cc1ccnc(N2CC[C@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000078404361	353515225	/nfs/dbraw/zinc/51/52/25/353515225.db2.gz	RRSULMXUKRXQDG-CYBMUJFWSA-N	1	1	306.366	1.457	20	5		DDBDMO
CCCC[N@@H+](CCO)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000078665045	353527764	/nfs/dbraw/zinc/52/77/64/353527764.db2.gz	QXAVOCMLJRDUBT-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3c([N+](=O)[O-])ncn3C)CC2)CCO1	ZINC000078960995	353543151	/nfs/dbraw/zinc/54/31/51/353543151.db2.gz	IHVKREMAINXHPQ-NSHDSACASA-N	1	1	309.370	1.018	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000080433646	353607227	/nfs/dbraw/zinc/60/72/27/353607227.db2.gz	YCESAOVMHNHANS-CQSZACIVSA-N	1	1	321.402	1.858	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)c1	ZINC000088718358	353757674	/nfs/dbraw/zinc/75/76/74/353757674.db2.gz	PAPWLLYPXZHOOK-CYBMUJFWSA-N	1	1	320.393	1.903	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000089265856	353763758	/nfs/dbraw/zinc/76/37/58/353763758.db2.gz	YSTWVCRNPNFFMB-LBPRGKRZSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@@H](N3CCNC3=O)C2)cc1[N+](=O)[O-]	ZINC000092188576	353846299	/nfs/dbraw/zinc/84/62/99/353846299.db2.gz	NSUOQMSBTRTBNW-CQSZACIVSA-N	1	1	318.377	1.893	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@@H](N3CCNC3=O)C2)cc1[N+](=O)[O-]	ZINC000092188576	353846304	/nfs/dbraw/zinc/84/63/04/353846304.db2.gz	NSUOQMSBTRTBNW-CQSZACIVSA-N	1	1	318.377	1.893	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[N@@H+](C)C[C@@H]21	ZINC000277039169	213256539	/nfs/dbraw/zinc/25/65/39/213256539.db2.gz	HBIMQNHJZWFVRB-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H](O)C[C@@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157104798	354223619	/nfs/dbraw/zinc/22/36/19/354223619.db2.gz	SINQPIQYFFDDFG-DZGCQCFKSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](O)C[C@@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157104798	354223625	/nfs/dbraw/zinc/22/36/25/354223625.db2.gz	SINQPIQYFFDDFG-DZGCQCFKSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCC(O)(C(F)(F)F)CC1	ZINC000319219020	354520709	/nfs/dbraw/zinc/52/07/09/354520709.db2.gz	SRQDACHWOXFLTB-UHFFFAOYSA-N	1	1	322.287	1.489	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000601310473	358490137	/nfs/dbraw/zinc/49/01/37/358490137.db2.gz	PMJFASSNPBLPCY-JOYOIKCWSA-N	1	1	307.325	1.946	20	5		DDBDMO
COc1cccc(N2CC[C@H]3OCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000585781955	354841257	/nfs/dbraw/zinc/84/12/57/354841257.db2.gz	GTKLYKWYLNOSMY-CHWSQXEVSA-N	1	1	307.350	1.513	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@H]21	ZINC000588001107	354892018	/nfs/dbraw/zinc/89/20/18/354892018.db2.gz	ONQNTEZXBNMFNE-IAQYHMDHSA-N	1	1	320.393	1.590	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1O	ZINC000589505443	354998209	/nfs/dbraw/zinc/99/82/09/354998209.db2.gz	IHHOEQQDYYBZGI-YGRLFVJLSA-N	1	1	308.334	1.584	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@@H]2C[N@H+](C)C[C@H]21	ZINC000590011323	355040109	/nfs/dbraw/zinc/04/01/09/355040109.db2.gz	HYVXHWXAYNKYOL-IUODEOHRSA-N	1	1	318.377	1.478	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21)c1ccc([N+](=O)[O-])cc1F	ZINC000590045683	355043664	/nfs/dbraw/zinc/04/36/64/355043664.db2.gz	SVRKMGJNYXVODN-PGUXBMHVSA-N	1	1	321.352	2.000	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000332520333	235056785	/nfs/dbraw/zinc/05/67/85/235056785.db2.gz	LWANRKTYVLBFAF-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000332520333	235056786	/nfs/dbraw/zinc/05/67/86/235056786.db2.gz	LWANRKTYVLBFAF-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC1	ZINC000591906608	355421939	/nfs/dbraw/zinc/42/19/39/355421939.db2.gz	UFEJHOBSSLRPLH-GFCCVEGCSA-N	1	1	320.393	1.371	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH2+][C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000592242288	355546088	/nfs/dbraw/zinc/54/60/88/355546088.db2.gz	RHDNQAHQALDEGK-LLVKDONJSA-N	1	1	309.370	1.340	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1	ZINC000593029325	355774179	/nfs/dbraw/zinc/77/41/79/355774179.db2.gz	FFXPAVAPRACXDH-IUODEOHRSA-N	1	1	319.361	1.517	20	5		DDBDMO
COCC[NH2+]C1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000593728582	355977715	/nfs/dbraw/zinc/97/77/15/355977715.db2.gz	XPSWFMYHYSMMRO-UHFFFAOYSA-N	1	1	309.366	1.501	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC[NH+]2CCCCC2)c1[N+](=O)[O-]	ZINC000593883540	356039847	/nfs/dbraw/zinc/03/98/47/356039847.db2.gz	OJTMZFCKAUOGLN-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C[C@@H](C)O)C1CC1	ZINC000594065568	356103510	/nfs/dbraw/zinc/10/35/10/356103510.db2.gz	SKFINWNIXKNPIR-LLVKDONJSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C[C@@H](C)O)C1CC1	ZINC000594065568	356103516	/nfs/dbraw/zinc/10/35/16/356103516.db2.gz	SKFINWNIXKNPIR-LLVKDONJSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[C@H]1O	ZINC000595744661	356632337	/nfs/dbraw/zinc/63/23/37/356632337.db2.gz	LKPRLBYLASVLSC-ATCWAGBWSA-N	1	1	321.377	1.506	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[C@H]1O	ZINC000595744661	356632341	/nfs/dbraw/zinc/63/23/41/356632341.db2.gz	LKPRLBYLASVLSC-ATCWAGBWSA-N	1	1	321.377	1.506	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755613	356637831	/nfs/dbraw/zinc/63/78/31/356637831.db2.gz	BJOQBJIHWVLDEH-MEBBXXQBSA-N	1	1	302.334	1.939	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755613	356637833	/nfs/dbraw/zinc/63/78/33/356637833.db2.gz	BJOQBJIHWVLDEH-MEBBXXQBSA-N	1	1	302.334	1.939	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595756501	356638656	/nfs/dbraw/zinc/63/86/56/356638656.db2.gz	GMPCFPUGDNDKMI-WBMJQRKESA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595756501	356638662	/nfs/dbraw/zinc/63/86/62/356638662.db2.gz	GMPCFPUGDNDKMI-WBMJQRKESA-N	1	1	319.361	1.810	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c([N+](=O)[O-])c1	ZINC000595872665	356686780	/nfs/dbraw/zinc/68/67/80/356686780.db2.gz	KLOYHUHEBMQXKW-WBMJQRKESA-N	1	1	324.377	1.933	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1	ZINC000595908469	356701698	/nfs/dbraw/zinc/70/16/98/356701698.db2.gz	IMQLOSMHZXRZHO-GASCZTMLSA-N	1	1	306.366	1.684	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])CCCO1	ZINC000596207345	356814112	/nfs/dbraw/zinc/81/41/12/356814112.db2.gz	DGYLAORCNIALFP-LLVKDONJSA-N	1	1	310.354	1.608	20	5		DDBDMO
Cc1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1C	ZINC000597014781	357041061	/nfs/dbraw/zinc/04/10/61/357041061.db2.gz	RYFJYUWLQMFDJU-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1C	ZINC000597014781	357041065	/nfs/dbraw/zinc/04/10/65/357041065.db2.gz	RYFJYUWLQMFDJU-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cnn4c3CCC4)nc2c1	ZINC000597114927	357064773	/nfs/dbraw/zinc/06/47/73/357064773.db2.gz	CYXFLDXEPVAOSX-UHFFFAOYSA-N	1	1	312.333	1.904	20	5		DDBDMO
CN(CC1C[NH+](C)C1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000598161194	357478505	/nfs/dbraw/zinc/47/85/05/357478505.db2.gz	CAXWMORAQFVFTH-UHFFFAOYSA-N	1	1	303.322	1.105	20	5		DDBDMO
CCC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CC)C(=O)OCC	ZINC000276824299	213116166	/nfs/dbraw/zinc/11/61/66/213116166.db2.gz	OUCPPYNTDWPOIQ-ZDUSSCGKSA-N	1	1	312.370	1.845	20	5		DDBDMO
CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CC)C(=O)OCC	ZINC000276824299	213116168	/nfs/dbraw/zinc/11/61/68/213116168.db2.gz	OUCPPYNTDWPOIQ-ZDUSSCGKSA-N	1	1	312.370	1.845	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC1COC1)c1cccc([N+](=O)[O-])c1	ZINC000599079325	357809056	/nfs/dbraw/zinc/80/90/56/357809056.db2.gz	DPHGMXADXIUISU-AWEZNQCLSA-N	1	1	302.334	1.654	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H]1C[C@@H](O)C1	ZINC000599673868	358019609	/nfs/dbraw/zinc/01/96/09/358019609.db2.gz	UVPFSUZYYATKIJ-VDISTLRHSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237375550	202248367	/nfs/dbraw/zinc/24/83/67/202248367.db2.gz	TVDXZADYHAEZKR-RNCFNFMXSA-N	1	1	317.349	1.813	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000600690441	358283740	/nfs/dbraw/zinc/28/37/40/358283740.db2.gz	KSYJLNKMPQZGBE-LBPRGKRZSA-N	1	1	307.350	1.356	20	5		DDBDMO
CC(C)N1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000601110525	358405476	/nfs/dbraw/zinc/40/54/76/358405476.db2.gz	DIDMRINHMCZAGE-NSHDSACASA-N	1	1	314.345	1.986	20	5		DDBDMO
Cc1cc([N+](=O)[O-])nn1C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1	ZINC000601960860	358754623	/nfs/dbraw/zinc/75/46/23/358754623.db2.gz	WVFGYYWAYBPQCM-INIZCTEOSA-N	1	1	316.361	1.737	20	5		DDBDMO
O=[N+]([O-])c1nccn1C[C@]1(O)CC[N@@H+](Cc2ccccc2)C1	ZINC000601965307	358755919	/nfs/dbraw/zinc/75/59/19/358755919.db2.gz	UAPAUJNZAZIPRZ-HNNXBMFYSA-N	1	1	302.334	1.428	20	5		DDBDMO
Cn1cc(C[N@H+]2CCSC3(CCOCC3)C2)c([N+](=O)[O-])n1	ZINC000602618539	359077630	/nfs/dbraw/zinc/07/76/30/359077630.db2.gz	IXBNMRLBJMNFMQ-UHFFFAOYSA-N	1	1	312.395	1.426	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](C2CCOCC2)C1	ZINC000602793658	359196750	/nfs/dbraw/zinc/19/67/50/359196750.db2.gz	CFASUUYFDAMPIL-AWEZNQCLSA-N	1	1	308.382	1.848	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](CN2CCCC2=O)C1	ZINC000602903828	359284466	/nfs/dbraw/zinc/28/44/66/359284466.db2.gz	SUFAFDCSXSEORT-CYBMUJFWSA-N	1	1	321.381	1.044	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899260	359280935	/nfs/dbraw/zinc/28/09/35/359280935.db2.gz	OYVPQTBVUBQMBM-AAEUAGOBSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899260	359280940	/nfs/dbraw/zinc/28/09/40/359280940.db2.gz	OYVPQTBVUBQMBM-AAEUAGOBSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@@H](OC)C[C@]2(C)CO)cc1[N+](=O)[O-]	ZINC000602963873	359327731	/nfs/dbraw/zinc/32/77/31/359327731.db2.gz	JLEQPQOAGDOFCA-SWLSCSKDSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[C@]1(O)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000602982687	359337665	/nfs/dbraw/zinc/33/76/65/359337665.db2.gz	WUAJRYJQQFKXQC-HOCLYGCPSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)CC[N@@H+](C)C1CC1	ZINC000186782719	200009670	/nfs/dbraw/zinc/00/96/70/200009670.db2.gz	GWFRCXGBMCTDBX-GFCCVEGCSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC000603400393	359616400	/nfs/dbraw/zinc/61/64/00/359616400.db2.gz	HLLCJWDUHKEZBL-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
CC(C)(C(=O)N1CC[NH+](C2CCC2)CC1)n1cc([N+](=O)[O-])cn1	ZINC000609594508	360330625	/nfs/dbraw/zinc/33/06/25/360330625.db2.gz	AGJWRINGKHOPCF-UHFFFAOYSA-N	1	1	321.381	1.223	20	5		DDBDMO
O=C(C[N@@H+](CCCO)C1CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610132906	360384794	/nfs/dbraw/zinc/38/47/94/360384794.db2.gz	CKNWIBSNZSVQOY-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@H+](CCCO)C1CC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610132906	360384795	/nfs/dbraw/zinc/38/47/95/360384795.db2.gz	CKNWIBSNZSVQOY-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])s2)CC1	ZINC000610808399	360542483	/nfs/dbraw/zinc/54/24/83/360542483.db2.gz	IJRXARYEYXTDMG-NSHDSACASA-N	1	1	324.406	1.399	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CC(c3nc4ccccc4[nH]3)C2)c1	ZINC000610844712	360551042	/nfs/dbraw/zinc/55/10/42/360551042.db2.gz	OBWFYEKGXKHYKL-UHFFFAOYSA-N	1	1	312.333	1.767	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C(C)(C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000611165989	360643232	/nfs/dbraw/zinc/64/32/32/360643232.db2.gz	UADBHZXQKUTCFP-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)C[C@H]1C	ZINC000611087903	360619177	/nfs/dbraw/zinc/61/91/77/360619177.db2.gz	QSJOUHINQBFGPK-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)C[C@H]1C	ZINC000611087903	360619178	/nfs/dbraw/zinc/61/91/78/360619178.db2.gz	QSJOUHINQBFGPK-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000611525546	360747021	/nfs/dbraw/zinc/74/70/21/360747021.db2.gz	KEEGBZZHPRZSNQ-LLVKDONJSA-N	1	1	308.382	1.813	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCN(c3[nH+]ccn3C)CC2)n1	ZINC000611616830	360777152	/nfs/dbraw/zinc/77/71/52/360777152.db2.gz	NNGNTBLXIMEAKH-UHFFFAOYSA-N	1	1	316.365	1.667	20	5		DDBDMO
Cn1ccc(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1=O	ZINC000612469088	361032174	/nfs/dbraw/zinc/03/21/74/361032174.db2.gz	JGKPTMLEJKKUKI-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
Cn1ccc(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1=O	ZINC000612469088	361032176	/nfs/dbraw/zinc/03/21/76/361032176.db2.gz	JGKPTMLEJKKUKI-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000193389453	201043282	/nfs/dbraw/zinc/04/32/82/201043282.db2.gz	LJCNPWNMZRQJME-ZDUSSCGKSA-N	1	1	321.425	1.863	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@H]2C(N)=O)n1	ZINC000359099315	299327997	/nfs/dbraw/zinc/32/79/97/299327997.db2.gz	VFLMGVYXNSFZMO-LBPRGKRZSA-N	1	1	321.381	1.358	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000579422462	422764652	/nfs/dbraw/zinc/76/46/52/422764652.db2.gz	RKXDSZADPBWGNR-GFCCVEGCSA-N	1	1	309.366	1.393	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC3(C[NH+](C)C3)C2)c1[N+](=O)[O-]	ZINC000618920882	363801545	/nfs/dbraw/zinc/80/15/45/363801545.db2.gz	GSJQTBJJKXWBDJ-UHFFFAOYSA-N	1	1	307.354	1.048	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249601785	202806362	/nfs/dbraw/zinc/80/63/62/202806362.db2.gz	YNTVMQWAUQGVFC-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249601785	202806366	/nfs/dbraw/zinc/80/63/66/202806366.db2.gz	YNTVMQWAUQGVFC-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000275067543	212101930	/nfs/dbraw/zinc/10/19/30/212101930.db2.gz	AHXMBWQYVPLIHR-GXSJLCMTSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000275067543	212101932	/nfs/dbraw/zinc/10/19/32/212101932.db2.gz	AHXMBWQYVPLIHR-GXSJLCMTSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000275067543	212101937	/nfs/dbraw/zinc/10/19/37/212101937.db2.gz	AHXMBWQYVPLIHR-GXSJLCMTSA-N	1	1	309.370	1.293	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc(C)ccc2[N+](=O)[O-])C1	ZINC000266073064	205074219	/nfs/dbraw/zinc/07/42/19/205074219.db2.gz	FLUDKRYKWZYYEQ-LBPRGKRZSA-N	1	1	307.350	1.354	20	5		DDBDMO
O=C(N[C@H](CO)C[NH+]1CCCCC1)c1ccc([N+](=O)[O-])s1	ZINC000288499349	220181303	/nfs/dbraw/zinc/18/13/03/220181303.db2.gz	MJFGACROHXRHEX-JTQLQIEISA-N	1	1	313.379	1.233	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000435994645	307305036	/nfs/dbraw/zinc/30/50/36/307305036.db2.gz	OSTKKZVPYWJLOQ-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000273900663	211156902	/nfs/dbraw/zinc/15/69/02/211156902.db2.gz	BOIYCNXYGFLFAL-ZDUSSCGKSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=C(NC1CC1)N[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000273900663	211156905	/nfs/dbraw/zinc/15/69/05/211156905.db2.gz	BOIYCNXYGFLFAL-ZDUSSCGKSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CCOC[C@@H]2[C@@H]2CCC[C@H]2O)cc1	ZINC000285020503	218258502	/nfs/dbraw/zinc/25/85/02/218258502.db2.gz	ZCFHCPNTCCCPCM-GVDBMIGSSA-N	1	1	320.389	1.999	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000106394222	194206634	/nfs/dbraw/zinc/20/66/34/194206634.db2.gz	CWMRAVPSGNQKRH-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917676	251276372	/nfs/dbraw/zinc/27/63/72/251276372.db2.gz	UWDBFHJLMILHSN-JOYOIKCWSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917676	251276377	/nfs/dbraw/zinc/27/63/77/251276377.db2.gz	UWDBFHJLMILHSN-JOYOIKCWSA-N	1	1	304.306	1.600	20	5		DDBDMO
COc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000418996550	532958912	/nfs/dbraw/zinc/95/89/12/532958912.db2.gz	FJSNLTQUGGGNER-NWDGAFQWSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)c2ccccc2C1	ZINC000352581870	285155947	/nfs/dbraw/zinc/15/59/47/285155947.db2.gz	AGYWZMBXVOKQIC-UHFFFAOYSA-N	1	1	301.306	1.410	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)c2ccccc2C1	ZINC000352581870	285155949	/nfs/dbraw/zinc/15/59/49/285155949.db2.gz	AGYWZMBXVOKQIC-UHFFFAOYSA-N	1	1	301.306	1.410	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)[C@H]1CCC[C@H]1O	ZINC000352659750	285204258	/nfs/dbraw/zinc/20/42/58/285204258.db2.gz	LDZFEUSGPDYADK-DDTOSNHZSA-N	1	1	307.350	1.767	20	5		DDBDMO
COC[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000452042393	285267376	/nfs/dbraw/zinc/26/73/76/285267376.db2.gz	TZAMINWOYYCISV-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1	ZINC000299221371	533215019	/nfs/dbraw/zinc/21/50/19/533215019.db2.gz	NGZCCQJLIFHMAS-ZFWWWQNUSA-N	1	1	319.361	1.960	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)[N@@H+](C)C1	ZINC000331971429	533283936	/nfs/dbraw/zinc/28/39/36/533283936.db2.gz	LAHWMCRFOFHVOZ-GJZGRUSLSA-N	1	1	319.361	1.199	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000075676209	406939353	/nfs/dbraw/zinc/93/93/53/406939353.db2.gz	LEUUGHXPFCNKDJ-CQSZACIVSA-N	1	1	307.350	1.124	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000077309133	406984818	/nfs/dbraw/zinc/98/48/18/406984818.db2.gz	IWAVLLCIVSKTOI-UHFFFAOYSA-N	1	1	324.356	1.101	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(CC(F)F)CC2)n1	ZINC000091084859	407176252	/nfs/dbraw/zinc/17/62/52/407176252.db2.gz	GYLHQSCPRZBEMK-UHFFFAOYSA-N	1	1	303.313	1.064	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000066832928	407260093	/nfs/dbraw/zinc/26/00/93/407260093.db2.gz	JOTRDEHLGFQHCT-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000066832928	407260094	/nfs/dbraw/zinc/26/00/94/407260094.db2.gz	JOTRDEHLGFQHCT-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O)C1CCCCC1	ZINC000123434659	407328817	/nfs/dbraw/zinc/32/88/17/407328817.db2.gz	SBOFPTVNUVXXPN-UHFFFAOYSA-N	1	1	322.365	1.690	20	5		DDBDMO
CC[NH+]1CCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000067374423	407272005	/nfs/dbraw/zinc/27/20/05/407272005.db2.gz	VWAXVGFLZLBVPT-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCCOC1	ZINC000107696849	407378198	/nfs/dbraw/zinc/37/81/98/407378198.db2.gz	MGEQTVWHGGWOIJ-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
COc1ccc(C(=O)NC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000108341334	407384729	/nfs/dbraw/zinc/38/47/29/407384729.db2.gz	KSSVFQROQOSGLK-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000127498491	407438855	/nfs/dbraw/zinc/43/88/55/407438855.db2.gz	HVPMAKGSLRFCGD-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](C(N)=O)C(C)(C)C	ZINC000109331391	407397495	/nfs/dbraw/zinc/39/74/95/407397495.db2.gz	KBGXLFFRXBIROQ-CYBMUJFWSA-N	1	1	322.365	1.331	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](C)N1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000127716538	407459180	/nfs/dbraw/zinc/45/91/80/407459180.db2.gz	NRILAAWMYZHLJG-KBPBESRZSA-N	1	1	306.410	1.881	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@@H](C)C1	ZINC000265947300	407523207	/nfs/dbraw/zinc/52/32/07/407523207.db2.gz	KAYVJKIEIKPNQH-CMPLNLGQSA-N	1	1	323.397	1.439	20	5		DDBDMO
C[C@@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC000185863090	407523764	/nfs/dbraw/zinc/52/37/64/407523764.db2.gz	QIKNQBFEYKAGSD-AWEZNQCLSA-N	1	1	306.410	1.710	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000129458012	407612998	/nfs/dbraw/zinc/61/29/98/407612998.db2.gz	QGZRAUNSPQGQBF-CYBMUJFWSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CCCCCO)CC1	ZINC000266739739	407618120	/nfs/dbraw/zinc/61/81/20/407618120.db2.gz	MZCMHYFCEBWYGC-UHFFFAOYSA-N	1	1	321.377	1.515	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](CO)C1	ZINC000266922689	407678495	/nfs/dbraw/zinc/67/84/95/407678495.db2.gz	MIOJDRXESDLHHN-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[N@@H+](C)[C@H]1CCSC1	ZINC000179259065	407761732	/nfs/dbraw/zinc/76/17/32/407761732.db2.gz	QLSVBUGEHUCIQH-ZDUSSCGKSA-N	1	1	323.418	1.991	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000268051513	407869164	/nfs/dbraw/zinc/86/91/64/407869164.db2.gz	QBFWICJFOFXSJG-UHFFFAOYSA-N	1	1	323.393	1.612	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H](O)C[C@H]2CO)o1	ZINC000187668838	407878060	/nfs/dbraw/zinc/87/80/60/407878060.db2.gz	PLDGINFVUMTOQM-RYUDHWBXSA-N	1	1	318.329	1.782	20	5		DDBDMO
CC[N@H+]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000118826840	407949405	/nfs/dbraw/zinc/94/94/05/407949405.db2.gz	DVNIPWIDGZWZAZ-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
CCN1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000118826840	407949414	/nfs/dbraw/zinc/94/94/14/407949414.db2.gz	DVNIPWIDGZWZAZ-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
CCN1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000118826840	407949422	/nfs/dbraw/zinc/94/94/22/407949422.db2.gz	DVNIPWIDGZWZAZ-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
COC(=O)CC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000154273137	408007603	/nfs/dbraw/zinc/00/76/03/408007603.db2.gz	XXGDULIAXUFTMA-CQSZACIVSA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1ccc(NC(=O)NC[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000272865605	408014644	/nfs/dbraw/zinc/01/46/44/408014644.db2.gz	SVGSUJZWFBCGHL-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)CC[N@H+]1C[C@H](C)O	ZINC000268479686	408065225	/nfs/dbraw/zinc/06/52/25/408065225.db2.gz	LCRLUWVUTSKYIN-AAEUAGOBSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182220767	408099032	/nfs/dbraw/zinc/09/90/32/408099032.db2.gz	DQGXXAUHODJIDV-MCIONIFRSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CC[N@H+]2CCC[C@@H]2C1	ZINC000182240993	408104843	/nfs/dbraw/zinc/10/48/43/408104843.db2.gz	USQXRHZWBVNUCK-KGLIPLIRSA-N	1	1	321.377	1.115	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(CO)CC1	ZINC000190009697	408145036	/nfs/dbraw/zinc/14/50/36/408145036.db2.gz	AHZFOKCVOXAIOA-LBPRGKRZSA-N	1	1	310.350	1.039	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000182492231	408179094	/nfs/dbraw/zinc/17/90/94/408179094.db2.gz	LZPBWQMQNGGYDP-UPJWGTAASA-N	1	1	310.350	1.037	20	5		DDBDMO
CCOC(=O)C1(O)CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000273496463	408223157	/nfs/dbraw/zinc/22/31/57/408223157.db2.gz	XWNYHXVAMWAEPG-UHFFFAOYSA-N	1	1	322.361	1.793	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000151201725	408274588	/nfs/dbraw/zinc/27/45/88/408274588.db2.gz	PPQHYZSTGZVYKW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000151201725	408274596	/nfs/dbraw/zinc/27/45/96/408274596.db2.gz	PPQHYZSTGZVYKW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000246756425	408333124	/nfs/dbraw/zinc/33/31/24/408333124.db2.gz	BPZHPKOFDGUVHB-IUODEOHRSA-N	1	1	305.378	1.982	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000183202354	408351849	/nfs/dbraw/zinc/35/18/49/408351849.db2.gz	UVHSEDUHHAFEIX-QWRGUYRKSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246889178	408361692	/nfs/dbraw/zinc/36/16/92/408361692.db2.gz	IUDPJRCCILMRBC-ZIAGYGMSSA-N	1	1	319.409	1.960	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000177001273	408495582	/nfs/dbraw/zinc/49/55/82/408495582.db2.gz	VOLLBBZBLOSHEZ-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000264538364	408526522	/nfs/dbraw/zinc/52/65/22/408526522.db2.gz	AGVMVPBCJHUVEQ-GFCCVEGCSA-N	1	1	308.338	1.437	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])cc1OC	ZINC000191724891	408477175	/nfs/dbraw/zinc/47/71/75/408477175.db2.gz	PFSWXKMPMJJOFV-PWSUYJOCSA-N	1	1	310.350	1.672	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H]([C@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000248529511	408582070	/nfs/dbraw/zinc/58/20/70/408582070.db2.gz	DSAWPCPXUKTZTM-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000192619679	408619106	/nfs/dbraw/zinc/61/91/06/408619106.db2.gz	ABCDTGJNYQCLON-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCC[N@H+]1CCCOCC1	ZINC000192619679	408619109	/nfs/dbraw/zinc/61/91/09/408619109.db2.gz	ABCDTGJNYQCLON-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COC[C@H]1CCCO1	ZINC000248784317	408632969	/nfs/dbraw/zinc/63/29/69/408632969.db2.gz	XLFIXPBKJDHMEO-HUUCEWRRSA-N	1	1	324.377	1.583	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000185309818	408794233	/nfs/dbraw/zinc/79/42/33/408794233.db2.gz	MXOZXUWPJWJYAP-SKDRFNHKSA-N	1	1	307.354	1.031	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000249583228	408746394	/nfs/dbraw/zinc/74/63/94/408746394.db2.gz	RYCHDWKQRXKZHQ-BXUZGUMPSA-N	1	1	310.350	1.685	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000270932652	408747062	/nfs/dbraw/zinc/74/70/62/408747062.db2.gz	QIWAYYPVQJQEHU-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000270932652	408747068	/nfs/dbraw/zinc/74/70/68/408747068.db2.gz	QIWAYYPVQJQEHU-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000249699037	408756940	/nfs/dbraw/zinc/75/69/40/408756940.db2.gz	WMUQOSNHKKFNMV-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c1[N+](=O)[O-]	ZINC000185128309	408764997	/nfs/dbraw/zinc/76/49/97/408764997.db2.gz	QNRDFNIVVJHSNI-AEJSXWLSSA-N	1	1	307.354	1.080	20	5		DDBDMO
C[N@H+](CCCCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000276455691	408861244	/nfs/dbraw/zinc/86/12/44/408861244.db2.gz	WNGHTXMMYOTGGG-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[N@@H+](CCCCO)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000276455691	408861248	/nfs/dbraw/zinc/86/12/48/408861248.db2.gz	WNGHTXMMYOTGGG-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[NH+]3CCC2CC3)c1	ZINC000191077404	163170843	/nfs/dbraw/zinc/17/08/43/163170843.db2.gz	LSBUAPUHBHZNJX-UHFFFAOYSA-N	1	1	311.363	1.064	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278121958	409069475	/nfs/dbraw/zinc/06/94/75/409069475.db2.gz	LSYJNICKOFVECU-LBPRGKRZSA-N	1	1	303.322	1.182	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293762887	409176523	/nfs/dbraw/zinc/17/65/23/409176523.db2.gz	PDSGYYYLJNBECO-CHWSQXEVSA-N	1	1	321.425	1.464	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)CCn3cc([N+](=O)[O-])cn3)C2)C1	ZINC000294128155	409245185	/nfs/dbraw/zinc/24/51/85/409245185.db2.gz	MECLBPKDIMLTRX-OAHLLOKOSA-N	1	1	321.381	1.126	20	5		DDBDMO
CCOC(=O)c1ccnc(NCC[N@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000280142496	409257628	/nfs/dbraw/zinc/25/76/28/409257628.db2.gz	FHLAEAAFZHPHQN-UHFFFAOYSA-N	1	1	320.349	1.840	20	5		DDBDMO
CCOC(=O)c1ccnc(NCC[N@@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000280142496	409257632	/nfs/dbraw/zinc/25/76/32/409257632.db2.gz	FHLAEAAFZHPHQN-UHFFFAOYSA-N	1	1	320.349	1.840	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NCC[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000294780844	409303547	/nfs/dbraw/zinc/30/35/47/409303547.db2.gz	GUAMNCUVWINMPS-UHFFFAOYSA-N	1	1	324.356	1.624	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ncccc1[N+](=O)[O-])C(C)C	ZINC000295047090	409308819	/nfs/dbraw/zinc/30/88/19/409308819.db2.gz	XFQIJGGTVSBSKH-LBPRGKRZSA-N	1	1	310.354	1.579	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[N@@H+](CCCO)C1	ZINC000295498736	409317283	/nfs/dbraw/zinc/31/72/83/409317283.db2.gz	PBGBMBXMUBAYGJ-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cn1ccc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1	ZINC000295979244	409389522	/nfs/dbraw/zinc/38/95/22/409389522.db2.gz	JYLDVMIOSXOUDW-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3ncc([N+](=O)[O-])cc3Cl)[C@H]2C1	ZINC000284571799	409351517	/nfs/dbraw/zinc/35/15/17/409351517.db2.gz	OKWSUCKTVFRBON-NWDGAFQWSA-N	1	1	312.757	1.553	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1cccc([N+](=O)[O-])c1	ZINC000295389566	409461517	/nfs/dbraw/zinc/46/15/17/409461517.db2.gz	HMWSHXVDZWYLHV-CYBMUJFWSA-N	1	1	307.350	1.171	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356725046	409551131	/nfs/dbraw/zinc/55/11/31/409551131.db2.gz	DJNSDUTWTRTTSK-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
CC[N@H+](Cc1cccc(F)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304302908	409598956	/nfs/dbraw/zinc/59/89/56/409598956.db2.gz	IQZOGWMHRGYCBU-OAHLLOKOSA-N	1	1	322.340	1.813	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000331533983	409611901	/nfs/dbraw/zinc/61/19/01/409611901.db2.gz	POWVGFFLXBATOO-ZANVPECISA-N	1	1	307.325	1.946	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000356835048	409647940	/nfs/dbraw/zinc/64/79/40/409647940.db2.gz	BFTQUMIKABYBSH-NEPJUHHUSA-N	1	1	323.397	1.349	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000338183025	409782584	/nfs/dbraw/zinc/78/25/84/409782584.db2.gz	YYNSCWTYYMWMEJ-UHFFFAOYSA-N	1	1	320.353	1.238	20	5		DDBDMO
C[C@@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1	ZINC000357308547	409967225	/nfs/dbraw/zinc/96/72/25/409967225.db2.gz	WNYSRUZWRVXNEZ-QWRGUYRKSA-N	1	1	321.381	1.621	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332228480	409994862	/nfs/dbraw/zinc/99/48/62/409994862.db2.gz	LIEXJGVTLDXTAY-WDEREUQCSA-N	1	1	303.366	1.996	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1COC[C@H]1O	ZINC000339192479	410069434	/nfs/dbraw/zinc/06/94/34/410069434.db2.gz	GDTHDUPFQOHNEI-NWDGAFQWSA-N	1	1	320.267	1.805	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1COC[C@H]1O	ZINC000339192479	410069438	/nfs/dbraw/zinc/06/94/38/410069438.db2.gz	GDTHDUPFQOHNEI-NWDGAFQWSA-N	1	1	320.267	1.805	20	5		DDBDMO
CCOc1ccc(C(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000357601771	410125924	/nfs/dbraw/zinc/12/59/24/410125924.db2.gz	RQZABKWMYFTRBQ-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
COc1ccc(OCCN2CC[C@H]([C@H](C)[NH3+])C2)c([N+](=O)[O-])c1	ZINC000351847589	410287026	/nfs/dbraw/zinc/28/70/26/410287026.db2.gz	AQPRIDCYSKHMQV-RYUDHWBXSA-N	1	1	309.366	1.651	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000357916701	410323912	/nfs/dbraw/zinc/32/39/12/410323912.db2.gz	WSEVJZYYJYOOAN-GFCCVEGCSA-N	1	1	323.397	1.713	20	5		DDBDMO
COc1ccc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000347011791	410312581	/nfs/dbraw/zinc/31/25/81/410312581.db2.gz	MLGILANBLTWHOU-CYBMUJFWSA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1ccc(CNC(=O)N2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000298924140	410452604	/nfs/dbraw/zinc/45/26/04/410452604.db2.gz	JLSTZINWACZGLT-UHFFFAOYSA-N	1	1	322.365	1.451	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000352186866	410533245	/nfs/dbraw/zinc/53/32/45/410533245.db2.gz	OJQDLPLIFVPMMG-UONOGXRCSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000343580961	410548748	/nfs/dbraw/zinc/54/87/48/410548748.db2.gz	XYYLRHIMFQBWQE-NSHDSACASA-N	1	1	324.356	1.920	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000343595921	410560314	/nfs/dbraw/zinc/56/03/14/410560314.db2.gz	HSOGKQHRPSGMBC-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCC[N@H+]1C	ZINC000355924339	410735896	/nfs/dbraw/zinc/73/58/96/410735896.db2.gz	ZBDOFTHHXBSYOZ-JOYOIKCWSA-N	1	1	317.349	1.684	20	5		DDBDMO
Cn1cc[nH+]c1C[C@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000301717971	410779654	/nfs/dbraw/zinc/77/96/54/410779654.db2.gz	OKRQQLNXNWEZQX-SNVBAGLBSA-N	1	1	317.353	1.160	20	5		DDBDMO
CC[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1c(C)nn(C)c1C	ZINC000348048396	410823751	/nfs/dbraw/zinc/82/37/51/410823751.db2.gz	PPUAAGFCLVUXTE-NSHDSACASA-N	1	1	306.370	1.920	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000301890183	410824688	/nfs/dbraw/zinc/82/46/88/410824688.db2.gz	TWUVLKJBCHORFP-LLVKDONJSA-N	1	1	304.354	1.416	20	5		DDBDMO
COc1cc(N2C[C@H]3OCC[N@@H+](C)[C@@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000301943198	410832204	/nfs/dbraw/zinc/83/22/04/410832204.db2.gz	XYMNQXUWVUXUFE-TZMCWYRMSA-N	1	1	311.313	1.262	20	5		DDBDMO
CN(CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000348211746	410856457	/nfs/dbraw/zinc/85/64/57/410856457.db2.gz	FXNIZQZDTQYCEX-CYBMUJFWSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000302823498	410869031	/nfs/dbraw/zinc/86/90/31/410869031.db2.gz	UYTOVVBFFMROMS-LBPRGKRZSA-N	1	1	309.341	1.892	20	5		DDBDMO
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[NH+]1CCC1	ZINC000337621266	410903548	/nfs/dbraw/zinc/90/35/48/410903548.db2.gz	OSPRHTBGMRSZRW-LLVKDONJSA-N	1	1	309.391	1.897	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344070171	410935357	/nfs/dbraw/zinc/93/53/57/410935357.db2.gz	QCESWHXJBJBEJF-SGMGOOAPSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344070171	410935359	/nfs/dbraw/zinc/93/53/59/410935359.db2.gz	QCESWHXJBJBEJF-SGMGOOAPSA-N	1	1	319.361	1.544	20	5		DDBDMO
C[NH+]1CCC(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000129004834	196011733	/nfs/dbraw/zinc/01/17/33/196011733.db2.gz	DKCGPSWXUYRPLC-UHFFFAOYSA-N	1	1	317.349	1.543	20	5		DDBDMO
O=C(NC[C@H]1CCC[NH2+]C1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000129818942	196078467	/nfs/dbraw/zinc/07/84/67/196078467.db2.gz	DISBGAHEELPXIK-VIFPVBQESA-N	1	1	303.322	1.201	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000131548850	196178630	/nfs/dbraw/zinc/17/86/30/196178630.db2.gz	GDWLWISYATYZGK-AWEZNQCLSA-N	1	1	321.377	1.052	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000366737319	418510832	/nfs/dbraw/zinc/51/08/32/418510832.db2.gz	GRXHWOBFYZVVGM-CYBMUJFWSA-N	1	1	309.322	1.348	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2OCC(=O)N[C@@H]2C1	ZINC000366810982	418519889	/nfs/dbraw/zinc/51/98/89/418519889.db2.gz	QQKQLROFQGJROF-LERXQTSPSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2OCC(=O)N[C@@H]2C1	ZINC000366810982	418519892	/nfs/dbraw/zinc/51/98/92/418519892.db2.gz	QQKQLROFQGJROF-LERXQTSPSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COC[C@@H]1CCCO1	ZINC000192707574	418527075	/nfs/dbraw/zinc/52/70/75/418527075.db2.gz	XLFIXPBKJDHMEO-CABCVRRESA-N	1	1	324.377	1.583	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NCC[N@@H+](C)C1CCCCC1	ZINC000360575213	418468718	/nfs/dbraw/zinc/46/87/18/418468718.db2.gz	WEQNDZOXCVSBJJ-UHFFFAOYSA-N	1	1	309.370	1.323	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)n1	ZINC000191678694	222107517	/nfs/dbraw/zinc/10/75/17/222107517.db2.gz	WECAAVLCWGPBQZ-RYUDHWBXSA-N	1	1	321.381	1.368	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000375057011	418598125	/nfs/dbraw/zinc/59/81/25/418598125.db2.gz	DPTNQYBJAPRMEX-IUODEOHRSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@@H]([NH2+]Cc2ccccc2)C1	ZINC000361342567	418630551	/nfs/dbraw/zinc/63/05/51/418630551.db2.gz	NLRPSRQTIDVRPF-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
CO[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362575	418635623	/nfs/dbraw/zinc/63/56/23/418635623.db2.gz	TYPVGOVIHFKGSI-VXGBXAGGSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362575	418635624	/nfs/dbraw/zinc/63/56/24/418635624.db2.gz	TYPVGOVIHFKGSI-VXGBXAGGSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000408113048	418787909	/nfs/dbraw/zinc/78/79/09/418787909.db2.gz	PUCAZXFUQMTZSW-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000408113048	418787911	/nfs/dbraw/zinc/78/79/11/418787911.db2.gz	PUCAZXFUQMTZSW-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
Cc1cc(C(=O)N2CCC[N@H+]([C@H](C)CO)CC2)cc([N+](=O)[O-])c1	ZINC000364922267	418822818	/nfs/dbraw/zinc/82/28/18/418822818.db2.gz	MQEUVYRMDRSAOZ-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC(=O)c1ccc(N2CCC[N@H+]([C@H](C)CO)CC2)c([N+](=O)[O-])c1	ZINC000364954051	418828092	/nfs/dbraw/zinc/82/80/92/418828092.db2.gz	JEKBGCMVJPMVNY-GFCCVEGCSA-N	1	1	321.377	1.690	20	5		DDBDMO
Cn1ccnc1[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000365649777	418889198	/nfs/dbraw/zinc/88/91/98/418889198.db2.gz	PKJXJYSQFHYCOI-GFCCVEGCSA-N	1	1	304.354	1.404	20	5		DDBDMO
CCN(CC)C(=O)[C@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280826	418851282	/nfs/dbraw/zinc/85/12/82/418851282.db2.gz	GGUXTZHUNZNGBI-QWHCGFSZSA-N	1	1	323.397	1.685	20	5		DDBDMO
CCN(CC)C(=O)[C@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280826	418851284	/nfs/dbraw/zinc/85/12/84/418851284.db2.gz	GGUXTZHUNZNGBI-QWHCGFSZSA-N	1	1	323.397	1.685	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C1(C(=O)N(C)C)CC1	ZINC000411914761	419481812	/nfs/dbraw/zinc/48/18/12/419481812.db2.gz	QSQXITSTLLQRPD-UHFFFAOYSA-N	1	1	320.349	1.052	20	5		DDBDMO
CC(=O)N[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000420990901	419429599	/nfs/dbraw/zinc/42/95/99/419429599.db2.gz	VHKSAUJAGDGPQO-ZDUSSCGKSA-N	1	1	320.349	1.134	20	5		DDBDMO
COCC(COC)[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000411840497	419433218	/nfs/dbraw/zinc/43/32/18/419433218.db2.gz	DGHGXTYOELOTPX-UHFFFAOYSA-N	1	1	323.393	1.374	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421002928	419438561	/nfs/dbraw/zinc/43/85/61/419438561.db2.gz	BYHULHAPJANSOQ-BNOWGMLFSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421009413	419445341	/nfs/dbraw/zinc/44/53/41/419445341.db2.gz	QAXQJPDJGVWYRK-WFASDCNBSA-N	1	1	320.393	1.948	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000411949195	419518528	/nfs/dbraw/zinc/51/85/28/419518528.db2.gz	NDLJHUYDURLZCJ-SECBINFHSA-N	1	1	313.304	1.783	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000411949195	419518532	/nfs/dbraw/zinc/51/85/32/419518532.db2.gz	NDLJHUYDURLZCJ-SECBINFHSA-N	1	1	313.304	1.783	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)[nH]1	ZINC000412029358	419574746	/nfs/dbraw/zinc/57/47/46/419574746.db2.gz	OJHPQCWEVCCEIK-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n1	ZINC000412029358	419574754	/nfs/dbraw/zinc/57/47/54/419574754.db2.gz	OJHPQCWEVCCEIK-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n1	ZINC000412029358	419574765	/nfs/dbraw/zinc/57/47/65/419574765.db2.gz	OJHPQCWEVCCEIK-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000412029358	419574774	/nfs/dbraw/zinc/57/47/74/419574774.db2.gz	OJHPQCWEVCCEIK-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000412029358	419574782	/nfs/dbraw/zinc/57/47/82/419574782.db2.gz	OJHPQCWEVCCEIK-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000421709141	419692689	/nfs/dbraw/zinc/69/26/89/419692689.db2.gz	CRKWUVXYONEQRB-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)C1	ZINC000421767823	419717204	/nfs/dbraw/zinc/71/72/04/419717204.db2.gz	MEMZHEUUMDZHHM-CYBMUJFWSA-N	1	1	321.377	1.662	20	5		DDBDMO
[NH3+]Cc1cn([C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3)C2)nn1	ZINC000415134784	419960617	/nfs/dbraw/zinc/96/06/17/419960617.db2.gz	WDVMAQVRBKXBCK-HNNXBMFYSA-N	1	1	316.365	1.482	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[NH2+]C[C@H]1c1cccc(F)c1	ZINC000423615278	420100152	/nfs/dbraw/zinc/10/01/52/420100152.db2.gz	QVQURURRFWJAKK-LBPRGKRZSA-N	1	1	319.296	1.244	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC([C@H](C)[NH3+])CC1	ZINC000430947495	420219932	/nfs/dbraw/zinc/21/99/32/420219932.db2.gz	BHDWQTNXGYSWRK-NWDGAFQWSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CCO)C1CCC1	ZINC000439300978	420505947	/nfs/dbraw/zinc/50/59/47/420505947.db2.gz	RZMYNAGBXLCJQT-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCO)C1CCC1	ZINC000439300978	420505949	/nfs/dbraw/zinc/50/59/49/420505949.db2.gz	RZMYNAGBXLCJQT-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)on1	ZINC000441241724	420642320	/nfs/dbraw/zinc/64/23/20/420642320.db2.gz	YZVOIEBLZPHMMN-CHWSQXEVSA-N	1	1	321.337	1.286	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000493298965	420812592	/nfs/dbraw/zinc/81/25/92/420812592.db2.gz	ZTFULIUITSYUIV-URWSZGRFSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000493298965	420812597	/nfs/dbraw/zinc/81/25/97/420812597.db2.gz	ZTFULIUITSYUIV-URWSZGRFSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000454370395	420848008	/nfs/dbraw/zinc/84/80/08/420848008.db2.gz	XWQVZCZZSVGCNM-HIFRSBDPSA-N	1	1	318.377	1.483	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)c1	ZINC000459813037	420880620	/nfs/dbraw/zinc/88/06/20/420880620.db2.gz	VYVDJQNQEDEQDH-LSDHHAIUSA-N	1	1	308.382	1.664	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000455879220	421072609	/nfs/dbraw/zinc/07/26/09/421072609.db2.gz	CBBPRZDXJQOUEJ-ZJUUUORDSA-N	1	1	319.365	1.387	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC[C@@H]1C1CCC1	ZINC000563083440	421452512	/nfs/dbraw/zinc/45/25/12/421452512.db2.gz	NCGOAUOYPPZCQU-CQSZACIVSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@@H]1C1CCC1	ZINC000563083440	421452516	/nfs/dbraw/zinc/45/25/16/421452516.db2.gz	NCGOAUOYPPZCQU-CQSZACIVSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1(C)C	ZINC000550133017	421513173	/nfs/dbraw/zinc/51/31/73/421513173.db2.gz	WIHYDCHWYMYPJF-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1(C)C	ZINC000550133017	421513177	/nfs/dbraw/zinc/51/31/77/421513177.db2.gz	WIHYDCHWYMYPJF-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])cn2C)[nH+]c1	ZINC000531011650	421621405	/nfs/dbraw/zinc/62/14/05/421621405.db2.gz	ZVQZVAQQIVTFOB-UHFFFAOYSA-N	1	1	317.349	1.869	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCC[C@@H](C)C1	ZINC000518772203	421667053	/nfs/dbraw/zinc/66/70/53/421667053.db2.gz	ZYNLXLMVKZXSSG-NEPJUHHUSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000554597369	421653878	/nfs/dbraw/zinc/65/38/78/421653878.db2.gz	DYDQYZILULHJMH-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cn1cc([C@H]2C[N@@H+](Cc3c([N+](=O)[O-])ncn3C)CC2(C)C)cn1	ZINC000571341434	421706734	/nfs/dbraw/zinc/70/67/34/421706734.db2.gz	LEBARNAKWSGBFX-GFCCVEGCSA-N	1	1	318.381	1.687	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000522306428	421824122	/nfs/dbraw/zinc/82/41/22/421824122.db2.gz	PDRSBBZZUDAVPY-GFCCVEGCSA-N	1	1	304.350	1.631	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000521837237	421800568	/nfs/dbraw/zinc/80/05/68/421800568.db2.gz	CVKIQZORZYNMRS-JTQLQIEISA-N	1	1	305.338	1.504	20	5		DDBDMO
CC[C@@]1(O)CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000602983652	422441032	/nfs/dbraw/zinc/44/10/32/422441032.db2.gz	PAQWYFGYFVSFIA-MRXNPFEDSA-N	1	1	321.377	1.795	20	5		DDBDMO
CC[C@@]1(O)CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000602983652	422441039	/nfs/dbraw/zinc/44/10/39/422441039.db2.gz	PAQWYFGYFVSFIA-MRXNPFEDSA-N	1	1	321.377	1.795	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@]12CCOC2	ZINC000341956080	271259402	/nfs/dbraw/zinc/25/94/02/271259402.db2.gz	SKIYNELTTRYQKY-CZUORRHYSA-N	1	1	322.361	1.589	20	5		DDBDMO
CN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347005001	272601600	/nfs/dbraw/zinc/60/16/00/272601600.db2.gz	KVUFLNXKPUOMMR-CQSZACIVSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])c2ncccc12	ZINC000413312699	274348786	/nfs/dbraw/zinc/34/87/86/274348786.db2.gz	GHUZBLBILRPHMV-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCC[NH+]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC000302751134	276013270	/nfs/dbraw/zinc/01/32/70/276013270.db2.gz	HEFOXTJXFVSGKJ-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
CC[NH+]1CCC(N(C)C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000331218234	276148941	/nfs/dbraw/zinc/14/89/41/276148941.db2.gz	RQNZXIMNNDCCLH-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)[C@@H]2C1	ZINC000272188275	277146727	/nfs/dbraw/zinc/14/67/27/277146727.db2.gz	LOSVBPJDZDEBNU-BXKDBHETSA-N	1	1	303.322	1.661	20	5		DDBDMO
COC(=O)CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C(C)C	ZINC000090549146	277316994	/nfs/dbraw/zinc/31/69/94/277316994.db2.gz	XIGKNKDZAOCVSV-UHFFFAOYSA-N	1	1	311.338	1.030	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269629460	279036923	/nfs/dbraw/zinc/03/69/23/279036923.db2.gz	FAGUJVBMSMTZCX-XJKSGUPXSA-N	1	1	307.394	1.902	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCCN2CC[NH+]([C@H]3CCOC3)CC2)c1	ZINC000362222651	300031511	/nfs/dbraw/zinc/03/15/11/300031511.db2.gz	ZWISPTSJRFWBMY-HNNXBMFYSA-N	1	1	321.377	1.380	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC000362454188	300067721	/nfs/dbraw/zinc/06/77/21/300067721.db2.gz	UOLSJQINWYVUOS-UHFFFAOYSA-N	1	1	316.361	1.938	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000363324522	300251209	/nfs/dbraw/zinc/25/12/09/300251209.db2.gz	PQZHIGBGNIIQGF-KBPBESRZSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000363564387	300283069	/nfs/dbraw/zinc/28/30/69/300283069.db2.gz	TXAHQHKEHIWWFB-UONOGXRCSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOCC2(CCCC2)C1	ZINC000364331426	300377909	/nfs/dbraw/zinc/37/79/09/300377909.db2.gz	YYIAFCZAXVTBHV-UHFFFAOYSA-N	1	1	321.377	1.649	20	5		DDBDMO
O=C(N[C@H]1CCC[NH2+]CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000368710413	301079843	/nfs/dbraw/zinc/07/98/43/301079843.db2.gz	SRQSHFRTRSNJLF-VIFPVBQESA-N	1	1	303.322	1.343	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369972656	301249432	/nfs/dbraw/zinc/24/94/32/301249432.db2.gz	HTVLPBIZLYYOMT-LBPRGKRZSA-N	1	1	309.370	1.297	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369972656	301249434	/nfs/dbraw/zinc/24/94/34/301249434.db2.gz	HTVLPBIZLYYOMT-LBPRGKRZSA-N	1	1	309.370	1.297	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)n1	ZINC000378306323	302309769	/nfs/dbraw/zinc/30/97/69/302309769.db2.gz	AFAWYIAPAJOWDX-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)n1	ZINC000378306323	302309772	/nfs/dbraw/zinc/30/97/72/302309772.db2.gz	AFAWYIAPAJOWDX-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)ccc1F	ZINC000444739313	302394859	/nfs/dbraw/zinc/39/48/59/302394859.db2.gz	ADNONFMTAHSAHZ-AWEZNQCLSA-N	1	1	322.340	1.732	20	5		DDBDMO
C[NH+](C)C[C@H]1CCCCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000532891443	303301262	/nfs/dbraw/zinc/30/12/62/303301262.db2.gz	LWGBXCLELMEOIX-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CCN(CC[N@H+]1C[C@H]3CC[C@@H](C1)O3)C2	ZINC000538379707	303384718	/nfs/dbraw/zinc/38/47/18/303384718.db2.gz	HMKHONBFWLYLAD-GASCZTMLSA-N	1	1	317.389	1.816	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CCN(CC[N@@H+]1C[C@H]3CC[C@@H](C1)O3)C2	ZINC000538379707	303384720	/nfs/dbraw/zinc/38/47/20/303384720.db2.gz	HMKHONBFWLYLAD-GASCZTMLSA-N	1	1	317.389	1.816	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](CCN1C[C@H]3CC[C@@H](C1)O3)C2	ZINC000538379707	303384722	/nfs/dbraw/zinc/38/47/22/303384722.db2.gz	HMKHONBFWLYLAD-GASCZTMLSA-N	1	1	317.389	1.816	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](CCN1C[C@H]3CC[C@@H](C1)O3)C2	ZINC000538379707	303384724	/nfs/dbraw/zinc/38/47/24/303384724.db2.gz	HMKHONBFWLYLAD-GASCZTMLSA-N	1	1	317.389	1.816	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](O)(C2CC2)C1	ZINC000365115558	307059063	/nfs/dbraw/zinc/05/90/63/307059063.db2.gz	ZTSFIBGLJOAREM-BDJLRTHQSA-N	1	1	319.361	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365115558	307059064	/nfs/dbraw/zinc/05/90/64/307059064.db2.gz	ZTSFIBGLJOAREM-BDJLRTHQSA-N	1	1	319.361	1.769	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330447	307168182	/nfs/dbraw/zinc/16/81/82/307168182.db2.gz	KZWUTCHFJKLOHJ-AVGNSLFASA-N	1	1	323.397	1.731	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330447	307168183	/nfs/dbraw/zinc/16/81/83/307168183.db2.gz	KZWUTCHFJKLOHJ-AVGNSLFASA-N	1	1	323.397	1.731	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373938064	307198173	/nfs/dbraw/zinc/19/81/73/307198173.db2.gz	MJVAOBUTAYURIQ-NWDGAFQWSA-N	1	1	304.350	1.655	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H]2CCC[C@H]2[C@@H]1C(N)=O	ZINC000373973971	307198716	/nfs/dbraw/zinc/19/87/16/307198716.db2.gz	CLLMSHQCONJHFL-PSOPSSQASA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@H]2[C@@H]1C(N)=O	ZINC000373973971	307198717	/nfs/dbraw/zinc/19/87/17/307198717.db2.gz	CLLMSHQCONJHFL-PSOPSSQASA-N	1	1	319.361	1.689	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000374695377	307211921	/nfs/dbraw/zinc/21/19/21/307211921.db2.gz	FNIMJXROSTXSGG-FZMZJTMJSA-N	1	1	308.338	1.066	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000375505424	307227043	/nfs/dbraw/zinc/22/70/43/307227043.db2.gz	HBXSXRHXIBEXJV-LLVKDONJSA-N	1	1	324.337	1.396	20	5		DDBDMO
NC(=O)c1ccc(NCc2c[nH+]c3n2CCCC3)c([N+](=O)[O-])c1	ZINC000376485152	307245826	/nfs/dbraw/zinc/24/58/26/307245826.db2.gz	CFZFGEQMZRRRTF-UHFFFAOYSA-N	1	1	315.333	1.839	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000435994645	307305035	/nfs/dbraw/zinc/30/50/35/307305035.db2.gz	OSTKKZVPYWJLOQ-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
[NH3+]CC(F)(F)CC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000565606540	308034530	/nfs/dbraw/zinc/03/45/30/308034530.db2.gz	NJALDFKMZQKOEJ-UHFFFAOYSA-N	1	1	303.265	1.074	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000576799321	308340001	/nfs/dbraw/zinc/34/00/01/308340001.db2.gz	ARGGLZYNYVILTD-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000576799321	308340002	/nfs/dbraw/zinc/34/00/02/308340002.db2.gz	ARGGLZYNYVILTD-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000488733445	484217429	/nfs/dbraw/zinc/21/74/29/484217429.db2.gz	JJHVGGFPYLKBLG-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000488733445	484217435	/nfs/dbraw/zinc/21/74/35/484217435.db2.gz	JJHVGGFPYLKBLG-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1c(CN2C[C@H](C)[N@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000419331798	533847299	/nfs/dbraw/zinc/84/72/99/533847299.db2.gz	RUTJOXPZBVJYDN-STQMWFEESA-N	1	1	307.394	1.790	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]([C@H](C)[NH3+])C2)c1[N+](=O)[O-]	ZINC000156444407	521326916	/nfs/dbraw/zinc/32/69/16/521326916.db2.gz	COPPJLYFHGEBFH-UWVGGRQHSA-N	1	1	309.370	1.470	20	5		DDBDMO
CC[N@H+]1CC[C@H](NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C1	ZINC000412836463	527874587	/nfs/dbraw/zinc/87/45/87/527874587.db2.gz	ISOHBVHTMUDFFQ-NSHDSACASA-N	1	1	323.349	1.436	20	5		DDBDMO
CCC[C@@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000294877908	529025884	/nfs/dbraw/zinc/02/58/84/529025884.db2.gz	FROOQDVURRMWHN-OAHLLOKOSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000451250276	529339091	/nfs/dbraw/zinc/33/90/91/529339091.db2.gz	DEJJOPRJGSIONL-DOMZBBRYSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000735883095	598500221	/nfs/dbraw/zinc/50/02/21/598500221.db2.gz	WFBNPWXTFCENPA-VIFPVBQESA-N	1	1	318.341	1.065	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@H+](C)[C@H](C)C2)c1	ZINC000798328741	700056552	/nfs/dbraw/zinc/05/65/52/700056552.db2.gz	AENPKPSCVLJHFG-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[N@@H+](C)[C@H](C)C2)c1	ZINC000798328741	700056555	/nfs/dbraw/zinc/05/65/55/700056555.db2.gz	AENPKPSCVLJHFG-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1cccc(NC(=S)NCCC[NH+]2CCOCC2)c1	ZINC000038240161	696136664	/nfs/dbraw/zinc/13/66/64/696136664.db2.gz	CUQALWSFHWNQBZ-UHFFFAOYSA-N	1	1	324.406	1.604	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000064736684	696341489	/nfs/dbraw/zinc/34/14/89/696341489.db2.gz	IMGBBWSSOBKCRC-SNVBAGLBSA-N	1	1	317.349	1.748	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCC3OCCO3)C2)nc1	ZINC000124994879	696748357	/nfs/dbraw/zinc/74/83/57/696748357.db2.gz	YPVMMOLXMSUAON-NSHDSACASA-N	1	1	308.338	1.239	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@H]1CCCS1(=O)=O	ZINC000134056586	696832988	/nfs/dbraw/zinc/83/29/88/696832988.db2.gz	HWCFHUKVSUGJIO-LLVKDONJSA-N	1	1	318.782	1.915	20	5		DDBDMO
CC(=O)OC1CC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000153232770	696911473	/nfs/dbraw/zinc/91/14/73/696911473.db2.gz	PFJPPTMEOIAMCG-UHFFFAOYSA-N	1	1	321.333	1.221	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCn2cc[nH+]c2C(C)C)c1[N+](=O)[O-]	ZINC000749941642	700193187	/nfs/dbraw/zinc/19/31/87/700193187.db2.gz	LCCGBEDSAWEGGA-UHFFFAOYSA-N	1	1	306.326	1.376	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000776593584	698124380	/nfs/dbraw/zinc/12/43/80/698124380.db2.gz	YDZBOTWCCZXDSQ-VXGBXAGGSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000776593584	698124384	/nfs/dbraw/zinc/12/43/84/698124384.db2.gz	YDZBOTWCCZXDSQ-VXGBXAGGSA-N	1	1	320.267	1.627	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000780868832	698566133	/nfs/dbraw/zinc/56/61/33/698566133.db2.gz	ZNGIGURVMPBJPD-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
O=C(CCN1C[C@H]2C[NH2+]C[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782480615	698728245	/nfs/dbraw/zinc/72/82/45/698728245.db2.gz	BAGCJZICIGYUMC-GHMZBOCLSA-N	1	1	322.340	1.214	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000787329724	699206256	/nfs/dbraw/zinc/20/62/56/699206256.db2.gz	DEYFIXNZNRPAFU-MYPMTAMASA-N	1	1	319.361	1.214	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000809861203	701696137	/nfs/dbraw/zinc/69/61/37/701696137.db2.gz	SUUDTWUZZNRPJA-VIFPVBQESA-N	1	1	321.424	1.663	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000743978817	699931500	/nfs/dbraw/zinc/93/15/00/699931500.db2.gz	PDLWCHKFWKHUDL-LLVKDONJSA-N	1	1	320.349	1.134	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000801945289	700359029	/nfs/dbraw/zinc/35/90/29/700359029.db2.gz	CCVUVABKMZIZNR-UHFFFAOYSA-N	1	1	308.313	1.308	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000758336335	700699483	/nfs/dbraw/zinc/69/94/83/700699483.db2.gz	PVEFHNWFDPSHDM-GXFFZTMASA-N	1	1	318.377	1.698	20	5		DDBDMO
Cc1nonc1C[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000809744592	701685045	/nfs/dbraw/zinc/68/50/45/701685045.db2.gz	TVIOOFILXUBCDL-SECBINFHSA-N	1	1	319.321	1.793	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC[NH+]1CCSCC1	ZINC000804450073	701190902	/nfs/dbraw/zinc/19/09/02/701190902.db2.gz	GGMFAIKPHMRHBU-UHFFFAOYSA-N	1	1	312.351	1.964	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140402	701234018	/nfs/dbraw/zinc/23/40/18/701234018.db2.gz	OJBJWARMTSCCDH-GHMZBOCLSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140402	701234019	/nfs/dbraw/zinc/23/40/19/701234019.db2.gz	OJBJWARMTSCCDH-GHMZBOCLSA-N	1	1	306.366	1.650	20	5		DDBDMO
COc1ccc(C(=O)OCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000771871616	701334985	/nfs/dbraw/zinc/33/49/85/701334985.db2.gz	GIUISVPUYURVCL-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
Cc1ccc([C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+]2CCCC2)cc1	ZINC000839605675	701752172	/nfs/dbraw/zinc/75/21/72/701752172.db2.gz	YTLBMLLLEOTEMF-OAGGEKHMSA-N	1	1	317.389	1.913	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839700089	701789597	/nfs/dbraw/zinc/78/95/97/701789597.db2.gz	JIUGHIHINDJBTI-SLBVQIDZSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000839700089	701789598	/nfs/dbraw/zinc/78/95/98/701789598.db2.gz	JIUGHIHINDJBTI-SLBVQIDZSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839700089	701789602	/nfs/dbraw/zinc/78/96/02/701789602.db2.gz	JIUGHIHINDJBTI-SLBVQIDZSA-N	1	1	317.389	1.821	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@@H+]1CCCN2c3ccccc3C[C@H]2C1	ZINC000811781522	702057738	/nfs/dbraw/zinc/05/77/38/702057738.db2.gz	DEBWTBAETGNFQA-AWEZNQCLSA-N	1	1	313.361	1.886	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@H+]1CCCN2c3ccccc3C[C@H]2C1	ZINC000811781522	702057745	/nfs/dbraw/zinc/05/77/45/702057745.db2.gz	DEBWTBAETGNFQA-AWEZNQCLSA-N	1	1	313.361	1.886	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866205427	706648606	/nfs/dbraw/zinc/64/86/06/706648606.db2.gz	LULDMJKBSFQFIX-STQMWFEESA-N	1	1	318.377	1.485	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000879322296	706649396	/nfs/dbraw/zinc/64/93/96/706649396.db2.gz	JGCPUVOPSIPDPY-GXFFZTMASA-N	1	1	307.350	1.693	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@H]2C1	ZINC000816952048	702235310	/nfs/dbraw/zinc/23/53/10/702235310.db2.gz	BEMWUXMHGRUYJB-OQPBUACISA-N	1	1	308.313	1.092	20	5		DDBDMO
Cc1ccc(CN(C)CC(=O)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000879355970	706659045	/nfs/dbraw/zinc/65/90/45/706659045.db2.gz	TVFPEXZDAAMTNG-UHFFFAOYSA-N	1	1	320.393	1.109	20	5		DDBDMO
O=[N+]([O-])c1ccccc1NCCc1noc(C[NH2+]C2CC2)n1	ZINC000843184693	702835762	/nfs/dbraw/zinc/83/57/62/702835762.db2.gz	HNIJZDDCFRBPCS-UHFFFAOYSA-N	1	1	303.322	1.884	20	5		DDBDMO
[NH3+]C[C@@H]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843347177	702863849	/nfs/dbraw/zinc/86/38/49/702863849.db2.gz	BOFZFMKBLXRCEX-NSHDSACASA-N	1	1	324.356	1.733	20	5		DDBDMO
C[C@H]1C[C@H](C[NH3+])C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000843362909	702866734	/nfs/dbraw/zinc/86/67/34/702866734.db2.gz	UNHAUDYIRSHNQE-WDEREUQCSA-N	1	1	324.356	1.732	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C2(C(N)=O)CCCC2)c1	ZINC000844308989	703010104	/nfs/dbraw/zinc/01/01/04/703010104.db2.gz	WSDVFPFUTKAGGS-UHFFFAOYSA-N	1	1	321.333	1.269	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000844450020	703033246	/nfs/dbraw/zinc/03/32/46/703033246.db2.gz	NWFBTRQIDUAKNE-JTQLQIEISA-N	1	1	313.329	1.765	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CCOc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000879571285	706722112	/nfs/dbraw/zinc/72/21/12/706722112.db2.gz	OSLBIFPAFTZLEK-UONOGXRCSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cn1ccnc1[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000846835473	703339544	/nfs/dbraw/zinc/33/95/44/703339544.db2.gz	BNPNHWSHEGRTGA-DZGCQCFKSA-N	1	1	316.361	1.851	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000851820595	703864727	/nfs/dbraw/zinc/86/47/27/703864727.db2.gz	CLMZBFSKFFXULW-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000819718151	704163934	/nfs/dbraw/zinc/16/39/34/704163934.db2.gz	RUTWXFMSQYHCAC-SMDDNHRTSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC000853540715	704263587	/nfs/dbraw/zinc/26/35/87/704263587.db2.gz	LBIPCGIBHSMMLO-SNVBAGLBSA-N	1	1	303.322	1.813	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1	ZINC000853965040	704341564	/nfs/dbraw/zinc/34/15/64/704341564.db2.gz	CWTZKGAOCCEMDJ-CYBMUJFWSA-N	1	1	306.366	1.212	20	5		DDBDMO
CC(C)[C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[NH+]1CCOCC1	ZINC000822317873	704915835	/nfs/dbraw/zinc/91/58/35/704915835.db2.gz	UIEGDSBSRJUISC-CYBMUJFWSA-N	1	1	315.414	1.295	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(-c2cccc([N+](=O)[O-])c2C)no1	ZINC000823269998	705189535	/nfs/dbraw/zinc/18/95/35/705189535.db2.gz	MRSUJFRLPPVQHO-JTQLQIEISA-N	1	1	320.305	1.906	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839960	705195776	/nfs/dbraw/zinc/19/57/76/705195776.db2.gz	YOHLHBPDTOZNQS-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874839960	705195779	/nfs/dbraw/zinc/19/57/79/705195779.db2.gz	YOHLHBPDTOZNQS-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839960	705195781	/nfs/dbraw/zinc/19/57/81/705195781.db2.gz	YOHLHBPDTOZNQS-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000823921354	705340130	/nfs/dbraw/zinc/34/01/30/705340130.db2.gz	SYKUTGBXWHAQEH-LLVKDONJSA-N	1	1	307.354	1.783	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000861340623	705433497	/nfs/dbraw/zinc/43/34/97/705433497.db2.gz	KGMBBXXQNQFZRZ-UKRRQHHQSA-N	1	1	308.334	1.861	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000861342995	705435000	/nfs/dbraw/zinc/43/50/00/705435000.db2.gz	FZEDVKNEXREHRF-SMDDNHRTSA-N	1	1	311.338	1.199	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000861342992	705435143	/nfs/dbraw/zinc/43/51/43/705435143.db2.gz	FZEDVKNEXREHRF-BXUZGUMPSA-N	1	1	311.338	1.199	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825379942	705658679	/nfs/dbraw/zinc/65/86/79/705658679.db2.gz	UECFAZGVPIEYPG-NHYWBVRUSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000863329198	705903328	/nfs/dbraw/zinc/90/33/28/705903328.db2.gz	MHTGQTBMHZJBBG-SNVBAGLBSA-N	1	1	313.741	1.045	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827252912	705960583	/nfs/dbraw/zinc/96/05/83/705960583.db2.gz	ALTDZYPUZWNRQK-JQWIXIFHSA-N	1	1	319.365	1.198	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827374737	705988950	/nfs/dbraw/zinc/98/89/50/705988950.db2.gz	PPCLBPGGUZHLBR-KBPBESRZSA-N	1	1	303.362	1.690	20	5		DDBDMO
COC(=O)C1=NO[C@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000877715429	706187162	/nfs/dbraw/zinc/18/71/62/706187162.db2.gz	YTVXFFTZAHMPBG-OAHLLOKOSA-N	1	1	319.317	1.489	20	5		DDBDMO
COC(=O)C1=NO[C@]2(CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000877715429	706187165	/nfs/dbraw/zinc/18/71/65/706187165.db2.gz	YTVXFFTZAHMPBG-OAHLLOKOSA-N	1	1	319.317	1.489	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]2C1=O	ZINC000877720995	706189469	/nfs/dbraw/zinc/18/94/69/706189469.db2.gz	SAIHQTVBVVLTBQ-AOOOYVTPSA-N	1	1	323.736	1.295	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]2C1=O	ZINC000877720995	706189471	/nfs/dbraw/zinc/18/94/71/706189471.db2.gz	SAIHQTVBVVLTBQ-AOOOYVTPSA-N	1	1	323.736	1.295	20	5		DDBDMO
COC(=O)CC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000877817798	706223860	/nfs/dbraw/zinc/22/38/60/706223860.db2.gz	AHNDVMZMKSNQHY-NSHDSACASA-N	1	1	310.354	1.494	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](c3nccs3)C2)c1	ZINC000880318444	706939565	/nfs/dbraw/zinc/93/95/65/706939565.db2.gz	ZEQFUSSTOJCZJY-CMPLNLGQSA-N	1	1	323.378	1.098	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2COC[C@@H]21	ZINC000832779264	706982109	/nfs/dbraw/zinc/98/21/09/706982109.db2.gz	XRTXKDJKJWBEET-RRFJBIMHSA-N	1	1	306.362	1.985	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC000881762372	707357291	/nfs/dbraw/zinc/35/72/91/707357291.db2.gz	YTERUBDDEYSBHB-LLVKDONJSA-N	1	1	310.329	1.430	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271627	707358889	/nfs/dbraw/zinc/35/88/89/707358889.db2.gz	TUFFVRFWRTWCJL-CHWSQXEVSA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271627	707358895	/nfs/dbraw/zinc/35/88/95/707358895.db2.gz	TUFFVRFWRTWCJL-CHWSQXEVSA-N	1	1	316.304	1.984	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[NH2+][C@H](c2ccccc2)C1)[N+](=O)[O-]	ZINC000837159805	707587037	/nfs/dbraw/zinc/58/70/37/707587037.db2.gz	NSPYVXDGCICHKO-AWEZNQCLSA-N	1	1	305.378	1.995	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000882492887	707663267	/nfs/dbraw/zinc/66/32/67/707663267.db2.gz	CPQYDFHWOJCGNZ-QLFBSQMISA-N	1	1	303.362	1.909	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000882493750	707664551	/nfs/dbraw/zinc/66/45/51/707664551.db2.gz	LFJMYHMAUWVNDM-SECBINFHSA-N	1	1	311.313	1.567	20	5		DDBDMO
C[C@H]([NH2+][C@H]1C[C@H](S(C)(=O)=O)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000883376719	707987892	/nfs/dbraw/zinc/98/78/92/707987892.db2.gz	RNUYAWIPJFMLQP-GUBZILKMSA-N	1	1	316.354	1.960	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897220527	708258676	/nfs/dbraw/zinc/25/86/76/708258676.db2.gz	XCDXIFYUDIIXLQ-GJZGRUSLSA-N	1	1	309.341	1.769	20	5		DDBDMO
CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886019398	708682358	/nfs/dbraw/zinc/68/23/58/708682358.db2.gz	SQJZJIXTLDFVHI-KBPBESRZSA-N	1	1	321.377	1.742	20	5		DDBDMO
O=C1CCCCN1C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886040925	708687117	/nfs/dbraw/zinc/68/71/17/708687117.db2.gz	HUHWSTCJGFFQSX-UHFFFAOYSA-N	1	1	318.377	1.967	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c([N+](=O)[O-])c1	ZINC000886827923	708855259	/nfs/dbraw/zinc/85/52/59/708855259.db2.gz	UFWDTHKRSMIRMS-HIFRSBDPSA-N	1	1	319.361	1.695	20	5		DDBDMO
Cc1c(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000887939330	709173239	/nfs/dbraw/zinc/17/32/39/709173239.db2.gz	ZSCJPYNHUAJGKM-WBMJQRKESA-N	1	1	303.362	1.927	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000900267541	709512443	/nfs/dbraw/zinc/51/24/43/709512443.db2.gz	HQYHBQJVYCXDMH-ZBINZKHDSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000900331140	709541829	/nfs/dbraw/zinc/54/18/29/709541829.db2.gz	BUKMARVYYKJZJD-MRXNPFEDSA-N	1	1	321.377	1.100	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000910288166	709868375	/nfs/dbraw/zinc/86/83/75/709868375.db2.gz	NUBIMLHFIDMWIN-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000928457578	713205511	/nfs/dbraw/zinc/20/55/11/713205511.db2.gz	XJIMFBWRCBCTSG-MWLCHTKSSA-N	1	1	323.349	1.434	20	5		DDBDMO
COc1cc([C@H](C)[NH2+][C@H](C)C(=O)N(C)OC)cc([N+](=O)[O-])c1	ZINC000903209003	711066272	/nfs/dbraw/zinc/06/62/72/711066272.db2.gz	DDHWHSWYRYJWII-VHSXEESVSA-N	1	1	311.338	1.662	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000928565979	713230701	/nfs/dbraw/zinc/23/07/01/713230701.db2.gz	CHJDPHNZXUDFKO-ZDUSSCGKSA-N	1	1	318.377	1.629	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000928565979	713230703	/nfs/dbraw/zinc/23/07/03/713230703.db2.gz	CHJDPHNZXUDFKO-ZDUSSCGKSA-N	1	1	318.377	1.629	20	5		DDBDMO
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895248477	711465145	/nfs/dbraw/zinc/46/51/45/711465145.db2.gz	LYUYYPNWFLNRFB-CABZTGNLSA-N	1	1	313.789	1.689	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000895486818	711524915	/nfs/dbraw/zinc/52/49/15/711524915.db2.gz	JMTWTBFIUKGBMF-AWEZNQCLSA-N	1	1	320.393	1.996	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000895713018	711585522	/nfs/dbraw/zinc/58/55/22/711585522.db2.gz	HOHMYRCYDFLTEO-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
CCOC(=O)Cc1ccc(NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895769262	711601066	/nfs/dbraw/zinc/60/10/66/711601066.db2.gz	PPXNQJDCLKOESK-GFCCVEGCSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC(C)(CCc1noc([C@H]2CCc3c[nH+]cn3C2)n1)[N+](=O)[O-]	ZINC000896314121	711705416	/nfs/dbraw/zinc/70/54/16/711705416.db2.gz	DCIZCYGSMWRRHO-JTQLQIEISA-N	1	1	305.338	1.984	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000896554428	711749781	/nfs/dbraw/zinc/74/97/81/711749781.db2.gz	FLPQDDBXTWJUFP-YGRLFVJLSA-N	1	1	324.356	1.098	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(F)c(C(=O)NC23CC[NH+](CC2)C3)c1F	ZINC000913634568	713273668	/nfs/dbraw/zinc/27/36/68/713273668.db2.gz	VAVHFLLCQURGJC-UHFFFAOYSA-N	1	1	311.288	1.759	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000914325476	713378772	/nfs/dbraw/zinc/37/87/72/713378772.db2.gz	LECWURGBXPVETF-BXUZGUMPSA-N	1	1	306.366	1.529	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000918395371	713541209	/nfs/dbraw/zinc/54/12/09/713541209.db2.gz	PFGDKGPWFWTKKD-SNVBAGLBSA-N	1	1	308.294	1.327	20	5		DDBDMO
Cc1cn(C)nc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929987098	713729079	/nfs/dbraw/zinc/72/90/79/713729079.db2.gz	JCBMSNREBKPVOM-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1cn(C)nc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929987098	713729081	/nfs/dbraw/zinc/72/90/81/713729081.db2.gz	JCBMSNREBKPVOM-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1cn(C)nc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929987097	713729175	/nfs/dbraw/zinc/72/91/75/713729175.db2.gz	JCBMSNREBKPVOM-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1cn(C)nc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929987097	713729177	/nfs/dbraw/zinc/72/91/77/713729177.db2.gz	JCBMSNREBKPVOM-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
C[N@H+]1CC[C@@H]2C[NH+](CCOc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931432745	714095882	/nfs/dbraw/zinc/09/58/82/714095882.db2.gz	CAUAWBSBHZVATE-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(CCOc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931432745	714095890	/nfs/dbraw/zinc/09/58/90/714095890.db2.gz	CAUAWBSBHZVATE-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931432745	714095892	/nfs/dbraw/zinc/09/58/92/714095892.db2.gz	CAUAWBSBHZVATE-KGLIPLIRSA-N	1	1	305.378	1.857	20	5		DDBDMO
[NH3+]C[C@]12CCC[C@H]1CN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000923386845	714337170	/nfs/dbraw/zinc/33/71/70/714337170.db2.gz	KGYCYAZVJKMENV-IMJJTQAJSA-N	1	1	305.378	1.689	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C)C[C@H]1CC(C)C	ZINC000933251079	714546980	/nfs/dbraw/zinc/54/69/80/714546980.db2.gz	JJVCDCSFNCSVHN-CQSZACIVSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCN(C)C[C@H]1CC(C)C	ZINC000933251079	714546981	/nfs/dbraw/zinc/54/69/81/714546981.db2.gz	JJVCDCSFNCSVHN-CQSZACIVSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCN(C)C[C@H]1CC(C)C	ZINC000933251079	714546982	/nfs/dbraw/zinc/54/69/82/714546982.db2.gz	JJVCDCSFNCSVHN-CQSZACIVSA-N	1	1	309.414	1.762	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncnc4cc([N+](=O)[O-])ccc43)C[C@@H]21	ZINC001164667330	719389123	/nfs/dbraw/zinc/38/91/23/719389123.db2.gz	NVBGKOPMJYIDNC-UONOGXRCSA-N	1	1	315.333	1.057	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1C[C@@H]2C[N@H+](CC3CC3)C[C@H](C1)O2	ZINC001164965231	722067555	/nfs/dbraw/zinc/06/75/55/722067555.db2.gz	GNWUWJXYBGUICV-GASCZTMLSA-N	1	1	318.377	1.598	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccccc2Cl)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063741	734368203	/nfs/dbraw/zinc/36/82/03/734368203.db2.gz	KSBWPOAKKSSRDK-GFQSEFKGSA-N	1	1	323.780	1.742	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1C	ZINC001022064157	734369043	/nfs/dbraw/zinc/36/90/43/734369043.db2.gz	YSNDLVZKMIXAQD-QKPAOTATSA-N	1	1	317.389	1.705	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001105415330	741191147	/nfs/dbraw/zinc/19/11/47/741191147.db2.gz	ONDKSDPKICTBFP-UHFFFAOYSA-N	1	1	323.397	1.225	20	5		DDBDMO
CC1(C)CC(C[NH2+]CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC000997772121	751269095	/nfs/dbraw/zinc/26/90/95/751269095.db2.gz	LHEXSBGTNSQHHL-HUUCEWRRSA-N	1	1	323.437	1.916	20	5		DDBDMO
COC(=O)CC[N@H+](CCCN(C)C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169030385	762186741	/nfs/dbraw/zinc/18/67/41/762186741.db2.gz	ZDLKVPIZLJANCO-UONOGXRCSA-N	1	1	315.414	1.249	20	5		DDBDMO
COC(=O)CC[N@@H+](CCCN(C)C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169030385	762186746	/nfs/dbraw/zinc/18/67/46/762186746.db2.gz	ZDLKVPIZLJANCO-UONOGXRCSA-N	1	1	315.414	1.249	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CC[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329371	766255030	/nfs/dbraw/zinc/25/50/30/766255030.db2.gz	PMPRZXWUOCNROL-XHDPSFHLSA-N	1	1	312.341	1.941	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329371	766255033	/nfs/dbraw/zinc/25/50/33/766255033.db2.gz	PMPRZXWUOCNROL-XHDPSFHLSA-N	1	1	312.341	1.941	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CC2CCCC2)CC1	ZINC001045437027	766305550	/nfs/dbraw/zinc/30/55/50/766305550.db2.gz	ALSIEPNMHYUUSU-ZIAGYGMSSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCCC3)C[C@@H]2C1	ZINC001048812701	769929734	/nfs/dbraw/zinc/92/97/34/769929734.db2.gz	NVFZHLVAURWAGD-LXTVHRRPSA-N	1	1	307.394	1.232	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CC3CCCC3)C[C@@H]2C1	ZINC001048812701	769929739	/nfs/dbraw/zinc/92/97/39/769929739.db2.gz	NVFZHLVAURWAGD-LXTVHRRPSA-N	1	1	307.394	1.232	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CC3CCCC3)C[C@@H]2C1	ZINC001048812701	769929741	/nfs/dbraw/zinc/92/97/41/769929741.db2.gz	NVFZHLVAURWAGD-LXTVHRRPSA-N	1	1	307.394	1.232	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N	ZINC001134144705	770708212	/nfs/dbraw/zinc/70/82/12/770708212.db2.gz	YIZCTTYTXSRZGD-LLVKDONJSA-N	1	1	314.345	1.764	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N	ZINC001134144705	770708218	/nfs/dbraw/zinc/70/82/18/770708218.db2.gz	YIZCTTYTXSRZGD-LLVKDONJSA-N	1	1	314.345	1.764	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)C[NH+]1CCOCC1	ZINC001135505167	771539599	/nfs/dbraw/zinc/53/95/99/771539599.db2.gz	ZDGPXCNKULJCIK-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@@H+](C)C1	ZINC001136342455	771942596	/nfs/dbraw/zinc/94/25/96/771942596.db2.gz	RAUSYUYVGUBVAY-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
COCCN1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001173220670	777053477	/nfs/dbraw/zinc/05/34/77/777053477.db2.gz	BTJQXFVHDRBTEV-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2CNC(=O)[C@H]2C1	ZINC001173233656	777063678	/nfs/dbraw/zinc/06/36/78/777063678.db2.gz	LOPBLJNHFZVCOA-ZLDLUXBVSA-N	1	1	303.362	1.594	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2COC[C@H](C1)C2=O	ZINC001173235931	777064725	/nfs/dbraw/zinc/06/47/25/777064725.db2.gz	COELCGJQMNHIAM-BNOWGMLFSA-N	1	1	304.346	1.673	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC[C@H](C1)C2=O	ZINC001173235931	777064731	/nfs/dbraw/zinc/06/47/31/777064731.db2.gz	COELCGJQMNHIAM-BNOWGMLFSA-N	1	1	304.346	1.673	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[N@@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC001178708146	779153854	/nfs/dbraw/zinc/15/38/54/779153854.db2.gz	COMOHDHKCLMJRF-SNVBAGLBSA-N	1	1	309.370	1.340	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001117797909	780902137	/nfs/dbraw/zinc/90/21/37/780902137.db2.gz	MZAQQTIFSNKMQN-SCDSUCTJSA-N	1	1	307.350	1.227	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC001119659006	781552148	/nfs/dbraw/zinc/55/21/48/781552148.db2.gz	IWGYPXYOBNRXLB-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C\CNC(=O)C=C1CCC1	ZINC001268527386	840390125	/nfs/dbraw/zinc/39/01/25/840390125.db2.gz	GDHHUILLPXKEKD-IHWYPQMZSA-N	1	1	319.365	1.201	20	5		DDBDMO
CN(CCC[NH2+]Cc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268792035	840813802	/nfs/dbraw/zinc/81/38/02/840813802.db2.gz	UNCBZRDTERWWAM-TZMCWYRMSA-N	1	1	309.341	1.429	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2C[N@@H+](C3CC3)C[C@H]2C)n1	ZINC001150120261	862098259	/nfs/dbraw/zinc/09/82/59/862098259.db2.gz	UWVZJAYITBMNDV-OTYXRUKQSA-N	1	1	304.350	1.511	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)[n+]([O-])c(N[C@H]2CC[N@H+](C3CCC3)C2)c1	ZINC001161177480	859978877	/nfs/dbraw/zinc/97/88/77/859978877.db2.gz	PLGUGTBNDPHOKC-VIFPVBQESA-N	1	1	312.757	1.920	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCc2cncnc2)ncc1[N+](=O)[O-]	ZINC001156573238	863157471	/nfs/dbraw/zinc/15/74/71/863157471.db2.gz	DPWBOIDYJNBMDR-ONEGZZNKSA-N	1	1	300.322	1.924	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc(-c2ccccc2[N+](=O)[O-])nn1	ZINC001156628461	863209127	/nfs/dbraw/zinc/20/91/27/863209127.db2.gz	UOTQDHZKTHWZGC-UHFFFAOYSA-N	1	1	323.316	1.176	20	5		DDBDMO
CC(C)[C@](C)(Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C(N)=O	ZINC001156653162	863231523	/nfs/dbraw/zinc/23/15/23/863231523.db2.gz	ZDSOBZNWQHSPJO-LFAOLKIESA-N	1	1	321.381	1.834	20	5		DDBDMO
C[N@@H+](C1CN(c2ncc([N+](=O)[O-])cc2Cl)C1)[C@H]1CCOC1	ZINC001158726765	864860607	/nfs/dbraw/zinc/86/06/07/864860607.db2.gz	SYHIYCJPNIKKKD-VIFPVBQESA-N	1	1	312.757	1.553	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC001225483849	881863186	/nfs/dbraw/zinc/86/31/86/881863186.db2.gz	KAXNZSKGNLBXLB-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
[NH3+]C[C@@]1(Nc2ccc3[nH]cc([N+](=O)[O-])c3n2)CN2CCC1CC2	ZINC001160514842	865900681	/nfs/dbraw/zinc/90/06/81/865900681.db2.gz	YSWMEIBQVGGACO-OAHLLOKOSA-N	1	1	316.365	1.306	20	5		DDBDMO
COC(=O)C[C@@H](C)Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001160534752	865920208	/nfs/dbraw/zinc/92/02/08/865920208.db2.gz	YKNYEFPCUBNUJP-BRAIEQGRSA-N	1	1	308.338	1.886	20	5		DDBDMO
CC(C)OCC(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001319982036	866415438	/nfs/dbraw/zinc/41/54/38/866415438.db2.gz	YFYABMFFXJQGAU-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
CC(C)OCC(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001319982036	866415454	/nfs/dbraw/zinc/41/54/54/866415454.db2.gz	YFYABMFFXJQGAU-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C3CCC2(CO)CC3)c1	ZINC001333318587	866630987	/nfs/dbraw/zinc/63/09/87/866630987.db2.gz	IOYKJOZKPKCVQQ-UHFFFAOYSA-N	1	1	320.345	1.871	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C3CCC2(CO)CC3)c1	ZINC001333318587	866630996	/nfs/dbraw/zinc/63/09/96/866630996.db2.gz	IOYKJOZKPKCVQQ-UHFFFAOYSA-N	1	1	320.345	1.871	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1NC1C[NH+](C(C)(C)C)C1	ZINC001162220594	867351660	/nfs/dbraw/zinc/35/16/60/867351660.db2.gz	XRRIKNWZLHWRAO-UHFFFAOYSA-N	1	1	308.338	1.671	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@](O)(C3CC3)C1)OCCO2	ZINC001321356382	867525616	/nfs/dbraw/zinc/52/56/16/867525616.db2.gz	FGHNWRITLOPFIH-INIZCTEOSA-N	1	1	320.345	1.713	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@H]([NH3+])C1CN(c2cccc([N+](=O)[O-])n2)C1	ZINC001163118139	868117226	/nfs/dbraw/zinc/11/72/26/868117226.db2.gz	UJEJFDKNIQQDTD-LBPRGKRZSA-N	1	1	308.338	1.095	20	5		DDBDMO
Cc1cnc(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])s1	ZINC001322504633	868210297	/nfs/dbraw/zinc/21/02/97/868210297.db2.gz	BREDFHGCUVZWHW-GHMZBOCLSA-N	1	1	312.395	1.055	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022414	868685222	/nfs/dbraw/zinc/68/52/22/868685222.db2.gz	XYWIZRYWSFNJMA-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022414	868685229	/nfs/dbraw/zinc/68/52/29/868685229.db2.gz	XYWIZRYWSFNJMA-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
[NH3+][C@@H]1CN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])CCC1(F)F	ZINC001164320058	869123407	/nfs/dbraw/zinc/12/34/07/869123407.db2.gz	XABAFSZZAAAQBN-MRVPVSSYSA-N	1	1	303.225	1.071	20	5		DDBDMO
C[N@@H+]1CCc2c(NCC(=O)N3CCCC3)ccc([N+](=O)[O-])c2C1	ZINC001164585286	869307373	/nfs/dbraw/zinc/30/73/73/869307373.db2.gz	QOYLKKAKVOOACZ-UHFFFAOYSA-N	1	1	318.377	1.617	20	5		DDBDMO
C[N@H+]1CCc2c(NCC(=O)N3CCCC3)ccc([N+](=O)[O-])c2C1	ZINC001164585286	869307382	/nfs/dbraw/zinc/30/73/82/869307382.db2.gz	QOYLKKAKVOOACZ-UHFFFAOYSA-N	1	1	318.377	1.617	20	5		DDBDMO
COc1nc(C)nc(NCC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001165261681	869474545	/nfs/dbraw/zinc/47/45/45/869474545.db2.gz	RXMFCQKTEYPRGL-NSHDSACASA-N	1	1	309.370	1.846	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]C/C=C/c2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001317076036	870206773	/nfs/dbraw/zinc/20/67/73/870206773.db2.gz	LIMVVEIMNPSBKN-SPVDZKOFSA-N	1	1	315.373	1.602	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc([N+](=O)[O-])c4nonc43)[C@@H]2C1	ZINC001339997591	870829593	/nfs/dbraw/zinc/82/95/93/870829593.db2.gz	DRMXPZKIRXRUST-IVZWLZJFSA-N	1	1	303.322	1.883	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](CO)[C@H](CCO)C2)cc1Cl	ZINC001308983840	871542953	/nfs/dbraw/zinc/54/29/53/871542953.db2.gz	UYLYCMNRPSDHLG-NEPJUHHUSA-N	1	1	314.769	1.671	20	5		DDBDMO
COc1c(C(=O)NC[C@H]2CCCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC001347505043	874165740	/nfs/dbraw/zinc/16/57/40/874165740.db2.gz	UYUPAOMQENGKBS-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)OC[C@@H]1CCC[N@H+]1CC1CC1	ZINC001347981975	874328500	/nfs/dbraw/zinc/32/85/00/874328500.db2.gz	CNYYNVPNIKGQBR-LBPRGKRZSA-N	1	1	308.338	1.209	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3cc(F)c([N+](=O)[O-])cc3CO)[C@@H]2C1	ZINC001348566012	874636455	/nfs/dbraw/zinc/63/64/55/874636455.db2.gz	UGPXSQJVIQVLJA-UFGOTCBOSA-N	1	1	309.341	1.978	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2nnc(CCC[N+](=O)[O-])n2C)[C@H](C)C1	ZINC001355391966	878532444	/nfs/dbraw/zinc/53/24/44/878532444.db2.gz	NSEGMRIUYCCROB-CHWSQXEVSA-N	1	1	324.429	1.191	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1COCC[N@@H+]1CC[C@@H](OC)C1	ZINC001223107833	880833227	/nfs/dbraw/zinc/83/32/27/880833227.db2.gz	OKXQYYHHFIFQNX-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COC(=O)N1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254592157	896522140	/nfs/dbraw/zinc/52/21/40/896522140.db2.gz	BUZGIAVKUPGXJF-OAHLLOKOSA-N	1	1	319.361	1.836	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2nnc(C[N+](=O)[O-])n2CC2CC2)C[C@@H]1C	ZINC001263676062	900668134	/nfs/dbraw/zinc/66/81/34/900668134.db2.gz	FYMXXAPGPJEQQC-NWDGAFQWSA-N	1	1	322.413	1.384	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc([N+](=O)[O-])ccc3F)[C@@H]2C1	ZINC001263980097	900853827	/nfs/dbraw/zinc/85/38/27/900853827.db2.gz	NEVFFFPZJIZKOD-BHYNMZESSA-N	1	1	307.325	1.804	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000295667510	529381675	/nfs/dbraw/zinc/38/16/75/529381675.db2.gz	IWYBJCHZDZRHNW-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@](O)(C(F)F)C2)c1	ZINC000451437556	231095195	/nfs/dbraw/zinc/09/51/95/231095195.db2.gz	LZVZYKAJNJGWHF-CYBMUJFWSA-N	1	1	302.277	1.676	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000295628502	529503814	/nfs/dbraw/zinc/50/38/14/529503814.db2.gz	FRPFWRQAHCRYGM-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000295628502	529503817	/nfs/dbraw/zinc/50/38/17/529503817.db2.gz	FRPFWRQAHCRYGM-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000295836666	529503973	/nfs/dbraw/zinc/50/39/73/529503973.db2.gz	ZCRZEJZWPHYQBH-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+]1C	ZINC000090551639	185303014	/nfs/dbraw/zinc/30/30/14/185303014.db2.gz	NNRGUYRPHWFPJU-CHWSQXEVSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@@H]1C[C@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551639	185303015	/nfs/dbraw/zinc/30/30/15/185303015.db2.gz	NNRGUYRPHWFPJU-CHWSQXEVSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551639	185303016	/nfs/dbraw/zinc/30/30/16/185303016.db2.gz	NNRGUYRPHWFPJU-CHWSQXEVSA-N	1	1	308.382	1.171	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C1CC1	ZINC000181506018	199308235	/nfs/dbraw/zinc/30/82/35/199308235.db2.gz	GWDLTOJGENCSQT-UHFFFAOYSA-N	1	1	321.333	1.538	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000299536852	530062028	/nfs/dbraw/zinc/06/20/28/530062028.db2.gz	UMPSGJMTUYRJJO-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294155092	282362648	/nfs/dbraw/zinc/36/26/48/282362648.db2.gz	NRNGRPJOVWPALH-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000294155092	282362649	/nfs/dbraw/zinc/36/26/49/282362649.db2.gz	NRNGRPJOVWPALH-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294155092	282362651	/nfs/dbraw/zinc/36/26/51/282362651.db2.gz	NRNGRPJOVWPALH-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000279755241	215119246	/nfs/dbraw/zinc/11/92/46/215119246.db2.gz	LUQYLYLCXHMVLE-RISCZKNCSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279816739	215172882	/nfs/dbraw/zinc/17/28/82/215172882.db2.gz	QGCHQCSPVKMDHY-ZWNOBZJWSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279816739	215172886	/nfs/dbraw/zinc/17/28/86/215172886.db2.gz	QGCHQCSPVKMDHY-ZWNOBZJWSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H]1NC(=O)N(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O	ZINC000459427956	233187251	/nfs/dbraw/zinc/18/72/51/233187251.db2.gz	AMEBRLFUXHFBCT-NSHDSACASA-N	1	1	320.349	1.009	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)n1	ZINC000191854488	186264601	/nfs/dbraw/zinc/26/46/01/186264601.db2.gz	VMXLUOKTKZIKBP-VXGBXAGGSA-N	1	1	321.381	1.368	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)C[C@H]1C	ZINC000617353010	363067180	/nfs/dbraw/zinc/06/71/80/363067180.db2.gz	AOULUCJRNYPYKT-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)C[C@H]1C	ZINC000617353010	363067182	/nfs/dbraw/zinc/06/71/82/363067182.db2.gz	AOULUCJRNYPYKT-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OCCO)C1	ZINC000172296199	198072375	/nfs/dbraw/zinc/07/23/75/198072375.db2.gz	XRYSFXZFDUGACY-CQSZACIVSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OCCO)C1	ZINC000172296199	198072377	/nfs/dbraw/zinc/07/23/77/198072377.db2.gz	XRYSFXZFDUGACY-CQSZACIVSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000072875153	191245896	/nfs/dbraw/zinc/24/58/96/191245896.db2.gz	NLLPAKBRCSDUTE-SECBINFHSA-N	1	1	307.306	1.746	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000072875153	191245897	/nfs/dbraw/zinc/24/58/97/191245897.db2.gz	NLLPAKBRCSDUTE-SECBINFHSA-N	1	1	307.306	1.746	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000069502306	353164181	/nfs/dbraw/zinc/16/41/81/353164181.db2.gz	NQAFUKCBSYIPOU-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2	ZINC000072829605	353218647	/nfs/dbraw/zinc/21/86/47/353218647.db2.gz	LPDRYUVCIAXNGD-MRXNPFEDSA-N	1	1	319.361	1.576	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1	ZINC000072578248	353202852	/nfs/dbraw/zinc/20/28/52/353202852.db2.gz	HAULTVOPEKZBFP-GXTWGEPZSA-N	1	1	305.338	1.317	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000174299857	198316606	/nfs/dbraw/zinc/31/66/06/198316606.db2.gz	LLXHPKQFPPDTPU-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000174299857	198316608	/nfs/dbraw/zinc/31/66/08/198316608.db2.gz	LLXHPKQFPPDTPU-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000074772860	353330136	/nfs/dbraw/zinc/33/01/36/353330136.db2.gz	VNTPGYBODZQPHI-NSHDSACASA-N	1	1	306.370	1.135	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[NH+](CCOC(C)C)CC1	ZINC000074773273	353330334	/nfs/dbraw/zinc/33/03/34/353330334.db2.gz	KSMRPBDVILPJOF-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c([N+](=O)[O-])c1	ZINC000075061409	353345736	/nfs/dbraw/zinc/34/57/36/353345736.db2.gz	SEXLDGIQFPNOHE-OLZOCXBDSA-N	1	1	318.377	1.627	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1C[C@@H](C)O	ZINC000174618371	198360792	/nfs/dbraw/zinc/36/07/92/198360792.db2.gz	JAQKOEHUGGLUBW-GHMZBOCLSA-N	1	1	311.338	1.105	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1C[C@@H](C)O	ZINC000174618371	198360794	/nfs/dbraw/zinc/36/07/94/198360794.db2.gz	JAQKOEHUGGLUBW-GHMZBOCLSA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ncc([N+](=O)[O-])c(N)n1	ZINC000076268912	353409838	/nfs/dbraw/zinc/40/98/38/353409838.db2.gz	CDPZOKCWRGVHBW-OUAUKWLOSA-N	1	1	308.386	1.745	20	5		DDBDMO
CCC[N@H+](CCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000078686594	353529060	/nfs/dbraw/zinc/52/90/60/353529060.db2.gz	VDDFLEVWAIONEE-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
CCC[N@@H+](CCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000078686594	353529062	/nfs/dbraw/zinc/52/90/62/353529062.db2.gz	VDDFLEVWAIONEE-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000080435049	353607632	/nfs/dbraw/zinc/60/76/32/353607632.db2.gz	ONPOENNRFKGIBB-LBPRGKRZSA-N	1	1	321.402	1.858	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(c2ncc(C)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000089265458	353763428	/nfs/dbraw/zinc/76/34/28/353763428.db2.gz	RYROYRSNKPLISA-LBPRGKRZSA-N	1	1	322.365	1.372	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ncc(C)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000089265458	353763431	/nfs/dbraw/zinc/76/34/31/353763431.db2.gz	RYROYRSNKPLISA-LBPRGKRZSA-N	1	1	322.365	1.372	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000280495755	354422762	/nfs/dbraw/zinc/42/27/62/354422762.db2.gz	BQWITFKBOJJBGR-VXGBXAGGSA-N	1	1	308.334	1.715	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NC[C@H]1CCCC[NH2+]1	ZINC000314019994	354482787	/nfs/dbraw/zinc/48/27/87/354482787.db2.gz	IQBPWBFJHJBIKM-SECBINFHSA-N	1	1	317.342	1.154	20	5		DDBDMO
Nc1cc(N[C@H]2CCn3cc[nH+]c3C2)cc(CO)c1[N+](=O)[O-]	ZINC000588022502	354894621	/nfs/dbraw/zinc/89/46/21/354894621.db2.gz	XRMCVYLLJBSYFS-JTQLQIEISA-N	1	1	303.322	1.293	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]([N@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000588863063	354944305	/nfs/dbraw/zinc/94/43/05/354944305.db2.gz	OOFINFKFHLTVEX-ZIAGYGMSSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]([N@H+]3CC[C@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000588863059	354944476	/nfs/dbraw/zinc/94/44/76/354944476.db2.gz	OOFINFKFHLTVEX-KBPBESRZSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@@H]2C1	ZINC000590012855	355041803	/nfs/dbraw/zinc/04/18/03/355041803.db2.gz	ZWWMMEGCKZHOJH-QMTHXVAHSA-N	1	1	301.350	1.607	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)c1cn[nH]c1	ZINC000494623409	235062621	/nfs/dbraw/zinc/06/26/21/235062621.db2.gz	ZBGUHCMTNDJBGU-JTQLQIEISA-N	1	1	303.322	1.916	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1CCOC1	ZINC000494957212	235107434	/nfs/dbraw/zinc/10/74/34/235107434.db2.gz	NSWXHYMFZIQFRE-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@H]3COC[C@@H]32)c1	ZINC000590972412	355227412	/nfs/dbraw/zinc/22/74/12/355227412.db2.gz	QUANIECLBTVHRC-XPKDYRNWSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](O)[C@@H](CO)C2)cc1	ZINC000591054806	355238600	/nfs/dbraw/zinc/23/86/00/355238600.db2.gz	DNSXFDCRCPXOCS-DOMZBBRYSA-N	1	1	310.350	1.039	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(c3ncc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000591162387	355257511	/nfs/dbraw/zinc/25/75/11/355257511.db2.gz	YRXCAKBZVIMSBX-QWHCGFSZSA-N	1	1	310.329	1.428	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC000592783658	355689264	/nfs/dbraw/zinc/68/92/64/355689264.db2.gz	ORRVKJPMIIMMMB-ZWNOBZJWSA-N	1	1	304.350	1.215	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cn[nH]c2)c1	ZINC000593025527	355773336	/nfs/dbraw/zinc/77/33/36/355773336.db2.gz	XGOVCLJFMLCZIF-VIFPVBQESA-N	1	1	304.306	1.955	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])[C@H](C)C1	ZINC000593029173	355774275	/nfs/dbraw/zinc/77/42/75/355774275.db2.gz	WGPZXEZSNRGWPK-GFCCVEGCSA-N	1	1	321.377	1.907	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)CC[C@H]2C)c1	ZINC000593036767	355776165	/nfs/dbraw/zinc/77/61/65/355776165.db2.gz	SUBTUZVEOCSYGC-MFKMUULPSA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)CC[C@H]2C)c1	ZINC000593036767	355776167	/nfs/dbraw/zinc/77/61/67/355776167.db2.gz	SUBTUZVEOCSYGC-MFKMUULPSA-N	1	1	308.334	1.727	20	5		DDBDMO
CC[C@@H]1COC(C)(C)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000593056740	355782321	/nfs/dbraw/zinc/78/23/21/355782321.db2.gz	OLCVDUASFLFFDJ-DGCLKSJQSA-N	1	1	312.370	1.042	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)n1	ZINC000594198108	356137157	/nfs/dbraw/zinc/13/71/57/356137157.db2.gz	RXLMSIDMLHIFIY-VXGBXAGGSA-N	1	1	321.381	1.558	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594419787	356204769	/nfs/dbraw/zinc/20/47/69/356204769.db2.gz	RLEVQTSVLOLULK-QWHCGFSZSA-N	1	1	318.377	1.924	20	5		DDBDMO
CO[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000595413432	356483954	/nfs/dbraw/zinc/48/39/54/356483954.db2.gz	BNNJSTOAWCANTL-JIMOISOXSA-N	1	1	314.363	1.057	20	5		DDBDMO
Cc1noc(CN2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c1[N+](=O)[O-]	ZINC000595370763	356468050	/nfs/dbraw/zinc/46/80/50/356468050.db2.gz	JFLYPOQYSKVLTK-CYBMUJFWSA-N	1	1	323.397	1.103	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000081527113	192283125	/nfs/dbraw/zinc/28/31/25/192283125.db2.gz	GJYIRGOOYTWISN-NSHDSACASA-N	1	1	322.365	1.156	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000595744234	356632649	/nfs/dbraw/zinc/63/26/49/356632649.db2.gz	UUBOYUKBTWJOIP-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2COC[C@@]2(C)C1	ZINC000595755404	356637784	/nfs/dbraw/zinc/63/77/84/356637784.db2.gz	ADXYPANMRDXJOW-BFQNTYOBSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC2(COC2)C1	ZINC000595833528	356669909	/nfs/dbraw/zinc/66/99/09/356669909.db2.gz	MBNXMUSNLSYVIA-LLVKDONJSA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC2(COC2)C1	ZINC000595833528	356669914	/nfs/dbraw/zinc/66/99/14/356669914.db2.gz	MBNXMUSNLSYVIA-LLVKDONJSA-N	1	1	305.334	1.644	20	5		DDBDMO
CC12CC(C1)C[N@@H+]2CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595916413	356703869	/nfs/dbraw/zinc/70/38/69/356703869.db2.gz	SIIOJLZFUUZPID-UHFFFAOYSA-N	1	1	301.346	1.968	20	5		DDBDMO
CC12CC(C1)C[N@H+]2CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595916413	356703872	/nfs/dbraw/zinc/70/38/72/356703872.db2.gz	SIIOJLZFUUZPID-UHFFFAOYSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=c1[nH]ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000596079018	356764783	/nfs/dbraw/zinc/76/47/83/356764783.db2.gz	ZEDDSIXNIWOHFW-LBPRGKRZSA-N	1	1	322.365	1.387	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596090558	356768963	/nfs/dbraw/zinc/76/89/63/356768963.db2.gz	YEPQRXPOAGDTCC-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3CC(C[NH+]4CCOCC4)C3)nc2c1	ZINC000596239955	356828749	/nfs/dbraw/zinc/82/87/49/356828749.db2.gz	QYFVHSCWFXTGPP-UHFFFAOYSA-N	1	1	317.349	1.240	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)n1C	ZINC000596127453	356783440	/nfs/dbraw/zinc/78/34/40/356783440.db2.gz	ZSBYSBJIIFKOKV-UHFFFAOYSA-N	1	1	318.337	1.105	20	5		DDBDMO
C[C@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C	ZINC000596137024	356787448	/nfs/dbraw/zinc/78/74/48/356787448.db2.gz	OCOUWMXJLSARGC-CMPLNLGQSA-N	1	1	306.366	1.613	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596265784	356838120	/nfs/dbraw/zinc/83/81/20/356838120.db2.gz	MGLZUYXMSHMAET-GFCCVEGCSA-N	1	1	306.366	1.613	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000596268206	356838852	/nfs/dbraw/zinc/83/88/52/356838852.db2.gz	HVUCNCLCANUBBY-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1OC	ZINC000276905954	213166661	/nfs/dbraw/zinc/16/66/61/213166661.db2.gz	PMXJPOIFQHZNMA-OKILXGFUSA-N	1	1	323.349	1.269	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000596308683	356852769	/nfs/dbraw/zinc/85/27/69/356852769.db2.gz	KNBSOLIQKJBBNJ-VIFPVBQESA-N	1	1	307.354	1.373	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597924825	357384889	/nfs/dbraw/zinc/38/48/89/357384889.db2.gz	LDARTJPONZYGMO-LBPRGKRZSA-N	1	1	323.397	1.479	20	5		DDBDMO
CCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@H]1CC[N@@H+](CC)C1	ZINC000598040097	357438908	/nfs/dbraw/zinc/43/89/08/357438908.db2.gz	CHALXWZIIYPPOU-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c1	ZINC000598649093	357670587	/nfs/dbraw/zinc/67/05/87/357670587.db2.gz	VLVYQGHSLOKOAF-BXUZGUMPSA-N	1	1	322.361	1.832	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000292357878	223018163	/nfs/dbraw/zinc/01/81/63/223018163.db2.gz	VYFLCCZGTOQTFB-KRWDZBQOSA-N	1	1	317.389	2.000	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599623257	357996548	/nfs/dbraw/zinc/99/65/48/357996548.db2.gz	KMXYOMUDULIMJP-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599623257	357996550	/nfs/dbraw/zinc/99/65/50/357996550.db2.gz	KMXYOMUDULIMJP-IYBDPMFKSA-N	1	1	324.377	1.416	20	5		DDBDMO
CCOc1ccc([C@@H](C)NC[C@@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000600710234	358290619	/nfs/dbraw/zinc/29/06/19/358290619.db2.gz	MUAJAHXTJXTOAZ-DGCLKSJQSA-N	1	1	309.366	1.633	20	5		DDBDMO
CC(C)[C@H]1CNCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000600714202	358292026	/nfs/dbraw/zinc/29/20/26/358292026.db2.gz	KEBJJMHVRBRURL-OAHLLOKOSA-N	1	1	320.393	1.853	20	5		DDBDMO
CC(C)[C@H]1CNCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000600714202	358292030	/nfs/dbraw/zinc/29/20/30/358292030.db2.gz	KEBJJMHVRBRURL-OAHLLOKOSA-N	1	1	320.393	1.853	20	5		DDBDMO
C[C@@H]1COCCN1CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601113555	358407781	/nfs/dbraw/zinc/40/77/81/358407781.db2.gz	IDHABUDQEPOIBG-GFCCVEGCSA-N	1	1	316.361	1.698	20	5		DDBDMO
CO[C@]1(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCOC1	ZINC000601143242	358419025	/nfs/dbraw/zinc/41/90/25/358419025.db2.gz	CHRHUHMTCZECPM-HNNXBMFYSA-N	1	1	303.318	1.782	20	5		DDBDMO
CO[C@@]1(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCOC1	ZINC000601143244	358419570	/nfs/dbraw/zinc/41/95/70/358419570.db2.gz	CHRHUHMTCZECPM-OAHLLOKOSA-N	1	1	303.318	1.782	20	5		DDBDMO
CC(C)NC(=O)[C@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601177113	358435704	/nfs/dbraw/zinc/43/57/04/358435704.db2.gz	TYFXKBRMPKZHQX-JTQLQIEISA-N	1	1	302.334	1.890	20	5		DDBDMO
Cc1cc(S(=O)(=O)N(C)CC2C[NH+](C)C2)c([N+](=O)[O-])s1	ZINC000601466139	358565570	/nfs/dbraw/zinc/56/55/70/358565570.db2.gz	ZDCXOLSWCSYEQF-UHFFFAOYSA-N	1	1	319.408	1.147	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601777818	358691072	/nfs/dbraw/zinc/69/10/72/358691072.db2.gz	LMZMPZYIYWHGGL-ZFWWWQNUSA-N	1	1	307.350	1.013	20	5		DDBDMO
CCCC(=O)NC1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602448947	358983963	/nfs/dbraw/zinc/98/39/63/358983963.db2.gz	WRJRATCXAFDODK-UHFFFAOYSA-N	1	1	309.370	1.209	20	5		DDBDMO
CC(C)(O)CN1CCC([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1	ZINC000602579916	359053389	/nfs/dbraw/zinc/05/33/89/359053389.db2.gz	JVQZREQDXYHFCV-UHFFFAOYSA-N	1	1	321.421	1.962	20	5		DDBDMO
COC(=O)C(C)(C)[C@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602598446	359063002	/nfs/dbraw/zinc/06/30/02/359063002.db2.gz	ZCDJAQOOICFFHT-LBPRGKRZSA-N	1	1	324.381	1.740	20	5		DDBDMO
COC(=O)C(C)(C)[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602598446	359063006	/nfs/dbraw/zinc/06/30/06/359063006.db2.gz	ZCDJAQOOICFFHT-LBPRGKRZSA-N	1	1	324.381	1.740	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H]([C@H](O)C(F)(F)F)C1	ZINC000602837809	359227535	/nfs/dbraw/zinc/22/75/35/359227535.db2.gz	AAEUEOCDPILXJZ-ONGXEEELSA-N	1	1	322.287	1.345	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000602875344	359258251	/nfs/dbraw/zinc/25/82/51/359258251.db2.gz	ZRSSMSQEZWKGPP-BETUJISGSA-N	1	1	308.382	1.171	20	5		DDBDMO
COC(=O)C1C[C@H](C)[NH+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H](C)C1	ZINC000602917529	359293899	/nfs/dbraw/zinc/29/38/99/359293899.db2.gz	LZNZIAUFJCVYAF-UWVGGRQHSA-N	1	1	310.354	1.490	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)C[C@@H]1C(C)C	ZINC000602953291	359318585	/nfs/dbraw/zinc/31/85/85/359318585.db2.gz	RYHVPARUNMUBBW-CYBMUJFWSA-N	1	1	321.381	1.524	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)n1	ZINC000603144130	359433467	/nfs/dbraw/zinc/43/34/67/359433467.db2.gz	WLSCCRRUEASLDW-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)n1	ZINC000603144130	359433471	/nfs/dbraw/zinc/43/34/71/359433471.db2.gz	WLSCCRRUEASLDW-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000186821652	200017530	/nfs/dbraw/zinc/01/75/30/200017530.db2.gz	CSBDKQXHIACPMV-UHFFFAOYSA-N	1	1	310.350	1.687	20	5		DDBDMO
C[N@H+](C[C@@H]1CCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000187833513	200162893	/nfs/dbraw/zinc/16/28/93/200162893.db2.gz	UIOMHPVRAMROAO-GJZGRUSLSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCCO1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000187833513	200162894	/nfs/dbraw/zinc/16/28/94/200162894.db2.gz	UIOMHPVRAMROAO-GJZGRUSLSA-N	1	1	319.361	1.811	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000609044248	360258139	/nfs/dbraw/zinc/25/81/39/360258139.db2.gz	AVRCRDKKWUHRNQ-UHFFFAOYSA-N	1	1	309.366	1.602	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000292409448	223059152	/nfs/dbraw/zinc/05/91/52/223059152.db2.gz	LYRKFBACEFYWAR-UBHSHLNASA-N	1	1	310.350	1.180	20	5		DDBDMO
CC[N@@H+](CC(=O)NCCOc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000611012115	360602993	/nfs/dbraw/zinc/60/29/93/360602993.db2.gz	YNCFVNCHBWSCDH-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000611087926	360619168	/nfs/dbraw/zinc/61/91/68/360619168.db2.gz	SFWPNYGBYIRLSC-NSHDSACASA-N	1	1	309.370	1.079	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000611087926	360619171	/nfs/dbraw/zinc/61/91/71/360619171.db2.gz	SFWPNYGBYIRLSC-NSHDSACASA-N	1	1	309.370	1.079	20	5		DDBDMO
C[C@H](O)C1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611268107	360683987	/nfs/dbraw/zinc/68/39/87/360683987.db2.gz	LZQWOKGNIMBGSW-NSHDSACASA-N	1	1	322.361	1.959	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@H](O)C[C@H](O)C2)o1	ZINC000611276840	360688193	/nfs/dbraw/zinc/68/81/93/360688193.db2.gz	UROBXVCADZQTHP-TXEJJXNPSA-N	1	1	318.329	1.782	20	5		DDBDMO
C[C@H](NC(=O)CN1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000611408036	360713026	/nfs/dbraw/zinc/71/30/26/360713026.db2.gz	GADOGLGGRQTVMG-LBPRGKRZSA-N	1	1	306.366	1.019	20	5		DDBDMO
CN(CC(=O)NCC1=CC[N@@H+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000271930814	209332920	/nfs/dbraw/zinc/33/29/20/209332920.db2.gz	VDLWYIJKCTUYTC-UHFFFAOYSA-N	1	1	318.377	1.409	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCOC1	ZINC000612059419	360904462	/nfs/dbraw/zinc/90/44/62/360904462.db2.gz	RSACOTZNVOHBFT-KBPBESRZSA-N	1	1	324.377	1.693	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000612589971	361075414	/nfs/dbraw/zinc/07/54/14/361075414.db2.gz	FLKNFBMWDIWPML-QTLSWZBMSA-N	1	1	303.362	1.624	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000612589971	361075416	/nfs/dbraw/zinc/07/54/16/361075416.db2.gz	FLKNFBMWDIWPML-QTLSWZBMSA-N	1	1	303.362	1.624	20	5		DDBDMO
C[N@@H+](CCCCO)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000349917899	284105536	/nfs/dbraw/zinc/10/55/36/284105536.db2.gz	BXCZAZSWPBNAOL-CQSZACIVSA-N	1	1	307.350	1.404	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000264757883	204133990	/nfs/dbraw/zinc/13/39/90/204133990.db2.gz	TYWZJGXZSHAIFF-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCN1CC[NH+](CCCNc2ncc(C)cc2[N+](=O)[O-])CC1	ZINC000266214865	205188723	/nfs/dbraw/zinc/18/87/23/205188723.db2.gz	OFFCZZUMUAQWKF-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000284350126	217990537	/nfs/dbraw/zinc/99/05/37/217990537.db2.gz	MFSPIUBWGDDFOX-SJKUQHEZSA-N	1	1	319.405	1.995	20	5		DDBDMO
Cc1ccc(CN2CC[N@H+](C[C@@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000284432076	218025338	/nfs/dbraw/zinc/02/53/38/218025338.db2.gz	SBADETLVKFJRMB-ZIAGYGMSSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[N@@H+](CCCOC(=O)NC(N)=O)CCc1ccccc1[N+](=O)[O-]	ZINC000285182789	218323226	/nfs/dbraw/zinc/32/32/26/218323226.db2.gz	BXHYDBGPJFJIOB-UHFFFAOYSA-N	1	1	324.337	1.264	20	5		DDBDMO
Cc1ccc([C@H](C)NC[C@@H]2C[N@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847711	207014665	/nfs/dbraw/zinc/01/46/65/207014665.db2.gz	BQBWEFGGCYOTGC-DZGCQCFKSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1ccc([C@H](C)NC[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847711	207014669	/nfs/dbraw/zinc/01/46/69/207014669.db2.gz	BQBWEFGGCYOTGC-DZGCQCFKSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000119661289	195012009	/nfs/dbraw/zinc/01/20/09/195012009.db2.gz	UPSUEYMETZPXJQ-JTQLQIEISA-N	1	1	307.354	1.075	20	5		DDBDMO
CC(C)CO[C@H]1CC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000120085697	195093052	/nfs/dbraw/zinc/09/30/52/195093052.db2.gz	XVTPQQOKTXGMFA-AWEZNQCLSA-N	1	1	321.377	1.941	20	5		DDBDMO
CC(C)CO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000120085697	195093054	/nfs/dbraw/zinc/09/30/54/195093054.db2.gz	XVTPQQOKTXGMFA-AWEZNQCLSA-N	1	1	321.377	1.941	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1C[N@@H+](C(C)C)C[C@@H]1C	ZINC000158881243	197308747	/nfs/dbraw/zinc/30/87/47/197308747.db2.gz	FHQKHSPZYMQJET-AAEUAGOBSA-N	1	1	323.397	1.335	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC1CCOCC1	ZINC000352545779	285130787	/nfs/dbraw/zinc/13/07/87/285130787.db2.gz	ZPSKAMRUMVQQHI-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NC1CCOCC1	ZINC000352545779	285130788	/nfs/dbraw/zinc/13/07/88/285130788.db2.gz	ZPSKAMRUMVQQHI-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[C@@H](C[N@H+](C)CCc1ccccc1[N+](=O)[O-])CS(C)(=O)=O	ZINC000352551374	285134749	/nfs/dbraw/zinc/13/47/49/285134749.db2.gz	XEDOHODEWAGPEN-LBPRGKRZSA-N	1	1	314.407	1.750	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCc1ccccc1[N+](=O)[O-])CS(C)(=O)=O	ZINC000352551374	285134752	/nfs/dbraw/zinc/13/47/52/285134752.db2.gz	XEDOHODEWAGPEN-LBPRGKRZSA-N	1	1	314.407	1.750	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000425003346	533092975	/nfs/dbraw/zinc/09/29/75/533092975.db2.gz	SKVHLXDXTSOKRJ-UHFFFAOYSA-N	1	1	310.354	1.106	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@@H](C)O	ZINC000156302869	197103010	/nfs/dbraw/zinc/10/30/10/197103010.db2.gz	QCNAANTULNRZHO-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
Cc1[nH+]cc2n1CC[C@H](C(=O)NCc1ccccc1[N+](=O)[O-])C2	ZINC000289730787	221184740	/nfs/dbraw/zinc/18/47/40/221184740.db2.gz	GEIJVNDAKZHEDZ-LBPRGKRZSA-N	1	1	314.345	1.979	20	5		DDBDMO
Cc1cnn([C@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)c1	ZINC000289843490	221264790	/nfs/dbraw/zinc/26/47/90/221264790.db2.gz	KFXMEEWSOOKIJT-ZDUSSCGKSA-N	1	1	317.349	1.208	20	5		DDBDMO
[NH3+]C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC12CCOCC2	ZINC000414789839	224395160	/nfs/dbraw/zinc/39/51/60/224395160.db2.gz	OTLBHYPXWCQDFL-CQSZACIVSA-N	1	1	305.378	1.782	20	5		DDBDMO
C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc([S@](C)=O)cc1	ZINC000360211952	299615737	/nfs/dbraw/zinc/61/57/37/299615737.db2.gz	HJUCOAFYFVMDQZ-MGUXCZDKSA-N	1	1	322.390	1.917	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000332238079	533418474	/nfs/dbraw/zinc/41/84/74/533418474.db2.gz	HQWZMQHBXGCXIT-STQMWFEESA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCCC[N@@H+]1CCCC[C@H]1C	ZINC000068410434	406641016	/nfs/dbraw/zinc/64/10/16/406641016.db2.gz	FAVJCNWSSKMZCU-GFCCVEGCSA-N	1	1	323.397	1.480	20	5		DDBDMO
CC(C)OC(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665350	406884651	/nfs/dbraw/zinc/88/46/51/406884651.db2.gz	ONFNCDJTVUTWMG-GFCCVEGCSA-N	1	1	322.365	1.818	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000052522635	407150932	/nfs/dbraw/zinc/15/09/32/407150932.db2.gz	BPSBCYFCVHBNSC-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000090459269	407167159	/nfs/dbraw/zinc/16/71/59/407167159.db2.gz	BJRFOMPVGFFEQN-CHWSQXEVSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000090459269	407167162	/nfs/dbraw/zinc/16/71/62/407167162.db2.gz	BJRFOMPVGFFEQN-CHWSQXEVSA-N	1	1	319.361	1.578	20	5		DDBDMO
COCC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000054353620	407183677	/nfs/dbraw/zinc/18/36/77/407183677.db2.gz	KHZGPLAUPTUWGV-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(OC)c1)C1CC1	ZINC000101957204	407318136	/nfs/dbraw/zinc/31/81/36/407318136.db2.gz	CTUYVWJVQKKVQV-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000123324008	407325725	/nfs/dbraw/zinc/32/57/25/407325725.db2.gz	QWGILHCXAKEIEZ-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123565014	407333019	/nfs/dbraw/zinc/33/30/19/407333019.db2.gz	GJSITHFXAWWXOF-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[NH2+]1	ZINC000124178933	407350687	/nfs/dbraw/zinc/35/06/87/407350687.db2.gz	RXRFCYZXAHDQFT-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H]1CCCCNC1=O	ZINC000105613126	407354204	/nfs/dbraw/zinc/35/42/04/407354204.db2.gz	HESBUEOKACSPDG-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000107891941	407381292	/nfs/dbraw/zinc/38/12/92/407381292.db2.gz	LGVYELJWZIYYQS-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000111267803	407404499	/nfs/dbraw/zinc/40/44/99/407404499.db2.gz	JLSMYSHONQUFFX-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCn1cccn1	ZINC000111283446	407405913	/nfs/dbraw/zinc/40/59/13/407405913.db2.gz	NRFSZCOKPYTLLE-GFCCVEGCSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCn1cccn1	ZINC000111283446	407405914	/nfs/dbraw/zinc/40/59/14/407405914.db2.gz	NRFSZCOKPYTLLE-GFCCVEGCSA-N	1	1	317.349	1.750	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CCn1cccn1	ZINC000111282171	407405941	/nfs/dbraw/zinc/40/59/41/407405941.db2.gz	SCVORBMEKJKNDW-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCn1cccn1	ZINC000111282171	407405942	/nfs/dbraw/zinc/40/59/42/407405942.db2.gz	SCVORBMEKJKNDW-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000265822724	407470371	/nfs/dbraw/zinc/47/03/71/407470371.db2.gz	SFFZMFDQGPCZGC-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccsc1	ZINC000270978317	407448055	/nfs/dbraw/zinc/44/80/55/407448055.db2.gz	ILIGBWHJUZJLIU-SECBINFHSA-N	1	1	309.351	1.412	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000265794797	407455155	/nfs/dbraw/zinc/45/51/55/407455155.db2.gz	MYMBIOUOXNCPSH-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000128942255	407585072	/nfs/dbraw/zinc/58/50/72/407585072.db2.gz	CVXOKHYUZUHOFG-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCc1nn(C)c(N2CCC(c3[nH]cc[nH+]3)CC2)c1[N+](=O)[O-]	ZINC000271138051	407533807	/nfs/dbraw/zinc/53/38/07/407533807.db2.gz	ASNSDDYUILLNMV-UHFFFAOYSA-N	1	1	304.354	1.998	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000272164036	407800588	/nfs/dbraw/zinc/80/05/88/407800588.db2.gz	ZSCCFCXYDDADKB-STQMWFEESA-N	1	1	321.377	1.740	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1C	ZINC000117293497	407823915	/nfs/dbraw/zinc/82/39/15/407823915.db2.gz	WMEYFXIUJNNAIQ-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1C	ZINC000117293497	407823917	/nfs/dbraw/zinc/82/39/17/407823917.db2.gz	WMEYFXIUJNNAIQ-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC000153582331	407855049	/nfs/dbraw/zinc/85/50/49/407855049.db2.gz	AZTAFLKBERKPEJ-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000272544376	407974632	/nfs/dbraw/zinc/97/46/32/407974632.db2.gz	CJDIWVPGXCXKDV-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000268261565	407976929	/nfs/dbraw/zinc/97/69/29/407976929.db2.gz	ZJLIJBMCKPXAKK-KWQFWETISA-N	1	1	307.354	1.093	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000180754474	407915943	/nfs/dbraw/zinc/91/59/43/407915943.db2.gz	JADLIZKSOJGVFY-LLVKDONJSA-N	1	1	322.365	1.018	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000268151148	407916140	/nfs/dbraw/zinc/91/61/40/407916140.db2.gz	UQUPASLZXMTSEW-NHYWBVRUSA-N	1	1	318.377	1.877	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CCC[N@@H+](C)C1	ZINC000153968168	407942889	/nfs/dbraw/zinc/94/28/89/407942889.db2.gz	CZCZHRVSAJDLPB-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CCC[N@@H+](C)C1	ZINC000153968278	407942918	/nfs/dbraw/zinc/94/29/18/407942918.db2.gz	CZCZHRVSAJDLPB-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@H](C[NH+]2CCCC2)C1	ZINC000272490064	407943162	/nfs/dbraw/zinc/94/31/62/407943162.db2.gz	HCWQBHSFQVGWCV-GFCCVEGCSA-N	1	1	319.361	1.858	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCOC3(CCOCC3)C2)c1	ZINC000135623963	408041163	/nfs/dbraw/zinc/04/11/63/408041163.db2.gz	SKDOJDKOFOBHTP-UHFFFAOYSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCOC3(CCOCC3)C2)c1	ZINC000135623963	408041172	/nfs/dbraw/zinc/04/11/72/408041172.db2.gz	SKDOJDKOFOBHTP-UHFFFAOYSA-N	1	1	322.361	1.855	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000136171045	408085861	/nfs/dbraw/zinc/08/58/61/408085861.db2.gz	KNVDZKVPTDSYKV-SNPRPXQTSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000189564110	408054245	/nfs/dbraw/zinc/05/42/45/408054245.db2.gz	ICOIXYYZYNDWIM-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3cccs3)CC2)c1	ZINC000121362748	408192050	/nfs/dbraw/zinc/19/20/50/408192050.db2.gz	UHDZYQXRFACKIV-UHFFFAOYSA-N	1	1	307.379	1.675	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000175976555	408255702	/nfs/dbraw/zinc/25/57/02/408255702.db2.gz	SOPQTBKZVDYAAX-UHFFFAOYSA-N	1	1	324.381	1.362	20	5		DDBDMO
C[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000121395024	408199938	/nfs/dbraw/zinc/19/99/38/408199938.db2.gz	OKVBGEVLKWAXRQ-LBPRGKRZSA-N	1	1	322.365	1.685	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000155704697	408200701	/nfs/dbraw/zinc/20/07/01/408200701.db2.gz	MXHDUIRISZNAAB-WFASDCNBSA-N	1	1	305.378	1.982	20	5		DDBDMO
C[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000121395179	408200782	/nfs/dbraw/zinc/20/07/82/408200782.db2.gz	OKVBGEVLKWAXRQ-GFCCVEGCSA-N	1	1	322.365	1.685	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H]1CO	ZINC000190404558	408236100	/nfs/dbraw/zinc/23/61/00/408236100.db2.gz	YCBSFIUNHOCDRG-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
COc1ccccc1C[N@@H+](CCO)CCn1ccc([N+](=O)[O-])n1	ZINC000176229270	408317071	/nfs/dbraw/zinc/31/70/71/408317071.db2.gz	CDWJYAVUAHLUCD-UHFFFAOYSA-N	1	1	320.349	1.294	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183184980	408347362	/nfs/dbraw/zinc/34/73/62/408347362.db2.gz	AGRFETPLPRKKJK-DGCLKSJQSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000183184980	408347370	/nfs/dbraw/zinc/34/73/70/408347370.db2.gz	AGRFETPLPRKKJK-DGCLKSJQSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000183202319	408352148	/nfs/dbraw/zinc/35/21/48/408352148.db2.gz	UVHSEDUHHAFEIX-WDEREUQCSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000247268351	408441909	/nfs/dbraw/zinc/44/19/09/408441909.db2.gz	KGDKJGXCIKJHIH-BXUZGUMPSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000247268351	408441914	/nfs/dbraw/zinc/44/19/14/408441914.db2.gz	KGDKJGXCIKJHIH-BXUZGUMPSA-N	1	1	315.333	1.493	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(O)(COC)CC1	ZINC000270351686	408498430	/nfs/dbraw/zinc/49/84/30/408498430.db2.gz	HWWICLFEDYGTTB-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC1CC[NH+](CCN(C)C)CC1	ZINC000264466134	408501937	/nfs/dbraw/zinc/50/19/37/408501937.db2.gz	LTOQTOIDIXUMRV-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cc1ccc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000269913049	408466623	/nfs/dbraw/zinc/46/66/23/408466623.db2.gz	IRUXMTHNEDNLKR-ZDUSSCGKSA-N	1	1	306.366	1.655	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000247447304	408472011	/nfs/dbraw/zinc/47/20/11/408472011.db2.gz	SLOBQXYPNJDLHK-ZYHUDNBSSA-N	1	1	323.397	1.729	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000177162558	408539603	/nfs/dbraw/zinc/53/96/03/408539603.db2.gz	GXZLDTRBHQKFAE-KOLCDFICSA-N	1	1	304.350	1.653	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000249054420	408680109	/nfs/dbraw/zinc/68/01/09/408680109.db2.gz	LGBLTSUGWVIAHP-ZIAGYGMSSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000249054420	408680115	/nfs/dbraw/zinc/68/01/15/408680115.db2.gz	LGBLTSUGWVIAHP-ZIAGYGMSSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000249083760	408685407	/nfs/dbraw/zinc/68/54/07/408685407.db2.gz	HZYXTACCUJKJDT-UWVGGRQHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000249083760	408685411	/nfs/dbraw/zinc/68/54/11/408685411.db2.gz	HZYXTACCUJKJDT-UWVGGRQHSA-N	1	1	313.379	1.183	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000270825155	408696568	/nfs/dbraw/zinc/69/65/68/408696568.db2.gz	BVTCILMYXHEHCC-HNNXBMFYSA-N	1	1	303.362	1.834	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@H]1CC[C@H](O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000275859660	408698300	/nfs/dbraw/zinc/69/83/00/408698300.db2.gz	MHZIOHSSZSFEQG-NNUKFRKNSA-N	1	1	321.377	1.793	20	5		DDBDMO
O=c1c2ccccc2n(CCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000291713978	408910355	/nfs/dbraw/zinc/91/03/55/408910355.db2.gz	VXBPCPXZZSBZMU-UHFFFAOYSA-N	1	1	317.345	1.632	20	5		DDBDMO
CSc1cccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000192519469	163224850	/nfs/dbraw/zinc/22/48/50/163224850.db2.gz	HJMUDQYVRABBNY-PHIMTYICSA-N	1	1	321.402	1.950	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000277456014	408943856	/nfs/dbraw/zinc/94/38/56/408943856.db2.gz	GORMHWORVGJFFC-NSHDSACASA-N	1	1	307.354	1.373	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000281952716	408959324	/nfs/dbraw/zinc/95/93/24/408959324.db2.gz	FQKFDWBHJKQAIU-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)CCC(N)=O)cccc1[N+](=O)[O-]	ZINC000286354490	408969199	/nfs/dbraw/zinc/96/91/99/408969199.db2.gz	HDLPMRFJPWHFKW-JTQLQIEISA-N	1	1	308.338	1.037	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)COc3ccccc3[N+](=O)[O-])C2)C1	ZINC000292111182	408981914	/nfs/dbraw/zinc/98/19/14/408981914.db2.gz	FVUZRMLNNBOQGI-INIZCTEOSA-N	1	1	319.361	1.528	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)CCc1cnc[nH]1	ZINC000282347604	409037741	/nfs/dbraw/zinc/03/77/41/409037741.db2.gz	AIWCWKMXOKBDPF-UHFFFAOYSA-N	1	1	302.334	1.952	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000278156566	409074653	/nfs/dbraw/zinc/07/46/53/409074653.db2.gz	AACLIJJOPTYDTL-NSHDSACASA-N	1	1	304.354	1.129	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278156566	409074655	/nfs/dbraw/zinc/07/46/55/409074655.db2.gz	AACLIJJOPTYDTL-NSHDSACASA-N	1	1	304.354	1.129	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278156566	409074656	/nfs/dbraw/zinc/07/46/56/409074656.db2.gz	AACLIJJOPTYDTL-NSHDSACASA-N	1	1	304.354	1.129	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@@H+](C)C1CC1	ZINC000279311300	409190155	/nfs/dbraw/zinc/19/01/55/409190155.db2.gz	AVQBEAIVROXNKN-MRVPVSSYSA-N	1	1	310.329	1.529	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293630259	409150312	/nfs/dbraw/zinc/15/03/12/409150312.db2.gz	FFMLYUQYNHSFAH-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293630259	409150315	/nfs/dbraw/zinc/15/03/15/409150315.db2.gz	FFMLYUQYNHSFAH-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293630259	409150317	/nfs/dbraw/zinc/15/03/17/409150317.db2.gz	FFMLYUQYNHSFAH-HNNXBMFYSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)[N@@H+](CCN1CCNC1=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000290181484	409314911	/nfs/dbraw/zinc/31/49/11/409314911.db2.gz	FJIQYIBXOIZEKT-UHFFFAOYSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H]1c1ccccc1	ZINC000285492508	409465749	/nfs/dbraw/zinc/46/57/49/409465749.db2.gz	AMVVQRPHEXNCQG-SMDDNHRTSA-N	1	1	315.333	1.493	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000352426197	164119963	/nfs/dbraw/zinc/11/99/63/164119963.db2.gz	RPVMLPWOTBGIRH-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000374827258	164173962	/nfs/dbraw/zinc/17/39/62/164173962.db2.gz	HKVNDYGROYBMIK-UHFFFAOYSA-N	1	1	322.340	1.626	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000408114603	164232528	/nfs/dbraw/zinc/23/25/28/164232528.db2.gz	YGBGQZVWPBUQLB-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000408114603	164232529	/nfs/dbraw/zinc/23/25/29/164232529.db2.gz	YGBGQZVWPBUQLB-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
CCOC1CC2(C1)CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2	ZINC000285575439	409494284	/nfs/dbraw/zinc/49/42/84/409494284.db2.gz	UTAMFORJZHXKHC-UHFFFAOYSA-N	1	1	321.377	1.648	20	5		DDBDMO
C[C@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC[N@@H+]1CCO	ZINC000302911998	409519796	/nfs/dbraw/zinc/51/97/96/409519796.db2.gz	ZXANZSKTZSLSBQ-NSHDSACASA-N	1	1	306.366	1.066	20	5		DDBDMO
C[C@H]1CN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC[N@H+]1CCO	ZINC000302911998	409519801	/nfs/dbraw/zinc/51/98/01/409519801.db2.gz	ZXANZSKTZSLSBQ-NSHDSACASA-N	1	1	306.366	1.066	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2C2CCCC2)c1	ZINC000304380557	409617931	/nfs/dbraw/zinc/61/79/31/409617931.db2.gz	YGJBCMSHOCRDPS-LSDHHAIUSA-N	1	1	308.382	1.807	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2C2CCOCC2)c1	ZINC000348946814	409603210	/nfs/dbraw/zinc/60/32/10/409603210.db2.gz	HLNCJNFAGKKWQM-HUUCEWRRSA-N	1	1	324.381	1.043	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000342474121	409664515	/nfs/dbraw/zinc/66/45/15/409664515.db2.gz	NKYCPKNBIQTKAA-OTYXRUKQSA-N	1	1	307.325	1.946	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000346689213	410085747	/nfs/dbraw/zinc/08/57/47/410085747.db2.gz	PRGSEHPLZGKLQR-GFCCVEGCSA-N	1	1	311.357	1.622	20	5		DDBDMO
Cc1cccc(NCCNc2nccc(C(N)=O)c2[N+](=O)[O-])[nH+]1	ZINC000357494390	410067304	/nfs/dbraw/zinc/06/73/04/410067304.db2.gz	XGQQBBKPLYWPAV-UHFFFAOYSA-N	1	1	316.321	1.316	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H]1C	ZINC000346695006	410090182	/nfs/dbraw/zinc/09/01/82/410090182.db2.gz	XRTIGVQTGIDDNE-MFKMUULPSA-N	1	1	308.334	1.987	20	5		DDBDMO
CCNC(=O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)C(C)C	ZINC000339320341	410091348	/nfs/dbraw/zinc/09/13/48/410091348.db2.gz	XEAXOAMTGIJMJH-AWEZNQCLSA-N	1	1	309.366	1.854	20	5		DDBDMO
Cc1cc(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000339335943	410103098	/nfs/dbraw/zinc/10/30/98/410103098.db2.gz	KZRKFLOZAOBYCW-MELADBBJSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000339393609	410155100	/nfs/dbraw/zinc/15/51/00/410155100.db2.gz	KQKNBXFHDKXJQD-HOTGVXAUSA-N	1	1	321.377	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000339393609	410155109	/nfs/dbraw/zinc/15/51/09/410155109.db2.gz	KQKNBXFHDKXJQD-HOTGVXAUSA-N	1	1	321.377	1.595	20	5		DDBDMO
CC(C)[C@@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000343206878	410236534	/nfs/dbraw/zinc/23/65/34/410236534.db2.gz	OOKWTTDBELCMQW-ZDUSSCGKSA-N	1	1	306.366	1.470	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000343440389	410454161	/nfs/dbraw/zinc/45/41/61/410454161.db2.gz	NWTSFKVDJLDUCF-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000343440389	410454164	/nfs/dbraw/zinc/45/41/64/410454164.db2.gz	NWTSFKVDJLDUCF-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CC[NH+](Cc3cccs3)CC2)n1	ZINC000358273833	410427829	/nfs/dbraw/zinc/42/78/29/410427829.db2.gz	LJWYUNNWEDJEAI-UHFFFAOYSA-N	1	1	321.406	1.671	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CCC[N@H+]1C	ZINC000343427195	410442517	/nfs/dbraw/zinc/44/25/17/410442517.db2.gz	DQVDDGJGHLUTHY-CMPLNLGQSA-N	1	1	309.370	1.125	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@@H]3CCC[C@H]32)c1	ZINC000299095441	410519146	/nfs/dbraw/zinc/51/91/46/410519146.db2.gz	KKHRHEBXUSDUAU-FVQBIDKESA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@@H]3CCC[C@H]32)c1	ZINC000299095441	410519150	/nfs/dbraw/zinc/51/91/50/410519150.db2.gz	KKHRHEBXUSDUAU-FVQBIDKESA-N	1	1	322.361	1.588	20	5		DDBDMO
CC(C)[C@H](CNc1ncc([N+](=O)[O-])cn1)N1CC[NH+](C)CC1	ZINC000301097635	410656673	/nfs/dbraw/zinc/65/66/73/410656673.db2.gz	QDRJLFLVUUDYKZ-ZDUSSCGKSA-N	1	1	308.386	1.069	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)C1	ZINC000301309227	410695067	/nfs/dbraw/zinc/69/50/67/410695067.db2.gz	XHLYPROGQZVDKQ-AWEZNQCLSA-N	1	1	322.384	1.950	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000359519093	410706157	/nfs/dbraw/zinc/70/61/57/410706157.db2.gz	QVMRSNAXQAYQHG-LBPRGKRZSA-N	1	1	308.382	1.880	20	5		DDBDMO
Cc1ccnc(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)c1[N+](=O)[O-]	ZINC000301246526	410683620	/nfs/dbraw/zinc/68/36/20/410683620.db2.gz	ATDQRLAEXBCXIA-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1nc(N2CCC[N@H+](C3CCOCC3)CC2)ccc1[N+](=O)[O-]	ZINC000301668844	410765365	/nfs/dbraw/zinc/76/53/65/410765365.db2.gz	POYRNNCERYFHJV-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000343888467	410782331	/nfs/dbraw/zinc/78/23/31/410782331.db2.gz	XHMUSFURKHDQQD-HNNXBMFYSA-N	1	1	308.334	1.483	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000330577757	410795755	/nfs/dbraw/zinc/79/57/55/410795755.db2.gz	HBNUTEZEANYGQL-QWHCGFSZSA-N	1	1	320.393	1.866	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000301921818	410831078	/nfs/dbraw/zinc/83/10/78/410831078.db2.gz	DQRQDLFDNHJLDP-UHFFFAOYSA-N	1	1	321.424	1.812	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@H]2C[N@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935488	410833127	/nfs/dbraw/zinc/83/31/27/410833127.db2.gz	RLDRMVVBQWTPIS-LKFCYVNXSA-N	1	1	313.329	1.874	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935488	410833132	/nfs/dbraw/zinc/83/31/32/410833132.db2.gz	RLDRMVVBQWTPIS-LKFCYVNXSA-N	1	1	313.329	1.874	20	5		DDBDMO
CC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1C[C@@H](C)O	ZINC000330602318	410818953	/nfs/dbraw/zinc/81/89/53/410818953.db2.gz	FHKOUZBNQXMHOU-TZMCWYRMSA-N	1	1	323.393	1.577	20	5		DDBDMO
CC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000330602318	410818961	/nfs/dbraw/zinc/81/89/61/410818961.db2.gz	FHKOUZBNQXMHOU-TZMCWYRMSA-N	1	1	323.393	1.577	20	5		DDBDMO
Cn1nccc1C[N@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000348368012	410939001	/nfs/dbraw/zinc/93/90/01/410939001.db2.gz	KLWHFGVICXGMKG-CYBMUJFWSA-N	1	1	320.349	1.200	20	5		DDBDMO
Cn1nccc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000348368012	410939009	/nfs/dbraw/zinc/93/90/09/410939009.db2.gz	KLWHFGVICXGMKG-CYBMUJFWSA-N	1	1	320.349	1.200	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@H]1C	ZINC000353490957	411027928	/nfs/dbraw/zinc/02/79/28/411027928.db2.gz	LOKGZRXUJWUTON-MNOVXSKESA-N	1	1	321.381	1.517	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000358038654	299054480	/nfs/dbraw/zinc/05/44/80/299054480.db2.gz	BONMIRGURBLDBF-OAHLLOKOSA-N	1	1	319.317	1.137	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cn3)CC[C@H]21	ZINC000366295038	418452813	/nfs/dbraw/zinc/45/28/13/418452813.db2.gz	PTQVWUVAGRYZJA-SMDDNHRTSA-N	1	1	304.350	1.546	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@H]2[C@@H]1C(N)=O	ZINC000373737045	418454353	/nfs/dbraw/zinc/45/43/53/418454353.db2.gz	FMRWXBWBEOBUHG-NWANDNLSSA-N	1	1	303.362	1.989	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373929504	418474249	/nfs/dbraw/zinc/47/42/49/418474249.db2.gz	ORJPRKPDEMNBOV-QWHCGFSZSA-N	1	1	319.361	1.717	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000375038641	418593622	/nfs/dbraw/zinc/59/36/22/418593622.db2.gz	MAZJASZGVMQJJD-IUODEOHRSA-N	1	1	319.361	1.526	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000375502218	418651626	/nfs/dbraw/zinc/65/16/26/418651626.db2.gz	RFOYOUUEHFERSA-ZDUSSCGKSA-N	1	1	323.393	1.492	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000367840326	418644316	/nfs/dbraw/zinc/64/43/16/418644316.db2.gz	QDSKXAXHFFTWHW-MNOVXSKESA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@@H]12	ZINC000367840326	418644319	/nfs/dbraw/zinc/64/43/19/418644319.db2.gz	QDSKXAXHFFTWHW-MNOVXSKESA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NCCN1[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000361308678	418622277	/nfs/dbraw/zinc/62/22/77/418622277.db2.gz	DYLLQWYWBLULBO-HNNXBMFYSA-N	1	1	318.377	1.627	20	5		DDBDMO
Cc1sc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000367995245	418671310	/nfs/dbraw/zinc/67/13/10/418671310.db2.gz	YKCWIXJCELIHKB-QMMMGPOBSA-N	1	1	305.306	1.644	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]12	ZINC000368063936	418682517	/nfs/dbraw/zinc/68/25/17/418682517.db2.gz	OSKDVYXRDQEYCF-PWSUYJOCSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@H]12	ZINC000368063936	418682519	/nfs/dbraw/zinc/68/25/19/418682519.db2.gz	OSKDVYXRDQEYCF-PWSUYJOCSA-N	1	1	309.753	1.816	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)[C@@H]1CCO[C@H]1C	ZINC000361586106	418687652	/nfs/dbraw/zinc/68/76/52/418687652.db2.gz	LCDRNXUQOOIHQK-SMDDNHRTSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)[C@@H]1CCO[C@H]1C	ZINC000361586106	418687654	/nfs/dbraw/zinc/68/76/54/418687654.db2.gz	LCDRNXUQOOIHQK-SMDDNHRTSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000385849877	418738077	/nfs/dbraw/zinc/73/80/77/418738077.db2.gz	XKTKIJCYDLWFLX-CHWSQXEVSA-N	1	1	307.350	1.287	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCOC[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000371099097	418762026	/nfs/dbraw/zinc/76/20/26/418762026.db2.gz	JQZHCGHNHAKMDL-GFCCVEGCSA-N	1	1	310.350	1.951	20	5		DDBDMO
COc1cc(N2CCC[N@H+]([C@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000364954102	418827838	/nfs/dbraw/zinc/82/78/38/418827838.db2.gz	JLGDKYDOJOHHQG-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cn2)[C@H]1c1cccs1	ZINC000364961222	418828414	/nfs/dbraw/zinc/82/84/14/418828414.db2.gz	YAOHNDLEYFUKHU-MFKMUULPSA-N	1	1	319.390	2.551	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@H]12	ZINC000365655248	418889987	/nfs/dbraw/zinc/88/99/87/418889987.db2.gz	IHTQXHIZRLQKBK-RDJPRVRMSA-N	1	1	301.346	1.676	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@H](O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000411420301	418903179	/nfs/dbraw/zinc/90/31/79/418903179.db2.gz	JIUDIBBQMPHMIF-WDEREUQCSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000420929417	419362513	/nfs/dbraw/zinc/36/25/13/419362513.db2.gz	BJNRJJAFFNBGPT-MCIONIFRSA-N	1	1	324.377	1.285	20	5		DDBDMO
CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC[N@H+]1C	ZINC000420994084	419427508	/nfs/dbraw/zinc/42/75/08/419427508.db2.gz	BTMPYLSTAUMNRJ-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420994084	419427519	/nfs/dbraw/zinc/42/75/19/419427519.db2.gz	BTMPYLSTAUMNRJ-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420994084	419427525	/nfs/dbraw/zinc/42/75/25/419427525.db2.gz	BTMPYLSTAUMNRJ-OAHLLOKOSA-N	1	1	320.393	1.949	20	5		DDBDMO
O=[N+]([O-])c1cnn(Cc2ccc(C[NH+]3CCOCC3)cc2)c1	ZINC000421211812	419525938	/nfs/dbraw/zinc/52/59/38/419525938.db2.gz	ISRUFNFDWWNIQQ-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCC[NH+]1CCSCC1	ZINC000421767439	419718868	/nfs/dbraw/zinc/71/88/68/419718868.db2.gz	KYZKXQXXISVROT-UHFFFAOYSA-N	1	1	323.418	1.990	20	5		DDBDMO
C[C@H](CCc1ccccc1[N+](=O)[O-])NC[C@@H]1C[NH2+]CCCO1	ZINC000415030494	419917781	/nfs/dbraw/zinc/91/77/81/419917781.db2.gz	CMKSRSCDGLUONV-HIFRSBDPSA-N	1	1	307.394	1.884	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2c(N)cccc2[N+](=O)[O-])[nH+]1	ZINC000354556314	306779228	/nfs/dbraw/zinc/77/92/28/306779228.db2.gz	UIADFCZGEGEBIO-UHFFFAOYSA-N	1	1	315.333	1.722	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(Cc2c([N+](=O)[O-])ncn2C)C[C@@H](C)C1	ZINC000429005576	419961573	/nfs/dbraw/zinc/96/15/73/419961573.db2.gz	MNMRJNRJCPYETF-JHJVBQTASA-N	1	1	307.398	1.490	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)n1	ZINC000418994793	420042258	/nfs/dbraw/zinc/04/22/58/420042258.db2.gz	IEJFYMGDEXZMRF-OLZOCXBDSA-N	1	1	308.382	1.498	20	5		DDBDMO
C[C@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](CN)C1	ZINC000420324823	420210946	/nfs/dbraw/zinc/21/09/46/420210946.db2.gz	BCNVERRSGCYPSH-WFASDCNBSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](CN)C1	ZINC000420324823	420210950	/nfs/dbraw/zinc/21/09/50/420210950.db2.gz	BCNVERRSGCYPSH-WFASDCNBSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420378154	420248792	/nfs/dbraw/zinc/24/87/92/420248792.db2.gz	WXEKLIDPMMSVTP-HSMVNMDESA-N	1	1	320.393	1.900	20	5		DDBDMO
CN(C)C[C@H](O)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000433124555	420249360	/nfs/dbraw/zinc/24/93/60/420249360.db2.gz	DFUFHWRUKBKWQV-DOMZBBRYSA-N	1	1	307.394	1.829	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000433747632	420253965	/nfs/dbraw/zinc/25/39/65/420253965.db2.gz	GKIPYPPXVQLXGL-UHFFFAOYSA-N	1	1	311.386	1.903	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1CCO	ZINC000416289727	420308954	/nfs/dbraw/zinc/30/89/54/420308954.db2.gz	FVYPLCBYYBZAGA-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1CCO	ZINC000416289727	420308958	/nfs/dbraw/zinc/30/89/58/420308958.db2.gz	FVYPLCBYYBZAGA-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1CCO	ZINC000416296423	420311928	/nfs/dbraw/zinc/31/19/28/420311928.db2.gz	NVKSLGUSTQTOLW-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@@H]2CC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000416496928	420394604	/nfs/dbraw/zinc/39/46/04/420394604.db2.gz	RJGVDSLQRXMUDW-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c3cccnc32)CC[N@H+]1CCO	ZINC000302378942	230227077	/nfs/dbraw/zinc/22/70/77/230227077.db2.gz	GFOQDYAOEUPNJG-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)[C@@H](C)O1	ZINC000446082132	230230662	/nfs/dbraw/zinc/23/06/62/230230662.db2.gz	OPSKCYWUFPYRPF-BHPKHCPMSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)[C@@H](C)O1	ZINC000446082132	230230666	/nfs/dbraw/zinc/23/06/66/230230666.db2.gz	OPSKCYWUFPYRPF-BHPKHCPMSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000493157644	420771930	/nfs/dbraw/zinc/77/19/30/420771930.db2.gz	OLPNVXGBMRMFLU-CUCMZFDFSA-N	1	1	301.346	1.771	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@H](CO)[C@H](O)C2)o1	ZINC000459712818	420854862	/nfs/dbraw/zinc/85/48/62/420854862.db2.gz	RTXHBDLSVLIVMA-IAQYHMDHSA-N	1	1	318.329	1.640	20	5		DDBDMO
CCN1C[C@H]([NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])CC1=O	ZINC000449515625	421018720	/nfs/dbraw/zinc/01/87/20/421018720.db2.gz	AJVAUVGFMAMHFS-LLVKDONJSA-N	1	1	323.349	1.322	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](CO)[C@H]2C)c([N+](=O)[O-])c1	ZINC000488753105	421111851	/nfs/dbraw/zinc/11/18/51/421111851.db2.gz	QHDPAOIMYJIDDM-VXGBXAGGSA-N	1	1	310.350	1.685	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nccc2c1cccc2[N+](=O)[O-]	ZINC000450334040	421184789	/nfs/dbraw/zinc/18/47/89/421184789.db2.gz	HNSWZBZZPPIRDK-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450334040	421184795	/nfs/dbraw/zinc/18/47/95/421184795.db2.gz	HNSWZBZZPPIRDK-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450334040	421184798	/nfs/dbraw/zinc/18/47/98/421184798.db2.gz	HNSWZBZZPPIRDK-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@]1(C)CO	ZINC000546105718	421284073	/nfs/dbraw/zinc/28/40/73/421284073.db2.gz	XFKWRXBLJKMOBS-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@]1(C)CO	ZINC000546105718	421284076	/nfs/dbraw/zinc/28/40/76/421284076.db2.gz	XFKWRXBLJKMOBS-HNNXBMFYSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@@H](NC(=O)c1c[nH]nc1[N+](=O)[O-])[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000549189194	421495596	/nfs/dbraw/zinc/49/55/96/421495596.db2.gz	BEUGNSLVFWJYBU-MNOVXSKESA-N	1	1	321.381	1.701	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000553319372	421611507	/nfs/dbraw/zinc/61/15/07/421611507.db2.gz	HRIDKLDPXNBZDY-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000553319372	421611510	/nfs/dbraw/zinc/61/15/10/421611510.db2.gz	HRIDKLDPXNBZDY-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000554597365	421653714	/nfs/dbraw/zinc/65/37/14/421653714.db2.gz	DYDQYZILULHJMH-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
O=C1C[C@H]([N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960198	421874036	/nfs/dbraw/zinc/87/40/36/421874036.db2.gz	HCNHCLOGAZDERY-AAEUAGOBSA-N	1	1	303.318	1.189	20	5		DDBDMO
O=C1C[C@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960198	421874042	/nfs/dbraw/zinc/87/40/42/421874042.db2.gz	HCNHCLOGAZDERY-AAEUAGOBSA-N	1	1	303.318	1.189	20	5		DDBDMO
O=C(CC[N@@H+]1CCn2nncc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000581140363	421907826	/nfs/dbraw/zinc/90/78/26/421907826.db2.gz	LRZQRKZISLUFAO-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(CC[N@H+]1CCn2nncc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000581140363	421907832	/nfs/dbraw/zinc/90/78/32/421907832.db2.gz	LRZQRKZISLUFAO-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
CC(C)Oc1nc(NCCc2c[nH+]cn2C)ccc1[N+](=O)[O-]	ZINC000573338086	421948192	/nfs/dbraw/zinc/94/81/92/421948192.db2.gz	CMCRVWVNVALTQY-UHFFFAOYSA-N	1	1	305.338	2.165	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCOc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000573742129	422009421	/nfs/dbraw/zinc/00/94/21/422009421.db2.gz	UWVLAKBGDLPPAD-GFCCVEGCSA-N	1	1	319.361	1.658	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC[C@@H](O)C[N@@H+](C)C1CC1	ZINC000574982698	422227197	/nfs/dbraw/zinc/22/71/97/422227197.db2.gz	HVIOKZCMDZKOCE-CQSZACIVSA-N	1	1	309.366	1.148	20	5		DDBDMO
COC(=O)c1ccnc(NCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000590579096	422320616	/nfs/dbraw/zinc/32/06/16/422320616.db2.gz	XYOWZBQFUMWNTD-UHFFFAOYSA-N	1	1	319.321	1.784	20	5		DDBDMO
NC(=O)c1cccc(N2CCC[C@@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-]	ZINC000342060456	271286472	/nfs/dbraw/zinc/28/64/72/271286472.db2.gz	AXUFJGJJPWLCHH-SNVBAGLBSA-N	1	1	315.333	1.801	20	5		DDBDMO
NC(=O)c1cccc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-]	ZINC000342060451	271286602	/nfs/dbraw/zinc/28/66/02/271286602.db2.gz	AXUFJGJJPWLCHH-JTQLQIEISA-N	1	1	315.333	1.801	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000344414492	272019232	/nfs/dbraw/zinc/01/92/32/272019232.db2.gz	AVDLWQIOGHIUDB-GWCFXTLKSA-N	1	1	320.349	1.132	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000345449489	272254257	/nfs/dbraw/zinc/25/42/57/272254257.db2.gz	AUHRVGDZHWFGRF-GFCCVEGCSA-N	1	1	308.382	1.928	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000408102230	274334079	/nfs/dbraw/zinc/33/40/79/274334079.db2.gz	BYOHAAPZWDSVHM-SECBINFHSA-N	1	1	303.322	1.384	20	5		DDBDMO
C[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@H+]1CCO	ZINC000450796050	274369668	/nfs/dbraw/zinc/36/96/68/274369668.db2.gz	QBTNXMLVEXLXRC-AOOOYVTPSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000450796050	274369669	/nfs/dbraw/zinc/36/96/69/274369669.db2.gz	QBTNXMLVEXLXRC-AOOOYVTPSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000155086193	274485949	/nfs/dbraw/zinc/48/59/49/274485949.db2.gz	RENGXNFUOGPKPP-ZIAGYGMSSA-N	1	1	306.410	1.881	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C	ZINC000185444711	276132813	/nfs/dbraw/zinc/13/28/13/276132813.db2.gz	KXPNXIKEPFUDBJ-UHFFFAOYSA-N	1	1	324.381	1.647	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000451932799	276342876	/nfs/dbraw/zinc/34/28/76/276342876.db2.gz	DPSQZDNGHCJCKN-LERXQTSPSA-N	1	1	323.349	1.315	20	5		DDBDMO
CN1CCNC[C@H]1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423522048	277116928	/nfs/dbraw/zinc/11/69/28/277116928.db2.gz	RENADVVNARJTTA-XJKSGUPXSA-N	1	1	318.421	1.810	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000182689149	288092852	/nfs/dbraw/zinc/09/28/52/288092852.db2.gz	CNIDEYGKRCTDMW-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000182689149	288092856	/nfs/dbraw/zinc/09/28/56/288092856.db2.gz	CNIDEYGKRCTDMW-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3ncc(Cl)cc3[N+](=O)[O-])[C@H]2C1	ZINC000284576040	290169708	/nfs/dbraw/zinc/16/97/08/290169708.db2.gz	OUVMIJWTABCKFZ-RYUDHWBXSA-N	1	1	312.757	1.553	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000354011361	298338408	/nfs/dbraw/zinc/33/84/08/298338408.db2.gz	ZQSLJQRFUFYQMJ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[C@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000354205241	298363148	/nfs/dbraw/zinc/36/31/48/298363148.db2.gz	QVVHZJYVJUNCGR-ZJUUUORDSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@@H]1C[C@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000354205241	298363150	/nfs/dbraw/zinc/36/31/50/298363150.db2.gz	QVVHZJYVJUNCGR-ZJUUUORDSA-N	1	1	321.333	1.992	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000363053466	300204383	/nfs/dbraw/zinc/20/43/83/300204383.db2.gz	LBUZUQZNJMDXED-HNNXBMFYSA-N	1	1	303.362	1.834	20	5		DDBDMO
COc1ccc(C[NH2+][C@@H]2CCc3[nH]cnc3C2)cc1[N+](=O)[O-]	ZINC000368688239	301075228	/nfs/dbraw/zinc/07/52/28/301075228.db2.gz	NQIQNYIGILDBSQ-LLVKDONJSA-N	1	1	302.334	1.974	20	5		DDBDMO
Cc1cccc(C(=O)N2CCC[N@H+]([C@@H](C)CO)CC2)c1[N+](=O)[O-]	ZINC000368976310	301115390	/nfs/dbraw/zinc/11/53/90/301115390.db2.gz	VKUPXPBBCQWQOT-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC[C@@H]21	ZINC000369981747	301251427	/nfs/dbraw/zinc/25/14/27/301251427.db2.gz	CYMBKKKSLFGHQJ-GWCFXTLKSA-N	1	1	319.365	1.128	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@]2(CNC(=O)C2)C1	ZINC000370631125	301374477	/nfs/dbraw/zinc/37/44/77/301374477.db2.gz	LJODJUCHDSAZEA-OAHLLOKOSA-N	1	1	305.334	1.315	20	5		DDBDMO
CNC(=O)C[N@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000370873575	301398989	/nfs/dbraw/zinc/39/89/89/301398989.db2.gz	RUWJZCAVBYCYAX-UHFFFAOYSA-N	1	1	304.350	1.321	20	5		DDBDMO
CNC(=O)C[N@@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000370873575	301398990	/nfs/dbraw/zinc/39/89/90/301398990.db2.gz	RUWJZCAVBYCYAX-UHFFFAOYSA-N	1	1	304.350	1.321	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCCC[C@@H]2CN1Cc1c([N+](=O)[O-])ncn1C	ZINC000375869456	302007856	/nfs/dbraw/zinc/00/78/56/302007856.db2.gz	AGBULJABLODGJF-CHWSQXEVSA-N	1	1	307.398	1.777	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H]2CCCO2)CC[C@H]1Nc1ncc([N+](=O)[O-])cn1	ZINC000376928225	302122575	/nfs/dbraw/zinc/12/25/75/302122575.db2.gz	YXJKCTPKUCRFLJ-KWCYVHTRSA-N	1	1	321.381	1.686	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532140712	303276538	/nfs/dbraw/zinc/27/65/38/303276538.db2.gz	RZPWBCMYSSKWNN-VXGBXAGGSA-N	1	1	306.366	1.840	20	5		DDBDMO
Cc1ccc2c(c1)C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000361603192	307000691	/nfs/dbraw/zinc/00/06/91/307000691.db2.gz	PNOOVVLSUHBWQV-HNNXBMFYSA-N	1	1	302.334	1.476	20	5		DDBDMO
Cc1ccc2c(c1)C[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000361603192	307000692	/nfs/dbraw/zinc/00/06/92/307000692.db2.gz	PNOOVVLSUHBWQV-HNNXBMFYSA-N	1	1	302.334	1.476	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073896	307012824	/nfs/dbraw/zinc/01/28/24/307012824.db2.gz	AHQVSVJMRYQPRD-GRYCIOLGSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362073896	307012825	/nfs/dbraw/zinc/01/28/25/307012825.db2.gz	AHQVSVJMRYQPRD-GRYCIOLGSA-N	1	1	307.350	1.482	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@]23CCOC3)c([N+](=O)[O-])c1	ZINC000367456781	307094556	/nfs/dbraw/zinc/09/45/56/307094556.db2.gz	CUTNCKHFIMSVJN-HNNXBMFYSA-N	1	1	305.334	1.449	20	5		DDBDMO
CCCCNC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000369693587	307127011	/nfs/dbraw/zinc/12/70/11/307127011.db2.gz	UHGJWTLLSVPEGI-UHFFFAOYSA-N	1	1	309.370	1.345	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000371277312	307146370	/nfs/dbraw/zinc/14/63/70/307146370.db2.gz	IOUNPRDBBAKCEV-GJZGRUSLSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000371277312	307146371	/nfs/dbraw/zinc/14/63/71/307146371.db2.gz	IOUNPRDBBAKCEV-GJZGRUSLSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000377563982	307273156	/nfs/dbraw/zinc/27/31/56/307273156.db2.gz	MPBPAHGGKBMDTR-NSHDSACASA-N	1	1	314.292	1.072	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)n1	ZINC000427252855	307302939	/nfs/dbraw/zinc/30/29/39/307302939.db2.gz	ZBACYSYQQBXXMY-NWDGAFQWSA-N	1	1	323.397	1.804	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)C[C@@H]21	ZINC000573917143	308255549	/nfs/dbraw/zinc/25/55/49/308255549.db2.gz	LWLAYIZBVOPKQS-RNCFNFMXSA-N	1	1	308.313	1.902	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cc(Cl)c1=O	ZINC000576479986	308317959	/nfs/dbraw/zinc/31/79/59/308317959.db2.gz	JNVXJSQBJHMXLE-SNVBAGLBSA-N	1	1	303.746	1.111	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@H](F)C2)c([N+](=O)[O-])c1	ZINC000451190032	534065842	/nfs/dbraw/zinc/06/58/42/534065842.db2.gz	GAGVCMGOYWDJDX-JTQLQIEISA-N	1	1	311.313	1.976	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2CCO)c1	ZINC000452391876	534317903	/nfs/dbraw/zinc/31/79/03/534317903.db2.gz	QQDXVDVQXUWGKZ-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000299391971	529014738	/nfs/dbraw/zinc/01/47/38/529014738.db2.gz	RTAMYRHOPVVQDK-NSHDSACASA-N	1	1	321.381	1.621	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000824860761	608196995	/nfs/dbraw/zinc/19/69/95/608196995.db2.gz	XSOQJIDPFURYPR-UWVGGRQHSA-N	1	1	317.353	1.304	20	5		DDBDMO
COCC[N@H+](CCc1ccccc1)Cn1cc([N+](=O)[O-])cn1	ZINC000746051526	700003606	/nfs/dbraw/zinc/00/36/06/700003606.db2.gz	MQYCEWFYSCOUFA-UHFFFAOYSA-N	1	1	304.350	1.940	20	5		DDBDMO
COCC[N@@H+](CCc1ccccc1)Cn1cc([N+](=O)[O-])cn1	ZINC000746051526	700003608	/nfs/dbraw/zinc/00/36/08/700003608.db2.gz	MQYCEWFYSCOUFA-UHFFFAOYSA-N	1	1	304.350	1.940	20	5		DDBDMO
C[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCOC1	ZINC000106857669	696628275	/nfs/dbraw/zinc/62/82/75/696628275.db2.gz	IYKBSVNIDDGUFR-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
C[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCOC1	ZINC000106857669	696628276	/nfs/dbraw/zinc/62/82/76/696628276.db2.gz	IYKBSVNIDDGUFR-ZDUSSCGKSA-N	1	1	303.322	1.532	20	5		DDBDMO
CN([C@H]1CCC[N@H+](C)C1)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119852768	696686801	/nfs/dbraw/zinc/68/68/01/696686801.db2.gz	CQMMIGWDIMHIJL-VIFPVBQESA-N	1	1	319.408	1.371	20	5		DDBDMO
CN([C@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119852768	696686802	/nfs/dbraw/zinc/68/68/02/696686802.db2.gz	CQMMIGWDIMHIJL-VIFPVBQESA-N	1	1	319.408	1.371	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](C/C=C\Cl)C2	ZINC000981764128	696907481	/nfs/dbraw/zinc/90/74/81/696907481.db2.gz	NNMVCUKBWWYBLT-DNDCWNJCSA-N	1	1	313.785	1.329	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H](OCCO)C2)cc1	ZINC000776585049	698122143	/nfs/dbraw/zinc/12/21/43/698122143.db2.gz	RQPJJGMQMHEHPO-LSDHHAIUSA-N	1	1	310.350	1.102	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857803	698144187	/nfs/dbraw/zinc/14/41/87/698144187.db2.gz	NCGWNULFYVHVQS-FZMZJTMJSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857803	698144189	/nfs/dbraw/zinc/14/41/89/698144189.db2.gz	NCGWNULFYVHVQS-FZMZJTMJSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@@H+]1C	ZINC000779219833	698403116	/nfs/dbraw/zinc/40/31/16/698403116.db2.gz	LMTUFKRUSGXXKP-SECBINFHSA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000779219833	698403120	/nfs/dbraw/zinc/40/31/20/698403120.db2.gz	LMTUFKRUSGXXKP-SECBINFHSA-N	1	1	307.306	1.100	20	5		DDBDMO
Cc1nn(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000779864603	698476422	/nfs/dbraw/zinc/47/64/22/698476422.db2.gz	ZYTVBQBTEYSKNI-AWEZNQCLSA-N	1	1	307.398	1.721	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1F	ZINC000750880724	700253761	/nfs/dbraw/zinc/25/37/61/700253761.db2.gz	SFURQGQLBZGQLN-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
Cc1cc(C(=O)OCCC[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC000750884481	700254385	/nfs/dbraw/zinc/25/43/85/700254385.db2.gz	RGQPSSQARHLLJA-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
COCC[N@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@H]1CCOC1	ZINC000782960568	698789214	/nfs/dbraw/zinc/78/92/14/698789214.db2.gz	HDQOBSMGQTVDRZ-AWEZNQCLSA-N	1	1	320.349	1.639	20	5		DDBDMO
COCC[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@H]1CCOC1	ZINC000782960568	698789217	/nfs/dbraw/zinc/78/92/17/698789217.db2.gz	HDQOBSMGQTVDRZ-AWEZNQCLSA-N	1	1	320.349	1.639	20	5		DDBDMO
Nc1c(F)c(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000785801488	699102621	/nfs/dbraw/zinc/10/26/21/699102621.db2.gz	RENPUGLXZAKPHK-ZJUUUORDSA-N	1	1	310.329	1.591	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000791255960	699617777	/nfs/dbraw/zinc/61/77/77/699617777.db2.gz	AWMIERYDCUSQTN-JSGCOSHPSA-N	1	1	322.340	1.435	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC[C@H](OC(F)F)C2)c1	ZINC000801986910	700362325	/nfs/dbraw/zinc/36/23/25/700362325.db2.gz	YFMJHTTXHMMZHD-NWDGAFQWSA-N	1	1	302.277	1.942	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](OC(F)F)C2)c1	ZINC000801986910	700362328	/nfs/dbraw/zinc/36/23/28/700362328.db2.gz	YFMJHTTXHMMZHD-NWDGAFQWSA-N	1	1	302.277	1.942	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000753951470	700471024	/nfs/dbraw/zinc/47/10/24/700471024.db2.gz	VJGYJYQEDOVFNI-CQSZACIVSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000753951470	700471025	/nfs/dbraw/zinc/47/10/25/700471025.db2.gz	VJGYJYQEDOVFNI-CQSZACIVSA-N	1	1	308.334	1.861	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CCC[C@H]1C	ZINC000756519254	700625411	/nfs/dbraw/zinc/62/54/11/700625411.db2.gz	HVNLLUPRCPSXLW-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H](CO)C3CC3)n2)c1	ZINC000763062120	700923212	/nfs/dbraw/zinc/92/32/12/700923212.db2.gz	AHFGGBHVXAQUEV-LBPRGKRZSA-N	1	1	304.306	1.505	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000770474582	701279543	/nfs/dbraw/zinc/27/95/43/701279543.db2.gz	BOTKENIWKLUAQB-QWRGUYRKSA-N	1	1	305.338	1.374	20	5		DDBDMO
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000770474582	701279544	/nfs/dbraw/zinc/27/95/44/701279544.db2.gz	BOTKENIWKLUAQB-QWRGUYRKSA-N	1	1	305.338	1.374	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CC[NH+](CCCCO)CC1	ZINC000807985877	701493222	/nfs/dbraw/zinc/49/32/22/701493222.db2.gz	OYIAVETULSFNMX-UHFFFAOYSA-N	1	1	321.377	1.692	20	5		DDBDMO
O=C(CC[N@H+]1CCOC[C@@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000839531490	701726994	/nfs/dbraw/zinc/72/69/94/701726994.db2.gz	DOSOYNSKEZDEON-LBPRGKRZSA-N	1	1	323.349	1.007	20	5		DDBDMO
O=C(CC[N@@H+]1CCOC[C@@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000839531490	701726999	/nfs/dbraw/zinc/72/69/99/701726999.db2.gz	DOSOYNSKEZDEON-LBPRGKRZSA-N	1	1	323.349	1.007	20	5		DDBDMO
Cc1ccc([C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+]2CCCC2)o1	ZINC000839621513	701756626	/nfs/dbraw/zinc/75/66/26/701756626.db2.gz	AWEGIPOKBNRLKE-JHJVBQTASA-N	1	1	307.350	1.506	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839636459	701761834	/nfs/dbraw/zinc/76/18/34/701761834.db2.gz	SJTBTCKHEMACLK-TZMCWYRMSA-N	1	1	307.350	1.038	20	5		DDBDMO
COC(=O)[C@]1(C)CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000839665959	701772908	/nfs/dbraw/zinc/77/29/08/701772908.db2.gz	JJUMYRBMWKJWQP-GOEBONIOSA-N	1	1	322.361	1.903	20	5		DDBDMO
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)[C@@H]1CC1[N+](=O)[O-])[NH+](C)C	ZINC000839761219	701814743	/nfs/dbraw/zinc/81/47/43/701814743.db2.gz	LYPMYJQNMIXRSA-NMFUWQPSSA-N	1	1	305.378	1.768	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@@H+](C)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000866112513	706621818	/nfs/dbraw/zinc/62/18/18/706621818.db2.gz	DQPFZUXYYMRTBD-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
C[N@H+]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CCC1(C)C	ZINC000866113044	706621933	/nfs/dbraw/zinc/62/19/33/706621933.db2.gz	PXWYYIABSTUHIF-UHFFFAOYSA-N	1	1	308.382	1.590	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2C[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000816648798	702135687	/nfs/dbraw/zinc/13/56/87/702135687.db2.gz	PKBBDSZNQRQBQE-WDEREUQCSA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000816648798	702135690	/nfs/dbraw/zinc/13/56/90/702135690.db2.gz	PKBBDSZNQRQBQE-WDEREUQCSA-N	1	1	308.334	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)C2CC2)c(F)c1	ZINC000840965313	702295985	/nfs/dbraw/zinc/29/59/85/702295985.db2.gz	DDYHEBOEDCAILV-UHFFFAOYSA-N	1	1	302.327	1.401	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nc2ccccn2c1[N+](=O)[O-]	ZINC000842047200	702663595	/nfs/dbraw/zinc/66/35/95/702663595.db2.gz	MISZGXMZKAQFID-RYUDHWBXSA-N	1	1	319.365	1.134	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000842163527	702678683	/nfs/dbraw/zinc/67/86/83/702678683.db2.gz	PEVFRQXIONNIRI-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H]1C	ZINC000844018430	702955824	/nfs/dbraw/zinc/95/58/24/702955824.db2.gz	KKWWRYBWYGUKEZ-TXEJJXNPSA-N	1	1	324.381	1.115	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H]1C	ZINC000844018430	702955825	/nfs/dbraw/zinc/95/58/25/702955825.db2.gz	KKWWRYBWYGUKEZ-TXEJJXNPSA-N	1	1	324.381	1.115	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCOC(F)F)C2)nc1	ZINC000851843642	703868666	/nfs/dbraw/zinc/86/86/66/703868666.db2.gz	JYYLMWVDCQTHCH-SECBINFHSA-N	1	1	302.281	1.715	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000818585726	703931436	/nfs/dbraw/zinc/93/14/36/703931436.db2.gz	NSCHDZWIMICSSO-SNVBAGLBSA-N	1	1	319.695	1.927	20	5		DDBDMO
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C[NH+]1CCCC1	ZINC000818966596	704036853	/nfs/dbraw/zinc/03/68/53/704036853.db2.gz	LMSBEZJZEFIANQ-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCC2	ZINC000818969311	704037528	/nfs/dbraw/zinc/03/75/28/704037528.db2.gz	CPQYEHDJLBDYND-MFKMUULPSA-N	1	1	317.349	1.517	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCc3cn[nH]c3C2)c1	ZINC000819155068	704077599	/nfs/dbraw/zinc/07/75/99/704077599.db2.gz	OKXGSMGTSRQLQO-DOMZBBRYSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH2+][C@@H]1CCn2ccnc21	ZINC000819337786	704109589	/nfs/dbraw/zinc/10/95/89/704109589.db2.gz	PHCQPLBIQNUYBF-NWDGAFQWSA-N	1	1	318.333	1.266	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@H]2CC[C@@H](C1)O2)c1cccc([N+](=O)[O-])c1	ZINC000870896149	704160883	/nfs/dbraw/zinc/16/08/83/704160883.db2.gz	QVAFANUXCFBHJU-VNHYZAJKSA-N	1	1	305.334	1.159	20	5		DDBDMO
CN(c1ccccc1)[C@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000853585515	704276082	/nfs/dbraw/zinc/27/60/82/704276082.db2.gz	QHZQGIOCMHCEEW-AWEZNQCLSA-N	1	1	301.350	1.960	20	5		DDBDMO
CN(c1ccccc1)[C@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000853585515	704276085	/nfs/dbraw/zinc/27/60/85/704276085.db2.gz	QHZQGIOCMHCEEW-AWEZNQCLSA-N	1	1	301.350	1.960	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)C2	ZINC000854739264	704446256	/nfs/dbraw/zinc/44/62/56/704446256.db2.gz	SGIYKZOOFZDKNG-OAHLLOKOSA-N	1	1	319.365	1.130	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000855362979	704481046	/nfs/dbraw/zinc/48/10/46/704481046.db2.gz	QORNKHPKFMUFNV-NSHDSACASA-N	1	1	322.321	1.669	20	5		DDBDMO
CCN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1	ZINC000855485767	704487325	/nfs/dbraw/zinc/48/73/25/704487325.db2.gz	HDAFOBVEPBZZAU-LSDHHAIUSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179359	705163336	/nfs/dbraw/zinc/16/33/36/705163336.db2.gz	MBSPJRJIJYEQHA-JKSUJKDBSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179359	705163337	/nfs/dbraw/zinc/16/33/37/705163337.db2.gz	MBSPJRJIJYEQHA-JKSUJKDBSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823179359	705163339	/nfs/dbraw/zinc/16/33/39/705163339.db2.gz	MBSPJRJIJYEQHA-JKSUJKDBSA-N	1	1	307.394	1.900	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000874837364	705194163	/nfs/dbraw/zinc/19/41/63/705194163.db2.gz	IGUMGLORBWHUKB-CHWSQXEVSA-N	1	1	321.381	1.222	20	5		DDBDMO
Cc1[nH+]cc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1C	ZINC000824497925	705465619	/nfs/dbraw/zinc/46/56/19/705465619.db2.gz	UFAMWEKLVYPTJF-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825118401	705603986	/nfs/dbraw/zinc/60/39/86/705603986.db2.gz	SMTZNJCTSZGBEJ-KFWWJZLASA-N	1	1	319.361	1.371	20	5		DDBDMO
O=[N+]([O-])c1cnn(Cc2ccc(C[NH+]3CCOCC3)cc2)n1	ZINC000863370293	705914194	/nfs/dbraw/zinc/91/41/94/705914194.db2.gz	AKUFQYAKXRSWMC-UHFFFAOYSA-N	1	1	303.322	1.067	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC[C@H]21	ZINC000827269311	705964922	/nfs/dbraw/zinc/96/49/22/705964922.db2.gz	WQWOONNHLACERH-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNc2ccnc(F)c2[N+](=O)[O-])C1	ZINC000881772863	707361688	/nfs/dbraw/zinc/36/16/88/707361688.db2.gz	DSLIHNPTYBZJIG-NSHDSACASA-N	1	1	312.345	1.898	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@H]2CCCC[N@@H+]2CCO)nc2ccccn21	ZINC000828461293	706184329	/nfs/dbraw/zinc/18/43/29/706184329.db2.gz	RINPJDQMMKUOJL-GFCCVEGCSA-N	1	1	319.365	1.501	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(N[C@@H]2CCn3cc[nH+]c3C2)cc1F	ZINC000865688550	706497758	/nfs/dbraw/zinc/49/77/58/706497758.db2.gz	GNZIFZDWCVJUIQ-SNVBAGLBSA-N	1	1	306.297	1.850	20	5		DDBDMO
C[C@@H](NCC[NH+]1CCC(O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872078884	707288521	/nfs/dbraw/zinc/28/85/21/707288521.db2.gz	UACHEWDQYLIHRK-LLVKDONJSA-N	1	1	311.357	1.841	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccnc(F)c3[N+](=O)[O-])CC2)C1	ZINC000881985495	707455030	/nfs/dbraw/zinc/45/50/30/707455030.db2.gz	NRVAJDSPWWLDDP-LBPRGKRZSA-N	1	1	323.372	1.345	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000872779586	707596683	/nfs/dbraw/zinc/59/66/83/707596683.db2.gz	GTERTWXKJNRIIW-ZIAGYGMSSA-N	1	1	306.366	1.342	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000882485346	707655757	/nfs/dbraw/zinc/65/57/57/707655757.db2.gz	HNSZBBPQTVHMKM-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)n1	ZINC000882540611	707688285	/nfs/dbraw/zinc/68/82/85/707688285.db2.gz	UHUVSQIUHBADNK-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@@H+]3CCOC[C@H]3C)CC2)n1	ZINC000882540610	707688788	/nfs/dbraw/zinc/68/87/88/707688788.db2.gz	UHUVSQIUHBADNK-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1ccc(CN[C@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1[N+](=O)[O-]	ZINC000873251848	707785997	/nfs/dbraw/zinc/78/59/97/707785997.db2.gz	LVJODEQCTFBPRN-HZPDHXFCSA-N	1	1	305.378	1.760	20	5		DDBDMO
O=C(NC[C@@H](c1ccccc1)[NH+]1CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839463372	708049261	/nfs/dbraw/zinc/04/92/61/708049261.db2.gz	OKRPWTBLJHUPAR-KFWWJZLASA-N	1	1	303.362	1.605	20	5		DDBDMO
O=C(C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1)N1CCCC1	ZINC000885928626	708665013	/nfs/dbraw/zinc/66/50/13/708665013.db2.gz	CMTJPAYCBAKOHW-UHFFFAOYSA-N	1	1	318.377	1.824	20	5		DDBDMO
Cc1ccccc1[C@@H](CO)[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000886433800	708760317	/nfs/dbraw/zinc/76/03/17/708760317.db2.gz	UXPBEQRZQBPZRZ-OAHLLOKOSA-N	1	1	304.350	1.765	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593165	708785672	/nfs/dbraw/zinc/78/56/72/708785672.db2.gz	JTLGLSOFOVPAGF-LBPRGKRZSA-N	1	1	323.397	1.439	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C)C[C@@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593165	708785675	/nfs/dbraw/zinc/78/56/75/708785675.db2.gz	JTLGLSOFOVPAGF-LBPRGKRZSA-N	1	1	323.397	1.439	20	5		DDBDMO
CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)CC[N@H+](C)CC1	ZINC000888983432	709421564	/nfs/dbraw/zinc/42/15/64/709421564.db2.gz	AYMBCVFINSMXRM-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2F)CC[N@@H+](C)CC1	ZINC000888983432	709421566	/nfs/dbraw/zinc/42/15/66/709421566.db2.gz	AYMBCVFINSMXRM-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
Cn1c(C(=O)NC(C)(C)CC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000912954185	713134448	/nfs/dbraw/zinc/13/44/48/713134448.db2.gz	IMABRMVLTVAHFF-UHFFFAOYSA-N	1	1	324.381	1.164	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H](CCO)C2)c1[N+](=O)[O-]	ZINC000891949022	710335840	/nfs/dbraw/zinc/33/58/40/710335840.db2.gz	YDQVGKBGZMIPJL-NSHDSACASA-N	1	1	310.350	1.903	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1=O	ZINC000892007845	710351778	/nfs/dbraw/zinc/35/17/78/710351778.db2.gz	NMFSBDGZPSIMNM-NSHDSACASA-N	1	1	316.361	1.953	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452037	713203248	/nfs/dbraw/zinc/20/32/48/713203248.db2.gz	MNJPKXBZVBTAQL-WFASDCNBSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928456455	713205035	/nfs/dbraw/zinc/20/50/35/713205035.db2.gz	RPLYOWIDVQDINW-MFKMUULPSA-N	1	1	318.377	1.992	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000928457570	713205238	/nfs/dbraw/zinc/20/52/38/713205238.db2.gz	XJIMFBWRCBCTSG-GXSJLCMTSA-N	1	1	323.349	1.434	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000893941812	710893892	/nfs/dbraw/zinc/89/38/92/710893892.db2.gz	WWXPVMKHDVDUOZ-CMPLNLGQSA-N	1	1	320.349	1.307	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CC[N@@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928569263	713232255	/nfs/dbraw/zinc/23/22/55/713232255.db2.gz	XVYOJIUORHSZDY-SECBINFHSA-N	1	1	309.322	1.046	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928569263	713232256	/nfs/dbraw/zinc/23/22/56/713232256.db2.gz	XVYOJIUORHSZDY-SECBINFHSA-N	1	1	309.322	1.046	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000928570074	713233048	/nfs/dbraw/zinc/23/30/48/713233048.db2.gz	REDWJBNSYPHWKK-LBPRGKRZSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000928570074	713233049	/nfs/dbraw/zinc/23/30/49/713233049.db2.gz	REDWJBNSYPHWKK-LBPRGKRZSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[C@H](NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000895066214	711394753	/nfs/dbraw/zinc/39/47/53/711394753.db2.gz	IXSTZRZUVUBPMV-FPMFFAJLSA-N	1	1	318.377	1.859	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@@H+](C)[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545980	713252914	/nfs/dbraw/zinc/25/29/14/713252914.db2.gz	DZAWFIZLIYTBBQ-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@H+](C)[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545980	713252916	/nfs/dbraw/zinc/25/29/16/713252916.db2.gz	DZAWFIZLIYTBBQ-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895247513	711464713	/nfs/dbraw/zinc/46/47/13/711464713.db2.gz	VFFJIHKBBUNXPW-SKDRFNHKSA-N	1	1	313.789	1.689	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@H]2CC[N@@H+]2C)c([N+](=O)[O-])c1=O	ZINC000895776909	711604103	/nfs/dbraw/zinc/60/41/03/711604103.db2.gz	NTUKOVVRMIYHLQ-SNVBAGLBSA-N	1	1	302.334	1.563	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])c1=O	ZINC000895776909	711604106	/nfs/dbraw/zinc/60/41/06/711604106.db2.gz	NTUKOVVRMIYHLQ-SNVBAGLBSA-N	1	1	302.334	1.563	20	5		DDBDMO
C[C@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1C[NH3+]	ZINC000904410717	711854470	/nfs/dbraw/zinc/85/44/70/711854470.db2.gz	FYBCPMLRQTXRGB-RYUDHWBXSA-N	1	1	321.377	1.783	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C1CN(C)CC[N@@H+](C)C1	ZINC000908269811	712725346	/nfs/dbraw/zinc/72/53/46/712725346.db2.gz	WDAYFVAWQIZOFZ-UHFFFAOYSA-N	1	1	320.393	1.644	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000929090338	713543789	/nfs/dbraw/zinc/54/37/89/713543789.db2.gz	BDLYBPKHKQYGKA-GXFFZTMASA-N	1	1	320.349	1.771	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)C2(O)CCC2)C2CC2)c1	ZINC000929853341	713707139	/nfs/dbraw/zinc/70/71/39/713707139.db2.gz	LYDONWWDJYYHMX-HNNXBMFYSA-N	1	1	306.362	1.835	20	5		DDBDMO
CCOCCOCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929987474	713729619	/nfs/dbraw/zinc/72/96/19/713729619.db2.gz	JYJLLHMCJHRKKR-CYBMUJFWSA-N	1	1	324.381	1.529	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2c(=O)[nH]n(C)c2C1	ZINC000931193840	714030736	/nfs/dbraw/zinc/03/07/36/714030736.db2.gz	OSGDSQSCMBUXMM-UHFFFAOYSA-N	1	1	318.333	1.601	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2c(=O)[nH]n(C)c2C1	ZINC000931193840	714030739	/nfs/dbraw/zinc/03/07/39/714030739.db2.gz	OSGDSQSCMBUXMM-UHFFFAOYSA-N	1	1	318.333	1.601	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000931397338	714084201	/nfs/dbraw/zinc/08/42/01/714084201.db2.gz	MGTPOFDLVCYROM-QLFBSQMISA-N	1	1	321.377	1.113	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000931720609	714168868	/nfs/dbraw/zinc/16/88/68/714168868.db2.gz	SYWPOAHYXFCAEG-NUEKZKHPSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000931720609	714168871	/nfs/dbraw/zinc/16/88/71/714168871.db2.gz	SYWPOAHYXFCAEG-NUEKZKHPSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CC[C@@H]2CC[C@H](C1)[N@H+]2C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000931720609	714168873	/nfs/dbraw/zinc/16/88/73/714168873.db2.gz	SYWPOAHYXFCAEG-NUEKZKHPSA-N	1	1	305.378	1.797	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000932104366	714259815	/nfs/dbraw/zinc/25/98/15/714259815.db2.gz	FIOUHMBSJVCHDD-UXIGCNINSA-N	1	1	322.361	1.759	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C3CCOCC3)C2)c([N+](=O)[O-])n1	ZINC000933088977	714514524	/nfs/dbraw/zinc/51/45/24/714514524.db2.gz	NXFJITWUOQYZOJ-ZDUSSCGKSA-N	1	1	308.382	1.967	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(CCOc3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000933743278	714660787	/nfs/dbraw/zinc/66/07/87/714660787.db2.gz	MPUKIXQHTMNQBD-CJNGLKHVSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CC[N@H+]1C	ZINC000925333468	714815377	/nfs/dbraw/zinc/81/53/77/714815377.db2.gz	FCMYAZQJCBSDHA-FZMZJTMJSA-N	1	1	318.377	1.755	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000925424516	714852201	/nfs/dbraw/zinc/85/22/01/714852201.db2.gz	MHRBUVQUWDHIDP-LLVKDONJSA-N	1	1	306.366	1.833	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CC[N@H+]1C	ZINC000925423557	714852384	/nfs/dbraw/zinc/85/23/84/714852384.db2.gz	QWTPSTMBCSDNHI-CYBMUJFWSA-N	1	1	306.366	1.483	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)n1	ZINC000934838779	714914201	/nfs/dbraw/zinc/91/42/01/714914201.db2.gz	OZFOKYWGXRIRGD-ZIAGYGMSSA-N	1	1	308.382	1.930	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)C[C@@H]2C)n1	ZINC001164631982	719256899	/nfs/dbraw/zinc/25/68/99/719256899.db2.gz	GSTXIWXRZISQES-ZJUUUORDSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)n1	ZINC001164631982	719256903	/nfs/dbraw/zinc/25/69/03/719256903.db2.gz	GSTXIWXRZISQES-ZJUUUORDSA-N	1	1	308.338	1.305	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1cc(Cl)ccc1/C=C/[N+](=O)[O-]	ZINC001167359220	733291505	/nfs/dbraw/zinc/29/15/05/733291505.db2.gz	MEIBLKUZXSQORB-CUQIWSDWSA-N	1	1	305.725	1.711	20	5		DDBDMO
CC1(C)CC(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC001025776703	736853310	/nfs/dbraw/zinc/85/33/10/736853310.db2.gz	FRLZVUBFRWKXCT-RGDJUOJXSA-N	1	1	307.394	1.134	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001025776703	736853312	/nfs/dbraw/zinc/85/33/12/736853312.db2.gz	FRLZVUBFRWKXCT-RGDJUOJXSA-N	1	1	307.394	1.134	20	5		DDBDMO
CC1(C)CC(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001025776703	736853314	/nfs/dbraw/zinc/85/33/14/736853314.db2.gz	FRLZVUBFRWKXCT-RGDJUOJXSA-N	1	1	307.394	1.134	20	5		DDBDMO
Cc1ccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)c1	ZINC001031662757	747337297	/nfs/dbraw/zinc/33/72/97/747337297.db2.gz	LKPDZVOFJPWQLP-HZPDHXFCSA-N	1	1	317.389	1.517	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC001128982755	750630313	/nfs/dbraw/zinc/63/03/13/750630313.db2.gz	QZRJEDSPXZHCTM-YOGCLGLASA-N	1	1	304.350	1.653	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](Cc2ccccc2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000673528	762077847	/nfs/dbraw/zinc/07/78/47/762077847.db2.gz	GCGWVIMGOINMKZ-HZPDHXFCSA-N	1	1	315.373	1.600	20	5		DDBDMO
O=C(NCC1=CC[N@H+](Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000673528	762077853	/nfs/dbraw/zinc/07/78/53/762077853.db2.gz	GCGWVIMGOINMKZ-HZPDHXFCSA-N	1	1	315.373	1.600	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000673528	762077860	/nfs/dbraw/zinc/07/78/60/762077860.db2.gz	GCGWVIMGOINMKZ-HZPDHXFCSA-N	1	1	315.373	1.600	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2C[C@H]3CN(CC4CC4)C[C@@H](C2)O3)C1	ZINC001169023821	762200693	/nfs/dbraw/zinc/20/06/93/762200693.db2.gz	FLWKVSDPPWPYRE-FPCVCCKLSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H](N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023821	762200700	/nfs/dbraw/zinc/20/07/00/762200700.db2.gz	FLWKVSDPPWPYRE-FPCVCCKLSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H](N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023821	762200704	/nfs/dbraw/zinc/20/07/04/762200704.db2.gz	FLWKVSDPPWPYRE-FPCVCCKLSA-N	1	1	309.410	1.227	20	5		DDBDMO
CCOCc1ncn2c1C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169025764	762203674	/nfs/dbraw/zinc/20/36/74/762203674.db2.gz	UVKOYHBALNIAKV-CHWSQXEVSA-N	1	1	308.382	1.681	20	5		DDBDMO
CCOCc1ncn2c1C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169025764	762203679	/nfs/dbraw/zinc/20/36/79/762203679.db2.gz	UVKOYHBALNIAKV-CHWSQXEVSA-N	1	1	308.382	1.681	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2C[C@@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328987	766254166	/nfs/dbraw/zinc/25/41/66/766254166.db2.gz	MRXPYYZXZXWRNB-WXHSDQCUSA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2C[C@@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328987	766254168	/nfs/dbraw/zinc/25/41/68/766254168.db2.gz	MRXPYYZXZXWRNB-WXHSDQCUSA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC001170329051	766254865	/nfs/dbraw/zinc/25/48/65/766254865.db2.gz	NPTGKPDHZGDQSQ-YPMHNXCESA-N	1	1	321.377	1.732	20	5		DDBDMO
C[C@@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC001170352518	766260416	/nfs/dbraw/zinc/26/04/16/766260416.db2.gz	XNDMNPBVMDMQMM-ZENOOKHLSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC001170352518	766260421	/nfs/dbraw/zinc/26/04/21/766260421.db2.gz	XNDMNPBVMDMQMM-ZENOOKHLSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC001170352518	766260426	/nfs/dbraw/zinc/26/04/26/766260426.db2.gz	XNDMNPBVMDMQMM-ZENOOKHLSA-N	1	1	323.393	1.015	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC001097057349	771610946	/nfs/dbraw/zinc/61/09/46/771610946.db2.gz	WKJZZBQHOXBNQM-HAQNSBGRSA-N	1	1	321.381	1.391	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1c(Br)cc(F)cc1[N+](=O)[O-]	ZINC001170900194	771898938	/nfs/dbraw/zinc/89/89/38/771898938.db2.gz	QBBAZUQWDKKCKH-SECBINFHSA-N	1	1	321.150	1.932	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ncccc1[N+](=O)[O-])C1CCC1	ZINC001094221993	775544334	/nfs/dbraw/zinc/54/43/34/775544334.db2.gz	ZLKJSOHMSQSIGH-UHFFFAOYSA-N	1	1	307.354	1.002	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(CCNC2=O)C1	ZINC001173221011	777053190	/nfs/dbraw/zinc/05/31/90/777053190.db2.gz	FGARWIVFGRAKBR-LRDDRELGSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001173231912	777063611	/nfs/dbraw/zinc/06/36/11/777063611.db2.gz	DPIMFNQALBQANR-BXUZGUMPSA-N	1	1	305.334	1.662	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001173231912	777063615	/nfs/dbraw/zinc/06/36/15/777063615.db2.gz	DPIMFNQALBQANR-BXUZGUMPSA-N	1	1	305.334	1.662	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101704408	777412802	/nfs/dbraw/zinc/41/28/02/777412802.db2.gz	GPRSUCCLJOSAFR-UHFFFAOYSA-N	1	1	309.370	1.202	20	5		DDBDMO
CN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)C[N@@H+](C)C1CCC1	ZINC001102017147	777798026	/nfs/dbraw/zinc/79/80/26/777798026.db2.gz	HLWWPTGXELDAJP-UHFFFAOYSA-N	1	1	321.381	1.344	20	5		DDBDMO
CCC(=O)N(C)CC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001102409844	778122525	/nfs/dbraw/zinc/12/25/25/778122525.db2.gz	YEWSJIXWOYCOEX-UHFFFAOYSA-N	1	1	320.393	1.585	20	5		DDBDMO
C[N@H+](CCNC(=O)c1ncc[nH]1)Cc1cccc([N+](=O)[O-])c1	ZINC001266271944	836021423	/nfs/dbraw/zinc/02/14/23/836021423.db2.gz	OGJJUHMGEUEANR-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ncc[nH]1)Cc1cccc([N+](=O)[O-])c1	ZINC001266271944	836021431	/nfs/dbraw/zinc/02/14/31/836021431.db2.gz	OGJJUHMGEUEANR-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001155155910	861782875	/nfs/dbraw/zinc/78/28/75/861782875.db2.gz	CATUAHBXECVZAN-JGVFFNPUSA-N	1	1	313.745	1.280	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+][C@H](c2ccc(O)cc2)C1	ZINC001149922548	861977004	/nfs/dbraw/zinc/97/70/04/861977004.db2.gz	DDGHDBOWQVHEDI-LBPRGKRZSA-N	1	1	317.301	1.680	20	5		DDBDMO
CO[C@@H]1C[C@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC001122952348	859024431	/nfs/dbraw/zinc/02/44/31/859024431.db2.gz	PTUACVQMILFHNV-RRFJBIMHSA-N	1	1	320.345	1.747	20	5		DDBDMO
CO[C@@H]1C[C@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC001122952348	859024444	/nfs/dbraw/zinc/02/44/44/859024444.db2.gz	PTUACVQMILFHNV-RRFJBIMHSA-N	1	1	320.345	1.747	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@H]1CC[N@H+]1C(C)(C)C	ZINC001123028248	859062607	/nfs/dbraw/zinc/06/26/07/859062607.db2.gz	AOJZUVSNBSDBCF-LLVKDONJSA-N	1	1	310.354	1.516	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])cc1OCC[N@@H+]1CC[C@@H](OC)C1	ZINC001225451269	881840750	/nfs/dbraw/zinc/84/07/50/881840750.db2.gz	PZWUPEUHIUMSIH-GFCCVEGCSA-N	1	1	324.333	1.481	20	5		DDBDMO
Cc1nc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160721464	866063028	/nfs/dbraw/zinc/06/30/28/866063028.db2.gz	YUSPWAUVMWAWBT-OCCSQVGLSA-N	1	1	306.366	1.963	20	5		DDBDMO
CCOc1cnc(NCCC[NH+]2CCN(C)CC2)c([N+](=O)[O-])c1	ZINC001161703979	866912628	/nfs/dbraw/zinc/91/26/28/866912628.db2.gz	VHWVBOANPNFQPC-UHFFFAOYSA-N	1	1	323.397	1.438	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC001333928908	867164738	/nfs/dbraw/zinc/16/47/38/867164738.db2.gz	CHOLDMWUMQRXEE-TUAOUCFPSA-N	1	1	321.381	1.429	20	5		DDBDMO
COC(=O)c1cnc(NC2C[NH+](C(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC001162221644	867355600	/nfs/dbraw/zinc/35/56/00/867355600.db2.gz	PCBYJDYEAIFJJX-UHFFFAOYSA-N	1	1	308.338	1.671	20	5		DDBDMO
CN1Cc2cc(NC[C@@H]3C[N@H+](C)CCO3)cc([N+](=O)[O-])c2N1	ZINC001162693994	867741015	/nfs/dbraw/zinc/74/10/15/867741015.db2.gz	KNTSGDOAIGRLLI-GFCCVEGCSA-N	1	1	307.354	1.110	20	5		DDBDMO
CN1Cc2cc(NC[C@@H]3C[N@@H+](C)CCO3)cc([N+](=O)[O-])c2N1	ZINC001162693994	867741026	/nfs/dbraw/zinc/74/10/26/867741026.db2.gz	KNTSGDOAIGRLLI-GFCCVEGCSA-N	1	1	307.354	1.110	20	5		DDBDMO
C[NH+](C)C=Cc1cc(NC[C@@H]2CNC(=O)O2)ncc1[N+](=O)[O-]	ZINC001163022555	868013344	/nfs/dbraw/zinc/01/33/44/868013344.db2.gz	KASRYSMFVBHACG-HMDXOVGESA-N	1	1	307.310	1.042	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@H]2CCCC[N@@H+]2C)c(C)c1[N+](=O)[O-]	ZINC001336205363	868787653	/nfs/dbraw/zinc/78/76/53/868787653.db2.gz	XSYYUEMRWMHPDM-CYBMUJFWSA-N	1	1	323.397	1.399	20	5		DDBDMO
CC(C)CCC[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494535	869232168	/nfs/dbraw/zinc/23/21/68/869232168.db2.gz	LEEZMTDDHNDTTL-ZIAGYGMSSA-N	1	1	311.426	1.964	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c1	ZINC001337678393	869592381	/nfs/dbraw/zinc/59/23/81/869592381.db2.gz	HTXRCCITBIOMGR-XHDPSFHLSA-N	1	1	308.382	1.650	20	5		DDBDMO
C[C@H](c1nnc(N2CCC[N@H+](C3CCCC3)CC2)n1C)[N+](=O)[O-]	ZINC001338210355	869869464	/nfs/dbraw/zinc/86/94/64/869869464.db2.gz	PJHANNWYLZYMKH-GFCCVEGCSA-N	1	1	322.413	1.608	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](c3ncccn3)C2)cc1	ZINC001308111072	871471025	/nfs/dbraw/zinc/47/10/25/871471025.db2.gz	BMDWUSCEEIVSQE-HIFRSBDPSA-N	1	1	314.345	1.908	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC001318153625	871784656	/nfs/dbraw/zinc/78/46/56/871784656.db2.gz	JYWCYJMYODYQNW-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1	ZINC001349696118	875310770	/nfs/dbraw/zinc/31/07/70/875310770.db2.gz	ZFCMKJFTIVKZTG-DDTOSNHZSA-N	1	1	319.361	1.673	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[N@@H+]3CCOC[C@H]3C2)c2ccccc21	ZINC001350007588	875497172	/nfs/dbraw/zinc/49/71/72/875497172.db2.gz	LIKFMPRUFPERGB-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[N@H+]3CCOC[C@H]3C2)c2ccccc21	ZINC001350007588	875497177	/nfs/dbraw/zinc/49/71/77/875497177.db2.gz	LIKFMPRUFPERGB-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1C1CCCC1	ZINC001352968661	877044999	/nfs/dbraw/zinc/04/49/99/877044999.db2.gz	HFRPTWUTKJDQIE-LBPRGKRZSA-N	1	1	321.381	1.267	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2C[NH+]3CCC2CC3)cc1O	ZINC001228810884	883681928	/nfs/dbraw/zinc/68/19/28/883681928.db2.gz	LDEHIJHPAQYESL-AWEZNQCLSA-N	1	1	322.317	1.560	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC001288259395	912802447	/nfs/dbraw/zinc/80/24/47/912802447.db2.gz	NKZNSRPBOVLQGQ-LLVKDONJSA-N	1	1	322.321	1.635	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC001288259395	912802458	/nfs/dbraw/zinc/80/24/58/912802458.db2.gz	NKZNSRPBOVLQGQ-LLVKDONJSA-N	1	1	322.321	1.635	20	5		DDBDMO
COC(=O)c1cnc(O[C@@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1	ZINC001233859990	887398254	/nfs/dbraw/zinc/39/82/54/887398254.db2.gz	SWLJUEQDXJMDCI-ZSBIGDGJSA-N	1	1	321.333	1.780	20	5		DDBDMO
COC(=O)N1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254592156	896520321	/nfs/dbraw/zinc/52/03/21/896520321.db2.gz	BUZGIAVKUPGXJF-HNNXBMFYSA-N	1	1	319.361	1.836	20	5		DDBDMO
CC(=O)N(C)[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254611676	896533689	/nfs/dbraw/zinc/53/36/89/896533689.db2.gz	QZEULWTXESPNMS-HOTGVXAUSA-N	1	1	303.362	1.615	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC3(CCCC3)C2)c1	ZINC000615000825	362112521	/nfs/dbraw/zinc/11/25/21/362112521.db2.gz	WSMOYIYALHKBGK-AWEZNQCLSA-N	1	1	308.382	1.808	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](CO)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000092763121	185338675	/nfs/dbraw/zinc/33/86/75/185338675.db2.gz	URAFSQWVMZKADY-GFCCVEGCSA-N	1	1	316.361	1.810	20	5		DDBDMO
CCc1nn(C)c(N[C@@H]2CCc3[nH+]c(C)cn3C2)c1[N+](=O)[O-]	ZINC000302611748	529767659	/nfs/dbraw/zinc/76/76/59/529767659.db2.gz	BQPLEMJMQHCAMJ-SNVBAGLBSA-N	1	1	304.354	1.823	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000181606753	199326234	/nfs/dbraw/zinc/32/62/34/199326234.db2.gz	JPYXOAIKOIKUMK-NSHDSACASA-N	1	1	321.333	1.538	20	5		DDBDMO
COc1ccc(CNC(=O)Cn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000457458755	232059679	/nfs/dbraw/zinc/05/96/79/232059679.db2.gz	PACNHFMFURWLRP-UHFFFAOYSA-N	1	1	304.306	1.425	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](O)C(C)(C)C1	ZINC000279723184	215092957	/nfs/dbraw/zinc/09/29/57/215092957.db2.gz	IZHYQCNXYGYLIX-MFKMUULPSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](O)C(C)(C)C1	ZINC000279723184	215092961	/nfs/dbraw/zinc/09/29/61/215092961.db2.gz	IZHYQCNXYGYLIX-MFKMUULPSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@@H+]2CC=C(C)CC2)c1[N+](=O)[O-]	ZINC000358468991	299163678	/nfs/dbraw/zinc/16/36/78/299163678.db2.gz	RLCCIDXTKOWTHI-UHFFFAOYSA-N	1	1	307.354	1.262	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](CC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000368572165	307105630	/nfs/dbraw/zinc/10/56/30/307105630.db2.gz	GFKZPIUPSHKIQD-LBPRGKRZSA-N	1	1	307.350	1.691	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2ccsc2C1	ZINC000152668389	186096022	/nfs/dbraw/zinc/09/60/22/186096022.db2.gz	IDRUQDJJVDDSKW-UHFFFAOYSA-N	1	1	305.359	1.876	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000266863674	186363514	/nfs/dbraw/zinc/36/35/14/186363514.db2.gz	LUEZGOSVFZDOOR-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000266863674	186363516	/nfs/dbraw/zinc/36/35/16/186363516.db2.gz	LUEZGOSVFZDOOR-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000047142666	352483086	/nfs/dbraw/zinc/48/30/86/352483086.db2.gz	AXLSJEJYDGTUKW-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000068777881	353129522	/nfs/dbraw/zinc/12/95/22/353129522.db2.gz	UNWPCMBVAPISJX-UHFFFAOYSA-N	1	1	324.356	1.872	20	5		DDBDMO
Cc1cnc(N2CC[C@@H](C[NH+]3CCOCC3)C2)c([N+](=O)[O-])c1	ZINC000078669267	353527291	/nfs/dbraw/zinc/52/72/91/353527291.db2.gz	HVRBYRXYFJXEIE-ZDUSSCGKSA-N	1	1	306.366	1.457	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1	ZINC000091478033	353827066	/nfs/dbraw/zinc/82/70/66/353827066.db2.gz	SNFNRHJRHUAAFN-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000091478067	353827301	/nfs/dbraw/zinc/82/73/01/353827301.db2.gz	JZSQLOUPZIDGAW-LBPRGKRZSA-N	1	1	306.366	1.594	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000126045079	354049878	/nfs/dbraw/zinc/04/98/78/354049878.db2.gz	JJJKVGCRRFHSLG-LBPRGKRZSA-N	1	1	318.377	1.702	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000280817252	354424700	/nfs/dbraw/zinc/42/47/00/354424700.db2.gz	UMEPZFKADDIRGS-BXUZGUMPSA-N	1	1	308.334	1.715	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)C[C@@H](O)C2CC2)cccc1[N+](=O)[O-]	ZINC000305211102	354469394	/nfs/dbraw/zinc/46/93/94/354469394.db2.gz	HALFEQVNWVPLRY-OAHLLOKOSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@H]2CN1c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000589574578	355002092	/nfs/dbraw/zinc/00/20/92/355002092.db2.gz	BNBTUNTVSHIXCL-QWRGUYRKSA-N	1	1	319.365	1.152	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H]1CCCOC1	ZINC000589184414	354969595	/nfs/dbraw/zinc/96/95/95/354969595.db2.gz	GBKJOEKVWVWFRZ-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@@H]1CCCOC1	ZINC000589184414	354969596	/nfs/dbraw/zinc/96/95/96/354969596.db2.gz	GBKJOEKVWVWFRZ-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
NC(=O)Cc1ccc(C[NH2+]Cc2csc([N+](=O)[O-])c2)cc1	ZINC000589320870	354984343	/nfs/dbraw/zinc/98/43/43/354984343.db2.gz	SQHHTOKCFBBJRB-UHFFFAOYSA-N	1	1	305.359	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H]2CCOC2)c1	ZINC000589502770	354996955	/nfs/dbraw/zinc/99/69/55/354996955.db2.gz	JLAOVMRCWFRITN-NSHDSACASA-N	1	1	308.334	1.850	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1	ZINC000590446508	355099654	/nfs/dbraw/zinc/09/96/54/355099654.db2.gz	WBWYIZYCOOEZEF-BXUZGUMPSA-N	1	1	323.780	1.953	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1	ZINC000591029800	355235782	/nfs/dbraw/zinc/23/57/82/355235782.db2.gz	JORUKIFOWLYBEK-AEGPPILISA-N	1	1	303.362	1.909	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CSc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000591953441	355445052	/nfs/dbraw/zinc/44/50/52/355445052.db2.gz	HPQMGEHTXSVOOF-LLVKDONJSA-N	1	1	320.374	1.961	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CSc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000591953441	355445055	/nfs/dbraw/zinc/44/50/55/355445055.db2.gz	HPQMGEHTXSVOOF-LLVKDONJSA-N	1	1	320.374	1.961	20	5		DDBDMO
CC(C)[C@@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CC=CC2	ZINC000592446776	355586846	/nfs/dbraw/zinc/58/68/46/355586846.db2.gz	XCNPQBAADKEHJK-CABCVRRESA-N	1	1	320.393	1.829	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2(CCC2)CO1	ZINC000593090663	355792167	/nfs/dbraw/zinc/79/21/67/355792167.db2.gz	BZBKXEMKJBPNHQ-LBPRGKRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C2(CCC2)CO1	ZINC000593090663	355792168	/nfs/dbraw/zinc/79/21/68/355792168.db2.gz	BZBKXEMKJBPNHQ-LBPRGKRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000593188884	355820809	/nfs/dbraw/zinc/82/08/09/355820809.db2.gz	RPHPUJJZCQSUDQ-OUAUKWLOSA-N	1	1	309.370	1.039	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CC[NH+]2CCCCC2)c1[N+](=O)[O-]	ZINC000593882411	356040166	/nfs/dbraw/zinc/04/01/66/356040166.db2.gz	GELJCJRSIFLGJQ-UHFFFAOYSA-N	1	1	323.397	1.999	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCCNC1=O	ZINC000595005612	356371356	/nfs/dbraw/zinc/37/13/56/356371356.db2.gz	BMXKOQXGMWFYJK-GWCFXTLKSA-N	1	1	307.350	1.923	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595458661	356499996	/nfs/dbraw/zinc/49/99/96/356499996.db2.gz	JMEZZMRMWRHBBV-ZDUSSCGKSA-N	1	1	300.330	1.952	20	5		DDBDMO
CC(C)OC[C@H](CO)[N@@H+](C)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595458661	356500000	/nfs/dbraw/zinc/50/00/00/356500000.db2.gz	JMEZZMRMWRHBBV-ZDUSSCGKSA-N	1	1	300.330	1.952	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC(C[NH2+]CC)CC2)c1[N+](=O)[O-]	ZINC000236883827	202052141	/nfs/dbraw/zinc/05/21/41/202052141.db2.gz	UFDYSXYRKVSMNI-UHFFFAOYSA-N	1	1	323.397	1.732	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H](C)[C@H]1O	ZINC000595747688	356633323	/nfs/dbraw/zinc/63/33/23/356633323.db2.gz	CCBQRMISJONFKC-HBYGRHMLSA-N	1	1	322.361	1.910	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595766300	356644355	/nfs/dbraw/zinc/64/43/55/356644355.db2.gz	OFTDNABOBQIQBA-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC(CO)(CO)C2)ccc1[N+](=O)[O-]	ZINC000595807599	356658954	/nfs/dbraw/zinc/65/89/54/356658954.db2.gz	RETCGUASBXQLDG-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC(CO)(CO)C2)ccc1[N+](=O)[O-]	ZINC000595807599	356658958	/nfs/dbraw/zinc/65/89/58/356658958.db2.gz	RETCGUASBXQLDG-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595876234	356688233	/nfs/dbraw/zinc/68/82/33/356688233.db2.gz	RCSWIXFKNAAHQK-BLLLJJGKSA-N	1	1	321.377	1.874	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CCc3[nH+]c[nH]c3C2)ccc1[N+](=O)[O-]	ZINC000596239198	356828889	/nfs/dbraw/zinc/82/88/89/356828889.db2.gz	ZFOVDTBEGOXWNG-SECBINFHSA-N	1	1	301.306	1.386	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CCc3[nH]c[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000596239198	356828891	/nfs/dbraw/zinc/82/88/91/356828891.db2.gz	ZFOVDTBEGOXWNG-SECBINFHSA-N	1	1	301.306	1.386	20	5		DDBDMO
COC(=O)c1cccc(OCCc2c[nH+]cn2C)c1[N+](=O)[O-]	ZINC000596299489	356849329	/nfs/dbraw/zinc/84/93/29/356849329.db2.gz	KXGUHFWURDRKGD-UHFFFAOYSA-N	1	1	305.290	1.736	20	5		DDBDMO
Cc1nc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000596537431	356910276	/nfs/dbraw/zinc/91/02/76/356910276.db2.gz	FXKOJHRVURLXDY-CYBMUJFWSA-N	1	1	306.366	1.334	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CSC[NH2+]1	ZINC000237257028	202207635	/nfs/dbraw/zinc/20/76/35/202207635.db2.gz	HPZPEFTYBSYUMY-NSHDSACASA-N	1	1	315.782	1.869	20	5		DDBDMO
CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1	ZINC000597944455	357393730	/nfs/dbraw/zinc/39/37/30/357393730.db2.gz	CYTDSSJHSUHBJI-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597944572	357394038	/nfs/dbraw/zinc/39/40/38/357394038.db2.gz	FPZDIILZZCGZOR-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](CC)C1	ZINC000598041437	357439858	/nfs/dbraw/zinc/43/98/58/357439858.db2.gz	LWTAZKRMNMRNSJ-AWEZNQCLSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C3CCCCC3)C2)n1	ZINC000598218893	357497122	/nfs/dbraw/zinc/49/71/22/357497122.db2.gz	IYJBJOXCZKLKIS-NSHDSACASA-N	1	1	321.381	1.465	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598221928	357498272	/nfs/dbraw/zinc/49/82/72/357498272.db2.gz	YRASKIRXHNGQOM-JTQLQIEISA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(NCC1CC[NH+](CC2CC2)CC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598540492	357626867	/nfs/dbraw/zinc/62/68/67/357626867.db2.gz	KZLAZRATPGGJRI-UHFFFAOYSA-N	1	1	307.354	1.170	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])[nH]1	ZINC000598512411	357611906	/nfs/dbraw/zinc/61/19/06/357611906.db2.gz	ZNURWOUXRHXRJB-ZDUSSCGKSA-N	1	1	314.345	1.927	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])[nH]1	ZINC000598512411	357611908	/nfs/dbraw/zinc/61/19/08/357611908.db2.gz	ZNURWOUXRHXRJB-ZDUSSCGKSA-N	1	1	314.345	1.927	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598651506	357671616	/nfs/dbraw/zinc/67/16/16/357671616.db2.gz	UPHUJDLSXVWQQV-RYUDHWBXSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598651506	357671620	/nfs/dbraw/zinc/67/16/20/357671620.db2.gz	UPHUJDLSXVWQQV-RYUDHWBXSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]C[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000599081267	357808931	/nfs/dbraw/zinc/80/89/31/357808931.db2.gz	KQSCMFBJTVJIGU-BYCMXARLSA-N	1	1	316.361	1.778	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(C)COC1	ZINC000599571975	357979509	/nfs/dbraw/zinc/97/95/09/357979509.db2.gz	ZBKQKZJOCSASLU-UHFFFAOYSA-N	1	1	323.349	1.510	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(C)COC1	ZINC000599571975	357979513	/nfs/dbraw/zinc/97/95/13/357979513.db2.gz	ZBKQKZJOCSASLU-UHFFFAOYSA-N	1	1	323.349	1.510	20	5		DDBDMO
C[C@@H]1CC(F)(F)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000599623364	357995986	/nfs/dbraw/zinc/99/59/86/357995986.db2.gz	OXUUFODZMDMABX-MWLCHTKSSA-N	1	1	304.297	1.272	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000600192455	358152055	/nfs/dbraw/zinc/15/20/55/358152055.db2.gz	OQFZEHPSRBVXHJ-HNNXBMFYSA-N	1	1	308.334	1.667	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000601120527	358410790	/nfs/dbraw/zinc/41/07/90/358410790.db2.gz	IAUVEFSGSBPSCE-LLVKDONJSA-N	1	1	310.329	1.287	20	5		DDBDMO
C[C@]1(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCC(=O)N1	ZINC000601172555	358432023	/nfs/dbraw/zinc/43/20/23/358432023.db2.gz	AOXWWVBTWFHTGL-OAHLLOKOSA-N	1	1	300.318	1.646	20	5		DDBDMO
O=[N+]([O-])c1cn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)cn1	ZINC000601953303	358751688	/nfs/dbraw/zinc/75/16/88/358751688.db2.gz	DXNQTOIYSIPRIM-OAHLLOKOSA-N	1	1	302.334	1.428	20	5		DDBDMO
CCCCNC(=O)[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602453997	358987729	/nfs/dbraw/zinc/98/77/29/358987729.db2.gz	LTYGUHTXYCDPPR-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O	ZINC000602843193	359231406	/nfs/dbraw/zinc/23/14/06/359231406.db2.gz	WERNWIYYNUDZDW-BFHYXJOUSA-N	1	1	308.382	1.725	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](C[C@@H]1CCc3ncnn31)CC2	ZINC000602802391	359202204	/nfs/dbraw/zinc/20/22/04/359202204.db2.gz	QRAFTHPQYFBUMD-NSHDSACASA-N	1	1	300.322	1.127	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000618455656	363637332	/nfs/dbraw/zinc/63/73/32/363637332.db2.gz	COYVSBXIRZPIJP-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[C@](CO)([NH2+]C[C@@H](O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000602963659	359326131	/nfs/dbraw/zinc/32/61/31/359326131.db2.gz	YDAQMWLWCHBAMW-GHMZBOCLSA-N	1	1	308.256	1.315	20	5		DDBDMO
CC[C@]1(O)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000602982688	359337758	/nfs/dbraw/zinc/33/77/58/359337758.db2.gz	WUAJRYJQQFKXQC-ZBFHGGJFSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141799	359431523	/nfs/dbraw/zinc/43/15/23/359431523.db2.gz	IOQUVGXUTCUYRF-JTQLQIEISA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141799	359431528	/nfs/dbraw/zinc/43/15/28/359431528.db2.gz	IOQUVGXUTCUYRF-JTQLQIEISA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141799	359431534	/nfs/dbraw/zinc/43/15/34/359431534.db2.gz	IOQUVGXUTCUYRF-JTQLQIEISA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000603141799	359431538	/nfs/dbraw/zinc/43/15/38/359431538.db2.gz	IOQUVGXUTCUYRF-JTQLQIEISA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1nn(CC[NH+]2C[C@H](C)O[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000603322099	359568407	/nfs/dbraw/zinc/56/84/07/359568407.db2.gz	SVGDLFHDHVMAKA-QWRGUYRKSA-N	1	1	319.365	1.757	20	5		DDBDMO
Cc1nn(CCCN2CC[NH+](C)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000603328629	359571319	/nfs/dbraw/zinc/57/13/19/359571319.db2.gz	SMABXEXRBZHSAI-UHFFFAOYSA-N	1	1	318.381	1.285	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)c1ccco1	ZINC000186755312	200004337	/nfs/dbraw/zinc/00/43/37/200004337.db2.gz	OHQWHQPLBHTXDX-LLVKDONJSA-N	1	1	320.305	1.321	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@@H](C)O)C[C@H]1C	ZINC000186959729	200039009	/nfs/dbraw/zinc/03/90/09/200039009.db2.gz	UJNKHPMKFFUXTK-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@@H](C)O)C[C@H]1C	ZINC000186959729	200039011	/nfs/dbraw/zinc/03/90/11/200039011.db2.gz	UJNKHPMKFFUXTK-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CC(C)(C)O	ZINC000188682628	200286641	/nfs/dbraw/zinc/28/66/41/200286641.db2.gz	XESPLXDOICZCAF-GFCCVEGCSA-N	1	1	321.377	1.512	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCOCC(F)F)CC2)c1	ZINC000188737756	200297338	/nfs/dbraw/zinc/29/73/38/200297338.db2.gz	CWKZVQFLMIASAK-UHFFFAOYSA-N	1	1	315.320	1.999	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000609269895	360285719	/nfs/dbraw/zinc/28/57/19/360285719.db2.gz	ZDPHISSCBIJCJB-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccncc3[N+](=O)[O-])CC2)C1	ZINC000609675107	360344048	/nfs/dbraw/zinc/34/40/48/360344048.db2.gz	VWRQGXQVULHGDU-CYBMUJFWSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])s3)CC2)C1	ZINC000609675066	360344096	/nfs/dbraw/zinc/34/40/96/360344096.db2.gz	RFMBUGPEENNJKI-LBPRGKRZSA-N	1	1	310.423	1.873	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000611525911	360748194	/nfs/dbraw/zinc/74/81/94/360748194.db2.gz	OEYUTOBLFRHSGM-ZDUSSCGKSA-N	1	1	308.382	1.956	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[NH+](C(C)(C)CO)CC2)n1	ZINC000611616479	360777137	/nfs/dbraw/zinc/77/71/37/360777137.db2.gz	SJFYYYNKTIZMTR-UHFFFAOYSA-N	1	1	308.382	1.500	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H](O)C1CC1	ZINC000612086862	360915040	/nfs/dbraw/zinc/91/50/40/360915040.db2.gz	YZYIHLRJYCOCLA-OCCSQVGLSA-N	1	1	310.350	1.037	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000193583750	201079589	/nfs/dbraw/zinc/07/95/89/201079589.db2.gz	GXTYECADMCULBZ-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000194033320	201167370	/nfs/dbraw/zinc/16/73/70/201167370.db2.gz	MWAARNMVPSRLOB-CQSZACIVSA-N	1	1	323.305	1.888	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000194033320	201167371	/nfs/dbraw/zinc/16/73/71/201167371.db2.gz	MWAARNMVPSRLOB-CQSZACIVSA-N	1	1	323.305	1.888	20	5		DDBDMO
C[N@@H+](CCO)CCNc1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC001120459635	781959265	/nfs/dbraw/zinc/95/92/65/781959265.db2.gz	DOZBUUQYHCFQKP-UHFFFAOYSA-N	1	1	307.272	1.950	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@H](C)[NH+]1CCOCC1	ZINC000264187220	203752367	/nfs/dbraw/zinc/75/23/67/203752367.db2.gz	BVPFWGWOYKKRHJ-ZJUUUORDSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1	ZINC000264611082	204027818	/nfs/dbraw/zinc/02/78/18/204027818.db2.gz	IAAVRFQHFXUONI-NSHDSACASA-N	1	1	309.391	1.755	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC[N@@H+](C)C1CC1	ZINC000264918512	204269757	/nfs/dbraw/zinc/26/97/57/204269757.db2.gz	YQLXFDGVQDPHIH-UHFFFAOYSA-N	1	1	322.365	1.497	20	5		DDBDMO
CCCNC(=O)NC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282544214	217076705	/nfs/dbraw/zinc/07/67/05/217076705.db2.gz	WJJKLZSCUJDRAL-UHFFFAOYSA-N	1	1	322.365	1.305	20	5		DDBDMO
CCCNC(=O)NC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282544214	217076708	/nfs/dbraw/zinc/07/67/08/217076708.db2.gz	WJJKLZSCUJDRAL-UHFFFAOYSA-N	1	1	322.365	1.305	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288342110	220096179	/nfs/dbraw/zinc/09/61/79/220096179.db2.gz	ISEDWBLMSBAAOG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288342110	220096184	/nfs/dbraw/zinc/09/61/84/220096184.db2.gz	ISEDWBLMSBAAOG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[NH+](C)C[C@@H]1CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000267443855	206071866	/nfs/dbraw/zinc/07/18/66/206071866.db2.gz	CPYFYMAOFCYYFJ-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
COc1ccc(OCC[N@H+](C)CC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000173499252	248339460	/nfs/dbraw/zinc/33/94/60/248339460.db2.gz	OAFQBZZDUZIXBI-UHFFFAOYSA-N	1	1	311.338	1.002	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000173499252	248339465	/nfs/dbraw/zinc/33/94/65/248339465.db2.gz	OAFQBZZDUZIXBI-UHFFFAOYSA-N	1	1	311.338	1.002	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000336870662	249276631	/nfs/dbraw/zinc/27/66/31/249276631.db2.gz	BMHAFAMLGBOKQN-NEPJUHHUSA-N	1	1	318.377	1.945	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000284864682	218213204	/nfs/dbraw/zinc/21/32/04/218213204.db2.gz	SHEDHWYPUGOGLT-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCO[C@@H]2CC[N@@H+](C)C[C@@H]21	ZINC000284923283	218236030	/nfs/dbraw/zinc/23/60/30/218236030.db2.gz	UDBBXQCDVTWMIZ-GOEBONIOSA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000105820980	194135650	/nfs/dbraw/zinc/13/56/50/194135650.db2.gz	PYQOCSXXNYEPFO-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC(C)(C)[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(N)=O	ZINC000106445330	194214636	/nfs/dbraw/zinc/21/46/36/194214636.db2.gz	GWLIHQZNSKYFRZ-LBPRGKRZSA-N	1	1	308.338	1.023	20	5		DDBDMO
O=C1OCC[C@@H]1CC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298218013	284949813	/nfs/dbraw/zinc/94/98/13/284949813.db2.gz	ZWJZKOABTIJDJQ-LBPRGKRZSA-N	1	1	320.349	1.065	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000414216448	532997233	/nfs/dbraw/zinc/99/72/33/532997233.db2.gz	VOCBWXZCJMFMMA-LBPRGKRZSA-N	1	1	321.377	1.849	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](CCO)CC1	ZINC000120023235	195082651	/nfs/dbraw/zinc/08/26/51/195082651.db2.gz	KDDBSODBUJUNQN-UHFFFAOYSA-N	1	1	308.338	1.045	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1	ZINC000285390756	285190023	/nfs/dbraw/zinc/19/00/23/285190023.db2.gz	NXXJLDZYXQMSML-JSGCOSHPSA-N	1	1	320.353	1.103	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1	ZINC000285390756	285190026	/nfs/dbraw/zinc/19/00/26/285190026.db2.gz	NXXJLDZYXQMSML-JSGCOSHPSA-N	1	1	320.353	1.103	20	5		DDBDMO
C[C@H](O)C[N@H+](CCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000289803001	221236540	/nfs/dbraw/zinc/23/65/40/221236540.db2.gz	NBOSDIXLCXIIMJ-NSHDSACASA-N	1	1	321.333	1.425	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000289803001	221236543	/nfs/dbraw/zinc/23/65/43/221236543.db2.gz	NBOSDIXLCXIIMJ-NSHDSACASA-N	1	1	321.333	1.425	20	5		DDBDMO
CCOCCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000121900674	195371005	/nfs/dbraw/zinc/37/10/05/195371005.db2.gz	VIGVYCGIDYAKAZ-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950688	533663031	/nfs/dbraw/zinc/66/30/31/533663031.db2.gz	HZBXNAMLXDEURZ-MWLCHTKSSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950688	533663042	/nfs/dbraw/zinc/66/30/42/533663042.db2.gz	HZBXNAMLXDEURZ-MWLCHTKSSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950688	533663052	/nfs/dbraw/zinc/66/30/52/533663052.db2.gz	HZBXNAMLXDEURZ-MWLCHTKSSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950688	533663059	/nfs/dbraw/zinc/66/30/59/533663059.db2.gz	HZBXNAMLXDEURZ-MWLCHTKSSA-N	1	1	307.354	1.325	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cnccn3)C2)nc1	ZINC000568723181	304307470	/nfs/dbraw/zinc/30/74/70/304307470.db2.gz	NXMVFZKXWUXZBY-NSHDSACASA-N	1	1	300.322	1.466	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cnccn3)C2)nc1	ZINC000568723181	304307471	/nfs/dbraw/zinc/30/74/71/304307471.db2.gz	NXMVFZKXWUXZBY-NSHDSACASA-N	1	1	300.322	1.466	20	5		DDBDMO
COc1ccc(C[NH2+][C@H](C)c2ccc(=O)[nH]n2)cc1[N+](=O)[O-]	ZINC000353383567	285698776	/nfs/dbraw/zinc/69/87/76/285698776.db2.gz	GBHCRJZVWKOWGW-SECBINFHSA-N	1	1	304.306	1.950	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](C)C[NH+]1CCOCC1	ZINC000361002693	299790040	/nfs/dbraw/zinc/79/00/40/299790040.db2.gz	PABRKPVGZBXNCH-LLVKDONJSA-N	1	1	311.386	1.500	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000073818212	406895130	/nfs/dbraw/zinc/89/51/30/406895130.db2.gz	XMPPYHLRTSTSBT-HNNXBMFYSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCCC[C@@H]2CCO)c1	ZINC000071794360	406841953	/nfs/dbraw/zinc/84/19/53/406841953.db2.gz	CXIGFPVFGCSJGP-UKRRQHHQSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@@H]1c2cccn2CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075612006	406936671	/nfs/dbraw/zinc/93/66/71/406936671.db2.gz	QQTRBHWTYFGOKQ-YPMHNXCESA-N	1	1	305.338	1.031	20	5		DDBDMO
C[C@@H]1c2cccn2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075612006	406936674	/nfs/dbraw/zinc/93/66/74/406936674.db2.gz	QQTRBHWTYFGOKQ-YPMHNXCESA-N	1	1	305.338	1.031	20	5		DDBDMO
O=C1NCCN1C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000052217495	407149005	/nfs/dbraw/zinc/14/90/05/407149005.db2.gz	PYTINVTYODCRBW-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000055407111	407202927	/nfs/dbraw/zinc/20/29/27/407202927.db2.gz	ZRXVHYRLFMPWOJ-NWDGAFQWSA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH+](CC2CC2)CC1	ZINC000055669315	407205684	/nfs/dbraw/zinc/20/56/84/407205684.db2.gz	SSQFFIGXGTYVBS-UHFFFAOYSA-N	1	1	304.350	1.466	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[NH+](C)CC1	ZINC000102677329	407325771	/nfs/dbraw/zinc/32/57/71/407325771.db2.gz	YVWFRDTVOUYCNB-LLVKDONJSA-N	1	1	317.349	1.953	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000097667749	407301219	/nfs/dbraw/zinc/30/12/19/407301219.db2.gz	GDHHXCFIRXVDHA-GHMZBOCLSA-N	1	1	322.365	1.133	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@@H]2CCC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000108330941	407383887	/nfs/dbraw/zinc/38/38/87/407383887.db2.gz	UECLASYXDNFCFX-ZDUSSCGKSA-N	1	1	323.397	1.256	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000111267856	407403732	/nfs/dbraw/zinc/40/37/32/407403732.db2.gz	JSHPOGOMCWTHSP-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111316492	407407496	/nfs/dbraw/zinc/40/74/96/407407496.db2.gz	PSHSSEUPGDEBAK-FKJOKYEKSA-N	1	1	319.361	1.910	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111316492	407407497	/nfs/dbraw/zinc/40/74/97/407407497.db2.gz	PSHSSEUPGDEBAK-FKJOKYEKSA-N	1	1	319.361	1.910	20	5		DDBDMO
CN(C(=O)CN1CC[N@@H+](C)CC1(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000270986870	407454579	/nfs/dbraw/zinc/45/45/79/407454579.db2.gz	DDOOYNNPPMMMDV-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000185820205	407511883	/nfs/dbraw/zinc/51/18/83/407511883.db2.gz	QTDXWVQKRDJVPU-SCZZXKLOSA-N	1	1	306.322	1.050	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000178972782	407679610	/nfs/dbraw/zinc/67/96/10/407679610.db2.gz	GOOCAEGFULDVGC-SECBINFHSA-N	1	1	303.322	1.153	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C(=O)OC)C1	ZINC000266999185	407712054	/nfs/dbraw/zinc/71/20/54/407712054.db2.gz	CCLIRJCGHNPITN-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)OC)C1	ZINC000266999185	407712058	/nfs/dbraw/zinc/71/20/58/407712058.db2.gz	CCLIRJCGHNPITN-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000171626214	407723640	/nfs/dbraw/zinc/72/36/40/407723640.db2.gz	BEDVKTIRAKAEAY-CABCVRRESA-N	1	1	321.377	1.115	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000134770735	407935054	/nfs/dbraw/zinc/93/50/54/407935054.db2.gz	LWXZNWQRFZGFGT-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000180995979	407943807	/nfs/dbraw/zinc/94/38/07/407943807.db2.gz	JVDMBFOHIQUONM-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[NH2+]1	ZINC000262955601	407983973	/nfs/dbraw/zinc/98/39/73/407983973.db2.gz	VXTYATDEVFZRAL-IUCAKERBSA-N	1	1	303.322	1.341	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000154218760	407995907	/nfs/dbraw/zinc/99/59/07/407995907.db2.gz	UOCAXOXNHFMONH-OCCSQVGLSA-N	1	1	307.350	1.086	20	5		DDBDMO
CCCCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(N)=O	ZINC000272599323	408000991	/nfs/dbraw/zinc/00/09/91/408000991.db2.gz	QQZMLDXMNOLMMM-UHFFFAOYSA-N	1	1	309.366	1.951	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000272732974	408011730	/nfs/dbraw/zinc/01/17/30/408011730.db2.gz	BYTNESJMNKSLBU-SNVBAGLBSA-N	1	1	321.381	1.822	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000136096431	408077309	/nfs/dbraw/zinc/07/73/09/408077309.db2.gz	FZTWZLTUVBSEPD-LLVKDONJSA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136096431	408077314	/nfs/dbraw/zinc/07/73/14/408077314.db2.gz	FZTWZLTUVBSEPD-LLVKDONJSA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136096431	408077320	/nfs/dbraw/zinc/07/73/20/408077320.db2.gz	FZTWZLTUVBSEPD-LLVKDONJSA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@@H]1C[C@@H](C)C[NH+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136205214	408088247	/nfs/dbraw/zinc/08/82/47/408088247.db2.gz	FSWAIRMBJUMVTD-VXGBXAGGSA-N	1	1	323.397	1.806	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCSCC1	ZINC000273170911	408091017	/nfs/dbraw/zinc/09/10/17/408091017.db2.gz	OTZNHASXHUBTOZ-GFCCVEGCSA-N	1	1	312.391	1.773	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)CC(=O)N1CCOCC1	ZINC000182632363	408212822	/nfs/dbraw/zinc/21/28/22/408212822.db2.gz	PAJNGSHKPKUKQY-ZDUSSCGKSA-N	1	1	321.377	1.755	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+](C)CC(=O)N1CCOCC1	ZINC000182632363	408212824	/nfs/dbraw/zinc/21/28/24/408212824.db2.gz	PAJNGSHKPKUKQY-ZDUSSCGKSA-N	1	1	321.377	1.755	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)n1	ZINC000246518867	408279610	/nfs/dbraw/zinc/27/96/10/408279610.db2.gz	IPUKQCNMPHFQGS-DZGCQCFKSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)n1	ZINC000246518867	408279643	/nfs/dbraw/zinc/27/96/43/408279643.db2.gz	IPUKQCNMPHFQGS-DZGCQCFKSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)n1	ZINC000246518867	408279649	/nfs/dbraw/zinc/27/96/49/408279649.db2.gz	IPUKQCNMPHFQGS-DZGCQCFKSA-N	1	1	319.409	1.740	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000246524906	408284464	/nfs/dbraw/zinc/28/44/64/408284464.db2.gz	WAWRXJKWWOFGMD-MNOVXSKESA-N	1	1	323.397	1.731	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccc(F)cc3)CC2)n1	ZINC000176189737	408303618	/nfs/dbraw/zinc/30/36/18/408303618.db2.gz	WUUYBABHVWLVEO-UHFFFAOYSA-N	1	1	319.340	1.753	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@H]1COc2ccccc2O1	ZINC000176193556	408303970	/nfs/dbraw/zinc/30/39/70/408303970.db2.gz	ZDGOETREDMCHHZ-LBPRGKRZSA-N	1	1	318.333	1.563	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000246634260	408307698	/nfs/dbraw/zinc/30/76/98/408307698.db2.gz	FAUWCGNHJAQGEY-UWVGGRQHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000246634260	408307701	/nfs/dbraw/zinc/30/77/01/408307701.db2.gz	FAUWCGNHJAQGEY-UWVGGRQHSA-N	1	1	313.379	1.183	20	5		DDBDMO
COC(=O)c1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176205764	408308644	/nfs/dbraw/zinc/30/86/44/408308644.db2.gz	CRYRGVCEAUWTTD-UHFFFAOYSA-N	1	1	318.333	1.710	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2C[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000190871333	408335073	/nfs/dbraw/zinc/33/50/73/408335073.db2.gz	OVIGEHNKKJIUOL-MNOVXSKESA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2C[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000190871333	408335075	/nfs/dbraw/zinc/33/50/75/408335075.db2.gz	OVIGEHNKKJIUOL-MNOVXSKESA-N	1	1	323.349	1.102	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000246825621	408347106	/nfs/dbraw/zinc/34/71/06/408347106.db2.gz	SWXZEWPEEFRXMD-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000246825621	408347113	/nfs/dbraw/zinc/34/71/13/408347113.db2.gz	SWXZEWPEEFRXMD-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000183198481	408349706	/nfs/dbraw/zinc/34/97/06/408349706.db2.gz	KUASMYUWIGSIRS-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000183198481	408349711	/nfs/dbraw/zinc/34/97/11/408349711.db2.gz	KUASMYUWIGSIRS-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc(C[N@H+](C[C@@H](C)O)[C@@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000190936089	408343211	/nfs/dbraw/zinc/34/32/11/408343211.db2.gz	HUHFHAIQEAUHPR-VHSXEESVSA-N	1	1	316.329	1.306	20	5		DDBDMO
COc1cc(C[N@@H+](C[C@@H](C)O)[C@@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000190936089	408343215	/nfs/dbraw/zinc/34/32/15/408343215.db2.gz	HUHFHAIQEAUHPR-VHSXEESVSA-N	1	1	316.329	1.306	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000246820917	408346835	/nfs/dbraw/zinc/34/68/35/408346835.db2.gz	SNABEVJSJGQKDA-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@H](C)O)[C@@H](C)C1	ZINC000246820917	408346842	/nfs/dbraw/zinc/34/68/42/408346842.db2.gz	SNABEVJSJGQKDA-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1C	ZINC000274660458	408486019	/nfs/dbraw/zinc/48/60/19/408486019.db2.gz	YSMGRNGSUQXUFB-QWRGUYRKSA-N	1	1	306.366	1.732	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000247534426	408488837	/nfs/dbraw/zinc/48/88/37/408488837.db2.gz	XNRBTZVELILIHX-CMPLNLGQSA-N	1	1	306.366	1.853	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177081925	408515071	/nfs/dbraw/zinc/51/50/71/408515071.db2.gz	XZISOKHRSOTQCL-WCBMZHEXSA-N	1	1	322.340	1.671	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000177420531	408610028	/nfs/dbraw/zinc/61/00/28/408610028.db2.gz	XGIRREKCSLNIMM-OAHLLOKOSA-N	1	1	308.334	1.859	20	5		DDBDMO
CCC[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000270868123	408717455	/nfs/dbraw/zinc/71/74/55/408717455.db2.gz	BBFQEKKFVOBCHC-CQSZACIVSA-N	1	1	308.382	1.927	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)C(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000270913438	408739859	/nfs/dbraw/zinc/73/98/59/408739859.db2.gz	HRZFPSPFSRRXKL-GFCCVEGCSA-N	1	1	319.361	1.452	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000251933778	408791167	/nfs/dbraw/zinc/79/11/67/408791167.db2.gz	UBUONCFZSBKOJG-IVMMDQJWSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014905	408907125	/nfs/dbraw/zinc/90/71/25/408907125.db2.gz	PPOATBOMPSLUMF-DGCLKSJQSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014905	408907128	/nfs/dbraw/zinc/90/71/28/408907128.db2.gz	PPOATBOMPSLUMF-DGCLKSJQSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[N@@H+](C[C@H](O)CNC(C)(C)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000292080318	408976047	/nfs/dbraw/zinc/97/60/47/408976047.db2.gz	FOFQSUXVXIFLNR-CYBMUJFWSA-N	1	1	307.394	1.875	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000277662802	408987339	/nfs/dbraw/zinc/98/73/39/408987339.db2.gz	WOVVSQKJBABOKY-YPMHNXCESA-N	1	1	319.361	1.912	20	5		DDBDMO
CC(=O)c1cc(N2CC[NH+](C[C@@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000286668415	408993897	/nfs/dbraw/zinc/99/38/97/408993897.db2.gz	MNNBMXQXTQIIEN-LLVKDONJSA-N	1	1	307.350	1.300	20	5		DDBDMO
Cc1cc(N2CC[C@H]3OCC[N@H+](C)[C@@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000292336547	409026705	/nfs/dbraw/zinc/02/67/05/409026705.db2.gz	BCPJIDISWIIAHN-HUUCEWRRSA-N	1	1	309.341	1.952	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])n[nH]1)Cc1ccc(F)cc1	ZINC000287695534	409077492	/nfs/dbraw/zinc/07/74/92/409077492.db2.gz	WXSLUDGFHPDOKY-UHFFFAOYSA-N	1	1	321.312	1.319	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](O)CC3)n2)c1	ZINC000293282626	409082094	/nfs/dbraw/zinc/08/20/94/409082094.db2.gz	VMMUHFASLSIMCY-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](O)CC3)n2)c1	ZINC000293282626	409082097	/nfs/dbraw/zinc/08/20/97/409082097.db2.gz	VMMUHFASLSIMCY-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000279281722	409184470	/nfs/dbraw/zinc/18/44/70/409184470.db2.gz	WWTQROIHFVCQPC-OLZOCXBDSA-N	1	1	322.340	1.673	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@]3(CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000289190797	409230546	/nfs/dbraw/zinc/23/05/46/409230546.db2.gz	IXMHNZSEULSLSI-HNNXBMFYSA-N	1	1	321.381	1.486	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000284195878	409294212	/nfs/dbraw/zinc/29/42/12/409294212.db2.gz	ZFXGDLQTEGTKKE-NXEZZACHSA-N	1	1	324.356	1.871	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337173	409294297	/nfs/dbraw/zinc/29/42/97/409294297.db2.gz	HNWBZZUDHJAJQV-APHBMKBZSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCO2	ZINC000280337173	409294300	/nfs/dbraw/zinc/29/43/00/409294300.db2.gz	HNWBZZUDHJAJQV-APHBMKBZSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@H](CO)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)CC1CCC1	ZINC000280557876	409358849	/nfs/dbraw/zinc/35/88/49/409358849.db2.gz	QYZDVEKCXQKLPP-GFCCVEGCSA-N	1	1	309.366	1.239	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(N)c3F)C[C@H]21	ZINC000285018806	409393514	/nfs/dbraw/zinc/39/35/14/409393514.db2.gz	MRVRPDUFEFIHCA-VXGBXAGGSA-N	1	1	310.329	1.225	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1COC1	ZINC000295278123	409411482	/nfs/dbraw/zinc/41/14/82/409411482.db2.gz	CSBJHDOGACSFBF-CYBMUJFWSA-N	1	1	310.350	1.444	20	5		DDBDMO
COCCOC[C@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000295299180	409419638	/nfs/dbraw/zinc/41/96/38/409419638.db2.gz	JXPQGKOYLOSRIS-OAHLLOKOSA-N	1	1	312.366	1.093	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000324009202	164049674	/nfs/dbraw/zinc/04/96/74/164049674.db2.gz	NQLAIUFRNHSLCE-MRXNPFEDSA-N	1	1	318.377	1.804	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)ccc1[N+](=O)[O-]	ZINC000295412601	409474166	/nfs/dbraw/zinc/47/41/66/409474166.db2.gz	JLTZOKTUDOVGCT-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290704114	409492163	/nfs/dbraw/zinc/49/21/63/409492163.db2.gz	WJXJMSMPFAAKNB-SNVBAGLBSA-N	1	1	307.354	1.375	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CCC[C@@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000303979083	409554727	/nfs/dbraw/zinc/55/47/27/409554727.db2.gz	DMYDJBKDOQKKMM-ZIAGYGMSSA-N	1	1	305.334	1.157	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC[C@@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000303979083	409554736	/nfs/dbraw/zinc/55/47/36/409554736.db2.gz	DMYDJBKDOQKKMM-ZIAGYGMSSA-N	1	1	305.334	1.157	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000356773804	409588972	/nfs/dbraw/zinc/58/89/72/409588972.db2.gz	MLOZPHIKAUHSPH-LBPRGKRZSA-N	1	1	309.366	1.819	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858121	409670691	/nfs/dbraw/zinc/67/06/91/409670691.db2.gz	UALMXNIVYYVRTN-KBPBESRZSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000296858121	409670700	/nfs/dbraw/zinc/67/07/00/409670700.db2.gz	UALMXNIVYYVRTN-KBPBESRZSA-N	1	1	323.349	1.401	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC000356913438	409716922	/nfs/dbraw/zinc/71/69/22/409716922.db2.gz	YFCBZMPDAHMGLU-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C	ZINC000356913438	409716924	/nfs/dbraw/zinc/71/69/24/409716924.db2.gz	YFCBZMPDAHMGLU-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412984	409828717	/nfs/dbraw/zinc/82/87/17/409828717.db2.gz	ZMTAPUSKLHXABR-GXFFZTMASA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](C)[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412984	409828728	/nfs/dbraw/zinc/82/87/28/409828728.db2.gz	ZMTAPUSKLHXABR-GXFFZTMASA-N	1	1	310.350	1.815	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3cccc(C(N)=O)c3[N+](=O)[O-])CC[C@H]21	ZINC000342706708	409831982	/nfs/dbraw/zinc/83/19/82/409831982.db2.gz	ROVWMGGYPISMEF-DGCLKSJQSA-N	1	1	318.377	1.614	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000332148142	409926158	/nfs/dbraw/zinc/92/61/58/409926158.db2.gz	LBSPURVUKPNDPQ-UHFFFAOYSA-N	1	1	300.318	1.685	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H]1C	ZINC000346657681	410062125	/nfs/dbraw/zinc/06/21/25/410062125.db2.gz	LHCKZTKLSZRNRQ-RISCZKNCSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[C@@H]([NH3+])[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000351753343	410211551	/nfs/dbraw/zinc/21/15/51/410211551.db2.gz	FDSJLQOFXHIFOL-RKDXNWHRSA-N	1	1	303.322	1.280	20	5		DDBDMO
CC[N@@H+]1CC[C@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000339393613	410154131	/nfs/dbraw/zinc/15/41/31/410154131.db2.gz	KQKNBXFHDKXJQD-JKSUJKDBSA-N	1	1	321.377	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000339393613	410154136	/nfs/dbraw/zinc/15/41/36/410154136.db2.gz	KQKNBXFHDKXJQD-JKSUJKDBSA-N	1	1	321.377	1.595	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[N@@H+](C)CC1	ZINC000298638736	410324994	/nfs/dbraw/zinc/32/49/94/410324994.db2.gz	OWLFWOPRWHEZMV-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000298729439	410370248	/nfs/dbraw/zinc/37/02/48/410370248.db2.gz	SEKVNJQCBGUXCF-RYUDHWBXSA-N	1	1	305.338	1.127	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000298732263	410371724	/nfs/dbraw/zinc/37/17/24/410371724.db2.gz	JRWRWOWOXPAROU-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
CC(C)c1ccc(C[N@@H+]2CC[C@@H](NC(N)=O)C2)cc1[N+](=O)[O-]	ZINC000355195842	410373036	/nfs/dbraw/zinc/37/30/36/410373036.db2.gz	XSJMRQWYHIJFDK-GFCCVEGCSA-N	1	1	306.366	1.961	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CC[C@@H](NC(N)=O)C2)cc1[N+](=O)[O-]	ZINC000355195842	410373045	/nfs/dbraw/zinc/37/30/45/410373045.db2.gz	XSJMRQWYHIJFDK-GFCCVEGCSA-N	1	1	306.366	1.961	20	5		DDBDMO
C[C@@H]1[C@@H](N2CCOCC2)CC[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000351997801	410402665	/nfs/dbraw/zinc/40/26/65/410402665.db2.gz	SNYMPGWFJWOWKC-YPMHNXCESA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1[C@@H](N2CCOCC2)CC[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000351997801	410402668	/nfs/dbraw/zinc/40/26/68/410402668.db2.gz	SNYMPGWFJWOWKC-YPMHNXCESA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1[C@@H]([NH+]2CCOCC2)CCN1Cc1csc([N+](=O)[O-])c1	ZINC000351997801	410402672	/nfs/dbraw/zinc/40/26/72/410402672.db2.gz	SNYMPGWFJWOWKC-YPMHNXCESA-N	1	1	311.407	1.951	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCO)CC1	ZINC000339826903	410486158	/nfs/dbraw/zinc/48/61/58/410486158.db2.gz	COCWAUMEQQEKGN-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
O=C([C@@H]1CC[NH2+]CC1(F)F)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000343417086	410436336	/nfs/dbraw/zinc/43/63/36/410436336.db2.gz	NGEUYFNLBXNWKV-NSHDSACASA-N	1	1	311.288	1.729	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337299225	410698591	/nfs/dbraw/zinc/69/85/91/410698591.db2.gz	MGDUOFBPHNPWIR-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000337299225	410698596	/nfs/dbraw/zinc/69/85/96/410698596.db2.gz	MGDUOFBPHNPWIR-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000337299225	410698601	/nfs/dbraw/zinc/69/86/01/410698601.db2.gz	MGDUOFBPHNPWIR-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CC[C@]2(CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)C1	ZINC000359555597	410727141	/nfs/dbraw/zinc/72/71/41/410727141.db2.gz	KRSMRNGVPDYUGD-SNPRPXQTSA-N	1	1	308.382	1.664	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc(C)cc([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000330535695	410757183	/nfs/dbraw/zinc/75/71/83/410757183.db2.gz	RZUQJUJHFXQGBS-GJZGRUSLSA-N	1	1	321.377	1.694	20	5		DDBDMO
CCC[N@H+](CCn1ccc([N+](=O)[O-])n1)CCN1CCCCC1	ZINC000353146758	410812413	/nfs/dbraw/zinc/81/24/13/410812413.db2.gz	NAGLCKUJRSGJNO-UHFFFAOYSA-N	1	1	309.414	1.989	20	5		DDBDMO
CCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)CCN1CCCCC1	ZINC000353146758	410812420	/nfs/dbraw/zinc/81/24/20/410812420.db2.gz	NAGLCKUJRSGJNO-UHFFFAOYSA-N	1	1	309.414	1.989	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@@H+]1CCOC	ZINC000330851342	410900947	/nfs/dbraw/zinc/90/09/47/410900947.db2.gz	QCILZEPHOVAINV-NSHDSACASA-N	1	1	310.354	1.106	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1CCOC	ZINC000330851342	410900953	/nfs/dbraw/zinc/90/09/53/410900953.db2.gz	QCILZEPHOVAINV-NSHDSACASA-N	1	1	310.354	1.106	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC1(O)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000353514418	411044174	/nfs/dbraw/zinc/04/41/74/411044174.db2.gz	GRWHIUNBHZVQDY-CQSZACIVSA-N	1	1	316.361	1.922	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000331430505	411086414	/nfs/dbraw/zinc/08/64/14/411086414.db2.gz	CDGQKCSYECETFG-MFKMUULPSA-N	1	1	319.361	1.816	20	5		DDBDMO
COC(=O)CC1([NH2+]Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1	ZINC000580317103	422917664	/nfs/dbraw/zinc/91/76/64/422917664.db2.gz	MVBLSWRAWQTBNX-UHFFFAOYSA-N	1	1	312.297	1.928	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000131868685	196205821	/nfs/dbraw/zinc/20/58/21/196205821.db2.gz	VOWKDJLSRJCXSH-UHFFFAOYSA-N	1	1	324.356	1.101	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C)[C@@H]1CO	ZINC000133026473	196305969	/nfs/dbraw/zinc/30/59/69/196305969.db2.gz	DFIMTDQAFADQER-FZMZJTMJSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CO	ZINC000133026473	196305970	/nfs/dbraw/zinc/30/59/70/196305970.db2.gz	DFIMTDQAFADQER-FZMZJTMJSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+](CCNc1ncc([N+](=O)[O-])c(N)n1)CCC(F)(F)F	ZINC000491869013	416633742	/nfs/dbraw/zinc/63/37/42/416633742.db2.gz	LHRKIQIYWPFPOY-UHFFFAOYSA-N	1	1	322.291	1.075	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1CCOc1cccc([N+](=O)[O-])c1	ZINC000419331825	226120228	/nfs/dbraw/zinc/12/02/28/226120228.db2.gz	RXEGQPRARFJCJK-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCOC2)O1	ZINC000373805508	418461090	/nfs/dbraw/zinc/46/10/90/418461090.db2.gz	ODQZJDFEPCJMAA-KBPBESRZSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCOC2)O1	ZINC000373805508	418461092	/nfs/dbraw/zinc/46/10/92/418461092.db2.gz	ODQZJDFEPCJMAA-KBPBESRZSA-N	1	1	310.354	1.061	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C[C@H]1C	ZINC000374019389	418484285	/nfs/dbraw/zinc/48/42/85/418484285.db2.gz	SKOIFDPTAFQHBD-ZWNOBZJWSA-N	1	1	308.334	1.844	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)Cc2ccccc21	ZINC000360797326	418519971	/nfs/dbraw/zinc/51/99/71/418519971.db2.gz	BJJMNDPIWTUAAG-UHFFFAOYSA-N	1	1	315.333	1.421	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)Cc2ccccc21	ZINC000360797326	418519973	/nfs/dbraw/zinc/51/99/73/418519973.db2.gz	BJJMNDPIWTUAAG-UHFFFAOYSA-N	1	1	315.333	1.421	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(c2c([N+](=O)[O-])c(C)nn2CC)CC1	ZINC000192604612	418525717	/nfs/dbraw/zinc/52/57/17/418525717.db2.gz	JMSIIPJKZAJAIE-GFCCVEGCSA-N	1	1	311.386	1.013	20	5		DDBDMO
CCc1nn(C)c(NCCC[NH+]2CCN(CC)CC2)c1[N+](=O)[O-]	ZINC000360961408	418556724	/nfs/dbraw/zinc/55/67/24/418556724.db2.gz	QJWRINQGHHXUNP-UHFFFAOYSA-N	1	1	324.429	1.330	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC[NH+](C)C)C2CCCC2)c1[N+](=O)[O-]	ZINC000192565391	222129486	/nfs/dbraw/zinc/12/94/86/222129486.db2.gz	XYIRQHFMDWIRNC-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]21	ZINC000375052760	418596277	/nfs/dbraw/zinc/59/62/77/418596277.db2.gz	ZLZVUUFUZYGOEC-HZMBPMFUSA-N	1	1	304.350	1.224	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000367842533	418644441	/nfs/dbraw/zinc/64/44/41/418644441.db2.gz	XPKYUWFXFSWAMU-WUHRBBMRSA-N	1	1	319.361	1.400	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000367842533	418644444	/nfs/dbraw/zinc/64/44/44/418644444.db2.gz	XPKYUWFXFSWAMU-WUHRBBMRSA-N	1	1	319.361	1.400	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000367870955	418650338	/nfs/dbraw/zinc/65/03/38/418650338.db2.gz	YOOCTNRESIBAAX-RYUDHWBXSA-N	1	1	322.390	1.598	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1C[C@@H](c2ccsc2)[C@H](CO)C1	ZINC000367870955	418650341	/nfs/dbraw/zinc/65/03/41/418650341.db2.gz	YOOCTNRESIBAAX-RYUDHWBXSA-N	1	1	322.390	1.598	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000368065798	418682652	/nfs/dbraw/zinc/68/26/52/418682652.db2.gz	VDRULCUJLHOEKI-MRXNPFEDSA-N	1	1	321.377	1.874	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000368065798	418682653	/nfs/dbraw/zinc/68/26/53/418682653.db2.gz	VDRULCUJLHOEKI-MRXNPFEDSA-N	1	1	321.377	1.874	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2C(=O)NC[C@@H]2C1	ZINC000368072064	418684271	/nfs/dbraw/zinc/68/42/71/418684271.db2.gz	ODNKGJJCUICUSI-YPMHNXCESA-N	1	1	305.334	1.171	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)CCOc1ccccc1[N+](=O)[O-]	ZINC000361586786	418687680	/nfs/dbraw/zinc/68/76/80/418687680.db2.gz	UJOCKURRZLRCRE-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCN([C@H]3CCC[N@H+](C)C3)CC2)n1	ZINC000371212641	418768368	/nfs/dbraw/zinc/76/83/68/418768368.db2.gz	MDCIAERFIMMAFQ-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCO[C@@H]2CCC[C@@H]21	ZINC000372352675	418860570	/nfs/dbraw/zinc/86/05/70/418860570.db2.gz	ZYEKAFWAMKQYQB-UONOGXRCSA-N	1	1	307.350	1.400	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2CC[NH2+][C@@H]2C1	ZINC000372871599	418911156	/nfs/dbraw/zinc/91/11/56/418911156.db2.gz	QSCUGXZZQZQJPX-TVQRCGJNSA-N	1	1	315.333	1.295	20	5		DDBDMO
COC(=O)[C@@H]1CN([C@@H](C)c2ccccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000411912326	419477981	/nfs/dbraw/zinc/47/79/81/419477981.db2.gz	VGKZXMDOVOWJLI-STQMWFEESA-N	1	1	321.377	1.692	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000412031839	419574151	/nfs/dbraw/zinc/57/41/51/419574151.db2.gz	GVJCZNSNDVTOCR-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCC[NH+]1CCOCC1	ZINC000421738339	419706004	/nfs/dbraw/zinc/70/60/04/419706004.db2.gz	ROUCYNXQHBUJQS-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1c1cccc(F)c1	ZINC000423619809	420101696	/nfs/dbraw/zinc/10/16/96/420101696.db2.gz	VXTDHCJRDBSTCO-NSHDSACASA-N	1	1	319.296	1.244	20	5		DDBDMO
COc1ccc(NC(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000415453124	420073008	/nfs/dbraw/zinc/07/30/08/420073008.db2.gz	YVVMBDKUKFVXSJ-UHFFFAOYSA-N	1	1	304.253	1.319	20	5		DDBDMO
CCC[C@H]1CNCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420308701	420195901	/nfs/dbraw/zinc/19/59/01/420195901.db2.gz	NWWKLTRLBDYFCK-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[C@H]1CNCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420308701	420195907	/nfs/dbraw/zinc/19/59/07/420195907.db2.gz	NWWKLTRLBDYFCK-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)ccc1[N+](=O)[O-]	ZINC000423972648	420287450	/nfs/dbraw/zinc/28/74/50/420287450.db2.gz	PQDPJHVAECWWPP-CYBMUJFWSA-N	1	1	315.333	1.115	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+]2C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)on1	ZINC000441241729	420642220	/nfs/dbraw/zinc/64/22/20/420642220.db2.gz	YZVOIEBLZPHMMN-OLZOCXBDSA-N	1	1	321.337	1.286	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000458159285	420642728	/nfs/dbraw/zinc/64/27/28/420642728.db2.gz	DYMGIJVYVKDUTJ-LBPRGKRZSA-N	1	1	323.397	1.375	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000454790634	420925021	/nfs/dbraw/zinc/92/50/21/420925021.db2.gz	CSQSASTUJPHKQR-WDEREUQCSA-N	1	1	319.365	1.388	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC000561527860	421328148	/nfs/dbraw/zinc/32/81/48/421328148.db2.gz	WEOSVLOZWMELPQ-LBPRGKRZSA-N	1	1	318.377	1.936	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649903	421443341	/nfs/dbraw/zinc/44/33/41/421443341.db2.gz	OCLZXUWIPLSZRH-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649903	421443344	/nfs/dbraw/zinc/44/33/44/421443344.db2.gz	OCLZXUWIPLSZRH-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649903	421443346	/nfs/dbraw/zinc/44/33/46/421443346.db2.gz	OCLZXUWIPLSZRH-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757795	421666059	/nfs/dbraw/zinc/66/60/59/421666059.db2.gz	IPIDADDNTKXNEM-WDEREUQCSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757795	421666061	/nfs/dbraw/zinc/66/60/61/421666061.db2.gz	IPIDADDNTKXNEM-WDEREUQCSA-N	1	1	313.379	1.279	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000520952790	421767632	/nfs/dbraw/zinc/76/76/32/421767632.db2.gz	HEWWGDFZYNKUHK-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+]1C1CC1	ZINC000572313319	421776059	/nfs/dbraw/zinc/77/60/59/421776059.db2.gz	KYOSWOWNWSYEAH-HNNXBMFYSA-N	1	1	319.361	1.717	20	5		DDBDMO
Nc1nccc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594418491	422348563	/nfs/dbraw/zinc/34/85/63/422348563.db2.gz	JMOKFPHYETVWSR-NEPJUHHUSA-N	1	1	319.365	1.319	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000342365433	271391447	/nfs/dbraw/zinc/39/14/47/271391447.db2.gz	VYYKYQXPAUYICL-GHMZBOCLSA-N	1	1	322.365	1.979	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408144230	274330438	/nfs/dbraw/zinc/33/04/38/274330438.db2.gz	HNHNOXLHBMRBGU-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408144230	274330442	/nfs/dbraw/zinc/33/04/42/274330442.db2.gz	HNHNOXLHBMRBGU-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])CC[NH2+]1	ZINC000124178769	288237912	/nfs/dbraw/zinc/23/79/12/288237912.db2.gz	RXRFCYZXAHDQFT-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@@H]3OCC[N@@H+](C)[C@@H]3C2)c1	ZINC000284896879	295254486	/nfs/dbraw/zinc/25/44/86/295254486.db2.gz	HHRAINCVHLNRLZ-CABCVRRESA-N	1	1	307.350	1.513	20	5		DDBDMO
CC(C)[N@H+](CCNS(C)(=O)=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000170958475	298225222	/nfs/dbraw/zinc/22/52/22/298225222.db2.gz	MYVMIMHAGQNJNL-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
CC(C)[N@@H+](CCNS(C)(=O)=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000170958475	298225223	/nfs/dbraw/zinc/22/52/23/298225223.db2.gz	MYVMIMHAGQNJNL-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000367286107	300822330	/nfs/dbraw/zinc/82/23/30/300822330.db2.gz	IJFREWFZAJCPOX-JTQLQIEISA-N	1	1	315.276	1.039	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C[C@H]21	ZINC000368596591	301061189	/nfs/dbraw/zinc/06/11/89/301061189.db2.gz	VMBVMCJIFIDKHT-QMTHXVAHSA-N	1	1	304.350	1.343	20	5		DDBDMO
O=C1CCCCN1[C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000370002407	301256052	/nfs/dbraw/zinc/25/60/52/301256052.db2.gz	OBBIOAJAFDWGJA-CYBMUJFWSA-N	1	1	321.381	1.268	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](c3ccncn3)C2)c1	ZINC000370002078	301256156	/nfs/dbraw/zinc/25/61/56/301256156.db2.gz	MNOPGTLXBIGEPM-GFCCVEGCSA-N	1	1	302.338	1.461	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n[nH]1	ZINC000370044644	301264392	/nfs/dbraw/zinc/26/43/92/301264392.db2.gz	FYPOOOUBARLADY-LLVKDONJSA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)n[nH]1	ZINC000370044644	301264394	/nfs/dbraw/zinc/26/43/94/301264394.db2.gz	FYPOOOUBARLADY-LLVKDONJSA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)[nH]n1	ZINC000370044644	301264396	/nfs/dbraw/zinc/26/43/96/301264396.db2.gz	FYPOOOUBARLADY-LLVKDONJSA-N	1	1	304.354	1.739	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+](Cc3c([N+](=O)[O-])ncn3C)C2)[nH]n1	ZINC000370044644	301264398	/nfs/dbraw/zinc/26/43/98/301264398.db2.gz	FYPOOOUBARLADY-LLVKDONJSA-N	1	1	304.354	1.739	20	5		DDBDMO
CCOC(=O)[C@@]1(C(C)C)CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000370525360	301357090	/nfs/dbraw/zinc/35/70/90/301357090.db2.gz	FJDNTQXYOGQUIU-HNNXBMFYSA-N	1	1	324.381	1.740	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1	ZINC000370534660	301358930	/nfs/dbraw/zinc/35/89/30/301358930.db2.gz	GJOWKVSBXJJYHL-OAHLLOKOSA-N	1	1	321.377	1.662	20	5		DDBDMO
CCN1C(=O)[C@@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000375860390	302006125	/nfs/dbraw/zinc/00/61/25/302006125.db2.gz	MWXABWVHXUISQU-ZDUSSCGKSA-N	1	1	318.333	1.063	20	5		DDBDMO
CCN1C(=O)[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000375860390	302006127	/nfs/dbraw/zinc/00/61/27/302006127.db2.gz	MWXABWVHXUISQU-ZDUSSCGKSA-N	1	1	318.333	1.063	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCC(c2cnc[nH]2)CC1	ZINC000378072663	302274786	/nfs/dbraw/zinc/27/47/86/302274786.db2.gz	DAONHOLETDAJEZ-UHFFFAOYSA-N	1	1	317.305	1.438	20	5		DDBDMO
C[NH+](C)C1(CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1	ZINC000397898375	302356833	/nfs/dbraw/zinc/35/68/33/302356833.db2.gz	UFSXOGUMUZWNDE-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1C[N@H+](C)CCN1C	ZINC000531970542	303268290	/nfs/dbraw/zinc/26/82/90/303268290.db2.gz	CRTUHCUNKJGXHM-ZFWWWQNUSA-N	1	1	306.410	1.800	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000548062252	303568562	/nfs/dbraw/zinc/56/85/62/303568562.db2.gz	DLVRZRGVRJPGEO-UHFFFAOYSA-N	1	1	301.306	1.280	20	5		DDBDMO
Cc1nnc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000563011410	303910022	/nfs/dbraw/zinc/91/00/22/303910022.db2.gz	JYQVQZAGVJDFPC-SNVBAGLBSA-N	1	1	324.362	1.284	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000364072940	307041035	/nfs/dbraw/zinc/04/10/35/307041035.db2.gz	PZXJKQFVHVAEJY-LSDHHAIUSA-N	1	1	319.361	1.266	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000529	307113938	/nfs/dbraw/zinc/11/39/38/307113938.db2.gz	ITNSNNQZROEUJL-NEPJUHHUSA-N	1	1	309.370	1.343	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000529	307113939	/nfs/dbraw/zinc/11/39/39/307113939.db2.gz	ITNSNNQZROEUJL-NEPJUHHUSA-N	1	1	309.370	1.343	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000370887022	307138994	/nfs/dbraw/zinc/13/89/94/307138994.db2.gz	SFTIZXPHFQAKTE-NSHDSACASA-N	1	1	321.381	1.581	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000370887022	307138995	/nfs/dbraw/zinc/13/89/95/307138995.db2.gz	SFTIZXPHFQAKTE-NSHDSACASA-N	1	1	321.381	1.581	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000370887022	307138996	/nfs/dbraw/zinc/13/89/96/307138996.db2.gz	SFTIZXPHFQAKTE-NSHDSACASA-N	1	1	321.381	1.581	20	5		DDBDMO
CCOCC[C@H](O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000373105550	307178795	/nfs/dbraw/zinc/17/87/95/307178795.db2.gz	AMDVVFHJZAYRGF-JSGCOSHPSA-N	1	1	312.370	1.216	20	5		DDBDMO
COC(=O)c1cnc(NC[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000564766620	308005231	/nfs/dbraw/zinc/00/52/31/308005231.db2.gz	GINVPWVZQHIYSU-LLVKDONJSA-N	1	1	322.365	1.919	20	5		DDBDMO
C[C@H]1C[C@H]([NH3+])CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000571773013	308201848	/nfs/dbraw/zinc/20/18/48/308201848.db2.gz	VNCBMWOVCGFFFK-NWDGAFQWSA-N	1	1	306.366	1.735	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000574140982	308262952	/nfs/dbraw/zinc/26/29/52/308262952.db2.gz	UXSJWIYNCUQMPY-GFCCVEGCSA-N	1	1	301.306	1.105	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000576799323	308339915	/nfs/dbraw/zinc/33/99/15/308339915.db2.gz	ARGGLZYNYVILTD-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000576799323	308339917	/nfs/dbraw/zinc/33/99/17/308339917.db2.gz	ARGGLZYNYVILTD-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H](CO)COC(C)C)ccc1[N+](=O)[O-]	ZINC000433162283	533790262	/nfs/dbraw/zinc/79/02/62/533790262.db2.gz	UEBRZSPUVKBCRH-ZDUSSCGKSA-N	1	1	312.366	1.821	20	5		DDBDMO
Cc1cc(NC(=O)C(=O)NC[C@H]2CCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000298156607	533934882	/nfs/dbraw/zinc/93/48/82/533934882.db2.gz	PGDMFRSEKBFBIG-GFCCVEGCSA-N	1	1	320.349	1.052	20	5		DDBDMO
COC(=O)c1cnc(NCC[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000413439419	534306904	/nfs/dbraw/zinc/30/69/04/534306904.db2.gz	NOCSLFPLRKFDGF-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C(C)(C)CN(C)C	ZINC000459542537	534340107	/nfs/dbraw/zinc/34/01/07/534340107.db2.gz	AFALGRUMNONISA-UHFFFAOYSA-N	1	1	308.382	1.772	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000301958722	534426071	/nfs/dbraw/zinc/42/60/71/534426071.db2.gz	LQJSMYGJTCKFMK-HNNXBMFYSA-N	1	1	318.377	1.513	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412269578	528544273	/nfs/dbraw/zinc/54/42/73/528544273.db2.gz	LPAVXTDHTAXGMD-LSDHHAIUSA-N	1	1	321.377	1.129	20	5		DDBDMO
CCC[C@@H]1CN(Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000159791420	697312597	/nfs/dbraw/zinc/31/25/97/697312597.db2.gz	NZUSGTMLNJSVBV-CYBMUJFWSA-N	1	1	311.386	1.182	20	5		DDBDMO
Cc1nn(C)c(C(=O)OCCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000778783755	698368294	/nfs/dbraw/zinc/36/82/94/698368294.db2.gz	PERAKUQKWMWKQK-UHFFFAOYSA-N	1	1	321.337	1.779	20	5		DDBDMO
Cc1nn(CN2CC[C@H](C[N@@H+](C)CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000779864607	698476311	/nfs/dbraw/zinc/47/63/11/698476311.db2.gz	ZYTVBQBTEYSKNI-CQSZACIVSA-N	1	1	307.398	1.721	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])s1	ZINC000750876658	700253347	/nfs/dbraw/zinc/25/33/47/700253347.db2.gz	ZVNNNCXYOKZXKE-UHFFFAOYSA-N	1	1	300.336	1.535	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](C3OCCO3)C2)cc1[N+](=O)[O-]	ZINC000719003844	699297206	/nfs/dbraw/zinc/29/72/06/699297206.db2.gz	ZFUJIOJXNFAUNP-GFCCVEGCSA-N	1	1	308.334	1.798	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCC1	ZINC000792873489	699720014	/nfs/dbraw/zinc/72/00/14/699720014.db2.gz	TVXSQUUXMZXNNY-UHFFFAOYSA-N	1	1	308.294	1.391	20	5		DDBDMO
C[C@H]1COCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000753985372	700473793	/nfs/dbraw/zinc/47/37/93/700473793.db2.gz	HBVVJLHOCDDFKI-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@H]1COCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000753985372	700473795	/nfs/dbraw/zinc/47/37/95/700473795.db2.gz	HBVVJLHOCDDFKI-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000768845466	701209227	/nfs/dbraw/zinc/20/92/27/701209227.db2.gz	MWOLEGWUPHMAAY-NXEZZACHSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000768845466	701209229	/nfs/dbraw/zinc/20/92/29/701209229.db2.gz	MWOLEGWUPHMAAY-NXEZZACHSA-N	1	1	322.321	1.668	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2cc(OC)cc(F)c2[N+](=O)[O-])C1	ZINC000771200807	701313010	/nfs/dbraw/zinc/31/30/10/701313010.db2.gz	UAFKABBJIQVMAR-JTQLQIEISA-N	1	1	313.329	1.875	20	5		DDBDMO
Cc1nn(CCC(=O)OCCn2cc[nH+]c2C)c(C)c1[N+](=O)[O-]	ZINC000771952935	701338340	/nfs/dbraw/zinc/33/83/40/701338340.db2.gz	WXWPWVZGYHMUQS-UHFFFAOYSA-N	1	1	321.337	1.547	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](CO)CC2)c1	ZINC000816666761	702138436	/nfs/dbraw/zinc/13/84/36/702138436.db2.gz	VJGBYJHTMGWJAC-GFCCVEGCSA-N	1	1	322.361	1.976	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1	ZINC000812342898	702165733	/nfs/dbraw/zinc/16/57/33/702165733.db2.gz	NMYWSQGKDRJOSE-NWDGAFQWSA-N	1	1	319.361	1.627	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC000866218035	706652261	/nfs/dbraw/zinc/65/22/61/706652261.db2.gz	KNZKIASIKWUHRJ-OAHLLOKOSA-N	1	1	320.393	1.731	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](n3cccn3)C2)cc1	ZINC000812876672	702256736	/nfs/dbraw/zinc/25/67/36/702256736.db2.gz	OGRVMWVDKNDWRN-CABCVRRESA-N	1	1	302.334	1.772	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000842046556	702663022	/nfs/dbraw/zinc/66/30/22/702663022.db2.gz	DCKUMLCRSMDHSE-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@H](C)[N@H+](CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000842046556	702663024	/nfs/dbraw/zinc/66/30/24/702663024.db2.gz	DCKUMLCRSMDHSE-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000842045983	702663214	/nfs/dbraw/zinc/66/32/14/702663214.db2.gz	NYILUWRCWLCHHY-WDEREUQCSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000842045983	702663216	/nfs/dbraw/zinc/66/32/16/702663216.db2.gz	NYILUWRCWLCHHY-WDEREUQCSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c2nonc21	ZINC000842046640	702663500	/nfs/dbraw/zinc/66/35/00/702663500.db2.gz	FTNOBBLOPYTYCA-VHSXEESVSA-N	1	1	321.337	1.022	20	5		DDBDMO
COc1c(C)c[nH+]c(CCCOC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1C	ZINC000842331575	702704716	/nfs/dbraw/zinc/70/47/16/702704716.db2.gz	GWTPLLKKMYRCKJ-DGCLKSJQSA-N	1	1	308.334	1.848	20	5		DDBDMO
CON1CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000846979316	703360409	/nfs/dbraw/zinc/36/04/09/703360409.db2.gz	ULDVBMWNKPGING-UHFFFAOYSA-N	1	1	308.338	1.102	20	5		DDBDMO
C[C@H]1C[C@H]1C(N)=[NH+]OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000848520490	703560601	/nfs/dbraw/zinc/56/06/01/703560601.db2.gz	QOUIKTOMIJYDPN-JOYOIKCWSA-N	1	1	318.333	1.638	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC3=C(CCC(=O)N3)C2)ccc1[N+](=O)[O-]	ZINC000852296932	704000745	/nfs/dbraw/zinc/00/07/45/704000745.db2.gz	CRKSDHATWOJTGN-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
COc1cc(C[N@H+]2CCC3=C(CCC(=O)N3)C2)ccc1[N+](=O)[O-]	ZINC000852296932	704000749	/nfs/dbraw/zinc/00/07/49/704000749.db2.gz	CRKSDHATWOJTGN-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CC[N@H+](CC3CC3)C2)cc1	ZINC000819039573	704056663	/nfs/dbraw/zinc/05/66/63/704056663.db2.gz	RWDVJMDVCPPHRG-HOCLYGCPSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CC[N@@H+](CC3CC3)C2)cc1	ZINC000819039573	704056666	/nfs/dbraw/zinc/05/66/66/704056666.db2.gz	RWDVJMDVCPPHRG-HOCLYGCPSA-N	1	1	305.378	1.702	20	5		DDBDMO
COC[C@@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870892152	704159124	/nfs/dbraw/zinc/15/91/24/704159124.db2.gz	NUYCNQAQOCTLRN-IAQYHMDHSA-N	1	1	307.350	1.264	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)CO1	ZINC000853798689	704317093	/nfs/dbraw/zinc/31/70/93/704317093.db2.gz	HOOZZDBGQIBENK-VHSXEESVSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)CO1	ZINC000853798689	704317095	/nfs/dbraw/zinc/31/70/95/704317095.db2.gz	HOOZZDBGQIBENK-VHSXEESVSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000832783216	706983542	/nfs/dbraw/zinc/98/35/42/706983542.db2.gz	PEYFLYLBOHMJDS-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179375	705163440	/nfs/dbraw/zinc/16/34/40/705163440.db2.gz	MMGGOYZBLMYHMD-JKSUJKDBSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179375	705163442	/nfs/dbraw/zinc/16/34/42/705163442.db2.gz	MMGGOYZBLMYHMD-JKSUJKDBSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179375	705163444	/nfs/dbraw/zinc/16/34/44/705163444.db2.gz	MMGGOYZBLMYHMD-JKSUJKDBSA-N	1	1	307.394	1.900	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848709	705202610	/nfs/dbraw/zinc/20/26/10/705202610.db2.gz	GMDIGNFSLFCPRD-CHWSQXEVSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000823468833	705249640	/nfs/dbraw/zinc/24/96/40/705249640.db2.gz	LIBKLMXKOFIXLQ-HUUCEWRRSA-N	1	1	317.349	1.557	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000823973430	705348162	/nfs/dbraw/zinc/34/81/62/705348162.db2.gz	HXDKATVXWYGRJV-TVQRCGJNSA-N	1	1	323.353	1.018	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000823973430	705348165	/nfs/dbraw/zinc/34/81/65/705348165.db2.gz	HXDKATVXWYGRJV-TVQRCGJNSA-N	1	1	323.353	1.018	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000861340621	705433161	/nfs/dbraw/zinc/43/31/61/705433161.db2.gz	KGMBBXXQNQFZRZ-DZGCQCFKSA-N	1	1	308.334	1.861	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000861345110	705436673	/nfs/dbraw/zinc/43/66/73/705436673.db2.gz	YWBYYBNHHFWONT-YGRLFVJLSA-N	1	1	311.338	1.199	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000824369053	705437821	/nfs/dbraw/zinc/43/78/21/705437821.db2.gz	VANYXIZMURAWIG-OLZOCXBDSA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c(N)c([N+](=O)[O-])c1	ZINC000827499358	706015063	/nfs/dbraw/zinc/01/50/63/706015063.db2.gz	DLQWZTXMERXRSU-CQSZACIVSA-N	1	1	320.393	1.898	20	5		DDBDMO
COC(=O)C1=NO[C@]2(CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000877714545	706186556	/nfs/dbraw/zinc/18/65/56/706186556.db2.gz	NUPRNWAIOYJCKQ-OAHLLOKOSA-N	1	1	319.317	1.489	20	5		DDBDMO
COC(=O)C1=NO[C@]2(CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000877714545	706186559	/nfs/dbraw/zinc/18/65/59/706186559.db2.gz	NUPRNWAIOYJCKQ-OAHLLOKOSA-N	1	1	319.317	1.489	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1	ZINC000880169729	706899471	/nfs/dbraw/zinc/89/94/71/706899471.db2.gz	ZGVRCHDNRGXRKW-AWEZNQCLSA-N	1	1	319.361	1.373	20	5		DDBDMO
[NH3+]C[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@H]1C(F)(F)F	ZINC000872149836	707303734	/nfs/dbraw/zinc/30/37/34/707303734.db2.gz	RDVSDIJLSMKBSJ-GXSJLCMTSA-N	1	1	319.283	1.869	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000837189584	707594716	/nfs/dbraw/zinc/59/47/16/707594716.db2.gz	JOIGWQFQYMRZBX-LBPRGKRZSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000882493751	707664658	/nfs/dbraw/zinc/66/46/58/707664658.db2.gz	LFJMYHMAUWVNDM-VIFPVBQESA-N	1	1	311.313	1.567	20	5		DDBDMO
Cn1nnc2c1C[C@@H](Nc1cc[nH+]c3ccc([N+](=O)[O-])cc13)CC2	ZINC000896675050	708115360	/nfs/dbraw/zinc/11/53/60/708115360.db2.gz	SYJYIQBVUZOGBD-JTQLQIEISA-N	1	1	324.344	1.663	20	5		DDBDMO
Cc1cc(N2CCN(C)CC[N@H+](C)CC2)c(F)cc1[N+](=O)[O-]	ZINC000897096017	708228853	/nfs/dbraw/zinc/22/88/53/708228853.db2.gz	YVHZTEIFESVKPE-UHFFFAOYSA-N	1	1	310.373	1.726	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000897222720	708260517	/nfs/dbraw/zinc/26/05/17/708260517.db2.gz	XANUFHXQVMLLHZ-STQMWFEESA-N	1	1	309.341	1.769	20	5		DDBDMO
CN(Cc1cccnc1[N+](=O)[O-])CC(C)(C)C[NH+]1CCOCC1	ZINC000886082821	708695120	/nfs/dbraw/zinc/69/51/20/708695120.db2.gz	BBZLKSJVBREXRQ-UHFFFAOYSA-N	1	1	322.409	1.780	20	5		DDBDMO
C[N@H+](Cc1cccnc1[N+](=O)[O-])CC(C)(C)CN1CCOCC1	ZINC000886082821	708695123	/nfs/dbraw/zinc/69/51/23/708695123.db2.gz	BBZLKSJVBREXRQ-UHFFFAOYSA-N	1	1	322.409	1.780	20	5		DDBDMO
C[N@@H+](Cc1cccnc1[N+](=O)[O-])CC(C)(C)CN1CCOCC1	ZINC000886082821	708695126	/nfs/dbraw/zinc/69/51/26/708695126.db2.gz	BBZLKSJVBREXRQ-UHFFFAOYSA-N	1	1	322.409	1.780	20	5		DDBDMO
O=C([C@@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1)N1CCCC1	ZINC000886205823	708714552	/nfs/dbraw/zinc/71/45/52/708714552.db2.gz	AAIGAXMQZXMEET-CYBMUJFWSA-N	1	1	304.350	1.434	20	5		DDBDMO
C[C@H](CNC(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000887399067	709036600	/nfs/dbraw/zinc/03/66/00/709036600.db2.gz	MBGMKGZHPLNGQO-BFQNTYOBSA-N	1	1	321.377	1.270	20	5		DDBDMO
C[C@H](CNC(=O)CN1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000887403211	709037403	/nfs/dbraw/zinc/03/74/03/709037403.db2.gz	RLTBAVYKORUDFK-CYBMUJFWSA-N	1	1	320.393	1.062	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC(C)(C)C1	ZINC000890080189	709738527	/nfs/dbraw/zinc/73/85/27/709738527.db2.gz	XWCQSZWPQNNDOF-UHFFFAOYSA-N	1	1	306.366	1.760	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000900804826	709767571	/nfs/dbraw/zinc/76/75/71/709767571.db2.gz	NNNONYGNGYBRSE-YGRLFVJLSA-N	1	1	324.356	1.098	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331562	710012531	/nfs/dbraw/zinc/01/25/31/710012531.db2.gz	XTCOLYBPDLLWJQ-RWSFTLGLSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331562	710012534	/nfs/dbraw/zinc/01/25/34/710012534.db2.gz	XTCOLYBPDLLWJQ-RWSFTLGLSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[NH+]1C[C@@]2(C)CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000913286019	713191870	/nfs/dbraw/zinc/19/18/70/713191870.db2.gz	XUXNZWFCZNPVIP-HOTGVXAUSA-N	1	1	319.361	1.714	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@@]2(C)C1	ZINC000913295448	713194087	/nfs/dbraw/zinc/19/40/87/713194087.db2.gz	UBFYWQAANJSOGT-CALCHBBNSA-N	1	1	317.389	1.938	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928435425	713194435	/nfs/dbraw/zinc/19/44/35/713194435.db2.gz	GOTSLOXNZUWBCY-CABZTGNLSA-N	1	1	313.304	1.895	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[N@@H+](C)[C@H](Cc2ccccc2)C1	ZINC000893743759	710803498	/nfs/dbraw/zinc/80/34/98/710803498.db2.gz	IOQHOZZKSVJOSO-CQSZACIVSA-N	1	1	315.377	1.691	20	5		DDBDMO
CCc1nn(C)c(N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000894798065	711275259	/nfs/dbraw/zinc/27/52/59/711275259.db2.gz	SPSDODZHYQXBTC-GASCZTMLSA-N	1	1	307.398	1.669	20	5		DDBDMO
C[N@H+]1CCN(c2nccc3c2cccc3[N+](=O)[O-])C[C@@H]1CO	ZINC000894883893	711307490	/nfs/dbraw/zinc/30/74/90/711307490.db2.gz	BKVICEWRKUUAJK-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](C)[C@H](CO)C2)c1[N+](=O)[O-]	ZINC000895515978	711531148	/nfs/dbraw/zinc/53/11/48/711531148.db2.gz	YRQDJJSKZNFNFG-JQWIXIFHSA-N	1	1	310.350	1.759	20	5		DDBDMO
CCOC(=O)c1ccnc(N[C@@H]2CC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000895739039	711591713	/nfs/dbraw/zinc/59/17/13/711591713.db2.gz	AMOJNYWTCWUWIP-MWLCHTKSSA-N	1	1	308.338	1.671	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1C1CCOCC1	ZINC000896524080	711738074	/nfs/dbraw/zinc/73/80/74/711738074.db2.gz	SBXALVRCMHCOEE-CYBMUJFWSA-N	1	1	323.397	1.785	20	5		DDBDMO
O=C(NCc1ccco1)c1cccc(C[NH2+]CC[N+](=O)[O-])c1	ZINC000905052111	711921509	/nfs/dbraw/zinc/92/15/09/711921509.db2.gz	LYYUVTZAJXWXKE-UHFFFAOYSA-N	1	1	303.318	1.576	20	5		DDBDMO
O=[N+]([O-])CCNCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1	ZINC000905197469	711965508	/nfs/dbraw/zinc/96/55/08/711965508.db2.gz	WNYOVSONZJOSFQ-UHFFFAOYSA-N	1	1	318.421	1.585	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1C[C@@H]3COC[C@@H]3O1)C2	ZINC000930100363	713755973	/nfs/dbraw/zinc/75/59/73/713755973.db2.gz	SVKMPGIGTSXUDK-WWGRRREGSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1C[C@@H]3COC[C@@H]3O1)C2	ZINC000930100363	713755977	/nfs/dbraw/zinc/75/59/77/713755977.db2.gz	SVKMPGIGTSXUDK-WWGRRREGSA-N	1	1	304.346	1.757	20	5		DDBDMO
CC(C)(C)OC(=O)N1CCC2(CC[N@@H+](CC[N+](=O)[O-])C2)CC1	ZINC000930179702	713773416	/nfs/dbraw/zinc/77/34/16/713773416.db2.gz	OWOFCDPJKHPZGN-UHFFFAOYSA-N	1	1	313.398	1.986	20	5		DDBDMO
Cc1ccc(CN2CCC(O)(C[NH+](C)C)CC2)cc1[N+](=O)[O-]	ZINC000931480422	714107840	/nfs/dbraw/zinc/10/78/40/714107840.db2.gz	WMUDWWLAJWOEPA-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000931641419	714147502	/nfs/dbraw/zinc/14/75/02/714147502.db2.gz	FALIPGCRDOTEOH-BXUZGUMPSA-N	1	1	310.350	1.712	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](C3OCCO3)C2)c1	ZINC000932004570	714231188	/nfs/dbraw/zinc/23/11/88/714231188.db2.gz	ZGPRZMRHWXEXNJ-OCCSQVGLSA-N	1	1	308.334	1.323	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000923280333	714295859	/nfs/dbraw/zinc/29/58/59/714295859.db2.gz	XAHBMQSIPGTPMW-WDEREUQCSA-N	1	1	304.350	1.486	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000932969618	714446326	/nfs/dbraw/zinc/44/63/26/714446326.db2.gz	MTPOXRUUTSOZJD-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000932969617	714446450	/nfs/dbraw/zinc/44/64/50/714446450.db2.gz	MTPOXRUUTSOZJD-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000933229160	714542514	/nfs/dbraw/zinc/54/25/14/714542514.db2.gz	YRJIEWIWHKNGDV-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000933229160	714542517	/nfs/dbraw/zinc/54/25/17/714542517.db2.gz	YRJIEWIWHKNGDV-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C2	ZINC000933760107	714665832	/nfs/dbraw/zinc/66/58/32/714665832.db2.gz	PARACBVJLIMAIW-LRDDRELGSA-N	1	1	319.361	1.561	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@H]2C2OCCO2)cc1	ZINC000933902375	714697251	/nfs/dbraw/zinc/69/72/51/714697251.db2.gz	ZNTPYTDCSFMBHB-UONOGXRCSA-N	1	1	308.334	1.466	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CC[C@H]1OC	ZINC000934121498	714747787	/nfs/dbraw/zinc/74/77/87/714747787.db2.gz	NARZHFGRVQTBRZ-CHWSQXEVSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CC[C@H]1OC	ZINC000934121498	714747788	/nfs/dbraw/zinc/74/77/88/714747788.db2.gz	NARZHFGRVQTBRZ-CHWSQXEVSA-N	1	1	323.349	1.651	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC001164637376	719161172	/nfs/dbraw/zinc/16/11/72/719161172.db2.gz	OKGXOHOZYHVQBG-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(c3nn(C)cc3[N+](=O)[O-])CC2)c1	ZINC001185684977	744267068	/nfs/dbraw/zinc/26/70/68/744267068.db2.gz	HYFWKIGZYVDVRW-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](O)C1)Nc1cc2cccnc2c2ncccc12	ZINC001186049190	744336152	/nfs/dbraw/zinc/33/61/52/744336152.db2.gz	QTKSXNWMFVGQOF-CYBMUJFWSA-N	1	1	322.368	1.788	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](O)C1)Nc1cc2cccnc2c2ncccc12	ZINC001186049190	744336154	/nfs/dbraw/zinc/33/61/54/744336154.db2.gz	QTKSXNWMFVGQOF-CYBMUJFWSA-N	1	1	322.368	1.788	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3C[C@H](CO)[C@H](CCO)C3)nc2c1	ZINC001198754684	747599945	/nfs/dbraw/zinc/59/99/45/747599945.db2.gz	VLPXWCDZUSVHHR-GHMZBOCLSA-N	1	1	321.333	1.159	20	5		DDBDMO
O=C(N1CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1)C(F)(F)F	ZINC001169011893	762178005	/nfs/dbraw/zinc/17/80/05/762178005.db2.gz	NGLQVFVMIOGKKA-VHSXEESVSA-N	1	1	309.288	1.138	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011992	762178866	/nfs/dbraw/zinc/17/88/66/762178866.db2.gz	OMIMZTMCAYEEAZ-NAKRPEOUSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011992	762178870	/nfs/dbraw/zinc/17/88/70/762178870.db2.gz	OMIMZTMCAYEEAZ-NAKRPEOUSA-N	1	1	314.279	1.769	20	5		DDBDMO
CCc1ncnc2c1CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169022087	762200634	/nfs/dbraw/zinc/20/06/34/762200634.db2.gz	MUIQWQQEPFJXOS-OLZOCXBDSA-N	1	1	304.394	1.885	20	5		DDBDMO
CCC(C)(C)CC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001128139825	753603350	/nfs/dbraw/zinc/60/33/50/753603350.db2.gz	NFUCUTZRKQUCKE-UHFFFAOYSA-N	1	1	311.386	1.360	20	5		DDBDMO
CCOc1cc(-n2[nH]c(=O)c(CC[NH3+])c2C)ccc1[N+](=O)[O-]	ZINC001170344205	766276121	/nfs/dbraw/zinc/27/61/21/766276121.db2.gz	JIAWZFFESJXLGQ-UHFFFAOYSA-N	1	1	306.322	1.694	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1cnc([N+](=O)[O-])c(OC)c1	ZINC001170518148	767759939	/nfs/dbraw/zinc/75/99/39/767759939.db2.gz	ZZDNKBHLDAUYHB-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C(C)(C)C1	ZINC001158569707	768735328	/nfs/dbraw/zinc/73/53/28/768735328.db2.gz	VPWSRYZPWPAWBK-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
CC(=O)NCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC001096259783	768799525	/nfs/dbraw/zinc/79/95/25/768799525.db2.gz	JLSDQXFVNZGCFB-UHFFFAOYSA-N	1	1	306.366	1.161	20	5		DDBDMO
O=C(NC[C@H]1CC[C@H](C[NH2+]CC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048607874	769577610	/nfs/dbraw/zinc/57/76/10/769577610.db2.gz	PBMIEXOLLVPSMV-KLHDSHLOSA-N	1	1	323.437	1.964	20	5		DDBDMO
C[NH+]1CC(CNC(F)(F)c2cc([N+](=O)[O-])cnc2Cl)C1	ZINC001159219225	771089815	/nfs/dbraw/zinc/08/98/15/771089815.db2.gz	XWCXZRNAAZTRAO-UHFFFAOYSA-N	1	1	306.700	1.844	20	5		DDBDMO
CN(CCNc1ccc([N+](=O)[O-])cc1)C(=O)C[N@@H+](C)C1CCC1	ZINC001102016411	777798343	/nfs/dbraw/zinc/79/83/43/777798343.db2.gz	UOXIZOKCQQCWKB-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC001177510027	778627608	/nfs/dbraw/zinc/62/76/08/778627608.db2.gz	SDFORXRTNZRHEB-UHFFFAOYSA-N	1	1	317.349	1.825	20	5		DDBDMO
Cc1nc(NC[C@@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC001327720242	862411863	/nfs/dbraw/zinc/41/18/63/862411863.db2.gz	CKHBGAQENQZNRB-MXWKQRLJSA-N	1	1	309.370	1.603	20	5		DDBDMO
Cc1nc(NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC001327720242	862411874	/nfs/dbraw/zinc/41/18/74/862411874.db2.gz	CKHBGAQENQZNRB-MXWKQRLJSA-N	1	1	309.370	1.603	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@@H](C)OCCC[NH+]1CCOCC1	ZINC001224870032	881565679	/nfs/dbraw/zinc/56/56/79/881565679.db2.gz	JMZLSUXEZNGWET-GFCCVEGCSA-N	1	1	312.370	1.227	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]21	ZINC001157266666	863695835	/nfs/dbraw/zinc/69/58/35/863695835.db2.gz	VXJIZHOIWLFAHZ-BXKDBHETSA-N	1	1	307.310	1.428	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)n1	ZINC001157282396	863708550	/nfs/dbraw/zinc/70/85/50/863708550.db2.gz	NBWPIYZLELCEHC-GXFFZTMASA-N	1	1	320.349	1.307	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1cnco1	ZINC001323508813	866652206	/nfs/dbraw/zinc/65/22/06/866652206.db2.gz	PRDPAUMKTNECHR-UHFFFAOYSA-N	1	1	322.346	1.697	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](C)[N@H+]1CCC[C@@H](C)C1	ZINC001334111559	867304642	/nfs/dbraw/zinc/30/46/42/867304642.db2.gz	VQFUAHYIAXTKMY-VXGBXAGGSA-N	1	1	323.397	1.336	20	5		DDBDMO
COc1ncnc(N[C@H]2CC[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC001163361651	868395895	/nfs/dbraw/zinc/39/58/95/868395895.db2.gz	JYHWABWIEFKTKG-QWRGUYRKSA-N	1	1	309.370	1.924	20	5		DDBDMO
C[N@@H+]1CCCC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022417	868684937	/nfs/dbraw/zinc/68/49/37/868684937.db2.gz	XYWIZRYWSFNJMA-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022417	868684945	/nfs/dbraw/zinc/68/49/45/868684945.db2.gz	XYWIZRYWSFNJMA-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCC1(N(C)C)CC[NH+](C)CC1	ZINC001164206384	869010423	/nfs/dbraw/zinc/01/04/23/869010423.db2.gz	OKRNTPXXSPAZMZ-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
C[N@@H+](CCCc1ccsc1)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001317448489	870858208	/nfs/dbraw/zinc/85/82/08/870858208.db2.gz	UWPQDKPVMGSILE-CHWSQXEVSA-N	1	1	311.407	1.394	20	5		DDBDMO
C[N@H+](CCCc1ccsc1)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317448489	870858215	/nfs/dbraw/zinc/85/82/15/870858215.db2.gz	UWPQDKPVMGSILE-CHWSQXEVSA-N	1	1	311.407	1.394	20	5		DDBDMO
C[N@@H+](CCCc1ccsc1)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317448489	870858223	/nfs/dbraw/zinc/85/82/23/870858223.db2.gz	UWPQDKPVMGSILE-CHWSQXEVSA-N	1	1	311.407	1.394	20	5		DDBDMO
Cc1ccc(NC(=O)c2cc(C[NH+](C)C)on2)c(N)c1[N+](=O)[O-]	ZINC001304500301	871216471	/nfs/dbraw/zinc/21/64/71/871216471.db2.gz	JYOSHPROHHVQSV-UHFFFAOYSA-N	1	1	319.321	1.787	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)CC1	ZINC001341358557	871619407	/nfs/dbraw/zinc/61/94/07/871619407.db2.gz	IHYNNEIVYHFRGY-GFCCVEGCSA-N	1	1	324.429	1.709	20	5		DDBDMO
O=C(CCCF)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001318146950	871779715	/nfs/dbraw/zinc/77/97/15/871779715.db2.gz	VSRQZHQAHIOVEH-UHFFFAOYSA-N	1	1	309.341	1.893	20	5		DDBDMO
CCO[C@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC001341939574	871904854	/nfs/dbraw/zinc/90/48/54/871904854.db2.gz	PRTUVKJSCVSLRY-ZFWWWQNUSA-N	1	1	307.350	1.406	20	5		DDBDMO
C[N@H+](CCCF)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC001353216135	877195018	/nfs/dbraw/zinc/19/50/18/877195018.db2.gz	NJYAJHUJIZPUNB-UHFFFAOYSA-N	1	1	324.312	1.612	20	5		DDBDMO
C[N@@H+](CCCF)CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC001353216135	877195023	/nfs/dbraw/zinc/19/50/23/877195023.db2.gz	NJYAJHUJIZPUNB-UHFFFAOYSA-N	1	1	324.312	1.612	20	5		DDBDMO
C[C@H](CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)[NH+](C)C	ZINC001353298243	877237702	/nfs/dbraw/zinc/23/77/02/877237702.db2.gz	RVQGSUCOYOXWPT-TZMCWYRMSA-N	1	1	311.382	1.264	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c([N+](=O)[O-])c1	ZINC001354400835	877952927	/nfs/dbraw/zinc/95/29/27/877952927.db2.gz	LZAATGFZRANWCD-JHJVBQTASA-N	1	1	318.377	1.707	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](COCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC001222928748	880748313	/nfs/dbraw/zinc/74/83/13/880748313.db2.gz	JCDFARUKGZTEOD-LLVKDONJSA-N	1	1	307.306	1.583	20	5		DDBDMO
C[N@H+]1CCO[C@@H](COCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC001222928748	880748322	/nfs/dbraw/zinc/74/83/22/880748322.db2.gz	JCDFARUKGZTEOD-LLVKDONJSA-N	1	1	307.306	1.583	20	5		DDBDMO
COC(=O)c1cccc(COC[C@@H]2C[N@H+](C)CCO2)c1[N+](=O)[O-]	ZINC001223663451	881050251	/nfs/dbraw/zinc/05/02/51/881050251.db2.gz	XIFFBRPJMFNWHA-LBPRGKRZSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cccc(COC[C@@H]2C[N@@H+](C)CCO2)c1[N+](=O)[O-]	ZINC001223663451	881050256	/nfs/dbraw/zinc/05/02/56/881050256.db2.gz	XIFFBRPJMFNWHA-LBPRGKRZSA-N	1	1	324.333	1.229	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C	ZINC001227696127	883136554	/nfs/dbraw/zinc/13/65/54/883136554.db2.gz	KQILJZKDNQPLOD-MRCXROJRSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001227696127	883136557	/nfs/dbraw/zinc/13/65/57/883136557.db2.gz	KQILJZKDNQPLOD-MRCXROJRSA-N	1	1	306.318	1.786	20	5		DDBDMO
COCCC(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001231009629	885129317	/nfs/dbraw/zinc/12/93/17/885129317.db2.gz	BAPPVCOLNGXZFX-UHFFFAOYSA-N	1	1	315.395	1.631	20	5		DDBDMO
COCCC(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001231009629	885129333	/nfs/dbraw/zinc/12/93/33/885129333.db2.gz	BAPPVCOLNGXZFX-UHFFFAOYSA-N	1	1	315.395	1.631	20	5		DDBDMO
CCOCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001231406395	885619855	/nfs/dbraw/zinc/61/98/55/885619855.db2.gz	FAYQDHQBXJIXBU-UHFFFAOYSA-N	1	1	309.366	1.569	20	5		DDBDMO
COC(=O)c1cnc(O[C@H]2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1	ZINC001233859989	887398937	/nfs/dbraw/zinc/39/89/37/887398937.db2.gz	SWLJUEQDXJMDCI-GDNZZTSVSA-N	1	1	321.333	1.780	20	5		DDBDMO
C[C@@]1(CO)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001254545140	896496746	/nfs/dbraw/zinc/49/67/46/896496746.db2.gz	JEBJSZLTNZEBCX-XJKSGUPXSA-N	1	1	324.377	1.429	20	5		DDBDMO
CCN(CC)CCNC(=[NH2+])N[C@@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254550244	896498436	/nfs/dbraw/zinc/49/84/36/896498436.db2.gz	GIYBPKIPBLLYBC-ZDUSSCGKSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[C@]1(CO)C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[C@H]1O	ZINC001254593352	896520462	/nfs/dbraw/zinc/52/04/62/896520462.db2.gz	LILUJHRMWPUFED-BZUAXINKSA-N	1	1	306.362	1.127	20	5		DDBDMO
C[C@]1(CO)CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]1O	ZINC001254592067	896522389	/nfs/dbraw/zinc/52/23/89/896522389.db2.gz	ABVXNTGSQXHNHO-BZUAXINKSA-N	1	1	306.362	1.127	20	5		DDBDMO
CC(=O)N[C@@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254600386	896525167	/nfs/dbraw/zinc/52/51/67/896525167.db2.gz	PNCYLLMBLZESCU-GDBMZVCRSA-N	1	1	303.362	1.663	20	5		DDBDMO
CN(C1COC1)C1C[NH+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254604339	896526856	/nfs/dbraw/zinc/52/68/56/896526856.db2.gz	VTGNQXZKLXHVOE-AWEZNQCLSA-N	1	1	303.362	1.077	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC12CC2	ZINC001254611166	896533655	/nfs/dbraw/zinc/53/36/55/896533655.db2.gz	WPLVLYLUIDFOBV-CABCVRRESA-N	1	1	316.357	1.947	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC001263996118	900864950	/nfs/dbraw/zinc/86/49/50/900864950.db2.gz	STGZXTBJEIJNCO-MXAVVETBSA-N	1	1	319.361	1.085	20	5		DDBDMO
O=C(NCCC[N@@H+](C/C=C\Cl)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266135588	903001893	/nfs/dbraw/zinc/00/18/93/903001893.db2.gz	PVGJQEHPGTVEHL-ZQTMTMAVSA-N	1	1	301.774	1.375	20	5		DDBDMO
O=C(NCCC[N@H+](C/C=C\Cl)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001266135588	903001910	/nfs/dbraw/zinc/00/19/10/903001910.db2.gz	PVGJQEHPGTVEHL-ZQTMTMAVSA-N	1	1	301.774	1.375	20	5		DDBDMO
O=C(NCCC[N@@H+](C/C=C\Cl)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001266135588	903001924	/nfs/dbraw/zinc/00/19/24/903001924.db2.gz	PVGJQEHPGTVEHL-ZQTMTMAVSA-N	1	1	301.774	1.375	20	5		DDBDMO
Cc1c(CC(=O)N[C@H]2C[N@H+](C)CC2(C)C)cccc1[N+](=O)[O-]	ZINC001303989922	903188416	/nfs/dbraw/zinc/18/84/16/903188416.db2.gz	UMNAGWXHERRSBP-AWEZNQCLSA-N	1	1	305.378	1.902	20	5		DDBDMO
O=C(NCC1([NH2+]CCc2ccccc2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001280480328	903723526	/nfs/dbraw/zinc/72/35/26/903723526.db2.gz	KKJJQMJVNVIESV-HUUCEWRRSA-N	1	1	317.389	1.523	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000358069429	299066365	/nfs/dbraw/zinc/06/63/65/299066365.db2.gz	STLAZIRADNYYRG-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@H+](CCc1cnccn1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000278480047	214179786	/nfs/dbraw/zinc/17/97/86/214179786.db2.gz	JCVMUMABHOFJFH-UHFFFAOYSA-N	1	1	317.305	1.968	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000278480047	214179787	/nfs/dbraw/zinc/17/97/87/214179787.db2.gz	JCVMUMABHOFJFH-UHFFFAOYSA-N	1	1	317.305	1.968	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000278571659	214245911	/nfs/dbraw/zinc/24/59/11/214245911.db2.gz	KNSRYTXLAWUNOK-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000278571659	214245914	/nfs/dbraw/zinc/24/59/14/214245914.db2.gz	KNSRYTXLAWUNOK-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000278571659	214245917	/nfs/dbraw/zinc/24/59/17/214245917.db2.gz	KNSRYTXLAWUNOK-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305756639	231039756	/nfs/dbraw/zinc/03/97/56/231039756.db2.gz	CTVDNZOZQZCBST-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000305756639	231039758	/nfs/dbraw/zinc/03/97/58/231039758.db2.gz	CTVDNZOZQZCBST-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
CCn1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cn1	ZINC000278748139	214372655	/nfs/dbraw/zinc/37/26/55/214372655.db2.gz	RWGKYXGSRGATJE-UHFFFAOYSA-N	1	1	300.322	1.977	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000495197630	529444192	/nfs/dbraw/zinc/44/41/92/529444192.db2.gz	YJPOVWAXXCQHNF-HOCLYGCPSA-N	1	1	319.361	1.547	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](CCCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000452131839	231314409	/nfs/dbraw/zinc/31/44/09/231314409.db2.gz	PUHIERQIDZLXMO-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](CCCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000452131839	231314410	/nfs/dbraw/zinc/31/44/10/231314410.db2.gz	PUHIERQIDZLXMO-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCC[C@@H]1O	ZINC000305358541	529984261	/nfs/dbraw/zinc/98/42/61/529984261.db2.gz	SOPUEKVHUQRGKX-JSGCOSHPSA-N	1	1	307.350	1.287	20	5		DDBDMO
C[NH+]1CCN(CCC(C)(C)Nc2ncc([N+](=O)[O-])cn2)CC1	ZINC000302233151	530072180	/nfs/dbraw/zinc/07/21/80/530072180.db2.gz	CZOMYSUHCIPIMJ-UHFFFAOYSA-N	1	1	308.386	1.213	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000140016504	186025377	/nfs/dbraw/zinc/02/53/77/186025377.db2.gz	FJANDAFARPFFFA-SNVBAGLBSA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000140016504	186025378	/nfs/dbraw/zinc/02/53/78/186025378.db2.gz	FJANDAFARPFFFA-SNVBAGLBSA-N	1	1	313.379	1.504	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H](O)C3)o2)c1	ZINC000152473120	186076715	/nfs/dbraw/zinc/07/67/15/186076715.db2.gz	CVIKAMVRXSSHBD-CYBMUJFWSA-N	1	1	303.318	1.859	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000155698634	186104363	/nfs/dbraw/zinc/10/43/63/186104363.db2.gz	QIDCXTLBTPEKTI-JSGCOSHPSA-N	1	1	305.378	1.982	20	5		DDBDMO
CC(C)(O)C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000189934619	186251752	/nfs/dbraw/zinc/25/17/52/186251752.db2.gz	YZTHNLHPNBXLLJ-UHFFFAOYSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)(O)C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000189934619	186251754	/nfs/dbraw/zinc/25/17/54/186251754.db2.gz	YZTHNLHPNBXLLJ-UHFFFAOYSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCC[N@H+]2C)cc([N+](=O)[O-])c1OC	ZINC000265975346	186344530	/nfs/dbraw/zinc/34/45/30/186344530.db2.gz	XBFJPTWTYRPIPH-LLVKDONJSA-N	1	1	323.349	1.436	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H](OCCO)C2)cc1	ZINC000172293473	198072755	/nfs/dbraw/zinc/07/27/55/198072755.db2.gz	SWXXYFDCEJVILC-INIZCTEOSA-N	1	1	324.377	1.837	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(N)=O)CC1	ZINC000021847331	352174955	/nfs/dbraw/zinc/17/49/55/352174955.db2.gz	BARQAGDLSDRVSH-SNVBAGLBSA-N	1	1	320.349	1.119	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000029587338	352241390	/nfs/dbraw/zinc/24/13/90/352241390.db2.gz	WTPOSHLPIUESFU-UHFFFAOYSA-N	1	1	310.329	1.356	20	5		DDBDMO
CC(C)NC(=O)C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000045726314	352420507	/nfs/dbraw/zinc/42/05/07/352420507.db2.gz	JFIRFXOMVBYNHX-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
CC(C)NC(=O)C[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000045726314	352420511	/nfs/dbraw/zinc/42/05/11/352420511.db2.gz	JFIRFXOMVBYNHX-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046996830	352475553	/nfs/dbraw/zinc/47/55/53/352475553.db2.gz	UWLQOFPMZNTXFY-ZIAGYGMSSA-N	1	1	304.350	1.655	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000047268318	352488724	/nfs/dbraw/zinc/48/87/24/352488724.db2.gz	JNTCTNCQJGDGEI-LSDHHAIUSA-N	1	1	303.362	1.432	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000067942915	353076026	/nfs/dbraw/zinc/07/60/26/353076026.db2.gz	DWBIDCXROYLCKB-UHFFFAOYSA-N	1	1	324.356	1.698	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000072714448	353210641	/nfs/dbraw/zinc/21/06/41/353210641.db2.gz	JRSVQZPDZCJNEG-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H](c1cccs1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174752882	198380289	/nfs/dbraw/zinc/38/02/89/198380289.db2.gz	JXKPKNZWVOZHHW-JQWIXIFHSA-N	1	1	310.379	1.907	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000093333211	353895246	/nfs/dbraw/zinc/89/52/46/353895246.db2.gz	RFDFFFVWCCRSRD-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc(F)cc1[N+](=O)[O-]	ZINC000108297130	353948527	/nfs/dbraw/zinc/94/85/27/353948527.db2.gz	AKIFPYRRZNTZAA-LLVKDONJSA-N	1	1	322.340	1.530	20	5		DDBDMO
O=C(c1n[nH]c2ccc([N+](=O)[O-])cc21)N1CC[NH+](C2CC2)CC1	ZINC000124763344	354042080	/nfs/dbraw/zinc/04/20/80/354042080.db2.gz	DOGCXTYFVSLMTK-UHFFFAOYSA-N	1	1	315.333	1.391	20	5		DDBDMO
O=C1NCCN1[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000139008275	354124756	/nfs/dbraw/zinc/12/47/56/354124756.db2.gz	MGUNDAUQICQWRY-CQSZACIVSA-N	1	1	304.350	1.584	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000357228402	291022025	/nfs/dbraw/zinc/02/20/25/291022025.db2.gz	XFPYEENAMHGNRT-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000156826685	354222572	/nfs/dbraw/zinc/22/25/72/354222572.db2.gz	SHGWGBVPXFSMOK-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000156826685	354222575	/nfs/dbraw/zinc/22/25/75/354222575.db2.gz	SHGWGBVPXFSMOK-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@@H](CO)CC2)c1	ZINC000293114305	354454183	/nfs/dbraw/zinc/45/41/83/354454183.db2.gz	LVKSBXOYNPTBIA-UKRRQHHQSA-N	1	1	324.377	1.429	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)COc1ccc(F)cc1[N+](=O)[O-]	ZINC000314680319	354487964	/nfs/dbraw/zinc/48/79/64/354487964.db2.gz	KEDSNWKMENDEPL-LLVKDONJSA-N	1	1	302.302	1.052	20	5		DDBDMO
O=C(C[N@H+]1CCCCC[C@@H]1CO)Nc1ccccc1[N+](=O)[O-]	ZINC000318623160	354516114	/nfs/dbraw/zinc/51/61/14/354516114.db2.gz	PHQBXLAIUJFBHY-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CCCCC[C@@H]1CO)Nc1ccccc1[N+](=O)[O-]	ZINC000318623160	354516115	/nfs/dbraw/zinc/51/61/15/354516115.db2.gz	PHQBXLAIUJFBHY-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@@H]2C[N@H+](C)C[C@H]21	ZINC000590010371	355039088	/nfs/dbraw/zinc/03/90/88/355039088.db2.gz	CIDCVFWUCWCRRI-IUODEOHRSA-N	1	1	318.377	1.478	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000590047000	355043609	/nfs/dbraw/zinc/04/36/09/355043609.db2.gz	SCONKIOSKQMRRM-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC000590443742	355097691	/nfs/dbraw/zinc/09/76/91/355097691.db2.gz	GYHRDEWGBRZYHY-GWCFXTLKSA-N	1	1	305.334	1.380	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590447420	355099812	/nfs/dbraw/zinc/09/98/12/355099812.db2.gz	XDCSNEKQAIPBIM-JQWIXIFHSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000591505194	355322244	/nfs/dbraw/zinc/32/22/44/355322244.db2.gz	DOKXVNXAAOMFOI-VXGBXAGGSA-N	1	1	322.361	1.816	20	5		DDBDMO
Cc1nc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)cs1	ZINC000591729086	355373647	/nfs/dbraw/zinc/37/36/47/355373647.db2.gz	KKRBLBGUZXBWFZ-ZDUSSCGKSA-N	1	1	323.374	1.889	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@H]1[NH3+]	ZINC000592330543	355560509	/nfs/dbraw/zinc/56/05/09/355560509.db2.gz	BZQYOKKRKFFVJL-BXKDBHETSA-N	1	1	317.349	1.671	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)[C@@H]1CC[N@@H+](C)C1	ZINC000592830344	355706201	/nfs/dbraw/zinc/70/62/01/355706201.db2.gz	DJJVALJBIXTAHP-GFCCVEGCSA-N	1	1	306.366	1.855	20	5		DDBDMO
CCCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000592832131	355707014	/nfs/dbraw/zinc/70/70/14/355707014.db2.gz	QUGPRRLZWWNPNH-CQSZACIVSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[C@@H]1COC(C)(C)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000593056742	355782897	/nfs/dbraw/zinc/78/28/97/355782897.db2.gz	OLCVDUASFLFFDJ-YPMHNXCESA-N	1	1	312.370	1.042	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](C)CCO	ZINC000593108164	355801195	/nfs/dbraw/zinc/80/11/95/355801195.db2.gz	UNHPRRAIAGDRHK-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593503319	355905655	/nfs/dbraw/zinc/90/56/55/355905655.db2.gz	HKXPMRFCSITILV-GFCCVEGCSA-N	1	1	314.345	1.398	20	5		DDBDMO
CN1CC[NH+](CCNc2ccnc3cc([N+](=O)[O-])ccc32)CC1	ZINC000593454899	355890909	/nfs/dbraw/zinc/89/09/09/355890909.db2.gz	MEWVSKLPCOEMMF-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
O=[N+]([O-])c1cccc(-n2cc(C[N@H+]3CCC[C@H]3CO)nn2)c1	ZINC000594639845	356269336	/nfs/dbraw/zinc/26/93/36/356269336.db2.gz	FQPYKJNERSWXCP-AWEZNQCLSA-N	1	1	303.322	1.132	20	5		DDBDMO
O=[N+]([O-])c1cccc(-n2cc(C[N@@H+]3CCC[C@H]3CO)nn2)c1	ZINC000594639845	356269340	/nfs/dbraw/zinc/26/93/40/356269340.db2.gz	FQPYKJNERSWXCP-AWEZNQCLSA-N	1	1	303.322	1.132	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000594731035	356300170	/nfs/dbraw/zinc/30/01/70/356300170.db2.gz	DLUUJTIZOUOAJE-NSHDSACASA-N	1	1	305.338	1.166	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000594990796	356369385	/nfs/dbraw/zinc/36/93/85/356369385.db2.gz	AITYRKXSKDFWNK-ZDUSSCGKSA-N	1	1	321.377	1.940	20	5		DDBDMO
CCCN1CC[C@H]([NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000594990796	356369387	/nfs/dbraw/zinc/36/93/87/356369387.db2.gz	AITYRKXSKDFWNK-ZDUSSCGKSA-N	1	1	321.377	1.940	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@]1(O)CC[N@@H+](C)C1	ZINC000595032293	356374372	/nfs/dbraw/zinc/37/43/72/356374372.db2.gz	MCVGCLPUDOIYEC-NHYWBVRUSA-N	1	1	309.366	1.321	20	5		DDBDMO
CCC[N@@H+]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000595355725	356461907	/nfs/dbraw/zinc/46/19/07/356461907.db2.gz	QPCNSTOIFMFHSH-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000595355725	356461910	/nfs/dbraw/zinc/46/19/10/356461910.db2.gz	QPCNSTOIFMFHSH-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
Cc1noc(C[N@H+]2CCCC[C@H]2[C@@H]2CNC(=O)C2)c1[N+](=O)[O-]	ZINC000595406331	356481746	/nfs/dbraw/zinc/48/17/46/356481746.db2.gz	BXHCMZIXAODAHS-QWRGUYRKSA-N	1	1	308.338	1.382	20	5		DDBDMO
CC1(C)C[C@@H]([NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)CO1	ZINC000595524526	356533199	/nfs/dbraw/zinc/53/31/99/356533199.db2.gz	WTMGUVQNOSQXRR-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000595779614	356650121	/nfs/dbraw/zinc/65/01/21/356650121.db2.gz	DQSQXWLZBTVCHD-MNOVXSKESA-N	1	1	307.350	1.693	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000595779614	356650123	/nfs/dbraw/zinc/65/01/23/356650123.db2.gz	DQSQXWLZBTVCHD-MNOVXSKESA-N	1	1	307.350	1.693	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H](C)[C@H]2CCC[NH3+])c1[N+](=O)[O-]	ZINC000595972445	356730441	/nfs/dbraw/zinc/73/04/41/356730441.db2.gz	BZGATCWMROUGOH-MWLCHTKSSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@@H](C)C1	ZINC000596136093	356786385	/nfs/dbraw/zinc/78/63/85/356786385.db2.gz	HCUIDCOHBPWMAQ-SMDDNHRTSA-N	1	1	320.393	1.860	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@]2(CC[N@H+](C)C2)C1	ZINC000597713682	357298249	/nfs/dbraw/zinc/29/82/49/357298249.db2.gz	FOKQDVSBFNBCEX-MRXNPFEDSA-N	1	1	318.377	1.856	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000597856855	357360356	/nfs/dbraw/zinc/36/03/56/357360356.db2.gz	BJQOLYIXFJQOTR-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000598341605	357544624	/nfs/dbraw/zinc/54/46/24/357544624.db2.gz	DLSDZXKLYOUJAZ-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000598599434	357648686	/nfs/dbraw/zinc/64/86/86/357648686.db2.gz	OCIOIOVKVWRQLK-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000598599434	357648690	/nfs/dbraw/zinc/64/86/90/357648690.db2.gz	OCIOIOVKVWRQLK-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N(C)Cc2cnc[nH]2)c(C)c1[N+](=O)[O-]	ZINC000598613701	357653495	/nfs/dbraw/zinc/65/34/95/357653495.db2.gz	CMTOHELIJZEOID-UHFFFAOYSA-N	1	1	324.362	1.755	20	5		DDBDMO
COc1nc(C)cc(C)c1C[N@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000598649348	357670332	/nfs/dbraw/zinc/67/03/32/357670332.db2.gz	NXNRSXTVVAAKEJ-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
COc1nc(C)cc(C)c1C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000598649348	357670336	/nfs/dbraw/zinc/67/03/36/357670336.db2.gz	NXNRSXTVVAAKEJ-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
O=c1[nH]cccc1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000599009515	357792847	/nfs/dbraw/zinc/79/28/47/357792847.db2.gz	YYHOLERYEGQXPM-UHFFFAOYSA-N	1	1	317.301	1.756	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000599095298	357814359	/nfs/dbraw/zinc/81/43/59/357814359.db2.gz	DIQQNUKKSKIKJG-CYBMUJFWSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[N@@H+]1C2(CCC2)COC[C@@]1(CO)CNc1ccc([N+](=O)[O-])cc1	ZINC000599132125	357825102	/nfs/dbraw/zinc/82/51/02/357825102.db2.gz	XWHMXONGCCPPFF-INIZCTEOSA-N	1	1	321.377	1.623	20	5		DDBDMO
C[N@H+]1C2(CCC2)COC[C@@]1(CO)CNc1ccc([N+](=O)[O-])cc1	ZINC000599132125	357825104	/nfs/dbraw/zinc/82/51/04/357825104.db2.gz	XWHMXONGCCPPFF-INIZCTEOSA-N	1	1	321.377	1.623	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599673861	358019474	/nfs/dbraw/zinc/01/94/74/358019474.db2.gz	UMVSMCHSTQPNLN-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC1CC([NH+]2CCOCC2)C1	ZINC000600068909	358114121	/nfs/dbraw/zinc/11/41/21/358114121.db2.gz	MLOCCRCSTFHRNV-UHFFFAOYSA-N	1	1	319.361	1.117	20	5		DDBDMO
Cc1cc(C(=O)NC2CC([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000600069335	358114810	/nfs/dbraw/zinc/11/48/10/358114810.db2.gz	RCNQFSCZQBELKI-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600474007	358234920	/nfs/dbraw/zinc/23/49/20/358234920.db2.gz	WAYNTESQMBPCSP-LLVKDONJSA-N	1	1	307.354	1.373	20	5		DDBDMO
C[C@@H](Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C(=O)NCCF	ZINC000601162228	358427327	/nfs/dbraw/zinc/42/73/27/358427327.db2.gz	KMQCQKYIGYDIDV-SECBINFHSA-N	1	1	306.297	1.451	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](O)[C@@H](CO)C3)c2c1	ZINC000601175513	358433610	/nfs/dbraw/zinc/43/36/10/358433610.db2.gz	ICHDYARWBKHATG-MEBBXXQBSA-N	1	1	303.318	1.323	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC2(CCOCC2)C1	ZINC000602778111	359184793	/nfs/dbraw/zinc/18/47/93/359184793.db2.gz	BHMOQCBQHHDSJX-UHFFFAOYSA-N	1	1	308.382	1.992	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCc3nc(C4CC4)ncc3C2)c([N+](=O)[O-])n1	ZINC000602725251	359151758	/nfs/dbraw/zinc/15/17/58/359151758.db2.gz	KOQVRPAZNKLQLG-UHFFFAOYSA-N	1	1	314.349	1.554	20	5		DDBDMO
Cn1cc(C[N@H+]2CCc3nc(C4CC4)ncc3C2)c([N+](=O)[O-])n1	ZINC000602725251	359151759	/nfs/dbraw/zinc/15/17/59/359151759.db2.gz	KOQVRPAZNKLQLG-UHFFFAOYSA-N	1	1	314.349	1.554	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2ccccc2[C@@H]1CO	ZINC000602795557	359198293	/nfs/dbraw/zinc/19/82/93/359198293.db2.gz	MMLKLIFRRKOUJD-HNNXBMFYSA-N	1	1	316.361	1.691	20	5		DDBDMO
Cn1cc([C@@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C(C)(C)C)cn1	ZINC000602806014	359204093	/nfs/dbraw/zinc/20/40/93/359204093.db2.gz	RKFCKJABCGFTSC-GFCCVEGCSA-N	1	1	306.370	1.939	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602824935	359218331	/nfs/dbraw/zinc/21/83/31/359218331.db2.gz	FTCUBGLUAXIOBJ-ZDUSSCGKSA-N	1	1	323.397	1.480	20	5		DDBDMO
CO[C@@H]1[C@H]2C[C@H]3C[N@@H+](CCn4c(C)ncc4[N+](=O)[O-])[C@H]1[C@H]3C2	ZINC000602829545	359220994	/nfs/dbraw/zinc/22/09/94/359220994.db2.gz	LKQKWCGMQAZJOW-ZCRGAIPPSA-N	1	1	306.366	1.455	20	5		DDBDMO
C[C@](CO)(NCC[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1	ZINC000602963016	359326030	/nfs/dbraw/zinc/32/60/30/359326030.db2.gz	ROIRTBUMUCAAPI-MRXNPFEDSA-N	1	1	307.394	1.878	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@@H]4C[C@]4(O)C3)co2)cc1	ZINC000603085408	359394043	/nfs/dbraw/zinc/39/40/43/359394043.db2.gz	GCFHPCYFOGGDFM-NHYWBVRUSA-N	1	1	301.302	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@@H]4C[C@]4(O)C3)co2)cc1	ZINC000603085408	359394044	/nfs/dbraw/zinc/39/40/44/359394044.db2.gz	GCFHPCYFOGGDFM-NHYWBVRUSA-N	1	1	301.302	1.816	20	5		DDBDMO
CC1(C)[C@H](Nc2ncc([N+](=O)[O-])cn2)C[C@@H]1[NH+]1CCOCC1	ZINC000603400423	359616556	/nfs/dbraw/zinc/61/65/56/359616556.db2.gz	XBEXQESDPOCIIO-NEPJUHHUSA-N	1	1	307.354	1.296	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1O	ZINC000186861184	200023705	/nfs/dbraw/zinc/02/37/05/200023705.db2.gz	OWIIRDVAXMTBFR-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1O	ZINC000186861184	200023706	/nfs/dbraw/zinc/02/37/06/200023706.db2.gz	OWIIRDVAXMTBFR-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
Cn1cc(CN2CCC([C@H]3CCC[NH2+]C3)CC2)c([N+](=O)[O-])n1	ZINC000603428645	359635085	/nfs/dbraw/zinc/63/50/85/359635085.db2.gz	KUPMIBYDHRBWCQ-ZDUSSCGKSA-N	1	1	307.398	1.540	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000604523830	359761050	/nfs/dbraw/zinc/76/10/50/359761050.db2.gz	ULMVPSWUHPUPPY-UHFFFAOYSA-N	1	1	303.322	1.599	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000604543996	359763734	/nfs/dbraw/zinc/76/37/34/359763734.db2.gz	FJDTYCWNTWVAHV-CYBMUJFWSA-N	1	1	320.393	1.853	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609383577	360303032	/nfs/dbraw/zinc/30/30/32/360303032.db2.gz	VLZPNYQKZXMQQG-CYBMUJFWSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(C)(C)CO	ZINC000609894932	360362456	/nfs/dbraw/zinc/36/24/56/360362456.db2.gz	PCPPFRXPJSEGGH-UHFFFAOYSA-N	1	1	323.349	1.596	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH+]1CCN(c2ccccn2)CC1	ZINC000610664358	360494756	/nfs/dbraw/zinc/49/47/56/360494756.db2.gz	GYZZDAJPZSHTCP-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
C[C@@H](NC(=O)CN1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000611408035	360712557	/nfs/dbraw/zinc/71/25/57/360712557.db2.gz	GADOGLGGRQTVMG-GFCCVEGCSA-N	1	1	306.366	1.019	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CC[N@H+]1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000611409206	360713377	/nfs/dbraw/zinc/71/33/77/360713377.db2.gz	KJJMGUNRHZTBCG-CALCHBBNSA-N	1	1	317.389	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CC[N@@H+]1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000611409206	360713382	/nfs/dbraw/zinc/71/33/82/360713382.db2.gz	KJJMGUNRHZTBCG-CALCHBBNSA-N	1	1	317.389	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCN1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000611409206	360713388	/nfs/dbraw/zinc/71/33/88/360713388.db2.gz	KJJMGUNRHZTBCG-CALCHBBNSA-N	1	1	317.389	1.816	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCN1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000611409206	360713394	/nfs/dbraw/zinc/71/33/94/360713394.db2.gz	KJJMGUNRHZTBCG-CALCHBBNSA-N	1	1	317.389	1.816	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC[NH+](C)CC1	ZINC000193321978	201028961	/nfs/dbraw/zinc/02/89/61/201028961.db2.gz	HUBAPWKLWLNPRY-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
Cc1c(CC(=O)NCC2=CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000271875893	209288838	/nfs/dbraw/zinc/28/88/38/209288838.db2.gz	MHSUMABSKCCOAB-UHFFFAOYSA-N	1	1	303.362	1.824	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000619566958	364063854	/nfs/dbraw/zinc/06/38/54/364063854.db2.gz	CUDBQUSFACCPNA-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000275043823	212090619	/nfs/dbraw/zinc/09/06/19/212090619.db2.gz	YMCJDXKWXPGWCZ-JTQLQIEISA-N	1	1	300.318	1.797	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000275043823	212090620	/nfs/dbraw/zinc/09/06/20/212090620.db2.gz	YMCJDXKWXPGWCZ-JTQLQIEISA-N	1	1	300.318	1.797	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000264990695	204328003	/nfs/dbraw/zinc/32/80/03/204328003.db2.gz	JRZYXSUNHLXCIC-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000265032571	204356974	/nfs/dbraw/zinc/35/69/74/204356974.db2.gz	XOXVZKJKCPBUIV-NSHDSACASA-N	1	1	309.370	1.621	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1nncs1)c1ccccc1[N+](=O)[O-]	ZINC000271726009	209160020	/nfs/dbraw/zinc/16/00/20/209160020.db2.gz	LYAXHKWGIATAND-QMMMGPOBSA-N	1	1	307.335	1.736	20	5		DDBDMO
CC(C)[C@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200778	284308362	/nfs/dbraw/zinc/30/83/62/284308362.db2.gz	JOUNYNDRUJWCDV-GOEBONIOSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200778	284308366	/nfs/dbraw/zinc/30/83/66/284308366.db2.gz	JOUNYNDRUJWCDV-GOEBONIOSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)c1	ZINC000266185631	205167299	/nfs/dbraw/zinc/16/72/99/205167299.db2.gz	CWNDUMWKTNONQB-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)c1	ZINC000266185631	205167300	/nfs/dbraw/zinc/16/73/00/205167300.db2.gz	CWNDUMWKTNONQB-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2C)CC[N@H+]1C[C@@H](C)O	ZINC000266309705	205255531	/nfs/dbraw/zinc/25/55/31/205255531.db2.gz	DIKFHRDHFWDIDC-CHWSQXEVSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cc1ccc(CN2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000284432073	218024630	/nfs/dbraw/zinc/02/46/30/218024630.db2.gz	SBADETLVKFJRMB-UONOGXRCSA-N	1	1	307.394	1.790	20	5		DDBDMO
O=C(CC[N@@H+]1CCn2cnnc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000105879309	194154909	/nfs/dbraw/zinc/15/49/09/194154909.db2.gz	ZCBLZORFVVJMJK-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(CC[N@H+]1CCn2cnnc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000105879309	194154911	/nfs/dbraw/zinc/15/49/11/194154911.db2.gz	ZCBLZORFVVJMJK-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000110993483	194378967	/nfs/dbraw/zinc/37/89/67/194378967.db2.gz	MOQSWZAKBIBYSD-GFCCVEGCSA-N	1	1	323.397	1.517	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000110994214	194379574	/nfs/dbraw/zinc/37/95/74/194379574.db2.gz	QWOLEIHLDBJRKO-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cc1ccncc1N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000340515918	251094062	/nfs/dbraw/zinc/09/40/62/251094062.db2.gz	HEFLWVVFHUCITF-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000340859523	251247400	/nfs/dbraw/zinc/24/74/00/251247400.db2.gz	AWDODEZJQVPUMY-LLVKDONJSA-N	1	1	311.386	1.013	20	5		DDBDMO
CC[C@@]1(C)COCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871831	251254080	/nfs/dbraw/zinc/25/40/80/251254080.db2.gz	CXSDYYZHWCYEMM-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)COCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871831	251254082	/nfs/dbraw/zinc/25/40/82/251254082.db2.gz	CXSDYYZHWCYEMM-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C1OCC[C@H]1CC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298218010	284953573	/nfs/dbraw/zinc/95/35/73/284953573.db2.gz	ZWJZKOABTIJDJQ-GFCCVEGCSA-N	1	1	320.349	1.065	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(N3CC[N@H+]4CCC[C@@H]4C3)n2)cc1	ZINC000486955869	285106894	/nfs/dbraw/zinc/10/68/94/285106894.db2.gz	MDKIUHFPLHVWCB-CYBMUJFWSA-N	1	1	315.333	1.929	20	5		DDBDMO
COCCCNC(=O)[C@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352571842	285149069	/nfs/dbraw/zinc/14/90/69/285149069.db2.gz	ZNYMZOJAPRSOJY-ZDUSSCGKSA-N	1	1	323.393	1.610	20	5		DDBDMO
COCCCNC(=O)[C@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352571842	285149073	/nfs/dbraw/zinc/14/90/73/285149073.db2.gz	ZNYMZOJAPRSOJY-ZDUSSCGKSA-N	1	1	323.393	1.610	20	5		DDBDMO
C[N@H+]([C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)[C@H]1CCC[C@@H]1O	ZINC000352668262	285211206	/nfs/dbraw/zinc/21/12/06/285211206.db2.gz	QQJFICOFDACSCV-ZNMIVQPWSA-N	1	1	319.361	1.545	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1	ZINC000294710135	224184872	/nfs/dbraw/zinc/18/48/72/224184872.db2.gz	BLJBJPPVTQTAMZ-SZTZYQKNSA-N	1	1	307.325	1.768	20	5		DDBDMO
C[C@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C[NH+](C)C	ZINC001120489016	781980084	/nfs/dbraw/zinc/98/00/84/781980084.db2.gz	MEGIXRQYSVWZEM-CHWSQXEVSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@H](C[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-])CN(C)C	ZINC001120489016	781980088	/nfs/dbraw/zinc/98/00/88/781980088.db2.gz	MEGIXRQYSVWZEM-CHWSQXEVSA-N	1	1	311.382	1.122	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000068127854	406617263	/nfs/dbraw/zinc/61/72/63/406617263.db2.gz	RHEHVWMHXDZOMU-UHFFFAOYSA-N	1	1	306.366	1.561	20	5		DDBDMO
CN(C)C(=O)C[N@@H+]1CCCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000029845363	406927853	/nfs/dbraw/zinc/92/78/53/406927853.db2.gz	UIKWTLPFAQOLSN-UHFFFAOYSA-N	1	1	320.393	1.191	20	5		DDBDMO
CN(C)C(=O)C[N@H+]1CCCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000029845363	406927855	/nfs/dbraw/zinc/92/78/55/406927855.db2.gz	UIKWTLPFAQOLSN-UHFFFAOYSA-N	1	1	320.393	1.191	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000075953145	406947568	/nfs/dbraw/zinc/94/75/68/406947568.db2.gz	VHEQOXDIMDCIKB-CQSZACIVSA-N	1	1	324.377	1.959	20	5		DDBDMO
CCCC[N@@H+](CCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000079982974	407067272	/nfs/dbraw/zinc/06/72/72/407067272.db2.gz	BKFDMJCLUAIIOV-UHFFFAOYSA-N	1	1	321.377	1.578	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000054942811	407191000	/nfs/dbraw/zinc/19/10/00/407191000.db2.gz	KTPHMYPUKUMJCI-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000102332300	407321556	/nfs/dbraw/zinc/32/15/56/407321556.db2.gz	VKHAWOBRMHBUEZ-GFCCVEGCSA-N	1	1	323.397	1.375	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-]	ZINC000123361388	407326888	/nfs/dbraw/zinc/32/68/88/407326888.db2.gz	NLBNAQXTZWUNSH-JTQLQIEISA-N	1	1	321.337	1.262	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@H](CNC(C)=O)C2)cc1[N+](=O)[O-]	ZINC000067413312	407273326	/nfs/dbraw/zinc/27/33/26/407273326.db2.gz	VQMCARDKTQOSFQ-CQSZACIVSA-N	1	1	321.377	1.952	20	5		DDBDMO
CC(C)[N@H+](CCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000170695029	407477612	/nfs/dbraw/zinc/47/76/12/407477612.db2.gz	OBFAYWBDEZXTAJ-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC(C)[N@@H+](CCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000170695029	407477616	/nfs/dbraw/zinc/47/76/16/407477616.db2.gz	OBFAYWBDEZXTAJ-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@@H]1CN(c2c([N+](=O)[O-])c(C)nn2C)CC[N@H+]1CCOC	ZINC000114709540	407603487	/nfs/dbraw/zinc/60/34/87/407603487.db2.gz	DWLIASOEEWXZNS-GFCCVEGCSA-N	1	1	311.386	1.184	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000171199284	407627737	/nfs/dbraw/zinc/62/77/37/407627737.db2.gz	WPBRHQNSJOCWDS-LBPRGKRZSA-N	1	1	324.381	1.533	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[NH2+]C1	ZINC000178891380	407644339	/nfs/dbraw/zinc/64/43/39/407644339.db2.gz	NTLIJMQGVCYXMO-LLVKDONJSA-N	1	1	317.349	1.685	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000189486491	408032496	/nfs/dbraw/zinc/03/24/96/408032496.db2.gz	VQEKHYYIBLFFSD-NEPJUHHUSA-N	1	1	320.349	1.394	20	5		DDBDMO
C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(CO)CO	ZINC000135854328	408058068	/nfs/dbraw/zinc/05/80/68/408058068.db2.gz	NCEZOILUWMPDMC-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(CO)CO	ZINC000135854328	408058073	/nfs/dbraw/zinc/05/80/73/408058073.db2.gz	NCEZOILUWMPDMC-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1(CO)CC1	ZINC000190011676	408145149	/nfs/dbraw/zinc/14/51/49/408145149.db2.gz	DZRAXJRNFNWLPI-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1(CO)CC1	ZINC000190011676	408145155	/nfs/dbraw/zinc/14/51/55/408145155.db2.gz	DZRAXJRNFNWLPI-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C(C)C)C[C@@H]1C	ZINC000155339444	408156345	/nfs/dbraw/zinc/15/63/45/408156345.db2.gz	XZVMHIZQSMTWGO-HZMBPMFUSA-N	1	1	306.366	1.757	20	5		DDBDMO
CCN1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])c(C)n3)C2)CC1	ZINC000150794259	408202419	/nfs/dbraw/zinc/20/24/19/408202419.db2.gz	PNSAVYVBXLQJAL-AWEZNQCLSA-N	1	1	319.409	1.514	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCC(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC000156992466	408284105	/nfs/dbraw/zinc/28/41/05/408284105.db2.gz	YDLUCOAHLCARIA-UHFFFAOYSA-N	1	1	320.353	1.318	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@@H](C)[NH+]1CCOCC1	ZINC000264187217	408395749	/nfs/dbraw/zinc/39/57/49/408395749.db2.gz	BVPFWGWOYKKRHJ-NXEZZACHSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177052884	408508790	/nfs/dbraw/zinc/50/87/90/408508790.db2.gz	MAQJNIZZMIJFJP-YPMHNXCESA-N	1	1	303.362	1.879	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177131078	408527364	/nfs/dbraw/zinc/52/73/64/408527364.db2.gz	IPPDAVNWHXXDAH-AAEUAGOBSA-N	1	1	303.362	1.879	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000192150091	408550296	/nfs/dbraw/zinc/55/02/96/408550296.db2.gz	XTDHZEGWSRCGDX-OLZOCXBDSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000248374107	408552851	/nfs/dbraw/zinc/55/28/51/408552851.db2.gz	NVWLNCNRYMMPAR-JHJVBQTASA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000248374107	408552854	/nfs/dbraw/zinc/55/28/54/408552854.db2.gz	NVWLNCNRYMMPAR-JHJVBQTASA-N	1	1	310.350	1.444	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@H]1O	ZINC000248374143	408553482	/nfs/dbraw/zinc/55/34/82/408553482.db2.gz	NZUIBEWWRDPCIU-KCQAQPDRSA-N	1	1	324.377	1.427	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2ccc([N+](=O)[O-])cc2F)n1C	ZINC000265123239	408561335	/nfs/dbraw/zinc/56/13/35/408561335.db2.gz	OIBRVRHTONSYIB-UHFFFAOYSA-N	1	1	321.312	1.463	20	5		DDBDMO
C[C@@H](CCN1CC[NH+](C)CC1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000184290838	408585885	/nfs/dbraw/zinc/58/58/85/408585885.db2.gz	YYSXZEVXPWQYQL-ZDUSSCGKSA-N	1	1	320.393	1.351	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)C1	ZINC000264565782	408537680	/nfs/dbraw/zinc/53/76/80/408537680.db2.gz	RJXAEXUGQGTIMW-LBPRGKRZSA-N	1	1	307.350	1.354	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000192528849	408606351	/nfs/dbraw/zinc/60/63/51/408606351.db2.gz	NSUXNQQTATYPGL-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000265389652	408632189	/nfs/dbraw/zinc/63/21/89/408632189.db2.gz	BZDZHYNSFVCKOU-ZDUSSCGKSA-N	1	1	322.365	1.745	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000270848153	408706355	/nfs/dbraw/zinc/70/63/55/408706355.db2.gz	GGODDCBHAVZKGY-ZOWXZIJZSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000270848153	408706360	/nfs/dbraw/zinc/70/63/60/408706360.db2.gz	GGODDCBHAVZKGY-ZOWXZIJZSA-N	1	1	321.377	1.933	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000270874706	408720607	/nfs/dbraw/zinc/72/06/07/408720607.db2.gz	JQFSYHUUKMGFMZ-HUUCEWRRSA-N	1	1	319.361	1.325	20	5		DDBDMO
CNC(=O)c1ccc(N(C)CC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000184788441	408687362	/nfs/dbraw/zinc/68/73/62/408687362.db2.gz	DUQFBQVGOKLVCR-UHFFFAOYSA-N	1	1	306.366	1.485	20	5		DDBDMO
CCc1ccc([C@@H](COC)[NH2+]CCn2ccc([N+](=O)[O-])n2)o1	ZINC000184794181	408690528	/nfs/dbraw/zinc/69/05/28/408690528.db2.gz	ITPBTXHVQGWQDD-GFCCVEGCSA-N	1	1	308.338	1.924	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000183198460	162844278	/nfs/dbraw/zinc/84/42/78/162844278.db2.gz	KUASMYUWIGSIRS-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000183198460	162844281	/nfs/dbraw/zinc/84/42/81/162844281.db2.gz	KUASMYUWIGSIRS-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@@H+](C)CC1	ZINC000281313223	408880066	/nfs/dbraw/zinc/88/00/66/408880066.db2.gz	ZSCVOKNKRXADFO-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](C)CCCCO)cccc1[N+](=O)[O-]	ZINC000276369655	408844421	/nfs/dbraw/zinc/84/44/21/408844421.db2.gz	JRONFYXQVUVSMN-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc(N)cc1[N+](=O)[O-]	ZINC000286147083	408930835	/nfs/dbraw/zinc/93/08/35/408930835.db2.gz	IIKGAEUIPFQWHE-UHFFFAOYSA-N	1	1	322.409	1.972	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C2(CCCCC2)C1	ZINC000286267723	408952044	/nfs/dbraw/zinc/95/20/44/408952044.db2.gz	VILSNPBWNWBFSK-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292126286	408985819	/nfs/dbraw/zinc/98/58/19/408985819.db2.gz	GXCNGAITXYUACP-MRXNPFEDSA-N	1	1	303.362	1.692	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1c2c(ccc1[N+](=O)[O-])NCC2	ZINC000278483365	409084477	/nfs/dbraw/zinc/08/44/77/409084477.db2.gz	VPGSPOJZVOEPRR-LLVKDONJSA-N	1	1	305.382	1.221	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000279125043	409153422	/nfs/dbraw/zinc/15/34/22/409153422.db2.gz	VFTXBLPRROWMNH-ZUZCIYMTSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000279125043	409153427	/nfs/dbraw/zinc/15/34/27/409153427.db2.gz	VFTXBLPRROWMNH-ZUZCIYMTSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@@H](NC[C@H]1C[N@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668339	409157893	/nfs/dbraw/zinc/15/78/93/409157893.db2.gz	JPMLFWIXVHELFN-YPMHNXCESA-N	1	1	307.398	1.073	20	5		DDBDMO
C[C@@H](NC[C@H]1C[N@@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668339	409157895	/nfs/dbraw/zinc/15/78/95/409157895.db2.gz	JPMLFWIXVHELFN-YPMHNXCESA-N	1	1	307.398	1.073	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[NH+](C)CC1	ZINC000184794997	306714839	/nfs/dbraw/zinc/71/48/39/306714839.db2.gz	TYMZSDMZHOTTDY-ZDUSSCGKSA-N	1	1	320.393	1.786	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)C2)C1	ZINC000294096096	409239621	/nfs/dbraw/zinc/23/96/21/409239621.db2.gz	KMHJTBZXUVJSQB-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355640	409298012	/nfs/dbraw/zinc/29/80/12/409298012.db2.gz	INBBEKHMKYFMFE-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355640	409298015	/nfs/dbraw/zinc/29/80/15/409298015.db2.gz	INBBEKHMKYFMFE-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000317417112	164026832	/nfs/dbraw/zinc/02/68/32/164026832.db2.gz	YIWQBNGOTMTALC-MNOVXSKESA-N	1	1	304.350	1.534	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000321979917	164046267	/nfs/dbraw/zinc/04/62/67/164046267.db2.gz	OZBQQPQKLNAFRU-NWDGAFQWSA-N	1	1	323.324	1.327	20	5		DDBDMO
COC(=O)Cc1ccc(NCC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000295495614	409505142	/nfs/dbraw/zinc/50/51/42/409505142.db2.gz	KICXDAZGJQNEOS-UHFFFAOYSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000342426594	409620934	/nfs/dbraw/zinc/62/09/34/409620934.db2.gz	DTFOVKLGRMLNDB-PELKAZGASA-N	1	1	318.782	1.771	20	5		DDBDMO
Cc1nc(N2CCC[C@@H](C[NH+]3CCOCC3)C2)ncc1[N+](=O)[O-]	ZINC000296718961	409634635	/nfs/dbraw/zinc/63/46/35/409634635.db2.gz	HEICPGBQNQQSNJ-ZDUSSCGKSA-N	1	1	321.381	1.242	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356749527	409572454	/nfs/dbraw/zinc/57/24/54/409572454.db2.gz	XOBUIDNKTQIXFX-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccon1	ZINC000349245483	409764273	/nfs/dbraw/zinc/76/42/73/409764273.db2.gz	RLKKTMFBUXWDFM-JQWIXIFHSA-N	1	1	307.306	1.673	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1OC	ZINC000357170830	409918472	/nfs/dbraw/zinc/91/84/72/409918472.db2.gz	LVSIYPWRGBOAMY-SNVBAGLBSA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1OC	ZINC000357170830	409918476	/nfs/dbraw/zinc/91/84/76/409918476.db2.gz	LVSIYPWRGBOAMY-SNVBAGLBSA-N	1	1	323.349	1.388	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC1	ZINC000342869424	409963285	/nfs/dbraw/zinc/96/32/85/409963285.db2.gz	XWEUWJPIOUUALH-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239816	410007544	/nfs/dbraw/zinc/00/75/44/410007544.db2.gz	IOIPQZRZMLZKKB-ZJUUUORDSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000332239816	410007551	/nfs/dbraw/zinc/00/75/51/410007551.db2.gz	IOIPQZRZMLZKKB-ZJUUUORDSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239816	410007559	/nfs/dbraw/zinc/00/75/59/410007559.db2.gz	IOIPQZRZMLZKKB-ZJUUUORDSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)C[N@H+]1C	ZINC000332228478	409995679	/nfs/dbraw/zinc/99/56/79/409995679.db2.gz	LIEXJGVTLDXTAY-MNOVXSKESA-N	1	1	303.366	1.996	20	5		DDBDMO
C[C@@H]1CN(c2ncnc3sc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000343024201	410082311	/nfs/dbraw/zinc/08/23/11/410082311.db2.gz	DDGHKDFASFCQEC-SECBINFHSA-N	1	1	323.378	1.102	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCC(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC000355028105	410251140	/nfs/dbraw/zinc/25/11/40/410251140.db2.gz	QDFQFQDEKPRIHB-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)[C@H](O)C1	ZINC000351776427	410224090	/nfs/dbraw/zinc/22/40/90/410224090.db2.gz	BAXXJDIMACJHPG-GXFFZTMASA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000351959191	410371716	/nfs/dbraw/zinc/37/17/16/410371716.db2.gz	NVEPXUQRWPCOJR-JOYOIKCWSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000351959191	410371721	/nfs/dbraw/zinc/37/17/21/410371721.db2.gz	NVEPXUQRWPCOJR-JOYOIKCWSA-N	1	1	304.306	1.457	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000355351923	410463103	/nfs/dbraw/zinc/46/31/03/410463103.db2.gz	UYRLUIOKSDHMQK-HUUCEWRRSA-N	1	1	319.361	1.530	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](CO)CC1	ZINC000339747524	410433831	/nfs/dbraw/zinc/43/38/31/410433831.db2.gz	KQISYMVEZCRLMO-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](CO)CC1	ZINC000339747524	410433834	/nfs/dbraw/zinc/43/38/34/410433834.db2.gz	KQISYMVEZCRLMO-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+](CCO)[C@H](C)C1	ZINC000347387462	410514806	/nfs/dbraw/zinc/51/48/06/410514806.db2.gz	ZWBCDWJGGLZYMM-YVGNARHYSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN(CCO)[C@H](C)C1	ZINC000347387462	410514817	/nfs/dbraw/zinc/51/48/17/410514817.db2.gz	ZWBCDWJGGLZYMM-YVGNARHYSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCN(CCO)[C@H](C)C1	ZINC000347387462	410514820	/nfs/dbraw/zinc/51/48/20/410514820.db2.gz	ZWBCDWJGGLZYMM-YVGNARHYSA-N	1	1	319.405	1.997	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000339953017	410573369	/nfs/dbraw/zinc/57/33/69/410573369.db2.gz	MQVOTKDXQMPIBH-NWDGAFQWSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2c(N)cccc2[N+](=O)[O-])CC1	ZINC000355545866	410574548	/nfs/dbraw/zinc/57/45/48/410574548.db2.gz	MCZUJJWOCFJVLB-UHFFFAOYSA-N	1	1	304.350	1.559	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000355592620	410595666	/nfs/dbraw/zinc/59/56/66/410595666.db2.gz	YUMCSRBFQVGRRP-LBPRGKRZSA-N	1	1	321.381	1.344	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C[C@@H](C)O	ZINC000352203662	410543928	/nfs/dbraw/zinc/54/39/28/410543928.db2.gz	ULBARGKSGKWQNN-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H](C)O	ZINC000352213155	410550978	/nfs/dbraw/zinc/55/09/78/410550978.db2.gz	UAQCPEISNQUYMV-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C[C@H](C)O	ZINC000352213155	410550982	/nfs/dbraw/zinc/55/09/82/410550982.db2.gz	UAQCPEISNQUYMV-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000352362213	410646627	/nfs/dbraw/zinc/64/66/27/410646627.db2.gz	VBKYGELFFKIBLC-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000352362213	410646632	/nfs/dbraw/zinc/64/66/32/410646632.db2.gz	VBKYGELFFKIBLC-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[N@@H+](CCNc1ncc([N+](=O)[O-])cc1C(N)=O)C1CCCCC1	ZINC000301104879	410658736	/nfs/dbraw/zinc/65/87/36/410658736.db2.gz	JBUBFJCVFUBVMC-UHFFFAOYSA-N	1	1	321.381	1.765	20	5		DDBDMO
Cc1nc(N2CCC[C@@H]2C[N@H+]2CCC[C@@H]2CO)ccc1[N+](=O)[O-]	ZINC000301662802	410765866	/nfs/dbraw/zinc/76/58/66/410765866.db2.gz	NDSWHYVPUMRNEH-ZIAGYGMSSA-N	1	1	320.393	1.724	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])c4cccnc43)C[C@@H]21	ZINC000301692305	410773243	/nfs/dbraw/zinc/77/32/43/410773243.db2.gz	ZDGNQSLMJRHHPY-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
CNS(=O)(=O)C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000330603270	410816850	/nfs/dbraw/zinc/81/68/50/410816850.db2.gz	FVUUOFNFXQQKCX-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNS(=O)(=O)C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000330603270	410816852	/nfs/dbraw/zinc/81/68/52/410816852.db2.gz	FVUUOFNFXQQKCX-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000301890184	410823656	/nfs/dbraw/zinc/82/36/56/410823656.db2.gz	TWUVLKJBCHORFP-NSHDSACASA-N	1	1	304.354	1.416	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@@H]21	ZINC000301965062	410836551	/nfs/dbraw/zinc/83/65/51/410836551.db2.gz	NYLVWFLPOBHREF-NEPJUHHUSA-N	1	1	316.365	1.558	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)CCO1	ZINC000302127762	410838390	/nfs/dbraw/zinc/83/83/90/410838390.db2.gz	XALKXEMOLQWYHK-LLVKDONJSA-N	1	1	307.354	1.074	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000330678592	410871894	/nfs/dbraw/zinc/87/18/94/410871894.db2.gz	WOKAKWFLHMQUIE-JTQLQIEISA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000330678592	410871898	/nfs/dbraw/zinc/87/18/98/410871898.db2.gz	WOKAKWFLHMQUIE-JTQLQIEISA-N	1	1	323.349	1.388	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882404	410902624	/nfs/dbraw/zinc/90/26/24/410902624.db2.gz	ZSFLJIARVHBWQJ-WDEREUQCSA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](C)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882404	410902626	/nfs/dbraw/zinc/90/26/26/410902626.db2.gz	ZSFLJIARVHBWQJ-WDEREUQCSA-N	1	1	309.341	2.000	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344038837	410912253	/nfs/dbraw/zinc/91/22/53/410912253.db2.gz	GKCPKLRRRBTWPL-LNSITVRQSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344038837	410912254	/nfs/dbraw/zinc/91/22/54/410912254.db2.gz	GKCPKLRRRBTWPL-LNSITVRQSA-N	1	1	319.361	1.544	20	5		DDBDMO
C[C@@H](CCO)[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353517115	411043193	/nfs/dbraw/zinc/04/31/93/411043193.db2.gz	HWKBFRDCOHXWKP-SMDDNHRTSA-N	1	1	304.350	1.778	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356464314	411044434	/nfs/dbraw/zinc/04/44/34/411044434.db2.gz	JQELRXYHYOSWSK-NSHDSACASA-N	1	1	309.370	1.323	20	5		DDBDMO
Cn1ccnc1[C@H](NCC[NH+]1CCC1)c1cccc([N+](=O)[O-])c1	ZINC000353646694	411097977	/nfs/dbraw/zinc/09/79/77/411097977.db2.gz	QRRPWVJMHMVWRO-OAHLLOKOSA-N	1	1	315.377	1.713	20	5		DDBDMO
Cn1ccnc1[C@H](NCC[NH+]1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000353649624	411098452	/nfs/dbraw/zinc/09/84/52/411098452.db2.gz	YJWKPGVHERFRHF-OAHLLOKOSA-N	1	1	315.377	1.713	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000356590853	411100088	/nfs/dbraw/zinc/10/00/88/411100088.db2.gz	CDOYAWUZRFZCAX-JTQLQIEISA-N	1	1	309.370	1.422	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000134119510	196363510	/nfs/dbraw/zinc/36/35/10/196363510.db2.gz	IZJJGUPQFPVGAV-LBPRGKRZSA-N	1	1	307.350	1.293	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@]2(CC[NH2+]C2)C1	ZINC000360831959	418528251	/nfs/dbraw/zinc/52/82/51/418528251.db2.gz	JVFRDCCCWCPGKU-OAHLLOKOSA-N	1	1	315.333	1.297	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000361093894	418581919	/nfs/dbraw/zinc/58/19/19/418581919.db2.gz	DEIORGBWFVTEBN-UHFFFAOYSA-N	1	1	318.337	1.486	20	5		DDBDMO
[NH3+][C@@H]1C[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000375250850	418621859	/nfs/dbraw/zinc/62/18/59/418621859.db2.gz	PWBOEISNZFXOGI-OWUUHHOZSA-N	1	1	315.333	1.565	20	5		DDBDMO
CCn1nccc1C[N@@H+](CCO)CCc1ccc([N+](=O)[O-])cc1	ZINC000361362283	418636216	/nfs/dbraw/zinc/63/62/16/418636216.db2.gz	QTZIMWZZUSOCTE-UHFFFAOYSA-N	1	1	318.377	1.848	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000385849879	418738177	/nfs/dbraw/zinc/73/81/77/418738177.db2.gz	XKTKIJCYDLWFLX-QWHCGFSZSA-N	1	1	307.350	1.287	20	5		DDBDMO
CC(C)CNC(=O)[C@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290153	418851566	/nfs/dbraw/zinc/85/15/66/418851566.db2.gz	VRYMMDBOGHEVIL-QWHCGFSZSA-N	1	1	323.397	1.589	20	5		DDBDMO
CC(C)CNC(=O)[C@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290153	418851569	/nfs/dbraw/zinc/85/15/69/418851569.db2.gz	VRYMMDBOGHEVIL-QWHCGFSZSA-N	1	1	323.397	1.589	20	5		DDBDMO
CC(C)CNC(=O)[C@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290154	418851672	/nfs/dbraw/zinc/85/16/72/418851672.db2.gz	VRYMMDBOGHEVIL-STQMWFEESA-N	1	1	323.397	1.589	20	5		DDBDMO
CC(C)CNC(=O)[C@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290154	418851673	/nfs/dbraw/zinc/85/16/73/418851673.db2.gz	VRYMMDBOGHEVIL-STQMWFEESA-N	1	1	323.397	1.589	20	5		DDBDMO
CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@@H]1CCC[N@H+]1C	ZINC000420991713	419428793	/nfs/dbraw/zinc/42/87/93/419428793.db2.gz	ALMKDELMWJXZSQ-LBPRGKRZSA-N	1	1	303.366	1.997	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000411946398	419514518	/nfs/dbraw/zinc/51/45/18/419514518.db2.gz	SKMHUWOCPHSOQE-GFCCVEGCSA-N	1	1	307.350	1.384	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000412037968	419584481	/nfs/dbraw/zinc/58/44/81/419584481.db2.gz	NYJKOKVLTPWQKH-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[NH+](C2CC2)CC1	ZINC000299374601	229082640	/nfs/dbraw/zinc/08/26/40/229082640.db2.gz	SARLXVNZOIBSSU-UHFFFAOYSA-N	1	1	314.345	1.996	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)C1CCOCC1	ZINC000430198633	420089730	/nfs/dbraw/zinc/08/97/30/420089730.db2.gz	ZDTNQJLAQURPGQ-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1CC(N)=O	ZINC000430226175	420092523	/nfs/dbraw/zinc/09/25/23/420092523.db2.gz	MNTUBLDRMSCTJE-GFCCVEGCSA-N	1	1	307.350	1.833	20	5		DDBDMO
[NH3+]C[C@@H]1CCN(CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000430928868	420210630	/nfs/dbraw/zinc/21/06/30/420210630.db2.gz	VCYINTQIYAWDDN-NSHDSACASA-N	1	1	320.349	1.173	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@H]2[C@@H](C)NCC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000420364684	420239591	/nfs/dbraw/zinc/23/95/91/420239591.db2.gz	KLBYWHVIRVIXEP-HWWQOWPSSA-N	1	1	323.393	1.958	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1	ZINC000436338278	420321855	/nfs/dbraw/zinc/32/18/55/420321855.db2.gz	BRHJFFAQOSAFRF-LLVKDONJSA-N	1	1	320.271	1.487	20	5		DDBDMO
CO[C@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000425417022	420379900	/nfs/dbraw/zinc/37/99/00/420379900.db2.gz	MCMKCXUHJTZZNE-GXTWGEPZSA-N	1	1	306.366	1.901	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000420766109	420384168	/nfs/dbraw/zinc/38/41/68/420384168.db2.gz	LWBQONSKGARSOZ-LBPRGKRZSA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@H]([C@H](C)Nc1ccc2ncc([N+](=O)[O-])n2n1)[NH+]1CCOCC1	ZINC000301959862	230004597	/nfs/dbraw/zinc/00/45/97/230004597.db2.gz	HIDUFXOOPKJATL-WDEREUQCSA-N	1	1	320.353	1.159	20	5		DDBDMO
COC[C@H](C)OC[C@@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315461	230362981	/nfs/dbraw/zinc/36/29/81/230362981.db2.gz	QPCFGKMJVSJFRL-LRDDRELGSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@H](C)OC[C@@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315461	230362982	/nfs/dbraw/zinc/36/29/82/230362982.db2.gz	QPCFGKMJVSJFRL-LRDDRELGSA-N	1	1	324.377	1.365	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(N)c2F)C[C@H](C)[N@H+]1CCO	ZINC000450800294	420534057	/nfs/dbraw/zinc/53/40/57/420534057.db2.gz	YRGVWOAUROKZGA-AOOOYVTPSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(N)c2F)C[C@H](C)[N@@H+]1CCO	ZINC000450800294	420534061	/nfs/dbraw/zinc/53/40/61/420534061.db2.gz	YRGVWOAUROKZGA-AOOOYVTPSA-N	1	1	312.345	1.207	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000457079743	420604656	/nfs/dbraw/zinc/60/46/56/420604656.db2.gz	SMHFVHUJNCBOGN-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000454276411	420829215	/nfs/dbraw/zinc/82/92/15/420829215.db2.gz	ORRBBUICXQUKKD-CQSZACIVSA-N	1	1	322.365	1.563	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000455183209	420979725	/nfs/dbraw/zinc/97/97/25/420979725.db2.gz	PAMTXLWHZCCQHK-NSHDSACASA-N	1	1	321.381	1.493	20	5		DDBDMO
COc1nccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000449289555	420984053	/nfs/dbraw/zinc/98/40/53/420984053.db2.gz	UGAWOCCVSVTLMX-UHFFFAOYSA-N	1	1	318.337	1.427	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000487948945	421060223	/nfs/dbraw/zinc/06/02/23/421060223.db2.gz	MYWBOJQSNDAASZ-JSGCOSHPSA-N	1	1	305.378	1.793	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@@H+](C)C2CCCC2)ccc1[N+](=O)[O-]	ZINC000455458600	421018213	/nfs/dbraw/zinc/01/82/13/421018213.db2.gz	DZBNNIKAURRXOI-UHFFFAOYSA-N	1	1	321.381	1.636	20	5		DDBDMO
Cc1cc(F)ccc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000488014529	421063278	/nfs/dbraw/zinc/06/32/78/421063278.db2.gz	ZBEDDJMRCWEWRA-HNNXBMFYSA-N	1	1	322.340	1.732	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000490295327	421191905	/nfs/dbraw/zinc/19/19/05/421191905.db2.gz	BRQCPOPSCUCPQD-CYBMUJFWSA-N	1	1	306.366	1.589	20	5		DDBDMO
Cc1nc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450539285	421207513	/nfs/dbraw/zinc/20/75/13/421207513.db2.gz	JMAMGXCROZNZDX-DMDPSCGWSA-N	1	1	305.382	1.860	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000525620062	421293389	/nfs/dbraw/zinc/29/33/89/421293389.db2.gz	ZESTYBXVEDMQJH-VHSXEESVSA-N	1	1	321.333	1.536	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@@H](n3c[nH+]c4c3CCCC4)C2)nc1	ZINC000548006334	421388328	/nfs/dbraw/zinc/38/83/28/421388328.db2.gz	DVPJAHYPMCAGQA-LLVKDONJSA-N	1	1	314.349	1.912	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1c1ccc(C(=O)NC)cc1[N+](=O)[O-]	ZINC000549654220	421503492	/nfs/dbraw/zinc/50/34/92/421503492.db2.gz	NLFPQSMCKVBFLA-LBPRGKRZSA-N	1	1	306.366	1.485	20	5		DDBDMO
[NH3+]C[C@H]1CN(Cc2ccccc2[N+](=O)[O-])CC12CCOCC2	ZINC000519659614	421714398	/nfs/dbraw/zinc/71/43/98/421714398.db2.gz	XIYRINPFFLKADM-AWEZNQCLSA-N	1	1	305.378	1.782	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H](CO)COC(C)C)cc1[N+](=O)[O-]	ZINC000519853577	421734610	/nfs/dbraw/zinc/73/46/10/421734610.db2.gz	WJLXBRZFMPNRGO-ZDUSSCGKSA-N	1	1	312.366	1.821	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000520361649	421747473	/nfs/dbraw/zinc/74/74/73/421747473.db2.gz	PYMXIZLIZGQANQ-UHFFFAOYSA-N	1	1	323.349	1.784	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000558759143	421825157	/nfs/dbraw/zinc/82/51/57/421825157.db2.gz	WCTDGAGSFYNOBD-LLVKDONJSA-N	1	1	307.354	1.122	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000600271936	422409348	/nfs/dbraw/zinc/40/93/48/422409348.db2.gz	RUIWBKLHZNNGIE-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCC[N@H+]1C	ZINC000600271935	422410330	/nfs/dbraw/zinc/41/03/30/422410330.db2.gz	RQLGJUXIEXLIDA-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000285747577	274074227	/nfs/dbraw/zinc/07/42/27/274074227.db2.gz	QRRGCOODICEDML-LLVKDONJSA-N	1	1	307.350	1.451	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000285747577	274074228	/nfs/dbraw/zinc/07/42/28/274074228.db2.gz	QRRGCOODICEDML-LLVKDONJSA-N	1	1	307.350	1.451	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[NH+](CCCO)CC2)c1	ZINC000301826261	274095699	/nfs/dbraw/zinc/09/56/99/274095699.db2.gz	MVEWGBXKHIWVEV-UHFFFAOYSA-N	1	1	313.329	1.247	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3cccc(C(N)=O)c3[N+](=O)[O-])C2)C1	ZINC000338745491	277072963	/nfs/dbraw/zinc/07/29/63/277072963.db2.gz	NRNFZRVTPWPINX-MRXNPFEDSA-N	1	1	318.377	1.616	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+](CCC(F)(F)F)C[C@H](O)CO)c1	ZINC000084867118	280372112	/nfs/dbraw/zinc/37/21/12/280372112.db2.gz	ORTUSTKNBPTDIP-LBPRGKRZSA-N	1	1	322.283	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+](CCC(F)(F)F)C[C@H](O)CO)c1	ZINC000084867118	280372114	/nfs/dbraw/zinc/37/21/14/280372114.db2.gz	ORTUSTKNBPTDIP-LBPRGKRZSA-N	1	1	322.283	1.702	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@@H+](C)CCCO)CC2)n1	ZINC000178226345	281010584	/nfs/dbraw/zinc/01/05/84/281010584.db2.gz	IJSJANAGKATGST-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+](CCC(F)(F)F)C[C@@H](O)CO)c1	ZINC000354040323	298346917	/nfs/dbraw/zinc/34/69/17/298346917.db2.gz	ORTUSTKNBPTDIP-GFCCVEGCSA-N	1	1	322.283	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+](CCC(F)(F)F)C[C@@H](O)CO)c1	ZINC000354040323	298346921	/nfs/dbraw/zinc/34/69/21/298346921.db2.gz	ORTUSTKNBPTDIP-GFCCVEGCSA-N	1	1	322.283	1.702	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000358061661	299061910	/nfs/dbraw/zinc/06/19/10/299061910.db2.gz	HAKURBFZOLYZTI-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000362910234	300176554	/nfs/dbraw/zinc/17/65/54/300176554.db2.gz	HDKMYYSTTYICNP-CYBMUJFWSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cn1cc(C[C@H]2CC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)cn1	ZINC000363129518	300216737	/nfs/dbraw/zinc/21/67/37/300216737.db2.gz	IBEJEERRPAGKSD-LLVKDONJSA-N	1	1	304.354	1.126	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H]3OCC[C@H]32)c1	ZINC000369788480	301225128	/nfs/dbraw/zinc/22/51/28/301225128.db2.gz	SKCUFFRRNVNHBM-NUEKZKHPSA-N	1	1	322.361	1.588	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@H](CNc2ccccn2)C1	ZINC000370045973	301265307	/nfs/dbraw/zinc/26/53/07/301265307.db2.gz	OYQAFRJLKFVDQA-GFCCVEGCSA-N	1	1	316.365	1.657	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@H](CNc2ccccn2)C1	ZINC000370045973	301265308	/nfs/dbraw/zinc/26/53/08/301265308.db2.gz	OYQAFRJLKFVDQA-GFCCVEGCSA-N	1	1	316.365	1.657	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)C1	ZINC000376176628	302045812	/nfs/dbraw/zinc/04/58/12/302045812.db2.gz	YCGNTZGDKWVNME-CQSZACIVSA-N	1	1	319.409	1.393	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000376512276	302088218	/nfs/dbraw/zinc/08/82/18/302088218.db2.gz	JDHRWABTFYZNIQ-GFCCVEGCSA-N	1	1	304.350	1.487	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000377481537	302183943	/nfs/dbraw/zinc/18/39/43/302183943.db2.gz	LZKAHZGMXOUWRT-CHWSQXEVSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@H]3C2)n1	ZINC000377963508	302257867	/nfs/dbraw/zinc/25/78/67/302257867.db2.gz	UYDKLOYVNBJCGI-RDBSUJKOSA-N	1	1	305.382	1.207	20	5		DDBDMO
O=C(Cn1c[nH+]c2c1CCCC2)NCc1ccccc1[N+](=O)[O-]	ZINC000538687287	303387886	/nfs/dbraw/zinc/38/78/86/303387886.db2.gz	RQZCGBZWRNKXTC-UHFFFAOYSA-N	1	1	314.345	1.987	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000366416607	307073050	/nfs/dbraw/zinc/07/30/50/307073050.db2.gz	KLWAOEGQSGNUQE-NNYUYHANSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000366416607	307073051	/nfs/dbraw/zinc/07/30/51/307073051.db2.gz	KLWAOEGQSGNUQE-NNYUYHANSA-N	1	1	305.334	1.092	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12	ZINC000368714973	307108564	/nfs/dbraw/zinc/10/85/64/307108564.db2.gz	HBZDRFSIWDSISN-MRXNPFEDSA-N	1	1	314.345	1.960	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@]2(C1)OCc1ccccc12	ZINC000368714973	307108565	/nfs/dbraw/zinc/10/85/65/307108565.db2.gz	HBZDRFSIWDSISN-MRXNPFEDSA-N	1	1	314.345	1.960	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034072	307114689	/nfs/dbraw/zinc/11/46/89/307114689.db2.gz	CIDVDKFTDUXVSS-UKRRQHHQSA-N	1	1	321.333	1.203	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034072	307114690	/nfs/dbraw/zinc/11/46/90/307114690.db2.gz	CIDVDKFTDUXVSS-UKRRQHHQSA-N	1	1	321.333	1.203	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC12CCC2	ZINC000373175647	307181200	/nfs/dbraw/zinc/18/12/00/307181200.db2.gz	ANLBMMHJLVXJDV-LLVKDONJSA-N	1	1	308.338	1.066	20	5		DDBDMO
COc1cc(N2CCC[N@H+](CCN(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000377837793	307277110	/nfs/dbraw/zinc/27/71/10/307277110.db2.gz	RCISAPJGUQYAHV-UHFFFAOYSA-N	1	1	322.409	1.677	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000425357154	307302529	/nfs/dbraw/zinc/30/25/29/307302529.db2.gz	XWJUMHORKVPQHT-UHFFFAOYSA-N	1	1	323.393	1.843	20	5		DDBDMO
C[C@@H](CCN(C)C)[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116857	308043691	/nfs/dbraw/zinc/04/36/91/308043691.db2.gz	LDTHDKSUWVFLCU-STQMWFEESA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@@H](CC[NH+](C)C)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116857	308043693	/nfs/dbraw/zinc/04/36/93/308043693.db2.gz	LDTHDKSUWVFLCU-STQMWFEESA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@H](CCN(C)C)[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116852	308043830	/nfs/dbraw/zinc/04/38/30/308043830.db2.gz	LDTHDKSUWVFLCU-OLZOCXBDSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@H](CC[NH+](C)C)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116852	308043831	/nfs/dbraw/zinc/04/38/31/308043831.db2.gz	LDTHDKSUWVFLCU-OLZOCXBDSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC(C)C[C@@H]([NH3+])c1noc(Cn2ccc(=O)c([N+](=O)[O-])c2)n1	ZINC000580311095	308594866	/nfs/dbraw/zinc/59/48/66/308594866.db2.gz	WGHXKINEJMPINA-SECBINFHSA-N	1	1	307.310	1.234	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3cccnc3)C2)c1	ZINC000582724549	337125660	/nfs/dbraw/zinc/12/56/60/337125660.db2.gz	ZVZXYFQCZZVFDK-UKRRQHHQSA-N	1	1	317.349	1.037	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@H](CO)[C@H]2C)c([N+](=O)[O-])c1	ZINC000488733442	484216969	/nfs/dbraw/zinc/21/69/69/484216969.db2.gz	JJHVGGFPYLKBLG-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@H](CO)[C@H]2C)c([N+](=O)[O-])c1	ZINC000488733442	484216978	/nfs/dbraw/zinc/21/69/78/484216978.db2.gz	JJHVGGFPYLKBLG-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000361591242	484521851	/nfs/dbraw/zinc/52/18/51/484521851.db2.gz	YPNRDUHHDYWNKI-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](O)[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101481	533857599	/nfs/dbraw/zinc/85/75/99/533857599.db2.gz	WZXDFPRIFFUEST-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](O)[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101481	533857608	/nfs/dbraw/zinc/85/76/08/533857608.db2.gz	WZXDFPRIFFUEST-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](O)CC1	ZINC000293011733	534298437	/nfs/dbraw/zinc/29/84/37/534298437.db2.gz	DRZOVRRKJLIZAR-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](O)CC1	ZINC000293011733	534298438	/nfs/dbraw/zinc/29/84/38/534298438.db2.gz	DRZOVRRKJLIZAR-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000154783671	525662142	/nfs/dbraw/zinc/66/21/42/525662142.db2.gz	ALQFSOYTBYEBRJ-TVQRCGJNSA-N	1	1	310.310	1.634	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000154783671	525662152	/nfs/dbraw/zinc/66/21/52/525662152.db2.gz	ALQFSOYTBYEBRJ-TVQRCGJNSA-N	1	1	310.310	1.634	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000451936088	527789761	/nfs/dbraw/zinc/78/97/61/527789761.db2.gz	KHMYADXNODHQGM-MPKXVKKWSA-N	1	1	323.349	1.315	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC000433757215	527998460	/nfs/dbraw/zinc/99/84/60/527998460.db2.gz	IRFIDUWCZQBPRU-LLVKDONJSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000457137206	529073997	/nfs/dbraw/zinc/07/39/97/529073997.db2.gz	XDRRAHPYLJUSIY-LBPRGKRZSA-N	1	1	309.370	1.123	20	5		DDBDMO
CC1(C)CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000302569130	529129404	/nfs/dbraw/zinc/12/94/04/529129404.db2.gz	YEBAZJWOJDQWKS-UHFFFAOYSA-N	1	1	314.773	1.536	20	5		DDBDMO
CC1(C)CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302569130	529129406	/nfs/dbraw/zinc/12/94/06/529129406.db2.gz	YEBAZJWOJDQWKS-UHFFFAOYSA-N	1	1	314.773	1.536	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CC[NH2+]Cc1ccc(-c2nn[nH]n2)o1	ZINC000823647257	599453006	/nfs/dbraw/zinc/45/30/06/599453006.db2.gz	IYSVHLOQZCFSKZ-UHFFFAOYSA-N	1	1	314.305	1.700	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776590325	698123517	/nfs/dbraw/zinc/12/35/17/698123517.db2.gz	ZNRKORDBTXXAMA-CJNGLKHVSA-N	1	1	324.377	1.613	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000776593583	698124231	/nfs/dbraw/zinc/12/42/31/698124231.db2.gz	YDZBOTWCCZXDSQ-RYUDHWBXSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000776593583	698124232	/nfs/dbraw/zinc/12/42/32/698124232.db2.gz	YDZBOTWCCZXDSQ-RYUDHWBXSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCC[C@H]2C2OCCO2)c1	ZINC000750055119	700201311	/nfs/dbraw/zinc/20/13/11/700201311.db2.gz	ZBWKEYCIZCSWMO-LSDHHAIUSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCC[C@H]2C2OCCO2)c1	ZINC000750055119	700201313	/nfs/dbraw/zinc/20/13/13/700201313.db2.gz	ZBWKEYCIZCSWMO-LSDHHAIUSA-N	1	1	322.361	1.856	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854190	698144235	/nfs/dbraw/zinc/14/42/35/698144235.db2.gz	PZKWPPHBZIBTOB-FZMZJTMJSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854190	698144236	/nfs/dbraw/zinc/14/42/36/698144236.db2.gz	PZKWPPHBZIBTOB-FZMZJTMJSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000262534284	698473333	/nfs/dbraw/zinc/47/33/33/698473333.db2.gz	QAUGDRVPDOWLRX-ZIAGYGMSSA-N	1	1	304.394	1.635	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000781961840	698666541	/nfs/dbraw/zinc/66/65/41/698666541.db2.gz	JQDUYENKQWAOEK-HUUCEWRRSA-N	1	1	310.350	1.366	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)c(N)c([N+](=O)[O-])c1	ZINC000729527397	699481529	/nfs/dbraw/zinc/48/15/29/699481529.db2.gz	MGAFKUUHQFIUCR-LBPRGKRZSA-N	1	1	320.393	1.946	20	5		DDBDMO
Cc1c(CNC(=O)CC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000791021781	699607591	/nfs/dbraw/zinc/60/75/91/699607591.db2.gz	RCZNJOVBTZXELP-UHFFFAOYSA-N	1	1	307.350	1.242	20	5		DDBDMO
Cc1c(C(=O)NCC[NH+]2CCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000752295531	700354182	/nfs/dbraw/zinc/35/41/82/700354182.db2.gz	LLFQUMVNTHIQPA-UHFFFAOYSA-N	1	1	308.294	1.247	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H]1C	ZINC000801934917	700357216	/nfs/dbraw/zinc/35/72/16/700357216.db2.gz	SSQPQBGYBXLIFK-NXEZZACHSA-N	1	1	324.356	1.871	20	5		DDBDMO
Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@H+]2Cn1cc([N+](=O)[O-])cn1	ZINC000802748832	700424274	/nfs/dbraw/zinc/42/42/74/700424274.db2.gz	ZGPJCERIOBJWEF-YHWZYXNKSA-N	1	1	316.365	1.893	20	5		DDBDMO
Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cn1cc([N+](=O)[O-])cn1	ZINC000802748832	700424276	/nfs/dbraw/zinc/42/42/76/700424276.db2.gz	ZGPJCERIOBJWEF-YHWZYXNKSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OCC[C@@H]2CCCC[N@H+]2C)n1	ZINC000755575163	700571622	/nfs/dbraw/zinc/57/16/22/700571622.db2.gz	VDNMCJQVRVFQQY-NSHDSACASA-N	1	1	310.354	1.842	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000758332461	700699193	/nfs/dbraw/zinc/69/91/93/700699193.db2.gz	BJFDNSBOFSVNLQ-NOZJJQNGSA-N	1	1	307.325	1.946	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000762720660	700904557	/nfs/dbraw/zinc/90/45/57/700904557.db2.gz	YPCWMVQWVDHTRT-CKDIWJPDSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[NH+]1CCN(C(=O)CNc2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000804430814	701188206	/nfs/dbraw/zinc/18/82/06/701188206.db2.gz	WOABEVWIFQPVOP-UHFFFAOYSA-N	1	1	312.757	1.434	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)[nH]1	ZINC000839660906	701770509	/nfs/dbraw/zinc/77/05/09/701770509.db2.gz	ZLENMCAUWWDJEH-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660906	701770520	/nfs/dbraw/zinc/77/05/20/701770520.db2.gz	ZLENMCAUWWDJEH-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660906	701770523	/nfs/dbraw/zinc/77/05/23/701770523.db2.gz	ZLENMCAUWWDJEH-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660906	701770530	/nfs/dbraw/zinc/77/05/30/701770530.db2.gz	ZLENMCAUWWDJEH-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660906	701770534	/nfs/dbraw/zinc/77/05/34/701770534.db2.gz	ZLENMCAUWWDJEH-TZMCWYRMSA-N	1	1	317.349	1.544	20	5		DDBDMO
C[C@@H]1CN(Cn2ncc3cc([N+](=O)[O-])ccc32)C[C@H](C)[N@@H+]1C	ZINC000840087850	701961085	/nfs/dbraw/zinc/96/10/85/701961085.db2.gz	BQLFTZCGJKFZHR-TXEJJXNPSA-N	1	1	303.366	1.926	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCC[C@@H]1CCCC[N@@H+]1C	ZINC000840226025	702035724	/nfs/dbraw/zinc/03/57/24/702035724.db2.gz	SJBHVILSQZGFHA-ZDUSSCGKSA-N	1	1	324.381	1.907	20	5		DDBDMO
CO[C@H]1CC[C@H](C)[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000879322293	706649350	/nfs/dbraw/zinc/64/93/50/706649350.db2.gz	JGCPUVOPSIPDPY-GWCFXTLKSA-N	1	1	307.350	1.693	20	5		DDBDMO
C[C@@H]1C[C@@H](C[NH3+])C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000843362907	702866978	/nfs/dbraw/zinc/86/69/78/702866978.db2.gz	UNHAUDYIRSHNQE-MNOVXSKESA-N	1	1	324.356	1.732	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000846921251	703351982	/nfs/dbraw/zinc/35/19/82/703351982.db2.gz	REWZLMBIIVVDEW-KGLIPLIRSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000848035477	703498374	/nfs/dbraw/zinc/49/83/74/703498374.db2.gz	VUOKRBMQLKBMPO-CYBMUJFWSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000848035477	703498375	/nfs/dbraw/zinc/49/83/75/703498375.db2.gz	VUOKRBMQLKBMPO-CYBMUJFWSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[NH2+][C@@H](C)c1nc(CC(=O)NCc2ccc([N+](=O)[O-])cc2)no1	ZINC000848627807	703569925	/nfs/dbraw/zinc/56/99/25/703569925.db2.gz	LKIBSIQLHGKPBV-VIFPVBQESA-N	1	1	319.321	1.117	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c1[N+](=O)[O-]	ZINC000851924521	703883893	/nfs/dbraw/zinc/88/38/93/703883893.db2.gz	OPUWKAGYLGMLCF-NSHDSACASA-N	1	1	311.338	1.866	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000818963294	704036158	/nfs/dbraw/zinc/03/61/58/704036158.db2.gz	NTSXJOWQFLYJAS-IJEWVQPXSA-N	1	1	305.378	1.845	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cn1ncc3ccc([N+](=O)[O-])cc31)C2	ZINC000853565926	704271784	/nfs/dbraw/zinc/27/17/84/704271784.db2.gz	KQZQQFKFJRNRFM-DOMZBBRYSA-N	1	1	302.334	1.870	20	5		DDBDMO
O=[N+]([O-])c1cn(C[N@@H+]2CCC3(COC3)C2)nc1-c1ccncc1	ZINC000853596947	704281104	/nfs/dbraw/zinc/28/11/04/704281104.db2.gz	COAVUUZEJWVVKR-UHFFFAOYSA-N	1	1	315.333	1.533	20	5		DDBDMO
O=[N+]([O-])c1cn(C[N@H+]2CCC3(COC3)C2)nc1-c1ccncc1	ZINC000853596947	704281108	/nfs/dbraw/zinc/28/11/08/704281108.db2.gz	COAVUUZEJWVVKR-UHFFFAOYSA-N	1	1	315.333	1.533	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000860176992	705124071	/nfs/dbraw/zinc/12/40/71/705124071.db2.gz	LFPMQRHCWIYUGN-CVEARBPZSA-N	1	1	321.377	1.619	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2ccc([N+](=O)[O-])s2)no1	ZINC000823069118	705130096	/nfs/dbraw/zinc/13/00/96/705130096.db2.gz	FJFIMERZTWFFIF-ZCFIWIBFSA-N	1	1	312.307	1.659	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874827847	705186605	/nfs/dbraw/zinc/18/66/05/705186605.db2.gz	DULZTCRMSKXMSF-STQMWFEESA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836659	705193654	/nfs/dbraw/zinc/19/36/54/705193654.db2.gz	HOCSLVMOBSCQKT-KGLIPLIRSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836659	705193657	/nfs/dbraw/zinc/19/36/57/705193657.db2.gz	HOCSLVMOBSCQKT-KGLIPLIRSA-N	1	1	305.334	1.609	20	5		DDBDMO
CCn1nc(C)c(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000824081014	705369886	/nfs/dbraw/zinc/36/98/86/705369886.db2.gz	RIJXLKJMDCWKNS-AWEZNQCLSA-N	1	1	305.338	1.338	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000863032903	705852412	/nfs/dbraw/zinc/85/24/12/705852412.db2.gz	QVVATGIPHMILRV-NSHDSACASA-N	1	1	319.365	1.319	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000827300688	705971468	/nfs/dbraw/zinc/97/14/68/705971468.db2.gz	NCAPKWQUKMILIL-MFKMUULPSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC(=O)c1c(NCCN2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000881779529	707363639	/nfs/dbraw/zinc/36/36/39/707363639.db2.gz	UKGAGVZQLDTXQU-UHFFFAOYSA-N	1	1	306.366	1.457	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](CCn3cnnn3)C2)cc1	ZINC000878679163	706466933	/nfs/dbraw/zinc/46/69/33/706466933.db2.gz	ULIHYFPWEAMHIC-CYBMUJFWSA-N	1	1	302.338	1.461	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000880069378	706869641	/nfs/dbraw/zinc/86/96/41/706869641.db2.gz	HNPXXGMAXRNOIL-NWDGAFQWSA-N	1	1	309.341	1.375	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC=C[C@H]1CO	ZINC000880490415	706992647	/nfs/dbraw/zinc/99/26/47/706992647.db2.gz	QLSRBPKTHHPUAS-ZDUSSCGKSA-N	1	1	305.334	1.465	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC[C@@H]2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000872320504	707381035	/nfs/dbraw/zinc/38/10/35/707381035.db2.gz	ZVKLDXWANKLAHA-PHIMTYICSA-N	1	1	323.324	1.641	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[NH2+][C@@H](c2ccccc2)C1)[N+](=O)[O-]	ZINC000837159806	707586859	/nfs/dbraw/zinc/58/68/59/707586859.db2.gz	NSPYVXDGCICHKO-CQSZACIVSA-N	1	1	305.378	1.995	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)c1ccc([N+](=O)[O-])o1	ZINC000885854671	708639756	/nfs/dbraw/zinc/63/97/56/708639756.db2.gz	BGFAUJCAMCSXCK-NSHDSACASA-N	1	1	309.322	1.171	20	5		DDBDMO
CC1(C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)OCCO1	ZINC000886077149	708693499	/nfs/dbraw/zinc/69/34/99/708693499.db2.gz	WHIQJBNSBWQFBD-UHFFFAOYSA-N	1	1	307.350	1.965	20	5		DDBDMO
CCC[C@@H]1CN(Cc2cccnc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000886099365	708698340	/nfs/dbraw/zinc/69/83/40/708698340.db2.gz	YCOUMOUUFTXCCA-OAHLLOKOSA-N	1	1	322.409	1.923	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000886596089	708787612	/nfs/dbraw/zinc/78/76/12/708787612.db2.gz	WOFLDKXUKHRIIM-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000886596089	708787615	/nfs/dbraw/zinc/78/76/15/708787615.db2.gz	WOFLDKXUKHRIIM-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000887930373	709168192	/nfs/dbraw/zinc/16/81/92/709168192.db2.gz	FPQCHLIQGWHCJV-PBHICJAKSA-N	1	1	317.389	1.856	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000900804824	709766985	/nfs/dbraw/zinc/76/69/85/709766985.db2.gz	NNNONYGNGYBRSE-QMTHXVAHSA-N	1	1	324.356	1.098	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000928438150	713195770	/nfs/dbraw/zinc/19/57/70/713195770.db2.gz	SQQVRENQUJVQMG-AAEUAGOBSA-N	1	1	307.350	1.491	20	5		DDBDMO
COc1cc([C@H](C)NC[C@@]2(O)CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000903154147	711049756	/nfs/dbraw/zinc/04/97/56/711049756.db2.gz	TVNDCMKFHJZYMU-NHYWBVRUSA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([C@H](C)[NH2+]C[C@@]2(O)CCN(C)C2)cc([N+](=O)[O-])c1	ZINC000903154147	711049758	/nfs/dbraw/zinc/04/97/58/711049758.db2.gz	TVNDCMKFHJZYMU-NHYWBVRUSA-N	1	1	309.366	1.321	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000928560172	713226545	/nfs/dbraw/zinc/22/65/45/713226545.db2.gz	PHWXTRKOPPTWKG-SECBINFHSA-N	1	1	315.276	1.630	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000928560172	713226546	/nfs/dbraw/zinc/22/65/46/713226546.db2.gz	PHWXTRKOPPTWKG-SECBINFHSA-N	1	1	315.276	1.630	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000928565722	713230800	/nfs/dbraw/zinc/23/08/00/713230800.db2.gz	BIWCEQSBJOSXQU-AWEZNQCLSA-N	1	1	306.366	1.607	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C2(CF)CCOCC2)c1[N+](=O)[O-]	ZINC000894695116	711240730	/nfs/dbraw/zinc/24/07/30/711240730.db2.gz	MBKBINLTHFSURG-UHFFFAOYSA-N	1	1	314.313	1.917	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c1[N+](=O)[O-]	ZINC000895386250	711500061	/nfs/dbraw/zinc/50/00/61/711500061.db2.gz	PIUCGUBEOSRVSC-XHDPSFHLSA-N	1	1	308.334	1.777	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](C)[C@@H](CO)C2)c1[N+](=O)[O-]	ZINC000895515976	711531211	/nfs/dbraw/zinc/53/12/11/711531211.db2.gz	YRQDJJSKZNFNFG-CMPLNLGQSA-N	1	1	310.350	1.759	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[N@@H+]2CCSC[C@@H]12	ZINC000895570475	711545753	/nfs/dbraw/zinc/54/57/53/711545753.db2.gz	UMDURPGDSTZAHN-RYUDHWBXSA-N	1	1	324.406	1.990	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[N@H+]2CCSC[C@@H]12	ZINC000895570475	711545755	/nfs/dbraw/zinc/54/57/55/711545755.db2.gz	UMDURPGDSTZAHN-RYUDHWBXSA-N	1	1	324.406	1.990	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1(CNCC[N+](=O)[O-])CCOCC1	ZINC000905575021	712083416	/nfs/dbraw/zinc/08/34/16/712083416.db2.gz	GIDVVWYYPKTGCD-UHFFFAOYSA-N	1	1	307.394	1.534	20	5		DDBDMO
CN(Cc1ccccc1)C1(C[NH2+]CC[N+](=O)[O-])CCOCC1	ZINC000905575021	712083419	/nfs/dbraw/zinc/08/34/19/712083419.db2.gz	GIDVVWYYPKTGCD-UHFFFAOYSA-N	1	1	307.394	1.534	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C	ZINC000908052259	712672233	/nfs/dbraw/zinc/67/22/33/712672233.db2.gz	CAOPPTACMUFTSA-ZBFHGGJFSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000908512388	712793415	/nfs/dbraw/zinc/79/34/15/712793415.db2.gz	LBZJLXMFZLQIGH-XEGUGMAKSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[NH+](C)C1CC(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000916955212	713476014	/nfs/dbraw/zinc/47/60/14/713476014.db2.gz	GHEHWXAGNMACHC-UHFFFAOYSA-N	1	1	317.342	1.105	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1CCOC(C)(C)C1)c1ccccc1[N+](=O)[O-]	ZINC000930234497	713782942	/nfs/dbraw/zinc/78/29/42/713782942.db2.gz	CGMSSZULCKLVAX-GFCCVEGCSA-N	1	1	321.377	1.883	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000930361978	713813615	/nfs/dbraw/zinc/81/36/15/713813615.db2.gz	AWGXOEAAVUAMEK-DFBGVHRSSA-N	1	1	303.362	1.766	20	5		DDBDMO
CC(C)(C)OC(=O)N1CCC[C@@]2(CC[N@@H+](CC[N+](=O)[O-])C2)C1	ZINC000930360676	713813663	/nfs/dbraw/zinc/81/36/63/713813663.db2.gz	NMXZULWMOWPGGL-HNNXBMFYSA-N	1	1	313.398	1.986	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](C3OCCO3)C2)cc1	ZINC000932007475	714232931	/nfs/dbraw/zinc/23/29/31/714232931.db2.gz	GOUHXGZNELCSAZ-LBPRGKRZSA-N	1	1	308.334	1.668	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CN[C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000932177897	714279853	/nfs/dbraw/zinc/27/98/53/714279853.db2.gz	GBXMZLOQTJFXNC-IUODEOHRSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@H](O)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000932177897	714279856	/nfs/dbraw/zinc/27/98/56/714279856.db2.gz	GBXMZLOQTJFXNC-IUODEOHRSA-N	1	1	311.382	1.185	20	5		DDBDMO
CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[NH2+]CC1	ZINC000923336032	714319715	/nfs/dbraw/zinc/31/97/15/714319715.db2.gz	UAYDNAZLCAQQLT-ZFWWWQNUSA-N	1	1	323.393	1.408	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@@H]1[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000923371048	714331635	/nfs/dbraw/zinc/33/16/35/714331635.db2.gz	URIYHHQVQCWIBF-NFFDBFGFSA-N	1	1	323.393	1.311	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000933438645	714589260	/nfs/dbraw/zinc/58/92/60/714589260.db2.gz	BGSBDSMFPFMONP-CMPLNLGQSA-N	1	1	309.370	1.041	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000933732336	714657631	/nfs/dbraw/zinc/65/76/31/714657631.db2.gz	NSRHLZRNQMMFHC-DOMZBBRYSA-N	1	1	320.349	1.887	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1	ZINC000933737203	714659642	/nfs/dbraw/zinc/65/96/42/714659642.db2.gz	LYMSKPTXQGSOJR-KBMXLJTQSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1C[C@@H](O)C[C@@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000924989605	714717942	/nfs/dbraw/zinc/71/79/42/714717942.db2.gz	SSJCOIXUVJNSLS-BDAKNGLRSA-N	1	1	313.741	1.043	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CC[C@@H]1OC	ZINC000934121499	714747772	/nfs/dbraw/zinc/74/77/72/714747772.db2.gz	NARZHFGRVQTBRZ-OLZOCXBDSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CC[C@@H]1OC	ZINC000934121499	714747773	/nfs/dbraw/zinc/74/77/73/714747773.db2.gz	NARZHFGRVQTBRZ-OLZOCXBDSA-N	1	1	323.349	1.651	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)cc1F	ZINC000934265788	714780003	/nfs/dbraw/zinc/78/00/03/714780003.db2.gz	NPMPFAOUQJSPQG-HOTGVXAUSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c1	ZINC000934438048	714822245	/nfs/dbraw/zinc/82/22/45/714822245.db2.gz	KEZWIDQPOYBANG-GDBMZVCRSA-N	1	1	316.361	1.327	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000925408921	714846299	/nfs/dbraw/zinc/84/62/99/714846299.db2.gz	MQODXDMWPYNNOP-AWEZNQCLSA-N	1	1	318.377	1.973	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H](C)[N@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC001164643044	719177692	/nfs/dbraw/zinc/17/76/92/719177692.db2.gz	YWMJDCJFZDVXNV-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC001164643044	719177702	/nfs/dbraw/zinc/17/77/02/719177702.db2.gz	YWMJDCJFZDVXNV-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
Cc1cc(Cl)c([N+](=O)[O-])c(N2C[C@@H]3OCC[N@H+](C)[C@H]3C2)n1	ZINC001164664956	719386341	/nfs/dbraw/zinc/38/63/41/719386341.db2.gz	DCKYTSDPZIORCL-QWRGUYRKSA-N	1	1	312.757	1.471	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ncnc2cc3ccccc3cc21	ZINC001167355188	733281279	/nfs/dbraw/zinc/28/12/79/733281279.db2.gz	VCFGHAYEISYRMJ-UHFFFAOYSA-N	1	1	302.341	1.907	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21)C1CCC1	ZINC001025645214	736807333	/nfs/dbraw/zinc/80/73/33/736807333.db2.gz	RHUSOGMYWOCXSI-ZSHCYNCHSA-N	1	1	315.373	1.941	20	5		DDBDMO
CC(C)Oc1cccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001126942596	742932638	/nfs/dbraw/zinc/93/26/38/742932638.db2.gz	CFIAVMXJBBIYSI-HUUCEWRRSA-N	1	1	321.377	1.345	20	5		DDBDMO
CO[C@H]1CC[NH2+][C@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)C1	ZINC001212240503	747104262	/nfs/dbraw/zinc/10/42/62/747104262.db2.gz	ALHJPZUGDKGNLQ-IUCAKERBSA-N	1	1	323.284	1.618	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)NCC(C)C	ZINC001200184831	748157053	/nfs/dbraw/zinc/15/70/53/748157053.db2.gz	ITBAKGAJSCDNJA-UHFFFAOYSA-N	1	1	309.366	1.855	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)/C=C\C(C)(C)C	ZINC001124884160	748595188	/nfs/dbraw/zinc/59/51/88/748595188.db2.gz	YBIUPJKCYGGLMY-WAYWQWQTSA-N	1	1	309.370	1.136	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCc2cccs2)CC1	ZINC000996442074	749576598	/nfs/dbraw/zinc/57/65/98/749576598.db2.gz	VGJBYKFGYBUOLA-ZIAGYGMSSA-N	1	1	323.418	1.536	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2cccnc2)CC1	ZINC001005377335	749943547	/nfs/dbraw/zinc/94/35/47/749943547.db2.gz	BKXNYPODEHKWNV-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
COC[C@]12CCCO[C@@H]1CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169022095	762201100	/nfs/dbraw/zinc/20/11/00/762201100.db2.gz	MUZSECJYXQWMOG-KLHDSHLOSA-N	1	1	312.410	1.949	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)c1	ZINC001169053571	762208833	/nfs/dbraw/zinc/20/88/33/762208833.db2.gz	ITPPFICTYNWZHF-UMVBOHGHSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001400719	754282323	/nfs/dbraw/zinc/28/23/23/754282323.db2.gz	VZOGKHXJLUHHTJ-ZIAGYGMSSA-N	1	1	323.418	1.742	20	5		DDBDMO
Cc1nc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)s1	ZINC001020139032	760612613	/nfs/dbraw/zinc/61/26/13/760612613.db2.gz	NOQNJUGZKMDIQQ-PRULPYPASA-N	1	1	324.406	1.162	20	5		DDBDMO
Cc1[nH+]c(N)ccc1CNc1c([N+](=O)[O-])cc[n+]([O-])c1Cl	ZINC001156980208	764255452	/nfs/dbraw/zinc/25/54/52/764255452.db2.gz	FDJURLZXUDAEFS-UHFFFAOYSA-N	1	1	309.713	1.779	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1ncc([N+](=O)[O-])cc1C	ZINC001093952429	775260297	/nfs/dbraw/zinc/26/02/97/775260297.db2.gz	BZYYVOXTEPMMAK-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ccc([N+](=O)[O-])cn1)C1CCC1	ZINC001094221697	775543689	/nfs/dbraw/zinc/54/36/89/775543689.db2.gz	NBXYGWHKYQTFBX-UHFFFAOYSA-N	1	1	307.354	1.002	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(CC)c1ccccc1[N+](=O)[O-]	ZINC001100576710	776320322	/nfs/dbraw/zinc/32/03/22/776320322.db2.gz	PJANZPMGZQJTNS-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
COC(=O)CO[C@H]1CC[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001173232457	777063563	/nfs/dbraw/zinc/06/35/63/777063563.db2.gz	BLYAJHCEVDEJJQ-WFASDCNBSA-N	1	1	322.361	1.790	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233805	777064623	/nfs/dbraw/zinc/06/46/23/777064623.db2.gz	YXFMNWGBDDMDQN-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC001173233805	777064630	/nfs/dbraw/zinc/06/46/30/777064630.db2.gz	YXFMNWGBDDMDQN-WFASDCNBSA-N	1	1	321.377	1.315	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CC(N(C)C2COC2)C1	ZINC001173234972	777064753	/nfs/dbraw/zinc/06/47/53/777064753.db2.gz	VJYMVLKJIJHICO-GFCCVEGCSA-N	1	1	305.378	1.541	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1	ZINC001101875457	777633186	/nfs/dbraw/zinc/63/31/86/777633186.db2.gz	XKHCWGCUYCHALL-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
Nc1cc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)nc[nH+]1	ZINC001115989582	780464872	/nfs/dbraw/zinc/46/48/72/780464872.db2.gz	UZDGOTDSYREACF-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
Cn1cc[nH+]c1C[C@H]1CCCN(c2c([N+](=O)[O-])ncn2C)C1	ZINC001116288533	780493072	/nfs/dbraw/zinc/49/30/72/780493072.db2.gz	HGPFXGHAPQEFFN-LLVKDONJSA-N	1	1	304.354	1.521	20	5		DDBDMO
Cc1nc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ncc1[N+](=O)[O-]	ZINC001120059082	781741488	/nfs/dbraw/zinc/74/14/88/781741488.db2.gz	CZZSBHCZNFTIBZ-PWSUYJOCSA-N	1	1	309.395	1.685	20	5		DDBDMO
CCN(CC[NH2+]CCc1cccs1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268450020	840210586	/nfs/dbraw/zinc/21/05/86/840210586.db2.gz	MYEXQJVLZUUKPL-CHWSQXEVSA-N	1	1	311.407	1.394	20	5		DDBDMO
O=C(NC/C=C\C[NH2+]CCc1ccccc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001268543988	840422646	/nfs/dbraw/zinc/42/26/46/840422646.db2.gz	YFWJYDZPARIGDR-SQLJOLKNSA-N	1	1	321.352	1.295	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc(C)n2)C1	ZINC001142515876	861171120	/nfs/dbraw/zinc/17/11/20/861171120.db2.gz	BMRLKZJIFURTIE-LBPRGKRZSA-N	1	1	306.366	1.760	20	5		DDBDMO
C[NH+]1CC2(CN(C(F)(F)c3cnc(Cl)c([N+](=O)[O-])c3)C2)C1	ZINC001158859951	864942159	/nfs/dbraw/zinc/94/21/59/864942159.db2.gz	SUWFIDFCWWHDCY-UHFFFAOYSA-N	1	1	318.711	1.940	20	5		DDBDMO
CC[C@@]([NH3+])(CO)Nc1nc(Cl)nc(SC)c1[N+](=O)[O-]	ZINC001159743577	865495528	/nfs/dbraw/zinc/49/55/28/865495528.db2.gz	JQGHEPNGUWHRDV-VIFPVBQESA-N	1	1	307.763	1.229	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC001320963605	867157050	/nfs/dbraw/zinc/15/70/50/867157050.db2.gz	VJHIBKUKEDXRQO-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
CC(C)(C)OC(=O)[C@H]([NH3+])C1CN(c2cccc([N+](=O)[O-])n2)C1	ZINC001163118138	868118099	/nfs/dbraw/zinc/11/80/99/868118099.db2.gz	UJEJFDKNIQQDTD-GFCCVEGCSA-N	1	1	308.338	1.095	20	5		DDBDMO
C[C@@H](CCNC[C@H](O)COc1ccccc1[N+](=O)[O-])[NH+](C)C	ZINC001336754490	869125720	/nfs/dbraw/zinc/12/57/20/869125720.db2.gz	LRQAONLEWKGULJ-STQMWFEESA-N	1	1	311.382	1.264	20	5		DDBDMO
COc1c(O)ccc(CN2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC001336813280	869160500	/nfs/dbraw/zinc/16/05/00/869160500.db2.gz	PMLCHDQIIZKRHG-ZYHUDNBSSA-N	1	1	307.350	1.445	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@H]12	ZINC001337837200	869651227	/nfs/dbraw/zinc/65/12/27/869651227.db2.gz	YYQGGKGDUZPYOX-DDTOSNHZSA-N	1	1	304.350	1.368	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2N)C1	ZINC001166444188	870001801	/nfs/dbraw/zinc/00/18/01/870001801.db2.gz	JRRINFJXYQBHHL-SNVBAGLBSA-N	1	1	306.366	1.780	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC001308003184	871461687	/nfs/dbraw/zinc/46/16/87/871461687.db2.gz	QBLXKRCTPWAZNO-AWEZNQCLSA-N	1	1	318.333	1.126	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@H]1[NH2+]CCc2occc21	ZINC001343188261	872530293	/nfs/dbraw/zinc/53/02/93/872530293.db2.gz	OXLHJBMAVCLKHA-HNNXBMFYSA-N	1	1	315.329	1.734	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)C3(CC3)C2)c1	ZINC001346118691	873616679	/nfs/dbraw/zinc/61/66/79/873616679.db2.gz	WBIOQVOWTQMOKU-CYBMUJFWSA-N	1	1	306.318	1.338	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)C3(CC3)C2)c1	ZINC001346118691	873616683	/nfs/dbraw/zinc/61/66/83/873616683.db2.gz	WBIOQVOWTQMOKU-CYBMUJFWSA-N	1	1	306.318	1.338	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3cc(F)c([N+](=O)[O-])cc3CO)[C@H]2C1	ZINC001348566010	874636441	/nfs/dbraw/zinc/63/64/41/874636441.db2.gz	UGPXSQJVIQVLJA-GAFUQQFSSA-N	1	1	309.341	1.978	20	5		DDBDMO
CN1C(=O)C[C@H]([NH2+]CC[N+](=O)[O-])[C@@H]1c1ccc(Cl)c(F)c1	ZINC001351401419	876231391	/nfs/dbraw/zinc/23/13/91/876231391.db2.gz	VKFBOLUBSIDNLW-AAEUAGOBSA-N	1	1	315.732	1.617	20	5		DDBDMO
CCOCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001231406526	885621308	/nfs/dbraw/zinc/62/13/08/885621308.db2.gz	LJZVYVQPNUUNQI-UHFFFAOYSA-N	1	1	309.366	1.569	20	5		DDBDMO
OC[C@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@@H]1O	ZINC001232219312	886165711	/nfs/dbraw/zinc/16/57/11/886165711.db2.gz	SOTSTVUVIYSOPA-WBVHZDCISA-N	1	1	323.396	1.958	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1C[C@H]2COC[C@@H](C1)C2[NH3+]	ZINC001246859548	892949067	/nfs/dbraw/zinc/94/90/67/892949067.db2.gz	LFPFGSWILVNELD-CLJRNHLWSA-N	1	1	305.378	1.431	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC001262653564	900286341	/nfs/dbraw/zinc/28/63/41/900286341.db2.gz	KOHXNOQTNKMFDQ-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000451650895	231152095	/nfs/dbraw/zinc/15/20/95/231152095.db2.gz	FZOCSQOJMNLWDR-TXEJJXNPSA-N	1	1	311.357	1.621	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@]2(CNC(=O)C2)C1	ZINC000278783617	214398993	/nfs/dbraw/zinc/39/89/93/214398993.db2.gz	DIJKDUIMRPFARB-MRXNPFEDSA-N	1	1	319.361	1.706	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CC[C@H](CCCO)C2)c1	ZINC000452135388	231315600	/nfs/dbraw/zinc/31/56/00/231315600.db2.gz	VWWUZLUEUSBKAP-DZGCQCFKSA-N	1	1	324.377	1.429	20	5		DDBDMO
COC[C@](C)(CCO)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000286587230	219067851	/nfs/dbraw/zinc/06/78/51/219067851.db2.gz	WXSUTTDIMLHPLW-ZDUSSCGKSA-N	1	1	304.293	1.750	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1CC(O)C1	ZINC000615507317	362312535	/nfs/dbraw/zinc/31/25/35/362312535.db2.gz	BOAISLNUCXCJCV-UHFFFAOYSA-N	1	1	308.334	1.569	20	5		DDBDMO
Cn1nccc1[C@@H]1CCCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000281396110	282334863	/nfs/dbraw/zinc/33/48/63/282334863.db2.gz	NENUUOAIPBNOGN-AWEZNQCLSA-N	1	1	304.354	1.752	20	5		DDBDMO
Cn1nccc1[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000281396110	282334864	/nfs/dbraw/zinc/33/48/64/282334864.db2.gz	NENUUOAIPBNOGN-AWEZNQCLSA-N	1	1	304.354	1.752	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000458207236	530054829	/nfs/dbraw/zinc/05/48/29/530054829.db2.gz	JFNUQVFPJVONCU-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
C[NH+](C)[C@H]1CCC[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000272663209	210066717	/nfs/dbraw/zinc/06/67/17/210066717.db2.gz	IFNLNRGLFWEVJV-NEPJUHHUSA-N	1	1	307.350	1.903	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000272621870	210024190	/nfs/dbraw/zinc/02/41/90/210024190.db2.gz	UVHHPDIMZDTJPU-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000266863574	186363233	/nfs/dbraw/zinc/36/32/33/186363233.db2.gz	LEUAZICMFWRSTO-LBPRGKRZSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)c1	ZINC000266863574	186363234	/nfs/dbraw/zinc/36/32/34/186363234.db2.gz	LEUAZICMFWRSTO-LBPRGKRZSA-N	1	1	320.267	1.973	20	5		DDBDMO
C[C@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000057713381	352825814	/nfs/dbraw/zinc/82/58/14/352825814.db2.gz	UXFKKSOWYPLXEK-GFCCVEGCSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000060567490	352876358	/nfs/dbraw/zinc/87/63/58/352876358.db2.gz	HYJWIIMMGVFQRA-ZFWWWQNUSA-N	1	1	303.362	1.880	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCCC[NH+]1CCOCC1	ZINC000063464912	352912863	/nfs/dbraw/zinc/91/28/63/352912863.db2.gz	NQPHQACOSZDFDO-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
CCOC[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000072977169	191261868	/nfs/dbraw/zinc/26/18/68/191261868.db2.gz	VBUIJGMBZHQSDZ-LBPRGKRZSA-N	1	1	321.377	1.942	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000074105512	353292525	/nfs/dbraw/zinc/29/25/25/353292525.db2.gz	CMTWVNJZTJUVII-ZDUSSCGKSA-N	1	1	321.377	1.364	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000174329867	198320168	/nfs/dbraw/zinc/32/01/68/198320168.db2.gz	UMHLTFHMGWLTJB-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000174329867	198320170	/nfs/dbraw/zinc/32/01/70/198320170.db2.gz	UMHLTFHMGWLTJB-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[N@@H+](CCc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174736486	198378627	/nfs/dbraw/zinc/37/86/27/198378627.db2.gz	NYOJPIKNUKLFGG-MRXNPFEDSA-N	1	1	318.377	1.717	20	5		DDBDMO
CCOC(=O)c1ccnc(N[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000077934087	353497487	/nfs/dbraw/zinc/49/74/87/353497487.db2.gz	VPAONYNDLPJASJ-JTQLQIEISA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000080717906	353625446	/nfs/dbraw/zinc/62/54/46/353625446.db2.gz	MEDQDWQZSLOIQF-FGWVZKOKSA-N	1	1	307.354	1.371	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCc3cc(F)ccc3C2)c1	ZINC000091894448	353838249	/nfs/dbraw/zinc/83/82/49/353838249.db2.gz	YOIGVTNQFISGOK-OAHLLOKOSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3cc(F)ccc3C2)c1	ZINC000091894448	353838252	/nfs/dbraw/zinc/83/82/52/353838252.db2.gz	YOIGVTNQFISGOK-OAHLLOKOSA-N	1	1	320.324	1.350	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000108299169	353948960	/nfs/dbraw/zinc/94/89/60/353948960.db2.gz	WDWPHJIVBATRHB-LBPRGKRZSA-N	1	1	304.350	1.512	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000108307430	353950299	/nfs/dbraw/zinc/95/02/99/353950299.db2.gz	SMJUTGSIRMKRPW-LLVKDONJSA-N	1	1	307.325	1.948	20	5		DDBDMO
Cc1nn(C[C@H](O)C[N@H+](C)Cc2ccccc2)c(C)c1[N+](=O)[O-]	ZINC000303369521	354462484	/nfs/dbraw/zinc/46/24/84/354462484.db2.gz	JTWTWUWOEDDCMG-OAHLLOKOSA-N	1	1	318.377	1.901	20	5		DDBDMO
C[C@@H]1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCS1(=O)=O	ZINC000313326732	354478838	/nfs/dbraw/zinc/47/88/38/354478838.db2.gz	KOQNYWCQQYFSDP-PRHODGIISA-N	1	1	318.782	1.913	20	5		DDBDMO
CN(CC(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21)c1ccccc1[N+](=O)[O-]	ZINC000590046411	355043406	/nfs/dbraw/zinc/04/34/06/355043406.db2.gz	CKRSECMEWLYSPC-WFASDCNBSA-N	1	1	318.377	1.194	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590442360	355096591	/nfs/dbraw/zinc/09/65/91/355096591.db2.gz	FNKLKDCVNYVVSW-WCQYABFASA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000590776544	355176281	/nfs/dbraw/zinc/17/62/81/355176281.db2.gz	WTRAZEUXFVHQJA-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)C1	ZINC000591147175	355255148	/nfs/dbraw/zinc/25/51/48/355255148.db2.gz	BRTZVXQXCRBBSK-GFCCVEGCSA-N	1	1	323.372	1.345	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1C	ZINC000592129661	355507282	/nfs/dbraw/zinc/50/72/82/355507282.db2.gz	NFLJWLOYOILDES-ZYHUDNBSSA-N	1	1	308.334	1.844	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)n1	ZINC000594198979	356137903	/nfs/dbraw/zinc/13/79/03/356137903.db2.gz	WXAPPBXZEBOZSJ-WDEREUQCSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC(C)c1ccc(CN2CC[N@H+]3C[C@H](O)C[C@H]3C2)cc1[N+](=O)[O-]	ZINC000594613716	356266456	/nfs/dbraw/zinc/26/64/56/356266456.db2.gz	RDZUPQVFXXOYOW-LSDHHAIUSA-N	1	1	319.405	1.969	20	5		DDBDMO
C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@@H]1[NH3+]	ZINC000595229403	356412346	/nfs/dbraw/zinc/41/23/46/356412346.db2.gz	XJBZKMWIYJMBPI-KCJUWKMLSA-N	1	1	303.322	1.280	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCOCCO)C1CCC1	ZINC000595597520	356569275	/nfs/dbraw/zinc/56/92/75/356569275.db2.gz	QRTXOPBDJJUCQX-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@H]1COCCO1	ZINC000595738010	356629156	/nfs/dbraw/zinc/62/91/56/356629156.db2.gz	UUDJBLBKBVADAM-SMDDNHRTSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1COCCO1	ZINC000595738010	356629158	/nfs/dbraw/zinc/62/91/58/356629158.db2.gz	UUDJBLBKBVADAM-SMDDNHRTSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2	ZINC000595760624	356642036	/nfs/dbraw/zinc/64/20/36/356642036.db2.gz	UWYPFBDHFMEFMV-CZUORRHYSA-N	1	1	320.345	1.930	20	5		DDBDMO
C[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)[NH+]1CCOCC1	ZINC000596113922	356776939	/nfs/dbraw/zinc/77/69/39/356776939.db2.gz	FBFHWMGQHMKLNZ-WDEREUQCSA-N	1	1	322.365	1.215	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000596232927	356826277	/nfs/dbraw/zinc/82/62/77/356826277.db2.gz	UFCBBOCIQYUSJZ-QYJAPNMZSA-N	1	1	318.377	1.755	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC([N@H+]3CCCOCC3)CC2)s1	ZINC000596268652	356839095	/nfs/dbraw/zinc/83/90/95/356839095.db2.gz	NPRSULHMEGKWCG-UHFFFAOYSA-N	1	1	312.395	1.742	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC(C[NH+]2CCOCC2)C1	ZINC000597682504	357283528	/nfs/dbraw/zinc/28/35/28/357283528.db2.gz	PQUGPTKKMJLRKD-UHFFFAOYSA-N	1	1	323.324	1.138	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C2	ZINC000597709974	357296090	/nfs/dbraw/zinc/29/60/90/357296090.db2.gz	FLWCXBHYNRBZHP-HNNXBMFYSA-N	1	1	320.349	1.253	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000598592662	357645278	/nfs/dbraw/zinc/64/52/78/357645278.db2.gz	LHCKTVBCJOSSDF-VIFPVBQESA-N	1	1	308.338	1.671	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000598746059	357714420	/nfs/dbraw/zinc/71/44/20/357714420.db2.gz	QKGAXGWTDAUWJX-SECBINFHSA-N	1	1	308.338	1.298	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CCCC[N@@H+](C)C2)n1	ZINC000599137646	357826730	/nfs/dbraw/zinc/82/67/30/357826730.db2.gz	ARVKLQWEIGQFLR-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCC[N@H+]1CC[C@H](O)C1	ZINC000599199800	357847767	/nfs/dbraw/zinc/84/77/67/357847767.db2.gz	QRUNJJXQAZALOU-NSHDSACASA-N	1	1	323.349	1.168	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1c[nH]nc1[N+](=O)[O-]	ZINC000600228815	358163730	/nfs/dbraw/zinc/16/37/30/358163730.db2.gz	GCFURIBEROCQMH-LLVKDONJSA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601006290	358379027	/nfs/dbraw/zinc/37/90/27/358379027.db2.gz	UNHAHNGHXWANRE-SNVBAGLBSA-N	1	1	307.325	1.948	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000601109662	358405610	/nfs/dbraw/zinc/40/56/10/358405610.db2.gz	WGIISJIPOZEVHZ-SSDOTTSWSA-N	1	1	319.287	1.996	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC([NH+]2CCOCC2)CC1	ZINC000601197519	358443539	/nfs/dbraw/zinc/44/35/39/358443539.db2.gz	CGQRUNTUNSTCBC-UHFFFAOYSA-N	1	1	310.329	1.430	20	5		DDBDMO
C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)C[C@](C)(O)C1CC1	ZINC000601956535	358752913	/nfs/dbraw/zinc/75/29/13/358752913.db2.gz	RUNLZTJFGASDIC-ZBFHGGJFSA-N	1	1	308.378	1.939	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)C[C@](C)(O)C1CC1	ZINC000601956535	358752917	/nfs/dbraw/zinc/75/29/17/358752917.db2.gz	RUNLZTJFGASDIC-ZBFHGGJFSA-N	1	1	308.378	1.939	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000602782544	359187146	/nfs/dbraw/zinc/18/71/46/359187146.db2.gz	CSJMQSHSYFHWGH-UONOGXRCSA-N	1	1	307.398	1.516	20	5		DDBDMO
CC(C)c1ncc2c(n1)CC[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C2	ZINC000602720618	359148140	/nfs/dbraw/zinc/14/81/40/359148140.db2.gz	JEJTXHDSMPBBTI-UHFFFAOYSA-N	1	1	316.365	1.800	20	5		DDBDMO
CC(C)c1ncc2c(n1)CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C2	ZINC000602720618	359148143	/nfs/dbraw/zinc/14/81/43/359148143.db2.gz	JEJTXHDSMPBBTI-UHFFFAOYSA-N	1	1	316.365	1.800	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C[C@@H]1CCC(=O)N1)C(C)C	ZINC000602845301	359234184	/nfs/dbraw/zinc/23/41/84/359234184.db2.gz	HKBGJMGJFCJPDG-LBPRGKRZSA-N	1	1	309.370	1.089	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602824934	359218791	/nfs/dbraw/zinc/21/87/91/359218791.db2.gz	FTCUBGLUAXIOBJ-CYBMUJFWSA-N	1	1	323.397	1.480	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21	ZINC000602914517	359292119	/nfs/dbraw/zinc/29/21/19/359292119.db2.gz	FVRMCLBWQQTHKO-JHJVBQTASA-N	1	1	322.365	1.492	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@@H]2CCC[C@@H]21	ZINC000602914517	359292123	/nfs/dbraw/zinc/29/21/23/359292123.db2.gz	FVRMCLBWQQTHKO-JHJVBQTASA-N	1	1	322.365	1.492	20	5		DDBDMO
Cc1nn(CC[N@H+]2C[C@H]3CC[C@@H](C2)O3)c2ncc([N+](=O)[O-])cc12	ZINC000603329646	359572321	/nfs/dbraw/zinc/57/23/21/359572321.db2.gz	YELXQPWHZRXZJK-BETUJISGSA-N	1	1	317.349	1.511	20	5		DDBDMO
Cc1nn(CC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c2ncc([N+](=O)[O-])cc12	ZINC000603329646	359572326	/nfs/dbraw/zinc/57/23/26/359572326.db2.gz	YELXQPWHZRXZJK-BETUJISGSA-N	1	1	317.349	1.511	20	5		DDBDMO
COc1cc([N+](=O)[O-])cn(CCCCn2cc[nH+]c2C)c1=O	ZINC000603360432	359591922	/nfs/dbraw/zinc/59/19/22/359591922.db2.gz	ZZUUACQQTHHYGH-UHFFFAOYSA-N	1	1	306.322	1.750	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000187152934	200069314	/nfs/dbraw/zinc/06/93/14/200069314.db2.gz	YMTUUGVSDHYAAQ-JTQLQIEISA-N	1	1	308.338	1.109	20	5		DDBDMO
Cc1c(NC(=O)NCC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000187439797	200112780	/nfs/dbraw/zinc/11/27/80/200112780.db2.gz	OONTVTACTNDHRH-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
CO[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C	ZINC000189289042	200376859	/nfs/dbraw/zinc/37/68/59/200376859.db2.gz	JTFVLQOWJJIDGS-WFASDCNBSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C	ZINC000189289042	200376861	/nfs/dbraw/zinc/37/68/61/200376861.db2.gz	JTFVLQOWJJIDGS-WFASDCNBSA-N	1	1	321.377	1.914	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cccc(C)c2[N+](=O)[O-])C1	ZINC000609269404	360285418	/nfs/dbraw/zinc/28/54/18/360285418.db2.gz	PRCIKOCHYQTKBI-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000609802170	360351347	/nfs/dbraw/zinc/35/13/47/360351347.db2.gz	BZFHBTDBOUNCKP-ZDUSSCGKSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@H](Nc3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000609802170	360351350	/nfs/dbraw/zinc/35/13/50/360351350.db2.gz	BZFHBTDBOUNCKP-ZDUSSCGKSA-N	1	1	305.382	1.570	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)[C@@H](C)C1	ZINC000610177827	360388248	/nfs/dbraw/zinc/38/82/48/360388248.db2.gz	HUXVWSPPVVOONH-AAEUAGOBSA-N	1	1	308.382	1.736	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC(C)(C)O)c1cccc([N+](=O)[O-])c1	ZINC000611560952	360760214	/nfs/dbraw/zinc/76/02/14/360760214.db2.gz	SLJNYCXUXIQSJK-CYBMUJFWSA-N	1	1	304.350	1.778	20	5		DDBDMO
C[N@H+](C1CC(O)C1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000612741057	361129827	/nfs/dbraw/zinc/12/98/27/361129827.db2.gz	ZKZLFYRTERGFDY-JXQTWKCFSA-N	1	1	305.334	1.155	20	5		DDBDMO
C[N@@H+](C1CC(O)C1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000612741057	361129828	/nfs/dbraw/zinc/12/98/28/361129828.db2.gz	ZKZLFYRTERGFDY-JXQTWKCFSA-N	1	1	305.334	1.155	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000194632412	201266267	/nfs/dbraw/zinc/26/62/67/201266267.db2.gz	WTYVKCHSCUIKMR-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619255008	363946702	/nfs/dbraw/zinc/94/67/02/363946702.db2.gz	SIMWKWIQUFEUSC-KGLIPLIRSA-N	1	1	322.340	1.557	20	5		DDBDMO
Cc1ccc(CN2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000245717506	202540097	/nfs/dbraw/zinc/54/00/97/202540097.db2.gz	HGWBWQIDUHATOL-KGLIPLIRSA-N	1	1	307.394	1.790	20	5		DDBDMO
COC(=O)c1cc(NC(=O)CC(F)(F)C[NH3+])cc([N+](=O)[O-])c1	ZINC000566404640	304150585	/nfs/dbraw/zinc/15/05/85/304150585.db2.gz	TYYBXWXQPDIULJ-UHFFFAOYSA-N	1	1	317.248	1.304	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000264939351	204286505	/nfs/dbraw/zinc/28/65/05/204286505.db2.gz	VJMUCCSPRPEXSX-LLVKDONJSA-N	1	1	302.334	1.900	20	5		DDBDMO
CC(C)[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200780	284308312	/nfs/dbraw/zinc/30/83/12/284308312.db2.gz	JOUNYNDRUJWCDV-HOCLYGCPSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200780	284308315	/nfs/dbraw/zinc/30/83/15/284308315.db2.gz	JOUNYNDRUJWCDV-HOCLYGCPSA-N	1	1	324.377	1.691	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000261993351	296227854	/nfs/dbraw/zinc/22/78/54/296227854.db2.gz	PDYQANYAAVAKEZ-LLVKDONJSA-N	1	1	302.290	1.370	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000341064909	251364897	/nfs/dbraw/zinc/36/48/97/251364897.db2.gz	HKNBFJXEHZCWPL-TXEJJXNPSA-N	1	1	308.382	1.926	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N2CC[NH2+]C[C@H]2C)cc1[N+](=O)[O-]	ZINC000193246981	291820506	/nfs/dbraw/zinc/82/05/06/291820506.db2.gz	PMOPKSVWCQBKJE-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000119623499	195005360	/nfs/dbraw/zinc/00/53/60/195005360.db2.gz	UDMGNNVOXJSSRG-GFCCVEGCSA-N	1	1	320.393	1.885	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2CN2CCOCC2)cs1	ZINC000174024712	285086417	/nfs/dbraw/zinc/08/64/17/285086417.db2.gz	BZHBIAVGJVULMY-ZDUSSCGKSA-N	1	1	311.407	1.953	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H]2CN2CCOCC2)cs1	ZINC000174024712	285086420	/nfs/dbraw/zinc/08/64/20/285086420.db2.gz	BZHBIAVGJVULMY-ZDUSSCGKSA-N	1	1	311.407	1.953	20	5		DDBDMO
C[C@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C[NH+](C)C	ZINC001120489017	781979832	/nfs/dbraw/zinc/97/98/32/781979832.db2.gz	MEGIXRQYSVWZEM-OLZOCXBDSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@H](C[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-])CN(C)C	ZINC001120489017	781979841	/nfs/dbraw/zinc/97/98/41/781979841.db2.gz	MEGIXRQYSVWZEM-OLZOCXBDSA-N	1	1	311.382	1.122	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000451539477	533413644	/nfs/dbraw/zinc/41/36/44/533413644.db2.gz	FISFUGJRPFNBHY-XNRPHZJLSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000330918567	533604077	/nfs/dbraw/zinc/60/40/77/533604077.db2.gz	XMDBFEPJPFLFJU-NEPJUHHUSA-N	1	1	307.350	1.573	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[NH2+]C[C@@H]1C	ZINC000123486634	291993164	/nfs/dbraw/zinc/99/31/64/291993164.db2.gz	QCPNDMVIOUGOBW-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
O=C1N=NCN1C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000568468658	304294131	/nfs/dbraw/zinc/29/41/31/304294131.db2.gz	KYUMSLVBTFFARI-UHFFFAOYSA-N	1	1	303.322	1.729	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2[C@@H]2CCCOC2)c1	ZINC000569453296	304355234	/nfs/dbraw/zinc/35/52/34/304355234.db2.gz	UVMIDDYHOWZRER-YUELXQCFSA-N	1	1	324.381	1.043	20	5		DDBDMO
CC[N@H+](CCCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000266578707	407566972	/nfs/dbraw/zinc/56/69/72/407566972.db2.gz	QTVAVDMISUTMEQ-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
CC[N@@H+](CCCO)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000266578707	407566976	/nfs/dbraw/zinc/56/69/76/407566976.db2.gz	QTVAVDMISUTMEQ-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccccc1	ZINC000081573401	407077889	/nfs/dbraw/zinc/07/78/89/407077889.db2.gz	GWEXASAPDQAIKV-RCBQFDQVSA-N	1	1	316.361	1.845	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000089205059	407126163	/nfs/dbraw/zinc/12/61/63/407126163.db2.gz	YFOOVIBRUHPNEI-GFCCVEGCSA-N	1	1	319.321	1.130	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000089205059	407126164	/nfs/dbraw/zinc/12/61/64/407126164.db2.gz	YFOOVIBRUHPNEI-GFCCVEGCSA-N	1	1	319.321	1.130	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1	ZINC000052101699	407148126	/nfs/dbraw/zinc/14/81/26/407148126.db2.gz	KIHBIMCPHWAUKI-ZFWWWQNUSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000107892515	407381333	/nfs/dbraw/zinc/38/13/33/407381333.db2.gz	AGVLSJVTKKGBLC-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111320758	407407613	/nfs/dbraw/zinc/40/76/13/407407613.db2.gz	FRLBOFORXPRZPD-FMVWZJFZSA-N	1	1	319.361	1.910	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000261755502	407602996	/nfs/dbraw/zinc/60/29/96/407602996.db2.gz	UIOJDCYDRIOFCW-SNVBAGLBSA-N	1	1	319.358	1.386	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000171167442	407614380	/nfs/dbraw/zinc/61/43/80/407614380.db2.gz	RHMNXHSEFLHYFC-UHFFFAOYSA-N	1	1	308.382	1.777	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000171626206	407723302	/nfs/dbraw/zinc/72/33/02/407723302.db2.gz	BEDVKTIRAKAEAY-HUUCEWRRSA-N	1	1	321.377	1.115	20	5		DDBDMO
C[C@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1	ZINC000171649831	407733816	/nfs/dbraw/zinc/73/38/16/407733816.db2.gz	HCIAYNMIZCLYMU-LLVKDONJSA-N	1	1	306.366	1.877	20	5		DDBDMO
Nc1c(C(=O)N2CC[NH+](C3CCC3)CC2)cccc1[N+](=O)[O-]	ZINC000267235922	407800938	/nfs/dbraw/zinc/80/09/38/407800938.db2.gz	HPBGRLFUCPTISE-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000117293619	407822278	/nfs/dbraw/zinc/82/22/78/407822278.db2.gz	AAZIQNCRMSPTET-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000117293619	407822284	/nfs/dbraw/zinc/82/22/84/407822284.db2.gz	AAZIQNCRMSPTET-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000187253162	407838440	/nfs/dbraw/zinc/83/84/40/407838440.db2.gz	SYAJZLSPPHLKHE-GFUIURDCSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000187253162	407838446	/nfs/dbraw/zinc/83/84/46/407838446.db2.gz	SYAJZLSPPHLKHE-GFUIURDCSA-N	1	1	319.361	1.133	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000268242969	407965422	/nfs/dbraw/zinc/96/54/22/407965422.db2.gz	VGABIQLVQBMZAW-GXFFZTMASA-N	1	1	319.361	1.816	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000272544365	407976259	/nfs/dbraw/zinc/97/62/59/407976259.db2.gz	CJDIWVPGXCXKDV-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1ccc(C(=O)NCC[N@@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000189433362	408014624	/nfs/dbraw/zinc/01/46/24/408014624.db2.gz	VKIAMGDDGALDCM-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1ccc(C(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000189433362	408014632	/nfs/dbraw/zinc/01/46/32/408014632.db2.gz	VKIAMGDDGALDCM-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000182116292	408075684	/nfs/dbraw/zinc/07/56/84/408075684.db2.gz	BMDZQYWIMBULOX-ZDUSSCGKSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNc2ncc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000273138613	408077528	/nfs/dbraw/zinc/07/75/28/408077528.db2.gz	DIUHYVKXVPUMPY-PHIMTYICSA-N	1	1	309.370	1.685	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2ncc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000273138613	408077535	/nfs/dbraw/zinc/07/75/35/408077535.db2.gz	DIUHYVKXVPUMPY-PHIMTYICSA-N	1	1	309.370	1.685	20	5		DDBDMO
C[C@H]1C[C@H](C)C[NH+](CCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136222824	408088572	/nfs/dbraw/zinc/08/85/72/408088572.db2.gz	RPCMQAWIZYEADS-QWRGUYRKSA-N	1	1	309.370	1.416	20	5		DDBDMO
C[N@@H+](CCOCC1CC1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273322230	408152758	/nfs/dbraw/zinc/15/27/58/408152758.db2.gz	KJFULLBUGGMGMC-CQSZACIVSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000155619889	408187232	/nfs/dbraw/zinc/18/72/32/408187232.db2.gz	PTIGPIYXZLPPAI-UHFFFAOYSA-N	1	1	315.395	1.354	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000175729227	408188647	/nfs/dbraw/zinc/18/86/47/408188647.db2.gz	BYCCSKXKZZMPGR-DTWKUNHWSA-N	1	1	307.354	1.235	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@H]2C1	ZINC000246383065	408237324	/nfs/dbraw/zinc/23/73/24/408237324.db2.gz	OTVMHRMIFUDWKR-OLZOCXBDSA-N	1	1	318.377	1.702	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2c(C)cccc2[N+](=O)[O-])CC1	ZINC000263772430	408250162	/nfs/dbraw/zinc/25/01/62/408250162.db2.gz	SWPXVWGPLKIDJB-UHFFFAOYSA-N	1	1	306.366	1.526	20	5		DDBDMO
Cc1c(NC(=O)CC[NH+]2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000122189025	408264702	/nfs/dbraw/zinc/26/47/02/408264702.db2.gz	SQVINETZBSOECB-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO	ZINC000190812974	408323674	/nfs/dbraw/zinc/32/36/74/408323674.db2.gz	QCZUFQJSBNLLME-QWHCGFSZSA-N	1	1	312.366	1.427	20	5		DDBDMO
CCCC[N@@H+](C)CC1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000263962865	408329086	/nfs/dbraw/zinc/32/90/86/408329086.db2.gz	PVCJHHWKZIXTPK-UHFFFAOYSA-N	1	1	322.413	1.915	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000269432252	408305678	/nfs/dbraw/zinc/30/56/78/408305678.db2.gz	BTHQFUYOZZLRGS-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000176307172	408337545	/nfs/dbraw/zinc/33/75/45/408337545.db2.gz	RLPIFOJGEXFGQH-OLZOCXBDSA-N	1	1	318.377	1.876	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNc1c(F)cc([N+](=O)[O-])cc1F	ZINC000269671883	408384059	/nfs/dbraw/zinc/38/40/59/408384059.db2.gz	XJVLLUXMGXTCGN-SNVBAGLBSA-N	1	1	300.309	1.531	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1c(F)cc([N+](=O)[O-])cc1F	ZINC000269671883	408384063	/nfs/dbraw/zinc/38/40/63/408384063.db2.gz	XJVLLUXMGXTCGN-SNVBAGLBSA-N	1	1	300.309	1.531	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000264166415	408387490	/nfs/dbraw/zinc/38/74/90/408387490.db2.gz	JUJWUZXZTMRTCS-LBPRGKRZSA-N	1	1	307.350	1.384	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000274574852	408456522	/nfs/dbraw/zinc/45/65/22/408456522.db2.gz	GIXBHDJVRZCXGW-INIZCTEOSA-N	1	1	322.361	1.873	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000269745457	408413850	/nfs/dbraw/zinc/41/38/50/408413850.db2.gz	XREKLIDGSAFKDW-AWEZNQCLSA-N	1	1	321.377	1.283	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000247545933	408491659	/nfs/dbraw/zinc/49/16/59/408491659.db2.gz	YIPSKNDDUFMRJG-GXTWGEPZSA-N	1	1	323.397	1.370	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402006	408475789	/nfs/dbraw/zinc/47/57/89/408475789.db2.gz	HSGGWECHQXAKEF-AAEUAGOBSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000264402006	408475795	/nfs/dbraw/zinc/47/57/95/408475795.db2.gz	HSGGWECHQXAKEF-AAEUAGOBSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC1(O)CC[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1	ZINC000177312747	408577048	/nfs/dbraw/zinc/57/70/48/408577048.db2.gz	ZJAYHVASMUBDEI-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1O	ZINC000275544140	408596161	/nfs/dbraw/zinc/59/61/61/408596161.db2.gz	ZLRIYRBXYMLJQS-HIFRSBDPSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000161817624	408642448	/nfs/dbraw/zinc/64/24/48/408642448.db2.gz	BAAQAKIDVUIQEN-SNVBAGLBSA-N	1	1	307.354	1.407	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000248880619	408654222	/nfs/dbraw/zinc/65/42/22/408654222.db2.gz	WVPGHUACUMNUMJ-LOWVWBTDSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000248880619	408654224	/nfs/dbraw/zinc/65/42/24/408654224.db2.gz	WVPGHUACUMNUMJ-LOWVWBTDSA-N	1	1	308.338	1.065	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000250817943	408779712	/nfs/dbraw/zinc/77/97/12/408779712.db2.gz	WIODLFDGQKXGAM-QWRGUYRKSA-N	1	1	312.757	1.918	20	5		DDBDMO
CC(=O)c1ccc(OC[C@@H](O)C[N@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000290797768	408834461	/nfs/dbraw/zinc/83/44/61/408834461.db2.gz	PDQXNBHHDRBPMK-ZDUSSCGKSA-N	1	1	308.334	1.631	20	5		DDBDMO
C[C@@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000285746207	408855752	/nfs/dbraw/zinc/85/57/52/408855752.db2.gz	HJXCSRZJABAVCB-GHMZBOCLSA-N	1	1	321.381	1.701	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2nc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000280914794	408858151	/nfs/dbraw/zinc/85/81/51/408858151.db2.gz	FGIKPOUAUZGSDP-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCCO	ZINC000281622747	408898619	/nfs/dbraw/zinc/89/86/19/408898619.db2.gz	HRCOTUPBEBKQTN-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCO	ZINC000281622747	408898622	/nfs/dbraw/zinc/89/86/22/408898622.db2.gz	HRCOTUPBEBKQTN-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CN1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000191137480	163174657	/nfs/dbraw/zinc/17/46/57/163174657.db2.gz	VBKYJCOWELWKSO-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000277508386	408954563	/nfs/dbraw/zinc/95/45/63/408954563.db2.gz	KRUFBJJJAMRANU-GFCCVEGCSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1cc(N)ccc1[N+](=O)[O-]	ZINC000286328481	408964833	/nfs/dbraw/zinc/96/48/33/408964833.db2.gz	LHOVSEPJMQOGTQ-WCQYABFASA-N	1	1	306.366	1.476	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000292151111	408991283	/nfs/dbraw/zinc/99/12/83/408991283.db2.gz	ILODXHJZCBBUQR-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
CC(=O)c1cc(NC[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000287520510	409049825	/nfs/dbraw/zinc/04/98/25/409049825.db2.gz	VFWMDQAQLAUZGM-ZDUSSCGKSA-N	1	1	306.366	1.455	20	5		DDBDMO
CC(=O)c1cc(NC[C@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000287520510	409049826	/nfs/dbraw/zinc/04/98/26/409049826.db2.gz	VFWMDQAQLAUZGM-ZDUSSCGKSA-N	1	1	306.366	1.455	20	5		DDBDMO
COCCO[C@H]1C[C@@H](CO)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000278398502	409080370	/nfs/dbraw/zinc/08/03/70/409080370.db2.gz	WCFCSRITTLIYLB-ZBFHGGJFSA-N	1	1	324.377	1.441	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283648969	409191139	/nfs/dbraw/zinc/19/11/39/409191139.db2.gz	CUROZUDNUWCDAA-VIFPVBQESA-N	1	1	312.345	1.776	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](C2CC2)O1	ZINC000279453510	409217268	/nfs/dbraw/zinc/21/72/68/409217268.db2.gz	ZQIHUAFFVWWTJW-BXUZGUMPSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](C2CC2)O1	ZINC000279453510	409217272	/nfs/dbraw/zinc/21/72/72/409217272.db2.gz	ZQIHUAFFVWWTJW-BXUZGUMPSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)CCn3cc([N+](=O)[O-])cn3)C2)C1	ZINC000294128154	409245774	/nfs/dbraw/zinc/24/57/74/409245774.db2.gz	MECLBPKDIMLTRX-HNNXBMFYSA-N	1	1	321.381	1.126	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C2)C1	ZINC000294313458	409277433	/nfs/dbraw/zinc/27/74/33/409277433.db2.gz	WMVLZHSAUVWTJY-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000280335421	409294010	/nfs/dbraw/zinc/29/40/10/409294010.db2.gz	VRCZFTABKOCHCG-UHFFFAOYSA-N	1	1	315.333	1.463	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+](C)C2CC2)c([N+](=O)[O-])cc1F	ZINC000294570842	409294625	/nfs/dbraw/zinc/29/46/25/409294625.db2.gz	PCXDYJHIPVCKLQ-UHFFFAOYSA-N	1	1	311.313	1.567	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)CC2(C)C)ccc1[N+](=O)[O-]	ZINC000280400034	409306929	/nfs/dbraw/zinc/30/69/29/409306929.db2.gz	AJGNOOXPWZFPDL-UHFFFAOYSA-N	1	1	321.377	1.835	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[N@H+](C[C@H](C)O)C[C@@H]1C	ZINC000284269179	409308374	/nfs/dbraw/zinc/30/83/74/409308374.db2.gz	GUUBLVWFPPMXQL-KBPBESRZSA-N	1	1	307.394	1.790	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCO[C@H]2CC[N@@H+](C)C[C@@H]21	ZINC000284923289	409371270	/nfs/dbraw/zinc/37/12/70/409371270.db2.gz	UDBBXQCDVTWMIZ-HOCLYGCPSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280507073	409333184	/nfs/dbraw/zinc/33/31/84/409333184.db2.gz	NINIUUHUPPEYNQ-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280507073	409333189	/nfs/dbraw/zinc/33/31/89/409333189.db2.gz	NINIUUHUPPEYNQ-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285377174	409418336	/nfs/dbraw/zinc/41/83/36/409418336.db2.gz	MWOBPQRVCHTYBD-JTQLQIEISA-N	1	1	318.337	1.554	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000321723623	164044445	/nfs/dbraw/zinc/04/44/45/164044445.db2.gz	ZXTUUSQAZQLYMG-STQMWFEESA-N	1	1	318.377	1.993	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccnc2c1cccc2[N+](=O)[O-]	ZINC000322079791	164045719	/nfs/dbraw/zinc/04/57/19/164045719.db2.gz	RLLRZYRAVVMPMR-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1	ZINC000322079791	164045720	/nfs/dbraw/zinc/04/57/20/164045720.db2.gz	RLLRZYRAVVMPMR-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1	ZINC000322079791	164045723	/nfs/dbraw/zinc/04/57/23/164045723.db2.gz	RLLRZYRAVVMPMR-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000408029606	164203571	/nfs/dbraw/zinc/20/35/71/164203571.db2.gz	UWLQOFPMZNTXFY-KBPBESRZSA-N	1	1	304.350	1.655	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000331533979	409612042	/nfs/dbraw/zinc/61/20/42/409612042.db2.gz	POWVGFFLXBATOO-TVQRCGJNSA-N	1	1	307.325	1.946	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C	ZINC000346185036	409851151	/nfs/dbraw/zinc/85/11/51/409851151.db2.gz	GNBHNVMYNZQDTE-OLZOCXBDSA-N	1	1	308.382	1.171	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000346325888	409917883	/nfs/dbraw/zinc/91/78/83/409917883.db2.gz	RRRDAOYGYDFOES-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Nc3ccncc3[N+](=O)[O-])C2)C1	ZINC000297855314	410025952	/nfs/dbraw/zinc/02/59/52/410025952.db2.gz	TXIKWKJAJGQPOZ-CQSZACIVSA-N	1	1	305.338	1.549	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000332272984	410032063	/nfs/dbraw/zinc/03/20/63/410032063.db2.gz	PYJLSUGWGIQJPY-NSHDSACASA-N	1	1	316.361	1.781	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000332272984	410032067	/nfs/dbraw/zinc/03/20/67/410032067.db2.gz	PYJLSUGWGIQJPY-NSHDSACASA-N	1	1	316.361	1.781	20	5		DDBDMO
CCC[C@H]1CN(c2c([N+](=O)[O-])ncn2C)CC[N@H+]1CCOC	ZINC000346659760	410064524	/nfs/dbraw/zinc/06/45/24/410064524.db2.gz	RILQGZCMTBFTIG-LBPRGKRZSA-N	1	1	311.386	1.265	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)N1CCCCC1	ZINC000332430614	410152316	/nfs/dbraw/zinc/15/23/16/410152316.db2.gz	GYKUNIDBQVTMFH-UHFFFAOYSA-N	1	1	318.377	1.751	20	5		DDBDMO
C[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@H]1C	ZINC000351700901	410160480	/nfs/dbraw/zinc/16/04/80/410160480.db2.gz	TUWAYWZQIUKYRJ-OLZOCXBDSA-N	1	1	323.397	1.561	20	5		DDBDMO
C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCC[C@H](C)C1	ZINC000298755316	410382812	/nfs/dbraw/zinc/38/28/12/410382812.db2.gz	YACISCNPJBTAGD-QWRGUYRKSA-N	1	1	321.381	1.621	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+]2CC=C(C)CC2)c1[N+](=O)[O-]	ZINC000355334937	410452658	/nfs/dbraw/zinc/45/26/58/410452658.db2.gz	IYSZYIIFBBPWDS-UHFFFAOYSA-N	1	1	321.381	1.652	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000355330169	410448463	/nfs/dbraw/zinc/44/84/63/410448463.db2.gz	DIGHWYFTKILXIP-UHFFFAOYSA-N	1	1	322.340	1.698	20	5		DDBDMO
Nc1nc(NCC[N@@H+]2CCc3sccc3C2)ncc1[N+](=O)[O-]	ZINC000299040599	410495867	/nfs/dbraw/zinc/49/58/67/410495867.db2.gz	CJZNDAMPIKSAGS-UHFFFAOYSA-N	1	1	320.378	1.499	20	5		DDBDMO
Nc1nc(NCC[N@H+]2CCc3sccc3C2)ncc1[N+](=O)[O-]	ZINC000299040599	410495872	/nfs/dbraw/zinc/49/58/72/410495872.db2.gz	CJZNDAMPIKSAGS-UHFFFAOYSA-N	1	1	320.378	1.499	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C)O[C@H](C(N)=O)C1	ZINC000347358661	410493122	/nfs/dbraw/zinc/49/31/22/410493122.db2.gz	LHFYVTZGTRSOBY-BXVLGRBHSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C)O[C@H](C(N)=O)C1	ZINC000347358661	410493125	/nfs/dbraw/zinc/49/31/25/410493125.db2.gz	LHFYVTZGTRSOBY-BXVLGRBHSA-N	1	1	319.361	1.573	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)C(=O)Nc1cc(F)cc([N+](=O)[O-])c1	ZINC000352191070	410534882	/nfs/dbraw/zinc/53/48/82/410534882.db2.gz	SEVXYCHTDBMKNK-JTQLQIEISA-N	1	1	311.313	1.641	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000352185434	410530571	/nfs/dbraw/zinc/53/05/71/410530571.db2.gz	CJMXVBAGUNIJFI-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C2CC(OC)C2)c([N+](=O)[O-])c1	ZINC000352230499	410567319	/nfs/dbraw/zinc/56/73/19/410567319.db2.gz	LBKNYCZJUHOOAB-UHFFFAOYSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C2CC(OC)C2)c([N+](=O)[O-])c1	ZINC000352230499	410567325	/nfs/dbraw/zinc/56/73/25/410567325.db2.gz	LBKNYCZJUHOOAB-UHFFFAOYSA-N	1	1	323.349	1.651	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)C1	ZINC000301304084	410697320	/nfs/dbraw/zinc/69/73/20/410697320.db2.gz	SVEFHFGTTUBOCR-CQSZACIVSA-N	1	1	322.384	1.950	20	5		DDBDMO
C[C@@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330565223	410781341	/nfs/dbraw/zinc/78/13/41/410781341.db2.gz	ACZKFZRTZIDVSU-OLZOCXBDSA-N	1	1	320.393	1.582	20	5		DDBDMO
C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCCC[C@@H]1C	ZINC000340267394	410808802	/nfs/dbraw/zinc/80/88/02/410808802.db2.gz	HYFYOIFIFATVMS-NWDGAFQWSA-N	1	1	309.370	1.170	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCC[C@H]1CO	ZINC000343919956	410811340	/nfs/dbraw/zinc/81/13/40/410811340.db2.gz	INAKFEYRYIZXMR-LBPRGKRZSA-N	1	1	321.333	1.350	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000330636886	410841493	/nfs/dbraw/zinc/84/14/93/410841493.db2.gz	ANSTWDJEZUYFLX-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000330636886	410841499	/nfs/dbraw/zinc/84/14/99/410841499.db2.gz	ANSTWDJEZUYFLX-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)C[C@@H]1C	ZINC000330665858	410861981	/nfs/dbraw/zinc/86/19/81/410861981.db2.gz	HJMAGSLFNVTKRL-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCCC[C@@H]1C	ZINC000356149521	410863029	/nfs/dbraw/zinc/86/30/29/410863029.db2.gz	HCCQAEIFKJKYQX-WDEREUQCSA-N	1	1	309.370	1.321	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@@H+]2CCCC[C@H]2CO1	ZINC000301878317	410820201	/nfs/dbraw/zinc/82/02/01/410820201.db2.gz	UCQUJUMGMYWQBC-GXTWGEPZSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1C[N@H+]2CCCC[C@H]2CO1	ZINC000301878317	410820205	/nfs/dbraw/zinc/82/02/05/410820205.db2.gz	UCQUJUMGMYWQBC-GXTWGEPZSA-N	1	1	306.366	1.963	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000341172770	410914062	/nfs/dbraw/zinc/91/40/62/410914062.db2.gz	CKOAHZRXMCVRHE-CYBMUJFWSA-N	1	1	318.377	1.673	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000348517815	410995380	/nfs/dbraw/zinc/99/53/80/410995380.db2.gz	YCAPDEDQGWVHGM-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000348517815	410995386	/nfs/dbraw/zinc/99/53/86/410995386.db2.gz	YCAPDEDQGWVHGM-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000348517815	410995393	/nfs/dbraw/zinc/99/53/93/410995393.db2.gz	YCAPDEDQGWVHGM-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399675	411009451	/nfs/dbraw/zinc/00/94/51/411009451.db2.gz	YMXCIWFECXCOBX-NWDGAFQWSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399675	411009457	/nfs/dbraw/zinc/00/94/57/411009457.db2.gz	YMXCIWFECXCOBX-NWDGAFQWSA-N	1	1	305.334	1.657	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C2)C1	ZINC000356289275	410946635	/nfs/dbraw/zinc/94/66/35/410946635.db2.gz	VWOBSARGDXSIHQ-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000331294379	411061680	/nfs/dbraw/zinc/06/16/80/411061680.db2.gz	XZKWBZGIPPBQTD-MFKMUULPSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000331294379	411061684	/nfs/dbraw/zinc/06/16/84/411061684.db2.gz	XZKWBZGIPPBQTD-MFKMUULPSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+](CCO)[C@@H]1CCCSC1	ZINC000331206593	411017195	/nfs/dbraw/zinc/01/71/95/411017195.db2.gz	UFRSQRNCLQDILH-SNVBAGLBSA-N	1	1	300.384	1.018	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+](CCO)[C@@H]1CCCSC1	ZINC000331206593	411017202	/nfs/dbraw/zinc/01/72/02/411017202.db2.gz	UFRSQRNCLQDILH-SNVBAGLBSA-N	1	1	300.384	1.018	20	5		DDBDMO
[NH3+]CCC[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1	ZINC000580714291	422949545	/nfs/dbraw/zinc/94/95/45/422949545.db2.gz	PYQQUOBZHNMXBX-LLVKDONJSA-N	1	1	303.322	1.528	20	5		DDBDMO
O=C(NC1CC[NH+](C2CCCC2)CC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000132410437	196253443	/nfs/dbraw/zinc/25/34/43/196253443.db2.gz	VTOYTNHMRUWBHO-UHFFFAOYSA-N	1	1	307.354	1.455	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](CO)C(C)(C)C	ZINC000134378125	196383776	/nfs/dbraw/zinc/38/37/76/196383776.db2.gz	CXHAGFPUOXZULD-ZDUSSCGKSA-N	1	1	309.366	1.872	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)[C@@H](C)C1	ZINC000360740316	418503989	/nfs/dbraw/zinc/50/39/89/418503989.db2.gz	VZUDDLHQLRPBNV-QWRGUYRKSA-N	1	1	309.370	1.131	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)[C@H](C)C1	ZINC000360740314	418504237	/nfs/dbraw/zinc/50/42/37/418504237.db2.gz	VZUDDLHQLRPBNV-MNOVXSKESA-N	1	1	309.370	1.131	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000188692596	222020799	/nfs/dbraw/zinc/02/07/99/222020799.db2.gz	GYCASGNIAISKSD-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000188692596	222020802	/nfs/dbraw/zinc/02/08/02/222020802.db2.gz	GYCASGNIAISKSD-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)OC)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000291312700	222305857	/nfs/dbraw/zinc/30/58/57/222305857.db2.gz	TWUHCQHEWCQJPF-CHWSQXEVSA-N	1	1	312.366	1.691	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367839100	418644450	/nfs/dbraw/zinc/64/44/50/418644450.db2.gz	KAYRMTWQFWPQFH-WDNDVIMCSA-N	1	1	319.361	1.402	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000342118675	418627247	/nfs/dbraw/zinc/62/72/47/418627247.db2.gz	DYQRJQQNWOVJTH-UHFFFAOYSA-N	1	1	319.365	2.387	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000375668210	418671092	/nfs/dbraw/zinc/67/10/92/418671092.db2.gz	DNOMXMNIDZOPBW-ZNMIVQPWSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000375668210	418671095	/nfs/dbraw/zinc/67/10/95/418671095.db2.gz	DNOMXMNIDZOPBW-ZNMIVQPWSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000375668210	418671097	/nfs/dbraw/zinc/67/10/97/418671097.db2.gz	DNOMXMNIDZOPBW-ZNMIVQPWSA-N	1	1	303.362	1.290	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)CCOc1cccc([N+](=O)[O-])c1	ZINC000361587116	418687337	/nfs/dbraw/zinc/68/73/37/418687337.db2.gz	UWNFTDBMEYHTSN-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1	ZINC000376740652	418701132	/nfs/dbraw/zinc/70/11/32/418701132.db2.gz	XLQFSGADTRGKRL-JSGCOSHPSA-N	1	1	314.349	1.885	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccco2)C(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000364457670	418777299	/nfs/dbraw/zinc/77/72/99/418777299.db2.gz	ORULYDCSLJEWTM-UONOGXRCSA-N	1	1	307.350	1.368	20	5		DDBDMO
CCOc1cccc(N2CC[NH+]([C@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000364855880	418815583	/nfs/dbraw/zinc/81/55/83/418815583.db2.gz	NNYVLRRRUDFRGD-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc[nH]c2C1	ZINC000364950387	418827438	/nfs/dbraw/zinc/82/74/38/418827438.db2.gz	BYWCCIDOUXKKAL-QMMMGPOBSA-N	1	1	301.306	1.187	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000372721320	418894990	/nfs/dbraw/zinc/89/49/90/418894990.db2.gz	CVHRRJULWGBCJU-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1O	ZINC000426213359	419404427	/nfs/dbraw/zinc/40/44/27/419404427.db2.gz	CDVMVPOUUDWCSP-UMVBOHGHSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420936457	419369033	/nfs/dbraw/zinc/36/90/33/419369033.db2.gz	INMBHEOIVQFOFP-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420936457	419369037	/nfs/dbraw/zinc/36/90/37/419369037.db2.gz	INMBHEOIVQFOFP-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000420936974	419370719	/nfs/dbraw/zinc/37/07/19/419370719.db2.gz	JFWLARRQKOJEGQ-CHWSQXEVSA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000426265343	419428380	/nfs/dbraw/zinc/42/83/80/419428380.db2.gz	UMAHFLHOLTWGIN-GFCCVEGCSA-N	1	1	310.350	1.829	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@]12CCOC2)Nc1ccc([N+](=O)[O-])cc1	ZINC000421016430	419451065	/nfs/dbraw/zinc/45/10/65/419451065.db2.gz	JDSXRFSFFZGQGX-OAHLLOKOSA-N	1	1	305.334	1.788	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CO)[C@@H]1C	ZINC000412063465	419609268	/nfs/dbraw/zinc/60/92/68/419609268.db2.gz	BBSACGKTVXDMOM-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CO)[C@@H]1C	ZINC000412063465	419609276	/nfs/dbraw/zinc/60/92/76/419609276.db2.gz	BBSACGKTVXDMOM-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])c(C)cc1C	ZINC000421741289	419707806	/nfs/dbraw/zinc/70/78/06/419707806.db2.gz	BNMWGTVNSROOMC-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NC[C@H]1C[N@H+](C)CCN1C	ZINC000421771475	419721874	/nfs/dbraw/zinc/72/18/74/419721874.db2.gz	WYWOSGIIOWRLGR-ZDUSSCGKSA-N	1	1	320.393	1.187	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000432249305	229090095	/nfs/dbraw/zinc/09/00/95/229090095.db2.gz	CUTUUKFJVVFKQQ-OLZOCXBDSA-N	1	1	321.377	1.833	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC([NH3+])CC1	ZINC000430646199	420170187	/nfs/dbraw/zinc/17/01/87/420170187.db2.gz	DPYNYUGPIISSMS-UHFFFAOYSA-N	1	1	322.365	1.355	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)[C@H](C)O1	ZINC000446061666	230223709	/nfs/dbraw/zinc/22/37/09/230223709.db2.gz	RCNGODKAIKJIBX-MQYQWHSLSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)[C@H](C)O1	ZINC000446061666	230223711	/nfs/dbraw/zinc/22/37/11/230223711.db2.gz	RCNGODKAIKJIBX-MQYQWHSLSA-N	1	1	324.377	1.832	20	5		DDBDMO
COc1cccc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1[N+](=O)[O-]	ZINC000450789075	420532832	/nfs/dbraw/zinc/53/28/32/420532832.db2.gz	IGHOOIOVHOHXKD-TXEJJXNPSA-N	1	1	307.350	1.879	20	5		DDBDMO
CCOc1cccc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000450797330	420533419	/nfs/dbraw/zinc/53/34/19/420533419.db2.gz	SDIHZRPFLLOIFG-BETUJISGSA-N	1	1	323.393	1.885	20	5		DDBDMO
CN(CC(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1)c1ccccc1[N+](=O)[O-]	ZINC000452976241	420693842	/nfs/dbraw/zinc/69/38/42/420693842.db2.gz	OGWSLEFLCPMGJH-SWLSCSKDSA-N	1	1	318.377	1.194	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[C@@H](CC[NH3+])C1	ZINC000443063897	420742277	/nfs/dbraw/zinc/74/22/77/420742277.db2.gz	XISDSYYZYVVQII-OLZOCXBDSA-N	1	1	320.393	1.983	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H](CO)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000488809134	421118838	/nfs/dbraw/zinc/11/88/38/421118838.db2.gz	SXAZSOFZCYXMOS-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)C[C@H]1[NH+]1CCOCC1	ZINC000450388648	421191455	/nfs/dbraw/zinc/19/14/55/421191455.db2.gz	IKMBISLBKFSKEU-TZMCWYRMSA-N	1	1	321.381	1.240	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000561582986	421331037	/nfs/dbraw/zinc/33/10/37/421331037.db2.gz	GEAVLZGLVOEZEW-TXEJJXNPSA-N	1	1	321.377	1.697	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649900	421442818	/nfs/dbraw/zinc/44/28/18/421442818.db2.gz	OCLZXUWIPLSZRH-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649900	421442821	/nfs/dbraw/zinc/44/28/21/421442821.db2.gz	OCLZXUWIPLSZRH-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649900	421442824	/nfs/dbraw/zinc/44/28/24/421442824.db2.gz	OCLZXUWIPLSZRH-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1C[C@H](C)O	ZINC000574857982	422195506	/nfs/dbraw/zinc/19/55/06/422195506.db2.gz	OSHACRCQLAQGLC-WDEREUQCSA-N	1	1	312.345	1.410	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1C[C@H](C)O	ZINC000574857982	422195509	/nfs/dbraw/zinc/19/55/09/422195509.db2.gz	OSHACRCQLAQGLC-WDEREUQCSA-N	1	1	312.345	1.410	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1NCC[N@@H+]1CC[C@@H](O)C1	ZINC000599175979	422404518	/nfs/dbraw/zinc/40/45/18/422404518.db2.gz	MBHXNIJWPBNIQC-GFCCVEGCSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000179708886	263362395	/nfs/dbraw/zinc/36/23/95/263362395.db2.gz	VIRMIBFDGMGARC-HNNXBMFYSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000179708886	263362398	/nfs/dbraw/zinc/36/23/98/263362398.db2.gz	VIRMIBFDGMGARC-HNNXBMFYSA-N	1	1	308.334	1.808	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc21	ZINC000183990957	263384014	/nfs/dbraw/zinc/38/40/14/263384014.db2.gz	DSQJEIAZKIRRDH-UHFFFAOYSA-N	1	1	320.349	1.120	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1C	ZINC000153718158	274272387	/nfs/dbraw/zinc/27/23/87/274272387.db2.gz	BOFAGCIDDGIGHX-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1C	ZINC000153718158	274272389	/nfs/dbraw/zinc/27/23/89/274272389.db2.gz	BOFAGCIDDGIGHX-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[NH+](CCOC(C)C)CC2)n1	ZINC000178243619	274762479	/nfs/dbraw/zinc/76/24/79/274762479.db2.gz	XRHDBLMWPVPMLE-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269468880	276370642	/nfs/dbraw/zinc/37/06/42/276370642.db2.gz	ILVNMBIWUOUDBK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H]1CN(C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000269468880	276370643	/nfs/dbraw/zinc/37/06/43/276370643.db2.gz	ILVNMBIWUOUDBK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000269468880	276370644	/nfs/dbraw/zinc/37/06/44/276370644.db2.gz	ILVNMBIWUOUDBK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)Nc1cccc([N+](=O)[O-])c1	ZINC000363094694	300209727	/nfs/dbraw/zinc/20/97/27/300209727.db2.gz	HJUNASPVYGGADS-KGLIPLIRSA-N	1	1	320.349	1.580	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000363220106	300234115	/nfs/dbraw/zinc/23/41/15/300234115.db2.gz	BTFLMVIIVYMCHZ-MRXNPFEDSA-N	1	1	304.394	1.811	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000363220105	300234282	/nfs/dbraw/zinc/23/42/82/300234282.db2.gz	BTFLMVIIVYMCHZ-INIZCTEOSA-N	1	1	304.394	1.811	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000363304923	300248108	/nfs/dbraw/zinc/24/81/08/300248108.db2.gz	MBOLJWVVDLJXAC-QLFBSQMISA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363304923	300248111	/nfs/dbraw/zinc/24/81/11/300248111.db2.gz	MBOLJWVVDLJXAC-QLFBSQMISA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363304923	300248112	/nfs/dbraw/zinc/24/81/12/300248112.db2.gz	MBOLJWVVDLJXAC-QLFBSQMISA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000364395947	300389626	/nfs/dbraw/zinc/38/96/26/300389626.db2.gz	CEVOVUOLUANJJF-IACUBPJLSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000364395947	300389627	/nfs/dbraw/zinc/38/96/27/300389627.db2.gz	CEVOVUOLUANJJF-IACUBPJLSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000364395947	300389629	/nfs/dbraw/zinc/38/96/29/300389629.db2.gz	CEVOVUOLUANJJF-IACUBPJLSA-N	1	1	323.418	1.742	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](n2cncn2)C1	ZINC000368872554	301098402	/nfs/dbraw/zinc/09/84/02/301098402.db2.gz	LPEXJAQJYIUBQA-ZDUSSCGKSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](n2cncn2)C1	ZINC000368872554	301098404	/nfs/dbraw/zinc/09/84/04/301098404.db2.gz	LPEXJAQJYIUBQA-ZDUSSCGKSA-N	1	1	303.322	1.642	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000368952732	301109250	/nfs/dbraw/zinc/10/92/50/301109250.db2.gz	XEMHFXPZGJHAJE-DFBGVHRSSA-N	1	1	319.361	1.559	20	5		DDBDMO
CCc1nc([C@@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370029638	301261553	/nfs/dbraw/zinc/26/15/53/301261553.db2.gz	SZGUAIKBYDWTAG-LLVKDONJSA-N	1	1	320.353	1.616	20	5		DDBDMO
CCc1nc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370029638	301261557	/nfs/dbraw/zinc/26/15/57/301261557.db2.gz	SZGUAIKBYDWTAG-LLVKDONJSA-N	1	1	320.353	1.616	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000370217832	301296427	/nfs/dbraw/zinc/29/64/27/301296427.db2.gz	BQENGVXURUUPII-JYJNAYRXSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000370217832	301296428	/nfs/dbraw/zinc/29/64/28/301296428.db2.gz	BQENGVXURUUPII-JYJNAYRXSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000370217832	301296431	/nfs/dbraw/zinc/29/64/31/301296431.db2.gz	BQENGVXURUUPII-JYJNAYRXSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@@H+]4CCOC[C@H]4C3)ccc2c1	ZINC000375849085	302003970	/nfs/dbraw/zinc/00/39/70/302003970.db2.gz	PCJDFWMIXQZISL-CQSZACIVSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4CCOC[C@H]4C3)ccc2c1	ZINC000375849085	302003971	/nfs/dbraw/zinc/00/39/71/302003971.db2.gz	PCJDFWMIXQZISL-CQSZACIVSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)S(C)(=O)=O	ZINC000541555370	303423156	/nfs/dbraw/zinc/42/31/56/303423156.db2.gz	AWQGYUHTNHISHP-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3nnc[nH]3)C2)c1	ZINC000366652338	307078793	/nfs/dbraw/zinc/07/87/93/307078793.db2.gz	KMPDFEYWEMVKTL-JSGCOSHPSA-N	1	1	317.349	1.626	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000369067638	307115255	/nfs/dbraw/zinc/11/52/55/307115255.db2.gz	UUZQFMZUIJHRRV-GFCCVEGCSA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1[nH+]c(CNC(=O)c2ccc([N+](=O)[O-])o2)c2n1CCCC2	ZINC000378377003	307287179	/nfs/dbraw/zinc/28/71/79/307287179.db2.gz	KULIKFRKNVBJPK-UHFFFAOYSA-N	1	1	304.306	1.959	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC[N@@H+]3CCOC[C@@H]3C1)CCCC2	ZINC000572116229	308211860	/nfs/dbraw/zinc/21/18/60/308211860.db2.gz	PJKPUYGVWIPGIN-ZDUSSCGKSA-N	1	1	318.377	1.389	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC[N@H+]3CCOC[C@@H]3C1)CCCC2	ZINC000572116229	308211862	/nfs/dbraw/zinc/21/18/62/308211862.db2.gz	PJKPUYGVWIPGIN-ZDUSSCGKSA-N	1	1	318.377	1.389	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000577208709	308370839	/nfs/dbraw/zinc/37/08/39/308370839.db2.gz	PVPDGVUXAAXPLY-ZDUSSCGKSA-N	1	1	318.377	1.195	20	5		DDBDMO
NC(=O)c1ccc(CN2CCC(CC[NH3+])CC2)c([N+](=O)[O-])c1	ZINC000387016899	325763447	/nfs/dbraw/zinc/76/34/47/325763447.db2.gz	CIWYCUFKZXCHPC-UHFFFAOYSA-N	1	1	306.366	1.255	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H]2CCC(=O)N(C)C2)ccc1[N+](=O)[O-]	ZINC000582310094	326010283	/nfs/dbraw/zinc/01/02/83/326010283.db2.gz	YVIDHKRLYZSGTD-GFCCVEGCSA-N	1	1	307.350	1.656	20	5		DDBDMO
Cn1cc[nH+]c1CCNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC001120786290	782140906	/nfs/dbraw/zinc/14/09/06/782140906.db2.gz	GJZZJBNAFQCFDV-UHFFFAOYSA-N	1	1	318.259	1.735	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000364881381	501083129	/nfs/dbraw/zinc/08/31/29/501083129.db2.gz	ITZZAKIHOUBVNR-LLVKDONJSA-N	1	1	308.294	1.024	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000364881381	501083132	/nfs/dbraw/zinc/08/31/32/501083132.db2.gz	ITZZAKIHOUBVNR-LLVKDONJSA-N	1	1	308.294	1.024	20	5		DDBDMO
Cc1c(C(=O)N[C@@H]2CCC[N@@H+](CCCO)C2)cccc1[N+](=O)[O-]	ZINC000295633394	533806111	/nfs/dbraw/zinc/80/61/11/533806111.db2.gz	ZMECBTLPZHFAFP-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
COc1cc(CN2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000451658203	533827241	/nfs/dbraw/zinc/82/72/41/533827241.db2.gz	CIEDABJCBSXXHR-BETUJISGSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000334041730	536521908	/nfs/dbraw/zinc/52/19/08/536521908.db2.gz	AGAMPOAMTMBBCM-PWSUYJOCSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC(C)c1ccc([C@H]([NH3+])CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1	ZINC000422797484	528145235	/nfs/dbraw/zinc/14/52/35/528145235.db2.gz	MVSSYNDIUSVOJJ-GFCCVEGCSA-N	1	1	317.349	1.871	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262259	529343799	/nfs/dbraw/zinc/34/37/99/529343799.db2.gz	XDLNEBYOZMHOHR-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262259	529343802	/nfs/dbraw/zinc/34/38/02/529343802.db2.gz	XDLNEBYOZMHOHR-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000078231716	696448593	/nfs/dbraw/zinc/44/85/93/696448593.db2.gz	OTXCSKKCCUKYJX-NSHDSACASA-N	1	1	322.321	1.717	20	5		DDBDMO
CCOCC[NH+]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000776273789	698090230	/nfs/dbraw/zinc/09/02/30/698090230.db2.gz	AAUASWYTTXHUOX-INIZCTEOSA-N	1	1	323.393	1.282	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000262534277	698473622	/nfs/dbraw/zinc/47/36/22/698473622.db2.gz	QAUGDRVPDOWLRX-KBPBESRZSA-N	1	1	304.394	1.635	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@H+]2CCCOCC2)nc2ccccn21	ZINC000782418936	698723446	/nfs/dbraw/zinc/72/34/46/698723446.db2.gz	YWFFDQNXDPVNEZ-UHFFFAOYSA-N	1	1	305.338	1.377	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1	ZINC000750877834	700253419	/nfs/dbraw/zinc/25/34/19/700253419.db2.gz	UMIOZLIHLKPOFQ-UHFFFAOYSA-N	1	1	309.322	1.177	20	5		DDBDMO
O=C(OCCn1cc([N+](=O)[O-])cn1)[C@H]1CCC[N@H+]1C1CCCC1	ZINC000786878706	699176554	/nfs/dbraw/zinc/17/65/54/699176554.db2.gz	GIDXRNKAIZAUMU-CQSZACIVSA-N	1	1	322.365	1.742	20	5		DDBDMO
C[N@H+](CC1CCOCC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794638324	699820559	/nfs/dbraw/zinc/82/05/59/699820559.db2.gz	CGIUMXWIZQCDMN-UHFFFAOYSA-N	1	1	321.333	1.819	20	5		DDBDMO
C[N@@H+](CC1CCOCC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794638324	699820561	/nfs/dbraw/zinc/82/05/61/699820561.db2.gz	CGIUMXWIZQCDMN-UHFFFAOYSA-N	1	1	321.333	1.819	20	5		DDBDMO
C[C@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000742197912	699866454	/nfs/dbraw/zinc/86/64/54/699866454.db2.gz	WKXWVRDCCOJQCZ-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000742197912	699866457	/nfs/dbraw/zinc/86/64/57/699866457.db2.gz	WKXWVRDCCOJQCZ-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000801891055	700351131	/nfs/dbraw/zinc/35/11/31/700351131.db2.gz	GNAYFLQWFZVQBI-SNVBAGLBSA-N	1	1	322.340	1.625	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCC3OCCCO3)C2)nc1	ZINC000754652246	700516992	/nfs/dbraw/zinc/51/69/92/700516992.db2.gz	MDEWSJXAQGUMLF-GFCCVEGCSA-N	1	1	322.365	1.629	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](C(F)(F)F)C2)c1	ZINC000761056546	700837159	/nfs/dbraw/zinc/83/71/59/700837159.db2.gz	YADKAXYKHMQBIA-SCZZXKLOSA-N	1	1	308.260	1.036	20	5		DDBDMO
Cn1ncc2c1CCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000839625963	701757296	/nfs/dbraw/zinc/75/72/96/701757296.db2.gz	YVRNGRUXMDZMLS-INIZCTEOSA-N	1	1	316.361	1.810	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839699250	701788598	/nfs/dbraw/zinc/78/85/98/701788598.db2.gz	UURHDVPYWKHEFK-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839699250	701788602	/nfs/dbraw/zinc/78/86/02/701788602.db2.gz	UURHDVPYWKHEFK-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839699250	701788606	/nfs/dbraw/zinc/78/86/06/701788606.db2.gz	UURHDVPYWKHEFK-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)OC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000810620469	701803560	/nfs/dbraw/zinc/80/35/60/701803560.db2.gz	HNWOIJJSDCGBQL-VIFPVBQESA-N	1	1	304.306	1.927	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCCO1	ZINC000867949634	701848835	/nfs/dbraw/zinc/84/88/35/701848835.db2.gz	FGTPOUYGZBHEJE-XHDPSFHLSA-N	1	1	307.350	1.406	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@](C)(CO)C1	ZINC000879261385	706633280	/nfs/dbraw/zinc/63/32/80/706633280.db2.gz	JMGVNWZFIXPNRL-KKUMJFAQSA-N	1	1	310.350	1.100	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000812337391	702161557	/nfs/dbraw/zinc/16/15/57/702161557.db2.gz	DPMNFUGEKDZTGA-NWDGAFQWSA-N	1	1	319.361	1.627	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@@H]2C1	ZINC000868967390	702409753	/nfs/dbraw/zinc/40/97/53/702409753.db2.gz	LRVQDPWXZAUKBS-GXTWGEPZSA-N	1	1	321.352	1.829	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000817679645	702448975	/nfs/dbraw/zinc/44/89/75/702448975.db2.gz	VENUOKWZJGOQBL-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
[NH3+]CCCCCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000842920945	702791271	/nfs/dbraw/zinc/79/12/71/702791271.db2.gz	UDKSEJQVQGXOMC-UHFFFAOYSA-N	1	1	319.358	1.531	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)CCC(C)(C)[N+](=O)[O-])C[C@@H]1C	ZINC000844022465	702957454	/nfs/dbraw/zinc/95/74/54/702957454.db2.gz	FFQBMXVYIQEPAN-BETUJISGSA-N	1	1	315.414	1.390	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@H]21	ZINC000879574461	706723462	/nfs/dbraw/zinc/72/34/62/706723462.db2.gz	AAQVEZOWIHEPMO-ZIAGYGMSSA-N	1	1	318.377	1.220	20	5		DDBDMO
C[C@H]1C[C@@H]1C(N)=[NH+]OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000848520489	703560474	/nfs/dbraw/zinc/56/04/74/703560474.db2.gz	QOUIKTOMIJYDPN-CABZTGNLSA-N	1	1	318.333	1.638	20	5		DDBDMO
Cc1nc(C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)[nH]c1C	ZINC000850138398	703706957	/nfs/dbraw/zinc/70/69/57/703706957.db2.gz	DYGMDVGIYUHZKM-UKRRQHHQSA-N	1	1	320.349	1.119	20	5		DDBDMO
CC1(C)OC[C@H](CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)O1	ZINC000851908568	703881724	/nfs/dbraw/zinc/88/17/24/703881724.db2.gz	OTZHDCJVSTYLRS-ZDUSSCGKSA-N	1	1	307.350	1.890	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1	ZINC000852316927	704009958	/nfs/dbraw/zinc/00/99/58/704009958.db2.gz	ISGARTCVTFGWAE-LLVKDONJSA-N	1	1	305.313	1.848	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852437435	704048568	/nfs/dbraw/zinc/04/85/68/704048568.db2.gz	YCCMXDFGUWEPCD-KGLIPLIRSA-N	1	1	321.333	1.155	20	5		DDBDMO
CCc1nnc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819321437	704106908	/nfs/dbraw/zinc/10/69/08/704106908.db2.gz	HNOSRXBLOQJFRM-LLVKDONJSA-N	1	1	308.363	1.832	20	5		DDBDMO
CN(CC(F)(F)F)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870865425	704149621	/nfs/dbraw/zinc/14/96/21/704149621.db2.gz	STLLLRBDWNVNPV-LLVKDONJSA-N	1	1	305.256	1.789	20	5		DDBDMO
COCC[NH+]1CCN(c2cc(OC)c(C)cc2[N+](=O)[O-])CC1	ZINC000853109893	704198646	/nfs/dbraw/zinc/19/86/46/704198646.db2.gz	ITFNKCYXSPXXGS-UHFFFAOYSA-N	1	1	309.366	1.680	20	5		DDBDMO
COc1cc(N2CC[NH+](CCCO)CC2)c([N+](=O)[O-])cc1C	ZINC000853244192	704223699	/nfs/dbraw/zinc/22/36/99/704223699.db2.gz	GMKWWFIYGPQRCM-UHFFFAOYSA-N	1	1	309.366	1.416	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2C	ZINC000874845029	705199662	/nfs/dbraw/zinc/19/96/62/705199662.db2.gz	FFHMFTMKXKPHGU-UONOGXRCSA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCC[N@@H+]2C	ZINC000874848147	705201256	/nfs/dbraw/zinc/20/12/56/705201256.db2.gz	RUWYMZWEGNRLQP-KBPBESRZSA-N	1	1	304.350	1.607	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000862794750	705800406	/nfs/dbraw/zinc/80/04/06/705800406.db2.gz	HARPOQYTXYZJGK-WFASDCNBSA-N	1	1	321.377	1.476	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1[C@H](CO)CC[C@H]1CO	ZINC000878883501	706524431	/nfs/dbraw/zinc/52/44/31/706524431.db2.gz	XNBMFQLNELDJFL-RYUDHWBXSA-N	1	1	300.742	1.566	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510073	706527874	/nfs/dbraw/zinc/52/78/74/706527874.db2.gz	QSOZCALVQHWYFH-UONOGXRCSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510073	706527876	/nfs/dbraw/zinc/52/78/76/706527876.db2.gz	QSOZCALVQHWYFH-UONOGXRCSA-N	1	1	323.349	1.401	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3[C@H]2CCC[N@H+]3C)c([N+](=O)[O-])c1	ZINC000872781606	707597963	/nfs/dbraw/zinc/59/79/63/707597963.db2.gz	VZKYNHHMICEPEL-QWHCGFSZSA-N	1	1	318.377	1.627	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000882487854	707659569	/nfs/dbraw/zinc/65/95/69/707659569.db2.gz	KCAMDNMJUWQMDR-GFCCVEGCSA-N	1	1	306.366	1.241	20	5		DDBDMO
CCOC(=O)[C@H]1NCC[C@@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000873296978	707802281	/nfs/dbraw/zinc/80/22/81/707802281.db2.gz	ORDBLJNXCCSDEL-OSMZGAPFSA-N	1	1	307.350	1.539	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H](C)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000873360993	707824366	/nfs/dbraw/zinc/82/43/66/707824366.db2.gz	QOXJUIKWSRMXKM-GRYCIOLGSA-N	1	1	324.381	1.904	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc(Br)cc1[N+](=O)[O-]	ZINC000884823707	708387543	/nfs/dbraw/zinc/38/75/43/708387543.db2.gz	ALWIHKMNHGYNIE-UHFFFAOYSA-N	1	1	318.171	1.693	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N(C)CC[N@@H+](C)CCO	ZINC000912605532	713045403	/nfs/dbraw/zinc/04/54/03/713045403.db2.gz	YTUDVBNAGZEWGA-OUKQBFOZSA-N	1	1	321.377	1.381	20	5		DDBDMO
COCC[N@H+]1CCN(Cc2cccnc2[N+](=O)[O-])C(C)(C)C1	ZINC000886268803	708733462	/nfs/dbraw/zinc/73/34/62/708733462.db2.gz	BOAIAYGFRCWNAB-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CCC[C@H]2O)c1	ZINC000886481906	708767710	/nfs/dbraw/zinc/76/77/10/708767710.db2.gz	MECKWCDKLQTNBN-ZIAGYGMSSA-N	1	1	308.334	1.727	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@](CO)(C(F)(F)F)C1	ZINC000886813630	708851108	/nfs/dbraw/zinc/85/11/08/708851108.db2.gz	QREWFXOKTHSEIB-LLVKDONJSA-N	1	1	322.287	1.346	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887939124	709173496	/nfs/dbraw/zinc/17/34/96/709173496.db2.gz	PLBDPBKPWHZOGW-WBMJQRKESA-N	1	1	319.361	1.384	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@@H](C)C1	ZINC000910280394	709862695	/nfs/dbraw/zinc/86/26/95/709862695.db2.gz	QYAJVGDLARNIFZ-JTQLQIEISA-N	1	1	324.356	1.872	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000910285165	709866092	/nfs/dbraw/zinc/86/60/92/709866092.db2.gz	RAXXGUCSOSSIEO-GFCCVEGCSA-N	1	1	323.397	1.469	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[NH+](Cc2ccccc2)CC1	ZINC000891395155	710183662	/nfs/dbraw/zinc/18/36/62/710183662.db2.gz	MVKXVLDBOLRQQA-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
Cn1c2ccccc2c(NC[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1=O	ZINC000892319590	710416131	/nfs/dbraw/zinc/41/61/31/710416131.db2.gz	MNCIJCGEFCJRDV-LLVKDONJSA-N	1	1	316.361	1.810	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@H+]1C	ZINC000928450127	713202074	/nfs/dbraw/zinc/20/20/74/713202074.db2.gz	SHNDEZSYVZZIEP-SKDRFNHKSA-N	1	1	321.333	1.188	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637828	710832639	/nfs/dbraw/zinc/83/26/39/710832639.db2.gz	JTIILFKOGSSESI-KBPBESRZSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637828	710832644	/nfs/dbraw/zinc/83/26/44/710832644.db2.gz	JTIILFKOGSSESI-KBPBESRZSA-N	1	1	317.349	1.920	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000893941488	710893780	/nfs/dbraw/zinc/89/37/80/710893780.db2.gz	SDWBHYGDQJPRLP-BXUZGUMPSA-N	1	1	304.350	1.095	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+]CCS(C)(=O)=O)cc([N+](=O)[O-])c1	ZINC000903084056	711026881	/nfs/dbraw/zinc/02/68/81/711026881.db2.gz	ULDBKLCFNFOQFH-SECBINFHSA-N	1	1	302.352	1.299	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+]CC(=O)NCC2CC2)cc([N+](=O)[O-])c1	ZINC000903146572	711047609	/nfs/dbraw/zinc/04/76/09/711047609.db2.gz	HOYXSOFMWKUPGZ-SNVBAGLBSA-N	1	1	307.350	1.780	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000928556098	713225210	/nfs/dbraw/zinc/22/52/10/713225210.db2.gz	RKJGLWUKTORJES-ZDUSSCGKSA-N	1	1	305.334	1.378	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000928556098	713225211	/nfs/dbraw/zinc/22/52/11/713225211.db2.gz	RKJGLWUKTORJES-ZDUSSCGKSA-N	1	1	305.334	1.378	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc4nonc4c3[N+](=O)[O-])CC[C@@H]21	ZINC000895021674	711372695	/nfs/dbraw/zinc/37/26/95/711372695.db2.gz	HUOXPPDSBAEUGC-ONGXEEELSA-N	1	1	303.322	1.661	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H]3C[C@@H]4COC[C@@H]4O3)c2c1	ZINC000896087879	711674507	/nfs/dbraw/zinc/67/45/07/711674507.db2.gz	IIRKASJHXJEHCM-XAGWURHQSA-N	1	1	315.329	1.781	20	5		DDBDMO
O=C1C[C@H](CCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CN1	ZINC000896134123	711680390	/nfs/dbraw/zinc/68/03/90/711680390.db2.gz	IRGNTPQUMUOMSZ-JTQLQIEISA-N	1	1	300.318	1.503	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCCO[C@H]3CCOC3)c2c1	ZINC000896472532	711730454	/nfs/dbraw/zinc/73/04/54/711730454.db2.gz	BBLBMPBEIFFBCQ-LBPRGKRZSA-N	1	1	303.318	1.782	20	5		DDBDMO
Nc1c(F)c(NC[C@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-]	ZINC000896521168	711737506	/nfs/dbraw/zinc/73/75/06/711737506.db2.gz	HKUQGGUCPYRLGD-LLVKDONJSA-N	1	1	324.356	1.981	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCOCC2)c1	ZINC000896524901	711738261	/nfs/dbraw/zinc/73/82/61/711738261.db2.gz	XPDYWZYCPMKSCQ-CYBMUJFWSA-N	1	1	306.366	1.842	20	5		DDBDMO
C[C@H]1CCCN(C(=O)OC[C@H]2CCCC[N@@H+]2CC[N+](=O)[O-])C1	ZINC000930471140	713843403	/nfs/dbraw/zinc/84/34/03/713843403.db2.gz	VBELWUKJZFWQQP-UONOGXRCSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[C@H]1CCCN(C(=O)OC[C@H]2CCCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000930471140	713843407	/nfs/dbraw/zinc/84/34/07/713843407.db2.gz	VBELWUKJZFWQQP-UONOGXRCSA-N	1	1	313.398	1.986	20	5		DDBDMO
COC(OC)[C@@H](C)[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000922312165	714018102	/nfs/dbraw/zinc/01/81/02/714018102.db2.gz	TYJGNWIENZDGCW-SECBINFHSA-N	1	1	312.322	1.463	20	5		DDBDMO
COC1(OC)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000931641300	714147422	/nfs/dbraw/zinc/14/74/22/714147422.db2.gz	XQAVKUUQJPCFJT-AWEZNQCLSA-N	1	1	310.350	1.193	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@@H]1[NH2+]Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000933036815	714505995	/nfs/dbraw/zinc/50/59/95/714505995.db2.gz	UMSDIAMBKZRUKN-CYBMUJFWSA-N	1	1	323.324	1.119	20	5		DDBDMO
CC(C)(CCc1noc([C@H]2C[N@H+]3CCC[C@@H]3CO2)n1)[N+](=O)[O-]	ZINC000924079305	714521678	/nfs/dbraw/zinc/52/16/78/714521678.db2.gz	UPRLWAYAHFVBOW-GHMZBOCLSA-N	1	1	310.354	1.593	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nccc4cc([N+](=O)[O-])ccc43)C[C@@H]21	ZINC000413474585	719482543	/nfs/dbraw/zinc/48/25/43/719482543.db2.gz	XDWXIXXHPVIZHH-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=[N+]([O-])c1ccc2ncc(N3CCc4[nH+]ccn4CC3)nc2c1	ZINC001167177913	732805746	/nfs/dbraw/zinc/80/57/46/732805746.db2.gz	AWXSUWUDMOCVBG-UHFFFAOYSA-N	1	1	310.317	1.797	20	5		DDBDMO
CCCCC[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001121087462	782351264	/nfs/dbraw/zinc/35/12/64/782351264.db2.gz	JPMFWXUMEVFQQK-QAALLOGESA-N	1	1	309.410	1.859	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001022061908	734367938	/nfs/dbraw/zinc/36/79/38/734367938.db2.gz	ZIVPQDLASROERU-LXTVHRRPSA-N	1	1	303.362	1.397	20	5		DDBDMO
CC(C)(F)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC001025648537	736808503	/nfs/dbraw/zinc/80/85/03/736808503.db2.gz	PETORJWQEWAYSG-WDNDVIMCSA-N	1	1	321.352	1.889	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCCC3CCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025778557	736850390	/nfs/dbraw/zinc/85/03/90/736850390.db2.gz	UUWUYTSLQKCYLA-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CCCC3CCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025778557	736850394	/nfs/dbraw/zinc/85/03/94/736850394.db2.gz	UUWUYTSLQKCYLA-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCCC3CCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025778557	736850396	/nfs/dbraw/zinc/85/03/96/736850396.db2.gz	UUWUYTSLQKCYLA-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@@H+]1C	ZINC001117752468	748996315	/nfs/dbraw/zinc/99/63/15/748996315.db2.gz	GYPLEYUNRXAUKA-JTQLQIEISA-N	1	1	324.356	1.576	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C	ZINC001117752468	748996321	/nfs/dbraw/zinc/99/63/21/748996321.db2.gz	GYPLEYUNRXAUKA-JTQLQIEISA-N	1	1	324.356	1.576	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2C[C@@H](OCC3CC3)[C@H]3COC[C@H]32)C1	ZINC001169030132	762186302	/nfs/dbraw/zinc/18/63/02/762186302.db2.gz	WUHQBOWUUZHXRJ-ZVDSWSACSA-N	1	1	310.394	1.558	20	5		DDBDMO
CCOC(=O)N1CCC([N@@H+](C)[C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169038629	762193637	/nfs/dbraw/zinc/19/36/37/762193637.db2.gz	JMBWXFDHYSRBNK-GXTWGEPZSA-N	1	1	313.398	1.985	20	5		DDBDMO
COc1nc(C)nc(N[C@H]2C[C@H]3CC[N@@H+](C2)[C@H]3C)c1[N+](=O)[O-]	ZINC001170965545	771970687	/nfs/dbraw/zinc/97/06/87/771970687.db2.gz	UAEYCIJAOCILRP-GDPRMGEGSA-N	1	1	307.354	1.596	20	5		DDBDMO
Cc1ncc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])o1	ZINC001178464668	779060902	/nfs/dbraw/zinc/06/09/02/779060902.db2.gz	WRCLBKPCZPHWAN-ZIAGYGMSSA-N	1	1	324.381	1.414	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCCc2ccsc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001266683246	836661957	/nfs/dbraw/zinc/66/19/57/836661957.db2.gz	KVBPRHNIDSAKQA-XJFOESAGSA-N	1	1	323.418	1.583	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC001273359786	849665772	/nfs/dbraw/zinc/66/57/72/849665772.db2.gz	UOHBEDOTMTXWME-RNCFNFMXSA-N	1	1	323.324	1.519	20	5		DDBDMO
CC[C@H]1[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021516	850518564	/nfs/dbraw/zinc/51/85/64/850518564.db2.gz	LGKQCJPNRMFIDS-NHIYQJMISA-N	1	1	309.410	1.955	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2ccc(-n3cncn3)c([N+](=O)[O-])c2)o1	ZINC001328432603	862971388	/nfs/dbraw/zinc/97/13/88/862971388.db2.gz	GJVJCQFVVYYWLG-UHFFFAOYSA-N	1	1	315.293	1.287	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC001121918264	858632905	/nfs/dbraw/zinc/63/29/05/858632905.db2.gz	DEHUSFDCVPKUFH-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1C[N@@H+]2CCN1C[C@@H]2C	ZINC001123879898	859452244	/nfs/dbraw/zinc/45/22/44/859452244.db2.gz	JVSVCNQCEQGZSZ-SMDDNHRTSA-N	1	1	318.377	1.538	20	5		DDBDMO
C[C@@H](NC(=O)[C@H]1C[N@H+]2CCN1C[C@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975896	859506797	/nfs/dbraw/zinc/50/67/97/859506797.db2.gz	GUSQVLAMRAVGBN-LALPHHSUSA-N	1	1	318.377	1.160	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)[n+]([O-])c(NCC[NH+]2CCSCC2)c1	ZINC001157046036	863536413	/nfs/dbraw/zinc/53/64/13/863536413.db2.gz	YOUPMULWFUZIBV-UHFFFAOYSA-N	1	1	318.786	1.342	20	5		DDBDMO
Cc1nsc(C)c1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767163	864118082	/nfs/dbraw/zinc/11/80/82/864118082.db2.gz	IOAOALBFUOFYJZ-ZYHUDNBSSA-N	1	1	312.395	1.021	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC001331523163	865134285	/nfs/dbraw/zinc/13/42/85/865134285.db2.gz	MOJBIROOFZQOES-BXUZGUMPSA-N	1	1	317.349	1.656	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC001331523163	865134291	/nfs/dbraw/zinc/13/42/91/865134291.db2.gz	MOJBIROOFZQOES-BXUZGUMPSA-N	1	1	317.349	1.656	20	5		DDBDMO
CCN(CC[NH2+]Cc1ccccc1[N+](=O)[O-])C(=O)c1ccn[nH]1	ZINC001320682646	866939868	/nfs/dbraw/zinc/93/98/68/866939868.db2.gz	JTVJFLFUBSCOMT-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)c1[N+](=O)[O-]	ZINC001333928907	867164611	/nfs/dbraw/zinc/16/46/11/867164611.db2.gz	CHOLDMWUMQRXEE-SRVKXCTJSA-N	1	1	321.381	1.429	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]CCF)CCc1ccccc1	ZINC001162810568	867844360	/nfs/dbraw/zinc/84/43/60/867844360.db2.gz	MCMXYTLYYUDBAU-HUUCEWRRSA-N	1	1	323.368	1.282	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001297536503	870091565	/nfs/dbraw/zinc/09/15/65/870091565.db2.gz	XAGTXVGCENMSHL-NSHDSACASA-N	1	1	307.354	1.176	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])c(C)n2)C[C@@H]1C	ZINC001345740911	873494771	/nfs/dbraw/zinc/49/47/71/873494771.db2.gz	BPPPLAPYGMYEAJ-PHIMTYICSA-N	1	1	309.370	1.239	20	5		DDBDMO
C[C@@H](CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)[NH+](C)C	ZINC001353298240	877237979	/nfs/dbraw/zinc/23/79/79/877237979.db2.gz	RVQGSUCOYOXWPT-GXTWGEPZSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[N@H+]1CCC[C@H](C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584227	879113586	/nfs/dbraw/zinc/11/35/86/879113586.db2.gz	NDXCLLYAJIYGRM-ZIAGYGMSSA-N	1	1	323.393	1.266	20	5		DDBDMO
CN1CCC[C@H](C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584227	879113594	/nfs/dbraw/zinc/11/35/94/879113594.db2.gz	NDXCLLYAJIYGRM-ZIAGYGMSSA-N	1	1	323.393	1.266	20	5		DDBDMO
C[C@H](OCC(=O)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC001222543322	880548956	/nfs/dbraw/zinc/54/89/56/880548956.db2.gz	NSHZRUDZKYSOQL-LBPRGKRZSA-N	1	1	307.350	1.446	20	5		DDBDMO
CC(C)OCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001235109548	888416274	/nfs/dbraw/zinc/41/62/74/888416274.db2.gz	MYZZJQXZXYRVKY-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@](F)(CO)C3)CC2)cc1	ZINC001254476366	896455558	/nfs/dbraw/zinc/45/55/58/896455558.db2.gz	ONZYRJKUTMTQTC-INIZCTEOSA-N	1	1	323.368	1.970	20	5		DDBDMO
CN1CCN(CCC[NH2+][C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254568891	896505790	/nfs/dbraw/zinc/50/57/90/896505790.db2.gz	VURKIACBAZLFKK-MRXNPFEDSA-N	1	1	318.421	1.289	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3F)[C@@H]2C1	ZINC001263980099	900853253	/nfs/dbraw/zinc/85/32/53/900853253.db2.gz	NEVFFFPZJIZKOD-MRCXROJRSA-N	1	1	307.325	1.804	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)CS(C)(=O)=O	ZINC000081903542	192336706	/nfs/dbraw/zinc/33/67/06/192336706.db2.gz	JDQFTDYKENYNOE-SECBINFHSA-N	1	1	302.352	1.126	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@H]1CO	ZINC000248900371	282116632	/nfs/dbraw/zinc/11/66/32/282116632.db2.gz	HFPRSXBPTVQTSU-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000452388732	231373569	/nfs/dbraw/zinc/37/35/69/231373569.db2.gz	KGEVGXGFFMILCK-CQSZACIVSA-N	1	1	307.350	1.171	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000495209183	529574620	/nfs/dbraw/zinc/57/46/20/529574620.db2.gz	APFPIHFKAFOCKW-IUODEOHRSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=C(C[N@@H+]1CCCSCC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000089985028	185274307	/nfs/dbraw/zinc/27/43/07/185274307.db2.gz	PIKGLFFGXOWONT-UHFFFAOYSA-N	1	1	321.402	1.923	20	5		DDBDMO
O=C(C[N@H+]1CCCSCC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000089985028	185274308	/nfs/dbraw/zinc/27/43/08/185274308.db2.gz	PIKGLFFGXOWONT-UHFFFAOYSA-N	1	1	321.402	1.923	20	5		DDBDMO
CC1(C)CN(CCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000614920062	362077050	/nfs/dbraw/zinc/07/70/50/362077050.db2.gz	CNCQGZJHTRIZGD-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC1(C)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000614920062	362077058	/nfs/dbraw/zinc/07/70/58/362077058.db2.gz	CNCQGZJHTRIZGD-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000614920062	362077063	/nfs/dbraw/zinc/07/70/63/362077063.db2.gz	CNCQGZJHTRIZGD-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CC1(C)CN(CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000614923393	362079812	/nfs/dbraw/zinc/07/98/12/362079812.db2.gz	JGQZUPRZGDTLLZ-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[N@H+](CCc1nccs1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090589427	185305622	/nfs/dbraw/zinc/30/56/22/185305622.db2.gz	SOEINVKLCLMGKD-UHFFFAOYSA-N	1	1	308.363	1.388	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286619399	219086777	/nfs/dbraw/zinc/08/67/77/219086777.db2.gz	SAXOMYHUZFNKBH-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000330783997	232065945	/nfs/dbraw/zinc/06/59/45/232065945.db2.gz	RGGXFNOXTSORRT-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000330783997	232065947	/nfs/dbraw/zinc/06/59/47/232065947.db2.gz	RGGXFNOXTSORRT-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(CNC(=O)N[C@@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000616200569	362584043	/nfs/dbraw/zinc/58/40/43/362584043.db2.gz	JANWMVWOLJUKHG-CYBMUJFWSA-N	1	1	306.366	1.797	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000279703198	215074509	/nfs/dbraw/zinc/07/45/09/215074509.db2.gz	JHOHREBVFUXREU-CQSZACIVSA-N	1	1	323.393	1.626	20	5		DDBDMO
Cc1ccc(NC(=O)NC[C@]2(O)CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358453093	299157049	/nfs/dbraw/zinc/15/70/49/299157049.db2.gz	IDXRTJAKTNIADS-CQSZACIVSA-N	1	1	308.338	1.091	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000064312137	352932739	/nfs/dbraw/zinc/93/27/39/352932739.db2.gz	VKEZKUZPFPNOCX-OLZOCXBDSA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NCC[N@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000066924561	353025988	/nfs/dbraw/zinc/02/59/88/353025988.db2.gz	NDEIPYGBIWPYKC-UHFFFAOYSA-N	1	1	322.321	1.635	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000332012027	234385630	/nfs/dbraw/zinc/38/56/30/234385630.db2.gz	SGHRPCRYVRAJPQ-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H]1CCC[C@@H]1O	ZINC000080441109	353608438	/nfs/dbraw/zinc/60/84/38/353608438.db2.gz	VFZYMSKBJSTRFK-KBPBESRZSA-N	1	1	307.350	1.687	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])C1	ZINC000081363240	353666851	/nfs/dbraw/zinc/66/68/51/353666851.db2.gz	RASBCSCPTOVDFO-LLVKDONJSA-N	1	1	309.370	1.430	20	5		DDBDMO
CCC[N@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1	ZINC000081363240	353666854	/nfs/dbraw/zinc/66/68/54/353666854.db2.gz	RASBCSCPTOVDFO-LLVKDONJSA-N	1	1	309.370	1.430	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1	ZINC000081363240	353666857	/nfs/dbraw/zinc/66/68/57/353666857.db2.gz	RASBCSCPTOVDFO-LLVKDONJSA-N	1	1	309.370	1.430	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000089265855	353763591	/nfs/dbraw/zinc/76/35/91/353763591.db2.gz	YSTWVCRNPNFFMB-GFCCVEGCSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])cnc2C)[nH+]1	ZINC000346210396	283029138	/nfs/dbraw/zinc/02/91/38/283029138.db2.gz	BAJMJGTWNDRGET-UHFFFAOYSA-N	1	1	315.333	1.844	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCc3c[nH+]cn3C2)n1	ZINC000588067846	354899485	/nfs/dbraw/zinc/89/94/85/354899485.db2.gz	UXCGLLTYVDQNMP-VIFPVBQESA-N	1	1	317.305	1.400	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H]2CCC[C@@H]2O)c1	ZINC000589501233	354996964	/nfs/dbraw/zinc/99/69/64/354996964.db2.gz	GMMBCECPNNLSRF-WFASDCNBSA-N	1	1	322.361	1.974	20	5		DDBDMO
CN1C[C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590011978	355040191	/nfs/dbraw/zinc/04/01/91/355040191.db2.gz	NSJXUWKXIVKKHC-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590011978	355040193	/nfs/dbraw/zinc/04/01/93/355040193.db2.gz	NSJXUWKXIVKKHC-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590011978	355040194	/nfs/dbraw/zinc/04/01/94/355040194.db2.gz	NSJXUWKXIVKKHC-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=N[C@H]3CC[N@@H+](CC4CC4)C3)[nH]c2c1	ZINC000590689626	355148549	/nfs/dbraw/zinc/14/85/49/355148549.db2.gz	IXDHXCACWLSAME-NSHDSACASA-N	1	1	301.350	1.789	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([C@@H]3CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256113	355548449	/nfs/dbraw/zinc/54/84/49/355548449.db2.gz	ZJMFTGMECAGLEG-GHMZBOCLSA-N	1	1	307.354	1.088	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000371664638	307155713	/nfs/dbraw/zinc/15/57/13/307155713.db2.gz	WJSVTCAFOVYNQP-OLZOCXBDSA-N	1	1	309.391	1.494	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)CC[N@H+]1C	ZINC000592792824	355693455	/nfs/dbraw/zinc/69/34/55/355693455.db2.gz	AIWMWAWXFYLQQH-IAQYHMDHSA-N	1	1	319.361	1.525	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000593188885	355821168	/nfs/dbraw/zinc/82/11/68/355821168.db2.gz	RPHPUJJZCQSUDQ-VWYCJHECSA-N	1	1	309.370	1.039	20	5		DDBDMO
C[C@H](O)C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000594055361	356101251	/nfs/dbraw/zinc/10/12/51/356101251.db2.gz	KZDXKESHWMJTCX-SMDDNHRTSA-N	1	1	310.350	1.180	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[NH+](C(C)(C)CO)CC1	ZINC000594555519	356249926	/nfs/dbraw/zinc/24/99/26/356249926.db2.gz	IBCQUZWPUAAKCA-UHFFFAOYSA-N	1	1	309.366	1.496	20	5		DDBDMO
COc1cc(C[N@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000594613182	356266124	/nfs/dbraw/zinc/26/61/24/356266124.db2.gz	ALMVAGLZVVKKRI-SNVBAGLBSA-N	1	1	310.350	1.957	20	5		DDBDMO
COc1cc(C[N@@H+](C[C@@H](C)O)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000594613182	356266127	/nfs/dbraw/zinc/26/61/27/356266127.db2.gz	ALMVAGLZVVKKRI-SNVBAGLBSA-N	1	1	310.350	1.957	20	5		DDBDMO
COC(=O)[C@H]1CC12CC[NH+](Cc1onc(C)c1[N+](=O)[O-])CC2	ZINC000595319689	356448305	/nfs/dbraw/zinc/44/83/05/356448305.db2.gz	CHBHXIUKTJISGB-SNVBAGLBSA-N	1	1	309.322	1.666	20	5		DDBDMO
COCC[N@H+]1CCN(Cc2onc(C)c2[N+](=O)[O-])C(C)(C)C1	ZINC000595562145	356553293	/nfs/dbraw/zinc/55/32/93/356553293.db2.gz	FJQMDAMEIRVUNE-UHFFFAOYSA-N	1	1	312.370	1.434	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)C[C@@H]1COCCO1	ZINC000595738007	356629498	/nfs/dbraw/zinc/62/94/98/356629498.db2.gz	UUDJBLBKBVADAM-BXUZGUMPSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H]1COCCO1	ZINC000595738007	356629499	/nfs/dbraw/zinc/62/94/99/356629499.db2.gz	UUDJBLBKBVADAM-BXUZGUMPSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000595761674	356642189	/nfs/dbraw/zinc/64/21/89/356642189.db2.gz	ZBHXHELHKJDLTN-DOMZBBRYSA-N	1	1	305.334	1.162	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@]1(C)CO	ZINC000595873336	356687390	/nfs/dbraw/zinc/68/73/90/356687390.db2.gz	LVCGPQARYWNKSD-BMIGLBTASA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@]1(C)CO	ZINC000595873336	356687393	/nfs/dbraw/zinc/68/73/93/356687393.db2.gz	LVCGPQARYWNKSD-BMIGLBTASA-N	1	1	304.350	1.921	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000596439116	356881971	/nfs/dbraw/zinc/88/19/71/356881971.db2.gz	BNMKEAILIVVVHF-LLVKDONJSA-N	1	1	308.382	1.784	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1	ZINC000596498479	356898226	/nfs/dbraw/zinc/89/82/26/356898226.db2.gz	CYPMLVZSTXXNQM-CYBMUJFWSA-N	1	1	320.393	1.785	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000597925367	357384283	/nfs/dbraw/zinc/38/42/83/357384283.db2.gz	NVQHULWRXQKFFS-LBPRGKRZSA-N	1	1	321.377	1.963	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000598451609	357588095	/nfs/dbraw/zinc/58/80/95/357588095.db2.gz	CCBLCBLYKMEMCV-ZDUSSCGKSA-N	1	1	319.361	1.266	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000598589080	357643447	/nfs/dbraw/zinc/64/34/47/357643447.db2.gz	CVUFVKBDWALIFM-NWDGAFQWSA-N	1	1	320.349	1.815	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598651505	357671399	/nfs/dbraw/zinc/67/13/99/357671399.db2.gz	UPHUJDLSXVWQQV-NWDGAFQWSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598651505	357671405	/nfs/dbraw/zinc/67/14/05/357671405.db2.gz	UPHUJDLSXVWQQV-NWDGAFQWSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000599139028	357826570	/nfs/dbraw/zinc/82/65/70/357826570.db2.gz	MQHREJKANJCWNA-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CC2(C)COC2)c([N+](=O)[O-])c1	ZINC000599571513	357978947	/nfs/dbraw/zinc/97/89/47/357978947.db2.gz	JQPWOHMYFOELCU-UHFFFAOYSA-N	1	1	310.350	1.951	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599680488	358022444	/nfs/dbraw/zinc/02/24/44/358022444.db2.gz	CZGRXVVVQAHDPQ-SGIREYDYSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599680488	358022448	/nfs/dbraw/zinc/02/24/48/358022448.db2.gz	CZGRXVVVQAHDPQ-SGIREYDYSA-N	1	1	319.361	1.687	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1	ZINC000600071949	358115631	/nfs/dbraw/zinc/11/56/31/358115631.db2.gz	JAEWVYUKXHTSNF-UHFFFAOYSA-N	1	1	309.341	1.641	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](O)COCC3CC3)c2c1	ZINC000601108436	358404574	/nfs/dbraw/zinc/40/45/74/358404574.db2.gz	HLELXOXVMVYZOH-ZDUSSCGKSA-N	1	1	317.345	1.764	20	5		DDBDMO
C[C@H](CN1CCCC1=O)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601106549	358404845	/nfs/dbraw/zinc/40/48/45/358404845.db2.gz	ZHOGMOKEXBNLOF-LLVKDONJSA-N	1	1	314.345	1.988	20	5		DDBDMO
CN1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCC1=O	ZINC000601119746	358409907	/nfs/dbraw/zinc/40/99/07/358409907.db2.gz	BCLANHRVPLTMHQ-SNVBAGLBSA-N	1	1	300.318	1.598	20	5		DDBDMO
CN(C)CC[NH+]1CCC(Nc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601103791	358403864	/nfs/dbraw/zinc/40/38/64/358403864.db2.gz	HPBXNTYRNJUVRR-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCC[C@]3(O)CCOC3)c2c1	ZINC000601183908	358437789	/nfs/dbraw/zinc/43/77/89/358437789.db2.gz	HWAHHRSOWVODNF-HNNXBMFYSA-N	1	1	303.318	1.518	20	5		DDBDMO
Cc1nccc([C@H]2CCC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000602448571	358983876	/nfs/dbraw/zinc/98/38/76/358983876.db2.gz	MKUJIYUBPHXQLN-LBPRGKRZSA-N	1	1	316.365	1.806	20	5		DDBDMO
Cc1nccc([C@H]2CCC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000602448571	358983877	/nfs/dbraw/zinc/98/38/77/358983877.db2.gz	MKUJIYUBPHXQLN-LBPRGKRZSA-N	1	1	316.365	1.806	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@H]1n1ccnc1	ZINC000602482358	359008465	/nfs/dbraw/zinc/00/84/65/359008465.db2.gz	FNZOCNGWIYKYMU-DGCLKSJQSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C[C@H]1n1ccnc1	ZINC000602482358	359008467	/nfs/dbraw/zinc/00/84/67/359008467.db2.gz	FNZOCNGWIYKYMU-DGCLKSJQSA-N	1	1	304.354	1.608	20	5		DDBDMO
COC[C@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccc(C)o1	ZINC000602808706	359205413	/nfs/dbraw/zinc/20/54/13/359205413.db2.gz	YUJRQOCGRWJSDJ-LBPRGKRZSA-N	1	1	308.338	1.978	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C)O[C@]2(CCO[C@H]2C)C1	ZINC000602819417	359214403	/nfs/dbraw/zinc/21/44/03/359214403.db2.gz	BGPUSIKALOJBCS-SLEUVZQESA-N	1	1	324.381	1.368	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)C[C@@](C)(O)C1CC1	ZINC000602831703	359223987	/nfs/dbraw/zinc/22/39/87/359223987.db2.gz	PWHXIDNHNMMMKF-NVXWUHKLSA-N	1	1	322.405	1.981	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@H]2CCC[C@@H]21	ZINC000602914518	359291892	/nfs/dbraw/zinc/29/18/92/359291892.db2.gz	FVRMCLBWQQTHKO-UPJWGTAASA-N	1	1	322.365	1.492	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@H]2CCC[C@@H]21	ZINC000602914518	359291899	/nfs/dbraw/zinc/29/18/99/359291899.db2.gz	FVRMCLBWQQTHKO-UPJWGTAASA-N	1	1	322.365	1.492	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](OC)C[C@]1(C)CO	ZINC000602965137	359329025	/nfs/dbraw/zinc/32/90/25/359329025.db2.gz	ZRSBCKOQALTQTI-DZGCQCFKSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[C@@]1(O)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000602982686	359337806	/nfs/dbraw/zinc/33/78/06/359337806.db2.gz	WUAJRYJQQFKXQC-GOEBONIOSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000602997598	359346658	/nfs/dbraw/zinc/34/66/58/359346658.db2.gz	NKDLRMNACFFHFG-IHRRRGAJSA-N	1	1	308.382	1.725	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H]2C[C@]2(O)C1	ZINC000603089676	359395856	/nfs/dbraw/zinc/39/58/56/359395856.db2.gz	SGNPGQZTCDIGCQ-NHYWBVRUSA-N	1	1	305.334	1.298	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000603403028	359618658	/nfs/dbraw/zinc/61/86/58/359618658.db2.gz	QRWIAHMHTSLZBM-NSHDSACASA-N	1	1	322.365	1.385	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1(O)CCOCC1	ZINC000187061663	200054968	/nfs/dbraw/zinc/05/49/68/200054968.db2.gz	DVWAKMWVEFJXBJ-UHFFFAOYSA-N	1	1	323.349	1.007	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1(O)CCOCC1	ZINC000187061663	200054970	/nfs/dbraw/zinc/05/49/70/200054970.db2.gz	DVWAKMWVEFJXBJ-UHFFFAOYSA-N	1	1	323.349	1.007	20	5		DDBDMO
CO[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C	ZINC000189289013	200376547	/nfs/dbraw/zinc/37/65/47/200376547.db2.gz	JTFVLQOWJJIDGS-DOMZBBRYSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C	ZINC000189289013	200376548	/nfs/dbraw/zinc/37/65/48/200376548.db2.gz	JTFVLQOWJJIDGS-DOMZBBRYSA-N	1	1	321.377	1.914	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@@H](CCO)C2)c1	ZINC000609204401	360274045	/nfs/dbraw/zinc/27/40/45/360274045.db2.gz	MUQXDZKGYRNRMX-ZFWWWQNUSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000609257955	360276672	/nfs/dbraw/zinc/27/66/72/360276672.db2.gz	XMJKJWLLMUPOQT-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000292407730	223057156	/nfs/dbraw/zinc/05/71/56/223057156.db2.gz	LTPPWUGLFOCKSR-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000292407730	223057157	/nfs/dbraw/zinc/05/71/57/223057157.db2.gz	LTPPWUGLFOCKSR-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1	ZINC000609797420	360351127	/nfs/dbraw/zinc/35/11/27/360351127.db2.gz	ZLKBVHZKVKHWFZ-CQSZACIVSA-N	1	1	305.382	1.206	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000609883747	360360488	/nfs/dbraw/zinc/36/04/88/360360488.db2.gz	STYNPGBLBZSYSP-SECBINFHSA-N	1	1	307.306	1.272	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000611256834	360680916	/nfs/dbraw/zinc/68/09/16/360680916.db2.gz	JCSZOHFHATYCQE-MNOVXSKESA-N	1	1	306.366	1.483	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)n1	ZINC000611616290	360777110	/nfs/dbraw/zinc/77/71/10/360777110.db2.gz	UVILJOULOFNASV-CHWSQXEVSA-N	1	1	308.382	1.498	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)ccc1[N+](=O)[O-]	ZINC000359058414	299316443	/nfs/dbraw/zinc/31/64/43/299316443.db2.gz	WYNACLBOMOERFV-LLVKDONJSA-N	1	1	306.366	1.680	20	5		DDBDMO
COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCOC1	ZINC000618779150	363757447	/nfs/dbraw/zinc/75/74/47/363757447.db2.gz	KELIDDGMPUWDBO-LBPRGKRZSA-N	1	1	321.333	1.973	20	5		DDBDMO
COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCOC1	ZINC000618779150	363757452	/nfs/dbraw/zinc/75/74/52/363757452.db2.gz	KELIDDGMPUWDBO-LBPRGKRZSA-N	1	1	321.333	1.973	20	5		DDBDMO
CCOC(=O)[C@]1(C(C)C)CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000194878137	201305531	/nfs/dbraw/zinc/30/55/31/201305531.db2.gz	VJUFHNJMXCLMPI-OAHLLOKOSA-N	1	1	324.381	1.703	20	5		DDBDMO
CNC(=O)c1ccc(NCC[NH+]2CCSCC2)c([N+](=O)[O-])c1	ZINC000264843274	204201776	/nfs/dbraw/zinc/20/17/76/204201776.db2.gz	XVKDSSRHAWFAGN-UHFFFAOYSA-N	1	1	324.406	1.415	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000288530863	220207814	/nfs/dbraw/zinc/20/78/14/220207814.db2.gz	UOIAQEZQKCGNJG-UHFFFAOYSA-N	1	1	315.333	1.274	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](OC)C1	ZINC000267863979	206309565	/nfs/dbraw/zinc/30/95/65/206309565.db2.gz	YPVKYYURTLMUAF-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@@H](c1ccco1)[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1	ZINC000267947290	206353734	/nfs/dbraw/zinc/35/37/34/206353734.db2.gz	SLEXFAUXMWGPQQ-FZMZJTMJSA-N	1	1	320.349	1.971	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000038533613	183001896	/nfs/dbraw/zinc/00/18/96/183001896.db2.gz	USGZOWDDVDCOKJ-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
COc1ncc(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c(C)n1	ZINC000337184574	249378601	/nfs/dbraw/zinc/37/86/01/249378601.db2.gz	OKOZHBZQQYOARQ-UHFFFAOYSA-N	1	1	315.333	1.655	20	5		DDBDMO
COc1ncc(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c(C)n1	ZINC000337184574	249378603	/nfs/dbraw/zinc/37/86/03/249378603.db2.gz	OKOZHBZQQYOARQ-UHFFFAOYSA-N	1	1	315.333	1.655	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000285277903	218363029	/nfs/dbraw/zinc/36/30/29/218363029.db2.gz	AXOWAXXCGSACPW-KGLIPLIRSA-N	1	1	304.350	1.235	20	5		DDBDMO
CC(C)(C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(N)=O	ZINC000109329982	194258297	/nfs/dbraw/zinc/25/82/97/194258297.db2.gz	NRTVXNFPFOWRNS-CYBMUJFWSA-N	1	1	323.349	1.451	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000109429005	194262846	/nfs/dbraw/zinc/26/28/46/194262846.db2.gz	LIKPIUCJYGJAEN-SNVBAGLBSA-N	1	1	321.381	1.485	20	5		DDBDMO
C[C@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)C[NH+]1CCCC1	ZINC000269219897	207339100	/nfs/dbraw/zinc/33/91/00/207339100.db2.gz	ZYZZALJHEFVTTA-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC(C)(C)O	ZINC000114204749	194639645	/nfs/dbraw/zinc/63/96/45/194639645.db2.gz	PCUFEOWUQHSUHJ-UHFFFAOYSA-N	1	1	321.377	1.577	20	5		DDBDMO
COc1cc(C[NH+]2CCC(NC(N)=O)CC2)ccc1[N+](=O)[O-]	ZINC000352539627	285126702	/nfs/dbraw/zinc/12/67/02/285126702.db2.gz	BJPQVRKWVGKMCE-UHFFFAOYSA-N	1	1	308.338	1.236	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(=O)c(O)co1	ZINC000352550735	285134324	/nfs/dbraw/zinc/13/43/24/285134324.db2.gz	QCHHZTJWLZLUOA-UHFFFAOYSA-N	1	1	304.302	1.928	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(=O)c(O)co1	ZINC000352550735	285134328	/nfs/dbraw/zinc/13/43/28/285134328.db2.gz	QCHHZTJWLZLUOA-UHFFFAOYSA-N	1	1	304.302	1.928	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)CN2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000246994856	285156945	/nfs/dbraw/zinc/15/69/45/285156945.db2.gz	BEDVKTIRAKAEAY-GJZGRUSLSA-N	1	1	321.377	1.115	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000352590972	285161655	/nfs/dbraw/zinc/16/16/55/285161655.db2.gz	PPLSADPEGVGDJS-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@H]1OCC[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000156562041	197123325	/nfs/dbraw/zinc/12/33/25/197123325.db2.gz	JQJBSKOPJPPVAD-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@H]1OCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000156562041	197123326	/nfs/dbraw/zinc/12/33/26/197123326.db2.gz	JQJBSKOPJPPVAD-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1OC[C@@H](O)C[NH+]1CCN(C)CC1	ZINC000414144586	224304584	/nfs/dbraw/zinc/30/45/84/224304584.db2.gz	OTALQRBWLPPRGQ-AWEZNQCLSA-N	1	1	323.393	1.199	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)CC[N@H+]1C	ZINC000330790362	533590563	/nfs/dbraw/zinc/59/05/63/533590563.db2.gz	AOGWGFBYFQORTF-ZJUUUORDSA-N	1	1	307.354	1.127	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@H+]2CC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000569191591	304339870	/nfs/dbraw/zinc/33/98/70/304339870.db2.gz	JADXVSBRPYLQNY-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000360985590	299787498	/nfs/dbraw/zinc/78/74/98/299787498.db2.gz	PGQIZOMNZUFCKT-ZDUSSCGKSA-N	1	1	323.397	1.278	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1C(N)=O	ZINC000068369199	406637206	/nfs/dbraw/zinc/63/72/06/406637206.db2.gz	HJCFPSSDWGSHHR-ZDUSSCGKSA-N	1	1	320.349	1.182	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])C1	ZINC000037647822	406992995	/nfs/dbraw/zinc/99/29/95/406992995.db2.gz	XRGUUUNRYZGTAI-SNVBAGLBSA-N	1	1	313.379	1.362	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000046988447	407068219	/nfs/dbraw/zinc/06/82/19/407068219.db2.gz	UZIGPMSWTFQQPD-CYBMUJFWSA-N	1	1	323.397	1.562	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CCO1	ZINC000124309807	407353671	/nfs/dbraw/zinc/35/36/71/407353671.db2.gz	XUIWTGHLUBDZMQ-LLVKDONJSA-N	1	1	323.349	1.513	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCNC1=O	ZINC000105610981	407354749	/nfs/dbraw/zinc/35/47/49/407354749.db2.gz	PVDSNBURIPTXSW-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000108783531	407390559	/nfs/dbraw/zinc/39/05/59/407390559.db2.gz	YJLFDOAIYHQATA-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000178516433	407478305	/nfs/dbraw/zinc/47/83/05/407478305.db2.gz	LZOHREXSTYSDLU-NSHDSACASA-N	1	1	310.354	1.455	20	5		DDBDMO
COC[C@@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000265766036	407442792	/nfs/dbraw/zinc/44/27/92/407442792.db2.gz	HXKUGHMHIHDRDJ-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000265766036	407442800	/nfs/dbraw/zinc/44/28/00/407442800.db2.gz	HXKUGHMHIHDRDJ-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
CN([C@H]1CCC[N@H+](C)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185845797	407517005	/nfs/dbraw/zinc/51/70/05/407517005.db2.gz	IOKVAZRWXJWYKE-LBPRGKRZSA-N	1	1	313.379	1.310	20	5		DDBDMO
CN([C@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185845797	407517022	/nfs/dbraw/zinc/51/70/22/407517022.db2.gz	IOKVAZRWXJWYKE-LBPRGKRZSA-N	1	1	313.379	1.310	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2C)CC[N@H+]1C[C@@H](C)O	ZINC000266309717	407536657	/nfs/dbraw/zinc/53/66/57/407536657.db2.gz	DIKFHRDHFWDIDC-OLZOCXBDSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000221174532	407544265	/nfs/dbraw/zinc/54/42/65/407544265.db2.gz	PFUXQIYWUARHJH-VIFPVBQESA-N	1	1	317.342	1.106	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	ZINC000221174532	407544269	/nfs/dbraw/zinc/54/42/69/407544269.db2.gz	PFUXQIYWUARHJH-VIFPVBQESA-N	1	1	317.342	1.106	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000271405781	407674273	/nfs/dbraw/zinc/67/42/73/407674273.db2.gz	NKIVXWZXLBWRFZ-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@@H+](C)C1	ZINC000115443614	407680403	/nfs/dbraw/zinc/68/04/03/407680403.db2.gz	PPMAYMYLUVEZFZ-LBPRGKRZSA-N	1	1	306.366	1.712	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000261984782	407701986	/nfs/dbraw/zinc/70/19/86/407701986.db2.gz	AVGVVOVSORCOSH-CJNGLKHVSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000261984782	407701990	/nfs/dbraw/zinc/70/19/90/407701990.db2.gz	AVGVVOVSORCOSH-CJNGLKHVSA-N	1	1	304.394	1.635	20	5		DDBDMO
C[C@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000171609705	407720664	/nfs/dbraw/zinc/72/06/64/407720664.db2.gz	SSYWRAXWKYAZGE-LLVKDONJSA-N	1	1	306.366	1.877	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000116891061	407790658	/nfs/dbraw/zinc/79/06/58/407790658.db2.gz	VXMYHPBLYAPWAB-JQWIXIFHSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000116891061	407790665	/nfs/dbraw/zinc/79/06/65/407790665.db2.gz	VXMYHPBLYAPWAB-JQWIXIFHSA-N	1	1	313.379	1.279	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@H]1C	ZINC000117285212	407820170	/nfs/dbraw/zinc/82/01/70/407820170.db2.gz	ZAWLYFQZOVEYOO-GFCCVEGCSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)C[C@H]1C	ZINC000117285212	407820175	/nfs/dbraw/zinc/82/01/75/407820175.db2.gz	ZAWLYFQZOVEYOO-GFCCVEGCSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000117295787	407827244	/nfs/dbraw/zinc/82/72/44/407827244.db2.gz	WSISLICBJDJUTI-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000117295787	407827245	/nfs/dbraw/zinc/82/72/45/407827245.db2.gz	WSISLICBJDJUTI-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[NH2+]1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000237918429	407852024	/nfs/dbraw/zinc/85/20/24/407852024.db2.gz	ZDIRAEHYSPVJFD-VIFPVBQESA-N	1	1	303.322	1.343	20	5		DDBDMO
CN(CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[N@@H+](C)C1	ZINC000118841687	407953229	/nfs/dbraw/zinc/95/32/29/407953229.db2.gz	QYRZSNAMWDHHRW-CYBMUJFWSA-N	1	1	320.393	1.807	20	5		DDBDMO
CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](C)C1	ZINC000153896429	407926439	/nfs/dbraw/zinc/92/64/39/407926439.db2.gz	AJQDQOXVUQVKEB-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000268280900	407982327	/nfs/dbraw/zinc/98/23/27/407982327.db2.gz	YCHCOGQEUNRQAL-NSHDSACASA-N	1	1	309.370	1.334	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@@H](CO)C1	ZINC000245437640	407984799	/nfs/dbraw/zinc/98/47/99/407984799.db2.gz	RPDNBHCHDYGKQG-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@@H](CO)C1	ZINC000245437640	407984805	/nfs/dbraw/zinc/98/48/05/407984805.db2.gz	RPDNBHCHDYGKQG-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
CSCC[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182024193	408065085	/nfs/dbraw/zinc/06/50/85/408065085.db2.gz	KHFYWDBEZQWPAQ-NSHDSACASA-N	1	1	300.380	1.629	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000245949965	408109240	/nfs/dbraw/zinc/10/92/40/408109240.db2.gz	SKFHYYDRQXYOON-GOEBONIOSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000245949965	408109246	/nfs/dbraw/zinc/10/92/46/408109246.db2.gz	SKFHYYDRQXYOON-GOEBONIOSA-N	1	1	319.361	1.547	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)CC[N@H+]1C[C@@H](C)O	ZINC000150767519	408196562	/nfs/dbraw/zinc/19/65/62/408196562.db2.gz	LCRLUWVUTSKYIN-YPMHNXCESA-N	1	1	308.382	1.580	20	5		DDBDMO
COC[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000273339207	408157399	/nfs/dbraw/zinc/15/73/99/408157399.db2.gz	NIMCEMDYUYQEKH-STQMWFEESA-N	1	1	310.350	1.303	20	5		DDBDMO
Cc1c(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cnn1C	ZINC000121282471	408177494	/nfs/dbraw/zinc/17/74/94/408177494.db2.gz	JNCADHFRSKEJJZ-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
CCOc1ccc(C(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000190303285	408216150	/nfs/dbraw/zinc/21/61/50/408216150.db2.gz	MEMULRLXEMSTHE-UHFFFAOYSA-N	1	1	303.265	1.317	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000246315642	408216464	/nfs/dbraw/zinc/21/64/64/408216464.db2.gz	KBGUGJKJJZPNRT-DOMZBBRYSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662241	408383573	/nfs/dbraw/zinc/38/35/73/408383573.db2.gz	QVMSHLBTGJHWHW-LSDHHAIUSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662241	408383579	/nfs/dbraw/zinc/38/35/79/408383579.db2.gz	QVMSHLBTGJHWHW-LSDHHAIUSA-N	1	1	319.361	1.371	20	5		DDBDMO
C[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[NH+]1CCSCC1	ZINC000269699307	408398345	/nfs/dbraw/zinc/39/83/45/408398345.db2.gz	QGVADBUWSQDGDX-LBPRGKRZSA-N	1	1	323.418	1.691	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@H]1c1ccccc1	ZINC000270338984	408494566	/nfs/dbraw/zinc/49/45/66/408494566.db2.gz	ZBGUPNRJIBOLBA-WCQYABFASA-N	1	1	314.349	1.824	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177033702	408502469	/nfs/dbraw/zinc/50/24/69/408502469.db2.gz	SMCLSNVZAAOGAC-NWDGAFQWSA-N	1	1	318.377	1.748	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@H]1O	ZINC000248374144	408553230	/nfs/dbraw/zinc/55/32/30/408553230.db2.gz	NZUIBEWWRDPCIU-VNHYZAJKSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)CC(C)(C)O)cccc1[N+](=O)[O-]	ZINC000265169890	408569164	/nfs/dbraw/zinc/56/91/64/408569164.db2.gz	YNGBFIKKOJLPGP-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000192477396	408594804	/nfs/dbraw/zinc/59/48/04/408594804.db2.gz	JEDSEEDIMJEESC-TXEJJXNPSA-N	1	1	318.377	1.294	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000270874708	408718683	/nfs/dbraw/zinc/71/86/83/408718683.db2.gz	JQFSYHUUKMGFMZ-LSDHHAIUSA-N	1	1	319.361	1.325	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1N)C1CCCC1	ZINC000178193772	408785860	/nfs/dbraw/zinc/78/58/60/408785860.db2.gz	PJSLHSZYERYJJG-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
COc1cccc(N[C@H](C)CN2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000185385107	408802413	/nfs/dbraw/zinc/80/24/13/408802413.db2.gz	WRPLNMQFHZDFIQ-GFCCVEGCSA-N	1	1	308.382	1.651	20	5		DDBDMO
COc1cccc(N[C@H](C)C[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000185385107	408802418	/nfs/dbraw/zinc/80/24/18/408802418.db2.gz	WRPLNMQFHZDFIQ-GFCCVEGCSA-N	1	1	308.382	1.651	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H]3NC(=O)OC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000281315869	408880103	/nfs/dbraw/zinc/88/01/03/408880103.db2.gz	QVVLCTSYPDCPRS-NEPJUHHUSA-N	1	1	321.333	1.534	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)[C@H]2C1	ZINC000276337663	408838998	/nfs/dbraw/zinc/83/89/98/408838998.db2.gz	HOPWYXVSVWSKNP-YGRLFVJLSA-N	1	1	304.350	1.343	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCCC[N@@H+](C)C(C)C)n1	ZINC000286188969	408939449	/nfs/dbraw/zinc/93/94/49/408939449.db2.gz	QRNHGPKBVCACQE-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CCC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000286929958	409002152	/nfs/dbraw/zinc/00/21/52/409002152.db2.gz	LIVWJPMMIZMOEI-UHFFFAOYSA-N	1	1	308.338	1.227	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000282209808	409010855	/nfs/dbraw/zinc/01/08/55/409010855.db2.gz	XWAPLHJJVKLTEZ-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)c2ccc(N)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000287607663	409062815	/nfs/dbraw/zinc/06/28/15/409062815.db2.gz	FXBTVEXICLOSNI-TXEJJXNPSA-N	1	1	308.382	1.722	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)c2ccc(N)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000287607663	409062817	/nfs/dbraw/zinc/06/28/17/409062817.db2.gz	FXBTVEXICLOSNI-TXEJJXNPSA-N	1	1	308.382	1.722	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CN1	ZINC000278870966	409105516	/nfs/dbraw/zinc/10/55/16/409105516.db2.gz	MARCWFFQVKHPFR-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CN1	ZINC000278870966	409105517	/nfs/dbraw/zinc/10/55/17/409105517.db2.gz	MARCWFFQVKHPFR-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000283281168	409128099	/nfs/dbraw/zinc/12/80/99/409128099.db2.gz	MBTNNCYGBIXOCD-ZDUSSCGKSA-N	1	1	321.333	1.561	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000283281168	409128102	/nfs/dbraw/zinc/12/81/02/409128102.db2.gz	MBTNNCYGBIXOCD-ZDUSSCGKSA-N	1	1	321.333	1.561	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[C@@H]([N@@H+](C)CCO)[C@H]2C)cc1[N+](=O)[O-]	ZINC000293567611	409140169	/nfs/dbraw/zinc/14/01/69/409140169.db2.gz	DGDIHUBYRHJFSU-TZMCWYRMSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C2)C1	ZINC000293584203	409142960	/nfs/dbraw/zinc/14/29/60/409142960.db2.gz	ANVNIKKECDORLQ-OAHLLOKOSA-N	1	1	307.325	1.902	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000279125030	409153047	/nfs/dbraw/zinc/15/30/47/409153047.db2.gz	VFTXBLPRROWMNH-BMIGLBTASA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000279125030	409153050	/nfs/dbraw/zinc/15/30/50/409153050.db2.gz	VFTXBLPRROWMNH-BMIGLBTASA-N	1	1	318.333	1.330	20	5		DDBDMO
Cc1c(C[NH2+]C2(CO)COC(C)(C)OC2)cccc1[N+](=O)[O-]	ZINC000279228026	409173548	/nfs/dbraw/zinc/17/35/48/409173548.db2.gz	IWMXLPFEFRBNBE-UHFFFAOYSA-N	1	1	310.350	1.507	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CCC[N@@H+](C)C1	ZINC000279391719	409204915	/nfs/dbraw/zinc/20/49/15/409204915.db2.gz	IUUSHJBBLNTUTD-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCO[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000284715656	409359221	/nfs/dbraw/zinc/35/92/21/409359221.db2.gz	ULZRFXDBGTWFQS-JKSUJKDBSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000295389144	409460555	/nfs/dbraw/zinc/46/05/55/409460555.db2.gz	KZODMTYQMSYXRX-OAGGEKHMSA-N	1	1	321.377	1.033	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000290517636	409429500	/nfs/dbraw/zinc/42/95/00/409429500.db2.gz	GZPVQDDCRMFICP-SNVBAGLBSA-N	1	1	311.386	1.487	20	5		DDBDMO
CNc1c(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000317037811	164024927	/nfs/dbraw/zinc/02/49/27/164024927.db2.gz	RKJBJWNUNWEVEP-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2NC)C1	ZINC000317537929	164027662	/nfs/dbraw/zinc/02/76/62/164027662.db2.gz	ARKYQLYRRXCJHC-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@@H+](CCCO)C1	ZINC000296420162	409541890	/nfs/dbraw/zinc/54/18/90/409541890.db2.gz	LIWLORGAOSOLCE-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](C)C[N@@H+](C)C(C)C	ZINC000356766596	409585998	/nfs/dbraw/zinc/58/59/98/409585998.db2.gz	LBYNHUBEYRCVLI-NSHDSACASA-N	1	1	311.386	1.335	20	5		DDBDMO
CC(C)(C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12)n1cc([N+](=O)[O-])cn1	ZINC000331663734	409746898	/nfs/dbraw/zinc/74/68/98/409746898.db2.gz	OSTXSGJXVVBHRF-STQMWFEESA-N	1	1	321.381	1.269	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1)C1CC1	ZINC000350930270	410016531	/nfs/dbraw/zinc/01/65/31/410016531.db2.gz	ULWINFRBNZVHKJ-UHFFFAOYSA-N	1	1	306.326	1.671	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1)C1CC1	ZINC000350930270	410016539	/nfs/dbraw/zinc/01/65/39/410016539.db2.gz	ULWINFRBNZVHKJ-UHFFFAOYSA-N	1	1	306.326	1.671	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1C	ZINC000357460900	410052375	/nfs/dbraw/zinc/05/23/75/410052375.db2.gz	RRFGCWKBNDADCO-ZJUUUORDSA-N	1	1	307.354	1.008	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000343110958	410156149	/nfs/dbraw/zinc/15/61/49/410156149.db2.gz	YVGJCOIKKMOVCK-XHDPSFHLSA-N	1	1	319.361	1.382	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CCO1	ZINC000332585871	410184976	/nfs/dbraw/zinc/18/49/76/410184976.db2.gz	HRAPPWSIXVKDJF-GFCCVEGCSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CCO1	ZINC000332585871	410184983	/nfs/dbraw/zinc/18/49/83/410184983.db2.gz	HRAPPWSIXVKDJF-GFCCVEGCSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[N@@H+](CC(=O)NCCc1ccccc1[N+](=O)[O-])[C@H]1CCSC1	ZINC000343315510	410345390	/nfs/dbraw/zinc/34/53/90/410345390.db2.gz	XVZUFLFTNLGGTJ-ZDUSSCGKSA-N	1	1	323.418	1.691	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ccc3ncccc3c2[N+](=O)[O-])C1	ZINC000358361128	410453936	/nfs/dbraw/zinc/45/39/36/410453936.db2.gz	WGNGXKOOUJGUDA-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000355351921	410461415	/nfs/dbraw/zinc/46/14/15/410461415.db2.gz	UYRLUIOKSDHMQK-CABCVRRESA-N	1	1	319.361	1.530	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CCCOC1	ZINC000352204018	410543777	/nfs/dbraw/zinc/54/37/77/410543777.db2.gz	WFKVQLKOLZATEZ-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CCCOC1	ZINC000352204018	410543783	/nfs/dbraw/zinc/54/37/83/410543783.db2.gz	WFKVQLKOLZATEZ-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCOc1cc(NC2CC[NH+](CC(N)=O)CC2)ccc1[N+](=O)[O-]	ZINC000301207884	410675544	/nfs/dbraw/zinc/67/55/44/410675544.db2.gz	UKLKVSFGVMYRPR-UHFFFAOYSA-N	1	1	322.365	1.355	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000337310866	410707079	/nfs/dbraw/zinc/70/70/79/410707079.db2.gz	BOZAOEYZSONRPI-HUBLWGQQSA-N	1	1	319.361	1.626	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301921804	410830351	/nfs/dbraw/zinc/83/03/51/410830351.db2.gz	DQHFUNQBYVCOQC-NWDGAFQWSA-N	1	1	323.397	1.556	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301921804	410830356	/nfs/dbraw/zinc/83/03/56/410830356.db2.gz	DQHFUNQBYVCOQC-NWDGAFQWSA-N	1	1	323.397	1.556	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000330643407	410847188	/nfs/dbraw/zinc/84/71/88/410847188.db2.gz	DZSQEQUULCUGQU-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000330643407	410847195	/nfs/dbraw/zinc/84/71/95/410847195.db2.gz	DZSQEQUULCUGQU-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](C(C)C)CC1	ZINC000331131765	410967840	/nfs/dbraw/zinc/96/78/40/410967840.db2.gz	GYDSCNOQQLOVAV-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000419010340	226003683	/nfs/dbraw/zinc/00/36/83/226003683.db2.gz	XSEZIOCNOCUCNK-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ncc(Cl)cc1[N+](=O)[O-]	ZINC000419010340	226003685	/nfs/dbraw/zinc/00/36/85/226003685.db2.gz	XSEZIOCNOCUCNK-NXEZZACHSA-N	1	1	314.773	1.535	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)n1	ZINC000191632787	222106696	/nfs/dbraw/zinc/10/66/96/222106696.db2.gz	PDMPXYUYXRYKGZ-QWRGUYRKSA-N	1	1	309.370	1.223	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)CC2(CO)CC2)cccc1[N+](=O)[O-]	ZINC000190015252	222065637	/nfs/dbraw/zinc/06/56/37/222065637.db2.gz	RNJZPPXYLLBJRN-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000361408638	418645849	/nfs/dbraw/zinc/64/58/49/418645849.db2.gz	PLLQRABNSLHNKS-LBPRGKRZSA-N	1	1	318.333	1.990	20	5		DDBDMO
CO[C@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371882	418639039	/nfs/dbraw/zinc/63/90/39/418639039.db2.gz	JEAOLWLJVZJYHA-UONOGXRCSA-N	1	1	305.334	1.421	20	5		DDBDMO
CO[C@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371882	418639041	/nfs/dbraw/zinc/63/90/41/418639041.db2.gz	JEAOLWLJVZJYHA-UONOGXRCSA-N	1	1	305.334	1.421	20	5		DDBDMO
C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCCNC1=O	ZINC000370997493	418755848	/nfs/dbraw/zinc/75/58/48/418755848.db2.gz	INPQNSPQKYHIRA-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCCNC1=O	ZINC000370997493	418755850	/nfs/dbraw/zinc/75/58/50/418755850.db2.gz	INPQNSPQKYHIRA-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccc(F)cn3)CC2)c1	ZINC000371541478	418799128	/nfs/dbraw/zinc/79/91/28/418799128.db2.gz	BNIWZIANEXUCFM-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
Cc1ccc(C(=O)N2CCC[N@H+]([C@H](C)CO)CC2)cc1[N+](=O)[O-]	ZINC000364933218	418824664	/nfs/dbraw/zinc/82/46/64/418824664.db2.gz	LPDWGZWUWJIPAA-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CCc1nc([C@@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365724273	418900408	/nfs/dbraw/zinc/90/04/08/418900408.db2.gz	QHMLVSZKVHTJJR-LLVKDONJSA-N	1	1	320.353	1.616	20	5		DDBDMO
CCc1nc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)no1	ZINC000365724273	418900410	/nfs/dbraw/zinc/90/04/10/418900410.db2.gz	QHMLVSZKVHTJJR-LLVKDONJSA-N	1	1	320.353	1.616	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@](O)(C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000365106188	418838307	/nfs/dbraw/zinc/83/83/07/418838307.db2.gz	CKTBLABIQDJKRP-MRXNPFEDSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420950423	419380419	/nfs/dbraw/zinc/38/04/19/419380419.db2.gz	WLNMYJIRUJFWIO-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)C[C@H]2C1	ZINC000427782261	419735012	/nfs/dbraw/zinc/73/50/12/419735012.db2.gz	URXDZNLDMLOPDL-PHIMTYICSA-N	1	1	314.345	1.710	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)n1	ZINC000427819704	419742783	/nfs/dbraw/zinc/74/27/83/419742783.db2.gz	RIRUSQHUCQVIJE-JTQLQIEISA-N	1	1	320.353	1.382	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CCCCCO	ZINC000434661906	229317134	/nfs/dbraw/zinc/31/71/34/229317134.db2.gz	AOSMZJJKORIXKC-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C1(CO)CCC1	ZINC000429254643	419993982	/nfs/dbraw/zinc/99/39/82/419993982.db2.gz	LJIGVPXJKVYJRE-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[C@@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OC	ZINC000419289659	420051437	/nfs/dbraw/zinc/05/14/37/420051437.db2.gz	QXNOUSOOAUKWLD-ZDUSSCGKSA-N	1	1	321.377	1.778	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCN1CCOCC1	ZINC000430230603	420092971	/nfs/dbraw/zinc/09/29/71/420092971.db2.gz	YSAZUMQKXSOPBO-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCN1CCOCC1	ZINC000430230603	420092975	/nfs/dbraw/zinc/09/29/75/420092975.db2.gz	YSAZUMQKXSOPBO-UHFFFAOYSA-N	1	1	309.366	1.367	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1[NH3+]	ZINC000430967675	420228122	/nfs/dbraw/zinc/22/81/22/420228122.db2.gz	UDUFBENVXWVGAC-SMDDNHRTSA-N	1	1	306.366	1.593	20	5		DDBDMO
Cc1ccc(F)c(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000444745341	230130275	/nfs/dbraw/zinc/13/02/75/230130275.db2.gz	QRQUEXMIRRWIMM-CQSZACIVSA-N	1	1	322.340	1.732	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)CC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000438840396	420467357	/nfs/dbraw/zinc/46/73/57/420467357.db2.gz	YUFFYOBXKPXSNE-LBPRGKRZSA-N	1	1	305.378	1.998	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000439358397	420508701	/nfs/dbraw/zinc/50/87/01/420508701.db2.gz	XXWWRZQHSXMRGG-NSHDSACASA-N	1	1	320.349	1.086	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCC[N@@H+]1CC=CCC1	ZINC000492320558	420523469	/nfs/dbraw/zinc/52/34/69/420523469.db2.gz	PDKNPYHIXIOLLY-TWGQIWQCSA-N	1	1	301.346	1.986	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)n1	ZINC000450797804	420532993	/nfs/dbraw/zinc/53/29/93/420532993.db2.gz	XOZGYHMEWBABHW-BETUJISGSA-N	1	1	306.366	1.882	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccnc2c1cccc2[N+](=O)[O-]	ZINC000450949263	420566953	/nfs/dbraw/zinc/56/69/53/420566953.db2.gz	AMDUUSOZTPNQDQ-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000452068543	420619902	/nfs/dbraw/zinc/61/99/02/420619902.db2.gz	OSUXFJMZOKOXFF-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000492724683	420642031	/nfs/dbraw/zinc/64/20/31/420642031.db2.gz	ZUZLXQKUEMCSLT-IRBQFCFKSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000492724683	420642035	/nfs/dbraw/zinc/64/20/35/420642035.db2.gz	ZUZLXQKUEMCSLT-IRBQFCFKSA-N	1	1	319.361	1.133	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C	ZINC000444700029	420759824	/nfs/dbraw/zinc/75/98/24/420759824.db2.gz	FOSHXCNRDUJYOA-ONGXEEELSA-N	1	1	318.333	1.855	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H]1C	ZINC000444700029	420759829	/nfs/dbraw/zinc/75/98/29/420759829.db2.gz	FOSHXCNRDUJYOA-ONGXEEELSA-N	1	1	318.333	1.855	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000454790628	420924926	/nfs/dbraw/zinc/92/49/26/420924926.db2.gz	CSQSASTUJPHKQR-GHMZBOCLSA-N	1	1	319.365	1.388	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000455769100	421059575	/nfs/dbraw/zinc/05/95/75/421059575.db2.gz	YUSJAPJMERAGML-VHSXEESVSA-N	1	1	307.354	1.244	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)CC1	ZINC000455461574	421019396	/nfs/dbraw/zinc/01/93/96/421019396.db2.gz	OPIYCAXIGANXRN-UHFFFAOYSA-N	1	1	307.354	1.199	20	5		DDBDMO
CC(C)[C@H]1CN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000488177658	421074206	/nfs/dbraw/zinc/07/42/06/421074206.db2.gz	FZZUUTDAIFQADI-OAHLLOKOSA-N	1	1	320.393	1.805	20	5		DDBDMO
CC[C@@H]1CN(CC)CCN1C(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC000456390739	421158391	/nfs/dbraw/zinc/15/83/91/421158391.db2.gz	VTXHCIGWVYRGLD-LLVKDONJSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000567625554	421612973	/nfs/dbraw/zinc/61/29/73/421612973.db2.gz	SMZINUMZBXQOMT-JTQLQIEISA-N	1	1	307.354	1.176	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000531633386	421640566	/nfs/dbraw/zinc/64/05/66/421640566.db2.gz	NSUPXZBNLWTDIF-ZDUSSCGKSA-N	1	1	322.365	1.076	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000518674174	421662363	/nfs/dbraw/zinc/66/23/63/421662363.db2.gz	BPDYIODSOXWSLV-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CCC3(O)CCC3)C2)nc1	ZINC000520531259	421754542	/nfs/dbraw/zinc/75/45/42/421754542.db2.gz	HXAWEFMGTVSIGW-LBPRGKRZSA-N	1	1	306.366	1.781	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000558681386	421820075	/nfs/dbraw/zinc/82/00/75/421820075.db2.gz	VCUADLSMMLGMNQ-UHFFFAOYSA-N	1	1	318.337	1.287	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000542651508	421826317	/nfs/dbraw/zinc/82/63/17/421826317.db2.gz	GJAKEZXNICBHNP-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1c[nH]nc1[N+](=O)[O-])CCC(F)(F)F	ZINC000559041098	421829528	/nfs/dbraw/zinc/82/95/28/421829528.db2.gz	PTWXUWUKZVZTNK-UHFFFAOYSA-N	1	1	323.275	1.322	20	5		DDBDMO
NC(=O)c1cccc(NC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000557520163	421773971	/nfs/dbraw/zinc/77/39/71/421773971.db2.gz	WBQWURCPHWKIKJ-SNVBAGLBSA-N	1	1	304.350	1.590	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ncnc2ccc([N+](=O)[O-])cc21	ZINC000611701149	422478843	/nfs/dbraw/zinc/47/88/43/422478843.db2.gz	OQQUWSQHULHMQM-UHFFFAOYSA-N	1	1	319.365	1.918	20	5		DDBDMO
CNc1c(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cccc1[N+](=O)[O-]	ZINC000322936697	271031158	/nfs/dbraw/zinc/03/11/58/271031158.db2.gz	PTAGXGPVSUQLEZ-YOGCLGLASA-N	1	1	318.377	1.992	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2cc(C)c([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000131925867	274034789	/nfs/dbraw/zinc/03/47/89/274034789.db2.gz	MMIIGQWQCIERBK-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
C[C@@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)C[NH+]1CCOCC1	ZINC000301952533	274226551	/nfs/dbraw/zinc/22/65/51/274226551.db2.gz	CFOVRBJUMAQSNZ-NSHDSACASA-N	1	1	320.353	1.018	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cnn(C)c1	ZINC000268926147	274511302	/nfs/dbraw/zinc/51/13/02/274511302.db2.gz	LATQRQIPUFYPQG-JTQLQIEISA-N	1	1	303.322	1.618	20	5		DDBDMO
CCC[NH+]1CCN(c2nccc(C(=O)OCC)c2[N+](=O)[O-])CC1	ZINC000133133752	276013243	/nfs/dbraw/zinc/01/32/43/276013243.db2.gz	ZIKTYRULLQMOQW-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C1CC1	ZINC000078496216	276130069	/nfs/dbraw/zinc/13/00/69/276130069.db2.gz	UGIMIBVKHLLYMQ-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269468883	276377404	/nfs/dbraw/zinc/37/74/04/276377404.db2.gz	ILVNMBIWUOUDBK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@@H+]1CCC[C@H]1CN(C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000269468883	276377405	/nfs/dbraw/zinc/37/74/05/276377405.db2.gz	ILVNMBIWUOUDBK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000269468883	276377407	/nfs/dbraw/zinc/37/74/07/276377407.db2.gz	ILVNMBIWUOUDBK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H](O)[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000114188018	280210986	/nfs/dbraw/zinc/21/09/86/280210986.db2.gz	FXFZWVBSSBXKJX-UKRRQHHQSA-N	1	1	321.377	1.819	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000427968838	300224161	/nfs/dbraw/zinc/22/41/61/300224161.db2.gz	VHDAEBSRGVCDHV-SMDDNHRTSA-N	1	1	319.361	1.514	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](O)C2(CC2)C1	ZINC000364435551	300396730	/nfs/dbraw/zinc/39/67/30/300396730.db2.gz	SPKBFIKBSMPKSJ-GXFFZTMASA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](O)C2(CC2)C1	ZINC000364435551	300396732	/nfs/dbraw/zinc/39/67/32/300396732.db2.gz	SPKBFIKBSMPKSJ-GXFFZTMASA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](O)C2(CC2)C1	ZINC000364435553	300396785	/nfs/dbraw/zinc/39/67/85/300396785.db2.gz	SPKBFIKBSMPKSJ-MFKMUULPSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](O)C2(CC2)C1	ZINC000364435553	300396789	/nfs/dbraw/zinc/39/67/89/300396789.db2.gz	SPKBFIKBSMPKSJ-MFKMUULPSA-N	1	1	305.334	1.379	20	5		DDBDMO
O=C(N[C@@H]1CCC[NH2+]CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000368710412	301079878	/nfs/dbraw/zinc/07/98/78/301079878.db2.gz	SRQSHFRTRSNJLF-SECBINFHSA-N	1	1	303.322	1.343	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019112	301120142	/nfs/dbraw/zinc/12/01/42/301120142.db2.gz	OATBYQUDBBHFCH-CMPLNLGQSA-N	1	1	307.354	1.095	20	5		DDBDMO
C[C@@H](C(=O)NC1CC1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019112	301120144	/nfs/dbraw/zinc/12/01/44/301120144.db2.gz	OATBYQUDBBHFCH-CMPLNLGQSA-N	1	1	307.354	1.095	20	5		DDBDMO
C[NH+]1CCN(C[C@@H]2CCCN(c3ncccc3[N+](=O)[O-])C2)CC1	ZINC000369027629	301121306	/nfs/dbraw/zinc/12/13/06/301121306.db2.gz	PSHMFEFJUPZKPX-AWEZNQCLSA-N	1	1	319.409	1.454	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(Cc3c([N+](=O)[O-])ncn3C)CC2)CCO1	ZINC000370055777	301268049	/nfs/dbraw/zinc/26/80/49/301268049.db2.gz	MYYFBSUGLAEDII-LBPRGKRZSA-N	1	1	323.397	1.013	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000370069193	301270079	/nfs/dbraw/zinc/27/00/79/301270079.db2.gz	FLFQBASZFWSCDH-NSHDSACASA-N	1	1	307.350	1.288	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000377468632	302182110	/nfs/dbraw/zinc/18/21/10/302182110.db2.gz	CIDNPQDIYJATOW-KBPBESRZSA-N	1	1	305.334	1.188	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000377481538	302183759	/nfs/dbraw/zinc/18/37/59/302183759.db2.gz	LZKAHZGMXOUWRT-OLZOCXBDSA-N	1	1	319.361	1.496	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000377651842	302203923	/nfs/dbraw/zinc/20/39/23/302203923.db2.gz	KGAWZKZZVPQTKD-CVEARBPZSA-N	1	1	308.378	1.969	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCN2CC[NH+]([C@@H]3CCOC3)CC2)cc1	ZINC000378398044	302321639	/nfs/dbraw/zinc/32/16/39/302321639.db2.gz	GSEGRGPORSGCQA-OAHLLOKOSA-N	1	1	321.377	1.380	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(NC(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000357054266	306868479	/nfs/dbraw/zinc/86/84/79/306868479.db2.gz	LFPRLYCTGXKVTK-UHFFFAOYSA-N	1	1	318.337	1.055	20	5		DDBDMO
C[C@H]1C[N@H+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1C	ZINC000531441815	303245508	/nfs/dbraw/zinc/24/55/08/303245508.db2.gz	CWYXEIQKQVCLPK-UHIISALHSA-N	1	1	317.345	1.815	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1C[N@@H+](C)C[C@@H]1C	ZINC000362644507	307023422	/nfs/dbraw/zinc/02/34/22/307023422.db2.gz	RXULOAZCXQIHFN-GXFFZTMASA-N	1	1	307.350	1.417	20	5		DDBDMO
CC(=O)c1cc(N2CCC[N@H+]([C@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000367449999	307093979	/nfs/dbraw/zinc/09/39/79/307093979.db2.gz	GEAGKCHGIABNAW-GFCCVEGCSA-N	1	1	321.377	1.690	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)n1	ZINC000373142414	307180454	/nfs/dbraw/zinc/18/04/54/307180454.db2.gz	TWHLPVPDYYFKIS-KBPBESRZSA-N	1	1	308.382	1.930	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373938680	307198140	/nfs/dbraw/zinc/19/81/40/307198140.db2.gz	OGZYIQHHQBBERN-CHWSQXEVSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@H]2C[N@@H+]2CCC[C@@H]2CO)s1	ZINC000374490963	307209083	/nfs/dbraw/zinc/20/90/83/307209083.db2.gz	XWLYQRBPCMUFOL-WDEREUQCSA-N	1	1	312.395	1.477	20	5		DDBDMO
Cc1ncccc1O[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000375976403	307237324	/nfs/dbraw/zinc/23/73/24/307237324.db2.gz	PAMCZJSOBSAGQH-AWEZNQCLSA-N	1	1	317.349	1.648	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000510171486	307398939	/nfs/dbraw/zinc/39/89/39/307398939.db2.gz	ZMWXZBODZKNBCN-OKILXGFUSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000510171486	307398941	/nfs/dbraw/zinc/39/89/41/307398941.db2.gz	ZMWXZBODZKNBCN-OKILXGFUSA-N	1	1	307.350	1.667	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@H](n3c[nH+]c4c3CCCC4)C2)nc1	ZINC000548006337	307752125	/nfs/dbraw/zinc/75/21/25/307752125.db2.gz	DVPJAHYPMCAGQA-NSHDSACASA-N	1	1	314.349	1.912	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000567302118	308077323	/nfs/dbraw/zinc/07/73/23/308077323.db2.gz	CMERLAUOJYZDDP-NSHDSACASA-N	1	1	309.370	1.573	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@@H+]1CC)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000567302118	308077325	/nfs/dbraw/zinc/07/73/25/308077325.db2.gz	CMERLAUOJYZDDP-NSHDSACASA-N	1	1	309.370	1.573	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000567302118	308077326	/nfs/dbraw/zinc/07/73/26/308077326.db2.gz	CMERLAUOJYZDDP-NSHDSACASA-N	1	1	309.370	1.573	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000572932666	308226415	/nfs/dbraw/zinc/22/64/15/308226415.db2.gz	LSULSESLIOACHR-SMDDNHRTSA-N	1	1	304.350	1.413	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)c1[N+](=O)[O-]	ZINC000576457295	308315601	/nfs/dbraw/zinc/31/56/01/308315601.db2.gz	FHXKRLNJTUVTPD-VIFPVBQESA-N	1	1	315.276	1.283	20	5		DDBDMO
CC1(C)C[NH+](CC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000577885789	308421962	/nfs/dbraw/zinc/42/19/62/308421962.db2.gz	UZIANBKMVSQGEU-UHFFFAOYSA-N	1	1	321.381	1.297	20	5		DDBDMO
CC1(C)C[NH+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000583389920	332381127	/nfs/dbraw/zinc/38/11/27/332381127.db2.gz	ACRFCYWTEHVVTM-UHFFFAOYSA-N	1	1	303.362	1.821	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC[N@@H+]4CCOC[C@@H]4C3)c2c1	ZINC000582713095	337123943	/nfs/dbraw/zinc/12/39/43/337123943.db2.gz	ZOVHOCBLZKMOFV-AWEZNQCLSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC[N@H+]4CCOC[C@@H]4C3)c2c1	ZINC000582713095	337123944	/nfs/dbraw/zinc/12/39/44/337123944.db2.gz	ZOVHOCBLZKMOFV-AWEZNQCLSA-N	1	1	314.345	1.664	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](CO)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000488809133	484220367	/nfs/dbraw/zinc/22/03/67/484220367.db2.gz	SXAZSOFZCYXMOS-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072365	534298414	/nfs/dbraw/zinc/29/84/14/534298414.db2.gz	WOWDKWGVMPHBNU-IJLUTSLNSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072365	534298416	/nfs/dbraw/zinc/29/84/16/534298416.db2.gz	WOWDKWGVMPHBNU-IJLUTSLNSA-N	1	1	307.350	1.625	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)c([N+](=O)[O-])c1	ZINC000292587734	534481159	/nfs/dbraw/zinc/48/11/59/534481159.db2.gz	CSOCDEPWPDQTHH-AWEZNQCLSA-N	1	1	319.361	1.573	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](CC)C2)c1	ZINC000412880632	528612809	/nfs/dbraw/zinc/61/28/09/528612809.db2.gz	RMMQGIFZQGCBDS-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)[C@@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000821241151	606731177	/nfs/dbraw/zinc/73/11/77/606731177.db2.gz	KGNQDKJJBORQJO-SKDRFNHKSA-N	1	1	317.353	1.527	20	5		DDBDMO
C[N@@H+]1CC=C(CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC1	ZINC000826021643	608587308	/nfs/dbraw/zinc/58/73/08/608587308.db2.gz	BLKWAIAVEIBNGM-UHFFFAOYSA-N	1	1	315.337	1.449	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](C)C1	ZINC000108327192	696633426	/nfs/dbraw/zinc/63/34/26/696633426.db2.gz	FVNOKZRDCBOYIB-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
Cc1cc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000749388545	700160898	/nfs/dbraw/zinc/16/08/98/700160898.db2.gz	ZJAHZXWXDHPHCQ-GFCCVEGCSA-N	1	1	318.377	1.794	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCOC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000781666838	698638173	/nfs/dbraw/zinc/63/81/73/698638173.db2.gz	WZZYXWPSZPSSDE-SNVBAGLBSA-N	1	1	308.338	1.603	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](Nc2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000729987785	699496911	/nfs/dbraw/zinc/49/69/11/699496911.db2.gz	ROEIRYFZLVWMFL-GFCCVEGCSA-N	1	1	319.365	1.765	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000792865491	699719608	/nfs/dbraw/zinc/71/96/08/699719608.db2.gz	CALJQEVQJMMQGM-MWLCHTKSSA-N	1	1	322.321	1.589	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000795752751	699889743	/nfs/dbraw/zinc/88/97/43/699889743.db2.gz	VRJQWMBOZHMWOI-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000795752751	699889746	/nfs/dbraw/zinc/88/97/46/699889746.db2.gz	VRJQWMBOZHMWOI-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
C[NH+]1CCN(C(=O)CNc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000744170779	699938778	/nfs/dbraw/zinc/93/87/78/699938778.db2.gz	KEROYLXDTMWPDP-UHFFFAOYSA-N	1	1	312.757	1.434	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)CC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000752743943	700384259	/nfs/dbraw/zinc/38/42/59/700384259.db2.gz	BSYDWPQUQNCJIN-CYBMUJFWSA-N	1	1	321.377	1.803	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000757035755	700653321	/nfs/dbraw/zinc/65/33/21/700653321.db2.gz	UWIAGKVHZKLKTI-ZDUSSCGKSA-N	1	1	318.377	1.757	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000757914356	700676111	/nfs/dbraw/zinc/67/61/11/700676111.db2.gz	ZLCBGAKLKHUDQC-UHFFFAOYSA-N	1	1	318.337	1.322	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000758332463	700699267	/nfs/dbraw/zinc/69/92/67/700699267.db2.gz	BJFDNSBOFSVNLQ-TVQRCGJNSA-N	1	1	307.325	1.946	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000769145164	701234463	/nfs/dbraw/zinc/23/44/63/701234463.db2.gz	MHXOFCYHURQUEJ-VXGBXAGGSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000769145164	701234465	/nfs/dbraw/zinc/23/44/65/701234465.db2.gz	MHXOFCYHURQUEJ-VXGBXAGGSA-N	1	1	320.393	1.825	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N[C@@H](C)CN1CC[NH+](C)CC1	ZINC000807967120	701492422	/nfs/dbraw/zinc/49/24/22/701492422.db2.gz	NPBHWMOWSOKHGF-LBPRGKRZSA-N	1	1	320.393	1.845	20	5		DDBDMO
C[NH+](C)CCCOc1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1	ZINC000839718023	701795847	/nfs/dbraw/zinc/79/58/47/701795847.db2.gz	XFZMZKIVFKXKCJ-ZIAGYGMSSA-N	1	1	307.350	1.621	20	5		DDBDMO
CCN(C[C@H]1CCCO1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867970194	701862555	/nfs/dbraw/zinc/86/25/55/701862555.db2.gz	YRBNEPMMHNJUEQ-ZBFHGGJFSA-N	1	1	321.377	1.796	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000867982196	701871767	/nfs/dbraw/zinc/87/17/67/701871767.db2.gz	LXRYOIAYZOPOAF-DJSGYFEHSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@H]2[C@@H](C1)C2(F)F)c1cccc([N+](=O)[O-])c1	ZINC000867984240	701873877	/nfs/dbraw/zinc/87/38/77/701873877.db2.gz	VRRUOGLSPADKJQ-NTZNESFSSA-N	1	1	311.288	1.492	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000840094478	701966294	/nfs/dbraw/zinc/96/62/94/701966294.db2.gz	UMOJYMTZSIKBAX-CYBMUJFWSA-N	1	1	303.366	1.928	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000840094779	701966466	/nfs/dbraw/zinc/96/64/66/701966466.db2.gz	WZONBSPLDVPLMN-CYBMUJFWSA-N	1	1	303.366	1.928	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@@H+]2CCCN3c4ccccc4C[C@@H]3C2)c1	ZINC000811783771	702058286	/nfs/dbraw/zinc/05/82/86/702058286.db2.gz	JNFXRUNLBUULPB-CQSZACIVSA-N	1	1	313.361	1.886	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@H+]2CCCN3c4ccccc4C[C@@H]3C2)c1	ZINC000811783771	702058292	/nfs/dbraw/zinc/05/82/92/702058292.db2.gz	JNFXRUNLBUULPB-CQSZACIVSA-N	1	1	313.361	1.886	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@H]21	ZINC000866208679	706649152	/nfs/dbraw/zinc/64/91/52/706649152.db2.gz	KJNKXKOGPUMAFU-ZWNOBZJWSA-N	1	1	304.350	1.224	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)Nc1cccc([N+](=O)[O-])c1Cl	ZINC000841233081	702397120	/nfs/dbraw/zinc/39/71/20/702397120.db2.gz	KNTGFAAIBACCGA-UHFFFAOYSA-N	1	1	308.672	1.964	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OC[C@@H]1CC[N@H+]1C(C)(C)C	ZINC000845733416	703195121	/nfs/dbraw/zinc/19/51/21/703195121.db2.gz	ALPHFQVZBXTRCS-LBPRGKRZSA-N	1	1	324.381	1.906	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485942	703556035	/nfs/dbraw/zinc/55/60/35/703556035.db2.gz	BEDOXGMMEVRBFL-SWLSCSKDSA-N	1	1	321.377	1.835	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485942	703556037	/nfs/dbraw/zinc/55/60/37/703556037.db2.gz	BEDOXGMMEVRBFL-SWLSCSKDSA-N	1	1	321.377	1.835	20	5		DDBDMO
CC1(C)OC[C@@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)O1	ZINC000851715514	703835797	/nfs/dbraw/zinc/83/57/97/703835797.db2.gz	WXXSQVUWFMOXIT-OAHLLOKOSA-N	1	1	321.377	1.868	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1	ZINC000852313495	704007058	/nfs/dbraw/zinc/00/70/58/704007058.db2.gz	IHIBQZHFUCGHFS-SWLSCSKDSA-N	1	1	317.349	1.242	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000852463944	704054604	/nfs/dbraw/zinc/05/46/04/704054604.db2.gz	ZIWGZGSJUJXOCD-OAGGEKHMSA-N	1	1	306.362	1.987	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[N@H+](CC3CC3)C2)c1	ZINC000819040287	704057344	/nfs/dbraw/zinc/05/73/44/704057344.db2.gz	ZAQDOKWNMAOFQM-GOEBONIOSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000819040287	704057349	/nfs/dbraw/zinc/05/73/49/704057349.db2.gz	ZAQDOKWNMAOFQM-GOEBONIOSA-N	1	1	305.378	1.702	20	5		DDBDMO
COC(=O)NC1CC[NH+](Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000852770597	704120249	/nfs/dbraw/zinc/12/02/49/704120249.db2.gz	UTDGNTJSCITHGW-UHFFFAOYSA-N	1	1	323.349	1.924	20	5		DDBDMO
C[C@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000870786396	704132036	/nfs/dbraw/zinc/13/20/36/704132036.db2.gz	WHMOJTVPMRIXPL-MNOVXSKESA-N	1	1	310.354	1.748	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000819899969	704183911	/nfs/dbraw/zinc/18/39/11/704183911.db2.gz	XHNWPXRVCYZIKE-JTQLQIEISA-N	1	1	308.338	1.084	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)C[N@H+](C)CCCN(C)C)n1	ZINC000853774598	704314234	/nfs/dbraw/zinc/31/42/34/704314234.db2.gz	UXCNSXFTPUHHKV-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N[C@@H](C)C[N@@H+](C)CCCN(C)C)n1	ZINC000853774598	704314236	/nfs/dbraw/zinc/31/42/36/704314236.db2.gz	UXCNSXFTPUHHKV-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)CO1	ZINC000853798686	704317059	/nfs/dbraw/zinc/31/70/59/704317059.db2.gz	HOOZZDBGQIBENK-UWVGGRQHSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)CO1	ZINC000853798686	704317062	/nfs/dbraw/zinc/31/70/62/704317062.db2.gz	HOOZZDBGQIBENK-UWVGGRQHSA-N	1	1	321.337	1.652	20	5		DDBDMO
Cc1noc(COC(=O)C[N@@H+](C)[C@H]2CCSC2)c1[N+](=O)[O-]	ZINC000853908123	704333555	/nfs/dbraw/zinc/33/35/55/704333555.db2.gz	VQGXAPRBAIWVQL-VIFPVBQESA-N	1	1	315.351	1.372	20	5		DDBDMO
Cc1noc(COC(=O)C[N@H+](C)[C@H]2CCSC2)c1[N+](=O)[O-]	ZINC000853908123	704333558	/nfs/dbraw/zinc/33/35/58/704333558.db2.gz	VQGXAPRBAIWVQL-VIFPVBQESA-N	1	1	315.351	1.372	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)C2	ZINC000854739262	704446356	/nfs/dbraw/zinc/44/63/56/704446356.db2.gz	SGIYKZOOFZDKNG-HNNXBMFYSA-N	1	1	319.365	1.130	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000880424635	706969868	/nfs/dbraw/zinc/96/98/68/706969868.db2.gz	JQTHRXHCUKVXBF-CABCVRRESA-N	1	1	310.350	1.709	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000859556021	704936406	/nfs/dbraw/zinc/93/64/06/704936406.db2.gz	CDFJCNQGZRAOPV-AWEZNQCLSA-N	1	1	312.297	1.498	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000859556021	704936407	/nfs/dbraw/zinc/93/64/07/704936407.db2.gz	CDFJCNQGZRAOPV-AWEZNQCLSA-N	1	1	312.297	1.498	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1COC(=O)Cn1c[nH+]cc1C	ZINC000859950698	705052626	/nfs/dbraw/zinc/05/26/26/705052626.db2.gz	GNCOYTKBQFWOSZ-UHFFFAOYSA-N	1	1	305.290	1.852	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[C@@H]2C[N@H+](C)C[C@@H]21	ZINC000823100738	705139786	/nfs/dbraw/zinc/13/97/86/705139786.db2.gz	IHNCATLRNQNNMQ-OCCSQVGLSA-N	1	1	303.362	1.988	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)n1	ZINC000874827014	705185559	/nfs/dbraw/zinc/18/55/59/705185559.db2.gz	AGNBGIWHFWJHRN-GHMZBOCLSA-N	1	1	307.354	1.120	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC000860506686	705207324	/nfs/dbraw/zinc/20/73/24/705207324.db2.gz	HVOVNMPGIBRAEB-UHFFFAOYSA-N	1	1	318.333	1.779	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@](C)(O)c1ccccc1	ZINC000823591361	705274751	/nfs/dbraw/zinc/27/47/51/705274751.db2.gz	KCFFYQAMIVCNTG-HNNXBMFYSA-N	1	1	304.350	1.631	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825378903	705658104	/nfs/dbraw/zinc/65/81/04/705658104.db2.gz	IXCDWRQYSZWIDU-FZMZJTMJSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000826128929	705775476	/nfs/dbraw/zinc/77/54/76/705775476.db2.gz	WOJMARZIEYJPRE-LSDHHAIUSA-N	1	1	321.377	1.427	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]CCCCN3CCOCC3)C2)c1	ZINC000876935328	705929935	/nfs/dbraw/zinc/92/99/35/705929935.db2.gz	BGTYZUFBYXKZST-UHFFFAOYSA-N	1	1	323.397	1.197	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000827216573	705952144	/nfs/dbraw/zinc/95/21/44/705952144.db2.gz	ASGRMCVTMMEIEB-CMPLNLGQSA-N	1	1	307.325	1.900	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827366708	705986500	/nfs/dbraw/zinc/98/65/00/705986500.db2.gz	OHOYIEYVMKANON-GXTWGEPZSA-N	1	1	318.377	1.803	20	5		DDBDMO
COC(=O)C1=NO[C@@]2(CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)C1	ZINC000877713922	706185591	/nfs/dbraw/zinc/18/55/91/706185591.db2.gz	IUTWEJJGPKWZGY-HNNXBMFYSA-N	1	1	319.317	1.489	20	5		DDBDMO
COC(=O)C1=NO[C@@]2(CC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)C1	ZINC000877713922	706185596	/nfs/dbraw/zinc/18/55/96/706185596.db2.gz	IUTWEJJGPKWZGY-HNNXBMFYSA-N	1	1	319.317	1.489	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]2C1=O	ZINC000877720550	706188949	/nfs/dbraw/zinc/18/89/49/706188949.db2.gz	RTXNZVOGCNAVAL-AOOOYVTPSA-N	1	1	323.736	1.295	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]2C1=O	ZINC000877720550	706188952	/nfs/dbraw/zinc/18/89/52/706188952.db2.gz	RTXNZVOGCNAVAL-AOOOYVTPSA-N	1	1	323.736	1.295	20	5		DDBDMO
C[N@H+]1CC[C@H]1CN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000877875789	706230659	/nfs/dbraw/zinc/23/06/59/706230659.db2.gz	RQLYKLFSRBTRLW-WFASDCNBSA-N	1	1	318.333	1.066	20	5		DDBDMO
C[C@H](CNC(=O)Cc1cccc(F)c1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000865142270	706362167	/nfs/dbraw/zinc/36/21/67/706362167.db2.gz	CFFKXGGMNIFBOU-SNVBAGLBSA-N	1	1	309.341	1.875	20	5		DDBDMO
Cc1cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000865705724	706501118	/nfs/dbraw/zinc/50/11/18/706501118.db2.gz	YNFGCBUMJWUILA-HNNXBMFYSA-N	1	1	304.350	1.634	20	5		DDBDMO
COc1cc(N[C@H]2CC[N@@H+](CC(C)(C)O)C2)ccc1[N+](=O)[O-]	ZINC000865999058	706589956	/nfs/dbraw/zinc/58/99/56/706589956.db2.gz	XEHBKIWRKFPXIK-LBPRGKRZSA-N	1	1	309.366	1.861	20	5		DDBDMO
C[C@]1(C(F)(F)F)CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000880001598	706850287	/nfs/dbraw/zinc/85/02/87/706850287.db2.gz	RCJQICRFJDBYKI-QWRGUYRKSA-N	1	1	322.287	1.427	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCN1	ZINC000880170802	706900175	/nfs/dbraw/zinc/90/01/75/706900175.db2.gz	WPHLEEPFKUIBJU-UHFFFAOYSA-N	1	1	303.362	1.882	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000872778801	707596943	/nfs/dbraw/zinc/59/69/43/707596943.db2.gz	BWLWHGHHTQWBSK-NEPJUHHUSA-N	1	1	304.350	1.367	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3ccnc(F)c3[N+](=O)[O-])CC2)CC1	ZINC000882700810	707752915	/nfs/dbraw/zinc/75/29/15/707752915.db2.gz	XIIUOQWWMXYUHW-UHFFFAOYSA-N	1	1	323.372	1.345	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000838149913	707854846	/nfs/dbraw/zinc/85/48/46/707854846.db2.gz	QVFGMSBKQPIDNR-IUODEOHRSA-N	1	1	321.377	1.476	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000896912411	708180598	/nfs/dbraw/zinc/18/05/98/708180598.db2.gz	WYBDZPRFUUINGZ-ZUZCIYMTSA-N	1	1	320.349	1.164	20	5		DDBDMO
COC(=O)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])C1CCOCC1	ZINC000886026977	708683802	/nfs/dbraw/zinc/68/38/02/708683802.db2.gz	AJDQADSCZZMNJY-UHFFFAOYSA-N	1	1	323.349	1.534	20	5		DDBDMO
C[C@@](O)(C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(F)F	ZINC000886067223	708691536	/nfs/dbraw/zinc/69/15/36/708691536.db2.gz	IPYOMZYTXVUBMZ-NOZJJQNGSA-N	1	1	316.308	1.492	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1C[C@H](O)CC2(CCOCC2)C1	ZINC000886319782	708741934	/nfs/dbraw/zinc/74/19/34/708741934.db2.gz	OYSOHBICXLZFGC-CYBMUJFWSA-N	1	1	307.350	1.353	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1C[C@H](O)CC2(CCOCC2)C1	ZINC000886319782	708741935	/nfs/dbraw/zinc/74/19/35/708741935.db2.gz	OYSOHBICXLZFGC-CYBMUJFWSA-N	1	1	307.350	1.353	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]([C@H]2CCCO2)C1	ZINC000886823107	708854184	/nfs/dbraw/zinc/85/41/84/708854184.db2.gz	ZAIWXAMQLVNYLE-TZMCWYRMSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[C@H](NC(=O)C[C@]1(O)CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000901328962	710011496	/nfs/dbraw/zinc/01/14/96/710011496.db2.gz	JVNSWJRBOHIIPU-BLLLJJGKSA-N	1	1	321.377	1.619	20	5		DDBDMO
Cc1cccc(C[NH+]2CCN(c3c([N+](=O)[O-])cnn3C)CC2)c1	ZINC000891531638	710228558	/nfs/dbraw/zinc/22/85/58/710228558.db2.gz	NRGHFHRQFDMRGP-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)c1	ZINC000928459938	713206187	/nfs/dbraw/zinc/20/61/87/713206187.db2.gz	YJMPGQZVGIOOKA-CHWSQXEVSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)Oc1cc(C(=O)NC[C@H]2CC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000928554502	713224366	/nfs/dbraw/zinc/22/43/66/713224366.db2.gz	PYIKICOAXGGALX-GFCCVEGCSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC(C)Oc1cc(C(=O)NC[C@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000928554502	713224367	/nfs/dbraw/zinc/22/43/67/713224367.db2.gz	PYIKICOAXGGALX-GFCCVEGCSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000894395850	711102252	/nfs/dbraw/zinc/10/22/52/711102252.db2.gz	BZEASVCPSMRHBF-UKRRQHHQSA-N	1	1	318.377	1.749	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000895734807	711590304	/nfs/dbraw/zinc/59/03/04/711590304.db2.gz	AUPOKUSTSAFVKI-ONGXEEELSA-N	1	1	308.338	1.589	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)NC[C@H]1CC[N@H+]1C	ZINC000914291383	713371593	/nfs/dbraw/zinc/37/15/93/713371593.db2.gz	KLOWPDUCTVUHPU-GFCCVEGCSA-N	1	1	308.338	1.107	20	5		DDBDMO
CC(C)(C)NC(=O)[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000932438783	714331114	/nfs/dbraw/zinc/33/11/14/714331114.db2.gz	UMVWROSVRIQQCO-NSHDSACASA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)(C)NC(=O)[C@@H]1CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000932438783	714331112	/nfs/dbraw/zinc/33/11/12/714331112.db2.gz	UMVWROSVRIQQCO-NSHDSACASA-N	1	1	309.370	1.170	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](C3CC3)C[C@@H]2C2CC2)c1	ZINC000932892606	714431957	/nfs/dbraw/zinc/43/19/57/714431957.db2.gz	GLWLVFRKILCELN-FVQBIDKESA-N	1	1	320.393	1.663	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000932931313	714439611	/nfs/dbraw/zinc/43/96/11/714439611.db2.gz	JEPAIVGZQYWWOF-UHFFFAOYSA-N	1	1	305.334	1.456	20	5		DDBDMO
NC(=O)C12CCC(CC1)[N@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000932931313	714439613	/nfs/dbraw/zinc/43/96/13/714439613.db2.gz	JEPAIVGZQYWWOF-UHFFFAOYSA-N	1	1	305.334	1.456	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000933225923	714541956	/nfs/dbraw/zinc/54/19/56/714541956.db2.gz	FNCZLEIUFYIGBJ-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C2	ZINC000933749555	714663012	/nfs/dbraw/zinc/66/30/12/714663012.db2.gz	CVESGJXRRMRUII-NHYWBVRUSA-N	1	1	307.325	1.821	20	5		DDBDMO
Cc1nc(N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923257	721849175	/nfs/dbraw/zinc/84/91/75/721849175.db2.gz	UPJXCWCOVAEYTF-HUUCEWRRSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1nc(N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923257	721849176	/nfs/dbraw/zinc/84/91/76/721849176.db2.gz	UPJXCWCOVAEYTF-HUUCEWRRSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1c(C)c(N2CC[NH+](C[C@@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC001165038244	721911457	/nfs/dbraw/zinc/91/14/57/721911457.db2.gz	MLUBVLGUZPJVHN-AWEZNQCLSA-N	1	1	320.393	1.908	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc4ncc([N+](=O)[O-])n4n3)[C@@H]2C1	ZINC001120921980	782237180	/nfs/dbraw/zinc/23/71/80/782237180.db2.gz	FZYWWZUJUTUFHW-AXFHLTTASA-N	1	1	302.338	1.390	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1CCc2[nH+]ccn2CC1	ZINC001167178176	732806222	/nfs/dbraw/zinc/80/62/22/732806222.db2.gz	KSMHQCMZQVWQNG-UHFFFAOYSA-N	1	1	317.305	1.036	20	5		DDBDMO
COc1c([N+](=O)[O-])cc(Cl)c(C)c1-n1cnc(C[NH3+])cc1=N	ZINC001167359200	733291720	/nfs/dbraw/zinc/29/17/20/733291720.db2.gz	LFXFIRHRBHZGCZ-UHFFFAOYSA-N	1	1	323.740	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC001121197462	782403941	/nfs/dbraw/zinc/40/39/41/782403941.db2.gz	ASSVUBAEDOONDS-LEWSCRJBSA-N	1	1	319.361	1.673	20	5		DDBDMO
CCc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001022063574	734368194	/nfs/dbraw/zinc/36/81/94/734368194.db2.gz	DRJFMGCLRCNGMC-QKPAOTATSA-N	1	1	317.389	1.651	20	5		DDBDMO
Cc1ccccc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001022064158	734369130	/nfs/dbraw/zinc/36/91/30/734369130.db2.gz	YTOATNKYRIBZPS-LXTVHRRPSA-N	1	1	303.362	1.397	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001105441974	741696568	/nfs/dbraw/zinc/69/65/68/741696568.db2.gz	TXPFVWMUXDSAQB-UHFFFAOYSA-N	1	1	323.397	1.226	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(NC2C[NH+](C(C)C)C2)cc1OC	ZINC001168314359	742180795	/nfs/dbraw/zinc/18/07/95/742180795.db2.gz	MFCVYADALNQRCU-UHFFFAOYSA-N	1	1	323.349	1.895	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC001183611606	743860994	/nfs/dbraw/zinc/86/09/94/743860994.db2.gz	LGADBJNWEDIHCS-JTQLQIEISA-N	1	1	321.381	1.193	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034645325	750627742	/nfs/dbraw/zinc/62/77/42/750627742.db2.gz	SNTJZWIRFGBOFA-AAVRWANBSA-N	1	1	323.418	1.930	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CC2CCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000674178	762078657	/nfs/dbraw/zinc/07/86/57/762078657.db2.gz	MGLGXEGENANQSV-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
O=C(NCC1=CC[N@H+](CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674178	762078664	/nfs/dbraw/zinc/07/86/64/762078664.db2.gz	MGLGXEGENANQSV-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674178	762078674	/nfs/dbraw/zinc/07/86/74/762078674.db2.gz	MGLGXEGENANQSV-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
CCOCc1nnn2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CCC2	ZINC001169024847	762202016	/nfs/dbraw/zinc/20/20/16/762202016.db2.gz	RNRAIWWWUDDCGA-QWHCGFSZSA-N	1	1	323.397	1.466	20	5		DDBDMO
CCOC[C@H]1Cn2nccc2C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169025782	762203603	/nfs/dbraw/zinc/20/36/03/762203603.db2.gz	UWQQZUWGWUMIDE-RBSFLKMASA-N	1	1	322.409	1.797	20	5		DDBDMO
Cc1cncnc1O[C@@H]1CC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169053208	762207692	/nfs/dbraw/zinc/20/76/92/762207692.db2.gz	IEJSUKLVBVTMAX-MELADBBJSA-N	1	1	306.366	1.684	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000828588417	759684263	/nfs/dbraw/zinc/68/42/63/759684263.db2.gz	AWBGDIYUZNZRTG-HZSPNIEDSA-N	1	1	321.377	1.113	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2cccc(Cl)n2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139165	760613060	/nfs/dbraw/zinc/61/30/60/760613060.db2.gz	UOBVKRAVOMEHDP-DDHJBXDOSA-N	1	1	324.768	1.137	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(CF)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139335	760613651	/nfs/dbraw/zinc/61/36/51/760613651.db2.gz	YFFFSJWZLSEVGQ-KBUPBQIOSA-N	1	1	321.352	1.558	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001086363530	761492898	/nfs/dbraw/zinc/49/28/98/761492898.db2.gz	ZOZKVARHBUEGAT-KLHDSHLOSA-N	1	1	317.389	1.645	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001100128005	763164281	/nfs/dbraw/zinc/16/42/81/763164281.db2.gz	XEPBMURFTVMGKJ-UHFFFAOYSA-N	1	1	317.349	1.352	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](CO)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334312	766256926	/nfs/dbraw/zinc/25/69/26/766256926.db2.gz	CAJBUYDAPHSDCN-NORZTCDRSA-N	1	1	324.377	1.210	20	5		DDBDMO
COc1nc(NCC[C@H]2CCC[N@H+]2C)nc(OC)c1[N+](=O)[O-]	ZINC001160964852	772882065	/nfs/dbraw/zinc/88/20/65/772882065.db2.gz	RMNTZYDIQGFIKD-SECBINFHSA-N	1	1	311.342	1.298	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ccc([N+](=O)[O-])cc1	ZINC001094573748	776048330	/nfs/dbraw/zinc/04/83/30/776048330.db2.gz	GBVQXXNGMZHGGK-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCCNc1ccccc1[N+](=O)[O-]	ZINC001094667470	776149885	/nfs/dbraw/zinc/14/98/85/776149885.db2.gz	RTXHKUGXCXLJMV-UHFFFAOYSA-N	1	1	317.349	1.718	20	5		DDBDMO
NC(=O)[C@@H]1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1	ZINC001172914845	776928933	/nfs/dbraw/zinc/92/89/33/776928933.db2.gz	KJMHWUHIHLIMFU-KGLIPLIRSA-N	1	1	303.362	1.649	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2CN(C)C(=O)[C@H]2C1	ZINC001173227389	777062547	/nfs/dbraw/zinc/06/25/47/777062547.db2.gz	OCRIOMMJHBTCIP-KYOSRNDESA-N	1	1	303.362	1.546	20	5		DDBDMO
Cn1cc[nH+]c1C[C@@H]1CCCN(c2c([N+](=O)[O-])ncn2C)C1	ZINC001116288534	780492879	/nfs/dbraw/zinc/49/28/79/780492879.db2.gz	HGPFXGHAPQEFFN-NSHDSACASA-N	1	1	304.354	1.521	20	5		DDBDMO
O=C(NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)C(F)F	ZINC001266579495	836492042	/nfs/dbraw/zinc/49/20/42/836492042.db2.gz	QQVZKXICSRXOFW-UHFFFAOYSA-N	1	1	313.304	1.941	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccsc1)C2	ZINC001072725869	857641921	/nfs/dbraw/zinc/64/19/21/857641921.db2.gz	UQTVECWJSIUILS-CHWSQXEVSA-N	1	1	321.402	1.448	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](Cc1ccsc1)C2	ZINC001072725869	857641928	/nfs/dbraw/zinc/64/19/28/857641928.db2.gz	UQTVECWJSIUILS-CHWSQXEVSA-N	1	1	321.402	1.448	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccsc1)C2	ZINC001072725869	857641930	/nfs/dbraw/zinc/64/19/30/857641930.db2.gz	UQTVECWJSIUILS-CHWSQXEVSA-N	1	1	321.402	1.448	20	5		DDBDMO
C[C@@H]1C[C@@H]2CC[C@H](C(=O)NCCn3cc([N+](=O)[O-])cn3)C[N@H+]2C1	ZINC001123668794	859353089	/nfs/dbraw/zinc/35/30/89/859353089.db2.gz	HIGHYNGCOLJXKA-AGIUHOORSA-N	1	1	321.381	1.028	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H](OCCC[NH+]1CCOCC1)C2	ZINC001224864250	881563736	/nfs/dbraw/zinc/56/37/36/881563736.db2.gz	GDZNPDNJIZQHGG-MRXNPFEDSA-N	1	1	306.362	1.801	20	5		DDBDMO
Cc1nc(C(C)C)oc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767771	864118143	/nfs/dbraw/zinc/11/81/43/864118143.db2.gz	TWZDKTJDKVGVAH-VXGBXAGGSA-N	1	1	324.381	1.368	20	5		DDBDMO
CCc1cccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157767883	864118774	/nfs/dbraw/zinc/11/87/74/864118774.db2.gz	ZVCHFHYXSLRUCG-HUUCEWRRSA-N	1	1	305.378	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(N3CC[N@H+]4CC[C@@H]4C3)nn2)cc1	ZINC001158434473	864653171	/nfs/dbraw/zinc/65/31/71/864653171.db2.gz	SEEWGLKXFFYOCB-CQSZACIVSA-N	1	1	311.345	1.946	20	5		DDBDMO
CC(=O)N[C@H]1C[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001159509898	865366541	/nfs/dbraw/zinc/36/65/41/865366541.db2.gz	CNFCKTALNGFSRZ-SOICHRRHSA-N	1	1	319.365	1.601	20	5		DDBDMO
Cc1nc(N[C@H]2CCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160721461	866064722	/nfs/dbraw/zinc/06/47/22/866064722.db2.gz	YUSPWAUVMWAWBT-GXTWGEPZSA-N	1	1	306.366	1.963	20	5		DDBDMO
COc1ncnc(NCC[NH+]2CCC(F)(F)CC2)c1[N+](=O)[O-]	ZINC001160748816	866095858	/nfs/dbraw/zinc/09/58/58/866095858.db2.gz	AVOLPLKTHSRZOW-UHFFFAOYSA-N	1	1	317.296	1.536	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)CN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001164123912	868955878	/nfs/dbraw/zinc/95/58/78/868955878.db2.gz	PTDXNRIZXXNJFR-BKVNPXPRSA-N	1	1	306.366	1.872	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762924	869129020	/nfs/dbraw/zinc/12/90/20/869129020.db2.gz	JQZIEUZWERRKAH-CZUORRHYSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762924	869129029	/nfs/dbraw/zinc/12/90/29/869129029.db2.gz	JQZIEUZWERRKAH-CZUORRHYSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762924	869129034	/nfs/dbraw/zinc/12/90/34/869129034.db2.gz	JQZIEUZWERRKAH-CZUORRHYSA-N	1	1	307.394	1.948	20	5		DDBDMO
COC[C@@H](O)C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-]	ZINC001203993880	870874700	/nfs/dbraw/zinc/87/47/00/870874700.db2.gz	NSUQUSXMJMQFMR-QMMMGPOBSA-N	1	1	319.155	1.454	20	5		DDBDMO
CS[C@H]1CC[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC001319451829	872636203	/nfs/dbraw/zinc/63/62/03/872636203.db2.gz	QQCUGUIIBJOVSI-AAEUAGOBSA-N	1	1	311.407	1.972	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC001348998646	874915296	/nfs/dbraw/zinc/91/52/96/874915296.db2.gz	MLTKTYAHMOTCFZ-NWDGAFQWSA-N	1	1	322.340	1.625	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C	ZINC001351177298	876100561	/nfs/dbraw/zinc/10/05/61/876100561.db2.gz	PIRHQYMHAUDIHI-NEPJUHHUSA-N	1	1	323.397	1.479	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[N@H+]1C1CCCC1	ZINC001352968522	877045853	/nfs/dbraw/zinc/04/58/53/877045853.db2.gz	FUUSLODMHSUCAA-SNVBAGLBSA-N	1	1	307.354	1.407	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nnc(CCC[N+](=O)[O-])n2C)[C@@H](C)C1	ZINC001355391971	878532919	/nfs/dbraw/zinc/53/29/19/878532919.db2.gz	NSEGMRIUYCCROB-STQMWFEESA-N	1	1	324.429	1.191	20	5		DDBDMO
O=C(NCC1CC[NH+](CCCCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001223114749	880837627	/nfs/dbraw/zinc/83/76/27/880837627.db2.gz	RDAHJCASNXRGED-ZIAGYGMSSA-N	1	1	315.389	1.620	20	5		DDBDMO
COC(=O)c1cnc(O[C@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1	ZINC001233865898	887402746	/nfs/dbraw/zinc/40/27/46/887402746.db2.gz	KNANBPXEJSTSDH-JTQLQIEISA-N	1	1	318.289	1.367	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O[C@@H]2CC[N@H+](C(C)C)C2)n1	ZINC001234910139	888245894	/nfs/dbraw/zinc/24/58/94/888245894.db2.gz	MOLWHZHOCWYXPE-LLVKDONJSA-N	1	1	323.353	1.513	20	5		DDBDMO
CCOCCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001235585120	888775598	/nfs/dbraw/zinc/77/55/98/888775598.db2.gz	VLLCOFXSIRUYFE-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCCC[C@@](O)(CN)C1	ZINC001246554965	892693476	/nfs/dbraw/zinc/69/34/76/892693476.db2.gz	AFPPLSKFIXMXIR-CZUORRHYSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCCC[C@@](O)(CN)C1	ZINC001246554965	892693481	/nfs/dbraw/zinc/69/34/81/892693481.db2.gz	AFPPLSKFIXMXIR-CZUORRHYSA-N	1	1	307.394	1.702	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCCC[C@@](O)(C[NH3+])C1	ZINC001246554965	892693483	/nfs/dbraw/zinc/69/34/83/892693483.db2.gz	AFPPLSKFIXMXIR-CZUORRHYSA-N	1	1	307.394	1.702	20	5		DDBDMO
NC[C@@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254466677	896453074	/nfs/dbraw/zinc/45/30/74/896453074.db2.gz	LDPKDJWUIWZNSF-INIZCTEOSA-N	1	1	304.394	1.987	20	5		DDBDMO
[NH3+]C[C@@H]1CCCN1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254466677	896453083	/nfs/dbraw/zinc/45/30/83/896453083.db2.gz	LDPKDJWUIWZNSF-INIZCTEOSA-N	1	1	304.394	1.987	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+](C)CC(=O)N1CCOCC1	ZINC001254550468	896498741	/nfs/dbraw/zinc/49/87/41/896498741.db2.gz	KFZFICYQZZJJRT-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C)CC(=O)N1CCOCC1	ZINC001254550468	896498746	/nfs/dbraw/zinc/49/87/46/896498746.db2.gz	KFZFICYQZZJJRT-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[N@@H+](C1CN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)[C@@H]1CCOC1	ZINC001254604605	896528370	/nfs/dbraw/zinc/52/83/70/896528370.db2.gz	WWFNXFGEJQDQEA-CVEARBPZSA-N	1	1	317.389	1.467	20	5		DDBDMO
COc1ccc2ncc([N+](=O)[O-])c(NC[C@H]3CC[N@@H+](C)C3)c2c1	ZINC001262060197	899922937	/nfs/dbraw/zinc/92/29/37/899922937.db2.gz	SOHHWAXEUJMZKK-LLVKDONJSA-N	1	1	316.361	1.937	20	5		DDBDMO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000081903843	192337137	/nfs/dbraw/zinc/33/71/37/192337137.db2.gz	HHIUBNGISPZBJS-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
O=C1NCCN1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451550132	231124640	/nfs/dbraw/zinc/12/46/40/231124640.db2.gz	REZBRCHPDDQYSC-AWEZNQCLSA-N	1	1	318.377	1.799	20	5		DDBDMO
CN(C(=O)CN1C[C@@H]2CC[N@@H+](C)[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000451627401	231143667	/nfs/dbraw/zinc/14/36/67/231143667.db2.gz	GYVJQBRLQYDGEY-SWLSCSKDSA-N	1	1	318.377	1.194	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000495231476	529442845	/nfs/dbraw/zinc/44/28/45/529442845.db2.gz	IHZJWKJBYWNLAH-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000495231476	529442846	/nfs/dbraw/zinc/44/28/46/529442846.db2.gz	IHZJWKJBYWNLAH-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@H]1O	ZINC000249590446	282179510	/nfs/dbraw/zinc/17/95/10/282179510.db2.gz	VGJPRKOGAFGXNM-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@H]1O	ZINC000249590446	282179512	/nfs/dbraw/zinc/17/95/12/282179512.db2.gz	VGJPRKOGAFGXNM-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000358133547	299085211	/nfs/dbraw/zinc/08/52/11/299085211.db2.gz	ZCMQRIAYVSAWQJ-JTQLQIEISA-N	1	1	306.322	1.425	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000251499132	282201486	/nfs/dbraw/zinc/20/14/86/282201486.db2.gz	BLJGYCRDLPDMAZ-CZUORRHYSA-N	1	1	324.377	1.571	20	5		DDBDMO
CC1(C)CN(C(=O)c2csc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000614895369	362066288	/nfs/dbraw/zinc/06/62/88/362066288.db2.gz	QTPGXGIEYIHWTR-UHFFFAOYSA-N	1	1	313.379	1.185	20	5		DDBDMO
CC1(C)CN(C(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000614895369	362066291	/nfs/dbraw/zinc/06/62/91/362066291.db2.gz	QTPGXGIEYIHWTR-UHFFFAOYSA-N	1	1	313.379	1.185	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1CCC[N@@H+](C)CC1	ZINC000181330230	199281899	/nfs/dbraw/zinc/28/18/99/199281899.db2.gz	BSMGCJRITRTSTN-UHFFFAOYSA-N	1	1	308.338	1.773	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]2OCCC[C@@H]2C1	ZINC000090552772	185302980	/nfs/dbraw/zinc/30/29/80/185302980.db2.gz	BWRJNKKFBHSNNV-OCCSQVGLSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H](O)C(F)(F)F	ZINC000305755594	529926386	/nfs/dbraw/zinc/92/63/86/529926386.db2.gz	AOEXCNYHHUIRHZ-NSHDSACASA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H](O)C(F)(F)F	ZINC000305755594	529926387	/nfs/dbraw/zinc/92/63/87/529926387.db2.gz	AOEXCNYHHUIRHZ-NSHDSACASA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCC[C@@H]1O	ZINC000305358542	529984586	/nfs/dbraw/zinc/98/45/86/529984586.db2.gz	SOPUEKVHUQRGKX-OCCSQVGLSA-N	1	1	307.350	1.287	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@@H+](C)[C@@H](Cc2ccccc2)C1	ZINC000286744961	219142442	/nfs/dbraw/zinc/14/24/42/219142442.db2.gz	NYDGFYQURNWLKX-AWEZNQCLSA-N	1	1	315.377	1.691	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649275	210055206	/nfs/dbraw/zinc/05/52/06/210055206.db2.gz	ZAFAHVRAPVPCEE-DGCLKSJQSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649275	210055207	/nfs/dbraw/zinc/05/52/07/210055207.db2.gz	ZAFAHVRAPVPCEE-DGCLKSJQSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000564644024	304005931	/nfs/dbraw/zinc/00/59/31/304005931.db2.gz	KKLIKORSSRBBFK-AWEZNQCLSA-N	1	1	310.329	1.438	20	5		DDBDMO
CCn1nncc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000459379216	233150346	/nfs/dbraw/zinc/15/03/46/233150346.db2.gz	PCZCPSWMVDXILY-LLVKDONJSA-N	1	1	317.353	1.288	20	5		DDBDMO
CCn1nncc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000459379216	233150355	/nfs/dbraw/zinc/15/03/55/233150355.db2.gz	PCZCPSWMVDXILY-LLVKDONJSA-N	1	1	317.353	1.288	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+][C@@H]1CCC[C@H]1O)c1cccc([N+](=O)[O-])c1	ZINC000459586271	233339054	/nfs/dbraw/zinc/33/90/54/233339054.db2.gz	KSKXHYZSZBKHHP-RBSFLKMASA-N	1	1	316.361	1.921	20	5		DDBDMO
C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)N1CCCC1	ZINC000051149106	352579481	/nfs/dbraw/zinc/57/94/81/352579481.db2.gz	PTMNLJASGQDTGW-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)N1CCCC1	ZINC000051149106	352579483	/nfs/dbraw/zinc/57/94/83/352579483.db2.gz	PTMNLJASGQDTGW-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(CO)CC1	ZINC000052807718	352626636	/nfs/dbraw/zinc/62/66/36/352626636.db2.gz	AZQZQVWGWVIWTK-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@H]3CCC[C@@H]32)c1	ZINC000054346925	352688191	/nfs/dbraw/zinc/68/81/91/352688191.db2.gz	KKHRHEBXUSDUAU-KBMXLJTQSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@H]3CCC[C@@H]32)c1	ZINC000054346925	352688195	/nfs/dbraw/zinc/68/81/95/352688195.db2.gz	KKHRHEBXUSDUAU-KBMXLJTQSA-N	1	1	322.361	1.588	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000057554929	352820488	/nfs/dbraw/zinc/82/04/88/352820488.db2.gz	SHQJJIGJHCWEKY-JTQLQIEISA-N	1	1	305.334	1.570	20	5		DDBDMO
C[C@@H](CNC(=O)COc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000057710410	352826325	/nfs/dbraw/zinc/82/63/25/352826325.db2.gz	AVAGEZWSUPWORZ-NSHDSACASA-N	1	1	307.350	1.573	20	5		DDBDMO
CN([C@H]1CCC[N@H+](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000173405631	198210687	/nfs/dbraw/zinc/21/06/87/198210687.db2.gz	LZAICLWYEAUXEV-LBPRGKRZSA-N	1	1	313.379	1.310	20	5		DDBDMO
CN([C@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000173405631	198210690	/nfs/dbraw/zinc/21/06/90/198210690.db2.gz	LZAICLWYEAUXEV-LBPRGKRZSA-N	1	1	313.379	1.310	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2CN2CCOCC2)c1	ZINC000174018224	198281700	/nfs/dbraw/zinc/28/17/00/198281700.db2.gz	IVTKVJXYKVOFNZ-MRXNPFEDSA-N	1	1	305.378	1.891	20	5		DDBDMO
CC[NH+]1CCN(c2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])CC1	ZINC000078256281	353507161	/nfs/dbraw/zinc/50/71/61/353507161.db2.gz	VWIUJMMZICLUSX-UHFFFAOYSA-N	1	1	324.337	1.446	20	5		DDBDMO
CCOC(=O)C1(O)CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000081019646	353645779	/nfs/dbraw/zinc/64/57/79/353645779.db2.gz	RMSIDMAVOHQOJR-UHFFFAOYSA-N	1	1	322.361	1.793	20	5		DDBDMO
C[C@H](c1ccco1)[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CC1	ZINC000086233759	353739648	/nfs/dbraw/zinc/73/96/48/353739648.db2.gz	SLEXFAUXMWGPQQ-BXUZGUMPSA-N	1	1	320.349	1.971	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)n1	ZINC000090145882	353791298	/nfs/dbraw/zinc/79/12/98/353791298.db2.gz	AFAWYIAPAJOWDX-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)n1	ZINC000090145882	353791299	/nfs/dbraw/zinc/79/12/99/353791299.db2.gz	AFAWYIAPAJOWDX-OLZOCXBDSA-N	1	1	306.366	1.963	20	5		DDBDMO
O=C1CCC(=O)N1CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000153246675	354197665	/nfs/dbraw/zinc/19/76/65/354197665.db2.gz	GJXHCVVKMUPBRM-UHFFFAOYSA-N	1	1	317.345	1.708	20	5		DDBDMO
COC(=O)CCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000166329784	354249827	/nfs/dbraw/zinc/24/98/27/354249827.db2.gz	PYLAFEARMRAEEB-UHFFFAOYSA-N	1	1	307.350	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+](CCO)C2CCOCC2)cc1	ZINC000275443196	354412419	/nfs/dbraw/zinc/41/24/19/354412419.db2.gz	AJGGMKYLVIPAEY-UHFFFAOYSA-N	1	1	324.377	1.837	20	5		DDBDMO
COC(=O)C[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCCC1	ZINC000316762848	354505443	/nfs/dbraw/zinc/50/54/43/354505443.db2.gz	VRWGNVMNLWMZNP-UHFFFAOYSA-N	1	1	310.354	1.517	20	5		DDBDMO
COC(=O)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCCC1	ZINC000316762848	354505445	/nfs/dbraw/zinc/50/54/45/354505445.db2.gz	VRWGNVMNLWMZNP-UHFFFAOYSA-N	1	1	310.354	1.517	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@@H](C)C1	ZINC000346216127	283032845	/nfs/dbraw/zinc/03/28/45/283032845.db2.gz	IAARIYJUMISKAV-COPLHBTASA-N	1	1	306.366	1.725	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000588007204	354892688	/nfs/dbraw/zinc/89/26/88/354892688.db2.gz	AGVPPVJVUPQJRR-JTQLQIEISA-N	1	1	317.349	1.397	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000587528829	354883183	/nfs/dbraw/zinc/88/31/83/354883183.db2.gz	ZFSVRVLCWOZBNM-LLVKDONJSA-N	1	1	308.382	1.812	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@]3(CCOC3)C2)c1	ZINC000589503313	354997754	/nfs/dbraw/zinc/99/77/54/354997754.db2.gz	RFSQEXSHCSMIDI-INIZCTEOSA-N	1	1	320.345	1.994	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590011103	355040222	/nfs/dbraw/zinc/04/02/22/355040222.db2.gz	HUKWCDIBACTPPT-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@H]2CC[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590011103	355040225	/nfs/dbraw/zinc/04/02/25/355040225.db2.gz	HUKWCDIBACTPPT-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590011103	355040227	/nfs/dbraw/zinc/04/02/27/355040227.db2.gz	HUKWCDIBACTPPT-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000590402426	355085509	/nfs/dbraw/zinc/08/55/09/355085509.db2.gz	UCFTWWSWWZLAFS-CABCVRRESA-N	1	1	319.361	1.530	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)C2)C1	ZINC000590141907	355053138	/nfs/dbraw/zinc/05/31/38/355053138.db2.gz	IKWCJWCYWIVQRG-INIZCTEOSA-N	1	1	320.393	1.591	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000590442693	355096563	/nfs/dbraw/zinc/09/65/63/355096563.db2.gz	ACHHCXYGGZBWPW-DGCLKSJQSA-N	1	1	305.334	1.380	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000590443459	355097343	/nfs/dbraw/zinc/09/73/43/355097343.db2.gz	KKVUJZJVTKDJAD-MFKMUULPSA-N	1	1	304.350	1.413	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)[C@@H]2C1	ZINC000590445616	355098487	/nfs/dbraw/zinc/09/84/87/355098487.db2.gz	QZZRWDQHDMEHRP-BXKDBHETSA-N	1	1	319.317	1.100	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC2(CCCC2)O1	ZINC000592196857	355532603	/nfs/dbraw/zinc/53/26/03/355532603.db2.gz	ZBTSKBUMEQDYDC-JSGCOSHPSA-N	1	1	324.381	1.186	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594417356	356202999	/nfs/dbraw/zinc/20/29/99/356202999.db2.gz	BZDBOQOBFZCBPD-GHMZBOCLSA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000080796254	192192199	/nfs/dbraw/zinc/19/21/99/192192199.db2.gz	CYMWYGMILNWELS-CYBMUJFWSA-N	1	1	322.365	1.515	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CC1C[NH+](C)C1	ZINC000594846413	356335247	/nfs/dbraw/zinc/33/52/47/356335247.db2.gz	ILNNXQZPBOOUAF-UHFFFAOYSA-N	1	1	313.379	1.085	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc(F)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000595446555	356495292	/nfs/dbraw/zinc/49/52/92/356495292.db2.gz	MDDYBXVNNXUSEW-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@](CO)(OC)C2)ccc1[N+](=O)[O-]	ZINC000595657640	356594889	/nfs/dbraw/zinc/59/48/89/356594889.db2.gz	DUZNYHINDLTRNK-INIZCTEOSA-N	1	1	324.377	1.967	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@](CO)(OC)C1	ZINC000595659800	356595616	/nfs/dbraw/zinc/59/56/16/356595616.db2.gz	PIMZPZPNAAGXCP-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@](CO)(OC)C1	ZINC000595659800	356595620	/nfs/dbraw/zinc/59/56/20/356595620.db2.gz	PIMZPZPNAAGXCP-OAHLLOKOSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)[C@H]1O	ZINC000595743752	356631111	/nfs/dbraw/zinc/63/11/11/356631111.db2.gz	QEGNBLJETLHARO-RTUWITSCSA-N	1	1	304.350	1.920	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)[C@H]1O	ZINC000595743752	356631112	/nfs/dbraw/zinc/63/11/12/356631112.db2.gz	QEGNBLJETLHARO-RTUWITSCSA-N	1	1	304.350	1.920	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000618265118	363551296	/nfs/dbraw/zinc/55/12/96/363551296.db2.gz	UWIUCVGCOZZTKY-CYBMUJFWSA-N	1	1	317.349	1.572	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595829062	356666721	/nfs/dbraw/zinc/66/67/21/356666721.db2.gz	GZIPKAKGGPCPEG-QWHCGFSZSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595829062	356666722	/nfs/dbraw/zinc/66/67/22/356666722.db2.gz	GZIPKAKGGPCPEG-QWHCGFSZSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[NH2+]CC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000237074089	202144722	/nfs/dbraw/zinc/14/47/22/202144722.db2.gz	LGKWQCIVOABWDV-UHFFFAOYSA-N	1	1	317.349	1.543	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000596081871	356766001	/nfs/dbraw/zinc/76/60/01/356766001.db2.gz	AXYKFFQPWVOZEN-RYUDHWBXSA-N	1	1	304.350	1.732	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2cc(C)sc2[N+](=O)[O-])CC1	ZINC000596110554	356775208	/nfs/dbraw/zinc/77/52/08/356775208.db2.gz	OZTMAZGMYPBJOI-UHFFFAOYSA-N	1	1	312.395	1.541	20	5		DDBDMO
C[C@H]1C[N@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)[C@@H](C)CO1	ZINC000596431583	356878204	/nfs/dbraw/zinc/87/82/04/356878204.db2.gz	PIFUYEXUJBQXSO-QWRGUYRKSA-N	1	1	319.365	1.414	20	5		DDBDMO
C[C@H]1C[N@@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)[C@@H](C)CO1	ZINC000596431583	356878207	/nfs/dbraw/zinc/87/82/07/356878207.db2.gz	PIFUYEXUJBQXSO-QWRGUYRKSA-N	1	1	319.365	1.414	20	5		DDBDMO
CCN(C(=O)c1nn(CC)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000598041418	357439729	/nfs/dbraw/zinc/43/97/29/357439729.db2.gz	UIMPTOBMYCURHW-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000598341800	357543872	/nfs/dbraw/zinc/54/38/72/357543872.db2.gz	GJZBTRQTHPUKIN-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000599164769	357835435	/nfs/dbraw/zinc/83/54/35/357835435.db2.gz	MBKZHRHWEZVVSU-NSHDSACASA-N	1	1	319.365	1.518	20	5		DDBDMO
CCOC(=O)c1cc(NCC[N@H+]2CC[C@H](O)C2)ccc1[N+](=O)[O-]	ZINC000599199266	357847867	/nfs/dbraw/zinc/84/78/67/357847867.db2.gz	INSCOMUYUHALKK-LBPRGKRZSA-N	1	1	323.349	1.250	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000600309516	358192403	/nfs/dbraw/zinc/19/24/03/358192403.db2.gz	BBRQOJKGANVUFQ-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000180553005	199174913	/nfs/dbraw/zinc/17/49/13/199174913.db2.gz	SJGVEADVJFORGG-NSHDSACASA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@H+](C)CCO1	ZINC000601130820	358415579	/nfs/dbraw/zinc/41/55/79/358415579.db2.gz	CHCBZVWZOUYXHE-BZNIZROVSA-N	1	1	316.361	1.696	20	5		DDBDMO
C[C@@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000601130820	358415582	/nfs/dbraw/zinc/41/55/82/358415582.db2.gz	CHCBZVWZOUYXHE-BZNIZROVSA-N	1	1	316.361	1.696	20	5		DDBDMO
CNC(=O)C(C)(C)CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601132852	358416361	/nfs/dbraw/zinc/41/63/61/358416361.db2.gz	OZQMDUOBGDDJKG-UHFFFAOYSA-N	1	1	302.334	1.749	20	5		DDBDMO
CC[N@@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@H](C)C1	ZINC000601165106	358428961	/nfs/dbraw/zinc/42/89/61/358428961.db2.gz	KGQFRDDOBNZOLO-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC[N@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@H](C)C1	ZINC000601165106	358428965	/nfs/dbraw/zinc/42/89/65/358428965.db2.gz	KGQFRDDOBNZOLO-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH+]2CCCC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000602167620	358860094	/nfs/dbraw/zinc/86/00/94/358860094.db2.gz	OQJGMKMJGWQQGZ-TXEJJXNPSA-N	1	1	305.334	1.657	20	5		DDBDMO
C[NH+](C)[C@@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1(C)C	ZINC000602174242	358863425	/nfs/dbraw/zinc/86/34/25/358863425.db2.gz	SQUSVGQQXAZXRV-QWHCGFSZSA-N	1	1	307.350	1.759	20	5		DDBDMO
Cn1cc(CN2CC[N@H+](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602425617	358968222	/nfs/dbraw/zinc/96/82/22/358968222.db2.gz	RSEKYPNVSAKHOG-OAHLLOKOSA-N	1	1	315.377	1.817	20	5		DDBDMO
Cn1cc(CN2CC[N@@H+](C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602425617	358968226	/nfs/dbraw/zinc/96/82/26/358968226.db2.gz	RSEKYPNVSAKHOG-OAHLLOKOSA-N	1	1	315.377	1.817	20	5		DDBDMO
O=C1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1	ZINC000602465266	358995919	/nfs/dbraw/zinc/99/59/19/358995919.db2.gz	MTFNNNMSWANJGO-UHFFFAOYSA-N	1	1	317.267	1.936	20	5		DDBDMO
O=C1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1	ZINC000602465266	358995922	/nfs/dbraw/zinc/99/59/22/358995922.db2.gz	MTFNNNMSWANJGO-UHFFFAOYSA-N	1	1	317.267	1.936	20	5		DDBDMO
CC(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602616966	359076011	/nfs/dbraw/zinc/07/60/11/359076011.db2.gz	LBWZLSSAZWFBPU-LBPRGKRZSA-N	1	1	324.381	1.882	20	5		DDBDMO
CC(C)OC(=O)C[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602616966	359076015	/nfs/dbraw/zinc/07/60/15/359076015.db2.gz	LBWZLSSAZWFBPU-LBPRGKRZSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)C1CCN(C(C)C)CC1	ZINC000602772617	359179250	/nfs/dbraw/zinc/17/92/50/359179250.db2.gz	VLZBYPMXAKWJIK-UHFFFAOYSA-N	1	1	309.414	1.904	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C1CCN(C(C)C)CC1	ZINC000602772617	359179254	/nfs/dbraw/zinc/17/92/54/359179254.db2.gz	VLZBYPMXAKWJIK-UHFFFAOYSA-N	1	1	309.414	1.904	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](c2ccncc2)C1	ZINC000602834590	359226686	/nfs/dbraw/zinc/22/66/86/359226686.db2.gz	ULJGAACBBUHLQY-AWEZNQCLSA-N	1	1	301.350	1.984	20	5		DDBDMO
Cn1cc(C[NH2+][C@]2(CO)CCCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602823745	359218380	/nfs/dbraw/zinc/21/83/80/359218380.db2.gz	CUIVTDNUZCGRRQ-INIZCTEOSA-N	1	1	316.361	1.642	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](n3ccnn3)CC2)c1	ZINC000602888608	359272347	/nfs/dbraw/zinc/27/23/47/359272347.db2.gz	OVNARVNHWWNYAF-GFCCVEGCSA-N	1	1	305.342	1.110	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC(C2CC2)(C2CC2)C1	ZINC000602902122	359283069	/nfs/dbraw/zinc/28/30/69/359283069.db2.gz	GRYNOYYBGZUAHD-UHFFFAOYSA-N	1	1	320.393	1.991	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CC1(CO)CC1	ZINC000186788029	200010391	/nfs/dbraw/zinc/01/03/91/200010391.db2.gz	VEKWPGOFGVSNQW-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(CO)CC1	ZINC000186788029	200010392	/nfs/dbraw/zinc/01/03/92/200010392.db2.gz	VEKWPGOFGVSNQW-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000187918060	200176956	/nfs/dbraw/zinc/17/69/56/200176956.db2.gz	LZGZOTFQSXOAEW-GFCCVEGCSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000604197986	359725754	/nfs/dbraw/zinc/72/57/54/359725754.db2.gz	CSELTQMFXFPEJI-VIFPVBQESA-N	1	1	303.322	1.295	20	5		DDBDMO
CO[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1C	ZINC000189326623	200382116	/nfs/dbraw/zinc/38/21/16/200382116.db2.gz	HTRFWMIFWMOBLC-WWGRRREGSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000609491318	360314612	/nfs/dbraw/zinc/31/46/12/360314612.db2.gz	FXGUFTSJWSTJGA-CQSZACIVSA-N	1	1	306.366	1.607	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)nc1	ZINC000610489101	360449861	/nfs/dbraw/zinc/44/98/61/360449861.db2.gz	AYZDOHUFMDZDOW-CQSZACIVSA-N	1	1	306.366	1.681	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610605355	360480945	/nfs/dbraw/zinc/48/09/45/360480945.db2.gz	ZMHUPJLJGJBCGV-UONOGXRCSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H](C(F)F)C2)c1	ZINC000611180229	360651708	/nfs/dbraw/zinc/65/17/08/360651708.db2.gz	VGILWVDWTVSJCA-PWSUYJOCSA-N	1	1	316.304	1.922	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611273137	360686795	/nfs/dbraw/zinc/68/67/95/360686795.db2.gz	ZXUJJOKANWSGCQ-OAHLLOKOSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611273137	360686797	/nfs/dbraw/zinc/68/67/97/360686797.db2.gz	ZXUJJOKANWSGCQ-OAHLLOKOSA-N	1	1	308.334	1.713	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+](CCCO)C1CC1	ZINC000612077640	360912235	/nfs/dbraw/zinc/91/22/35/360912235.db2.gz	FYNUEMOPHGSLKS-CYBMUJFWSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000619567163	364063643	/nfs/dbraw/zinc/06/36/43/364063643.db2.gz	XVGGKCDPTSOELF-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@H+]2CCCOCC2)c2nonc21	ZINC000275524609	212392475	/nfs/dbraw/zinc/39/24/75/212392475.db2.gz	XCGIHCYGQCDJNM-UHFFFAOYSA-N	1	1	307.310	1.265	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000264908637	204259243	/nfs/dbraw/zinc/25/92/43/204259243.db2.gz	MWSPKOAWCKMYJX-UHFFFAOYSA-N	1	1	309.322	1.048	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)NC	ZINC000282624195	217133143	/nfs/dbraw/zinc/13/31/43/217133143.db2.gz	JEZCLMDANWSCFO-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NCC[NH+]1CCSCC1	ZINC000266163635	205150071	/nfs/dbraw/zinc/15/00/71/205150071.db2.gz	UIAAFYGURKNEQS-UHFFFAOYSA-N	1	1	309.391	1.302	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269629455	284353172	/nfs/dbraw/zinc/35/31/72/284353172.db2.gz	FAGUJVBMSMTZCX-CJNGLKHVSA-N	1	1	307.394	1.902	20	5		DDBDMO
C[C@H](CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C[NH+](C)C	ZINC000293966121	223792688	/nfs/dbraw/zinc/79/26/88/223792688.db2.gz	WNPMJJWKGMJBGV-SECBINFHSA-N	1	1	305.338	1.399	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCS(=O)(=O)C2)c(F)c1	ZINC000336830108	249240833	/nfs/dbraw/zinc/24/08/33/249240833.db2.gz	BLMVNUDDLQABRB-SNVBAGLBSA-N	1	1	302.327	1.401	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284408553	218015704	/nfs/dbraw/zinc/01/57/04/218015704.db2.gz	NUHFCYSEFFQDDC-AMIZOPFISA-N	1	1	322.340	1.529	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@@H]3OCCN(C)[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000284699800	218139463	/nfs/dbraw/zinc/13/94/63/218139463.db2.gz	IJXQQJVAFCZVEJ-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000110653647	194347562	/nfs/dbraw/zinc/34/75/62/194347562.db2.gz	JZKZGFSZUZCGSZ-SECBINFHSA-N	1	1	308.294	1.185	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000110995340	194378511	/nfs/dbraw/zinc/37/85/11/194378511.db2.gz	FHJWWIJKSJLKNI-NSHDSACASA-N	1	1	324.356	1.920	20	5		DDBDMO
C[C@H](C[NH+]1CCCCC1)NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269163145	207286001	/nfs/dbraw/zinc/28/60/01/207286001.db2.gz	ZBYGOGXTKQAKOH-LLVKDONJSA-N	1	1	307.350	1.905	20	5		DDBDMO
CCCNC(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866549	194938655	/nfs/dbraw/zinc/93/86/55/194938655.db2.gz	PWUCKKXBDFVMKJ-LLVKDONJSA-N	1	1	307.354	1.002	20	5		DDBDMO
CCCNC(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866549	194938657	/nfs/dbraw/zinc/93/86/57/194938657.db2.gz	PWUCKKXBDFVMKJ-LLVKDONJSA-N	1	1	307.354	1.002	20	5		DDBDMO
COc1cc(C[N@H+](C)C2CCN(CCO)CC2)ccc1[N+](=O)[O-]	ZINC000352425657	285041579	/nfs/dbraw/zinc/04/15/79/285041579.db2.gz	MLDOUFHIQNQLTO-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
COc1cc(C[N@@H+](C)C2CCN(CCO)CC2)ccc1[N+](=O)[O-]	ZINC000352425657	285041582	/nfs/dbraw/zinc/04/15/82/285041582.db2.gz	MLDOUFHIQNQLTO-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000424982419	533093561	/nfs/dbraw/zinc/09/35/61/533093561.db2.gz	QKLMRXCBFXTGIM-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCC[C@H]1O	ZINC000352661251	285205611	/nfs/dbraw/zinc/20/56/11/285205611.db2.gz	RNRJCJHJGZXACX-CHWSQXEVSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCC[C@H]1O	ZINC000352661251	285205614	/nfs/dbraw/zinc/20/56/14/285205614.db2.gz	RNRJCJHJGZXACX-CHWSQXEVSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000352802445	285311499	/nfs/dbraw/zinc/31/14/99/285311499.db2.gz	DVDCZMFZFCWYNN-IAQYHMDHSA-N	1	1	321.352	1.829	20	5		DDBDMO
CCOCC[NH+]1CCN(c2c([N+](=O)[O-])nc(C)n2CC)CC1	ZINC000360903429	306990659	/nfs/dbraw/zinc/99/06/59/306990659.db2.gz	GPBGEQDPAZAXHU-UHFFFAOYSA-N	1	1	311.386	1.278	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000187681817	292295454	/nfs/dbraw/zinc/29/54/54/292295454.db2.gz	GAVVBQOOGJOHDK-ZIAGYGMSSA-N	1	1	307.394	1.963	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](CCO)C(C)C)c([N+](=O)[O-])c1	ZINC000078681604	407041122	/nfs/dbraw/zinc/04/11/22/407041122.db2.gz	CSUZBYZZMADZJP-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](CCO)C(C)C)c([N+](=O)[O-])c1	ZINC000078681604	407041126	/nfs/dbraw/zinc/04/11/26/407041126.db2.gz	CSUZBYZZMADZJP-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC(C)[C@@H](CNc1ccc([N+](=O)[O-])cn1)N1CC[NH+](C)CC1	ZINC000045851956	407049891	/nfs/dbraw/zinc/04/98/91/407049891.db2.gz	HWRDMZWKDAJWOC-CQSZACIVSA-N	1	1	307.398	1.674	20	5		DDBDMO
CC[C@@H](CSC)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000091097020	407178388	/nfs/dbraw/zinc/17/83/88/407178388.db2.gz	LXXCGKVFGDGFLH-JQWIXIFHSA-N	1	1	302.400	1.226	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000098093508	407305728	/nfs/dbraw/zinc/30/57/28/407305728.db2.gz	TVGQGOIZTVVRTE-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c1C	ZINC000124197086	407350740	/nfs/dbraw/zinc/35/07/40/407350740.db2.gz	RDQNHGODAFJOGK-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000107895227	407381141	/nfs/dbraw/zinc/38/11/41/407381141.db2.gz	PSFMFOGZAHXEII-VIFPVBQESA-N	1	1	310.329	1.388	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000127418158	407435908	/nfs/dbraw/zinc/43/59/08/407435908.db2.gz	MGUPOCLOGORBCA-RISCZKNCSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000270985683	407451115	/nfs/dbraw/zinc/45/11/15/407451115.db2.gz	XSKFXBVGHSWZGK-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000270985683	407451121	/nfs/dbraw/zinc/45/11/21/407451121.db2.gz	XSKFXBVGHSWZGK-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000266550820	407555786	/nfs/dbraw/zinc/55/57/86/407555786.db2.gz	UGWKRIPEWFIKMX-LBPRGKRZSA-N	1	1	323.349	1.193	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@H+]1CCOc1ccc(OC)cc1[N+](=O)[O-]	ZINC000266550820	407555791	/nfs/dbraw/zinc/55/57/91/407555791.db2.gz	UGWKRIPEWFIKMX-LBPRGKRZSA-N	1	1	323.349	1.193	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-]	ZINC000266613417	407579993	/nfs/dbraw/zinc/57/99/93/407579993.db2.gz	CBUNOGFEHJEUFN-NEPJUHHUSA-N	1	1	321.381	1.714	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c1[N+](=O)[O-]	ZINC000266613417	407580000	/nfs/dbraw/zinc/58/00/00/407580000.db2.gz	CBUNOGFEHJEUFN-NEPJUHHUSA-N	1	1	321.381	1.714	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1[N+](=O)[O-]	ZINC000266613417	407580004	/nfs/dbraw/zinc/58/00/04/407580004.db2.gz	CBUNOGFEHJEUFN-NEPJUHHUSA-N	1	1	321.381	1.714	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000114062605	407535590	/nfs/dbraw/zinc/53/55/90/407535590.db2.gz	SOLKBCFSRANGBQ-QWRGUYRKSA-N	1	1	323.349	1.663	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000114062620	407535884	/nfs/dbraw/zinc/53/58/84/407535884.db2.gz	LVUMSQJTJSQXSU-MNOVXSKESA-N	1	1	323.349	1.663	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC(C)(C)O	ZINC000114728069	407608206	/nfs/dbraw/zinc/60/82/06/407608206.db2.gz	GOUBVQVQLGBUOF-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cc1cc(N2CC[C@@H](C[NH+]3CCOCC3)C2)ncc1[N+](=O)[O-]	ZINC000266796836	407637992	/nfs/dbraw/zinc/63/79/92/407637992.db2.gz	AUUDRUAKZWMOHQ-ZDUSSCGKSA-N	1	1	306.366	1.457	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H](CO)C3)n2)cc1	ZINC000266898881	407665016	/nfs/dbraw/zinc/66/50/16/407665016.db2.gz	GBDGPFDCGNLQKV-SNVBAGLBSA-N	1	1	304.306	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@H](CO)C3)n2)cc1	ZINC000266898881	407665019	/nfs/dbraw/zinc/66/50/19/407665019.db2.gz	GBDGPFDCGNLQKV-SNVBAGLBSA-N	1	1	304.306	1.459	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)NCc1ccccc1[N+](=O)[O-]	ZINC000186866687	407785979	/nfs/dbraw/zinc/78/59/79/407785979.db2.gz	URMBQKQMMDOQOR-UHFFFAOYSA-N	1	1	322.365	1.116	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@@H](NS(C)(=O)=O)C2)cccc1[N+](=O)[O-]	ZINC000116891459	407792466	/nfs/dbraw/zinc/79/24/66/407792466.db2.gz	DPPVLABMJLJKLL-GFCCVEGCSA-N	1	1	313.379	1.027	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H](NS(C)(=O)=O)C2)cccc1[N+](=O)[O-]	ZINC000116891459	407792470	/nfs/dbraw/zinc/79/24/70/407792470.db2.gz	DPPVLABMJLJKLL-GFCCVEGCSA-N	1	1	313.379	1.027	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000117285334	407822912	/nfs/dbraw/zinc/82/29/12/407822912.db2.gz	DYAHDCAULVLIDC-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000117285334	407822916	/nfs/dbraw/zinc/82/29/16/407822916.db2.gz	DYAHDCAULVLIDC-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000268102278	407889435	/nfs/dbraw/zinc/88/94/35/407889435.db2.gz	FTHXKLZLDONKFT-RISCZKNCSA-N	1	1	318.377	1.877	20	5		DDBDMO
O=C(NCC[C@@H]1CCC[NH2+]C1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000238145478	407895654	/nfs/dbraw/zinc/89/56/54/407895654.db2.gz	ZMVDIVYJPJASPB-JTQLQIEISA-N	1	1	317.349	1.591	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000267599232	407848188	/nfs/dbraw/zinc/84/81/88/407848188.db2.gz	JBFABSXIDMFDPH-AAEUAGOBSA-N	1	1	320.393	1.731	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-]	ZINC000245437247	407981527	/nfs/dbraw/zinc/98/15/27/407981527.db2.gz	DRDMZFMXXVAUEF-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
CSC[C@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000188067358	407916730	/nfs/dbraw/zinc/91/67/30/407916730.db2.gz	QANAIYGPYLXJFD-CMPLNLGQSA-N	1	1	312.395	1.200	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000268162286	407923643	/nfs/dbraw/zinc/92/36/43/407923643.db2.gz	CZEFGTNBLRUUKA-RISCZKNCSA-N	1	1	303.362	1.736	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000272451589	407925853	/nfs/dbraw/zinc/92/58/53/407925853.db2.gz	NPPYYGUIWXXNMR-NWDGAFQWSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])[C@@H]2C1	ZINC000272768228	408011259	/nfs/dbraw/zinc/01/12/59/408011259.db2.gz	WYWNPNRHLXLBQG-GXFFZTMASA-N	1	1	305.338	1.548	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000182492269	408178995	/nfs/dbraw/zinc/17/89/95/408178995.db2.gz	LZPBWQMQNGGYDP-AGIUHOORSA-N	1	1	310.350	1.037	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269265696	408241196	/nfs/dbraw/zinc/24/11/96/408241196.db2.gz	DCZLUYDOOUPNBW-JTQLQIEISA-N	1	1	305.334	1.515	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269265696	408241202	/nfs/dbraw/zinc/24/12/02/408241202.db2.gz	DCZLUYDOOUPNBW-JTQLQIEISA-N	1	1	305.334	1.515	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000190425381	408243302	/nfs/dbraw/zinc/24/33/02/408243302.db2.gz	YYGXMRRHQPYISJ-SGMGOOAPSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000182773557	408244795	/nfs/dbraw/zinc/24/47/95/408244795.db2.gz	CIKTVFVNNBZMPC-LBPRGKRZSA-N	1	1	318.377	1.120	20	5		DDBDMO
O=C1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]2N1	ZINC000246405762	408250084	/nfs/dbraw/zinc/25/00/84/408250084.db2.gz	BTXKYAHKVXEELQ-LSDHHAIUSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCC[C@@H]2N1	ZINC000246405762	408250087	/nfs/dbraw/zinc/25/00/87/408250087.db2.gz	BTXKYAHKVXEELQ-LSDHHAIUSA-N	1	1	303.362	1.880	20	5		DDBDMO
C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C[NH+]1CCOCC1	ZINC000121392740	408200056	/nfs/dbraw/zinc/20/00/56/408200056.db2.gz	GUMOVMNPIGCTLS-LBPRGKRZSA-N	1	1	322.365	1.685	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]1CO	ZINC000190376788	408232166	/nfs/dbraw/zinc/23/21/66/408232166.db2.gz	ZWDVSFFSCBOUHW-GXFFZTMASA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]1CO	ZINC000190376788	408232172	/nfs/dbraw/zinc/23/21/72/408232172.db2.gz	ZWDVSFFSCBOUHW-GXFFZTMASA-N	1	1	323.349	1.245	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@]3(CCOC3)C2)c1	ZINC000246739028	408330437	/nfs/dbraw/zinc/33/04/37/408330437.db2.gz	AWLGLJXJMURAHC-GDBMZVCRSA-N	1	1	322.361	1.447	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@H]2C[NH+]3CCN2CC3)c2ncccc12	ZINC000269496663	408330964	/nfs/dbraw/zinc/33/09/64/408330964.db2.gz	PCKFJKCJIOOHMP-GFCCVEGCSA-N	1	1	313.361	1.555	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000269591588	408354229	/nfs/dbraw/zinc/35/42/29/408354229.db2.gz	JTAIZNJSCQWFPK-UHFFFAOYSA-N	1	1	306.326	1.294	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000171806415	162243355	/nfs/dbraw/zinc/24/33/55/162243355.db2.gz	WLOOQSNHUOCABA-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000171806415	162243357	/nfs/dbraw/zinc/24/33/57/162243357.db2.gz	WLOOQSNHUOCABA-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000171806415	162243362	/nfs/dbraw/zinc/24/33/62/162243362.db2.gz	WLOOQSNHUOCABA-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000246994874	408380886	/nfs/dbraw/zinc/38/08/86/408380886.db2.gz	BEDVKTIRAKAEAY-LSDHHAIUSA-N	1	1	321.377	1.115	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000274440132	408405601	/nfs/dbraw/zinc/40/56/01/408405601.db2.gz	HGGRYSZDGGBPRP-LLVKDONJSA-N	1	1	309.370	1.239	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000264410914	408479324	/nfs/dbraw/zinc/47/93/24/408479324.db2.gz	JNOAHRHTJIKRKO-MFKMUULPSA-N	1	1	307.350	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000264429783	408487079	/nfs/dbraw/zinc/48/70/79/408487079.db2.gz	ALKLVQKIRFZDKX-LLVKDONJSA-N	1	1	307.354	1.327	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2CC)n1	ZINC000191810827	408496303	/nfs/dbraw/zinc/49/63/03/408496303.db2.gz	DAIYWXXOYJGKTH-LLVKDONJSA-N	1	1	309.370	1.415	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000247458151	408472061	/nfs/dbraw/zinc/47/20/61/408472061.db2.gz	QUFUXUDOBALSOL-WCQYABFASA-N	1	1	323.397	1.288	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000247447301	408473259	/nfs/dbraw/zinc/47/32/59/408473259.db2.gz	SLOBQXYPNJDLHK-PWSUYJOCSA-N	1	1	323.397	1.729	20	5		DDBDMO
C[C@@H](CCN1CC[NH+](C)CC1)NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000184337325	408593351	/nfs/dbraw/zinc/59/33/51/408593351.db2.gz	VVLCBWAAEWLYBX-ZDUSSCGKSA-N	1	1	320.393	1.351	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]2C1	ZINC000192475757	408594492	/nfs/dbraw/zinc/59/44/92/408594492.db2.gz	AFUCEKKYGNJXAZ-TXEJJXNPSA-N	1	1	323.780	1.811	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Nc2ccccc2[N+](=O)[O-])CC1	ZINC000264564797	408536673	/nfs/dbraw/zinc/53/66/73/408536673.db2.gz	QZDVDPMEIXFHCV-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1	ZINC000192527766	408604492	/nfs/dbraw/zinc/60/44/92/408604492.db2.gz	SJSVKGVRESEVNW-PHIMTYICSA-N	1	1	321.402	1.950	20	5		DDBDMO
Cc1nc(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000275662416	408638420	/nfs/dbraw/zinc/63/84/20/408638420.db2.gz	YROLTXUWUKRUMK-NSHDSACASA-N	1	1	308.382	1.580	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000270879520	408722707	/nfs/dbraw/zinc/72/27/07/408722707.db2.gz	DVDRIDAXQBJBBO-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1cccc(NC[C@@H]2C[N@@H+](C3CC3)CCO2)c1[N+](=O)[O-]	ZINC000185382133	408802760	/nfs/dbraw/zinc/80/27/60/408802760.db2.gz	CEIUICAYINOPFC-GFCCVEGCSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1cccc(NC[C@@H]2C[N@H+](C3CC3)CCO2)c1[N+](=O)[O-]	ZINC000185382133	408802765	/nfs/dbraw/zinc/80/27/65/408802765.db2.gz	CEIUICAYINOPFC-GFCCVEGCSA-N	1	1	307.350	1.879	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CC1	ZINC000290869319	408847636	/nfs/dbraw/zinc/84/76/36/408847636.db2.gz	ZNTBDLSLMDJGNF-LBPRGKRZSA-N	1	1	317.345	1.977	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC000188854285	163073132	/nfs/dbraw/zinc/07/31/32/163073132.db2.gz	HCXYTBWNADPKKU-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1C	ZINC000189208439	163089360	/nfs/dbraw/zinc/08/93/60/163089360.db2.gz	OLVGBTGYXMZFMG-LLVKDONJSA-N	1	1	307.350	1.593	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000194743034	163296174	/nfs/dbraw/zinc/29/61/74/163296174.db2.gz	IRVMIZCJAASGPA-CYBMUJFWSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[C@H](CNc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[NH+]1CCOCC1	ZINC000278408424	409080748	/nfs/dbraw/zinc/08/07/48/409080748.db2.gz	HIVUUXJNEWLTLW-LLVKDONJSA-N	1	1	319.365	1.851	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@]3(CNC(=O)C3)C2)c([N+](=O)[O-])cc1F	ZINC000278969874	409123017	/nfs/dbraw/zinc/12/30/17/409123017.db2.gz	XRPVPWNWNKDLAE-HNNXBMFYSA-N	1	1	323.324	1.455	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@]3(CNC(=O)C3)C2)c([N+](=O)[O-])cc1F	ZINC000278969874	409123019	/nfs/dbraw/zinc/12/30/19/409123019.db2.gz	XRPVPWNWNKDLAE-HNNXBMFYSA-N	1	1	323.324	1.455	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000279273771	409183053	/nfs/dbraw/zinc/18/30/53/409183053.db2.gz	WOBVUHQGAKPONT-SNVBAGLBSA-N	1	1	324.356	1.481	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@H]2CC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000280410249	409307350	/nfs/dbraw/zinc/30/73/50/409307350.db2.gz	AUNVCCRQXZPVQZ-GFCCVEGCSA-N	1	1	307.350	1.350	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@@H]2CCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000280470163	409316745	/nfs/dbraw/zinc/31/67/45/409316745.db2.gz	GKMZEDMYQVVGQO-LBPRGKRZSA-N	1	1	307.350	1.492	20	5		DDBDMO
C[N@H+](Cc1ccccn1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000295243783	409394308	/nfs/dbraw/zinc/39/43/08/409394308.db2.gz	YKTZZNBLLJOMGD-HNNXBMFYSA-N	1	1	317.345	1.862	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000295355872	409447937	/nfs/dbraw/zinc/44/79/37/409447937.db2.gz	ZCCWGUSACRUYOC-OAHLLOKOSA-N	1	1	324.356	1.557	20	5		DDBDMO
C[C@]1(O)CCOC[C@H]1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000331623725	409708002	/nfs/dbraw/zinc/70/80/02/409708002.db2.gz	YEXKBUXXPHEAMA-ZNMIVQPWSA-N	1	1	324.381	1.043	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000356902457	409708918	/nfs/dbraw/zinc/70/89/18/409708918.db2.gz	OBNIIWBQXAHEPV-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000356902457	409708928	/nfs/dbraw/zinc/70/89/28/409708928.db2.gz	OBNIIWBQXAHEPV-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
NC(=O)c1cccc(NC[C@@H]2CCCn3cc[nH+]c32)c1[N+](=O)[O-]	ZINC000342778457	409898500	/nfs/dbraw/zinc/89/85/00/409898500.db2.gz	IUEMOYDNJROCII-JTQLQIEISA-N	1	1	315.333	1.880	20	5		DDBDMO
CCC(=O)N[C@@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000354675089	410009482	/nfs/dbraw/zinc/00/94/82/410009482.db2.gz	GLSKJLTUEUKKIY-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC(=O)N[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000354675089	410009485	/nfs/dbraw/zinc/00/94/85/410009485.db2.gz	GLSKJLTUEUKKIY-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H]1C	ZINC000346609486	410036583	/nfs/dbraw/zinc/03/65/83/410036583.db2.gz	CZPGRZWINQMHCX-SMDDNHRTSA-N	1	1	308.334	1.857	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000354665353	410003518	/nfs/dbraw/zinc/00/35/18/410003518.db2.gz	QLWMGJWPHVGUCC-VHSXEESVSA-N	1	1	309.370	1.619	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000286166585	287101025	/nfs/dbraw/zinc/10/10/25/287101025.db2.gz	WOIPALXJXAUSHJ-KGLIPLIRSA-N	1	1	323.393	1.772	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687669	410084177	/nfs/dbraw/zinc/08/41/77/410084177.db2.gz	MIAQHRZRLVQGLS-SLEUVZQESA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000346687669	410084179	/nfs/dbraw/zinc/08/41/79/410084179.db2.gz	MIAQHRZRLVQGLS-SLEUVZQESA-N	1	1	319.361	1.689	20	5		DDBDMO
C[C@@H]1CC[C@@H]([N@@H+](CCO)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000351635837	410124417	/nfs/dbraw/zinc/12/44/17/410124417.db2.gz	QKRIXZNWIIQUOB-CHWSQXEVSA-N	1	1	309.366	1.239	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@H](O)[C@@H](C)C1	ZINC000351817063	410261216	/nfs/dbraw/zinc/26/12/16/410261216.db2.gz	UEMHOAMURUYANV-KWBADKCTSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@H](O)[C@@H](C)C1	ZINC000351817063	410261220	/nfs/dbraw/zinc/26/12/20/410261220.db2.gz	UEMHOAMURUYANV-KWBADKCTSA-N	1	1	323.349	1.243	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000351774893	410224637	/nfs/dbraw/zinc/22/46/37/410224637.db2.gz	PGFPHEDEWSVUPT-GWCFXTLKSA-N	1	1	321.333	1.205	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351774205	410225511	/nfs/dbraw/zinc/22/55/11/410225511.db2.gz	KDJOFYZAYGPGDQ-NURSFMCSSA-N	1	1	307.350	1.543	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351774205	410225519	/nfs/dbraw/zinc/22/55/19/410225519.db2.gz	KDJOFYZAYGPGDQ-NURSFMCSSA-N	1	1	307.350	1.543	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000343199627	410227454	/nfs/dbraw/zinc/22/74/54/410227454.db2.gz	FGOXMKVNQWHRGP-TUAOUCFPSA-N	1	1	321.381	1.795	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNc2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)O1	ZINC000298725048	410365762	/nfs/dbraw/zinc/36/57/62/410365762.db2.gz	PPMOUGKLHKHUBF-NXEZZACHSA-N	1	1	324.385	1.267	20	5		DDBDMO
COc1cc(C[N@@H+](C)CC2(O)CCC2)c([N+](=O)[O-])cc1OC	ZINC000355361390	410468553	/nfs/dbraw/zinc/46/85/53/410468553.db2.gz	HIORMJTWUWIQQM-UHFFFAOYSA-N	1	1	310.350	1.959	20	5		DDBDMO
Cc1cc(NC(=O)c2cc([N+](=O)[O-])nn2C)cn2cc[nH+]c12	ZINC000355426102	410510022	/nfs/dbraw/zinc/51/00/22/410510022.db2.gz	VXCBNJLSXDHAGI-UHFFFAOYSA-N	1	1	300.278	1.537	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000352187447	410534393	/nfs/dbraw/zinc/53/43/93/410534393.db2.gz	RVSQBMIKZPBOPA-RISCZKNCSA-N	1	1	307.350	1.403	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1	ZINC000355590732	410596839	/nfs/dbraw/zinc/59/68/39/410596839.db2.gz	WGNLAHUCELBIJE-UHFFFAOYSA-N	1	1	309.322	1.662	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291221	410602672	/nfs/dbraw/zinc/60/26/72/410602672.db2.gz	XIRJIPVROBSPNP-SWLSCSKDSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291221	410602678	/nfs/dbraw/zinc/60/26/78/410602678.db2.gz	XIRJIPVROBSPNP-SWLSCSKDSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)O)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000352202912	410545294	/nfs/dbraw/zinc/54/52/94/410545294.db2.gz	NLQALLCWHRECLO-ZYHUDNBSSA-N	1	1	309.366	1.933	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@@H](O)C(F)(F)F)n1	ZINC000340205520	410751667	/nfs/dbraw/zinc/75/16/67/410751667.db2.gz	YLPRUAYYCKUGKA-MWLCHTKSSA-N	1	1	322.287	1.569	20	5		DDBDMO
Cc1nc(N2CCCC[C@@H]2C[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000301641301	410760004	/nfs/dbraw/zinc/76/00/04/410760004.db2.gz	GPVUYYWKAYDYLS-CQSZACIVSA-N	1	1	320.393	1.989	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000359628209	410780220	/nfs/dbraw/zinc/78/02/20/410780220.db2.gz	ZITSRWYQJGBUFR-CYBMUJFWSA-N	1	1	305.334	1.410	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000330649745	410851630	/nfs/dbraw/zinc/85/16/30/410851630.db2.gz	JELPDOFQFIXSMW-OSAQELSMSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCSc2ccc([N+](=O)[O-])cn2)CC1	ZINC000330663313	410859887	/nfs/dbraw/zinc/85/98/87/410859887.db2.gz	DVQAZDUSHVJNJX-UHFFFAOYSA-N	1	1	310.379	1.246	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC(C[NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000331095204	410945713	/nfs/dbraw/zinc/94/57/13/410945713.db2.gz	ZYFPMQCSQVJAGC-UHFFFAOYSA-N	1	1	309.370	1.294	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000344242527	411049118	/nfs/dbraw/zinc/04/91/18/411049118.db2.gz	OCTCKNVGZITEIC-JTQLQIEISA-N	1	1	307.325	1.948	20	5		DDBDMO
NC(=O)c1cccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000341722587	411051779	/nfs/dbraw/zinc/05/17/79/411051779.db2.gz	OLOKNUXTFQUVRJ-WDEREUQCSA-N	1	1	304.350	1.732	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H]2CCc3[nH+]c[nH]c3C2)ccc1[N+](=O)[O-]	ZINC000580725715	422950935	/nfs/dbraw/zinc/95/09/35/422950935.db2.gz	UJYYCSZYGFKGTN-SNVBAGLBSA-N	1	1	317.349	2.470	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H]2CCc3[nH]c[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000580725715	422950937	/nfs/dbraw/zinc/95/09/37/422950937.db2.gz	UJYYCSZYGFKGTN-SNVBAGLBSA-N	1	1	317.349	2.470	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)C[NH+]1CCOCC1	ZINC000134059639	196357513	/nfs/dbraw/zinc/35/75/13/196357513.db2.gz	RQVYLYCOJLWOJW-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3COC[C@H]3O)cs2)c1	ZINC000295717768	225157454	/nfs/dbraw/zinc/15/74/54/225157454.db2.gz	VCHGGIJFCHFFNR-CHWSQXEVSA-N	1	1	321.358	1.568	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1C[C@@H](C)[NH2+][C@H](C)C1	ZINC000070077003	292587555	/nfs/dbraw/zinc/58/75/55/292587555.db2.gz	VQFUDNYLCHZVGK-GHMZBOCLSA-N	1	1	313.379	1.274	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1CCc1ccc([N+](=O)[O-])cc1	ZINC000419336576	226121994	/nfs/dbraw/zinc/12/19/94/226121994.db2.gz	XHRUDGNGMWGPDC-ZIAGYGMSSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](C)CN1CCO	ZINC000419336576	226121998	/nfs/dbraw/zinc/12/19/98/226121998.db2.gz	XHRUDGNGMWGPDC-ZIAGYGMSSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](C)CN1CCO	ZINC000419336576	226122001	/nfs/dbraw/zinc/12/20/01/226122001.db2.gz	XHRUDGNGMWGPDC-ZIAGYGMSSA-N	1	1	307.394	1.524	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000361075668	418578566	/nfs/dbraw/zinc/57/85/66/418578566.db2.gz	CQBZEACTWVTGIC-QWRGUYRKSA-N	1	1	306.366	1.849	20	5		DDBDMO
CC(C)(O)C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000189895797	222061278	/nfs/dbraw/zinc/06/12/78/222061278.db2.gz	FFVMMNIORCYFQE-CQSZACIVSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNc2ccncc2[N+](=O)[O-])C[C@H](C)O1	ZINC000361073600	418577797	/nfs/dbraw/zinc/57/77/97/418577797.db2.gz	LTLZZBJOFALYQU-BETUJISGSA-N	1	1	308.382	1.713	20	5		DDBDMO
C[C@@H]1CCOCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000374992225	418586099	/nfs/dbraw/zinc/58/60/99/418586099.db2.gz	WLEHDDKDNVWDMB-OCCSQVGLSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[N@H+](C)[C@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000375037019	418593268	/nfs/dbraw/zinc/59/32/68/418593268.db2.gz	HXURXPBZETUEKB-RISCZKNCSA-N	1	1	318.377	1.652	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1c1nc(Cc2ccc([N+](=O)[O-])cn2)no1	ZINC000361262700	418614344	/nfs/dbraw/zinc/61/43/44/418614344.db2.gz	OOIHAIMKVUPMRK-BXKDBHETSA-N	1	1	303.322	1.629	20	5		DDBDMO
CCO[C@@H]1C[C@@H](O)C12CC[NH+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC000361364974	418635165	/nfs/dbraw/zinc/63/51/65/418635165.db2.gz	CSLDUOQXZSMXOY-CHWSQXEVSA-N	1	1	324.381	1.080	20	5		DDBDMO
COC(=O)[C@@]12CCC[C@H]1C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)C2	ZINC000367796405	418635526	/nfs/dbraw/zinc/63/55/26/418635526.db2.gz	RIMFLMHQOWPCCW-IINYFYTJSA-N	1	1	308.338	1.103	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC000375508588	418651649	/nfs/dbraw/zinc/65/16/49/418651649.db2.gz	UDIQCSNIVLIHIX-JTQLQIEISA-N	1	1	314.773	1.536	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCOC1	ZINC000361575866	418683672	/nfs/dbraw/zinc/68/36/72/418683672.db2.gz	FKUGGPSGNIYVEV-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCOC1	ZINC000361575866	418683675	/nfs/dbraw/zinc/68/36/75/418683675.db2.gz	FKUGGPSGNIYVEV-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000372839443	418907084	/nfs/dbraw/zinc/90/70/84/418907084.db2.gz	OOYWVLVNBPGOQL-CABCVRRESA-N	1	1	318.377	1.422	20	5		DDBDMO
Nc1cc(C[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)ccn1	ZINC000365880429	418918714	/nfs/dbraw/zinc/91/87/14/418918714.db2.gz	QSMORTDAXIHOAI-GFCCVEGCSA-N	1	1	302.338	1.606	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1	ZINC000411555767	419341866	/nfs/dbraw/zinc/34/18/66/419341866.db2.gz	WWYXCQOXYWRKAI-TUKIKUTGSA-N	1	1	303.362	1.766	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000411960192	419524475	/nfs/dbraw/zinc/52/44/75/419524475.db2.gz	WDWPQENLZYTWEA-JTQLQIEISA-N	1	1	317.349	1.381	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000411960192	419524486	/nfs/dbraw/zinc/52/44/86/419524486.db2.gz	WDWPQENLZYTWEA-JTQLQIEISA-N	1	1	317.349	1.381	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000411935958	419505260	/nfs/dbraw/zinc/50/52/60/419505260.db2.gz	LHEFNKSCPDQNGN-LBPRGKRZSA-N	1	1	307.350	1.384	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CCCCC2)n1	ZINC000427456833	419663893	/nfs/dbraw/zinc/66/38/93/419663893.db2.gz	QWYACUOSFOOVMT-UHFFFAOYSA-N	1	1	323.397	1.806	20	5		DDBDMO
CN1CCNC[C@@H]1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423517857	420068668	/nfs/dbraw/zinc/06/86/68/420068668.db2.gz	OJFZKFMBVPZIDI-GDBMZVCRSA-N	1	1	304.394	1.465	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1CN	ZINC000420283566	420181345	/nfs/dbraw/zinc/18/13/45/420181345.db2.gz	CDIYZEASHPRQLL-WFASDCNBSA-N	1	1	320.393	1.983	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420592776	420325354	/nfs/dbraw/zinc/32/53/54/420325354.db2.gz	BCBVHQSRFMORNG-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
C[C@H](O)[C@H]1C[C@H](C)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000443349074	230006835	/nfs/dbraw/zinc/00/68/35/230006835.db2.gz	SYPVCIUBNNRCJE-MBNYWOFBSA-N	1	1	309.366	1.238	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cnc4cnccn34)nc2c1	ZINC000446828103	230306453	/nfs/dbraw/zinc/30/64/53/230306453.db2.gz	RSHWQZAHNCWDRB-UHFFFAOYSA-N	1	1	323.316	1.804	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000457103534	420615238	/nfs/dbraw/zinc/61/52/38/420615238.db2.gz	BCCOXQFXPYEDAL-AWEZNQCLSA-N	1	1	321.377	1.915	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])NCC[N@H+]1CCCOCC1	ZINC000493085623	420752902	/nfs/dbraw/zinc/75/29/02/420752902.db2.gz	CPPROEFNQACUKN-SREVYHEPSA-N	1	1	319.361	1.447	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000493153804	420772821	/nfs/dbraw/zinc/77/28/21/420772821.db2.gz	LMGYJRCGKBGZQI-IDTUSYRASA-N	1	1	307.325	1.768	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000447685986	420793818	/nfs/dbraw/zinc/79/38/18/420793818.db2.gz	OGRWHYLGZOVMER-LLVKDONJSA-N	1	1	319.365	1.364	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CCO)C[C@H]1C	ZINC000454139173	420805117	/nfs/dbraw/zinc/80/51/17/420805117.db2.gz	DLWVXWGJWBYVAH-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](CCO)C[C@H]1C	ZINC000454139173	420805120	/nfs/dbraw/zinc/80/51/20/420805120.db2.gz	DLWVXWGJWBYVAH-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000448058399	420835028	/nfs/dbraw/zinc/83/50/28/420835028.db2.gz	NECSRGCREKQWFY-YPMHNXCESA-N	1	1	305.382	1.781	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449635813	421041341	/nfs/dbraw/zinc/04/13/41/421041341.db2.gz	CHSPHBDNIFPSKI-NXEZZACHSA-N	1	1	317.349	1.718	20	5		DDBDMO
COCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000490065427	421188074	/nfs/dbraw/zinc/18/80/74/421188074.db2.gz	WHLRLPIYPYEFKF-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CCC[N@H+]1CCCO	ZINC000450601295	421215932	/nfs/dbraw/zinc/21/59/32/421215932.db2.gz	YITFPXLKQQLBSD-GFCCVEGCSA-N	1	1	311.386	1.378	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])cn1C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000560522660	421277308	/nfs/dbraw/zinc/27/73/08/421277308.db2.gz	ZHDYYRGOEDBJCP-FOSCPWQOSA-N	1	1	306.366	1.631	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000556321746	421708306	/nfs/dbraw/zinc/70/83/06/421708306.db2.gz	HARCNJZARQDTRO-JBLDHEPKSA-N	1	1	307.354	1.120	20	5		DDBDMO
Cc1c(CC(=O)NCC[N@@H+]2CC[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000533497594	421676110	/nfs/dbraw/zinc/67/61/10/421676110.db2.gz	ZJUCRESSNMQLHR-LBPRGKRZSA-N	1	1	305.378	1.904	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C(C)(C)C)CC1	ZINC000519885105	421735962	/nfs/dbraw/zinc/73/59/62/421735962.db2.gz	ITJKXTHPQUZCLT-UHFFFAOYSA-N	1	1	308.382	1.880	20	5		DDBDMO
NC1(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)CCOCC1	ZINC000600712334	422412207	/nfs/dbraw/zinc/41/22/07/422412207.db2.gz	WWNDUXYYXMNSHK-CHWSQXEVSA-N	1	1	323.397	1.373	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000179708899	263362352	/nfs/dbraw/zinc/36/23/52/263362352.db2.gz	VIRMIBFDGMGARC-OAHLLOKOSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000179708899	263362357	/nfs/dbraw/zinc/36/23/57/263362357.db2.gz	VIRMIBFDGMGARC-OAHLLOKOSA-N	1	1	308.334	1.808	20	5		DDBDMO
CC(=O)c1cc(N2CC[NH+](CC(C)(C)O)CC2)ccc1[N+](=O)[O-]	ZINC000322609287	271029223	/nfs/dbraw/zinc/02/92/23/271029223.db2.gz	YZPOODRVMMZKFN-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
Cc1cccc(C[N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)n1	ZINC000341690959	271172182	/nfs/dbraw/zinc/17/21/82/271172182.db2.gz	XANVMWKOWSTDPE-UHFFFAOYSA-N	1	1	302.334	1.592	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)n1	ZINC000341690959	271172186	/nfs/dbraw/zinc/17/21/86/271172186.db2.gz	XANVMWKOWSTDPE-UHFFFAOYSA-N	1	1	302.334	1.592	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)[C@@H](C)C1	ZINC000341772129	271206821	/nfs/dbraw/zinc/20/68/21/271206821.db2.gz	MUVXKRORYVVYFJ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)[C@@H](C)C1	ZINC000341772129	271206823	/nfs/dbraw/zinc/20/68/23/271206823.db2.gz	MUVXKRORYVVYFJ-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2NC)[C@@H](C)C1	ZINC000341799998	271215491	/nfs/dbraw/zinc/21/54/91/271215491.db2.gz	PKGPYTGMMSRJNI-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2NC)[C@@H](C)C1	ZINC000341799998	271215494	/nfs/dbraw/zinc/21/54/94/271215494.db2.gz	PKGPYTGMMSRJNI-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-]	ZINC000344662750	272084392	/nfs/dbraw/zinc/08/43/92/272084392.db2.gz	KMIQUOGEVOWQRU-NSHDSACASA-N	1	1	323.397	1.487	20	5		DDBDMO
COCC[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000153542152	274032021	/nfs/dbraw/zinc/03/20/21/274032021.db2.gz	IDOLCESSZONZDG-UHFFFAOYSA-N	1	1	300.746	1.412	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H]1C	ZINC000275387164	274270510	/nfs/dbraw/zinc/27/05/10/274270510.db2.gz	PYSWOEPDMHWHBM-VXGBXAGGSA-N	1	1	320.393	1.454	20	5		DDBDMO
CCOc1cccc(N2CC[N@H+](CCO)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000302469443	276381232	/nfs/dbraw/zinc/38/12/32/276381232.db2.gz	VSWIUUJGSGUBCR-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](CCO)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000302469443	276381233	/nfs/dbraw/zinc/38/12/33/276381233.db2.gz	VSWIUUJGSGUBCR-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000296580003	277212977	/nfs/dbraw/zinc/21/29/77/277212977.db2.gz	IBLYQISFLGZYIM-LBPRGKRZSA-N	1	1	324.381	1.533	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(c2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000425278981	277481642	/nfs/dbraw/zinc/48/16/42/277481642.db2.gz	KTMIVFZMIOQKOJ-UHFFFAOYSA-N	1	1	311.386	1.184	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193658134	279236175	/nfs/dbraw/zinc/23/61/75/279236175.db2.gz	SKQXGCOXMZUCIL-UPJWGTAASA-N	1	1	318.377	1.415	20	5		DDBDMO
CCOc1cc(N2CCC[N@@H+](CCO)CC2)ccc1[N+](=O)[O-]	ZINC000107040023	281054456	/nfs/dbraw/zinc/05/44/56/281054456.db2.gz	IZRBAOLDRRYXJH-UHFFFAOYSA-N	1	1	309.366	1.498	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000324470664	298262913	/nfs/dbraw/zinc/26/29/13/298262913.db2.gz	ZULXCEYWTXMRFQ-CQSZACIVSA-N	1	1	319.365	1.554	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+]2CC=C(C)CC2)ccc1[N+](=O)[O-]	ZINC000358062411	299061590	/nfs/dbraw/zinc/06/15/90/299061590.db2.gz	XIUPTCGMFGQQSO-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362072669	300000450	/nfs/dbraw/zinc/00/04/50/300000450.db2.gz	PLYQHHQFKHGCMC-RYUDHWBXSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362072669	300000453	/nfs/dbraw/zinc/00/04/53/300000453.db2.gz	PLYQHHQFKHGCMC-RYUDHWBXSA-N	1	1	307.350	1.402	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)CCOC1	ZINC000362276427	300041755	/nfs/dbraw/zinc/04/17/55/300041755.db2.gz	GXKAURCJJJQYGF-HNNXBMFYSA-N	1	1	324.333	1.415	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000362444040	300064805	/nfs/dbraw/zinc/06/48/05/300064805.db2.gz	BRXQEAZRXZLQIJ-RISCZKNCSA-N	1	1	306.366	1.321	20	5		DDBDMO
COCCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000364251637	300362891	/nfs/dbraw/zinc/36/28/91/300362891.db2.gz	KXEWCCWWLRBPFQ-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](O)C2(CC2)C1	ZINC000364435545	300397007	/nfs/dbraw/zinc/39/70/07/300397007.db2.gz	SPKBFIKBSMPKSJ-GWCFXTLKSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](O)C2(CC2)C1	ZINC000364435545	300397010	/nfs/dbraw/zinc/39/70/10/300397010.db2.gz	SPKBFIKBSMPKSJ-GWCFXTLKSA-N	1	1	305.334	1.379	20	5		DDBDMO
Cn1cc(C[C@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cn1	ZINC000368405797	301020541	/nfs/dbraw/zinc/02/05/41/301020541.db2.gz	VVLRTGSQJOVRCB-GFCCVEGCSA-N	1	1	304.354	1.089	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	ZINC000369279146	301155726	/nfs/dbraw/zinc/15/57/26/301155726.db2.gz	VVTKLTZKVHROOT-NSHDSACASA-N	1	1	322.365	1.086	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])o3)C2)CC1	ZINC000369279146	301155727	/nfs/dbraw/zinc/15/57/27/301155727.db2.gz	VVTKLTZKVHROOT-NSHDSACASA-N	1	1	322.365	1.086	20	5		DDBDMO
Cc1nc(C)n(C[C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)n1	ZINC000369996093	301254720	/nfs/dbraw/zinc/25/47/20/301254720.db2.gz	LQJCOBRTKQXBAW-ZDUSSCGKSA-N	1	1	319.369	1.164	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CCC[N@H+](C2CCCC2)CC1	ZINC000370044250	301264333	/nfs/dbraw/zinc/26/43/33/301264333.db2.gz	APGVPLJXDZMZNV-UHFFFAOYSA-N	1	1	307.398	1.779	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]12	ZINC000377715115	302217720	/nfs/dbraw/zinc/21/77/20/302217720.db2.gz	CTYOYUXHKQJIHC-MWLCHTKSSA-N	1	1	316.317	1.304	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]12	ZINC000377715115	302217723	/nfs/dbraw/zinc/21/77/23/302217723.db2.gz	CTYOYUXHKQJIHC-MWLCHTKSSA-N	1	1	316.317	1.304	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000531804456	303257863	/nfs/dbraw/zinc/25/78/63/303257863.db2.gz	ZPGCKLGGYGKRCB-ABAIWWIYSA-N	1	1	318.377	1.877	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532144533	303277092	/nfs/dbraw/zinc/27/70/92/303277092.db2.gz	DVOVTOPTIUOTAF-LBPRGKRZSA-N	1	1	306.366	1.984	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000534338945	303331903	/nfs/dbraw/zinc/33/19/03/303331903.db2.gz	GVUNNXQILANMBS-RYUDHWBXSA-N	1	1	321.377	1.697	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000362086967	307013701	/nfs/dbraw/zinc/01/37/01/307013701.db2.gz	LFXAKBUVMMJIAF-RYUDHWBXSA-N	1	1	310.350	1.542	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1C[N@@H+](C)C[C@@H]1C	ZINC000362644506	307023444	/nfs/dbraw/zinc/02/34/44/307023444.db2.gz	RXULOAZCXQIHFN-GWCFXTLKSA-N	1	1	307.350	1.417	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000367518653	307096291	/nfs/dbraw/zinc/09/62/91/307096291.db2.gz	NNYVOGQRNITPNH-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@H]1CCN(C2CC[NH+](C)CC2)C1	ZINC000367518653	307096292	/nfs/dbraw/zinc/09/62/92/307096292.db2.gz	NNYVOGQRNITPNH-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369017394	307114588	/nfs/dbraw/zinc/11/45/88/307114588.db2.gz	OIDFLILIDQXYMR-UONOGXRCSA-N	1	1	307.398	1.913	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000369067639	307115169	/nfs/dbraw/zinc/11/51/69/307115169.db2.gz	UUZQFMZUIJHRRV-LBPRGKRZSA-N	1	1	321.381	1.233	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@]12CCOC2)c1ccc([N+](=O)[O-])cc1	ZINC000375325473	307222323	/nfs/dbraw/zinc/22/23/23/307222323.db2.gz	DTIBIHWCLOOEBR-MRXNPFEDSA-N	1	1	319.361	1.813	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@]12CCOC2)c1ccc([N+](=O)[O-])cc1	ZINC000375325473	307222324	/nfs/dbraw/zinc/22/23/24/307222324.db2.gz	DTIBIHWCLOOEBR-MRXNPFEDSA-N	1	1	319.361	1.813	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[N@H+](C)[C@@H]3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000376663595	307252400	/nfs/dbraw/zinc/25/24/00/307252400.db2.gz	LJGVZJBHDXMSEJ-ZYHUDNBSSA-N	1	1	320.349	1.170	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2c(OC)cccc2[N+](=O)[O-])CC1	ZINC000521899241	307470545	/nfs/dbraw/zinc/47/05/45/307470545.db2.gz	PGNOZKSVUAZTHT-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
CC(C)O[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000564915082	308011887	/nfs/dbraw/zinc/01/18/87/308011887.db2.gz	AUPUACRPYZFQNR-ZIAGYGMSSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000488727961	484215404	/nfs/dbraw/zinc/21/54/04/484215404.db2.gz	WZZVIZLGSRHLMJ-AAEUAGOBSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC(=O)[C@@](C)(O)C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000330869345	527139475	/nfs/dbraw/zinc/13/94/75/527139475.db2.gz	SWYAKCFGBSYPRY-HNNXBMFYSA-N	1	1	307.350	1.057	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@H]21	ZINC000157291517	527311638	/nfs/dbraw/zinc/31/16/38/527311638.db2.gz	RWEKLBAYMSAYKS-IUODEOHRSA-N	1	1	318.377	1.855	20	5		DDBDMO
CC[N@H+](CC1CC1)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000069797439	696385990	/nfs/dbraw/zinc/38/59/90/696385990.db2.gz	RWWBOGJTRTUMPO-UHFFFAOYSA-N	1	1	303.318	1.880	20	5		DDBDMO
CC[N@@H+](CC1CC1)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000069797439	696385992	/nfs/dbraw/zinc/38/59/92/696385992.db2.gz	RWWBOGJTRTUMPO-UHFFFAOYSA-N	1	1	303.318	1.880	20	5		DDBDMO
C[C@H](C(=O)OCCn1ccc([N+](=O)[O-])n1)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000748128458	700101227	/nfs/dbraw/zinc/10/12/27/700101227.db2.gz	IOIDTXMQJKHSHP-GRYCIOLGSA-N	1	1	310.354	1.596	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2CCC[N@@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194732183	697719420	/nfs/dbraw/zinc/71/94/20/697719420.db2.gz	CLNXPGZDNJNLDV-JTQLQIEISA-N	1	1	322.321	1.635	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1	ZINC000778260571	698254631	/nfs/dbraw/zinc/25/46/31/698254631.db2.gz	BKJBHQJUPKBTCL-SECBINFHSA-N	1	1	321.362	1.424	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000778840806	698375267	/nfs/dbraw/zinc/37/52/67/698375267.db2.gz	JWSQMVIJODYLPT-UHFFFAOYSA-N	1	1	307.310	1.470	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000781668336	698638251	/nfs/dbraw/zinc/63/82/51/698638251.db2.gz	QAZBJVPFYFAVMT-UHFFFAOYSA-N	1	1	305.294	1.324	20	5		DDBDMO
O=C1CN(C[NH+]2CCCC2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000726582977	699369084	/nfs/dbraw/zinc/36/90/84/699369084.db2.gz	LIUYHCPBSQTLNY-UHFFFAOYSA-N	1	1	304.306	1.417	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](Nc2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000729987786	699496869	/nfs/dbraw/zinc/49/68/69/699496869.db2.gz	ROEIRYFZLVWMFL-LBPRGKRZSA-N	1	1	319.365	1.765	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc(Br)c([N+](=O)[O-])c2)CC1	ZINC000792175719	699680782	/nfs/dbraw/zinc/68/07/82/699680782.db2.gz	ZRLABQOKKQYESY-UHFFFAOYSA-N	1	1	314.139	1.465	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H]2[C@H](C(=O)OC)[C@H]2C1	ZINC000794953926	699837442	/nfs/dbraw/zinc/83/74/42/699837442.db2.gz	STMLZXPNEBKHPK-NHAGDIPZSA-N	1	1	320.345	1.844	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H]2[C@H](C(=O)OC)[C@H]2C1	ZINC000794953926	699837444	/nfs/dbraw/zinc/83/74/44/699837444.db2.gz	STMLZXPNEBKHPK-NHAGDIPZSA-N	1	1	320.345	1.844	20	5		DDBDMO
C[C@@H]1CCC[N@@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000751926659	700326889	/nfs/dbraw/zinc/32/68/89/700326889.db2.gz	VGCWYKZGVPBFGK-LLVKDONJSA-N	1	1	318.333	1.805	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000751926659	700326894	/nfs/dbraw/zinc/32/68/94/700326894.db2.gz	VGCWYKZGVPBFGK-LLVKDONJSA-N	1	1	318.333	1.805	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H]2C[C@H](C)O)c2ncc([N+](=O)[O-])cc12	ZINC000752803517	700388926	/nfs/dbraw/zinc/38/89/26/700388926.db2.gz	JNMLIZQRTPCRKH-CMPLNLGQSA-N	1	1	319.365	1.841	20	5		DDBDMO
COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCCn1cc[nH+]c1C	ZINC000753451072	700435091	/nfs/dbraw/zinc/43/50/91/700435091.db2.gz	DGDGTFLAQBHQHD-UHFFFAOYSA-N	1	1	320.305	1.548	20	5		DDBDMO
C[C@@H]1COCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000753991667	700474564	/nfs/dbraw/zinc/47/45/64/700474564.db2.gz	CDVJTCQJXGWVHL-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000753991667	700474567	/nfs/dbraw/zinc/47/45/67/700474567.db2.gz	CDVJTCQJXGWVHL-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000839708588	701791872	/nfs/dbraw/zinc/79/18/72/701791872.db2.gz	KBCVMYVNGCFKNW-NILFDRSVSA-N	1	1	318.377	1.388	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)OC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000810614156	701800734	/nfs/dbraw/zinc/80/07/34/701800734.db2.gz	BOCCXIUQTBXWNY-SNVBAGLBSA-N	1	1	321.337	1.663	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C[C@@H]2C1	ZINC000868452990	702137622	/nfs/dbraw/zinc/13/76/22/702137622.db2.gz	QNFXUNMJMKPWRK-OLZOCXBDSA-N	1	1	321.352	1.687	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1	ZINC000816954084	702237179	/nfs/dbraw/zinc/23/71/79/702237179.db2.gz	STGALXSLNNAYNT-MFOKFAIFSA-N	1	1	301.346	1.771	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000817282551	702327224	/nfs/dbraw/zinc/32/72/24/702327224.db2.gz	GGUYXLVRDXNQJK-SNVBAGLBSA-N	1	1	308.294	1.071	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000817282551	702327229	/nfs/dbraw/zinc/32/72/29/702327229.db2.gz	GGUYXLVRDXNQJK-SNVBAGLBSA-N	1	1	308.294	1.071	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000842045980	702663168	/nfs/dbraw/zinc/66/31/68/702663168.db2.gz	NYILUWRCWLCHHY-GHMZBOCLSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000842045980	702663171	/nfs/dbraw/zinc/66/31/71/702663171.db2.gz	NYILUWRCWLCHHY-GHMZBOCLSA-N	1	1	324.337	1.394	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH2+]C[C@H]3CCCO3)n2)cc1	ZINC000842568848	702734207	/nfs/dbraw/zinc/73/42/07/702734207.db2.gz	CMIRGVHUQSBACW-GFCCVEGCSA-N	1	1	304.306	1.913	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000866540344	706724496	/nfs/dbraw/zinc/72/44/96/706724496.db2.gz	LYAKAWKTDUMUGS-YGRLFVJLSA-N	1	1	321.352	1.875	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481548	703555546	/nfs/dbraw/zinc/55/55/46/703555546.db2.gz	ZZZVOGHIYCQCMF-CABCVRRESA-N	1	1	319.361	1.589	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481548	703555547	/nfs/dbraw/zinc/55/55/47/703555547.db2.gz	ZZZVOGHIYCQCMF-CABCVRRESA-N	1	1	319.361	1.589	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[NH+](CCCCO)CC1	ZINC000848668109	703573753	/nfs/dbraw/zinc/57/37/53/703573753.db2.gz	OEECTOJXRDLFDI-UHFFFAOYSA-N	1	1	309.366	1.498	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCOCC1	ZINC000879710468	706767167	/nfs/dbraw/zinc/76/71/67/706767167.db2.gz	ZEMDQNBFTMMEKG-INIZCTEOSA-N	1	1	324.377	1.756	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852437434	704048522	/nfs/dbraw/zinc/04/85/22/704048522.db2.gz	YCCMXDFGUWEPCD-KBPBESRZSA-N	1	1	321.333	1.155	20	5		DDBDMO
COC[C@@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870892151	704159225	/nfs/dbraw/zinc/15/92/25/704159225.db2.gz	NUYCNQAQOCTLRN-ABAIWWIYSA-N	1	1	307.350	1.264	20	5		DDBDMO
Cc1cccc(C[N@H+]2CC[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)c1	ZINC000870908892	704163868	/nfs/dbraw/zinc/16/38/68/704163868.db2.gz	CFRAHKUJSOTBNE-RRFJBIMHSA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1cccc(C[N@@H+]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC000870908892	704163869	/nfs/dbraw/zinc/16/38/69/704163869.db2.gz	CFRAHKUJSOTBNE-RRFJBIMHSA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1cccc(C[N@H+]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC000870908892	704163871	/nfs/dbraw/zinc/16/38/71/704163871.db2.gz	CFRAHKUJSOTBNE-RRFJBIMHSA-N	1	1	303.362	1.351	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CCC1(C)C	ZINC000871152834	704231721	/nfs/dbraw/zinc/23/17/21/704231721.db2.gz	UTLSXFHWJRVWIZ-UHFFFAOYSA-N	1	1	324.356	1.872	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000853798691	704317121	/nfs/dbraw/zinc/31/71/21/704317121.db2.gz	HOOZZDBGQIBENK-ZJUUUORDSA-N	1	1	321.337	1.652	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000853798691	704317122	/nfs/dbraw/zinc/31/71/22/704317122.db2.gz	HOOZZDBGQIBENK-ZJUUUORDSA-N	1	1	321.337	1.652	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000821091299	704371152	/nfs/dbraw/zinc/37/11/52/704371152.db2.gz	AQQQGTGLIQSUEJ-TZMCWYRMSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000821091299	704371155	/nfs/dbraw/zinc/37/11/55/704371155.db2.gz	AQQQGTGLIQSUEJ-TZMCWYRMSA-N	1	1	321.377	1.661	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H]2CN(C(C)=O)C[C@H]2C1	ZINC000821328854	704391528	/nfs/dbraw/zinc/39/15/28/704391528.db2.gz	QRTGVRBFDCUUAR-OKILXGFUSA-N	1	1	319.361	1.514	20	5		DDBDMO
CCN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1	ZINC000855485766	704487270	/nfs/dbraw/zinc/48/72/70/704487270.db2.gz	HDAFOBVEPBZZAU-HUUCEWRRSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000874850681	705203220	/nfs/dbraw/zinc/20/32/20/705203220.db2.gz	VUUDOEHAABRUPN-HUUCEWRRSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827346623	705982392	/nfs/dbraw/zinc/98/23/92/705982392.db2.gz	PSBOFNCFIKVFKU-DOMZBBRYSA-N	1	1	319.361	1.526	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC000827363734	705985463	/nfs/dbraw/zinc/98/54/63/705985463.db2.gz	CABPIJKYHGOBSC-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@H]21	ZINC000827371933	705988098	/nfs/dbraw/zinc/98/80/98/705988098.db2.gz	BELWJINKVDYOSD-WCQYABFASA-N	1	1	304.350	1.343	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000863829895	706022828	/nfs/dbraw/zinc/02/28/28/706022828.db2.gz	MHTGQTBMHZJBBG-JTQLQIEISA-N	1	1	313.741	1.045	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+]2CCCO)c2nonc21	ZINC000828421133	706176247	/nfs/dbraw/zinc/17/62/47/706176247.db2.gz	IXDFKAZKQDEQIT-SNVBAGLBSA-N	1	1	321.337	1.390	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2nccn2C)C1	ZINC000878518885	706414524	/nfs/dbraw/zinc/41/45/24/706414524.db2.gz	VBSMKYTXPBZVOR-CYBMUJFWSA-N	1	1	318.381	1.713	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000880138963	706888461	/nfs/dbraw/zinc/88/84/61/706888461.db2.gz	JGQOKTFDKRDWDK-TZMCWYRMSA-N	1	1	324.377	1.427	20	5		DDBDMO
O=C1CC2(CCC2)[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])CCN1	ZINC000880167214	706898544	/nfs/dbraw/zinc/89/85/44/706898544.db2.gz	NSPMUEQISPZCOP-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])CCN1	ZINC000880167214	706898545	/nfs/dbraw/zinc/89/85/45/706898545.db2.gz	NSPMUEQISPZCOP-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](CF)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000880297007	706932110	/nfs/dbraw/zinc/93/21/10/706932110.db2.gz	IQHYOJSFNOSNNZ-LLVKDONJSA-N	1	1	307.325	1.775	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](CF)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000880297007	706932113	/nfs/dbraw/zinc/93/21/13/706932113.db2.gz	IQHYOJSFNOSNNZ-LLVKDONJSA-N	1	1	307.325	1.775	20	5		DDBDMO
C[C@H](NCC[NH+]1CCC(O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872078885	707288956	/nfs/dbraw/zinc/28/89/56/707288956.db2.gz	UACHEWDQYLIHRK-NSHDSACASA-N	1	1	311.357	1.841	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1	ZINC000882491639	707662575	/nfs/dbraw/zinc/66/25/75/707662575.db2.gz	KDIDIKQXPHSANY-LBPRGKRZSA-N	1	1	307.350	1.736	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000883078284	707919611	/nfs/dbraw/zinc/91/96/11/707919611.db2.gz	MDWNEQRMTNDDAZ-CQSZACIVSA-N	1	1	321.381	1.400	20	5		DDBDMO
CC(C)(CCC(=O)O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)[N+](=O)[O-]	ZINC000838904356	708000411	/nfs/dbraw/zinc/00/04/11/708000411.db2.gz	KARHLDRGQXXECQ-TXEJJXNPSA-N	1	1	300.355	1.228	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000883896428	708078089	/nfs/dbraw/zinc/07/80/89/708078089.db2.gz	PDJDVDXFZOORNF-ZDUSSCGKSA-N	1	1	318.377	1.757	20	5		DDBDMO
CN1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC[N@H+](C)CC1	ZINC000897094824	708228513	/nfs/dbraw/zinc/22/85/13/708228513.db2.gz	XHFSOIQHLQJTTF-UHFFFAOYSA-N	1	1	313.789	1.327	20	5		DDBDMO
CN1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC[N@@H+](C)CC1	ZINC000897094824	708228515	/nfs/dbraw/zinc/22/85/15/708228515.db2.gz	XHFSOIQHLQJTTF-UHFFFAOYSA-N	1	1	313.789	1.327	20	5		DDBDMO
C[N@@H+](CCO)CCNc1cc(Br)ccc1[N+](=O)[O-]	ZINC000884824695	708388151	/nfs/dbraw/zinc/38/81/51/708388151.db2.gz	IKPUJXGTXCZUOG-UHFFFAOYSA-N	1	1	318.171	1.693	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N(C)CC[N@@H+](C)CCO	ZINC000912598582	713041864	/nfs/dbraw/zinc/04/18/64/713041864.db2.gz	HFUOJWITXWUHSM-UHFFFAOYSA-N	1	1	313.329	1.038	20	5		DDBDMO
C/C(=C\C(=O)N(C)CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])cc1	ZINC000912605267	713045288	/nfs/dbraw/zinc/04/52/88/713045288.db2.gz	LBKRBOFWQWUPJC-OUKQBFOZSA-N	1	1	321.377	1.381	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+](CCF)C1	ZINC000898494037	708657479	/nfs/dbraw/zinc/65/74/79/708657479.db2.gz	DICHUNDBUQJFSY-CYBMUJFWSA-N	1	1	309.341	1.687	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@@H+](CCF)C1	ZINC000898494037	708657482	/nfs/dbraw/zinc/65/74/82/708657482.db2.gz	DICHUNDBUQJFSY-CYBMUJFWSA-N	1	1	309.341	1.687	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[NH+]1CCC(Cn2cnnc2)CC1	ZINC000886267763	708732805	/nfs/dbraw/zinc/73/28/05/708732805.db2.gz	UUKJHKCBZYMOLC-UHFFFAOYSA-N	1	1	302.338	1.494	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CC2(CCOCC2)CC[C@H]1CO	ZINC000886297667	708738006	/nfs/dbraw/zinc/73/80/06/708738006.db2.gz	XDYGBMJOSWHDMD-AWEZNQCLSA-N	1	1	321.377	1.743	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1C[C@@H](O)CC2(CCOCC2)C1	ZINC000886319783	708741941	/nfs/dbraw/zinc/74/19/41/708741941.db2.gz	OYSOHBICXLZFGC-ZDUSSCGKSA-N	1	1	307.350	1.353	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1C[C@@H](O)CC2(CCOCC2)C1	ZINC000886319783	708741942	/nfs/dbraw/zinc/74/19/42/708741942.db2.gz	OYSOHBICXLZFGC-ZDUSSCGKSA-N	1	1	307.350	1.353	20	5		DDBDMO
O=c1c2c(ncn1CC[N+](=O)[O-])C[N@@H+](Cc1ccccc1)CC2	ZINC000899881780	709225268	/nfs/dbraw/zinc/22/52/68/709225268.db2.gz	QGMPLFBWWQKTGF-UHFFFAOYSA-N	1	1	314.345	1.078	20	5		DDBDMO
O=c1c2c(ncn1CC[N+](=O)[O-])C[N@H+](Cc1ccccc1)CC2	ZINC000899881780	709225270	/nfs/dbraw/zinc/22/52/70/709225270.db2.gz	QGMPLFBWWQKTGF-UHFFFAOYSA-N	1	1	314.345	1.078	20	5		DDBDMO
COc1c(O)ccc(CN2CC[N@@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000892056067	710362376	/nfs/dbraw/zinc/36/23/76/710362376.db2.gz	NPVQCJORULDFNV-UHFFFAOYSA-N	1	1	309.366	1.835	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000928448251	713201267	/nfs/dbraw/zinc/20/12/67/713201267.db2.gz	NDLDEHRKIAFMMD-PWSUYJOCSA-N	1	1	309.370	1.007	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000894077870	710954233	/nfs/dbraw/zinc/95/42/33/710954233.db2.gz	VZYWLAIJTGDCMP-TXEJJXNPSA-N	1	1	308.338	1.274	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000894082801	710957572	/nfs/dbraw/zinc/95/75/72/710957572.db2.gz	IJMZSSJXXBZCNA-TXEJJXNPSA-N	1	1	307.350	1.302	20	5		DDBDMO
[NH3+]CC1([C@@H]2CCCCN2CCn2cc([N+](=O)[O-])cn2)CCC1	ZINC000903813080	711288833	/nfs/dbraw/zinc/28/88/33/711288833.db2.gz	YOGVGNFOWXDUAV-AWEZNQCLSA-N	1	1	307.398	1.775	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](CCc3ccncc3)CC2)nc1	ZINC000894839978	711291950	/nfs/dbraw/zinc/29/19/50/711291950.db2.gz	MJAHUNMHIVWIOC-UHFFFAOYSA-N	1	1	314.349	1.145	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1[C@@H]2CC[C@H]1C[N@@H+](C)C2	ZINC000894879258	711306180	/nfs/dbraw/zinc/30/61/80/711306180.db2.gz	SVRWYPUVSOLQSB-OCAPTIKFSA-N	1	1	319.287	1.630	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1[C@@H]2CC[C@H]1C[N@H+](C)C2	ZINC000894879258	711306182	/nfs/dbraw/zinc/30/61/82/711306182.db2.gz	SVRWYPUVSOLQSB-OCAPTIKFSA-N	1	1	319.287	1.630	20	5		DDBDMO
Cc1[nH+]ccn1CCNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000895115542	711420092	/nfs/dbraw/zinc/42/00/92/711420092.db2.gz	OHIBENUHVCLOEV-UHFFFAOYSA-N	1	1	318.259	1.964	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)[C@@H](CO)C1	ZINC000913546379	713253045	/nfs/dbraw/zinc/25/30/45/713253045.db2.gz	OMRCSBCYJJPTKK-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)[C@@H](CO)C1	ZINC000913546379	713253047	/nfs/dbraw/zinc/25/30/47/713253047.db2.gz	OMRCSBCYJJPTKK-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12	ZINC000895570473	711545866	/nfs/dbraw/zinc/54/58/66/711545866.db2.gz	UMDURPGDSTZAHN-NEPJUHHUSA-N	1	1	324.406	1.990	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[N@H+]2CCSC[C@@H]12	ZINC000895570473	711545869	/nfs/dbraw/zinc/54/58/69/711545869.db2.gz	UMDURPGDSTZAHN-NEPJUHHUSA-N	1	1	324.406	1.990	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1Cn1nc(-c2ccccc2[N+](=O)[O-])oc1=O	ZINC000917605651	713506359	/nfs/dbraw/zinc/50/63/59/713506359.db2.gz	IDPRGSNBKIORPI-SNVBAGLBSA-N	1	1	304.306	1.506	20	5		DDBDMO
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])C1	ZINC000930032439	713739933	/nfs/dbraw/zinc/73/99/33/713739933.db2.gz	QMTPTTGFHXABAF-VXGBXAGGSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)[C@H](C)[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000930916135	713958217	/nfs/dbraw/zinc/95/82/17/713958217.db2.gz	NJSYFAHHVAZXLF-TYNCELHUSA-N	1	1	321.377	1.948	20	5		DDBDMO
C[C@H]1[C@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044511	713989641	/nfs/dbraw/zinc/98/96/41/713989641.db2.gz	NNODNCYMAIEMTG-SWLSCSKDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044511	713989642	/nfs/dbraw/zinc/98/96/42/713989642.db2.gz	NNODNCYMAIEMTG-SWLSCSKDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459849	714102814	/nfs/dbraw/zinc/10/28/14/714102814.db2.gz	BEZZIGKDRYGVHU-HZMBPMFUSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459849	714102816	/nfs/dbraw/zinc/10/28/16/714102816.db2.gz	BEZZIGKDRYGVHU-HZMBPMFUSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCn2cc[nH+]c21	ZINC000931525151	714119383	/nfs/dbraw/zinc/11/93/83/714119383.db2.gz	YCIZNKKFQLBXEI-JTQLQIEISA-N	1	1	301.306	1.639	20	5		DDBDMO
O=[N+]([O-])CC[NH2+][C@@]1(c2ccc(Br)cc2)C[C@@H](O)C1	ZINC000931683685	714159932	/nfs/dbraw/zinc/15/99/32/714159932.db2.gz	FEKKQVRWIABIQQ-TXEJJXNPSA-N	1	1	315.167	1.665	20	5		DDBDMO
O=C1N[C@H](C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)CO1	ZINC000932770794	714410126	/nfs/dbraw/zinc/41/01/26/714410126.db2.gz	RBZKDDOYIGFPHH-LBPRGKRZSA-N	1	1	306.322	1.310	20	5		DDBDMO
Cc1ccc(CNC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000923910120	714488247	/nfs/dbraw/zinc/48/82/47/714488247.db2.gz	JLDIKBRDZCQZHY-DGCLKSJQSA-N	1	1	306.366	1.795	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](C3CCOCC3)C2)n1	ZINC000933080067	714513329	/nfs/dbraw/zinc/51/33/29/714513329.db2.gz	TVUDACMCZPHONK-CQSZACIVSA-N	1	1	308.382	1.930	20	5		DDBDMO
CC(C)(CCc1noc([C@@H]2C[N@H+]3CCC[C@H]3CO2)n1)[N+](=O)[O-]	ZINC000924079309	714522069	/nfs/dbraw/zinc/52/20/69/714522069.db2.gz	UPRLWAYAHFVBOW-QWRGUYRKSA-N	1	1	310.354	1.593	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C1	ZINC000933779685	714669896	/nfs/dbraw/zinc/66/98/96/714669896.db2.gz	PRHLHTOMOUSNOY-ZDUSSCGKSA-N	1	1	323.397	1.290	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000934257582	714777175	/nfs/dbraw/zinc/77/71/75/714777175.db2.gz	AMTVHBOVCKWFIH-JKSUJKDBSA-N	1	1	323.368	1.765	20	5		DDBDMO
Nc1cc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)ncc1[N+](=O)[O-]	ZINC001164773635	721291321	/nfs/dbraw/zinc/29/13/21/721291321.db2.gz	SJWQWQQGKYPKDA-UHFFFAOYSA-N	1	1	303.366	1.494	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ncc1NCc1ccc(N)[nH+]c1C	ZINC001167787339	738553815	/nfs/dbraw/zinc/55/38/15/738553815.db2.gz	VWXUZOUAOVOQRJ-UHFFFAOYSA-N	1	1	317.305	1.674	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccnc(Cl)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063747	734368135	/nfs/dbraw/zinc/36/81/35/734368135.db2.gz	LCCRMVDPWWDFJC-WRWGMCAJSA-N	1	1	324.768	1.137	20	5		DDBDMO
CCC(CO)(CO)Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001167972684	740321446	/nfs/dbraw/zinc/32/14/46/740321446.db2.gz	WHERLUCDXUHWLN-UHFFFAOYSA-N	1	1	309.366	1.128	20	5		DDBDMO
CCC(CO)(CO)Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001167972684	740321447	/nfs/dbraw/zinc/32/14/47/740321447.db2.gz	WHERLUCDXUHWLN-UHFFFAOYSA-N	1	1	309.366	1.128	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)cc([N+](=O)[O-])c1C	ZINC001129186402	751564725	/nfs/dbraw/zinc/56/47/25/751564725.db2.gz	WNAXXCHLRWVNTJ-RISCZKNCSA-N	1	1	319.361	1.688	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2nn(C)cc2[N+](=O)[O-])CC1	ZINC001186881359	744458511	/nfs/dbraw/zinc/45/85/11/744458511.db2.gz	NZKVDOUEJNUZSI-NSHDSACASA-N	1	1	309.370	1.018	20	5		DDBDMO
CCOc1cc(C[N@@H+]2C[C@H](CCO)[C@H](CO)C2)ccc1[N+](=O)[O-]	ZINC001198755067	747599887	/nfs/dbraw/zinc/59/98/87/747599887.db2.gz	XGCAVCLQPDNHCO-KBPBESRZSA-N	1	1	324.377	1.416	20	5		DDBDMO
Cc1nc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1	ZINC000996439032	749573955	/nfs/dbraw/zinc/57/39/55/749573955.db2.gz	AOJRNNHZSISQPV-CHWSQXEVSA-N	1	1	324.406	1.197	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017585	762197714	/nfs/dbraw/zinc/19/77/14/762197714.db2.gz	AQTYZTMBLRVMQE-RDBSUJKOSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017585	762197717	/nfs/dbraw/zinc/19/77/17/762197717.db2.gz	AQTYZTMBLRVMQE-RDBSUJKOSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@]3(C)C[NH+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000823484734	758319035	/nfs/dbraw/zinc/31/90/35/758319035.db2.gz	SFZZBUBMNIXGRJ-HUUCEWRRSA-N	1	1	321.381	1.294	20	5		DDBDMO
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC000829037763	759863844	/nfs/dbraw/zinc/86/38/44/759863844.db2.gz	MIXZTHJYWZHKFB-HZMBPMFUSA-N	1	1	324.356	1.098	20	5		DDBDMO
Cc1cnc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC001086363446	761493231	/nfs/dbraw/zinc/49/32/31/761493231.db2.gz	VCLQPLJKFNVJIF-DDHJBXDOSA-N	1	1	324.406	1.101	20	5		DDBDMO
CC[N+](C)(C)Cc1ccccc1-n1[n-]c(=O)c(CC[NH3+])c1C	ZINC001170339030	766272989	/nfs/dbraw/zinc/27/29/89/766272989.db2.gz	DJZBJNGWGWASRD-UHFFFAOYSA-O	1	1	303.430	1.984	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCCN(C)C(=O)C2)c([N+](=O)[O-])c1	ZINC001170346449	766277300	/nfs/dbraw/zinc/27/73/00/766277300.db2.gz	NOIUMFORBYBZMH-LBPRGKRZSA-N	1	1	321.377	1.699	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCCN(C)C(=O)C2)c([N+](=O)[O-])c1	ZINC001170346449	766277304	/nfs/dbraw/zinc/27/73/04/766277304.db2.gz	NOIUMFORBYBZMH-LBPRGKRZSA-N	1	1	321.377	1.699	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCC(=O)N(C)CC2)c([N+](=O)[O-])c1	ZINC001170347576	766278098	/nfs/dbraw/zinc/27/80/98/766278098.db2.gz	RZWVFLNUKQKILS-GFCCVEGCSA-N	1	1	321.377	1.699	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)Oc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC001130849250	767764304	/nfs/dbraw/zinc/76/43/04/767764304.db2.gz	ACFAKFZLHQEGHY-UHFFFAOYSA-N	1	1	306.234	1.614	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001093952873	775260403	/nfs/dbraw/zinc/26/04/03/775260403.db2.gz	OXWPLZJAVZTEST-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](S(C)(=O)=O)C1	ZINC001173227205	777062205	/nfs/dbraw/zinc/06/22/05/777062205.db2.gz	OJTNPPXIAJJMPZ-BXUZGUMPSA-N	1	1	312.391	1.645	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](S(C)(=O)=O)C1	ZINC001173227205	777062209	/nfs/dbraw/zinc/06/22/09/777062209.db2.gz	OJTNPPXIAJJMPZ-BXUZGUMPSA-N	1	1	312.391	1.645	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(=O)N1CCOCC1	ZINC001173228941	777062618	/nfs/dbraw/zinc/06/26/18/777062618.db2.gz	OEOMBOWKGFHWOD-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC([N@@H+](C)[C@@H]2CCOC2)C1	ZINC001173235436	777064495	/nfs/dbraw/zinc/06/44/95/777064495.db2.gz	WYJLKJHLROVBGX-XJKSGUPXSA-N	1	1	319.405	1.931	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc(F)c1	ZINC001266560707	836470365	/nfs/dbraw/zinc/47/03/65/836470365.db2.gz	TYYOVWVAFOWARY-HUUCEWRRSA-N	1	1	323.368	1.819	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(F)c1	ZINC001266560707	836470373	/nfs/dbraw/zinc/47/03/73/836470373.db2.gz	TYYOVWVAFOWARY-HUUCEWRRSA-N	1	1	323.368	1.819	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(F)c1	ZINC001266560707	836470380	/nfs/dbraw/zinc/47/03/80/836470380.db2.gz	TYYOVWVAFOWARY-HUUCEWRRSA-N	1	1	323.368	1.819	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C(F)F	ZINC001268230587	839863104	/nfs/dbraw/zinc/86/31/04/839863104.db2.gz	ZOEYXMMAMKCDMN-UHFFFAOYSA-N	1	1	301.293	1.750	20	5		DDBDMO
COc1cnc(NCC2(N(C)C)CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC001156181484	862787367	/nfs/dbraw/zinc/78/73/67/862787367.db2.gz	CXISZOQVXIAKBR-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]2C1	ZINC001157691011	864050738	/nfs/dbraw/zinc/05/07/38/864050738.db2.gz	NJUMNMCTVBXSDF-PHIMTYICSA-N	1	1	321.337	1.676	20	5		DDBDMO
[NH3+]Cc1ncn(-c2cc3ccc(Cl)nc3cc2[N+](=O)[O-])n1	ZINC001157931776	864279026	/nfs/dbraw/zinc/27/90/26/864279026.db2.gz	ZCBUWMOUHOJLSG-UHFFFAOYSA-N	1	1	304.697	1.836	20	5		DDBDMO
Cc1ccc(NC(=O)[C@@H](C)C[NH+]2CCOCC2)c(N)c1[N+](=O)[O-]	ZINC001158232508	864505956	/nfs/dbraw/zinc/50/59/56/864505956.db2.gz	XHUZQQJAFFFPNI-NSHDSACASA-N	1	1	322.365	1.392	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(OC)nc(C)c2[N+](=O)[O-])C(C)(C)C1	ZINC001158562387	864728972	/nfs/dbraw/zinc/72/89/72/864728972.db2.gz	AOPAQXMHJDSPRL-UHFFFAOYSA-N	1	1	309.370	1.622	20	5		DDBDMO
COC(=O)C[C@H](C)Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001160534753	865919861	/nfs/dbraw/zinc/91/98/61/865919861.db2.gz	YKNYEFPCUBNUJP-PORFMDCZSA-N	1	1	308.338	1.886	20	5		DDBDMO
Nc1cc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160724729	866074313	/nfs/dbraw/zinc/07/43/13/866074313.db2.gz	MPNNEKLYBHRDQP-NEPJUHHUSA-N	1	1	307.354	1.237	20	5		DDBDMO
CCOc1nc(N2CCC(F)(F)[C@H]([NH3+])C2)ccc1[N+](=O)[O-]	ZINC001164323939	869129229	/nfs/dbraw/zinc/12/92/29/869129229.db2.gz	PLGJCPYLYUSQDO-SECBINFHSA-N	1	1	302.281	1.561	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])c(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)n1	ZINC001166032645	869809498	/nfs/dbraw/zinc/80/94/98/869809498.db2.gz	MGIRMJPTTVNRFZ-UHFFFAOYSA-N	1	1	320.353	1.328	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC001339266726	870429691	/nfs/dbraw/zinc/42/96/91/870429691.db2.gz	VXWKGQCZUCTSJX-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C(CO)CO)cs2)c1	ZINC001339511013	870533919	/nfs/dbraw/zinc/53/39/19/870533919.db2.gz	ZHROLTYVBDKRET-UHFFFAOYSA-N	1	1	309.347	1.161	20	5		DDBDMO
O=C1N[C@@H]2C[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@H]2CO1	ZINC001307906489	871459631	/nfs/dbraw/zinc/45/96/31/871459631.db2.gz	XVJIOYUVBHCPAF-YUTCNCBUSA-N	1	1	321.333	1.059	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]CCc2n[nH]c(C)n2)c1[N+](=O)[O-]	ZINC001205340703	871502606	/nfs/dbraw/zinc/50/26/06/871502606.db2.gz	HVYQKITVOWDKTM-UHFFFAOYSA-N	1	1	307.310	1.068	20	5		DDBDMO
C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCC1=CCCCC1	ZINC001316824328	872119898	/nfs/dbraw/zinc/11/98/98/872119898.db2.gz	XBUXAGFUXAXUHH-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CCC1=CCCCC1	ZINC001316824328	872119904	/nfs/dbraw/zinc/11/99/04/872119904.db2.gz	XBUXAGFUXAXUHH-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CCC1=CCCCC1	ZINC001316824328	872119909	/nfs/dbraw/zinc/11/99/09/872119909.db2.gz	XBUXAGFUXAXUHH-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
O=[N+]([O-])c1sc(C[NH2+][C@@H]2COC[C@@H]2O)cc1Br	ZINC001207067533	872975919	/nfs/dbraw/zinc/97/59/19/872975919.db2.gz	PYRZNMLQNHRIAI-SFYZADRCSA-N	1	1	323.168	1.268	20	5		DDBDMO
C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCN1C	ZINC001345719706	873488507	/nfs/dbraw/zinc/48/85/07/873488507.db2.gz	PHZLXQIRIZAJEB-BXUZGUMPSA-N	1	1	321.381	1.351	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c(N)c1F)[C@H]1C[N@@H+](C)CCN1C	ZINC001348311189	874476337	/nfs/dbraw/zinc/47/63/37/874476337.db2.gz	GOTGLUQOPDFAET-JOYOIKCWSA-N	1	1	311.361	1.362	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1[N+](=O)[O-]	ZINC001355171690	878452367	/nfs/dbraw/zinc/45/23/67/878452367.db2.gz	PIISSVFQHQWITE-RAIGVLPGSA-N	1	1	319.361	1.673	20	5		DDBDMO
C[N@H+]1CCC[C@@H](C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584224	879114182	/nfs/dbraw/zinc/11/41/82/879114182.db2.gz	NDXCLLYAJIYGRM-UONOGXRCSA-N	1	1	323.393	1.266	20	5		DDBDMO
CN1CCC[C@@H](C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584224	879114197	/nfs/dbraw/zinc/11/41/97/879114197.db2.gz	NDXCLLYAJIYGRM-UONOGXRCSA-N	1	1	323.393	1.266	20	5		DDBDMO
CC/C=C\CC[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001223114967	880837666	/nfs/dbraw/zinc/83/76/66/880837666.db2.gz	ZAJOYXORAKBQMW-LPUOJRKPSA-N	1	1	309.410	1.836	20	5		DDBDMO
COc1ccc(COCC[N@@H+]2CC[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC001223515020	880986933	/nfs/dbraw/zinc/98/69/33/880986933.db2.gz	CGUQSKOEGZKNJA-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[N@@H+]1CCC[C@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001228602605	883569173	/nfs/dbraw/zinc/56/91/73/883569173.db2.gz	CTZMOUBNRQHSCX-JTQLQIEISA-N	1	1	308.338	1.831	20	5		DDBDMO
C[N@H+]1CCC[C@H](Oc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001228602605	883569186	/nfs/dbraw/zinc/56/91/86/883569186.db2.gz	CTZMOUBNRQHSCX-JTQLQIEISA-N	1	1	308.338	1.831	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CCC[N@H+](C)C2)cc1O	ZINC001228812489	883685214	/nfs/dbraw/zinc/68/52/14/883685214.db2.gz	WRPNASMTPGDRAU-VIFPVBQESA-N	1	1	310.306	1.560	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CCC[N@@H+](C)C2)cc1O	ZINC001228812489	883685217	/nfs/dbraw/zinc/68/52/17/883685217.db2.gz	WRPNASMTPGDRAU-VIFPVBQESA-N	1	1	310.306	1.560	20	5		DDBDMO
C[N@H+](CCCNC(=O)c1cn[nH]c1)Cc1csc([N+](=O)[O-])c1	ZINC001234382749	887924391	/nfs/dbraw/zinc/92/43/91/887924391.db2.gz	ZYWSCGAPRWUVHN-UHFFFAOYSA-N	1	1	323.378	1.631	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cn[nH]c1)Cc1csc([N+](=O)[O-])c1	ZINC001234382749	887924400	/nfs/dbraw/zinc/92/44/00/887924400.db2.gz	ZYWSCGAPRWUVHN-UHFFFAOYSA-N	1	1	323.378	1.631	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCNC2(CC[NH2+]CC2)C1	ZINC001246594612	892718444	/nfs/dbraw/zinc/71/84/44/892718444.db2.gz	KFIOQPSMWNEITA-AWEZNQCLSA-N	1	1	318.421	1.553	20	5		DDBDMO
CN(C)C(=O)C[N@@H+](C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478461	896456424	/nfs/dbraw/zinc/45/64/24/896456424.db2.gz	DZWVOSJIQQPZSD-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
CN(C)C1C[NH+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC001254475718	896456829	/nfs/dbraw/zinc/45/68/29/896456829.db2.gz	ILYMBNICETVOSE-UHFFFAOYSA-N	1	1	304.394	1.809	20	5		DDBDMO
CCN(CC)CCNC(=[NH2+])N[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254590336	896522543	/nfs/dbraw/zinc/52/25/43/896522543.db2.gz	VNXSGGIQSWCUNX-CQSZACIVSA-N	1	1	319.409	1.518	20	5		DDBDMO
C[C@H]1[C@H](O)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457351	231101825	/nfs/dbraw/zinc/10/18/25/231101825.db2.gz	MGWQVHCBVYCNJO-GXFFZTMASA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H]1[C@H](O)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457351	231101829	/nfs/dbraw/zinc/10/18/29/231101829.db2.gz	MGWQVHCBVYCNJO-GXFFZTMASA-N	1	1	318.333	1.990	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000083171493	185215977	/nfs/dbraw/zinc/21/59/77/185215977.db2.gz	RPTCWWAGXLJOFU-JTQLQIEISA-N	1	1	318.333	1.694	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000083171493	185215978	/nfs/dbraw/zinc/21/59/78/185215978.db2.gz	RPTCWWAGXLJOFU-JTQLQIEISA-N	1	1	318.333	1.694	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CCCO)c1ccccc1[N+](=O)[O-]	ZINC000452347341	231356043	/nfs/dbraw/zinc/35/60/43/231356043.db2.gz	IJRNFIFWSIMFQX-GFCCVEGCSA-N	1	1	307.350	1.171	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000615494263	362306408	/nfs/dbraw/zinc/30/64/08/362306408.db2.gz	KKPFVOVWNJLZPM-NSHDSACASA-N	1	1	318.377	1.627	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000615494263	362306414	/nfs/dbraw/zinc/30/64/14/362306414.db2.gz	KKPFVOVWNJLZPM-NSHDSACASA-N	1	1	318.377	1.627	20	5		DDBDMO
Cn1cncc1CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000459494904	233246515	/nfs/dbraw/zinc/24/65/15/233246515.db2.gz	CPPDXMURUDLUOU-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
Cn1cncc1CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000459494904	233246518	/nfs/dbraw/zinc/24/65/18/233246518.db2.gz	CPPDXMURUDLUOU-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
Cn1c[nH+]cc1CCN1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000459494904	233246520	/nfs/dbraw/zinc/24/65/20/233246520.db2.gz	CPPDXMURUDLUOU-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000155768361	186111171	/nfs/dbraw/zinc/11/11/71/186111171.db2.gz	KCTHFDRRDGIYLI-VXGBXAGGSA-N	1	1	321.381	1.193	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000191861933	186265955	/nfs/dbraw/zinc/26/59/55/186265955.db2.gz	OJFRGCZHTJFZLT-CQDKDKBSSA-N	1	1	322.361	1.759	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000042310029	352333598	/nfs/dbraw/zinc/33/35/98/352333598.db2.gz	ITJQBGPHMNDZQD-UHFFFAOYSA-N	1	1	310.354	1.685	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@H]([NH+]3CC=CC3)C2)cc1	ZINC000173524144	198224040	/nfs/dbraw/zinc/22/40/40/198224040.db2.gz	BULXVFVRKWFWRH-ZDUSSCGKSA-N	1	1	323.374	1.230	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000174640991	198363504	/nfs/dbraw/zinc/36/35/04/198363504.db2.gz	VSIJKAZEWZWZIM-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000174652763	198365210	/nfs/dbraw/zinc/36/52/10/198365210.db2.gz	YAOKINDJNBLLEI-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000076269950	353410533	/nfs/dbraw/zinc/41/05/33/353410533.db2.gz	HTWMMQAEQGMHMV-JTQLQIEISA-N	1	1	308.386	1.889	20	5		DDBDMO
COC[C@](C)(CC(=O)OC)[NH2+]Cc1c(F)cccc1[N+](=O)[O-]	ZINC000078662019	353527206	/nfs/dbraw/zinc/52/72/06/353527206.db2.gz	XYSVISAGKFEPFA-AWEZNQCLSA-N	1	1	314.313	1.792	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000141334075	354139764	/nfs/dbraw/zinc/13/97/64/354139764.db2.gz	QPGTWFYDGVCWEJ-CYBMUJFWSA-N	1	1	318.377	1.703	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000357228404	291022149	/nfs/dbraw/zinc/02/21/49/291022149.db2.gz	XFPYEENAMHGNRT-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@@H](CO)CC1	ZINC000293056331	354453120	/nfs/dbraw/zinc/45/31/20/354453120.db2.gz	IFHQJXOLRKTUPR-ZIAGYGMSSA-N	1	1	324.377	1.429	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CO)(OC)CC1	ZINC000401764576	354667225	/nfs/dbraw/zinc/66/72/25/354667225.db2.gz	XOGPCVDLECFUCM-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(C)(O)CC2)c1	ZINC000589502524	354996666	/nfs/dbraw/zinc/99/66/66/354996666.db2.gz	ZNEOVBFESQAKJD-UHFFFAOYSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@](C)(C(N)=O)C2)c1	ZINC000589515641	354998869	/nfs/dbraw/zinc/99/88/69/354998869.db2.gz	VSPOUUDQKKFIQC-HNNXBMFYSA-N	1	1	321.333	1.079	20	5		DDBDMO
COc1ccc(OCCN2CC[C@@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC000590010309	355039128	/nfs/dbraw/zinc/03/91/28/355039128.db2.gz	AUZNHXZRCRARHM-IUODEOHRSA-N	1	1	321.377	1.618	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590011104	355040614	/nfs/dbraw/zinc/04/06/14/355040614.db2.gz	HUKWCDIBACTPPT-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@@H]2CC[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590011104	355040618	/nfs/dbraw/zinc/04/06/18/355040618.db2.gz	HUKWCDIBACTPPT-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590011104	355040620	/nfs/dbraw/zinc/04/06/20/355040620.db2.gz	HUKWCDIBACTPPT-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000590443743	355097236	/nfs/dbraw/zinc/09/72/36/355097236.db2.gz	GYHRDEWGBRZYHY-GXFFZTMASA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CSc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590446349	355099212	/nfs/dbraw/zinc/09/92/12/355099212.db2.gz	UTPAZNMRFOSNOL-BXUZGUMPSA-N	1	1	321.402	1.849	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21	ZINC000590446506	355099579	/nfs/dbraw/zinc/09/95/79/355099579.db2.gz	VZFCVKRQXNRXCN-ZWNOBZJWSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000591510739	355322829	/nfs/dbraw/zinc/32/28/29/355322829.db2.gz	GADNKSURVSCSTA-DOMZBBRYSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000591510739	355322832	/nfs/dbraw/zinc/32/28/32/355322832.db2.gz	GADNKSURVSCSTA-DOMZBBRYSA-N	1	1	321.377	1.661	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000592205586	355536703	/nfs/dbraw/zinc/53/67/03/355536703.db2.gz	DBOWGBVAMPIWTL-SUHUHFCYSA-N	1	1	308.334	1.512	20	5		DDBDMO
CCCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@@H]1CC[N@@H+](C)C1	ZINC000592831709	355707235	/nfs/dbraw/zinc/70/72/35/355707235.db2.gz	NVTPHJANTDJFSQ-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCCN(C(=O)c1c([N+](=O)[O-])c(C)nn1C)[C@@H]1CC[N@@H+](C)C1	ZINC000592833286	355707852	/nfs/dbraw/zinc/70/78/52/355707852.db2.gz	YDOAFEHLTXJVQI-LLVKDONJSA-N	1	1	309.370	1.193	20	5		DDBDMO
Cc1c(C[NH+]2CCN(c3nncn3C)CC2)cccc1[N+](=O)[O-]	ZINC000594023365	356092142	/nfs/dbraw/zinc/09/21/42/356092142.db2.gz	RCZDTIOGUHWJBZ-UHFFFAOYSA-N	1	1	316.365	1.354	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000594063571	356103368	/nfs/dbraw/zinc/10/33/68/356103368.db2.gz	IGXQALUFLNGGLL-YPMHNXCESA-N	1	1	310.350	1.180	20	5		DDBDMO
[NH3+]C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(F)(F)F	ZINC000594451007	356221959	/nfs/dbraw/zinc/22/19/59/356221959.db2.gz	BADXGXNJNRDOAT-QMMMGPOBSA-N	1	1	317.227	1.091	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC1(C)C	ZINC000594356921	356181861	/nfs/dbraw/zinc/18/18/61/356181861.db2.gz	XWTLIYXDRDXVDU-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000595455199	356499305	/nfs/dbraw/zinc/49/93/05/356499305.db2.gz	SZGRDZWJLBSSLX-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
Cc1noc(CN2CC[N@H+](CC(C)(C)O)C[C@H]2C)c1[N+](=O)[O-]	ZINC000595470672	356506215	/nfs/dbraw/zinc/50/62/15/356506215.db2.gz	OOLHOPPVYITOGS-SNVBAGLBSA-N	1	1	312.370	1.168	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000595744990	356631943	/nfs/dbraw/zinc/63/19/43/356631943.db2.gz	XPLWGVKCKBYEPX-ZFWWWQNUSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595755405	356636925	/nfs/dbraw/zinc/63/69/25/356636925.db2.gz	ADXYPANMRDXJOW-HSMVNMDESA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595755460	356637079	/nfs/dbraw/zinc/63/70/79/356637079.db2.gz	ARLLWCNSJQONHQ-HSMVNMDESA-N	1	1	319.361	1.890	20	5		DDBDMO
COc1ccc2c(c1)CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000595758784	356640687	/nfs/dbraw/zinc/64/06/87/356640687.db2.gz	GFBHKFWVFRKAAW-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000595758784	356640691	/nfs/dbraw/zinc/64/06/91/356640691.db2.gz	GFBHKFWVFRKAAW-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595835873	356671449	/nfs/dbraw/zinc/67/14/49/356671449.db2.gz	WKBHXUJLEKVTOH-UPJWGTAASA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595835873	356671451	/nfs/dbraw/zinc/67/14/51/356671451.db2.gz	WKBHXUJLEKVTOH-UPJWGTAASA-N	1	1	319.361	1.890	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000595862324	356682232	/nfs/dbraw/zinc/68/22/32/356682232.db2.gz	ABRWVQKIENSLEF-OAHLLOKOSA-N	1	1	305.378	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595870478	356685838	/nfs/dbraw/zinc/68/58/38/356685838.db2.gz	GOPXMXZZUOLHPO-BLLLJJGKSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595870478	356685843	/nfs/dbraw/zinc/68/58/43/356685843.db2.gz	GOPXMXZZUOLHPO-BLLLJJGKSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[N@@H+](CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1)C1CCCC1	ZINC000596113677	356776459	/nfs/dbraw/zinc/77/64/59/356776459.db2.gz	WITGCBJVNDQDOS-UHFFFAOYSA-N	1	1	306.366	1.980	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C1(CO)CCC1	ZINC000597255915	357111427	/nfs/dbraw/zinc/11/14/27/357111427.db2.gz	QHHMIAYMHFGGSR-UHFFFAOYSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[NH+]1CCC2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)CC1	ZINC000597667066	357275758	/nfs/dbraw/zinc/27/57/58/357275758.db2.gz	PJKXIABWZDDMGF-UHFFFAOYSA-N	1	1	319.361	1.858	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597854986	357358723	/nfs/dbraw/zinc/35/87/23/357358723.db2.gz	OKXKFGMGCKTLCM-LBPRGKRZSA-N	1	1	323.397	1.336	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])cnc1C)[C@H]1CC[N@@H+](CC)C1	ZINC000598041304	357439456	/nfs/dbraw/zinc/43/94/56/357439456.db2.gz	KXPMKQFSDROYJG-LBPRGKRZSA-N	1	1	306.366	1.855	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@H](C)[NH2+]1	ZINC000598536783	357624874	/nfs/dbraw/zinc/62/48/74/357624874.db2.gz	WUTRGHKMUDAZFS-VHSXEESVSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598651507	357671892	/nfs/dbraw/zinc/67/18/92/357671892.db2.gz	UPHUJDLSXVWQQV-VXGBXAGGSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000598651507	357671893	/nfs/dbraw/zinc/67/18/93/357671893.db2.gz	UPHUJDLSXVWQQV-VXGBXAGGSA-N	1	1	307.350	1.484	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@@H+]2CC[C@H](O)C2)ccc2ncccc21	ZINC000599200089	357847843	/nfs/dbraw/zinc/84/78/43/357847843.db2.gz	WGSDGHSEHAUOEJ-NSHDSACASA-N	1	1	302.334	1.622	20	5		DDBDMO
COC(=O)c1ccc(C[N@H+](C)CCn2ccc([N+](=O)[O-])n2)nc1	ZINC000599443442	357939342	/nfs/dbraw/zinc/93/93/42/357939342.db2.gz	OHMBEDCIORXHGH-UHFFFAOYSA-N	1	1	319.321	1.105	20	5		DDBDMO
COC(=O)c1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)nc1	ZINC000599443442	357939346	/nfs/dbraw/zinc/93/93/46/357939346.db2.gz	OHMBEDCIORXHGH-UHFFFAOYSA-N	1	1	319.321	1.105	20	5		DDBDMO
NC(=O)[C@@H]1CN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC[NH2+]1	ZINC000274563508	283327616	/nfs/dbraw/zinc/32/76/16/283327616.db2.gz	BSVUJJSGNQSMQH-VIFPVBQESA-N	1	1	319.148	1.165	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000599937113	358085367	/nfs/dbraw/zinc/08/53/67/358085367.db2.gz	DTRFOQPGDIQBCH-GXTWGEPZSA-N	1	1	323.324	1.015	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)n1	ZINC000600470444	358233345	/nfs/dbraw/zinc/23/33/45/358233345.db2.gz	OLHOWSIOBMQLBC-GFCCVEGCSA-N	1	1	321.381	1.558	20	5		DDBDMO
CC(C)(C(=O)NCC[N@H+]1CC[C@H](O)C1)c1ccccc1[N+](=O)[O-]	ZINC000600808061	358320087	/nfs/dbraw/zinc/32/00/87/358320087.db2.gz	HGSVJSABEVBWLB-LBPRGKRZSA-N	1	1	321.377	1.055	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000600808832	358320854	/nfs/dbraw/zinc/32/08/54/358320854.db2.gz	SNTFYKWADJIZEK-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000600961041	358358112	/nfs/dbraw/zinc/35/81/12/358358112.db2.gz	KNTAYIQEUZCXLB-GXTWGEPZSA-N	1	1	320.393	1.853	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)c1ncc(F)cc1[N+](=O)[O-]	ZINC000601116395	358408914	/nfs/dbraw/zinc/40/89/14/358408914.db2.gz	SRTNPSPZUYDANU-UHFFFAOYSA-N	1	1	311.361	1.203	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccnc2ccc([N+](=O)[O-])cc21	ZINC000601104428	358403733	/nfs/dbraw/zinc/40/37/33/358403733.db2.gz	WWDZEUPYCPSULY-UHFFFAOYSA-N	1	1	318.377	1.945	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](O)[C@@H]3CCCO3)c2c1	ZINC000601201015	358445198	/nfs/dbraw/zinc/44/51/98/358445198.db2.gz	JVICIHBNMZFSBM-CABCVRRESA-N	1	1	303.318	1.517	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](O)[C@@H](CO)C3)c2c1	ZINC000601175511	358433978	/nfs/dbraw/zinc/43/39/78/358433978.db2.gz	ICHDYARWBKHATG-BMIGLBTASA-N	1	1	303.318	1.323	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181066825	199247873	/nfs/dbraw/zinc/24/78/73/199247873.db2.gz	VQYLMASHKWVQSF-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2COC[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000601973316	358760067	/nfs/dbraw/zinc/76/00/67/358760067.db2.gz	JXZYDIMZPRFWOS-BETUJISGSA-N	1	1	317.345	1.062	20	5		DDBDMO
Cn1cc(C[N@H+](C)[C@H](CCO)c2ccccc2)c([N+](=O)[O-])n1	ZINC000602469223	358999618	/nfs/dbraw/zinc/99/96/18/358999618.db2.gz	CCAIRXUVDGXJEG-CQSZACIVSA-N	1	1	304.350	1.884	20	5		DDBDMO
Cn1cc(C[N@@H+](C)[C@H](CCO)c2ccccc2)c([N+](=O)[O-])n1	ZINC000602469223	358999621	/nfs/dbraw/zinc/99/96/21/358999621.db2.gz	CCAIRXUVDGXJEG-CQSZACIVSA-N	1	1	304.350	1.884	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681232	359122367	/nfs/dbraw/zinc/12/23/67/359122367.db2.gz	MWKSYFYJSHXJTO-CBAPKCEASA-N	1	1	308.260	1.073	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)c([N+](=O)[O-])n1	ZINC000602681232	359122369	/nfs/dbraw/zinc/12/23/69/359122369.db2.gz	MWKSYFYJSHXJTO-CBAPKCEASA-N	1	1	308.260	1.073	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@@H](N3CCCC3=O)CC2)c([N+](=O)[O-])n1	ZINC000602693556	359129336	/nfs/dbraw/zinc/12/93/36/359129336.db2.gz	NSTRNYKTRWDNCQ-CYBMUJFWSA-N	1	1	321.381	1.305	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](N3CCCC3=O)CC2)c([N+](=O)[O-])n1	ZINC000602693556	359129341	/nfs/dbraw/zinc/12/93/41/359129341.db2.gz	NSTRNYKTRWDNCQ-CYBMUJFWSA-N	1	1	321.381	1.305	20	5		DDBDMO
Cn1cc(C[N@@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839134	359228411	/nfs/dbraw/zinc/22/84/11/359228411.db2.gz	HIYUBLTVPDNQLB-ZIAGYGMSSA-N	1	1	302.334	1.636	20	5		DDBDMO
Cn1cc(C[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839134	359228417	/nfs/dbraw/zinc/22/84/17/359228417.db2.gz	HIYUBLTVPDNQLB-ZIAGYGMSSA-N	1	1	302.334	1.636	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](OC(F)F)C1	ZINC000602809093	359205523	/nfs/dbraw/zinc/20/55/23/359205523.db2.gz	YQXRPXUYBIQSKX-SNVBAGLBSA-N	1	1	304.297	1.803	20	5		DDBDMO
CCCN(C(=O)Nc1c(C)cncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000602961592	359325230	/nfs/dbraw/zinc/32/52/30/359325230.db2.gz	WJTKGAHDVBRHJL-GFCCVEGCSA-N	1	1	321.381	1.668	20	5		DDBDMO
C[C@@](CO)([NH2+]C[C@@H](O)C(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000602963660	359326352	/nfs/dbraw/zinc/32/63/52/359326352.db2.gz	YDAQMWLWCHBAMW-MNOVXSKESA-N	1	1	308.256	1.315	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C	ZINC000603143286	359432613	/nfs/dbraw/zinc/43/26/13/359432613.db2.gz	SFFPBBSFUOOGHG-GFCCVEGCSA-N	1	1	322.365	1.498	20	5		DDBDMO
CC1(C)[C@H](Nc2ccc([N+](=O)[O-])cn2)C[C@H]1[NH+]1CCOCC1	ZINC000603397051	359614802	/nfs/dbraw/zinc/61/48/02/359614802.db2.gz	JLXYIIWSUFYJGA-CHWSQXEVSA-N	1	1	306.366	1.901	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000186944729	200035439	/nfs/dbraw/zinc/03/54/39/200035439.db2.gz	OCWBEPSFWGQKRI-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](O)[C@H](C)C1	ZINC000186858850	200023630	/nfs/dbraw/zinc/02/36/30/200023630.db2.gz	XQEUANFUPUBRKP-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000186977500	200041973	/nfs/dbraw/zinc/04/19/73/200041973.db2.gz	OITRLJNFMXHMCS-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000186977500	200041976	/nfs/dbraw/zinc/04/19/76/200041976.db2.gz	OITRLJNFMXHMCS-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1CCC(C)(CO)CC1	ZINC000186947643	200036972	/nfs/dbraw/zinc/03/69/72/200036972.db2.gz	XEWQADNCSJBFMD-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604267969	359730944	/nfs/dbraw/zinc/73/09/44/359730944.db2.gz	KCYGONHABKWOPT-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccncc3[N+](=O)[O-])CC2)C1	ZINC000609675108	360344284	/nfs/dbraw/zinc/34/42/84/360344284.db2.gz	VWRQGXQVULHGDU-ZDUSSCGKSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000610899190	360566634	/nfs/dbraw/zinc/56/66/34/360566634.db2.gz	DTBTYTVAZKCQIQ-MFKMUULPSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000610899190	360566637	/nfs/dbraw/zinc/56/66/37/360566637.db2.gz	DTBTYTVAZKCQIQ-MFKMUULPSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@H+](C)CCO1	ZINC000611712050	360802307	/nfs/dbraw/zinc/80/23/07/360802307.db2.gz	UXOZEQZGEUHUMC-IINYFYTJSA-N	1	1	317.349	1.669	20	5		DDBDMO
C[C@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@@H+](C)CCO1	ZINC000611712050	360802310	/nfs/dbraw/zinc/80/23/10/360802310.db2.gz	UXOZEQZGEUHUMC-IINYFYTJSA-N	1	1	317.349	1.669	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000612030667	360895425	/nfs/dbraw/zinc/89/54/25/360895425.db2.gz	WIWJMUGNOLWRJS-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000579438172	422765251	/nfs/dbraw/zinc/76/52/51/422765251.db2.gz	QJAQCVWIDSHYLH-YPMHNXCESA-N	1	1	305.334	1.136	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619251943	363945101	/nfs/dbraw/zinc/94/51/01/363945101.db2.gz	CBQXYTQMULKXNZ-UONOGXRCSA-N	1	1	307.325	1.853	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000619789700	364151642	/nfs/dbraw/zinc/15/16/42/364151642.db2.gz	OICQXMJEBNBNDX-GFCCVEGCSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000619789700	364151647	/nfs/dbraw/zinc/15/16/47/364151647.db2.gz	OICQXMJEBNBNDX-GFCCVEGCSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000566115249	304119968	/nfs/dbraw/zinc/11/99/68/304119968.db2.gz	IHSSANDHDBUBME-RDBSUJKOSA-N	1	1	323.393	1.407	20	5		DDBDMO
C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1cn[nH]c1	ZINC000275137174	212142865	/nfs/dbraw/zinc/14/28/65/212142865.db2.gz	CTVRAGFRSXRFET-SNVBAGLBSA-N	1	1	324.362	1.442	20	5		DDBDMO
Cn1nccc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534636	193266174	/nfs/dbraw/zinc/26/61/74/193266174.db2.gz	JSQHMWIUQHYHNI-NSHDSACASA-N	1	1	302.338	1.410	20	5		DDBDMO
Cn1nccc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534636	193266176	/nfs/dbraw/zinc/26/61/76/193266176.db2.gz	JSQHMWIUQHYHNI-NSHDSACASA-N	1	1	302.338	1.410	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000350596974	284218993	/nfs/dbraw/zinc/21/89/93/284218993.db2.gz	IQFYDPRLXVCDFB-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
C[N@@H+](CCCn1ccnc1)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271684223	209124862	/nfs/dbraw/zinc/12/48/62/209124862.db2.gz	KLFMPZWVTAARAW-HNNXBMFYSA-N	1	1	304.350	1.847	20	5		DDBDMO
C[C@H]1C[NH+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C[C@@H]1C	ZINC000267798276	206288964	/nfs/dbraw/zinc/28/89/64/206288964.db2.gz	KNGGUMPOSJYHHJ-UWVGGRQHSA-N	1	1	321.333	1.850	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](C)O)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340792997	251215037	/nfs/dbraw/zinc/21/50/37/251215037.db2.gz	RSKKZYYRHIROAK-JSGCOSHPSA-N	1	1	312.366	1.426	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000288638563	220312876	/nfs/dbraw/zinc/31/28/76/220312876.db2.gz	YYAVODDCDWFQCP-UHFFFAOYSA-N	1	1	308.338	1.591	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@H]1C1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000414791101	224395189	/nfs/dbraw/zinc/39/51/89/224395189.db2.gz	QGUUDLLZKSNXOM-ZBFHGGJFSA-N	1	1	305.378	1.923	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330923163	533604530	/nfs/dbraw/zinc/60/45/30/533604530.db2.gz	SGBLICMNESKOFL-OLZOCXBDSA-N	1	1	320.393	1.630	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c1C	ZINC000124196868	292291688	/nfs/dbraw/zinc/29/16/88/292291688.db2.gz	RDQNHGODAFJOGK-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)cc1[N+](=O)[O-]	ZINC000070076666	406808889	/nfs/dbraw/zinc/80/88/89/406808889.db2.gz	BSMWHTIWZHNMHJ-GHMZBOCLSA-N	1	1	313.379	1.274	20	5		DDBDMO
O=C1NCCCC[C@H]1[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000010987082	406825799	/nfs/dbraw/zinc/82/57/99/406825799.db2.gz	SZAQAKAWNKSOER-OAHLLOKOSA-N	1	1	318.377	1.386	20	5		DDBDMO
CC(C)[C@H](CNc1ccc([N+](=O)[O-])cn1)N1CC[NH+](C)CC1	ZINC000045851958	407050811	/nfs/dbraw/zinc/05/08/11/407050811.db2.gz	HWRDMZWKDAJWOC-AWEZNQCLSA-N	1	1	307.398	1.674	20	5		DDBDMO
CC[N@@H+](C)CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000049320564	407118161	/nfs/dbraw/zinc/11/81/61/407118161.db2.gz	YMNQUBPXKFJLTO-UHFFFAOYSA-N	1	1	301.368	1.362	20	5		DDBDMO
CC(C)[C@@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000066498403	407252480	/nfs/dbraw/zinc/25/24/80/407252480.db2.gz	ABKXUSBYBPXQNZ-OAHLLOKOSA-N	1	1	321.377	1.820	20	5		DDBDMO
CC(C)[C@@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000066498403	407252482	/nfs/dbraw/zinc/25/24/82/407252482.db2.gz	ABKXUSBYBPXQNZ-OAHLLOKOSA-N	1	1	321.377	1.820	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000067709385	407281425	/nfs/dbraw/zinc/28/14/25/407281425.db2.gz	MQWUQHRQYJEQOQ-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCCC[N@@H+](CCOC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000109333711	407397686	/nfs/dbraw/zinc/39/76/86/407397686.db2.gz	WLHDNGVUFSCAID-UHFFFAOYSA-N	1	1	309.366	1.942	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185766193	407496631	/nfs/dbraw/zinc/49/66/31/407496631.db2.gz	DSLONXRDFORPEW-NSHDSACASA-N	1	1	315.395	1.603	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000112991254	407455244	/nfs/dbraw/zinc/45/52/44/407455244.db2.gz	RXRDTFGXKQPDQQ-ZFWWWQNUSA-N	1	1	324.377	1.693	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000178759876	407589689	/nfs/dbraw/zinc/58/96/89/407589689.db2.gz	HBZNDXINLIZGQR-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000185934628	407544418	/nfs/dbraw/zinc/54/44/18/407544418.db2.gz	XCIVVWYZUYQLOZ-OAHLLOKOSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000185934628	407544423	/nfs/dbraw/zinc/54/44/23/407544423.db2.gz	XCIVVWYZUYQLOZ-OAHLLOKOSA-N	1	1	307.350	1.704	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(C)C	ZINC000178952358	407671741	/nfs/dbraw/zinc/67/17/41/407671741.db2.gz	AKZPZNLWFLYAIN-ZDUSSCGKSA-N	1	1	323.349	1.322	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000171402371	407679588	/nfs/dbraw/zinc/67/95/88/407679588.db2.gz	GPXQTIALDHCBTF-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000171402371	407679595	/nfs/dbraw/zinc/67/95/95/407679595.db2.gz	GPXQTIALDHCBTF-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1	ZINC000272528858	407965371	/nfs/dbraw/zinc/96/53/71/407965371.db2.gz	MHBZSHWHVNRPJA-QMMMGPOBSA-N	1	1	321.362	1.281	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NC[C@@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000118494665	407920661	/nfs/dbraw/zinc/92/06/61/407920661.db2.gz	WUBQLYLMQQJZNM-JTQLQIEISA-N	1	1	322.321	1.493	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1C[N@@H+](C2CC2)C[C@@H]1C	ZINC000268278939	407982211	/nfs/dbraw/zinc/98/22/11/407982211.db2.gz	WUSBWOKCUIEELZ-GXFFZTMASA-N	1	1	321.381	1.089	20	5		DDBDMO
Cc1nc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000268439319	408045130	/nfs/dbraw/zinc/04/51/30/408045130.db2.gz	CRWVLEBJWQRRHS-HNNXBMFYSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[N@H+](CCc1ccncc1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000181447443	407998950	/nfs/dbraw/zinc/99/89/50/407998950.db2.gz	ZFTOWXABQFGYJE-UHFFFAOYSA-N	1	1	302.334	1.326	20	5		DDBDMO
C[N@H+]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000273098091	408056310	/nfs/dbraw/zinc/05/63/10/408056310.db2.gz	DQGGPJRCOLHZJQ-ZDUSSCGKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000273098091	408056320	/nfs/dbraw/zinc/05/63/20/408056320.db2.gz	DQGGPJRCOLHZJQ-ZDUSSCGKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000273098091	408056327	/nfs/dbraw/zinc/05/63/27/408056327.db2.gz	DQGGPJRCOLHZJQ-ZDUSSCGKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OCCO)C1	ZINC000175236208	408083832	/nfs/dbraw/zinc/08/38/32/408083832.db2.gz	OQIPSRYHPSMBEQ-OAHLLOKOSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](OCCO)C1	ZINC000175236208	408083839	/nfs/dbraw/zinc/08/38/39/408083839.db2.gz	OQIPSRYHPSMBEQ-OAHLLOKOSA-N	1	1	324.377	1.967	20	5		DDBDMO
COCCOCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000175683175	408183800	/nfs/dbraw/zinc/18/38/00/408183800.db2.gz	NKZZTASGMZORGP-LBPRGKRZSA-N	1	1	310.354	1.139	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ncccc1[N+](=O)[O-]	ZINC000263753846	408240515	/nfs/dbraw/zinc/24/05/15/408240515.db2.gz	TUDJXGSXHTVBLE-CYBMUJFWSA-N	1	1	321.381	1.344	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246280421	408204945	/nfs/dbraw/zinc/20/49/45/408204945.db2.gz	NLYGOXXKLVNOLB-HIFRSBDPSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H]1C[NH3+]	ZINC000156654625	408270800	/nfs/dbraw/zinc/27/08/00/408270800.db2.gz	FIMBZDGVSAXHPG-TVQRCGJNSA-N	1	1	317.349	1.671	20	5		DDBDMO
CSCC[N@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000138252697	162129425	/nfs/dbraw/zinc/12/94/25/162129425.db2.gz	IHEMWLOQXHNZIT-CYBMUJFWSA-N	1	1	309.391	1.995	20	5		DDBDMO
CSCC[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000138252697	162129427	/nfs/dbraw/zinc/12/94/27/162129427.db2.gz	IHEMWLOQXHNZIT-CYBMUJFWSA-N	1	1	309.391	1.995	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247157023	408417313	/nfs/dbraw/zinc/41/73/13/408417313.db2.gz	IUEVFRFEEPCCHE-GXTWGEPZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247157023	408417320	/nfs/dbraw/zinc/41/73/20/408417320.db2.gz	IUEVFRFEEPCCHE-GXTWGEPZSA-N	1	1	310.350	1.445	20	5		DDBDMO
COCC1(O)CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000270340325	408492750	/nfs/dbraw/zinc/49/27/50/408492750.db2.gz	DTEHKPJUAOGBGO-UHFFFAOYSA-N	1	1	321.333	1.709	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000177130306	408528345	/nfs/dbraw/zinc/52/83/45/408528345.db2.gz	DECHSJVQDGHIHW-JQWIXIFHSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176866506	408462085	/nfs/dbraw/zinc/46/20/85/408462085.db2.gz	FGQZCAKNIMSQHN-PWSUYJOCSA-N	1	1	306.366	1.589	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cnc1N)[N@H+]1CCC[C@H](C)C1	ZINC000248438759	408566323	/nfs/dbraw/zinc/56/63/23/408566323.db2.gz	TWUVZLYIPOEJHV-WDEREUQCSA-N	1	1	321.381	1.422	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000177144799	408533232	/nfs/dbraw/zinc/53/32/32/408533232.db2.gz	YYCGSTDKPLKFKD-NXEZZACHSA-N	1	1	321.381	1.625	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000160874249	408535173	/nfs/dbraw/zinc/53/51/73/408535173.db2.gz	AOMQAEYXTOARRG-BDAKNGLRSA-N	1	1	303.322	1.471	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000265297302	408605712	/nfs/dbraw/zinc/60/57/12/408605712.db2.gz	LNJCFHLJCWLTCP-NSHDSACASA-N	1	1	309.370	1.051	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000177470800	408630340	/nfs/dbraw/zinc/63/03/40/408630340.db2.gz	BZCHWPWFIKHAMC-HNNXBMFYSA-N	1	1	308.334	1.859	20	5		DDBDMO
COc1cccc(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000194771712	408796410	/nfs/dbraw/zinc/79/64/10/408796410.db2.gz	ALINHKKVEDEFLC-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000194771712	408796415	/nfs/dbraw/zinc/79/64/15/408796415.db2.gz	ALINHKKVEDEFLC-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000270942887	408751235	/nfs/dbraw/zinc/75/12/35/408751235.db2.gz	RSFKXYPVNIOLCV-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000270942887	408751242	/nfs/dbraw/zinc/75/12/42/408751242.db2.gz	RSFKXYPVNIOLCV-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@]1(O)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000178009860	408757760	/nfs/dbraw/zinc/75/77/60/408757760.db2.gz	IWGZOWCQTBSZGB-AWEZNQCLSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@]1(O)CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000178009860	408757763	/nfs/dbraw/zinc/75/77/63/408757763.db2.gz	IWGZOWCQTBSZGB-AWEZNQCLSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000249760466	408765088	/nfs/dbraw/zinc/76/50/88/408765088.db2.gz	XOGZHPKFVRGPIG-RYUDHWBXSA-N	1	1	309.370	1.028	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)c1	ZINC000285631191	408832722	/nfs/dbraw/zinc/83/27/22/408832722.db2.gz	AFKVZRCVMLADTK-ONGXEEELSA-N	1	1	322.287	1.284	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)[C@@H]2C1	ZINC000276337659	408839072	/nfs/dbraw/zinc/83/90/72/408839072.db2.gz	HOPWYXVSVWSKNP-QMTHXVAHSA-N	1	1	304.350	1.343	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000188741992	163065200	/nfs/dbraw/zinc/06/52/00/163065200.db2.gz	XLSTUWRODIBOIX-GFCCVEGCSA-N	1	1	321.377	1.296	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000188741992	163065205	/nfs/dbraw/zinc/06/52/05/163065205.db2.gz	XLSTUWRODIBOIX-GFCCVEGCSA-N	1	1	321.377	1.296	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCCO)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000281740243	408920911	/nfs/dbraw/zinc/92/09/11/408920911.db2.gz	JXXLSHFPFVCPLA-UHFFFAOYSA-N	1	1	304.350	1.810	20	5		DDBDMO
CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000286086493	408921794	/nfs/dbraw/zinc/92/17/94/408921794.db2.gz	SQFNFZUMEKGCMO-NSHDSACASA-N	1	1	323.397	1.948	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[NH2+]C2(CO)CCOCC2)c(F)c1	ZINC000286171627	408935479	/nfs/dbraw/zinc/93/54/79/408935479.db2.gz	YRJNPDQFXGHQKL-UHFFFAOYSA-N	1	1	302.277	1.504	20	5		DDBDMO
CC[N@H+]1CCCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000286651241	408992820	/nfs/dbraw/zinc/99/28/20/408992820.db2.gz	DRAHNFCNDBWJNI-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000282271336	409024187	/nfs/dbraw/zinc/02/41/87/409024187.db2.gz	HPWSVYHUXSHRAZ-BPLDGKMQSA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000287505021	409045964	/nfs/dbraw/zinc/04/59/64/409045964.db2.gz	NWJSYQCOKHZCGZ-SNVBAGLBSA-N	1	1	304.310	1.128	20	5		DDBDMO
O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+](CCO)CCCO)c1	ZINC000293180701	409063397	/nfs/dbraw/zinc/06/33/97/409063397.db2.gz	SMBKZSJPAWHQIY-UHFFFAOYSA-N	1	1	322.283	1.790	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1CC[NH+](C2CC2)CC1	ZINC000278788490	409089435	/nfs/dbraw/zinc/08/94/35/409089435.db2.gz	WTAHQJMLDZEYOJ-UHFFFAOYSA-N	1	1	319.361	1.974	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000287831237	409101402	/nfs/dbraw/zinc/10/14/02/409101402.db2.gz	KSLNIWWPIUBWHD-SNVBAGLBSA-N	1	1	322.365	1.979	20	5		DDBDMO
C[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)N1CCN(C)CC1	ZINC000293872854	409198309	/nfs/dbraw/zinc/19/83/09/409198309.db2.gz	VACFQQYKYWAMPZ-OLZOCXBDSA-N	1	1	321.425	1.464	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000279384983	409203723	/nfs/dbraw/zinc/20/37/23/409203723.db2.gz	IFOOUWFPUJDSPL-JTQLQIEISA-N	1	1	324.356	1.730	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355630	409298232	/nfs/dbraw/zinc/29/82/32/409298232.db2.gz	INBBEKHMKYFMFE-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355630	409298233	/nfs/dbraw/zinc/29/82/33/409298233.db2.gz	INBBEKHMKYFMFE-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000321308458	164044046	/nfs/dbraw/zinc/04/40/46/164044046.db2.gz	CRQAVIMZPOZAPU-YPMHNXCESA-N	1	1	318.377	1.876	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000304323871	409605846	/nfs/dbraw/zinc/60/58/46/409605846.db2.gz	MRDVLYVDTHDXKE-AWEZNQCLSA-N	1	1	320.349	1.293	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000356902458	409705022	/nfs/dbraw/zinc/70/50/22/409705022.db2.gz	OBNIIWBQXAHEPV-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000356902458	409705033	/nfs/dbraw/zinc/70/50/33/409705033.db2.gz	OBNIIWBQXAHEPV-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C2CC2)C[C@@H]1C	ZINC000342451396	409642325	/nfs/dbraw/zinc/64/23/25/409642325.db2.gz	PAVZHJAPORMNHZ-LKFCYVNXSA-N	1	1	304.350	1.511	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nccc2cc([N+](=O)[O-])ccc21	ZINC000296971627	409737147	/nfs/dbraw/zinc/73/71/47/409737147.db2.gz	DDMBFXDHPSLTOB-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000296971627	409737153	/nfs/dbraw/zinc/73/71/53/409737153.db2.gz	DDMBFXDHPSLTOB-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000296971627	409737158	/nfs/dbraw/zinc/73/71/58/409737158.db2.gz	DDMBFXDHPSLTOB-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000354523324	409918135	/nfs/dbraw/zinc/91/81/35/409918135.db2.gz	WTSXUCGTYYGEMC-CYBMUJFWSA-N	1	1	317.349	2.284	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346254933	409877955	/nfs/dbraw/zinc/87/79/55/409877955.db2.gz	HSTLVKNXIPQTTC-QJPTWQEYSA-N	1	1	321.381	1.131	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000346623379	410041845	/nfs/dbraw/zinc/04/18/45/410041845.db2.gz	WSACOIQXEYRQFQ-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229644	409998162	/nfs/dbraw/zinc/99/81/62/409998162.db2.gz	PNOCBPXJUQZSFQ-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229644	409998167	/nfs/dbraw/zinc/99/81/67/409998167.db2.gz	PNOCBPXJUQZSFQ-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
COc1cc(CN2CCC(C[NH3+])CC2)c([N+](=O)[O-])cc1OC	ZINC000346681309	410078013	/nfs/dbraw/zinc/07/80/13/410078013.db2.gz	DESCCDNQJNNZGY-UHFFFAOYSA-N	1	1	309.366	1.783	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000298450554	410236537	/nfs/dbraw/zinc/23/65/37/410236537.db2.gz	QZMDPEVSJBOECO-UHFFFAOYSA-N	1	1	300.380	1.854	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000355051444	410269892	/nfs/dbraw/zinc/26/98/92/410269892.db2.gz	NNQOFZWJIRZJPP-UHFFFAOYSA-N	1	1	310.354	1.177	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351774207	410223770	/nfs/dbraw/zinc/22/37/70/410223770.db2.gz	KDJOFYZAYGPGDQ-PUYPPJJSSA-N	1	1	307.350	1.543	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351774207	410223773	/nfs/dbraw/zinc/22/37/73/410223773.db2.gz	KDJOFYZAYGPGDQ-PUYPPJJSSA-N	1	1	307.350	1.543	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCOC[C@@H]2CC2CCC2)c1	ZINC000339781480	410455846	/nfs/dbraw/zinc/45/58/46/410455846.db2.gz	YDYPPRRCIMALAK-DZGCQCFKSA-N	1	1	324.381	1.043	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CCc3nc[nH]c3C2)cccc1[N+](=O)[O-]	ZINC000358400027	410460589	/nfs/dbraw/zinc/46/05/89/410460589.db2.gz	VYQLIMAVNYBWMU-SECBINFHSA-N	1	1	316.317	1.614	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000343457052	410468912	/nfs/dbraw/zinc/46/89/12/410468912.db2.gz	KOYBYCNWNJOCKQ-MFKMUULPSA-N	1	1	306.366	1.849	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000343462142	410470890	/nfs/dbraw/zinc/47/08/90/410470890.db2.gz	SVSKYJSTVGPQLM-JQWIXIFHSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000299070711	410507910	/nfs/dbraw/zinc/50/79/10/410507910.db2.gz	UVGYISKYSGYARR-UHFFFAOYSA-N	1	1	317.349	1.989	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H]1CCC[N@@H+]1C	ZINC000299213212	410571619	/nfs/dbraw/zinc/57/16/19/410571619.db2.gz	FCXIBGVBDHIYRP-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000301296404	410693332	/nfs/dbraw/zinc/69/33/32/410693332.db2.gz	SHNKJUOUYMRSQE-GFCCVEGCSA-N	1	1	324.429	1.322	20	5		DDBDMO
Cc1nn(C)c(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)c1[N+](=O)[O-]	ZINC000301306381	410697271	/nfs/dbraw/zinc/69/72/71/410697271.db2.gz	YLVZKVVEICRMFB-NSHDSACASA-N	1	1	323.397	1.326	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000301430496	410720681	/nfs/dbraw/zinc/72/06/81/410720681.db2.gz	QEUQLFADGMXJQH-WCQYABFASA-N	1	1	320.393	1.873	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])[N@H+](C)C1	ZINC000330532818	410753406	/nfs/dbraw/zinc/75/34/06/410753406.db2.gz	NXCYZEROUNXISG-JSGCOSHPSA-N	1	1	307.350	1.272	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])[N@@H+](C)C1	ZINC000330532818	410753412	/nfs/dbraw/zinc/75/34/12/410753412.db2.gz	NXCYZEROUNXISG-JSGCOSHPSA-N	1	1	307.350	1.272	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000302750017	410856931	/nfs/dbraw/zinc/85/69/31/410856931.db2.gz	GWKLHYSZFDCPBI-KOLCDFICSA-N	1	1	320.349	1.814	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356142857	410860401	/nfs/dbraw/zinc/86/04/01/410860401.db2.gz	AVRSMYMYTUOGGR-GFCCVEGCSA-N	1	1	323.397	1.713	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000330836111	410896310	/nfs/dbraw/zinc/89/63/10/410896310.db2.gz	KMIAPKLTJKLNKR-YRGRVCCFSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344055658	410922515	/nfs/dbraw/zinc/92/25/15/410922515.db2.gz	KUSVPNXLTQARLO-BVIHXZOGSA-N	1	1	319.361	1.625	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OC	ZINC000348556870	411015350	/nfs/dbraw/zinc/01/53/50/411015350.db2.gz	QCPRJOWQPBLULT-WCQYABFASA-N	1	1	310.350	1.957	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000356649972	411116742	/nfs/dbraw/zinc/11/67/42/411116742.db2.gz	QVECLKRYNHQMAN-SNVBAGLBSA-N	1	1	310.354	1.546	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H](C)C[NH+]1CCOCC1	ZINC000194741977	292584394	/nfs/dbraw/zinc/58/43/94/292584394.db2.gz	LFFMABPVENKYJF-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
C[C@@H]1CN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000419338955	226123960	/nfs/dbraw/zinc/12/39/60/226123960.db2.gz	ZPGZCUBKBBVYRX-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=C(N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000374894925	418574329	/nfs/dbraw/zinc/57/43/29/418574329.db2.gz	OEBYETRWWZLCHN-AAVRWANBSA-N	1	1	307.325	1.053	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H]1CC[N@@H+](C)C1	ZINC000360872537	418538040	/nfs/dbraw/zinc/53/80/40/418538040.db2.gz	ODPISLRYXPUYCK-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N[C@H]1CC[N@H+](C)C1	ZINC000360872537	418538043	/nfs/dbraw/zinc/53/80/43/418538043.db2.gz	ODPISLRYXPUYCK-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
COc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)c(F)cc1[N+](=O)[O-]	ZINC000291030308	222083633	/nfs/dbraw/zinc/08/36/33/222083633.db2.gz	YSEFODMYBRCHQV-UHFFFAOYSA-N	1	1	321.312	1.792	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000195442169	222202420	/nfs/dbraw/zinc/20/24/20/222202420.db2.gz	SWXNBUFDDUAHGZ-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000375035555	418592084	/nfs/dbraw/zinc/59/20/84/418592084.db2.gz	CTNFLEBQLKZOOS-ABAIWWIYSA-N	1	1	318.377	1.485	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)CC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000361213711	418607002	/nfs/dbraw/zinc/60/70/02/418607002.db2.gz	ZSLLJZIPXDPYSQ-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](O)C2(CC2)C1	ZINC000375311222	418627949	/nfs/dbraw/zinc/62/79/49/418627949.db2.gz	VTVRYFFLLPZQHS-AWEZNQCLSA-N	1	1	319.361	1.689	20	5		DDBDMO
CNC(=O)CN1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000368211595	418705216	/nfs/dbraw/zinc/70/52/16/418705216.db2.gz	HNOFKTFSAQKCPE-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CNC(=O)CN1CCCN(Cc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000368211595	418705217	/nfs/dbraw/zinc/70/52/17/418705217.db2.gz	HNOFKTFSAQKCPE-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2C(N)=O)CC1	ZINC000361828439	418715153	/nfs/dbraw/zinc/71/51/53/418715153.db2.gz	FKJXQYZXIFBCFU-UHFFFAOYSA-N	1	1	321.381	1.257	20	5		DDBDMO
CC(C)(C)[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000361541724	418673784	/nfs/dbraw/zinc/67/37/84/418673784.db2.gz	SBZNMBKUDJMXJB-TZMCWYRMSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000368068000	418684097	/nfs/dbraw/zinc/68/40/97/418684097.db2.gz	DNJFVCBVITVRAC-INIZCTEOSA-N	1	1	321.377	1.534	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N[C@@H]3CC[N@H+]4CCC[C@@H]4C3)nn21	ZINC000372703421	418893709	/nfs/dbraw/zinc/89/37/09/418893709.db2.gz	IDOIEHMCTDHWSJ-GHMZBOCLSA-N	1	1	302.338	1.676	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712156	418893783	/nfs/dbraw/zinc/89/37/83/418893783.db2.gz	FDIZQUSVGWEYTQ-CHWSQXEVSA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712156	418893784	/nfs/dbraw/zinc/89/37/84/418893784.db2.gz	FDIZQUSVGWEYTQ-CHWSQXEVSA-N	1	1	321.381	1.304	20	5		DDBDMO
COC(=O)[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)C1	ZINC000411915054	419482348	/nfs/dbraw/zinc/48/23/48/419482348.db2.gz	YJTQYRONLQBYSL-AWEZNQCLSA-N	1	1	321.377	1.174	20	5		DDBDMO
COC(=O)[C@H]1CN(C)CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000411915054	419482359	/nfs/dbraw/zinc/48/23/59/419482359.db2.gz	YJTQYRONLQBYSL-AWEZNQCLSA-N	1	1	321.377	1.174	20	5		DDBDMO
COC(=O)[C@H]1CN(C)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000411915054	419482365	/nfs/dbraw/zinc/48/23/65/419482365.db2.gz	YJTQYRONLQBYSL-AWEZNQCLSA-N	1	1	321.377	1.174	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000411926312	419494363	/nfs/dbraw/zinc/49/43/63/419494363.db2.gz	VPQABKZFSHYHGU-GJZGRUSLSA-N	1	1	324.377	1.964	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000411926312	419494369	/nfs/dbraw/zinc/49/43/69/419494369.db2.gz	VPQABKZFSHYHGU-GJZGRUSLSA-N	1	1	324.377	1.964	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)C[C@H]1CCC[N@H+]1C	ZINC000421002731	419442500	/nfs/dbraw/zinc/44/25/00/419442500.db2.gz	MOXRGLXWLLBSRP-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000421395094	419597407	/nfs/dbraw/zinc/59/74/07/419597407.db2.gz	YBZKIQBEKFOPRZ-SNVBAGLBSA-N	1	1	323.349	1.180	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000412061861	419610917	/nfs/dbraw/zinc/61/09/17/419610917.db2.gz	AKLXPLBKYVCOIC-RDBSUJKOSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC(C)[C@@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000427188144	419614131	/nfs/dbraw/zinc/61/41/31/419614131.db2.gz	WZAHFBFQEGKILY-KGLIPLIRSA-N	1	1	308.382	1.663	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](CO)[C@@H]1C	ZINC000412072593	419623574	/nfs/dbraw/zinc/62/35/74/419623574.db2.gz	HJLUJOKWROZUNS-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](CO)[C@@H]1C	ZINC000412072593	419623578	/nfs/dbraw/zinc/62/35/78/419623578.db2.gz	HJLUJOKWROZUNS-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)n1	ZINC000427705077	419719448	/nfs/dbraw/zinc/71/94/48/419719448.db2.gz	GYYIJRJCVAPKQI-LLVKDONJSA-N	1	1	309.370	1.414	20	5		DDBDMO
COCCC[N@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000299254975	229009758	/nfs/dbraw/zinc/00/97/58/229009758.db2.gz	DNLDHYWCFHLSHT-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
COCCC[N@@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000299254975	229009763	/nfs/dbraw/zinc/00/97/63/229009763.db2.gz	DNLDHYWCFHLSHT-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](OCCO)C1	ZINC000430192117	420088768	/nfs/dbraw/zinc/08/87/68/420088768.db2.gz	ACIUTEAEKKRSAZ-CQSZACIVSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](OCCO)C1	ZINC000430192117	420088772	/nfs/dbraw/zinc/08/87/72/420088772.db2.gz	ACIUTEAEKKRSAZ-CQSZACIVSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1[NH3+]	ZINC000430967674	420228917	/nfs/dbraw/zinc/22/89/17/420228917.db2.gz	UDUFBENVXWVGAC-RISCZKNCSA-N	1	1	306.366	1.593	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]([NH3+])[C@@H](C)C1	ZINC000430946076	420219531	/nfs/dbraw/zinc/21/95/31/420219531.db2.gz	YYXIOKUZANYTAX-JSGCOSHPSA-N	1	1	320.393	1.901	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@@H+]1CCO	ZINC000416287329	420308071	/nfs/dbraw/zinc/30/80/71/420308071.db2.gz	BWMOFCMSGNHBCZ-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1CCO	ZINC000416287329	420308076	/nfs/dbraw/zinc/30/80/76/420308076.db2.gz	BWMOFCMSGNHBCZ-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000416298476	420316443	/nfs/dbraw/zinc/31/64/43/420316443.db2.gz	QXAOPILEGCUHOQ-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000416298476	420316444	/nfs/dbraw/zinc/31/64/44/420316444.db2.gz	QXAOPILEGCUHOQ-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
COC(=O)c1cc(C)nc(N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000420638581	420338442	/nfs/dbraw/zinc/33/84/42/420338442.db2.gz	QQAWEXXOKDCXHM-LLVKDONJSA-N	1	1	322.365	1.615	20	5		DDBDMO
CO[C@@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000425417023	420379948	/nfs/dbraw/zinc/37/99/48/420379948.db2.gz	MCMKCXUHJTZZNE-JSGCOSHPSA-N	1	1	306.366	1.901	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)Nc2ncc([N+](=O)[O-])cn2)CC1	ZINC000450920768	420562092	/nfs/dbraw/zinc/56/20/92/420562092.db2.gz	ASLNNWDFVFPBDF-UHFFFAOYSA-N	1	1	308.386	1.213	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@H](O)[C@H](CO)C3)o2)c1	ZINC000459694209	420849221	/nfs/dbraw/zinc/84/92/21/420849221.db2.gz	GDAOKEYKYPTNSD-WFASDCNBSA-N	1	1	318.329	1.640	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2C[C@H]1CS2	ZINC000459792259	420874902	/nfs/dbraw/zinc/87/49/02/420874902.db2.gz	JKYOLDJJCJKUGA-TUAOUCFPSA-N	1	1	310.375	1.524	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000487071805	421001318	/nfs/dbraw/zinc/00/13/18/421001318.db2.gz	BPLWRDVXBHNDMZ-OAHLLOKOSA-N	1	1	320.393	1.731	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1	ZINC000449430237	421010898	/nfs/dbraw/zinc/01/08/98/421010898.db2.gz	BVOPQTGUJLKBIW-FVQBIDKESA-N	1	1	306.362	1.957	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000487515345	421032908	/nfs/dbraw/zinc/03/29/08/421032908.db2.gz	KHQTVVDCKUSRLE-DGCLKSJQSA-N	1	1	321.381	1.153	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]nc1[N+](=O)[O-])Cc1ccc(F)cc1	ZINC000563458032	421512919	/nfs/dbraw/zinc/51/29/19/421512919.db2.gz	GOTJXYSGHLJMRG-UHFFFAOYSA-N	1	1	321.312	1.319	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000571118404	421690028	/nfs/dbraw/zinc/69/00/28/421690028.db2.gz	NUUCVMQRZSRSHH-LLVKDONJSA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000518792703	421668310	/nfs/dbraw/zinc/66/83/10/421668310.db2.gz	QCMQAAMSJCDGSR-GFCCVEGCSA-N	1	1	303.362	1.821	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000570823134	421671238	/nfs/dbraw/zinc/67/12/38/421671238.db2.gz	IIRUFYPNYNHLON-LLVKDONJSA-N	1	1	321.381	1.518	20	5		DDBDMO
C[C@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)[NH+]1CC(C)C1	ZINC000520836415	421765682	/nfs/dbraw/zinc/76/56/82/421765682.db2.gz	NUFRXFORBIDRGU-LLVKDONJSA-N	1	1	304.350	1.215	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000557556163	421777700	/nfs/dbraw/zinc/77/77/00/421777700.db2.gz	VBGTZWDTCATVDI-LLVKDONJSA-N	1	1	306.366	1.836	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@@H+]2CC[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000578480308	422579232	/nfs/dbraw/zinc/57/92/32/422579232.db2.gz	QGTYCKAIMVJGTO-LBPRGKRZSA-N	1	1	321.377	1.740	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCOC1	ZINC000181957048	263371714	/nfs/dbraw/zinc/37/17/14/263371714.db2.gz	VLNAJDIMKOYKAO-OLZOCXBDSA-N	1	1	310.350	1.303	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[NH+](CC)C[C@H]2C)n1	ZINC000344419519	272021373	/nfs/dbraw/zinc/02/13/73/272021373.db2.gz	GDOQXNXYRBTPQR-GHMZBOCLSA-N	1	1	309.370	1.366	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000344756087	272110924	/nfs/dbraw/zinc/11/09/24/272110924.db2.gz	GQEUKTVNCRAVJG-SNVBAGLBSA-N	1	1	305.338	1.504	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CCC[N@H+]1C	ZINC000345321782	272219388	/nfs/dbraw/zinc/21/93/88/272219388.db2.gz	OUQYRXIADAGGPE-KWQFWETISA-N	1	1	310.329	1.529	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NCC[N@@H+]1C[C@H]3CC[C@@H](C1)O3)CCN2	ZINC000450785326	275038711	/nfs/dbraw/zinc/03/87/11/275038711.db2.gz	AMBJKWNQGXCFFQ-TXEJJXNPSA-N	1	1	318.377	1.838	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[C@@H](NC[C@@H]1C[NH2+]CCCO1)C1CC1	ZINC000423494113	275040123	/nfs/dbraw/zinc/04/01/23/275040123.db2.gz	RPTADJVHIPDEGC-JKSUJKDBSA-N	1	1	319.405	1.884	20	5		DDBDMO
CCC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1CCOC	ZINC000271006141	276030981	/nfs/dbraw/zinc/03/09/81/276030981.db2.gz	YACOKLAJNPOHPH-GFCCVEGCSA-N	1	1	324.381	1.496	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000269333246	276040582	/nfs/dbraw/zinc/04/05/82/276040582.db2.gz	ATGZKHRKRVHBSG-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000269333246	276040583	/nfs/dbraw/zinc/04/05/83/276040583.db2.gz	ATGZKHRKRVHBSG-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000269333246	276040584	/nfs/dbraw/zinc/04/05/84/276040584.db2.gz	ATGZKHRKRVHBSG-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455818371	276169594	/nfs/dbraw/zinc/16/95/94/276169594.db2.gz	AXVIVUMZLSOHMT-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
CNC(=O)c1ccc(N2CCC[N@H+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000057857608	277258450	/nfs/dbraw/zinc/25/84/50/277258450.db2.gz	ALGMETKFYMKABI-UHFFFAOYSA-N	1	1	318.377	1.629	20	5		DDBDMO
O=C1CCC(=O)N1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000130195678	280248786	/nfs/dbraw/zinc/24/87/86/280248786.db2.gz	HMJIDGCLXQMICA-UHFFFAOYSA-N	1	1	317.345	1.708	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c1	ZINC000420432276	280654584	/nfs/dbraw/zinc/65/45/84/280654584.db2.gz	XVCSQJZBZUFPIR-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C[C@@H](C)[NH2+]1	ZINC000123884677	281179581	/nfs/dbraw/zinc/17/95/81/281179581.db2.gz	WHKUGSHQZJVSAZ-HTQZYQBOSA-N	1	1	305.381	1.027	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000128326652	281307499	/nfs/dbraw/zinc/30/74/99/281307499.db2.gz	XNKZMBPLNFXASI-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000128326652	281307501	/nfs/dbraw/zinc/30/75/01/281307501.db2.gz	XNKZMBPLNFXASI-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362079096	300001991	/nfs/dbraw/zinc/00/19/91/300001991.db2.gz	SVIYDAWWXKFAQT-NWDGAFQWSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362079096	300001992	/nfs/dbraw/zinc/00/19/92/300001992.db2.gz	SVIYDAWWXKFAQT-NWDGAFQWSA-N	1	1	307.350	1.402	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c([N+](=O)[O-])c1	ZINC000362454463	300067521	/nfs/dbraw/zinc/06/75/21/300067521.db2.gz	QNQJGKAMIONJMU-ZIAGYGMSSA-N	1	1	319.361	1.695	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1c([N+](=O)[O-])ncn1C	ZINC000362659120	300111476	/nfs/dbraw/zinc/11/14/76/300111476.db2.gz	UVQJIEWVWTXZFE-NSHDSACASA-N	1	1	309.370	1.018	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000363026611	300200360	/nfs/dbraw/zinc/20/03/60/300200360.db2.gz	JVZMEJZCHFFVGX-UKRRQHHQSA-N	1	1	303.362	1.880	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000363099272	300210680	/nfs/dbraw/zinc/21/06/80/300210680.db2.gz	FQVFTMVTMDHMAQ-CHWSQXEVSA-N	1	1	318.377	1.993	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000363651026	300292640	/nfs/dbraw/zinc/29/26/40/300292640.db2.gz	JNNXLBTWHYODGB-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@H]2C1	ZINC000363877251	300320107	/nfs/dbraw/zinc/32/01/07/300320107.db2.gz	UGILMMBVZONAEV-CORIIIEPSA-N	1	1	316.361	1.546	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H]2OCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000368471042	301034946	/nfs/dbraw/zinc/03/49/46/301034946.db2.gz	PFMMQLCRDNWMDW-SMDDNHRTSA-N	1	1	305.334	1.644	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]2OCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000368471042	301034949	/nfs/dbraw/zinc/03/49/49/301034949.db2.gz	PFMMQLCRDNWMDW-SMDDNHRTSA-N	1	1	305.334	1.644	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC23CCOCC3)c([N+](=O)[O-])c1	ZINC000368576840	301055994	/nfs/dbraw/zinc/05/59/94/301055994.db2.gz	QLAJPRTTWVIQSQ-UHFFFAOYSA-N	1	1	319.361	1.839	20	5		DDBDMO
C[C@H]1CC(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000369453854	301187982	/nfs/dbraw/zinc/18/79/82/301187982.db2.gz	XAZBEJPPYDVISC-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)[C@H]2C1	ZINC000376729423	302093155	/nfs/dbraw/zinc/09/31/55/302093155.db2.gz	PXEDNAJFFKGDME-MFKMUULPSA-N	1	1	307.325	1.900	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000429274587	302387811	/nfs/dbraw/zinc/38/78/11/302387811.db2.gz	SUHPMQZQQOBGRC-CYBMUJFWSA-N	1	1	312.366	1.691	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cc([N+](=O)[O-])cn2C)[nH+]1	ZINC000530582615	303204581	/nfs/dbraw/zinc/20/45/81/303204581.db2.gz	FHGDWVQSIPSHBQ-UHFFFAOYSA-N	1	1	303.322	1.479	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21	ZINC000532873519	303300199	/nfs/dbraw/zinc/30/01/99/303300199.db2.gz	PCRBDDJMHNKITI-YPMHNXCESA-N	1	1	306.366	1.490	20	5		DDBDMO
Cc1ccc2c(c1)C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000361603197	307000703	/nfs/dbraw/zinc/00/07/03/307000703.db2.gz	PNOOVVLSUHBWQV-OAHLLOKOSA-N	1	1	302.334	1.476	20	5		DDBDMO
Cc1ccc2c(c1)C[N@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000361603197	307000704	/nfs/dbraw/zinc/00/07/04/307000704.db2.gz	PNOOVVLSUHBWQV-OAHLLOKOSA-N	1	1	302.334	1.476	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000365182776	307060845	/nfs/dbraw/zinc/06/08/45/307060845.db2.gz	IQJICXBJMOYVQU-NEPJUHHUSA-N	1	1	318.377	1.842	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000366425823	307073555	/nfs/dbraw/zinc/07/35/55/307073555.db2.gz	XTXKYCZYHKALHX-ITGUQSILSA-N	1	1	308.334	1.152	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12	ZINC000368714971	307108472	/nfs/dbraw/zinc/10/84/72/307108472.db2.gz	HBZDRFSIWDSISN-INIZCTEOSA-N	1	1	314.345	1.960	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@]2(C1)OCc1ccccc12	ZINC000368714971	307108473	/nfs/dbraw/zinc/10/84/73/307108473.db2.gz	HBZDRFSIWDSISN-INIZCTEOSA-N	1	1	314.345	1.960	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000373972938	307198838	/nfs/dbraw/zinc/19/88/38/307198838.db2.gz	KXMQDAHWEVVUBZ-HRCADAONSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000373972938	307198839	/nfs/dbraw/zinc/19/88/39/307198839.db2.gz	KXMQDAHWEVVUBZ-HRCADAONSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000373972938	307198840	/nfs/dbraw/zinc/19/88/40/307198840.db2.gz	KXMQDAHWEVVUBZ-HRCADAONSA-N	1	1	317.389	1.332	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1NC[C@@H](C)C[NH+]1CCOCC1	ZINC000579494626	308536812	/nfs/dbraw/zinc/53/68/12/308536812.db2.gz	UVLJZGCCZXKMKM-GFCCVEGCSA-N	1	1	309.366	1.984	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@]12CCOC2)Nc1ccccc1[N+](=O)[O-]	ZINC000421019809	484110492	/nfs/dbraw/zinc/11/04/92/484110492.db2.gz	MTVGBCRKWIIISR-OAHLLOKOSA-N	1	1	305.334	1.788	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H](CCO)CC2)c([N+](=O)[O-])c1	ZINC000421024313	484112006	/nfs/dbraw/zinc/11/20/06/484112006.db2.gz	XELBOZZOWWELHF-LBPRGKRZSA-N	1	1	321.377	1.678	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000361427935	500642574	/nfs/dbraw/zinc/64/25/74/500642574.db2.gz	WGDZQNFAWDESAN-AWEZNQCLSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000361427935	500642577	/nfs/dbraw/zinc/64/25/77/500642577.db2.gz	WGDZQNFAWDESAN-AWEZNQCLSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1[C@@H](O)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457352	534244091	/nfs/dbraw/zinc/24/40/91/534244091.db2.gz	MGWQVHCBVYCNJO-MFKMUULPSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H]1[C@@H](O)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000451457352	534244094	/nfs/dbraw/zinc/24/40/94/534244094.db2.gz	MGWQVHCBVYCNJO-MFKMUULPSA-N	1	1	318.333	1.990	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](O)[C@H](CO)C1	ZINC000414564653	527528743	/nfs/dbraw/zinc/52/87/43/527528743.db2.gz	XVSSKKCMRHFVMZ-CMIZMYSDSA-N	1	1	306.362	1.673	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000451936089	527790177	/nfs/dbraw/zinc/79/01/77/527790177.db2.gz	KHMYADXNODHQGM-ZKYQVNSYSA-N	1	1	323.349	1.315	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000490300041	527825566	/nfs/dbraw/zinc/82/55/66/527825566.db2.gz	NXDYUWPSOFCHHW-CYBMUJFWSA-N	1	1	323.397	1.325	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1cc(N)c([N+](=O)[O-])cn1	ZINC001120828299	782166879	/nfs/dbraw/zinc/16/68/79/782166879.db2.gz	OJYIPDVBHQJVRG-UHFFFAOYSA-N	1	1	323.397	1.367	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000736857417	598504122	/nfs/dbraw/zinc/50/41/22/598504122.db2.gz	NKLATWDFVYFBAW-JTQLQIEISA-N	1	1	317.353	1.529	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](CCC(N)=O)C2)c(C)c1[N+](=O)[O-]	ZINC000066080632	696349681	/nfs/dbraw/zinc/34/96/81/696349681.db2.gz	UZSLIOHCCPPFSB-LBPRGKRZSA-N	1	1	309.370	1.343	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](CCC(N)=O)C2)c(C)c1[N+](=O)[O-]	ZINC000066080632	696349684	/nfs/dbraw/zinc/34/96/84/696349684.db2.gz	UZSLIOHCCPPFSB-LBPRGKRZSA-N	1	1	309.370	1.343	20	5		DDBDMO
C[N@H+](CCn1cccn1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000111169483	696642243	/nfs/dbraw/zinc/64/22/43/696642243.db2.gz	LUFWFPHLSDALNR-UHFFFAOYSA-N	1	1	300.322	1.731	20	5		DDBDMO
C[N@@H+](CCn1cccn1)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000111169483	696642246	/nfs/dbraw/zinc/64/22/46/696642246.db2.gz	LUFWFPHLSDALNR-UHFFFAOYSA-N	1	1	300.322	1.731	20	5		DDBDMO
O=[N+]([O-])c1cc(S(=O)(=O)NCC[NH+]2CCCCC2)cs1	ZINC000119568945	696682351	/nfs/dbraw/zinc/68/23/51/696682351.db2.gz	LQASNQIFMSYVOL-UHFFFAOYSA-N	1	1	319.408	1.421	20	5		DDBDMO
COCCOC[C@H]1CC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000173393496	697377722	/nfs/dbraw/zinc/37/77/22/697377722.db2.gz	CXOQMUFLYACECO-ZDUSSCGKSA-N	1	1	312.370	1.351	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000173393496	697377724	/nfs/dbraw/zinc/37/77/24/697377724.db2.gz	CXOQMUFLYACECO-ZDUSSCGKSA-N	1	1	312.370	1.351	20	5		DDBDMO
CCCC(=O)N1CCC([N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000985212966	697469050	/nfs/dbraw/zinc/46/90/50/697469050.db2.gz	HNSJNDUMRNYEAC-UHFFFAOYSA-N	1	1	323.397	1.551	20	5		DDBDMO
CCCC(=O)N1CCC([N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000985212966	697469051	/nfs/dbraw/zinc/46/90/51/697469051.db2.gz	HNSJNDUMRNYEAC-UHFFFAOYSA-N	1	1	323.397	1.551	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776580556	698120743	/nfs/dbraw/zinc/12/07/43/698120743.db2.gz	WJWWKQOYHIPELB-CJNGLKHVSA-N	1	1	321.377	1.476	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(c3nc[nH]n3)CC2)cc1	ZINC000776593624	698124252	/nfs/dbraw/zinc/12/42/52/698124252.db2.gz	YSHJJKCVRPFIAH-AWEZNQCLSA-N	1	1	317.349	1.626	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782525613	698734308	/nfs/dbraw/zinc/73/43/08/698734308.db2.gz	ZHZBTKDULMWVKI-MWLCHTKSSA-N	1	1	311.313	1.518	20	5		DDBDMO
Nc1ccc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-]	ZINC000791258854	699618072	/nfs/dbraw/zinc/61/80/72/699618072.db2.gz	LQPJBDUBCAIAIB-WCQYABFASA-N	1	1	322.340	1.435	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1	ZINC000735894606	699708970	/nfs/dbraw/zinc/70/89/70/699708970.db2.gz	VCHIZUGORFBXAM-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637352	699820424	/nfs/dbraw/zinc/82/04/24/699820424.db2.gz	WINGXHOGAYGTTE-MNOVXSKESA-N	1	1	321.333	1.696	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637352	699820426	/nfs/dbraw/zinc/82/04/26/699820426.db2.gz	WINGXHOGAYGTTE-MNOVXSKESA-N	1	1	321.333	1.696	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)CC[NH+]1CCOCC1	ZINC000751321644	700280796	/nfs/dbraw/zinc/28/07/96/700280796.db2.gz	MWJOUKLYSJPMQO-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000754778176	700526841	/nfs/dbraw/zinc/52/68/41/700526841.db2.gz	MSAWEKNJFLJQPW-CYBMUJFWSA-N	1	1	309.370	1.166	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@H+](C)Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000754778176	700526844	/nfs/dbraw/zinc/52/68/44/700526844.db2.gz	MSAWEKNJFLJQPW-CYBMUJFWSA-N	1	1	309.370	1.166	20	5		DDBDMO
O=C(CC[NH+]1CCOCC1)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000757641115	700667323	/nfs/dbraw/zinc/66/73/23/700667323.db2.gz	AFSVUFZOODOHBM-UHFFFAOYSA-N	1	1	319.361	1.202	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCC(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC000803856625	701150263	/nfs/dbraw/zinc/15/02/63/701150263.db2.gz	SSXQQOSALDTAJA-LBPRGKRZSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@H]1C[N@H+](C)CCO1	ZINC000770474565	701279529	/nfs/dbraw/zinc/27/95/29/701279529.db2.gz	BLXWGIBIDQMIGU-LDYMZIIASA-N	1	1	307.310	1.262	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@H]1C[N@@H+](C)CCO1	ZINC000770474565	701279530	/nfs/dbraw/zinc/27/95/30/701279530.db2.gz	BLXWGIBIDQMIGU-LDYMZIIASA-N	1	1	307.310	1.262	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH+]2CCCCCC2)CC1	ZINC000839525956	701724477	/nfs/dbraw/zinc/72/44/77/701724477.db2.gz	BSGXSEYRCGWUMF-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
Cc1cccc(CN(CC[NH+](C)C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC000839707344	701791252	/nfs/dbraw/zinc/79/12/52/701791252.db2.gz	SXRUCFMOTHXJFZ-HUUCEWRRSA-N	1	1	305.378	1.550	20	5		DDBDMO
C[NH+](C)C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000839762523	701814625	/nfs/dbraw/zinc/81/46/25/701814625.db2.gz	YLIRMBPOHCKXKX-JHJVBQTASA-N	1	1	311.769	1.724	20	5		DDBDMO
CCN(C[C@@H]1CCCO1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867970192	701862580	/nfs/dbraw/zinc/86/25/80/701862580.db2.gz	YRBNEPMMHNJUEQ-HOCLYGCPSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3c4cc([N+](=O)[O-])ccc4oc3=O)C[C@@H]21	ZINC000840132292	701987314	/nfs/dbraw/zinc/98/73/14/701987314.db2.gz	JYARTFHVNWTRFK-MFKMUULPSA-N	1	1	318.333	1.096	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000812340546	702164134	/nfs/dbraw/zinc/16/41/34/702164134.db2.gz	CSIJFLPRAITKKP-OLZOCXBDSA-N	1	1	319.361	1.384	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000866209645	706649500	/nfs/dbraw/zinc/64/95/00/706649500.db2.gz	UOGOAHRHDBXVSX-PWSUYJOCSA-N	1	1	320.349	1.307	20	5		DDBDMO
COc1cc(Cc2noc([C@H](C)[NH3+])n2)c([N+](=O)[O-])c(OC)c1	ZINC000843224898	702845821	/nfs/dbraw/zinc/84/58/21/702845821.db2.gz	AJCDNJWLLJSCPP-ZETCQYMHSA-N	1	1	308.294	1.606	20	5		DDBDMO
C[C@H]1C[C@@H]([NH3+])CCN1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000846709025	703322198	/nfs/dbraw/zinc/32/21/98/703322198.db2.gz	XWOTVLNTZIQZBE-QWRGUYRKSA-N	1	1	324.356	1.874	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)c1	ZINC000852345394	704019385	/nfs/dbraw/zinc/01/93/85/704019385.db2.gz	BKJLBXHVRVZDOR-XRGAULLZSA-N	1	1	306.362	1.721	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CNCc1cc([N+](=O)[O-])ccc1Cl)C1CC1	ZINC000819149151	704076499	/nfs/dbraw/zinc/07/64/99/704076499.db2.gz	HSCSTNCHXDUMJB-ZDUSSCGKSA-N	1	1	313.785	1.793	20	5		DDBDMO
Cc1cc(C[C@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819177551	704082187	/nfs/dbraw/zinc/08/21/87/704082187.db2.gz	OFNDMLVRVBEVSI-ZUZCIYMTSA-N	1	1	304.350	1.881	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000852701697	704102556	/nfs/dbraw/zinc/10/25/56/704102556.db2.gz	DXFSUVZJJPASQZ-YGRLFVJLSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000852701697	704102559	/nfs/dbraw/zinc/10/25/59/704102559.db2.gz	DXFSUVZJJPASQZ-YGRLFVJLSA-N	1	1	309.322	1.953	20	5		DDBDMO
CC[NH+]1CCN(CCNc2ccc([N+](=O)[O-])cc2C(C)=O)CC1	ZINC000853150834	704205179	/nfs/dbraw/zinc/20/51/79/704205179.db2.gz	JAMGEAWPYFSFAN-UHFFFAOYSA-N	1	1	320.393	1.847	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C(C)(C)CC1	ZINC000871151174	704231238	/nfs/dbraw/zinc/23/12/38/704231238.db2.gz	YIMCPVBIPLXAMD-UHFFFAOYSA-N	1	1	306.366	1.855	20	5		DDBDMO
CCN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000855360252	704480674	/nfs/dbraw/zinc/48/06/74/704480674.db2.gz	DFCZGCNYHHGSFU-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
Nc1ncc2c(n1)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000857924165	704643246	/nfs/dbraw/zinc/64/32/46/704643246.db2.gz	SFRMREXCXFATIQ-AWEZNQCLSA-N	1	1	315.333	1.059	20	5		DDBDMO
Nc1ncc2c(n1)C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000857924165	704643248	/nfs/dbraw/zinc/64/32/48/704643248.db2.gz	SFRMREXCXFATIQ-AWEZNQCLSA-N	1	1	315.333	1.059	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000824002999	705352519	/nfs/dbraw/zinc/35/25/19/705352519.db2.gz	LCFJYEHIXOROSD-NEPJUHHUSA-N	1	1	319.365	1.925	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000861385804	705452715	/nfs/dbraw/zinc/45/27/15/705452715.db2.gz	VYXTXNNCWAVWMT-UHFFFAOYSA-N	1	1	316.317	1.643	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000863319843	705900484	/nfs/dbraw/zinc/90/04/84/705900484.db2.gz	QBMUFEZIHUGANZ-KUGGDMIFSA-N	1	1	319.361	1.181	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC000827269757	705965023	/nfs/dbraw/zinc/96/50/23/705965023.db2.gz	ZUSKEJGTJNQOAH-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827310041	705972742	/nfs/dbraw/zinc/97/27/42/705972742.db2.gz	JJKDZNCTCYJWRH-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000827459524	706006835	/nfs/dbraw/zinc/00/68/35/706006835.db2.gz	LMLBUQVYBVEQGL-CYBMUJFWSA-N	1	1	321.381	1.233	20	5		DDBDMO
CO[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC000878165760	706312292	/nfs/dbraw/zinc/31/22/92/706312292.db2.gz	DOMPHTWDTMLJAU-SNVBAGLBSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC000878165760	706312294	/nfs/dbraw/zinc/31/22/94/706312294.db2.gz	DOMPHTWDTMLJAU-SNVBAGLBSA-N	1	1	304.306	1.866	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000865067154	706341451	/nfs/dbraw/zinc/34/14/51/706341451.db2.gz	NKFZMFVNADVBBF-UHFFFAOYSA-N	1	1	306.297	1.598	20	5		DDBDMO
Cn1nnnc1CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000878286531	706347596	/nfs/dbraw/zinc/34/75/96/706347596.db2.gz	QCTORVWPNQDTLS-UHFFFAOYSA-N	1	1	302.338	1.325	20	5		DDBDMO
C[C@](O)(C[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303412	706352260	/nfs/dbraw/zinc/35/22/60/706352260.db2.gz	PYUXGDIMAGHWMI-YOEHRIQHSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@](O)(C[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303412	706352261	/nfs/dbraw/zinc/35/22/61/706352261.db2.gz	PYUXGDIMAGHWMI-YOEHRIQHSA-N	1	1	320.389	1.865	20	5		DDBDMO
Cn1nnnc1C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000879916356	706818215	/nfs/dbraw/zinc/81/82/15/706818215.db2.gz	BYBSGWWJRLJJOC-UHFFFAOYSA-N	1	1	320.328	1.637	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832450853	706917025	/nfs/dbraw/zinc/91/70/25/706917025.db2.gz	POVCLOHFRFQGCJ-GJZGRUSLSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000880438417	706976423	/nfs/dbraw/zinc/97/64/23/706976423.db2.gz	GVQVSSOQKLFHAH-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832908240	706997625	/nfs/dbraw/zinc/99/76/25/706997625.db2.gz	HJAFSZMXKGDSKJ-BXUZGUMPSA-N	1	1	309.366	1.473	20	5		DDBDMO
C[C@H]([NH2+]CCCS(C)(=O)=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000872032654	707283673	/nfs/dbraw/zinc/28/36/73/707283673.db2.gz	XGOLQEHBFSVJGX-VIFPVBQESA-N	1	1	304.343	1.819	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCN(C)c2ncccc2C1	ZINC000872319240	707380430	/nfs/dbraw/zinc/38/04/30/707380430.db2.gz	BOWFMTCKPFEVLS-UHFFFAOYSA-N	1	1	316.365	1.447	20	5		DDBDMO
Cc1c(C[NH2+]C[C@@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873041913	707705396	/nfs/dbraw/zinc/70/53/96/707705396.db2.gz	CHPBNSMHIJFRJN-CQSZACIVSA-N	1	1	320.437	1.876	20	5		DDBDMO
CCOC(=O)[C@H]1NCC[C@H]1[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000873296980	707802258	/nfs/dbraw/zinc/80/22/58/707802258.db2.gz	ORDBLJNXCCSDEL-SUHUHFCYSA-N	1	1	307.350	1.539	20	5		DDBDMO
O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000838913010	708002372	/nfs/dbraw/zinc/00/23/72/708002372.db2.gz	VJTVWVXZYVXCIC-OKILXGFUSA-N	1	1	306.318	1.615	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000896650108	708108077	/nfs/dbraw/zinc/10/80/77/708108077.db2.gz	CXLCCTQLXNOYHE-CYBMUJFWSA-N	1	1	320.393	1.860	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H]2CCC[N@H+](CCF)C2)cccc1[N+](=O)[O-]	ZINC000898494386	708657453	/nfs/dbraw/zinc/65/74/53/708657453.db2.gz	AIERBNDACIWHEI-CQSZACIVSA-N	1	1	323.368	1.996	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H]2CCC[N@@H+](CCF)C2)cccc1[N+](=O)[O-]	ZINC000898494386	708657457	/nfs/dbraw/zinc/65/74/57/708657457.db2.gz	AIERBNDACIWHEI-CQSZACIVSA-N	1	1	323.368	1.996	20	5		DDBDMO
CCC[C@H]1CN(Cc2cccnc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000886099364	708698252	/nfs/dbraw/zinc/69/82/52/708698252.db2.gz	YCOUMOUUFTXCCA-HNNXBMFYSA-N	1	1	322.409	1.923	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593164	708785769	/nfs/dbraw/zinc/78/57/69/708785769.db2.gz	JTLGLSOFOVPAGF-GFCCVEGCSA-N	1	1	323.397	1.439	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593164	708785770	/nfs/dbraw/zinc/78/57/70/708785770.db2.gz	JTLGLSOFOVPAGF-GFCCVEGCSA-N	1	1	323.397	1.439	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C[C@]1(O)CCC[N@@H+](C)C1	ZINC000900160822	709311498	/nfs/dbraw/zinc/31/14/98/709311498.db2.gz	ZUNCBDSAYAKBDW-MRXNPFEDSA-N	1	1	321.377	1.400	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC)C[C@@H]2C)n1	ZINC000910279790	709862581	/nfs/dbraw/zinc/86/25/81/709862581.db2.gz	NCCTXQRPUDQRJA-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C	ZINC000928447860	713201141	/nfs/dbraw/zinc/20/11/41/713201141.db2.gz	AHXPGXYLZZGPRL-TVQRCGJNSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000928459991	713206139	/nfs/dbraw/zinc/20/61/39/713206139.db2.gz	YYGSZSDOSAXUHI-GXFFZTMASA-N	1	1	317.349	1.153	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)CC[N@H+]1C	ZINC000911474176	710813128	/nfs/dbraw/zinc/81/31/28/710813128.db2.gz	KWVNQFSHKFRZSR-PSASIEDQSA-N	1	1	313.304	1.829	20	5		DDBDMO
C[C@H](NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccccc1[N+](=O)[O-]	ZINC000894016735	710928874	/nfs/dbraw/zinc/92/88/74/710928874.db2.gz	VJJCUPAFSPLQEB-RWMBFGLXSA-N	1	1	318.377	1.859	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC000894591674	711199131	/nfs/dbraw/zinc/19/91/31/711199131.db2.gz	TXPXEUKBMSBUSB-UHFFFAOYSA-N	1	1	322.287	1.369	20	5		DDBDMO
C[N@@H+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894886954	711309135	/nfs/dbraw/zinc/30/91/35/711309135.db2.gz	XUXJICKEPUKWKN-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2c3ccccc3ncc2[N+](=O)[O-])C[C@@H]1CO	ZINC000894886954	711309137	/nfs/dbraw/zinc/30/91/37/711309137.db2.gz	XUXJICKEPUKWKN-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-]	ZINC000895161671	711438192	/nfs/dbraw/zinc/43/81/92/711438192.db2.gz	SSVCJEZNNHARQC-NSHDSACASA-N	1	1	316.361	1.953	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-]	ZINC000895161671	711438194	/nfs/dbraw/zinc/43/81/94/711438194.db2.gz	SSVCJEZNNHARQC-NSHDSACASA-N	1	1	316.361	1.953	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000895734804	711590352	/nfs/dbraw/zinc/59/03/52/711590352.db2.gz	AUPOKUSTSAFVKI-MWLCHTKSSA-N	1	1	308.338	1.589	20	5		DDBDMO
Nc1ccc(NC[C@H]2CC[N@H+]2C2CCOCC2)c([N+](=O)[O-])c1	ZINC000896523026	711738000	/nfs/dbraw/zinc/73/80/00/711738000.db2.gz	LYKGNZVNOQOPIZ-CYBMUJFWSA-N	1	1	306.366	1.842	20	5		DDBDMO
O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCN1c1ccc(Cl)c(F)c1	ZINC000905189924	711963486	/nfs/dbraw/zinc/96/34/86/711963486.db2.gz	JNDKNMBRANGKPJ-LLVKDONJSA-N	1	1	301.705	1.451	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000905984564	712209625	/nfs/dbraw/zinc/20/96/25/712209625.db2.gz	NCNNTYGLVNKZES-MXWKQRLJSA-N	1	1	309.370	1.039	20	5		DDBDMO
COc1ccc(CNC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000914300034	713372999	/nfs/dbraw/zinc/37/29/99/713372999.db2.gz	HTEHOWVAIWSVAU-ZYHUDNBSSA-N	1	1	322.365	1.495	20	5		DDBDMO
COC(=O)[C@]1(NCC[N+](=O)[O-])CCC[N@@H+](Cc2ccccc2)C1	ZINC000930151969	713768270	/nfs/dbraw/zinc/76/82/70/713768270.db2.gz	LCIZYEGFWABZKM-INIZCTEOSA-N	1	1	321.377	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](C4OCCO4)C3)nc2c1	ZINC000932001119	714229623	/nfs/dbraw/zinc/22/96/23/714229623.db2.gz	KMJQDXGDKYVTPB-JTQLQIEISA-N	1	1	318.333	1.666	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](C4OCCO4)C3)nc2c1	ZINC000932001119	714229625	/nfs/dbraw/zinc/22/96/25/714229625.db2.gz	KMJQDXGDKYVTPB-JTQLQIEISA-N	1	1	318.333	1.666	20	5		DDBDMO
CC(C)(C)NC(=O)[C@H]1CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000932438781	714331364	/nfs/dbraw/zinc/33/13/64/714331364.db2.gz	UMVWROSVRIQQCO-LLVKDONJSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)(C)NC(=O)[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000932438781	714331366	/nfs/dbraw/zinc/33/13/66/714331366.db2.gz	UMVWROSVRIQQCO-LLVKDONJSA-N	1	1	309.370	1.170	20	5		DDBDMO
COC[C@H]1COCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000933329469	714563856	/nfs/dbraw/zinc/56/38/56/714563856.db2.gz	JCPKNKSIYRPADB-LBPRGKRZSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@H]1COCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000933329469	714563859	/nfs/dbraw/zinc/56/38/59/714563859.db2.gz	JCPKNKSIYRPADB-LBPRGKRZSA-N	1	1	323.349	1.271	20	5		DDBDMO
NC(=O)[C@]12CCC[C@H]1C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C2	ZINC000933760147	714666047	/nfs/dbraw/zinc/66/60/47/714666047.db2.gz	QMHZPWBFYBPASN-LRDDRELGSA-N	1	1	319.361	1.561	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H]1CC[N@H+](CC(C)C)C1	ZINC000934547763	714848410	/nfs/dbraw/zinc/84/84/10/714848410.db2.gz	JEJQFWUGRDZFLK-CYBMUJFWSA-N	1	1	323.397	1.194	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC001164637378	719161069	/nfs/dbraw/zinc/16/10/69/719161069.db2.gz	OKGXOHOZYHVQBG-VHSXEESVSA-N	1	1	308.338	1.305	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000351508211	719250608	/nfs/dbraw/zinc/25/06/08/719250608.db2.gz	GKEJBALPRLSIPC-WDEREUQCSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000351508211	719250609	/nfs/dbraw/zinc/25/06/09/719250609.db2.gz	GKEJBALPRLSIPC-WDEREUQCSA-N	1	1	322.365	1.695	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063605	734368164	/nfs/dbraw/zinc/36/81/64/734368164.db2.gz	FWBWCMDAKVZSON-LYIQGSDWSA-N	1	1	309.391	1.193	20	5		DDBDMO
Cc1cc(CC(=O)NCC[NH2+]Cc2ccc([N+](=O)[O-])cc2)[nH]n1	ZINC001125542684	734451908	/nfs/dbraw/zinc/45/19/08/734451908.db2.gz	UJKJILJPBVVAMD-UHFFFAOYSA-N	1	1	317.349	1.075	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)C1CC1	ZINC001025645505	736808246	/nfs/dbraw/zinc/80/82/46/736808246.db2.gz	ANTHJZMGYYPEKT-FICVDOATSA-N	1	1	301.346	1.551	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775474	736853265	/nfs/dbraw/zinc/85/32/65/736853265.db2.gz	CLHOPWQTGIPTRP-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CCC3CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775474	736853268	/nfs/dbraw/zinc/85/32/68/736853268.db2.gz	CLHOPWQTGIPTRP-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCC3CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775474	736853270	/nfs/dbraw/zinc/85/32/70/736853270.db2.gz	CLHOPWQTGIPTRP-LJIZCISZSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cccc(Cl)c1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932315	742777101	/nfs/dbraw/zinc/77/71/01/742777101.db2.gz	RVGSJGHVXXKQAP-MWLCHTKSSA-N	1	1	315.732	1.350	20	5		DDBDMO
Cc1cccc(Cl)c1C[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936277	742831084	/nfs/dbraw/zinc/83/10/84/742831084.db2.gz	DTKRSNYHPKMXJM-ZWNOBZJWSA-N	1	1	311.769	1.519	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208404	743780522	/nfs/dbraw/zinc/78/05/22/743780522.db2.gz	KBTPCSOUHKYHAL-YPMHNXCESA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000698208404	743780526	/nfs/dbraw/zinc/78/05/26/743780526.db2.gz	KBTPCSOUHKYHAL-YPMHNXCESA-N	1	1	300.742	1.566	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)n1	ZINC001184820537	744108393	/nfs/dbraw/zinc/10/83/93/744108393.db2.gz	MAMYYVNCMNRJTI-LBPRGKRZSA-N	1	1	309.370	1.019	20	5		DDBDMO
CCN(CCNc1ncccc1[N+](=O)[O-])C(=O)C[N@@H+](C)C(C)C	ZINC001106778868	746064867	/nfs/dbraw/zinc/06/48/67/746064867.db2.gz	LEKPZBOCZKFGSY-UHFFFAOYSA-N	1	1	323.397	1.590	20	5		DDBDMO
Cc1ccccc1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000996430048	749588709	/nfs/dbraw/zinc/58/87/09/749588709.db2.gz	YXOXEIMHRPGQQW-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cn1	ZINC001107280245	749725808	/nfs/dbraw/zinc/72/58/08/749725808.db2.gz	KCPOKOSXAZUPNK-PLNGDYQASA-N	1	1	321.381	1.416	20	5		DDBDMO
COC[C@]12CCCO[C@@H]1CC[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169022097	762200775	/nfs/dbraw/zinc/20/07/75/762200775.db2.gz	MUZSECJYXQWMOG-ZJIFWQFVSA-N	1	1	312.410	1.949	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169055295	762209821	/nfs/dbraw/zinc/20/98/21/762209821.db2.gz	PBRHVCPJGUSICP-FRRDWIJNSA-N	1	1	300.355	1.086	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@H+]1[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169055295	762209829	/nfs/dbraw/zinc/20/98/29/762209829.db2.gz	PBRHVCPJGUSICP-FRRDWIJNSA-N	1	1	300.355	1.086	20	5		DDBDMO
C=CC(=O)NCCNc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2	ZINC001169813693	762686105	/nfs/dbraw/zinc/68/61/05/762686105.db2.gz	LPAXNNZLCWGOPP-UHFFFAOYSA-N	1	1	304.350	1.297	20	5		DDBDMO
C=CC(=O)NCCNc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2	ZINC001169813693	762686110	/nfs/dbraw/zinc/68/61/10/762686110.db2.gz	LPAXNNZLCWGOPP-UHFFFAOYSA-N	1	1	304.350	1.297	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1cc2ncnc(Cl)c2cc1[N+](=O)[O-]	ZINC001159783455	771924333	/nfs/dbraw/zinc/92/43/33/771924333.db2.gz	CXGASTJZVZHZHN-LLVKDONJSA-N	1	1	310.745	1.627	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001136444167	771969433	/nfs/dbraw/zinc/96/94/33/771969433.db2.gz	CQCSSZUFUUEYEK-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2ccnc(N)c2[N+](=O)[O-])cc[nH+]1	ZINC001148924741	773651705	/nfs/dbraw/zinc/65/17/05/773651705.db2.gz	XGJGPJUPRYMPAH-UHFFFAOYSA-N	1	1	302.294	1.285	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC001093953310	775261992	/nfs/dbraw/zinc/26/19/92/775261992.db2.gz	WNHZPSIMTMBWJC-UHFFFAOYSA-N	1	1	308.382	1.853	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCCNc1ccc([N+](=O)[O-])cc1	ZINC001094667495	776149301	/nfs/dbraw/zinc/14/93/01/776149301.db2.gz	UEEDLOYTISLGJE-UHFFFAOYSA-N	1	1	317.349	1.718	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)c1	ZINC001171936518	776536346	/nfs/dbraw/zinc/53/63/46/776536346.db2.gz	BKJLBXHVRVZDOR-OCVGTWLNSA-N	1	1	306.362	1.721	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](N2CCOCC2)C1	ZINC001173227588	777062193	/nfs/dbraw/zinc/06/21/93/777062193.db2.gz	RCKIUXRDKGIMCO-WMLDXEAASA-N	1	1	319.405	1.932	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC001116442118	780510155	/nfs/dbraw/zinc/51/01/55/780510155.db2.gz	IHJOAANFQBJTMH-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC001116442118	780510159	/nfs/dbraw/zinc/51/01/59/780510159.db2.gz	IHJOAANFQBJTMH-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1nc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ncc1[N+](=O)[O-]	ZINC001120059083	781741737	/nfs/dbraw/zinc/74/17/37/781741737.db2.gz	CZZSBHCZNFTIBZ-ZYHUDNBSSA-N	1	1	309.395	1.685	20	5		DDBDMO
C[N@H+](CC/C=C\c1ccccc1)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001267194118	837510340	/nfs/dbraw/zinc/51/03/40/837510340.db2.gz	IYRBDORYQRGVDO-PLHDSQEVSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@@H+](CC/C=C\c1ccccc1)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267194118	837510343	/nfs/dbraw/zinc/51/03/43/837510343.db2.gz	IYRBDORYQRGVDO-PLHDSQEVSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@H+](CC/C=C\c1ccccc1)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267194118	837510346	/nfs/dbraw/zinc/51/03/46/837510346.db2.gz	IYRBDORYQRGVDO-PLHDSQEVSA-N	1	1	317.389	1.803	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ncccc1C	ZINC001267314120	837806039	/nfs/dbraw/zinc/80/60/39/837806039.db2.gz	IYILPONPPLJKQM-UKRRQHHQSA-N	1	1	320.393	1.383	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ncccc1C	ZINC001267314120	837806054	/nfs/dbraw/zinc/80/60/54/837806054.db2.gz	IYILPONPPLJKQM-UKRRQHHQSA-N	1	1	320.393	1.383	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ncccc1C	ZINC001267314120	837806068	/nfs/dbraw/zinc/80/60/68/837806068.db2.gz	IYILPONPPLJKQM-UKRRQHHQSA-N	1	1	320.393	1.383	20	5		DDBDMO
CN(CC[NH2+]Cc1cnc(Cl)s1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267371572	837933876	/nfs/dbraw/zinc/93/38/76/837933876.db2.gz	MNURSZIZQRDTLO-RKDXNWHRSA-N	1	1	318.786	1.010	20	5		DDBDMO
O=C(NCC1([NH2+]CCCC2CCC2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001326823795	861633967	/nfs/dbraw/zinc/63/39/67/861633967.db2.gz	ZBCCBIFSBSTDGS-ZIAGYGMSSA-N	1	1	309.410	1.860	20	5		DDBDMO
CC[C@H]1[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021508	850518519	/nfs/dbraw/zinc/51/85/19/850518519.db2.gz	LGKQCJPNRMFIDS-CTASWTNQSA-N	1	1	309.410	1.955	20	5		DDBDMO
COC(=O)c1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc([N+](=O)[O-])c1	ZINC001155892649	862536219	/nfs/dbraw/zinc/53/62/19/862536219.db2.gz	KSKAISRNXXEDDA-ZANVPECISA-N	1	1	321.333	1.204	20	5		DDBDMO
CCC[NH+]1CCC(CCOC)(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001151121704	862636052	/nfs/dbraw/zinc/63/60/52/862636052.db2.gz	QYSAKHNHKFXLPY-CHWSQXEVSA-N	1	1	313.398	1.049	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC001141747794	860927851	/nfs/dbraw/zinc/92/78/51/860927851.db2.gz	IWQQCAPIFBBLQD-WDEREUQCSA-N	1	1	306.322	1.052	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N1CC([NH2+]C2COC2)C1	ZINC001157602329	863966757	/nfs/dbraw/zinc/96/67/57/863966757.db2.gz	WMKWYKCWQNXLCV-UHFFFAOYSA-N	1	1	319.361	1.333	20	5		DDBDMO
O=C(NCCC[NH2+]CCCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775026	864129232	/nfs/dbraw/zinc/12/92/32/864129232.db2.gz	IHBQUDLKNCAOHR-HUUCEWRRSA-N	1	1	305.378	1.380	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ncc([N+](=O)[O-])cc2F)CC[NH2+]C1	ZINC001159453193	865311657	/nfs/dbraw/zinc/31/16/57/865311657.db2.gz	UXFJSINVSWAWSX-UHFFFAOYSA-N	1	1	310.285	1.351	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCSCC[NH+]1CCOCC1	ZINC001332260793	865703806	/nfs/dbraw/zinc/70/38/06/865703806.db2.gz	GRTKXCGSSRHYQM-UHFFFAOYSA-N	1	1	300.384	1.165	20	5		DDBDMO
COc1ncc([N+](=O)[O-])cc1NCCC[NH+]1CCN(C)CC1	ZINC001161708751	866918583	/nfs/dbraw/zinc/91/85/83/866918583.db2.gz	VCAXGHLYYVUIGU-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
O=C(NC/C=C\C[NH2+]CCc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001321057400	867271062	/nfs/dbraw/zinc/27/10/62/867271062.db2.gz	OQSCBMQGSPHXRD-ZYDHHDLOSA-N	1	1	303.362	1.156	20	5		DDBDMO
Cc1ncc(Nc2cc(C=C[NH+](C)C)c([N+](=O)[O-])cn2)c(=O)[nH]1	ZINC001162303600	867428100	/nfs/dbraw/zinc/42/81/00/867428100.db2.gz	VUIRFZBACHRLPY-ZWNMCFTASA-N	1	1	316.321	1.332	20	5		DDBDMO
CC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001162810297	867844246	/nfs/dbraw/zinc/84/42/46/867844246.db2.gz	IODISMHMRDBBSU-HUUCEWRRSA-N	1	1	305.378	1.332	20	5		DDBDMO
Cc1ccnc(N2CC([C@@H]([NH3+])C(=O)OC(C)(C)C)C2)c1[N+](=O)[O-]	ZINC001163118339	868117420	/nfs/dbraw/zinc/11/74/20/868117420.db2.gz	XERMYRYPQFVLCW-LLVKDONJSA-N	1	1	322.365	1.403	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001298876749	870762983	/nfs/dbraw/zinc/76/29/83/870762983.db2.gz	ZPSQURFKPPTVOZ-QMMMGPOBSA-N	1	1	317.777	1.822	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC001339998976	870829026	/nfs/dbraw/zinc/82/90/26/870829026.db2.gz	LEMQLKCQLXUNRB-MVWJERBFSA-N	1	1	320.349	1.529	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cc[nH]c1)Cc1cccc([N+](=O)[O-])c1	ZINC001317446574	870849102	/nfs/dbraw/zinc/84/91/02/870849102.db2.gz	FJSCICARUGYEBC-UHFFFAOYSA-N	1	1	302.334	1.785	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc[nH]c1)Cc1cccc([N+](=O)[O-])c1	ZINC001317446574	870849117	/nfs/dbraw/zinc/84/91/17/870849117.db2.gz	FJSCICARUGYEBC-UHFFFAOYSA-N	1	1	302.334	1.785	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC001340124498	870907317	/nfs/dbraw/zinc/90/73/17/870907317.db2.gz	TXWUGSXWXVWOAL-NWDGAFQWSA-N	1	1	310.402	1.412	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H](CO)[C@H](CCO)C2)cc1[N+](=O)[O-]	ZINC001308164982	871475550	/nfs/dbraw/zinc/47/55/50/871475550.db2.gz	WWGLQOVHGPDMKT-OLZOCXBDSA-N	1	1	310.350	1.026	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](CO)[C@@H](CCO)C2)cc1Cl	ZINC001308983841	871544524	/nfs/dbraw/zinc/54/45/24/871544524.db2.gz	UYLYCMNRPSDHLG-NWDGAFQWSA-N	1	1	314.769	1.671	20	5		DDBDMO
COc1c(O)ccc(CN2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001342829736	872404939	/nfs/dbraw/zinc/40/49/39/872404939.db2.gz	LSUYWYYWQDIBSO-CYBMUJFWSA-N	1	1	321.377	1.979	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC001347503989	874163234	/nfs/dbraw/zinc/16/32/34/874163234.db2.gz	PPNMNHXEMRCNDF-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC001354400843	877953709	/nfs/dbraw/zinc/95/37/09/877953709.db2.gz	LZAATGFZRANWCD-YNEHKIRRSA-N	1	1	318.377	1.707	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1CO[C@@H]1CCC[N@@H+](C)C1	ZINC001223449782	880966572	/nfs/dbraw/zinc/96/65/72/880966572.db2.gz	GWXQBQGLCCMOPE-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COc1cccc(CO[C@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC001223809724	881107272	/nfs/dbraw/zinc/10/72/72/881107272.db2.gz	VIOQLILNTARDKQ-GFCCVEGCSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+](C)CCN1CCN(C)CC1	ZINC001254558336	896501055	/nfs/dbraw/zinc/50/10/55/896501055.db2.gz	FSMRHXREEQUEGL-HNNXBMFYSA-N	1	1	320.437	1.705	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C)CCN1CCN(C)CC1	ZINC001254558336	896501066	/nfs/dbraw/zinc/50/10/66/896501066.db2.gz	FSMRHXREEQUEGL-HNNXBMFYSA-N	1	1	320.437	1.705	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565879	896505405	/nfs/dbraw/zinc/50/54/05/896505405.db2.gz	QUFBCPSGGQNBAJ-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565879	896505411	/nfs/dbraw/zinc/50/54/11/896505411.db2.gz	QUFBCPSGGQNBAJ-DOMZBBRYSA-N	1	1	321.377	1.315	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC001262706584	900321266	/nfs/dbraw/zinc/32/12/66/900321266.db2.gz	SSPNFSXACKJXPX-UHFFFAOYSA-N	1	1	322.409	1.909	20	5		DDBDMO
CC[C@@]1(C)C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248985855	282123928	/nfs/dbraw/zinc/12/39/28/282123928.db2.gz	WGWXTUYPBZTOOJ-CJNGLKHVSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248985855	282123934	/nfs/dbraw/zinc/12/39/34/282123934.db2.gz	WGWXTUYPBZTOOJ-CJNGLKHVSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000495218714	529441451	/nfs/dbraw/zinc/44/14/51/529441451.db2.gz	GHSJYZBGIVUXMP-HNNXBMFYSA-N	1	1	310.350	1.829	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000452106357	231303859	/nfs/dbraw/zinc/30/38/59/231303859.db2.gz	ZZRYPORAAGHOSH-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000452106357	231303861	/nfs/dbraw/zinc/30/38/61/231303861.db2.gz	ZZRYPORAAGHOSH-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000452114903	231307449	/nfs/dbraw/zinc/30/74/49/231307449.db2.gz	AZEPGPYCJNQKSG-JTQLQIEISA-N	1	1	315.320	1.371	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000452114903	231307452	/nfs/dbraw/zinc/30/74/52/231307452.db2.gz	AZEPGPYCJNQKSG-JTQLQIEISA-N	1	1	315.320	1.371	20	5		DDBDMO
CC(C)C[C@@H]1COCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090549254	185302368	/nfs/dbraw/zinc/30/23/68/185302368.db2.gz	NQWBLBJJQMGUKX-CQSZACIVSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC(C)C[C@@H]1COCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090549254	185302369	/nfs/dbraw/zinc/30/23/69/185302369.db2.gz	NQWBLBJJQMGUKX-CQSZACIVSA-N	1	1	309.366	1.503	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O	ZINC000305806500	529984068	/nfs/dbraw/zinc/98/40/68/529984068.db2.gz	KCGGJXJDSFVEFN-DZGCQCFKSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000458169030	530054498	/nfs/dbraw/zinc/05/44/98/530054498.db2.gz	FBKNZZLLWRYHIR-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000358474128	299164998	/nfs/dbraw/zinc/16/49/98/299164998.db2.gz	UCULEDQHGCUWLU-CQSZACIVSA-N	1	1	308.338	1.091	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1	ZINC000459592476	233346047	/nfs/dbraw/zinc/34/60/47/233346047.db2.gz	UOZXUZOCPZUJGE-HNNXBMFYSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1	ZINC000459592476	233346057	/nfs/dbraw/zinc/34/60/57/233346057.db2.gz	UOZXUZOCPZUJGE-HNNXBMFYSA-N	1	1	324.381	1.882	20	5		DDBDMO
C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)C[NH+]1CCOCC1	ZINC000150713050	186059151	/nfs/dbraw/zinc/05/91/51/186059151.db2.gz	JEZKURJDINMBPA-CYBMUJFWSA-N	1	1	321.377	1.222	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000155667436	186101238	/nfs/dbraw/zinc/10/12/38/186101238.db2.gz	SMHJSAAFXPYIHT-NSHDSACASA-N	1	1	322.365	1.403	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000155698523	186104600	/nfs/dbraw/zinc/10/46/00/186104600.db2.gz	QIDCXTLBTPEKTI-OCCSQVGLSA-N	1	1	305.378	1.982	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C	ZINC000617353011	363067240	/nfs/dbraw/zinc/06/72/40/363067240.db2.gz	AOULUCJRNYPYKT-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)C[C@@H]1C	ZINC000617353011	363067241	/nfs/dbraw/zinc/06/72/41/363067241.db2.gz	AOULUCJRNYPYKT-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000047268316	352488467	/nfs/dbraw/zinc/48/84/67/352488467.db2.gz	JNTCTNCQJGDGEI-HUUCEWRRSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NCC1([NH+]2CCCCC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000047295363	352489440	/nfs/dbraw/zinc/48/94/40/352489440.db2.gz	BQBZVMXICACNEW-KGLIPLIRSA-N	1	1	309.410	1.957	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000057159505	352802135	/nfs/dbraw/zinc/80/21/35/352802135.db2.gz	FHZDBNUAPGHFAN-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000058276454	352841378	/nfs/dbraw/zinc/84/13/78/352841378.db2.gz	IFIPFSOOIMOGSN-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000075783736	353379573	/nfs/dbraw/zinc/37/95/73/353379573.db2.gz	HIAOAKKLAKTIJL-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000075783736	353379575	/nfs/dbraw/zinc/37/95/75/353379575.db2.gz	HIAOAKKLAKTIJL-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000174651295	198365425	/nfs/dbraw/zinc/36/54/25/198365425.db2.gz	AKYRBIGCARJOHW-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000174657040	198366487	/nfs/dbraw/zinc/36/64/87/198366487.db2.gz	AQCXSAHEEAAVIC-ONGXEEELSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078620886	353525144	/nfs/dbraw/zinc/52/51/44/353525144.db2.gz	YYPQVGHWWICMHI-LLVKDONJSA-N	1	1	314.345	1.808	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078620886	353525149	/nfs/dbraw/zinc/52/51/49/353525149.db2.gz	YYPQVGHWWICMHI-LLVKDONJSA-N	1	1	314.345	1.808	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C)n2)[C@@H](C)C1	ZINC000089265368	353763304	/nfs/dbraw/zinc/76/33/04/353763304.db2.gz	YSDDPTQTPYYISZ-NSHDSACASA-N	1	1	322.365	1.372	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000093332557	353895750	/nfs/dbraw/zinc/89/57/50/353895750.db2.gz	CTVDNZOZQZCBST-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000093332557	353895752	/nfs/dbraw/zinc/89/57/52/353895752.db2.gz	CTVDNZOZQZCBST-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC(C)(C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1)n1cc([N+](=O)[O-])cn1	ZINC000108298395	353949424	/nfs/dbraw/zinc/94/94/24/353949424.db2.gz	BDQWAIYUVUKWCM-LBPRGKRZSA-N	1	1	321.381	1.127	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1	ZINC000141332026	354139646	/nfs/dbraw/zinc/13/96/46/354139646.db2.gz	XGBODVFMKSORMP-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=[N+]([O-])c1c(N2CCC[N@H+]3CCC[C@@H]3C2)nc2sccn21	ZINC000142898104	354146890	/nfs/dbraw/zinc/14/68/90/354146890.db2.gz	SYNGYWOYZZWHLP-SNVBAGLBSA-N	1	1	307.379	1.979	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000156827093	354222466	/nfs/dbraw/zinc/22/24/66/354222466.db2.gz	SHGWGBVPXFSMOK-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000156827093	354222472	/nfs/dbraw/zinc/22/24/72/354222472.db2.gz	SHGWGBVPXFSMOK-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000157689903	354227035	/nfs/dbraw/zinc/22/70/35/354227035.db2.gz	XJFLPXCFSXWLHF-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000157689903	354227038	/nfs/dbraw/zinc/22/70/38/354227038.db2.gz	XJFLPXCFSXWLHF-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[N@@H+](C[C@@H](O)C1CC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000305708928	354470636	/nfs/dbraw/zinc/47/06/36/354470636.db2.gz	FJOOCMTZJGLBQH-LSDHHAIUSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000586801864	354868361	/nfs/dbraw/zinc/86/83/61/354868361.db2.gz	XVBVFEXILPNFQE-LBPRGKRZSA-N	1	1	301.306	1.234	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000586801864	354868363	/nfs/dbraw/zinc/86/83/63/354868363.db2.gz	XVBVFEXILPNFQE-LBPRGKRZSA-N	1	1	301.306	1.234	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+]([C@H]2CCOC2)CC1	ZINC000588823605	354939345	/nfs/dbraw/zinc/93/93/45/354939345.db2.gz	LDXZRTJOCAWLMB-LBPRGKRZSA-N	1	1	309.370	1.031	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)C[N@H+]1C1CC1	ZINC000589584114	355002332	/nfs/dbraw/zinc/00/23/32/355002332.db2.gz	GCANXYHTCVQIKG-BXKDBHETSA-N	1	1	306.366	1.706	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H]2C[N@H+](C)C[C@@H]21	ZINC000590010689	355040765	/nfs/dbraw/zinc/04/07/65/355040765.db2.gz	OTTZBKPGGDFLLC-OCCSQVGLSA-N	1	1	318.377	1.478	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](O)CC2)c1	ZINC000590381710	355079154	/nfs/dbraw/zinc/07/91/54/355079154.db2.gz	BPEMHNDWXHCBLU-ZDUSSCGKSA-N	1	1	308.334	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](O)CC2)c1	ZINC000590381710	355079155	/nfs/dbraw/zinc/07/91/55/355079155.db2.gz	BPEMHNDWXHCBLU-ZDUSSCGKSA-N	1	1	308.334	1.728	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000590402429	355085330	/nfs/dbraw/zinc/08/53/30/355085330.db2.gz	UCFTWWSWWZLAFS-LSDHHAIUSA-N	1	1	319.361	1.530	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H](C)N1CC[NH+](C)CC1	ZINC000590550117	355110888	/nfs/dbraw/zinc/11/08/88/355110888.db2.gz	MFVMWJNHCAXSDI-CYBMUJFWSA-N	1	1	320.393	1.786	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590443376	355097886	/nfs/dbraw/zinc/09/78/86/355097886.db2.gz	IMZHFRHEEDPNJG-SMDDNHRTSA-N	1	1	305.334	1.136	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000590447663	355099138	/nfs/dbraw/zinc/09/91/38/355099138.db2.gz	ZRENJKZSRAHWEG-ZWNOBZJWSA-N	1	1	305.334	1.380	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C[C@H](C)C2)c1	ZINC000590663891	355140190	/nfs/dbraw/zinc/14/01/90/355140190.db2.gz	ACEIBRIHMVWEFY-GXFFZTMASA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C[C@H](C)C2)c1	ZINC000590663891	355140191	/nfs/dbraw/zinc/14/01/91/355140191.db2.gz	ACEIBRIHMVWEFY-GXFFZTMASA-N	1	1	308.334	1.584	20	5		DDBDMO
CN1C[C@@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591037766	355237000	/nfs/dbraw/zinc/23/70/00/355237000.db2.gz	ZMZDFWANZDYMPK-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591037766	355237001	/nfs/dbraw/zinc/23/70/01/355237001.db2.gz	ZMZDFWANZDYMPK-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591037766	355237003	/nfs/dbraw/zinc/23/70/03/355237003.db2.gz	ZMZDFWANZDYMPK-SWLSCSKDSA-N	1	1	318.377	1.559	20	5		DDBDMO
[NH3+]CC[C@H]1CCCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000592432154	355581661	/nfs/dbraw/zinc/58/16/61/355581661.db2.gz	GKNPKCTXDUTKPH-GFCCVEGCSA-N	1	1	321.377	1.927	20	5		DDBDMO
CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000593066441	355785412	/nfs/dbraw/zinc/78/54/12/355785412.db2.gz	DFIKAPDUOUSECX-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000593168846	355815836	/nfs/dbraw/zinc/81/58/36/355815836.db2.gz	YGVIKRHCJINUQZ-RISCZKNCSA-N	1	1	307.325	1.439	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593392998	355871071	/nfs/dbraw/zinc/87/10/71/355871071.db2.gz	XNIDTGJGLDMQFM-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[C@H](O)C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000594055359	356101724	/nfs/dbraw/zinc/10/17/24/356101724.db2.gz	KZDXKESHWMJTCX-FZMZJTMJSA-N	1	1	310.350	1.180	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594419784	356204382	/nfs/dbraw/zinc/20/43/82/356204382.db2.gz	RLEVQTSVLOLULK-CHWSQXEVSA-N	1	1	318.377	1.924	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594575372	356253173	/nfs/dbraw/zinc/25/31/73/356253173.db2.gz	FJBRDEJNUGYGRL-GFCCVEGCSA-N	1	1	324.381	1.280	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594575372	356253174	/nfs/dbraw/zinc/25/31/74/356253174.db2.gz	FJBRDEJNUGYGRL-GFCCVEGCSA-N	1	1	324.381	1.280	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000080780351	192189860	/nfs/dbraw/zinc/18/98/60/192189860.db2.gz	ZNQHXRHTGUZMRC-ZDUSSCGKSA-N	1	1	322.365	1.515	20	5		DDBDMO
C[C@@H]1CN(CC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C[C@@H](C)O1	ZINC000595421670	356485539	/nfs/dbraw/zinc/48/55/39/356485539.db2.gz	AHJRNGNZACRKRO-CHWSQXEVSA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@@H]1CN(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C[C@@H](C)O1	ZINC000595421670	356485540	/nfs/dbraw/zinc/48/55/40/356485540.db2.gz	AHJRNGNZACRKRO-CHWSQXEVSA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@@H]1C[NH+](CCN2CCc3ncc([N+](=O)[O-])cc3C2)C[C@@H](C)O1	ZINC000595421670	356485544	/nfs/dbraw/zinc/48/55/44/356485544.db2.gz	AHJRNGNZACRKRO-CHWSQXEVSA-N	1	1	320.393	1.457	20	5		DDBDMO
CC(=O)NC1CCC([N@H+](C)Cc2onc(C)c2[N+](=O)[O-])CC1	ZINC000595422990	356486922	/nfs/dbraw/zinc/48/69/22/356486922.db2.gz	CVUORYNURVLJFG-UHFFFAOYSA-N	1	1	310.354	1.770	20	5		DDBDMO
CC(=O)NC1CCC([N@@H+](C)Cc2onc(C)c2[N+](=O)[O-])CC1	ZINC000595422990	356486925	/nfs/dbraw/zinc/48/69/25/356486925.db2.gz	CVUORYNURVLJFG-UHFFFAOYSA-N	1	1	310.354	1.770	20	5		DDBDMO
COC[C@@H](C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)OC	ZINC000595370249	356468334	/nfs/dbraw/zinc/46/83/34/356468334.db2.gz	FYIHJIZBXWPYNJ-DGCLKSJQSA-N	1	1	310.354	1.137	20	5		DDBDMO
C[C@@H]1C[NH+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H](C)C1O	ZINC000595743751	356631557	/nfs/dbraw/zinc/63/15/57/356631557.db2.gz	QEGNBLJETLHARO-NXEZZACHSA-N	1	1	304.350	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@@H]3CNCCO3)CC2)cc1	ZINC000595886664	356692430	/nfs/dbraw/zinc/69/24/30/356692430.db2.gz	XXCBFFJEUDUMQH-INIZCTEOSA-N	1	1	321.377	1.426	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@@H](C(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000276929788	213183076	/nfs/dbraw/zinc/18/30/76/213183076.db2.gz	QRGANFWWAHQVPT-CYBMUJFWSA-N	1	1	321.377	1.952	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2c(Cl)cncc2[N+](=O)[O-])n1C	ZINC000596126277	356783381	/nfs/dbraw/zinc/78/33/81/356783381.db2.gz	LRUWHJUQPNJWIX-UHFFFAOYSA-N	1	1	310.745	1.477	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000596334536	356860188	/nfs/dbraw/zinc/86/01/88/356860188.db2.gz	BIOMOBGIIRDYHU-VIFPVBQESA-N	1	1	307.354	1.373	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(F)c1	ZINC000596541540	356911899	/nfs/dbraw/zinc/91/18/99/356911899.db2.gz	ZAAYMVWAURILDP-GFCCVEGCSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c(F)c1	ZINC000596541541	356911977	/nfs/dbraw/zinc/91/19/77/356911977.db2.gz	ZAAYMVWAURILDP-LBPRGKRZSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@H]3COC[C@H]3C1)OCCO2	ZINC000597231770	357103632	/nfs/dbraw/zinc/10/36/32/357103632.db2.gz	QPCOVUIOGUDPJM-WCQYABFASA-N	1	1	320.345	1.834	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000597854821	357359345	/nfs/dbraw/zinc/35/93/45/357359345.db2.gz	MSPQBEOXKBEUHW-NSHDSACASA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C(C)(C)C	ZINC000597856849	357360506	/nfs/dbraw/zinc/36/05/06/357360506.db2.gz	BGSWDXBDZTZFEG-LLVKDONJSA-N	1	1	306.366	1.901	20	5		DDBDMO
C[C@H]1CC(F)(F)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000599623365	357995829	/nfs/dbraw/zinc/99/58/29/357995829.db2.gz	OXUUFODZMDMABX-ONGXEEELSA-N	1	1	304.297	1.272	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599673860	358019768	/nfs/dbraw/zinc/01/97/68/358019768.db2.gz	UMVSMCHSTQPNLN-COPLHBTASA-N	1	1	307.350	1.625	20	5		DDBDMO
CCOc1ccc([C@H](C)NC[C@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000600710232	358290819	/nfs/dbraw/zinc/29/08/19/358290819.db2.gz	MUAJAHXTJXTOAZ-AAEUAGOBSA-N	1	1	309.366	1.633	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000358914485	299279565	/nfs/dbraw/zinc/27/95/65/299279565.db2.gz	JIPASOZBPDUOSD-LLVKDONJSA-N	1	1	311.386	1.013	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC(CC)([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000601791877	358697270	/nfs/dbraw/zinc/69/72/70/358697270.db2.gz	OYCZWKBUIMMUOR-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1	ZINC000602840647	359230251	/nfs/dbraw/zinc/23/02/51/359230251.db2.gz	OUWDMTLVKNLHCK-LSDHHAIUSA-N	1	1	322.409	1.973	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1	ZINC000602801071	359202026	/nfs/dbraw/zinc/20/20/26/359202026.db2.gz	LFFDODLLVLXTAS-CHWSQXEVSA-N	1	1	310.398	1.829	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@H]2CCC[C@H]21	ZINC000602914521	359291428	/nfs/dbraw/zinc/29/14/28/359291428.db2.gz	FVRMCLBWQQTHKO-XQQFMLRXSA-N	1	1	322.365	1.492	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])[C@H]2CCC[C@H]21	ZINC000602914521	359291434	/nfs/dbraw/zinc/29/14/34/359291434.db2.gz	FVRMCLBWQQTHKO-XQQFMLRXSA-N	1	1	322.365	1.492	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H]2C[C@@]2(O)C1	ZINC000603089708	359395937	/nfs/dbraw/zinc/39/59/37/359395937.db2.gz	SRIRMYCVPHLTPX-IAQYHMDHSA-N	1	1	305.334	1.298	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@@H]3C[C@]3(O)C2)cccc1[N+](=O)[O-]	ZINC000603092735	359397617	/nfs/dbraw/zinc/39/76/17/359397617.db2.gz	YYXJFDPNFUAGRE-NHYWBVRUSA-N	1	1	305.334	1.298	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1	ZINC000186836259	200019311	/nfs/dbraw/zinc/01/93/11/200019311.db2.gz	CQBSLXVHWXBGCE-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
CCO[C@@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000604436833	359750615	/nfs/dbraw/zinc/75/06/15/359750615.db2.gz	ASQVPBYQBVPZDN-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
[NH3+]C[C@@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237848319	202369329	/nfs/dbraw/zinc/36/93/29/202369329.db2.gz	BTVIADQPPLBWSP-JTQLQIEISA-N	1	1	303.322	1.425	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](CCO)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188704541	200291342	/nfs/dbraw/zinc/29/13/42/200291342.db2.gz	FWUUQNGPLJLNFO-LLVKDONJSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188704541	200291343	/nfs/dbraw/zinc/29/13/43/200291343.db2.gz	FWUUQNGPLJLNFO-LLVKDONJSA-N	1	1	307.350	1.042	20	5		DDBDMO
COCC[NH+](CCOC)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000610580893	360476132	/nfs/dbraw/zinc/47/61/32/360476132.db2.gz	VYOXURHNJPJSOZ-UHFFFAOYSA-N	1	1	309.322	1.831	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNc2nc(N3CCOCC3)cc[nH+]2)c1	ZINC000610908851	360570392	/nfs/dbraw/zinc/57/03/92/360570392.db2.gz	OATVQMZCXANKAZ-UHFFFAOYSA-N	1	1	315.333	1.834	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@@H]1C	ZINC000611088479	360619944	/nfs/dbraw/zinc/61/99/44/360619944.db2.gz	YXKGVFQFWIPSRX-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@@H]1C	ZINC000611088479	360619951	/nfs/dbraw/zinc/61/99/51/360619951.db2.gz	YXKGVFQFWIPSRX-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000611088442	360620071	/nfs/dbraw/zinc/62/00/71/360620071.db2.gz	WMJPJUZVFDQFGO-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000611088442	360620075	/nfs/dbraw/zinc/62/00/75/360620075.db2.gz	WMJPJUZVFDQFGO-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[N@H+]1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611092123	360621493	/nfs/dbraw/zinc/62/14/93/360621493.db2.gz	JFIFQSJQYSRZOS-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000611211031	360661216	/nfs/dbraw/zinc/66/12/16/360661216.db2.gz	HDJFWTHBGXEURE-NSHDSACASA-N	1	1	307.354	1.122	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000611528069	360749309	/nfs/dbraw/zinc/74/93/09/360749309.db2.gz	BPJFSVPSCRHTDX-LLVKDONJSA-N	1	1	304.350	1.391	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H](C(F)F)C1	ZINC000612110343	360923029	/nfs/dbraw/zinc/92/30/29/360923029.db2.gz	DLVXILPDBGJFGS-GHMZBOCLSA-N	1	1	316.304	1.922	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000194012711	201161894	/nfs/dbraw/zinc/16/18/94/201161894.db2.gz	HZYXTACCUJKJDT-VHSXEESVSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000194012711	201161896	/nfs/dbraw/zinc/16/18/96/201161896.db2.gz	HZYXTACCUJKJDT-VHSXEESVSA-N	1	1	313.379	1.183	20	5		DDBDMO
Cc1cnc(N[C@@H](C)CC[NH+]2CCN(C)CC2)c([N+](=O)[O-])c1	ZINC000613704767	361526272	/nfs/dbraw/zinc/52/62/72/361526272.db2.gz	QVCFDZNISCOOPR-ZDUSSCGKSA-N	1	1	307.398	1.736	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH+]1CC([C@H]3CCOC3)C1)OCCO2	ZINC000619432131	364006395	/nfs/dbraw/zinc/00/63/95/364006395.db2.gz	CWAGQAMVXFYJCW-NSHDSACASA-N	1	1	320.345	1.834	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)NCc1ccc([N+](=O)[O-])cc1	ZINC000264773539	204145408	/nfs/dbraw/zinc/14/54/08/204145408.db2.gz	AQDXTXJTPPWJKY-UHFFFAOYSA-N	1	1	324.406	1.443	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[NH+](C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000265095352	204392324	/nfs/dbraw/zinc/39/23/24/204392324.db2.gz	VIHGRXDACBLQKP-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCS(=O)(=O)C1	ZINC000282557542	217086873	/nfs/dbraw/zinc/08/68/73/217086873.db2.gz	XWOLDAFXJICKFO-ZDUSSCGKSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCS(=O)(=O)C1	ZINC000282557542	217086875	/nfs/dbraw/zinc/08/68/75/217086875.db2.gz	XWOLDAFXJICKFO-ZDUSSCGKSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H](c2ccccc2)C1	ZINC000351486021	284336397	/nfs/dbraw/zinc/33/63/97/284336397.db2.gz	LTSBOBKVIUSAIH-HIFRSBDPSA-N	1	1	314.345	1.751	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000266099725	205097889	/nfs/dbraw/zinc/09/78/89/205097889.db2.gz	RFXWJJIJUQMSPJ-UHFFFAOYSA-N	1	1	306.326	1.341	20	5		DDBDMO
Cc1ccccc1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266436983	205344447	/nfs/dbraw/zinc/34/44/47/205344447.db2.gz	LVXSNFQHHQQYSF-OAHLLOKOSA-N	1	1	304.350	1.593	20	5		DDBDMO
O=c1c([N+](=O)[O-])cc(Cl)cn1CCC[NH+]1CCOCC1	ZINC000158525133	248310817	/nfs/dbraw/zinc/31/08/17/248310817.db2.gz	VPEKMTFFIJUEBA-UHFFFAOYSA-N	1	1	301.730	1.132	20	5		DDBDMO
Cc1ccc(CN2CCO[C@@H]3CC[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000284719171	218148856	/nfs/dbraw/zinc/14/88/56/218148856.db2.gz	UTHHUGJRDMOMSA-HZPDHXFCSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@H](O)C[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000159482432	197356526	/nfs/dbraw/zinc/35/65/26/197356526.db2.gz	JINJVWZMNLFTIV-IUCAKERBSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000159482432	197356528	/nfs/dbraw/zinc/35/65/28/197356528.db2.gz	JINJVWZMNLFTIV-IUCAKERBSA-N	1	1	315.757	1.888	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000105824060	194137695	/nfs/dbraw/zinc/13/76/95/194137695.db2.gz	HAKDHCBKAAFMLC-CHWSQXEVSA-N	1	1	307.394	1.790	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000340967282	251308168	/nfs/dbraw/zinc/30/81/68/251308168.db2.gz	APIIOZLTLMXDTA-NSHDSACASA-N	1	1	304.350	1.360	20	5		DDBDMO
CCNC(=O)NC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000064350394	184295238	/nfs/dbraw/zinc/29/52/38/184295238.db2.gz	SNIOBYMUSPNTLA-UHFFFAOYSA-N	1	1	322.365	1.651	20	5		DDBDMO
CCNC(=O)NC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000064350394	184295239	/nfs/dbraw/zinc/29/52/39/184295239.db2.gz	SNIOBYMUSPNTLA-UHFFFAOYSA-N	1	1	322.365	1.651	20	5		DDBDMO
CO[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCC2	ZINC000451864618	532954018	/nfs/dbraw/zinc/95/40/18/532954018.db2.gz	ZXEVRKUAACTEAM-UONOGXRCSA-N	1	1	321.377	1.646	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000120213922	195120742	/nfs/dbraw/zinc/12/07/42/195120742.db2.gz	WIEOXRWJQMJDIS-UHFFFAOYSA-N	1	1	317.349	1.725	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000352590973	285161552	/nfs/dbraw/zinc/16/15/52/285161552.db2.gz	PPLSADPEGVGDJS-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000155319552	197043816	/nfs/dbraw/zinc/04/38/16/197043816.db2.gz	DKHJMEZFAGKRKW-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)CCn3cc([N+](=O)[O-])cn3)CC[C@@H]21	ZINC000154904284	197003940	/nfs/dbraw/zinc/00/39/40/197003940.db2.gz	VYMZUZPTLAMBIX-JSGCOSHPSA-N	1	1	321.381	1.124	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000154978643	197010115	/nfs/dbraw/zinc/01/01/15/197010115.db2.gz	PZBGMYSZOMRBKO-JTQLQIEISA-N	1	1	323.349	1.309	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000154978643	197010117	/nfs/dbraw/zinc/01/01/17/197010117.db2.gz	PZBGMYSZOMRBKO-JTQLQIEISA-N	1	1	323.349	1.309	20	5		DDBDMO
C[N@@H+](CCCNC(=O)Cn1ccc([N+](=O)[O-])n1)C1CCCCC1	ZINC000121742748	195338163	/nfs/dbraw/zinc/33/81/63/195338163.db2.gz	HGOMBYAORYGIPR-UHFFFAOYSA-N	1	1	323.397	1.562	20	5		DDBDMO
COC(=O)CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072664937	406884088	/nfs/dbraw/zinc/88/40/88/406884088.db2.gz	POUOZFKHKUONEC-LLVKDONJSA-N	1	1	308.338	1.429	20	5		DDBDMO
CN(C(=O)C[N@H+](C)C[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1	ZINC000076299269	406962343	/nfs/dbraw/zinc/96/23/43/406962343.db2.gz	RICJNQHBPFZCQZ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1	ZINC000076299269	406962346	/nfs/dbraw/zinc/96/23/46/406962346.db2.gz	RICJNQHBPFZCQZ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000078622690	407036648	/nfs/dbraw/zinc/03/66/48/407036648.db2.gz	XXDYVOIBKKEDOD-UHFFFAOYSA-N	1	1	314.345	1.289	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078621142	407036910	/nfs/dbraw/zinc/03/69/10/407036910.db2.gz	JFWPYRGKIRQXAU-LLVKDONJSA-N	1	1	314.345	1.808	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078621142	407036913	/nfs/dbraw/zinc/03/69/13/407036913.db2.gz	JFWPYRGKIRQXAU-LLVKDONJSA-N	1	1	314.345	1.808	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CC2)CC1	ZINC000061604584	407228858	/nfs/dbraw/zinc/22/88/58/407228858.db2.gz	JSEDJZATEXNZCO-UHFFFAOYSA-N	1	1	319.361	1.670	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[NH+](C3CC3)CC2)c(C)c1[N+](=O)[O-]	ZINC000102341156	407322005	/nfs/dbraw/zinc/32/20/05/407322005.db2.gz	DUSLWFPPUQNIKY-UHFFFAOYSA-N	1	1	321.381	1.105	20	5		DDBDMO
CC[NH+]1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000067374425	407272202	/nfs/dbraw/zinc/27/22/02/407272202.db2.gz	VWAXVGFLZLBVPT-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000124569575	407362392	/nfs/dbraw/zinc/36/23/92/407362392.db2.gz	SGFUAXNSFBZDOJ-HNNXBMFYSA-N	1	1	310.350	1.829	20	5		DDBDMO
C[NH+](C)C[C@@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000114478672	407580392	/nfs/dbraw/zinc/58/03/92/407580392.db2.gz	JRIXGMMSFXWKNJ-ZDUSSCGKSA-N	1	1	320.393	1.807	20	5		DDBDMO
CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC(C)(C)O	ZINC000114487334	407584322	/nfs/dbraw/zinc/58/43/22/407584322.db2.gz	BLCJKNSWSXUTEX-UHFFFAOYSA-N	1	1	309.366	1.650	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000114062255	407534444	/nfs/dbraw/zinc/53/44/44/407534444.db2.gz	WZIMANYCLBZJTG-LLVKDONJSA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000114062255	407534453	/nfs/dbraw/zinc/53/44/53/407534453.db2.gz	WZIMANYCLBZJTG-LLVKDONJSA-N	1	1	323.349	1.583	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271357147	407650286	/nfs/dbraw/zinc/65/02/86/407650286.db2.gz	FVTFYVODFCOMRK-LBPRGKRZSA-N	1	1	323.397	1.426	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](CO)C1	ZINC000266922691	407677489	/nfs/dbraw/zinc/67/74/89/407677489.db2.gz	MIOJDRXESDLHHN-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000186755923	407765096	/nfs/dbraw/zinc/76/50/96/407765096.db2.gz	HKYPRQOCVOWYLG-NSHDSACASA-N	1	1	321.381	1.566	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000117292038	407822866	/nfs/dbraw/zinc/82/28/66/407822866.db2.gz	ASLBAUYKPXHBIM-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000117292038	407822877	/nfs/dbraw/zinc/82/28/77/407822877.db2.gz	ASLBAUYKPXHBIM-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000187132355	407826020	/nfs/dbraw/zinc/82/60/20/407826020.db2.gz	WRSBLYZEZHGEOI-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000187132355	407826028	/nfs/dbraw/zinc/82/60/28/407826028.db2.gz	WRSBLYZEZHGEOI-LLVKDONJSA-N	1	1	308.338	1.125	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000133550278	407855701	/nfs/dbraw/zinc/85/57/01/407855701.db2.gz	YXRJVUHWJAOUHU-JQWIXIFHSA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154073088	407965185	/nfs/dbraw/zinc/96/51/85/407965185.db2.gz	ZPEPUSSEUVKUTB-VNHYZAJKSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154073088	407965191	/nfs/dbraw/zinc/96/51/91/407965191.db2.gz	ZPEPUSSEUVKUTB-VNHYZAJKSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000268147756	407914224	/nfs/dbraw/zinc/91/42/24/407914224.db2.gz	FKWCDIKLEIEZFC-XPTSAGLGSA-N	1	1	307.325	1.946	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2nn(C)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000272467547	407934970	/nfs/dbraw/zinc/93/49/70/407934970.db2.gz	WIABJMJPDXLUSI-WDEREUQCSA-N	1	1	309.370	1.131	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c(N)c([N+](=O)[O-])c1	ZINC000273069355	408044572	/nfs/dbraw/zinc/04/45/72/408044572.db2.gz	ZJJTUTQJSZCCTF-LLVKDONJSA-N	1	1	318.377	1.866	20	5		DDBDMO
Cc1nnc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)[nH]1	ZINC000268497003	408069875	/nfs/dbraw/zinc/06/98/75/408069875.db2.gz	RIWYDAFKHZSMSX-NSHDSACASA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1n[nH]c([C@H]2CCC[N@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000268497003	408069885	/nfs/dbraw/zinc/06/98/85/408069885.db2.gz	RIWYDAFKHZSMSX-NSHDSACASA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1n[nH]c([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000268497003	408069889	/nfs/dbraw/zinc/06/98/89/408069889.db2.gz	RIWYDAFKHZSMSX-NSHDSACASA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+](C)CC2(CO)CC2)cccc1[N+](=O)[O-]	ZINC000190031976	408150498	/nfs/dbraw/zinc/15/04/98/408150498.db2.gz	WUNRGZWWLALBSE-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CC2(CO)CC2)cccc1[N+](=O)[O-]	ZINC000190031976	408150502	/nfs/dbraw/zinc/15/05/02/408150502.db2.gz	WUNRGZWWLALBSE-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000263650786	408189408	/nfs/dbraw/zinc/18/94/08/408189408.db2.gz	GTNLQRBKMGYRHH-LLVKDONJSA-N	1	1	323.397	1.875	20	5		DDBDMO
CCOC(=O)C[C@@H](C)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000182628086	408208229	/nfs/dbraw/zinc/20/82/29/408208229.db2.gz	ZGZWIKIGMIJSNK-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)C[C@@H](C)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000182628086	408208235	/nfs/dbraw/zinc/20/82/35/408208235.db2.gz	ZGZWIKIGMIJSNK-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000156657633	408268806	/nfs/dbraw/zinc/26/88/06/408268806.db2.gz	XVVBGWZJJHHFBW-OAHLLOKOSA-N	1	1	305.378	1.938	20	5		DDBDMO
CC[C@@](C)([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(N)=O	ZINC000133102162	162050702	/nfs/dbraw/zinc/05/07/02/162050702.db2.gz	JWZNNTMLEDTFNM-CQSZACIVSA-N	1	1	308.338	1.085	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCOCC23CCC3)c1	ZINC000135498969	162106083	/nfs/dbraw/zinc/10/60/83/162106083.db2.gz	PNEOLDSKLKZQJO-CQSZACIVSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCOCC23CCC3)c1	ZINC000135498969	162106084	/nfs/dbraw/zinc/10/60/84/162106084.db2.gz	PNEOLDSKLKZQJO-CQSZACIVSA-N	1	1	322.361	1.589	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1(CO)CCOCC1	ZINC000190977310	408350369	/nfs/dbraw/zinc/35/03/69/408350369.db2.gz	IHQAHHKLMOFWLT-UHFFFAOYSA-N	1	1	324.377	1.837	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000183195786	408350366	/nfs/dbraw/zinc/35/03/66/408350366.db2.gz	CMCIEMWMFLZBEV-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000190924374	408343692	/nfs/dbraw/zinc/34/36/92/408343692.db2.gz	NHJIIEZLYDTUFR-WXHSDQCUSA-N	1	1	321.377	1.790	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000246977528	408378254	/nfs/dbraw/zinc/37/82/54/408378254.db2.gz	GFTGUXUIHIDTMX-WCQYABFASA-N	1	1	309.370	1.026	20	5		DDBDMO
CCCn1ccnc1CCC[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000191504437	408437078	/nfs/dbraw/zinc/43/70/78/408437078.db2.gz	OIEQJCOJPNVDAM-UHFFFAOYSA-N	1	1	320.397	1.962	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000177030524	408500726	/nfs/dbraw/zinc/50/07/26/408500726.db2.gz	FQINRWJALAEYQL-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177133881	408531744	/nfs/dbraw/zinc/53/17/44/408531744.db2.gz	FNIMYLZJIQDGDJ-RYUDHWBXSA-N	1	1	319.361	1.715	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000248374109	408551859	/nfs/dbraw/zinc/55/18/59/408551859.db2.gz	NVWLNCNRYMMPAR-YNEHKIRRSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000248374109	408551865	/nfs/dbraw/zinc/55/18/65/408551865.db2.gz	NVWLNCNRYMMPAR-YNEHKIRRSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC(C)(C)O	ZINC000265160336	408564220	/nfs/dbraw/zinc/56/42/20/408564220.db2.gz	RAUVQEVSVSVJQG-UHFFFAOYSA-N	1	1	321.377	1.577	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000184458935	408623378	/nfs/dbraw/zinc/62/33/78/408623378.db2.gz	QZKNUEHXTUHXSL-JTQLQIEISA-N	1	1	307.354	1.176	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]1CO	ZINC000248936518	408663481	/nfs/dbraw/zinc/66/34/81/408663481.db2.gz	NHKDPQYNPIALBG-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]1CO	ZINC000248936518	408663487	/nfs/dbraw/zinc/66/34/87/408663487.db2.gz	NHKDPQYNPIALBG-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[NH+](C)C1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCC1	ZINC000275985408	408739457	/nfs/dbraw/zinc/73/94/57/408739457.db2.gz	NAAGRZJFIBIRBJ-UHFFFAOYSA-N	1	1	317.349	1.685	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280795052	408835269	/nfs/dbraw/zinc/83/52/69/408835269.db2.gz	RLWJNBRSEQYRJB-BONVTDFDSA-N	1	1	320.349	1.119	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H](C)OC	ZINC000285682115	408841658	/nfs/dbraw/zinc/84/16/58/408841658.db2.gz	NFNVEUSRUTZVOK-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H](C)OC	ZINC000285682115	408841661	/nfs/dbraw/zinc/84/16/61/408841661.db2.gz	NFNVEUSRUTZVOK-SNVBAGLBSA-N	1	1	311.338	1.509	20	5		DDBDMO
CSc1cccc(C(=O)NC[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000188075871	163039838	/nfs/dbraw/zinc/03/98/38/163039838.db2.gz	CYRHYJRXBRIIIZ-SNVBAGLBSA-N	1	1	309.391	1.998	20	5		DDBDMO
COC[C@H](Cc1ccccc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000191506268	163190059	/nfs/dbraw/zinc/19/00/59/163190059.db2.gz	AVNHUURKYUWUCB-HNNXBMFYSA-N	1	1	318.377	1.981	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193637218	163262758	/nfs/dbraw/zinc/26/27/58/163262758.db2.gz	ATNUHCIATGAWLG-RWMBFGLXSA-N	1	1	318.377	1.415	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](C)CCC(N)=O)cccc1[N+](=O)[O-]	ZINC000286281596	408955141	/nfs/dbraw/zinc/95/51/41/408955141.db2.gz	CJXFNGUXFKXUHC-UHFFFAOYSA-N	1	1	308.338	1.039	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000282094569	408990330	/nfs/dbraw/zinc/99/03/30/408990330.db2.gz	OWOJEYKSQXETGV-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+](CCO)CCO)c1	ZINC000293129055	409055542	/nfs/dbraw/zinc/05/55/42/409055542.db2.gz	PQLTYIAOSFKLLH-UHFFFAOYSA-N	1	1	308.256	1.400	20	5		DDBDMO
C[C@H]([C@H](C)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[NH+]1CCOCC1	ZINC000278376204	409078911	/nfs/dbraw/zinc/07/89/11/409078911.db2.gz	DTEKGMJHBFBTON-WDEREUQCSA-N	1	1	319.365	1.992	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000279391109	409204891	/nfs/dbraw/zinc/20/48/91/409204891.db2.gz	UHCKQMIWIBKABR-CJNGLKHVSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000295210694	409377567	/nfs/dbraw/zinc/37/75/67/409377567.db2.gz	LNKGICWICNPCIB-AWEZNQCLSA-N	1	1	321.312	1.245	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000295216438	409380301	/nfs/dbraw/zinc/38/03/01/409380301.db2.gz	MEGOFCDELPGWQX-HNNXBMFYSA-N	1	1	309.341	1.687	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](CO)c1cnn(C)c1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284983342	409388418	/nfs/dbraw/zinc/38/84/18/409388418.db2.gz	GFNYMNOZRHTYML-RNCFNFMXSA-N	1	1	305.338	1.295	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000280682786	409408984	/nfs/dbraw/zinc/40/89/84/409408984.db2.gz	YWNQNOBQBNATMK-ZDUSSCGKSA-N	1	1	321.377	1.740	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCN2CCO[C@H]1C2	ZINC000295281886	409411724	/nfs/dbraw/zinc/41/17/24/409411724.db2.gz	DBVALEKCJDGWDI-HOTGVXAUSA-N	1	1	321.377	1.379	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccc([N+](=O)[O-])c(F)c1F)C1CC1	ZINC000296100498	409429887	/nfs/dbraw/zinc/42/98/87/409429887.db2.gz	ZXCWESOZQWMRBO-VIFPVBQESA-N	1	1	302.277	1.707	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290555348	409443237	/nfs/dbraw/zinc/44/32/37/409443237.db2.gz	QXSWNAIFIVJIOC-LLVKDONJSA-N	1	1	321.381	1.765	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347020517	164098365	/nfs/dbraw/zinc/09/83/65/164098365.db2.gz	YFTMKMDPPYOKSK-CYBMUJFWSA-N	1	1	321.381	1.185	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1	ZINC000357034104	164136776	/nfs/dbraw/zinc/13/67/76/164136776.db2.gz	CEHYZACCFDHIRA-LBPRGKRZSA-N	1	1	321.381	1.323	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408156401	164245509	/nfs/dbraw/zinc/24/55/09/164245509.db2.gz	ZJLFGGFCYWXNAQ-NEPJUHHUSA-N	1	1	321.381	1.222	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1	ZINC000295445293	409486065	/nfs/dbraw/zinc/48/60/65/409486065.db2.gz	AJSCWHSTLHTWNI-NSHDSACASA-N	1	1	318.377	1.733	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@H](C)O	ZINC000303989109	409560835	/nfs/dbraw/zinc/56/08/35/409560835.db2.gz	KJPVPQOYTVXXDL-LBPRGKRZSA-N	1	1	309.366	1.649	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCC(N)=O)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000348839526	409543501	/nfs/dbraw/zinc/54/35/01/409543501.db2.gz	WPZILDKHYMOOFL-UHFFFAOYSA-N	1	1	317.349	1.303	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356793987	409611200	/nfs/dbraw/zinc/61/12/00/409611200.db2.gz	LWBVGLBWLPTQQB-WDEREUQCSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356793987	409611207	/nfs/dbraw/zinc/61/12/07/409611207.db2.gz	LWBVGLBWLPTQQB-WDEREUQCSA-N	1	1	322.365	1.695	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C2CC2)C[C@H]1C	ZINC000342451398	409642221	/nfs/dbraw/zinc/64/22/21/409642221.db2.gz	PAVZHJAPORMNHZ-OTYXRUKQSA-N	1	1	304.350	1.511	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000345170671	409655980	/nfs/dbraw/zinc/65/59/80/409655980.db2.gz	IVKJNMOZGWWJKW-MNOVXSKESA-N	1	1	306.366	1.613	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356851427	409664881	/nfs/dbraw/zinc/66/48/81/409664881.db2.gz	MPTRJULPERWSEL-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356851427	409664887	/nfs/dbraw/zinc/66/48/87/409664887.db2.gz	MPTRJULPERWSEL-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[N@@H+](CC[C@@H]1CCCO1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000342577197	409733736	/nfs/dbraw/zinc/73/37/36/409733736.db2.gz	BGLDWTNZVNQDCV-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nccc2cc([N+](=O)[O-])ccc21	ZINC000296971622	409735859	/nfs/dbraw/zinc/73/58/59/409735859.db2.gz	DDMBFXDHPSLTOB-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000296971622	409735866	/nfs/dbraw/zinc/73/58/66/409735866.db2.gz	DDMBFXDHPSLTOB-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000296971622	409735870	/nfs/dbraw/zinc/73/58/70/409735870.db2.gz	DDMBFXDHPSLTOB-AWEZNQCLSA-N	1	1	315.377	1.801	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCCCn1cc[nH+]c1C	ZINC000338181423	409783221	/nfs/dbraw/zinc/78/32/21/409783221.db2.gz	YUARZLNTYZEFAT-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000331920957	409799743	/nfs/dbraw/zinc/79/97/43/409799743.db2.gz	CAXRIHRYTULLJW-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000331920957	409799747	/nfs/dbraw/zinc/79/97/47/409799747.db2.gz	CAXRIHRYTULLJW-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCC[N@@H+]3C[C@@H]2C)n1	ZINC000332027113	409816026	/nfs/dbraw/zinc/81/60/26/409816026.db2.gz	UHCQXTOZBHWWMH-NWDGAFQWSA-N	1	1	321.381	1.510	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H]3CCCC[N@H+]3C[C@@H]2C)n1	ZINC000332027113	409816035	/nfs/dbraw/zinc/81/60/35/409816035.db2.gz	UHCQXTOZBHWWMH-NWDGAFQWSA-N	1	1	321.381	1.510	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000354391104	409816232	/nfs/dbraw/zinc/81/62/32/409816232.db2.gz	JUGUTTHEQTXFQQ-STQMWFEESA-N	1	1	323.397	1.513	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@H+](C)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000317158037	409867453	/nfs/dbraw/zinc/86/74/53/409867453.db2.gz	SDJCPCRVVRKNKC-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000317158037	409867460	/nfs/dbraw/zinc/86/74/60/409867460.db2.gz	SDJCPCRVVRKNKC-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000342773043	409894434	/nfs/dbraw/zinc/89/44/34/409894434.db2.gz	BNYKMBZVUCRNND-SNVBAGLBSA-N	1	1	315.333	1.421	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000342773041	409894908	/nfs/dbraw/zinc/89/49/08/409894908.db2.gz	BNYKMBZVUCRNND-JTQLQIEISA-N	1	1	315.333	1.421	20	5		DDBDMO
C[C@@H]1[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@@H+]1C	ZINC000354548074	409931347	/nfs/dbraw/zinc/93/13/47/409931347.db2.gz	RRUWPZCROHOOCK-ZWNOBZJWSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H]1[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000354548074	409931351	/nfs/dbraw/zinc/93/13/51/409931351.db2.gz	RRUWPZCROHOOCK-ZWNOBZJWSA-N	1	1	313.379	1.356	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000346657679	410062488	/nfs/dbraw/zinc/06/24/88/410062488.db2.gz	LHCKZTKLSZRNRQ-FZMZJTMJSA-N	1	1	308.334	1.857	20	5		DDBDMO
CC(C)[N@H+](C)C[C@H](C)Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000357585390	410116970	/nfs/dbraw/zinc/11/69/70/410116970.db2.gz	VTAJOXGMJUCALG-JTQLQIEISA-N	1	1	319.365	2.384	20	5		DDBDMO
C[C@H]1CC[C@H]([N@@H+](CCO)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000351635840	410124850	/nfs/dbraw/zinc/12/48/50/410124850.db2.gz	QKRIXZNWIIQUOB-STQMWFEESA-N	1	1	309.366	1.239	20	5		DDBDMO
C[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@H]1C	ZINC000351700900	410160414	/nfs/dbraw/zinc/16/04/14/410160414.db2.gz	TUWAYWZQIUKYRJ-CHWSQXEVSA-N	1	1	323.397	1.561	20	5		DDBDMO
Nc1ccc(N2CCN(c3ccncc3[N+](=O)[O-])CC2)c[nH+]1	ZINC000346949189	410272230	/nfs/dbraw/zinc/27/22/30/410272230.db2.gz	YEUKAZSVOXJUQM-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351934582	410349959	/nfs/dbraw/zinc/34/99/59/410349959.db2.gz	IMWYPIVTIAYWBR-QMTHXVAHSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2cccnc2)c1	ZINC000346999100	410298804	/nfs/dbraw/zinc/29/88/04/410298804.db2.gz	PCXYUSDBCOKDFI-GJZGRUSLSA-N	1	1	317.349	1.384	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000355599164	410599393	/nfs/dbraw/zinc/59/93/93/410599393.db2.gz	MWLGLKYWXSNFLC-UHFFFAOYSA-N	1	1	324.333	1.369	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000355599164	410599398	/nfs/dbraw/zinc/59/93/98/410599398.db2.gz	MWLGLKYWXSNFLC-UHFFFAOYSA-N	1	1	324.333	1.369	20	5		DDBDMO
COC1CC([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000352209574	410547837	/nfs/dbraw/zinc/54/78/37/410547837.db2.gz	CARKFRSAMJYRSB-CPCZMJQVSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@@H]21	ZINC000301965064	410836884	/nfs/dbraw/zinc/83/68/84/410836884.db2.gz	NYLVWFLPOBHREF-RYUDHWBXSA-N	1	1	316.365	1.558	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000330673180	410866297	/nfs/dbraw/zinc/86/62/97/410866297.db2.gz	OZALNYGVSJDJGQ-LLVKDONJSA-N	1	1	323.349	1.145	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000330673180	410866304	/nfs/dbraw/zinc/86/63/04/410866304.db2.gz	OZALNYGVSJDJGQ-LLVKDONJSA-N	1	1	323.349	1.145	20	5		DDBDMO
C[NH+]1CCN(C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000353326128	410921136	/nfs/dbraw/zinc/92/11/36/410921136.db2.gz	BWSLZLMBQZIWTA-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344064107	410933228	/nfs/dbraw/zinc/93/32/28/410933228.db2.gz	OSNAMWMAWKDLEC-OXJKWZBOSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344064107	410933229	/nfs/dbraw/zinc/93/32/29/410933229.db2.gz	OSNAMWMAWKDLEC-OXJKWZBOSA-N	1	1	319.361	1.625	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CO)C[C@H]1C	ZINC000344121039	410971409	/nfs/dbraw/zinc/97/14/09/410971409.db2.gz	DZRQLJBNZDCQAO-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CO)C[C@H]1C	ZINC000344121039	410971415	/nfs/dbraw/zinc/97/14/15/410971415.db2.gz	DZRQLJBNZDCQAO-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]1C[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000344215505	411033241	/nfs/dbraw/zinc/03/32/41/411033241.db2.gz	KVGSQMLKHXEROH-VHSXEESVSA-N	1	1	317.349	2.140	20	5		DDBDMO
C[NH2+][C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000133061812	196308667	/nfs/dbraw/zinc/30/86/67/196308667.db2.gz	UPSNLDSKPOZUIW-SECBINFHSA-N	1	1	303.322	1.295	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000296640437	226076837	/nfs/dbraw/zinc/07/68/37/226076837.db2.gz	IHGSEAOATIQFKW-OAHLLOKOSA-N	1	1	307.350	1.552	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCOC2)O1	ZINC000373805513	418462048	/nfs/dbraw/zinc/46/20/48/418462048.db2.gz	ODQZJDFEPCJMAA-UONOGXRCSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCOC2)O1	ZINC000373805513	418462049	/nfs/dbraw/zinc/46/20/49/418462049.db2.gz	ODQZJDFEPCJMAA-UONOGXRCSA-N	1	1	310.354	1.061	20	5		DDBDMO
COCCOC[C@@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000295421458	418586024	/nfs/dbraw/zinc/58/60/24/418586024.db2.gz	YFHSXLARNGBGMO-AWEZNQCLSA-N	1	1	312.366	1.093	20	5		DDBDMO
O=[N+]([O-])c1ccn(C2CCN(CC[N@H+]3CCCOCC3)CC2)n1	ZINC000361381147	418640778	/nfs/dbraw/zinc/64/07/78/418640778.db2.gz	LVIOHRFCIWSCOM-UHFFFAOYSA-N	1	1	323.397	1.151	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000341798423	418626192	/nfs/dbraw/zinc/62/61/92/418626192.db2.gz	KYDVACWGURZCKD-GRYCIOLGSA-N	1	1	320.397	1.809	20	5		DDBDMO
Cc1nn(C)c(C)c1C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392744	418634097	/nfs/dbraw/zinc/63/40/97/418634097.db2.gz	OTHYUGKJENZTFT-ZDUSSCGKSA-N	1	1	318.381	1.979	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000364611070	418793561	/nfs/dbraw/zinc/79/35/61/418793561.db2.gz	YLFFKLLLIHLWRY-GFCCVEGCSA-N	1	1	320.393	1.456	20	5		DDBDMO
CCOc1cccc(N2CC[NH+]([C@@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000364855879	418816266	/nfs/dbraw/zinc/81/62/66/418816266.db2.gz	NNYVLRRRUDFRGD-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000365587278	418878485	/nfs/dbraw/zinc/87/84/85/418878485.db2.gz	KLXZKYVHNKTIBK-ARFHVFGLSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000365587278	418878488	/nfs/dbraw/zinc/87/84/88/418878488.db2.gz	KLXZKYVHNKTIBK-ARFHVFGLSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000365587278	418878491	/nfs/dbraw/zinc/87/84/91/418878491.db2.gz	KLXZKYVHNKTIBK-ARFHVFGLSA-N	1	1	317.389	1.680	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2C[C@H](CO)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000420943303	419374278	/nfs/dbraw/zinc/37/42/78/419374278.db2.gz	POQPOECQNYKBRA-QWHCGFSZSA-N	1	1	324.377	1.933	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](C(=O)N(C)C)C1	ZINC000411958390	419523195	/nfs/dbraw/zinc/52/31/95/419523195.db2.gz	UUHFWBAOEZGHAZ-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000412061859	419608190	/nfs/dbraw/zinc/60/81/90/419608190.db2.gz	AKLXPLBKYVCOIC-MGPQQGTHSA-N	1	1	324.377	1.427	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1	ZINC000427597695	419690026	/nfs/dbraw/zinc/69/00/26/419690026.db2.gz	XIMOIRKXSVPUJC-ZDUSSCGKSA-N	1	1	319.361	1.912	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000421707063	419694183	/nfs/dbraw/zinc/69/41/83/419694183.db2.gz	WQFZKSXIJQPYKR-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN1CCN(C(=O)C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])CC1	ZINC000429243976	419990989	/nfs/dbraw/zinc/99/09/89/419990989.db2.gz	CUZBTUSNKFVHPE-UHFFFAOYSA-N	1	1	320.393	1.194	20	5		DDBDMO
CC(=O)c1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000418991945	420039809	/nfs/dbraw/zinc/03/98/09/420039809.db2.gz	FFMVPCCEODGBFM-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000418991945	420039813	/nfs/dbraw/zinc/03/98/13/420039813.db2.gz	FFMVPCCEODGBFM-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
C[C@H]1CC[C@H]([N@@H+](CCO)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000429794231	420049029	/nfs/dbraw/zinc/04/90/29/420049029.db2.gz	WTQKGLWUFBGJIV-FZMZJTMJSA-N	1	1	321.377	1.677	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)c1[N+](=O)[O-]	ZINC000423676264	420124075	/nfs/dbraw/zinc/12/40/75/420124075.db2.gz	FVNBJDKDMOUCIF-CQSZACIVSA-N	1	1	311.313	1.377	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1[NH3+]	ZINC000430940744	420216914	/nfs/dbraw/zinc/21/69/14/420216914.db2.gz	QVIWFIOZHAPQQT-VXGBXAGGSA-N	1	1	306.366	1.593	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH3+])NCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420373417	420244304	/nfs/dbraw/zinc/24/43/04/420244304.db2.gz	ZDTWQWJJFDYXQR-CYBMUJFWSA-N	1	1	308.382	1.886	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420378156	420248477	/nfs/dbraw/zinc/24/84/77/420248477.db2.gz	WXEKLIDPMMSVTP-XHBSWPGZSA-N	1	1	320.393	1.900	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000416303861	420321329	/nfs/dbraw/zinc/32/13/29/420321329.db2.gz	HMXGOVLBYDOHJA-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000436009898	420301330	/nfs/dbraw/zinc/30/13/30/420301330.db2.gz	WQFWEDXBHYCHOU-VXGBXAGGSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@@H](Nc1ccc2ncc([N+](=O)[O-])n2n1)[C@@H](C)[NH+]1CCOCC1	ZINC000301959859	230004822	/nfs/dbraw/zinc/00/48/22/230004822.db2.gz	HIDUFXOOPKJATL-GHMZBOCLSA-N	1	1	320.353	1.159	20	5		DDBDMO
COCCCOCC[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444690362	230121247	/nfs/dbraw/zinc/12/12/47/230121247.db2.gz	SEBKWOPYIVZATP-UHFFFAOYSA-N	1	1	322.365	1.956	20	5		DDBDMO
COCCCOCC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444690362	230121251	/nfs/dbraw/zinc/12/12/51/230121251.db2.gz	SEBKWOPYIVZATP-UHFFFAOYSA-N	1	1	322.365	1.956	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](CC(F)(F)F)C2)c1	ZINC000444697971	230124184	/nfs/dbraw/zinc/12/41/84/230124184.db2.gz	RIFCAGAKKRDMMC-ONGXEEELSA-N	1	1	322.287	1.427	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1	ZINC000457105358	420614688	/nfs/dbraw/zinc/61/46/88/420614688.db2.gz	CDMQILOOSYOQDT-GFCCVEGCSA-N	1	1	309.370	1.041	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000442132917	420671425	/nfs/dbraw/zinc/67/14/25/420671425.db2.gz	QKSDANHFBDIYED-CMPLNLGQSA-N	1	1	320.349	1.132	20	5		DDBDMO
O=C1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]2CCCCN12	ZINC000453629336	420739130	/nfs/dbraw/zinc/73/91/30/420739130.db2.gz	NOBLTICRJVPHLS-SMDDNHRTSA-N	1	1	307.325	1.977	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000493298963	420813097	/nfs/dbraw/zinc/81/30/97/420813097.db2.gz	ZTFULIUITSYUIV-GFUIURDCSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000493298963	420813101	/nfs/dbraw/zinc/81/31/01/420813101.db2.gz	ZTFULIUITSYUIV-GFUIURDCSA-N	1	1	319.361	1.133	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000455040382	420961059	/nfs/dbraw/zinc/96/10/59/420961059.db2.gz	MHSXUUVWXCKUPX-NSHDSACASA-N	1	1	307.354	1.360	20	5		DDBDMO
CNc1nc(C(=O)NCCCn2cc[nH+]c2C)ccc1[N+](=O)[O-]	ZINC000454920766	420943075	/nfs/dbraw/zinc/94/30/75/420943075.db2.gz	LJEAEMZXFCWKJG-UHFFFAOYSA-N	1	1	318.337	1.357	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(N)=O)c1ccccn1	ZINC000449364561	420998379	/nfs/dbraw/zinc/99/83/79/420998379.db2.gz	SHYAZWFTNGFCJI-IAQYHMDHSA-N	1	1	314.345	1.737	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@@](O)(C(F)F)C2)cc1[N+](=O)[O-]	ZINC000449471446	421017260	/nfs/dbraw/zinc/01/72/60/421017260.db2.gz	OWUPOQMRCMJFMF-ZDUSSCGKSA-N	1	1	302.277	1.805	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@](O)(C(F)F)C2)cc1[N+](=O)[O-]	ZINC000449471446	421017263	/nfs/dbraw/zinc/01/72/63/421017263.db2.gz	OWUPOQMRCMJFMF-ZDUSSCGKSA-N	1	1	302.277	1.805	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000455818472	421065410	/nfs/dbraw/zinc/06/54/10/421065410.db2.gz	MGXQEPGMZSMXNO-LLVKDONJSA-N	1	1	321.381	1.445	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2nnnc2Sc2ccc([N+](=O)[O-])nc2)C1	ZINC000450397909	421193312	/nfs/dbraw/zinc/19/33/12/421193312.db2.gz	WMGXQDTZXMMBIP-VIFPVBQESA-N	1	1	321.366	1.079	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+](C)C	ZINC000514517486	421434636	/nfs/dbraw/zinc/43/46/36/421434636.db2.gz	XZDPZKQWMKVGTM-LBPRGKRZSA-N	1	1	306.322	1.559	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC[C@H]1C1CCC1	ZINC000563083439	421452361	/nfs/dbraw/zinc/45/23/61/421452361.db2.gz	NCGOAUOYPPZCQU-AWEZNQCLSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@H]1C1CCC1	ZINC000563083439	421452362	/nfs/dbraw/zinc/45/23/62/421452362.db2.gz	NCGOAUOYPPZCQU-AWEZNQCLSA-N	1	1	307.350	1.257	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548714397	421466152	/nfs/dbraw/zinc/46/61/52/421466152.db2.gz	WCSAKWJXGXBNQQ-LLVKDONJSA-N	1	1	321.381	1.566	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000563989956	421564084	/nfs/dbraw/zinc/56/40/84/421564084.db2.gz	OCBVGJBYIOMJFL-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000516852235	421571181	/nfs/dbraw/zinc/57/11/81/421571181.db2.gz	JAAFMVGLRCJFAL-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H](OCC(F)(F)F)C2)c1	ZINC000530623247	421610543	/nfs/dbraw/zinc/61/05/43/421610543.db2.gz	JFWGETQCAYPRNR-LLVKDONJSA-N	1	1	322.287	1.835	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](OCC(F)(F)F)C2)c1	ZINC000530623247	421610546	/nfs/dbraw/zinc/61/05/46/421610546.db2.gz	JFWGETQCAYPRNR-LLVKDONJSA-N	1	1	322.287	1.835	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)Cn1cccn1)C2	ZINC000534514071	421691241	/nfs/dbraw/zinc/69/12/41/421691241.db2.gz	AGXLPAXBUDAQNE-ZDUSSCGKSA-N	1	1	302.334	1.211	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)Cn1cccn1)C2	ZINC000534514071	421691244	/nfs/dbraw/zinc/69/12/44/421691244.db2.gz	AGXLPAXBUDAQNE-ZDUSSCGKSA-N	1	1	302.334	1.211	20	5		DDBDMO
CCC[C@@H](NCC(=O)N1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000573108297	421922121	/nfs/dbraw/zinc/92/21/21/421922121.db2.gz	LOXHRAFSTVPWFX-OAHLLOKOSA-N	1	1	320.393	1.457	20	5		DDBDMO
CC(C)[N@@H+](CCN1C(=O)CCC1=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000193843081	263495185	/nfs/dbraw/zinc/49/51/85/263495185.db2.gz	AXOJZUWBDLDYEX-UHFFFAOYSA-N	1	1	319.361	1.954	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1	ZINC000341682532	271167078	/nfs/dbraw/zinc/16/70/78/271167078.db2.gz	CRDNIDLTWVSBOY-KGLIPLIRSA-N	1	1	321.377	1.505	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCCCC[C@@H]1CCO	ZINC000342070544	271290344	/nfs/dbraw/zinc/29/03/44/271290344.db2.gz	WRPSCGQBBWGEDU-CYBMUJFWSA-N	1	1	309.366	1.384	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1	ZINC000344359822	272008513	/nfs/dbraw/zinc/00/85/13/272008513.db2.gz	WMDOBFFBYYJPEE-UHFFFAOYSA-N	1	1	324.356	1.101	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000408106099	274368022	/nfs/dbraw/zinc/36/80/22/274368022.db2.gz	XBISAYXQOTZOKR-NXEZZACHSA-N	1	1	317.349	1.772	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[N@@H+]2CCC[C@H]2CO)nc1	ZINC000301526265	275036253	/nfs/dbraw/zinc/03/62/53/275036253.db2.gz	JFGYDYIJSBVXJC-KGLIPLIRSA-N	1	1	306.366	1.415	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[C@H]2C[N@@H+]2CCC[C@@H]2CO)nc1	ZINC000301526267	275036295	/nfs/dbraw/zinc/03/62/95/275036295.db2.gz	JFGYDYIJSBVXJC-UONOGXRCSA-N	1	1	306.366	1.415	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@@H]3C2)c2cccnc21	ZINC000413230112	275036638	/nfs/dbraw/zinc/03/66/38/275036638.db2.gz	KSWGCFUZYOWYLO-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@@H]3C2)c2cccnc21	ZINC000413230112	275036639	/nfs/dbraw/zinc/03/66/39/275036639.db2.gz	KSWGCFUZYOWYLO-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
CCOC(=O)[C@@H]1NCC[C@@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000423017456	279599826	/nfs/dbraw/zinc/59/98/26/279599826.db2.gz	ORDBLJNXCCSDEL-SCDSUCTJSA-N	1	1	307.350	1.539	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000423974077	280192416	/nfs/dbraw/zinc/19/24/16/280192416.db2.gz	RQCJMDXLTSYKGV-LLVKDONJSA-N	1	1	318.358	1.838	20	5		DDBDMO
Cc1c(CC(=O)NC[C@@H]2CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000121834808	281145298	/nfs/dbraw/zinc/14/52/98/281145298.db2.gz	DCRGXJORCLALAC-ZDUSSCGKSA-N	1	1	305.378	1.904	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCO[C@H](C3CC3)C2)c1	ZINC000362579775	300101361	/nfs/dbraw/zinc/10/13/61/300101361.db2.gz	XRVFWAOSSOQKTB-HOCLYGCPSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCO[C@H](C3CC3)C2)c1	ZINC000362579775	300101363	/nfs/dbraw/zinc/10/13/63/300101363.db2.gz	XRVFWAOSSOQKTB-HOCLYGCPSA-N	1	1	322.361	1.445	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1	ZINC000362617466	300106755	/nfs/dbraw/zinc/10/67/55/300106755.db2.gz	NQHLUOGPHCCHHR-UHFFFAOYSA-N	1	1	313.304	1.626	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1	ZINC000363884074	300320641	/nfs/dbraw/zinc/32/06/41/300320641.db2.gz	FLBPBQYMDUHEMA-UHFFFAOYSA-N	1	1	321.381	1.376	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](OCC3CC3)C2)c1	ZINC000364451248	300399130	/nfs/dbraw/zinc/39/91/30/300399130.db2.gz	XOMNTTZCINUWGM-HUUCEWRRSA-N	1	1	324.381	1.043	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000368579789	301056695	/nfs/dbraw/zinc/05/66/95/301056695.db2.gz	UIIKPGDLXUFWMH-QWRGUYRKSA-N	1	1	320.349	1.119	20	5		DDBDMO
Cc1c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cccc1[N+](=O)[O-]	ZINC000368976270	301115537	/nfs/dbraw/zinc/11/55/37/301115537.db2.gz	VGECAVZOBQBKCJ-YDHLFZDLSA-N	1	1	303.362	1.989	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N[C@@H]1CC[N@@H+](CCN2CCOCC2)C1	ZINC000369349459	301169695	/nfs/dbraw/zinc/16/96/95/301169695.db2.gz	YQKXCEHRKWQMKS-CQSZACIVSA-N	1	1	320.393	1.413	20	5		DDBDMO
Cc1nc(C)n(C[C@@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)n1	ZINC000370024584	301260566	/nfs/dbraw/zinc/26/05/66/301260566.db2.gz	ABXQYBUCKAMLMG-ZDUSSCGKSA-N	1	1	319.369	1.164	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H]2COC[C@H]21	ZINC000370223568	301297818	/nfs/dbraw/zinc/29/78/18/301297818.db2.gz	DHGZITCHKUVJBV-GZBFAFLISA-N	1	1	322.361	1.445	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@H+](C)C[C@H]1c1ccccc1	ZINC000266633599	303020678	/nfs/dbraw/zinc/02/06/78/303020678.db2.gz	XGMFUJBUOAOJRQ-ZDUSSCGKSA-N	1	1	301.350	1.821	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@H]1c1ccccc1	ZINC000266633599	303020681	/nfs/dbraw/zinc/02/06/81/303020681.db2.gz	XGMFUJBUOAOJRQ-ZDUSSCGKSA-N	1	1	301.350	1.821	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000532397200	303284937	/nfs/dbraw/zinc/28/49/37/303284937.db2.gz	AZCIKGZNLDMMBM-CYBMUJFWSA-N	1	1	318.377	1.794	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1ccc3ncc([N+](=O)[O-])n3n1)CC2	ZINC000364640563	307049248	/nfs/dbraw/zinc/04/92/48/307049248.db2.gz	XGRKBNZOJMDEKG-UHFFFAOYSA-N	1	1	316.365	1.702	20	5		DDBDMO
Cc1ccc(CN2CCC[N@H+]([C@H](C)CO)CC2)cc1[N+](=O)[O-]	ZINC000364973908	307055528	/nfs/dbraw/zinc/05/55/28/307055528.db2.gz	NNDRYDBWCUCALX-CQSZACIVSA-N	1	1	307.394	1.792	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000372557203	307170350	/nfs/dbraw/zinc/17/03/50/307170350.db2.gz	ZIIBLENNGFWQOE-UHFFFAOYSA-N	1	1	311.338	1.107	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C[C@H]1CCCC2	ZINC000375301358	307221124	/nfs/dbraw/zinc/22/11/24/307221124.db2.gz	GDVZMTHEIRPOEZ-IAQYHMDHSA-N	1	1	322.365	1.494	20	5		DDBDMO
CCN(C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301693	307242594	/nfs/dbraw/zinc/24/25/94/307242594.db2.gz	HTFUGVZZEAGRCO-OAGGEKHMSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000376301693	307242595	/nfs/dbraw/zinc/24/25/95/307242595.db2.gz	HTFUGVZZEAGRCO-OAGGEKHMSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301693	307242596	/nfs/dbraw/zinc/24/25/96/307242596.db2.gz	HTFUGVZZEAGRCO-OAGGEKHMSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488373	307289187	/nfs/dbraw/zinc/28/91/87/307289187.db2.gz	AUPCEZWOSJWTOI-ARLBYUKCSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000378488373	307289188	/nfs/dbraw/zinc/28/91/88/307289188.db2.gz	AUPCEZWOSJWTOI-ARLBYUKCSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488373	307289189	/nfs/dbraw/zinc/28/91/89/307289189.db2.gz	AUPCEZWOSJWTOI-ARLBYUKCSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000378496200	307289821	/nfs/dbraw/zinc/28/98/21/307289821.db2.gz	MSWJLAFXDJTAKL-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000421026137	307300932	/nfs/dbraw/zinc/30/09/32/307300932.db2.gz	UACIOBPBOKHCOS-RISCZKNCSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000421026137	307300933	/nfs/dbraw/zinc/30/09/33/307300933.db2.gz	UACIOBPBOKHCOS-RISCZKNCSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H]1NC(=O)N(CC[N@@H+](C)CCc2ccccc2[N+](=O)[O-])C1=O	ZINC000459464523	307307472	/nfs/dbraw/zinc/30/74/72/307307472.db2.gz	NJBXMIHBROHPPU-NSHDSACASA-N	1	1	320.349	1.009	20	5		DDBDMO
C[C@@H](CCN(C)C)[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116856	308043898	/nfs/dbraw/zinc/04/38/98/308043898.db2.gz	LDTHDKSUWVFLCU-QWHCGFSZSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@@H](CC[NH+](C)C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116856	308043899	/nfs/dbraw/zinc/04/38/99/308043899.db2.gz	LDTHDKSUWVFLCU-QWHCGFSZSA-N	1	1	311.382	1.264	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[N@@H+]2CC[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000566444063	308052602	/nfs/dbraw/zinc/05/26/02/308052602.db2.gz	JALXRKTWTPFFNZ-SNVBAGLBSA-N	1	1	321.333	1.662	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[N@H+]2CC[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000566444063	308052603	/nfs/dbraw/zinc/05/26/03/308052603.db2.gz	JALXRKTWTPFFNZ-SNVBAGLBSA-N	1	1	321.333	1.662	20	5		DDBDMO
O=C(NCCC[NH2+]C1CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000567922411	308099816	/nfs/dbraw/zinc/09/98/16/308099816.db2.gz	CCGSOSMOEDPJCP-UHFFFAOYSA-N	1	1	303.322	1.343	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000488727963	484215446	/nfs/dbraw/zinc/21/54/46/484215446.db2.gz	WZZVIZLGSRHLMJ-WCQYABFASA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000488736784	484217670	/nfs/dbraw/zinc/21/76/70/484217670.db2.gz	QYWDMGOFQQFENW-AGIUHOORSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](CO)[C@H]1C	ZINC000488805473	484219162	/nfs/dbraw/zinc/21/91/62/484219162.db2.gz	SUJWOHPLVDOQEA-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nn1	ZINC000414399106	533955742	/nfs/dbraw/zinc/95/57/42/533955742.db2.gz	VBSFKXBNZPZTIG-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)nn1	ZINC000414399106	533955748	/nfs/dbraw/zinc/95/57/48/533955748.db2.gz	VBSFKXBNZPZTIG-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000330897378	534104718	/nfs/dbraw/zinc/10/47/18/534104718.db2.gz	HLLLYKIXJRLJSP-RYUDHWBXSA-N	1	1	307.350	1.573	20	5		DDBDMO
COC(=O)c1cnc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])c1	ZINC000295969485	534306595	/nfs/dbraw/zinc/30/65/95/534306595.db2.gz	KDRXKQKDHHUZJN-YOGCLGLASA-N	1	1	320.349	1.814	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000330930553	529091233	/nfs/dbraw/zinc/09/12/33/529091233.db2.gz	PRPHRYSDOXCDLX-DGCLKSJQSA-N	1	1	323.397	1.371	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000451261678	529344235	/nfs/dbraw/zinc/34/42/35/529344235.db2.gz	WDGFJIVZOJCWDU-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000736847355	598797450	/nfs/dbraw/zinc/79/74/50/598797450.db2.gz	GQTAKSLIKUUFFT-JTQLQIEISA-N	1	1	317.353	1.163	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000824860826	608197064	/nfs/dbraw/zinc/19/70/64/608197064.db2.gz	YAPUCZCGSRQXSM-UWVGGRQHSA-N	1	1	317.353	1.304	20	5		DDBDMO
C[C@@H]1[C@H](C)N(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000824860831	608197127	/nfs/dbraw/zinc/19/71/27/608197127.db2.gz	YAPUCZCGSRQXSM-ZJUUUORDSA-N	1	1	317.353	1.304	20	5		DDBDMO
COCC[NH+](CCOC)Cn1nc(C)c2ccc([N+](=O)[O-])cc21	ZINC000121081484	696706069	/nfs/dbraw/zinc/70/60/69/696706069.db2.gz	RBXUUYATZKZEMA-UHFFFAOYSA-N	1	1	322.365	1.805	20	5		DDBDMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1	ZINC000077510961	696440633	/nfs/dbraw/zinc/44/06/33/696440633.db2.gz	NCFSWAUXUGUTQS-UHFFFAOYSA-N	1	1	307.325	1.902	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CCC1)C2	ZINC000982279023	697082319	/nfs/dbraw/zinc/08/23/19/697082319.db2.gz	YKCVXAYAYUVIPL-SRABZTEZSA-N	1	1	321.421	1.622	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@H+](CC1CCC1)C2	ZINC000982279023	697082321	/nfs/dbraw/zinc/08/23/21/697082321.db2.gz	YKCVXAYAYUVIPL-SRABZTEZSA-N	1	1	321.421	1.622	20	5		DDBDMO
C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[N@@H+](CC1CCC1)C2	ZINC000982279023	697082323	/nfs/dbraw/zinc/08/23/23/697082323.db2.gz	YKCVXAYAYUVIPL-SRABZTEZSA-N	1	1	321.421	1.622	20	5		DDBDMO
Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)sn1	ZINC000983658218	697287156	/nfs/dbraw/zinc/28/71/56/697287156.db2.gz	VJQHVQPPZSIVTE-FPQZTECRSA-N	1	1	324.406	1.101	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CCC[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000773195911	697726473	/nfs/dbraw/zinc/72/64/73/697726473.db2.gz	BZXFWLJCBHRVEO-LLVKDONJSA-N	1	1	306.366	1.700	20	5		DDBDMO
CCC[N@@H+](CC(=O)N(C)C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579646	698120462	/nfs/dbraw/zinc/12/04/62/698120462.db2.gz	OWAKZGLEJRHOMA-CQSZACIVSA-N	1	1	309.366	1.428	20	5		DDBDMO
CCC[N@H+](CC(=O)N(C)C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579646	698120464	/nfs/dbraw/zinc/12/04/64/698120464.db2.gz	OWAKZGLEJRHOMA-CQSZACIVSA-N	1	1	309.366	1.428	20	5		DDBDMO
CO[C@H]1CC(=O)N(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000800865471	700250642	/nfs/dbraw/zinc/25/06/42/700250642.db2.gz	DFJHMKXZIDMVIT-AWEZNQCLSA-N	1	1	307.350	1.274	20	5		DDBDMO
CO[C@H]1CC(=O)N(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000800865471	700250644	/nfs/dbraw/zinc/25/06/44/700250644.db2.gz	DFJHMKXZIDMVIT-AWEZNQCLSA-N	1	1	307.350	1.274	20	5		DDBDMO
CC[C@H]1CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000782860964	698774089	/nfs/dbraw/zinc/77/40/89/698774089.db2.gz	TWSGEGHAGLQZPT-LBPRGKRZSA-N	1	1	321.381	1.644	20	5		DDBDMO
C/C(=C/C(=O)N1CC[NH+](CCO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000784647423	699032539	/nfs/dbraw/zinc/03/25/39/699032539.db2.gz	PXNXOOWZHFXMFC-SEYXRHQNSA-N	1	1	319.361	1.135	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1CNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000788884094	699344763	/nfs/dbraw/zinc/34/47/63/699344763.db2.gz	GKLLPUKOZPYGBM-MRVPVSSYSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000788884094	699344766	/nfs/dbraw/zinc/34/47/66/699344766.db2.gz	GKLLPUKOZPYGBM-MRVPVSSYSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000789334032	699377745	/nfs/dbraw/zinc/37/77/45/699377745.db2.gz	FUTRFFVAIWCMTP-CJNGLKHVSA-N	1	1	323.393	1.281	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](CC[N+](=O)[O-])C1)C(=O)OC(C)(C)C	ZINC000791052053	699608923	/nfs/dbraw/zinc/60/89/23/699608923.db2.gz	KKBYPSYKQSPQGV-GFCCVEGCSA-N	1	1	301.387	1.842	20	5		DDBDMO
COC(=O)[C@H]1CC12CC[NH+](Cn1nc(C)c([N+](=O)[O-])c1C)CC2	ZINC000733790835	699617089	/nfs/dbraw/zinc/61/70/89/699617089.db2.gz	FJBIOLADWXGHFT-GFCCVEGCSA-N	1	1	322.365	1.641	20	5		DDBDMO
C[N@H+](C[C@@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794633934	699820046	/nfs/dbraw/zinc/82/00/46/699820046.db2.gz	XDTSYDQGGBJXPE-JTQLQIEISA-N	1	1	307.306	1.429	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794633934	699820048	/nfs/dbraw/zinc/82/00/48/699820048.db2.gz	XDTSYDQGGBJXPE-JTQLQIEISA-N	1	1	307.306	1.429	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@@H+]1C	ZINC000742199011	699866439	/nfs/dbraw/zinc/86/64/39/699866439.db2.gz	OUKGRLZEOLHKIL-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1C	ZINC000742199011	699866442	/nfs/dbraw/zinc/86/64/42/699866442.db2.gz	OUKGRLZEOLHKIL-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000768845675	701209282	/nfs/dbraw/zinc/20/92/82/701209282.db2.gz	MWOLEGWUPHMAAY-UWVGGRQHSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000768845675	701209283	/nfs/dbraw/zinc/20/92/83/701209283.db2.gz	MWOLEGWUPHMAAY-UWVGGRQHSA-N	1	1	322.321	1.668	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000770302011	701273994	/nfs/dbraw/zinc/27/39/94/701273994.db2.gz	YSTYYGYNCFOBRL-UHFFFAOYSA-N	1	1	319.321	1.445	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2csc([N+](=O)[O-])c2)CCCOC1	ZINC000770675887	701289307	/nfs/dbraw/zinc/28/93/07/701289307.db2.gz	GJWRUDKAQIQFQL-CYBMUJFWSA-N	1	1	314.363	1.858	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](CC(N)=O)C2)c2ccc([N+](=O)[O-])cc12	ZINC000808228547	701509590	/nfs/dbraw/zinc/50/95/90/701509590.db2.gz	UJQJWKNSMJSNOM-NSHDSACASA-N	1	1	317.349	1.408	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](C)Cn1cc[nH+]c1C	ZINC000810616324	701801709	/nfs/dbraw/zinc/80/17/09/701801709.db2.gz	VESZIRSBWWNOGO-JTQLQIEISA-N	1	1	321.337	1.627	20	5		DDBDMO
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])cc2F)CC[N@@H+](C)C1	ZINC000840358617	702082714	/nfs/dbraw/zinc/08/27/14/702082714.db2.gz	CLUYPZUTCOJTAQ-SNVBAGLBSA-N	1	1	311.313	1.275	20	5		DDBDMO
C[C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000847175520	703384177	/nfs/dbraw/zinc/38/41/77/703384177.db2.gz	COZQWZIHHFRWHH-RWMBFGLXSA-N	1	1	315.414	1.436	20	5		DDBDMO
C[C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000847175520	703384180	/nfs/dbraw/zinc/38/41/80/703384180.db2.gz	COZQWZIHHFRWHH-RWMBFGLXSA-N	1	1	315.414	1.436	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000852432328	704045749	/nfs/dbraw/zinc/04/57/49/704045749.db2.gz	MKNMLJLGZXXXBW-LBPRGKRZSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000852432328	704045752	/nfs/dbraw/zinc/04/57/52/704045752.db2.gz	MKNMLJLGZXXXBW-LBPRGKRZSA-N	1	1	321.333	1.630	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000852434048	704047667	/nfs/dbraw/zinc/04/76/67/704047667.db2.gz	WGMHUDIGWSHXEX-ZDUSSCGKSA-N	1	1	321.333	1.500	20	5		DDBDMO
COC[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853497812	704250666	/nfs/dbraw/zinc/25/06/66/704250666.db2.gz	GQFLASLLXSYOPD-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853497812	704250667	/nfs/dbraw/zinc/25/06/67/704250667.db2.gz	GQFLASLLXSYOPD-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CC2CN(C)C2)c2cc([N+](=O)[O-])ccc12	ZINC000853553684	704267327	/nfs/dbraw/zinc/26/73/27/704267327.db2.gz	RVEODVHMLVNSRC-UHFFFAOYSA-N	1	1	303.366	1.704	20	5		DDBDMO
Cc1nn(C[N@H+](C)CC2CN(C)C2)c2cc([N+](=O)[O-])ccc12	ZINC000853553684	704267329	/nfs/dbraw/zinc/26/73/29/704267329.db2.gz	RVEODVHMLVNSRC-UHFFFAOYSA-N	1	1	303.366	1.704	20	5		DDBDMO
Cc1noc(CON=C(N)C[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000853665821	704295835	/nfs/dbraw/zinc/29/58/35/704295835.db2.gz	DHSNSWYTJZHRMI-VIFPVBQESA-N	1	1	311.342	1.764	20	5		DDBDMO
Cc1noc(CON=C(N)C[N@@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000853665821	704295837	/nfs/dbraw/zinc/29/58/37/704295837.db2.gz	DHSNSWYTJZHRMI-VIFPVBQESA-N	1	1	311.342	1.764	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cc([N+](=O)[O-])ccc1N)C2	ZINC000854735266	704445806	/nfs/dbraw/zinc/44/58/06/704445806.db2.gz	MJGUTCKTAPAYMQ-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000824300614	705421432	/nfs/dbraw/zinc/42/14/32/705421432.db2.gz	DGWBFDWTQAFYSY-QWHCGFSZSA-N	1	1	319.361	1.103	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000825526991	705687863	/nfs/dbraw/zinc/68/78/63/705687863.db2.gz	KVCMCOYSMUXBHL-CABCVRRESA-N	1	1	321.377	1.081	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825615414	705703277	/nfs/dbraw/zinc/70/32/77/705703277.db2.gz	VOVQYDSIGGGLGZ-SMDDNHRTSA-N	1	1	309.366	1.475	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@]1(CO)CCOC1	ZINC000862427152	705715755	/nfs/dbraw/zinc/71/57/55/705715755.db2.gz	UZLWNAXXOJFZCX-ZDUSSCGKSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC[C@H]21	ZINC000827338034	705979518	/nfs/dbraw/zinc/97/95/18/705979518.db2.gz	NADCRRXYAWFPCD-JOYOIKCWSA-N	1	1	322.340	1.482	20	5		DDBDMO
CCOC(=O)[C@@H](C)C1C[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000871993205	707272190	/nfs/dbraw/zinc/27/21/90/707272190.db2.gz	MQTQIZYNXVNXQL-NHYWBVRUSA-N	1	1	322.361	1.759	20	5		DDBDMO
CON(C)C(=O)[C@@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865975572	706581696	/nfs/dbraw/zinc/58/16/96/706581696.db2.gz	KJICUQPPGMIFKP-SECBINFHSA-N	1	1	304.306	1.385	20	5		DDBDMO
C[C@@]1(C(F)(F)F)CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000880001600	706850188	/nfs/dbraw/zinc/85/01/88/706850188.db2.gz	RCJQICRFJDBYKI-WDEREUQCSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137800	706887835	/nfs/dbraw/zinc/88/78/35/706887835.db2.gz	KVMDWBWLQJUECK-OAGGEKHMSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137800	706887840	/nfs/dbraw/zinc/88/78/40/706887840.db2.gz	KVMDWBWLQJUECK-OAGGEKHMSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@H+]2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880137800	706887842	/nfs/dbraw/zinc/88/78/42/706887842.db2.gz	KVMDWBWLQJUECK-OAGGEKHMSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000872778802	707596817	/nfs/dbraw/zinc/59/68/17/707596817.db2.gz	BWLWHGHHTQWBSK-NWDGAFQWSA-N	1	1	304.350	1.367	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872781507	707597410	/nfs/dbraw/zinc/59/74/10/707597410.db2.gz	UQKWXPOCQJOZJA-WDEREUQCSA-N	1	1	302.338	1.310	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000882485911	707657185	/nfs/dbraw/zinc/65/71/85/707657185.db2.gz	MHJSAEHKBLOMNM-SNVBAGLBSA-N	1	1	311.313	1.323	20	5		DDBDMO
Cc1nc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221121	708258797	/nfs/dbraw/zinc/25/87/97/708258797.db2.gz	HLOXKMMTJRIJSF-UONOGXRCSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000886589524	708783554	/nfs/dbraw/zinc/78/35/54/708783554.db2.gz	YDTJMYKULRGNMB-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000886589524	708783558	/nfs/dbraw/zinc/78/35/58/708783558.db2.gz	YDTJMYKULRGNMB-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887936700	709172121	/nfs/dbraw/zinc/17/21/21/709172121.db2.gz	TWHBOSVHQYFGFA-WBMJQRKESA-N	1	1	319.361	1.384	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)ccc1[N+](=O)[O-]	ZINC000887939151	709173407	/nfs/dbraw/zinc/17/34/07/709173407.db2.gz	QRCLUURYFJAQMU-CJNGLKHVSA-N	1	1	303.362	1.927	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC([NH+]3CCC3)CC2)c1[N+](=O)[O-]	ZINC000912879566	713113261	/nfs/dbraw/zinc/11/32/61/713113261.db2.gz	HLHMRNIRLWDOFW-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1F	ZINC000928431794	713192940	/nfs/dbraw/zinc/19/29/40/713192940.db2.gz	HAPXCSUVRZWZBK-GZMMTYOYSA-N	1	1	311.313	1.565	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOC(=O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000893392681	710633750	/nfs/dbraw/zinc/63/37/50/710633750.db2.gz	HTXZALWVBPFFOU-GFCCVEGCSA-N	1	1	308.334	1.862	20	5		DDBDMO
O=c1[nH]ccc(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-]	ZINC000895570435	711545550	/nfs/dbraw/zinc/54/55/50/711545550.db2.gz	SYKVXOBFCDZVIF-MWLCHTKSSA-N	1	1	310.379	1.687	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000895709032	711585009	/nfs/dbraw/zinc/58/50/09/711585009.db2.gz	XWXIMQXMKJXXKP-ZDTYVGOBSA-N	1	1	306.318	1.218	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000895709032	711585011	/nfs/dbraw/zinc/58/50/11/711585011.db2.gz	XWXIMQXMKJXXKP-ZDTYVGOBSA-N	1	1	306.318	1.218	20	5		DDBDMO
C[C@H]1[C@@H](Nc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)CC[N@H+]1C	ZINC000895737460	711590867	/nfs/dbraw/zinc/59/08/67/711590867.db2.gz	VRHXZQUCZAELLD-UWVGGRQHSA-N	1	1	319.365	1.290	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000895738496	711591176	/nfs/dbraw/zinc/59/11/76/711591176.db2.gz	WTPHQFJXUIMQHK-PWSUYJOCSA-N	1	1	307.350	1.815	20	5		DDBDMO
C[N@@H+]1CCN(Cn2cc([N+](=O)[O-])cn2)[C@H](c2ccccc2)C1	ZINC000917462759	713499181	/nfs/dbraw/zinc/49/91/81/713499181.db2.gz	IVLDSOXRTIPJIR-HNNXBMFYSA-N	1	1	301.350	1.738	20	5		DDBDMO
C[N@H+]1CCN(Cn2cc([N+](=O)[O-])cn2)[C@H](c2ccccc2)C1	ZINC000917462759	713499183	/nfs/dbraw/zinc/49/91/83/713499183.db2.gz	IVLDSOXRTIPJIR-HNNXBMFYSA-N	1	1	301.350	1.738	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](CCO[C@H]2CCOC2)CC1	ZINC000929245956	713575355	/nfs/dbraw/zinc/57/53/55/713575355.db2.gz	BVCHSBRIYLUHKN-AWEZNQCLSA-N	1	1	321.377	1.522	20	5		DDBDMO
O=[N+]([O-])CCN1CCO[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]21	ZINC000930849528	713937065	/nfs/dbraw/zinc/93/70/65/713937065.db2.gz	NISJLVXVZGMSAN-HZPDHXFCSA-N	1	1	305.378	1.238	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000932647281	714374613	/nfs/dbraw/zinc/37/46/13/714374613.db2.gz	NWCGGTHXNAOPSQ-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000932647281	714374614	/nfs/dbraw/zinc/37/46/14/714374614.db2.gz	NWCGGTHXNAOPSQ-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCO[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000932972253	714446831	/nfs/dbraw/zinc/44/68/31/714446831.db2.gz	QOYAZZRBOKCSOD-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000932972253	714446833	/nfs/dbraw/zinc/44/68/33/714446833.db2.gz	QOYAZZRBOKCSOD-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC[C@@H]1CC1CC1	ZINC000933209228	714537685	/nfs/dbraw/zinc/53/76/85/714537685.db2.gz	CYYGTESYEAJATG-AWEZNQCLSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@@H]1CC1CC1	ZINC000933209228	714537686	/nfs/dbraw/zinc/53/76/86/714537686.db2.gz	CYYGTESYEAJATG-AWEZNQCLSA-N	1	1	307.350	1.257	20	5		DDBDMO
CCC1(CC)CNC(=O)[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1OC	ZINC000933281618	714553679	/nfs/dbraw/zinc/55/36/79/714553679.db2.gz	HUHKYWINLXBAIS-CQSZACIVSA-N	1	1	321.377	1.998	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1C1OCCO1	ZINC000933908717	714699517	/nfs/dbraw/zinc/69/95/17/714699517.db2.gz	KVXGTDVRNWGCCG-ZDUSSCGKSA-N	1	1	308.334	1.811	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1C1OCCO1	ZINC000933908717	714699518	/nfs/dbraw/zinc/69/95/18/714699518.db2.gz	KVXGTDVRNWGCCG-ZDUSSCGKSA-N	1	1	308.334	1.811	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC001165039391	721907090	/nfs/dbraw/zinc/90/70/90/721907090.db2.gz	SKLLZQKMNSWGCW-LBPRGKRZSA-N	1	1	322.365	1.299	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001121199294	782406206	/nfs/dbraw/zinc/40/62/06/782406206.db2.gz	NWIVISKYVGODAB-FZZIBODNSA-N	1	1	307.325	1.804	20	5		DDBDMO
CC(C)(C)c1cnc(NC(=N)NCCCC[NH3+])c([N+](=O)[O-])c1	ZINC001167878439	739167325	/nfs/dbraw/zinc/16/73/25/739167325.db2.gz	SGXQMOAPWMRCSV-UHFFFAOYSA-N	1	1	308.386	1.962	20	5		DDBDMO
O=C(NCC[NH2+]Cc1sccc1Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932255	742776481	/nfs/dbraw/zinc/77/64/81/742776481.db2.gz	ONYMGCCXWAUDFM-VXNVDRBHSA-N	1	1	303.771	1.273	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N[C@@H]3CCC[N@@H+](C4COC4)C3)cn21	ZINC001168371810	743586098	/nfs/dbraw/zinc/58/60/98/743586098.db2.gz	FPKAIHGVPKEIFM-LLVKDONJSA-N	1	1	317.349	1.518	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N[C@@H]3CCC[N@H+](C4COC4)C3)cn21	ZINC001168371810	743586103	/nfs/dbraw/zinc/58/61/03/743586103.db2.gz	FPKAIHGVPKEIFM-LLVKDONJSA-N	1	1	317.349	1.518	20	5		DDBDMO
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169007210	762175025	/nfs/dbraw/zinc/17/50/25/762175025.db2.gz	LWUCKTKQSZHBRU-BARDWOONSA-N	1	1	317.389	1.713	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CCOC[C@@](O)(C(F)(F)F)C2)C1	ZINC001169014420	762178996	/nfs/dbraw/zinc/17/89/96/762178996.db2.gz	ZLZOUOGVAZSCLT-OUAUKWLOSA-N	1	1	312.288	1.057	20	5		DDBDMO
O=C1[C@H]2C[N@@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]2CN1CC1CC1	ZINC001169025218	762203557	/nfs/dbraw/zinc/20/35/57/762203557.db2.gz	YDZUWGPWPFHOBM-AJNGGQMLSA-N	1	1	307.394	1.232	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@@H](N3CCOCC3)[C@@H](F)C2)C1	ZINC001169055293	762210102	/nfs/dbraw/zinc/21/01/02/762210102.db2.gz	PBRGGDSERKFASP-LJISPDSOSA-N	1	1	315.389	1.176	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)C1CCC1	ZINC001169057441	762210835	/nfs/dbraw/zinc/21/08/35/762210835.db2.gz	VIOXNHDUPCBKPX-YUELXQCFSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccc(F)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020138907	760612816	/nfs/dbraw/zinc/61/28/16/760612816.db2.gz	HKLQBTXXVQEVDK-AAVRWANBSA-N	1	1	307.325	1.228	20	5		DDBDMO
CC[N@@H+](CCC(N)=O)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170345042	766277355	/nfs/dbraw/zinc/27/73/55/766277355.db2.gz	GWJFHTYXWJWLIF-NSHDSACASA-N	1	1	309.366	1.732	20	5		DDBDMO
CCC/C=C/CC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001147507450	773156251	/nfs/dbraw/zinc/15/62/51/773156251.db2.gz	ONPBBPSBHYQOPQ-DPOFCPOHSA-N	1	1	321.421	1.932	20	5		DDBDMO
CCC/C=C/CC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147507450	773156254	/nfs/dbraw/zinc/15/62/54/773156254.db2.gz	ONPBBPSBHYQOPQ-DPOFCPOHSA-N	1	1	321.421	1.932	20	5		DDBDMO
CCC/C=C/CC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147507450	773156256	/nfs/dbraw/zinc/15/62/56/773156256.db2.gz	ONPBBPSBHYQOPQ-DPOFCPOHSA-N	1	1	321.421	1.932	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CC[C@H](CO)[C@H](O)C1)CC2	ZINC001172902305	776915807	/nfs/dbraw/zinc/91/58/07/776915807.db2.gz	AKFINVJCANPYTF-BFYDXBDKSA-N	1	1	320.389	1.517	20	5		DDBDMO
CNC(=O)C[N@H+](C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-]	ZINC001173183509	777035374	/nfs/dbraw/zinc/03/53/74/777035374.db2.gz	ZFOPACXRZOGJQF-VIFPVBQESA-N	1	1	313.329	1.351	20	5		DDBDMO
CNC(=O)C[N@@H+](C)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-]	ZINC001173183509	777035380	/nfs/dbraw/zinc/03/53/80/777035380.db2.gz	ZFOPACXRZOGJQF-VIFPVBQESA-N	1	1	313.329	1.351	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)cc1	ZINC001176778477	778235439	/nfs/dbraw/zinc/23/54/39/778235439.db2.gz	VNKUXGPAFFOHOV-QEJZJMRPSA-N	1	1	309.341	1.356	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN2CC[N@H+]3C[C@@H](F)C[C@H]3C2)cc1	ZINC001176778477	778235444	/nfs/dbraw/zinc/23/54/44/778235444.db2.gz	VNKUXGPAFFOHOV-QEJZJMRPSA-N	1	1	309.341	1.356	20	5		DDBDMO
Cc1oncc1C[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178464480	779061022	/nfs/dbraw/zinc/06/10/22/779061022.db2.gz	TXKGSIBWUBIIRX-ZIAGYGMSSA-N	1	1	324.381	1.414	20	5		DDBDMO
CCc1ncc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC001179352816	779341651	/nfs/dbraw/zinc/34/16/51/779341651.db2.gz	IHVJCYHJYDWMIN-MRXNPFEDSA-N	1	1	316.361	1.945	20	5		DDBDMO
CSc1ccc(C(=O)NCC[NH+]2CC=CC2)cc1[N+](=O)[O-]	ZINC001116194658	780483514	/nfs/dbraw/zinc/48/35/14/780483514.db2.gz	TYRKEELKTONVTQ-UHFFFAOYSA-N	1	1	307.375	1.918	20	5		DDBDMO
C[C@@]1(CO)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC001116361044	780500343	/nfs/dbraw/zinc/50/03/43/780500343.db2.gz	FCCJVVVFSCJCGP-GDBMZVCRSA-N	1	1	324.377	1.429	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001116491572	780514595	/nfs/dbraw/zinc/51/45/95/780514595.db2.gz	UITGZBNXQJEUAI-SMDDNHRTSA-N	1	1	307.350	1.216	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3Cl)C[C@H]2C1	ZINC001118916258	781271455	/nfs/dbraw/zinc/27/14/55/781271455.db2.gz	XORIJYKWOCSXEM-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3ccncc3[N+](=O)[O-])CC2)CC1	ZINC001118991997	781292594	/nfs/dbraw/zinc/29/25/94/781292594.db2.gz	VSWXBYUIONZJQD-UHFFFAOYSA-N	1	1	305.382	1.206	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC001119630961	781543330	/nfs/dbraw/zinc/54/33/30/781543330.db2.gz	LMLDAPXQSBCHST-ZDUSSCGKSA-N	1	1	306.366	1.833	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC001119977757	781703519	/nfs/dbraw/zinc/70/35/19/781703519.db2.gz	SPEDRLQKIIRGGA-ZDUSSCGKSA-N	1	1	306.366	1.385	20	5		DDBDMO
CN(C)c1cc(F)c(-c2nnc(C[NH+](C)C)o2)cc1[N+](=O)[O-]	ZINC001329091826	863469675	/nfs/dbraw/zinc/46/96/75/863469675.db2.gz	ATFXPUKGDLJYMD-UHFFFAOYSA-N	1	1	309.301	1.912	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)n1	ZINC001157263713	863690425	/nfs/dbraw/zinc/69/04/25/863690425.db2.gz	BLGDZVAIBDNVEI-WDEREUQCSA-N	1	1	307.354	1.232	20	5		DDBDMO
CN1C[C@@H](CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CC1=O	ZINC001157909927	864250499	/nfs/dbraw/zinc/25/04/99/864250499.db2.gz	TWVWKLLCJUFLFO-SGUJLRQBSA-N	1	1	319.365	1.412	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+](C2CC2)C1	ZINC001330658557	864516114	/nfs/dbraw/zinc/51/61/14/864516114.db2.gz	DKZOSLDVXNCRPZ-NSHDSACASA-N	1	1	318.377	1.733	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ncc(F)cc2[N+](=O)[O-])CC[NH2+]C1	ZINC001159453454	865310803	/nfs/dbraw/zinc/31/08/03/865310803.db2.gz	ROKVZHQBTJXYFK-UHFFFAOYSA-N	1	1	310.285	1.351	20	5		DDBDMO
Cc1nn(CN2CC[N@H+](C)C(C)(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC001333313508	866623134	/nfs/dbraw/zinc/62/31/34/866623134.db2.gz	OEKCXIDGCYDGAM-UHFFFAOYSA-N	1	1	318.381	1.631	20	5		DDBDMO
O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1cnco1	ZINC001321177423	867377327	/nfs/dbraw/zinc/37/73/27/867377327.db2.gz	CUOPRXVIRLKSSR-UPHRSURJSA-N	1	1	322.346	1.720	20	5		DDBDMO
COc1cc(C(=O)NCC[NH+]2CC=CC2)c([N+](=O)[O-])cc1F	ZINC001324701043	867462831	/nfs/dbraw/zinc/46/28/31/867462831.db2.gz	BFLRFCJBJJLGRS-UHFFFAOYSA-N	1	1	309.297	1.344	20	5		DDBDMO
CC(C)n1cc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)nn1	ZINC001336699803	869098832	/nfs/dbraw/zinc/09/88/32/869098832.db2.gz	NHOOBGIMGHECBG-CQSZACIVSA-N	1	1	305.338	1.590	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3nc4ccccn4c3[N+](=O)[O-])[C@H]2C1	ZINC001338161460	869841665	/nfs/dbraw/zinc/84/16/65/869841665.db2.gz	CNOLYLVQGTYZJV-SRVKXCTJSA-N	1	1	301.350	1.995	20	5		DDBDMO
C[NH+](C)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCOCC1	ZINC001338475542	870000572	/nfs/dbraw/zinc/00/05/72/870000572.db2.gz	SRDLXLVEZSMCDM-OAHLLOKOSA-N	1	1	323.393	1.329	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC001339923683	870787607	/nfs/dbraw/zinc/78/76/07/870787607.db2.gz	WHIIBYKAXPFHKS-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2C[N@@H+](CC)CC2(C)C)c1[N+](=O)[O-]	ZINC001304042443	871181270	/nfs/dbraw/zinc/18/12/70/871181270.db2.gz	JHGTVMOMFHWSQH-LLVKDONJSA-N	1	1	323.397	1.731	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001307157858	871403266	/nfs/dbraw/zinc/40/32/66/871403266.db2.gz	ZZPSEZOONANOML-MNOVXSKESA-N	1	1	320.349	1.164	20	5		DDBDMO
COc1c(O)ccc(CNC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC001342898356	872427600	/nfs/dbraw/zinc/42/76/00/872427600.db2.gz	QVUUNJXGKDNGHX-NSHDSACASA-N	1	1	321.377	1.883	20	5		DDBDMO
C[C@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cn2)C1	ZINC001226733070	882618788	/nfs/dbraw/zinc/61/87/88/882618788.db2.gz	GPOJQFLFGLOMGC-DGCLKSJQSA-N	1	1	315.333	1.994	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC001319297820	872549140	/nfs/dbraw/zinc/54/91/40/872549140.db2.gz	DQSSYPVMVROHCN-NSHDSACASA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[N@@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC001319297820	872549151	/nfs/dbraw/zinc/54/91/51/872549151.db2.gz	DQSSYPVMVROHCN-NSHDSACASA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC001319297820	872549156	/nfs/dbraw/zinc/54/91/56/872549156.db2.gz	DQSSYPVMVROHCN-NSHDSACASA-N	1	1	321.381	1.752	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C	ZINC001227185374	882898655	/nfs/dbraw/zinc/89/86/55/882898655.db2.gz	QFCZEDBYTUAWBQ-SUHUHFCYSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001227185374	882898667	/nfs/dbraw/zinc/89/86/67/882898667.db2.gz	QFCZEDBYTUAWBQ-SUHUHFCYSA-N	1	1	306.318	1.786	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC001215998117	876839688	/nfs/dbraw/zinc/83/96/88/876839688.db2.gz	UVDJMWPEBSDAIW-NSHDSACASA-N	1	1	307.354	1.265	20	5		DDBDMO
C[C@H](NC(=O)C[NH+]1CCC(CO)CC1)c1ccccc1[N+](=O)[O-]	ZINC001353777037	877555555	/nfs/dbraw/zinc/55/55/55/877555555.db2.gz	OHXFQRYOGYRYTQ-LBPRGKRZSA-N	1	1	321.377	1.476	20	5		DDBDMO
CCCC(=O)NCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001222232087	880347895	/nfs/dbraw/zinc/34/78/95/880347895.db2.gz	CJZADGPZSRYDBV-UHFFFAOYSA-N	1	1	323.397	1.457	20	5		DDBDMO
CC/C=C/CC[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001223114968	880836127	/nfs/dbraw/zinc/83/61/27/880836127.db2.gz	ZAJOYXORAKBQMW-LRPXVYOUSA-N	1	1	309.410	1.836	20	5		DDBDMO
OC[C@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@H]1O	ZINC001232218316	886166556	/nfs/dbraw/zinc/16/65/56/886166556.db2.gz	FUPHJKIPJQJFDN-NVXWUHKLSA-N	1	1	323.396	1.958	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H](C)Cn1cc[nH+]c1C	ZINC001291813943	913581924	/nfs/dbraw/zinc/58/19/24/913581924.db2.gz	XHKACDQGCZOBCN-SNVBAGLBSA-N	1	1	320.353	1.057	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H]1O	ZINC001254474694	896456895	/nfs/dbraw/zinc/45/68/95/896456895.db2.gz	SVXRQHSQOFNNGX-LRDDRELGSA-N	1	1	305.378	1.876	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCO[C@@]3(CCOC3)C1)C2	ZINC001254593216	896521843	/nfs/dbraw/zinc/52/18/43/896521843.db2.gz	KAUNHDMLNPFOCF-CVEARBPZSA-N	1	1	304.346	1.553	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCC[C@@H](n3ccnn3)C1)C2	ZINC001254610585	896530286	/nfs/dbraw/zinc/53/02/86/896530286.db2.gz	LHJAHDMAQCYOQT-HZPDHXFCSA-N	1	1	313.361	1.991	20	5		DDBDMO
O=C(NCC[NH+]1CC=CC1)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC001262155873	899991246	/nfs/dbraw/zinc/99/12/46/899991246.db2.gz	XWLYZJIMNISJLT-UHFFFAOYSA-N	1	1	313.716	1.989	20	5		DDBDMO
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2C[N@@H+](CC[N+](=O)[O-])C[C@H]21	ZINC001262256057	900055804	/nfs/dbraw/zinc/05/58/04/900055804.db2.gz	DYEHYZDGVASTLZ-YNEHKIRRSA-N	1	1	313.398	1.888	20	5		DDBDMO
COCC(=O)N(C)CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001280776391	904017981	/nfs/dbraw/zinc/01/79/81/904017981.db2.gz	IVBWFTKYIKNVOH-UHFFFAOYSA-N	1	1	309.366	1.522	20	5		DDBDMO
Cc1conc1C[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001282295227	905666926	/nfs/dbraw/zinc/66/69/26/905666926.db2.gz	SSGKVJKUZOITMG-DGCLKSJQSA-N	1	1	324.381	1.222	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)cc1	ZINC000451306466	231063116	/nfs/dbraw/zinc/06/31/16/231063116.db2.gz	YHKCGJXGGUVPCI-DJIMGWMZSA-N	1	1	320.389	1.999	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000451920287	231232365	/nfs/dbraw/zinc/23/23/65/231232365.db2.gz	ADTAKRRHYNJMLT-HNNXBMFYSA-N	1	1	310.350	1.304	20	5		DDBDMO
CN1C(=O)CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1=O	ZINC000090030071	185278921	/nfs/dbraw/zinc/27/89/21/185278921.db2.gz	IQBWZERFEADYKL-NSHDSACASA-N	1	1	311.725	1.485	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000458204267	530060423	/nfs/dbraw/zinc/06/04/23/530060423.db2.gz	YUJPZSKCYIOVJJ-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000458222727	530061021	/nfs/dbraw/zinc/06/10/21/530061021.db2.gz	QMTTYOJKTGTPRR-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[NH+](C)CC1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000330786026	232066734	/nfs/dbraw/zinc/06/67/34/232066734.db2.gz	UXNZABRXPWGMON-UHFFFAOYSA-N	1	1	307.350	1.714	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000330889571	232139889	/nfs/dbraw/zinc/13/98/89/232139889.db2.gz	BMNRAYCQQARCQI-WDEREUQCSA-N	1	1	309.370	1.125	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000279755236	215119216	/nfs/dbraw/zinc/11/92/16/215119216.db2.gz	LUQYLYLCXHMVLE-BXUZGUMPSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000279785214	215143773	/nfs/dbraw/zinc/14/37/73/215143773.db2.gz	UWXOSIBUIBNCBP-CZUORRHYSA-N	1	1	323.393	1.281	20	5		DDBDMO
O=C(NCC[N@H+]1CC=CCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000279908368	215227444	/nfs/dbraw/zinc/22/74/44/215227444.db2.gz	FHLUJTAUVUQRCQ-UHFFFAOYSA-N	1	1	320.305	1.495	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000279908368	215227448	/nfs/dbraw/zinc/22/74/48/215227448.db2.gz	FHLUJTAUVUQRCQ-UHFFFAOYSA-N	1	1	320.305	1.495	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2cccnc2[N+](=O)[O-])CC1	ZINC000617470536	363123216	/nfs/dbraw/zinc/12/32/16/363123216.db2.gz	GXUJLGDTBCCVNZ-UHFFFAOYSA-N	1	1	302.338	1.804	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@H](C)O1	ZINC000054925853	352710278	/nfs/dbraw/zinc/71/02/78/352710278.db2.gz	LHQRTSYUYYVJIJ-QWRGUYRKSA-N	1	1	324.381	1.541	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCCCn2cc[nH+]c2C)c1	ZINC000062271202	352897231	/nfs/dbraw/zinc/89/72/31/352897231.db2.gz	SFKMXLPBEXIYHA-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000182085304	199384709	/nfs/dbraw/zinc/38/47/09/199384709.db2.gz	WUNAAGJWRUSRMS-CYBMUJFWSA-N	1	1	321.377	1.664	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)Cc2ccc([N+](=O)[O-])cc2)n1C	ZINC000074094846	353290839	/nfs/dbraw/zinc/29/08/39/353290839.db2.gz	FYWNIVGEYJEKLP-UHFFFAOYSA-N	1	1	317.349	1.253	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000174296088	198315988	/nfs/dbraw/zinc/31/59/88/198315988.db2.gz	WJEZXFKEUYGRMU-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000174296088	198315990	/nfs/dbraw/zinc/31/59/90/198315990.db2.gz	WJEZXFKEUYGRMU-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000174299871	198316513	/nfs/dbraw/zinc/31/65/13/198316513.db2.gz	LLXHPKQFPPDTPU-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000174299871	198316515	/nfs/dbraw/zinc/31/65/15/198316515.db2.gz	LLXHPKQFPPDTPU-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ncc(C)cc2[N+](=O)[O-])CC1	ZINC000078632332	353526002	/nfs/dbraw/zinc/52/60/02/353526002.db2.gz	NUZWKKBGCFDBRE-CQSZACIVSA-N	1	1	321.425	1.984	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H](O)C1CC1	ZINC000079769570	353576697	/nfs/dbraw/zinc/57/66/97/353576697.db2.gz	NYPVLZVAOOTCSA-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H](O)C1CC1	ZINC000079769570	353576698	/nfs/dbraw/zinc/57/66/98/353576698.db2.gz	NYPVLZVAOOTCSA-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000091742980	353835235	/nfs/dbraw/zinc/83/52/35/353835235.db2.gz	ITWBEZSZLFXIID-YPMHNXCESA-N	1	1	307.398	1.811	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1	ZINC000141331809	354139479	/nfs/dbraw/zinc/13/94/79/354139479.db2.gz	XGBODVFMKSORMP-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000142016478	354143000	/nfs/dbraw/zinc/14/30/00/354143000.db2.gz	JSSYBNYWENUBOJ-GFCCVEGCSA-N	1	1	304.350	1.609	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1OC	ZINC000276850932	354413671	/nfs/dbraw/zinc/41/36/71/354413671.db2.gz	IWDFCUYDRCCQGQ-GASCZTMLSA-N	1	1	310.350	1.709	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305729958	354471279	/nfs/dbraw/zinc/47/12/79/354471279.db2.gz	KFAPPIXVFAAEFK-IINYFYTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C[C@@H](C)C1	ZINC000346216131	283032528	/nfs/dbraw/zinc/03/25/28/283032528.db2.gz	IAARIYJUMISKAV-MJVIPROJSA-N	1	1	306.366	1.725	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588861855	354944336	/nfs/dbraw/zinc/94/43/36/354944336.db2.gz	VSYGJQZVQCHZQS-NEPJUHHUSA-N	1	1	323.324	1.015	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c1	ZINC000590053373	355044898	/nfs/dbraw/zinc/04/48/98/355044898.db2.gz	UCVORINUXYLTOK-ITGUQSILSA-N	1	1	306.318	1.052	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c1	ZINC000590053373	355044900	/nfs/dbraw/zinc/04/49/00/355044900.db2.gz	UCVORINUXYLTOK-ITGUQSILSA-N	1	1	306.318	1.052	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000590402431	355085413	/nfs/dbraw/zinc/08/54/13/355085413.db2.gz	UDGVNVRIDJSCJA-GJZGRUSLSA-N	1	1	319.361	1.530	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000590446399	355099681	/nfs/dbraw/zinc/09/96/81/355099681.db2.gz	TVSMNOSSPTXYPE-ZANVPECISA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@H+]1C[C@H]2[C@@H](CCN2C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000590446399	355099684	/nfs/dbraw/zinc/09/96/84/355099684.db2.gz	TVSMNOSSPTXYPE-ZANVPECISA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000590446399	355099686	/nfs/dbraw/zinc/09/96/86/355099686.db2.gz	TVSMNOSSPTXYPE-ZANVPECISA-N	1	1	315.333	1.247	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000590452372	355100764	/nfs/dbraw/zinc/10/07/64/355100764.db2.gz	BNIRHWZXANYHLC-JTQLQIEISA-N	1	1	307.354	1.264	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594081515	356107828	/nfs/dbraw/zinc/10/78/28/356107828.db2.gz	OFPMLORGBRPJLP-AAEUAGOBSA-N	1	1	319.365	1.550	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594198078	356136675	/nfs/dbraw/zinc/13/66/75/356136675.db2.gz	CXFPOGWXZNSHNF-KBPBESRZSA-N	1	1	321.381	1.315	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594200419	356137975	/nfs/dbraw/zinc/13/79/75/356137975.db2.gz	LVXPZTJKPOFQEM-RYUDHWBXSA-N	1	1	321.381	1.383	20	5		DDBDMO
CCn1cc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])nn1	ZINC000594716286	356294586	/nfs/dbraw/zinc/29/45/86/356294586.db2.gz	OFXATYKJUBVCLM-UHFFFAOYSA-N	1	1	318.337	1.325	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NCc2cc(OC)c(O)cc2[N+](=O)[O-])C1	ZINC000594992768	356369814	/nfs/dbraw/zinc/36/98/14/356369814.db2.gz	XHGCQIRFAUDSJY-LBPRGKRZSA-N	1	1	309.366	1.883	20	5		DDBDMO
CCCN1CC[C@H]([NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])C1	ZINC000594992768	356369819	/nfs/dbraw/zinc/36/98/19/356369819.db2.gz	XHGCQIRFAUDSJY-LBPRGKRZSA-N	1	1	309.366	1.883	20	5		DDBDMO
Cc1noc(CN2CC[NH+](CCOC(C)C)CC2)c1[N+](=O)[O-]	ZINC000595330416	356451006	/nfs/dbraw/zinc/45/10/06/356451006.db2.gz	AXBQPHLLDSZGSW-UHFFFAOYSA-N	1	1	312.370	1.434	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@@H](N3CCOCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000595493930	356516750	/nfs/dbraw/zinc/51/67/50/356516750.db2.gz	XEORYTOFGUISES-PWSUYJOCSA-N	1	1	310.354	1.186	20	5		DDBDMO
Cc1noc(C[N@@H+]2C[C@@H](N3CCOCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000595493930	356516753	/nfs/dbraw/zinc/51/67/53/356516753.db2.gz	XEORYTOFGUISES-PWSUYJOCSA-N	1	1	310.354	1.186	20	5		DDBDMO
C[C@]1(C2CC2)C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000595624735	356581973	/nfs/dbraw/zinc/58/19/73/356581973.db2.gz	FKGBOBYORKWEQO-OAHLLOKOSA-N	1	1	307.350	1.257	20	5		DDBDMO
C[C@]1(C2CC2)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000595624735	356581977	/nfs/dbraw/zinc/58/19/77/356581977.db2.gz	FKGBOBYORKWEQO-OAHLLOKOSA-N	1	1	307.350	1.257	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H]3COC[C@]3(C)C2)c1	ZINC000595761070	356641856	/nfs/dbraw/zinc/64/18/56/356641856.db2.gz	WNUKVDSDRIPXAG-BBRMVZONSA-N	1	1	320.345	1.850	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC(CO)(CO)C2)cc1	ZINC000595800933	356655773	/nfs/dbraw/zinc/65/57/73/356655773.db2.gz	UHAOCJGEKYBMMB-UHFFFAOYSA-N	1	1	310.350	1.040	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC2(COC2)C1	ZINC000595834374	356670442	/nfs/dbraw/zinc/67/04/42/356670442.db2.gz	OVDOWGBWFJKDPM-UHFFFAOYSA-N	1	1	305.334	1.564	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC2(COC2)C1	ZINC000595834374	356670443	/nfs/dbraw/zinc/67/04/43/356670443.db2.gz	OVDOWGBWFJKDPM-UHFFFAOYSA-N	1	1	305.334	1.564	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC3(COC3)C2)cccc1[N+](=O)[O-]	ZINC000595832478	356668750	/nfs/dbraw/zinc/66/87/50/356668750.db2.gz	DLACPADFDDMYJY-UHFFFAOYSA-N	1	1	319.361	1.954	20	5		DDBDMO
C[N@H+](CC1=CCSC1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595888446	356692384	/nfs/dbraw/zinc/69/23/84/356692384.db2.gz	MCQQTXVCSRJBFU-ZDUSSCGKSA-N	1	1	324.402	1.940	20	5		DDBDMO
C[N@H+](CC1=CCSC1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595895043	356695204	/nfs/dbraw/zinc/69/52/04/356695204.db2.gz	BQKPATCKCHCKRL-CQSZACIVSA-N	1	1	324.402	1.940	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)c(F)c1	ZINC000595864799	356683286	/nfs/dbraw/zinc/68/32/86/356683286.db2.gz	CTHSHAMWLGUZEJ-HNNXBMFYSA-N	1	1	323.368	1.765	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC[NH2+]CC1	ZINC000237101040	202154493	/nfs/dbraw/zinc/15/44/93/202154493.db2.gz	YIDMJTMHCCAIFC-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)CC2(O)CCOCC2)ccc1[N+](=O)[O-]	ZINC000276917586	213174615	/nfs/dbraw/zinc/17/46/15/213174615.db2.gz	ONOPQNNQVYSDNF-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@]1(C)CO	ZINC000597237039	357105519	/nfs/dbraw/zinc/10/55/19/357105519.db2.gz	VZCDNDMKWCXXHT-MEDUHNTESA-N	1	1	322.361	1.816	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598650807	357670327	/nfs/dbraw/zinc/67/03/27/357670327.db2.gz	OXQNQBOIWBPGGZ-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598650807	357670328	/nfs/dbraw/zinc/67/03/28/357670328.db2.gz	OXQNQBOIWBPGGZ-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000598716207	357701698	/nfs/dbraw/zinc/70/16/98/357701698.db2.gz	AIFMNIWVMXDIRD-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1C[C@@H](O)C1	ZINC000599670515	358018479	/nfs/dbraw/zinc/01/84/79/358018479.db2.gz	GLHGDQILAQLDNG-GSJFWJNXSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H]1C[C@@H](O)C1	ZINC000599670515	358018483	/nfs/dbraw/zinc/01/84/83/358018483.db2.gz	GLHGDQILAQLDNG-GSJFWJNXSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC1CC([NH+]2CCOCC2)C1	ZINC000600068512	358113877	/nfs/dbraw/zinc/11/38/77/358113877.db2.gz	FVRCCFLGCICGNP-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000600534368	358250272	/nfs/dbraw/zinc/25/02/72/358250272.db2.gz	VIEDSHLOXWFURH-GFCCVEGCSA-N	1	1	319.317	1.137	20	5		DDBDMO
C[C@@H]1[C@H](C)N(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C	ZINC000601136473	358416937	/nfs/dbraw/zinc/41/69/37/358416937.db2.gz	FLTNWQYPPPAFOG-SFYZADRCSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1[C@H](C)N(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@@H+]1C	ZINC000601136473	358416940	/nfs/dbraw/zinc/41/69/40/358416940.db2.gz	FLTNWQYPPPAFOG-SFYZADRCSA-N	1	1	321.303	1.876	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](O)[C@H](CO)C3)c2c1	ZINC000601175512	358433771	/nfs/dbraw/zinc/43/37/71/358433771.db2.gz	ICHDYARWBKHATG-BONVTDFDSA-N	1	1	303.318	1.323	20	5		DDBDMO
O=c1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c[nH]1	ZINC000602439636	358977106	/nfs/dbraw/zinc/97/71/06/358977106.db2.gz	OUHNJHNMGFROOA-UHFFFAOYSA-N	1	1	315.333	1.413	20	5		DDBDMO
Cn1cc(C[N@H+](CCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602780442	359186001	/nfs/dbraw/zinc/18/60/01/359186001.db2.gz	UQWWQJYEQXSABV-HNNXBMFYSA-N	1	1	316.361	1.810	20	5		DDBDMO
Cn1cc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602780442	359186004	/nfs/dbraw/zinc/18/60/04/359186004.db2.gz	UQWWQJYEQXSABV-HNNXBMFYSA-N	1	1	316.361	1.810	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](N2CCCC2=O)C1	ZINC000602780652	359186547	/nfs/dbraw/zinc/18/65/47/359186547.db2.gz	BHBWLTQHYLKEFO-CYBMUJFWSA-N	1	1	321.381	1.187	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000602782545	359187215	/nfs/dbraw/zinc/18/72/15/359187215.db2.gz	CSJMQSHSYFHWGH-ZIAGYGMSSA-N	1	1	307.398	1.516	20	5		DDBDMO
C[C@@H](C[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000602687980	359126084	/nfs/dbraw/zinc/12/60/84/359126084.db2.gz	SXULIVPRXYKUJM-JTQLQIEISA-N	1	1	312.370	1.738	20	5		DDBDMO
C[C@@H](C[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000602687980	359126085	/nfs/dbraw/zinc/12/60/85/359126085.db2.gz	SXULIVPRXYKUJM-JTQLQIEISA-N	1	1	312.370	1.738	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@@H]1[C@@H]1CNC(=O)C1	ZINC000602795885	359197447	/nfs/dbraw/zinc/19/74/47/359197447.db2.gz	BYAGAKDJUMSECD-QWHCGFSZSA-N	1	1	321.381	1.090	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C)O[C@@]2(CCO[C@H]2C)C1	ZINC000602819416	359214146	/nfs/dbraw/zinc/21/41/46/359214146.db2.gz	BGPUSIKALOJBCS-HUBLWGQQSA-N	1	1	324.381	1.368	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](C)OC2(CCOCC2)C1	ZINC000602823055	359217480	/nfs/dbraw/zinc/21/74/80/359217480.db2.gz	VQPNNXBFFDUINY-LBPRGKRZSA-N	1	1	324.381	1.370	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602825506	359219573	/nfs/dbraw/zinc/21/95/73/359219573.db2.gz	CFQVTGNSUBDLGZ-CYBMUJFWSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H]3C[C@@]3(O)C2)cccc1[N+](=O)[O-]	ZINC000603092733	359397604	/nfs/dbraw/zinc/39/76/04/359397604.db2.gz	YYXJFDPNFUAGRE-IAQYHMDHSA-N	1	1	305.334	1.298	20	5		DDBDMO
CN(C(=O)C[NH+]1CCC(C)(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000186900286	200028485	/nfs/dbraw/zinc/02/84/85/200028485.db2.gz	MXQWXGZXKWVFIT-UHFFFAOYSA-N	1	1	321.377	1.652	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C	ZINC000603396384	359613960	/nfs/dbraw/zinc/61/39/60/359613960.db2.gz	ICBVGDJBWUUVAI-MNOVXSKESA-N	1	1	309.370	1.240	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@@H]3NC(=O)OC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000281150305	216114038	/nfs/dbraw/zinc/11/40/38/216114038.db2.gz	FKGCOCWJGUAEDM-OLZOCXBDSA-N	1	1	305.334	1.834	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000189408784	200396332	/nfs/dbraw/zinc/39/63/32/200396332.db2.gz	GXMRGCJAKJVNSE-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000189408784	200396334	/nfs/dbraw/zinc/39/63/34/200396334.db2.gz	GXMRGCJAKJVNSE-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2C)C1	ZINC000609268852	360285586	/nfs/dbraw/zinc/28/55/86/360285586.db2.gz	GPOWWALPDFSGAM-GFCCVEGCSA-N	1	1	322.365	1.139	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2C)C1	ZINC000609269643	360285812	/nfs/dbraw/zinc/28/58/12/360285812.db2.gz	UHUZLFGDZFDJOD-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H]3NC(=O)OC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000281199915	216148986	/nfs/dbraw/zinc/14/89/86/216148986.db2.gz	CKDVLBFFISQYGN-OLZOCXBDSA-N	1	1	305.334	1.834	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C[C@@H]1C	ZINC000611087777	360618583	/nfs/dbraw/zinc/61/85/83/360618583.db2.gz	JIFXFADPXQIQHW-NSHDSACASA-N	1	1	323.397	1.351	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@H]1C	ZINC000611088152	360619767	/nfs/dbraw/zinc/61/97/67/360619767.db2.gz	FRUKRSVEBPPYHP-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@H]1C	ZINC000611088152	360619774	/nfs/dbraw/zinc/61/97/74/360619774.db2.gz	FRUKRSVEBPPYHP-SNVBAGLBSA-N	1	1	317.349	1.637	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C(C)(C)CO)CC2)cc([N+](=O)[O-])c1	ZINC000611515673	360742675	/nfs/dbraw/zinc/74/26/75/360742675.db2.gz	KJNMXTVKICAZAZ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC2=CC[N@@H+](C)CC2)c1	ZINC000271902338	209310106	/nfs/dbraw/zinc/31/01/06/209310106.db2.gz	GVXIXURLAKOTEI-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CCN(c2[nH]cc[nH+]2)CC1	ZINC000618903271	363789932	/nfs/dbraw/zinc/78/99/32/363789932.db2.gz	OFXBHJBFVOMOGP-UHFFFAOYSA-N	1	1	305.313	1.779	20	5		DDBDMO
C[N@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)NCc1cccs1	ZINC000350081831	284144588	/nfs/dbraw/zinc/14/45/88/284144588.db2.gz	QDKXCJUIQWATDH-UHFFFAOYSA-N	1	1	323.378	1.101	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC(=O)NCc1cccs1	ZINC000350081831	284144590	/nfs/dbraw/zinc/14/45/90/284144590.db2.gz	QDKXCJUIQWATDH-UHFFFAOYSA-N	1	1	323.378	1.101	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@H](c2ccccc2)C1	ZINC000351486023	284336450	/nfs/dbraw/zinc/33/64/50/284336450.db2.gz	LTSBOBKVIUSAIH-ZFWWWQNUSA-N	1	1	314.345	1.751	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000266271876	205228450	/nfs/dbraw/zinc/22/84/50/205228450.db2.gz	RIHRBFFGSWHSQL-LBPRGKRZSA-N	1	1	309.341	1.892	20	5		DDBDMO
C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266416826	205331072	/nfs/dbraw/zinc/33/10/72/205331072.db2.gz	HORHLHQYLUZQQV-IAQYHMDHSA-N	1	1	322.340	1.984	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000336861783	249269718	/nfs/dbraw/zinc/26/97/18/249269718.db2.gz	ARZQVISWZHXXCT-UHFFFAOYSA-N	1	1	307.285	1.251	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000041873580	183223426	/nfs/dbraw/zinc/22/34/26/183223426.db2.gz	XOFANOYLFLYHNF-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285072824	218279048	/nfs/dbraw/zinc/27/90/48/218279048.db2.gz	HCYVJHLADODKSH-NSHDSACASA-N	1	1	309.370	1.560	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917673	251275538	/nfs/dbraw/zinc/27/55/38/251275538.db2.gz	UWDBFHJLMILHSN-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917673	251275542	/nfs/dbraw/zinc/27/55/42/251275542.db2.gz	UWDBFHJLMILHSN-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269193918	207314651	/nfs/dbraw/zinc/31/46/51/207314651.db2.gz	PBWGHVGIRHYRAX-LLVKDONJSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269193918	207314652	/nfs/dbraw/zinc/31/46/52/207314652.db2.gz	PBWGHVGIRHYRAX-LLVKDONJSA-N	1	1	307.350	1.905	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCO)CC3CC3)o2)cc1	ZINC000352490797	285087805	/nfs/dbraw/zinc/08/78/05/285087805.db2.gz	LIGQPXRHVIAPQB-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1	ZINC000288627598	220302353	/nfs/dbraw/zinc/30/23/53/220302353.db2.gz	YGPJIFAQUAGHRG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1	ZINC000288627598	220302355	/nfs/dbraw/zinc/30/23/55/220302355.db2.gz	YGPJIFAQUAGHRG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1noc([C@@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000157756879	197212825	/nfs/dbraw/zinc/21/28/25/197212825.db2.gz	FUMLQOLTJVMEHH-LLVKDONJSA-N	1	1	306.326	1.362	20	5		DDBDMO
Cc1noc([C@H]2CCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)n1	ZINC000157757032	197212606	/nfs/dbraw/zinc/21/26/06/197212606.db2.gz	FUMLQOLTJVMEHH-NSHDSACASA-N	1	1	306.326	1.362	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCC[C@H]1O	ZINC000352657397	285202004	/nfs/dbraw/zinc/20/20/04/285202004.db2.gz	AEEYUQQXBRDGAU-CHWSQXEVSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCC[C@H]1O	ZINC000352657397	285202005	/nfs/dbraw/zinc/20/20/05/285202005.db2.gz	AEEYUQQXBRDGAU-CHWSQXEVSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)CCn3cc([N+](=O)[O-])cn3)CC[C@@H]21	ZINC000154904403	197004260	/nfs/dbraw/zinc/00/42/60/197004260.db2.gz	VYMZUZPTLAMBIX-OCCSQVGLSA-N	1	1	321.381	1.124	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000331596399	533370749	/nfs/dbraw/zinc/37/07/49/533370749.db2.gz	UCNSFDSJZCGBFG-ZIAGYGMSSA-N	1	1	312.370	1.043	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000451629619	533327497	/nfs/dbraw/zinc/32/74/97/533327497.db2.gz	KJAULPFUSAKPPH-SLEUVZQESA-N	1	1	318.377	1.558	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2CCO)c([N+](=O)[O-])c1	ZINC000072044679	406872521	/nfs/dbraw/zinc/87/25/21/406872521.db2.gz	HRRSCRZAABYUGE-CYBMUJFWSA-N	1	1	307.350	1.431	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c1C	ZINC000088059572	407120951	/nfs/dbraw/zinc/12/09/51/407120951.db2.gz	IYHBKNQXUSAUFN-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000066835227	407260575	/nfs/dbraw/zinc/26/05/75/407260575.db2.gz	XYORAEABXDJNPV-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000066835227	407260577	/nfs/dbraw/zinc/26/05/77/407260577.db2.gz	XYORAEABXDJNPV-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC[C@](C)(O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000123613406	407334527	/nfs/dbraw/zinc/33/45/27/407334527.db2.gz	ZXFAUFMJFKBKEG-INIZCTEOSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC(=O)N1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000178568725	407496888	/nfs/dbraw/zinc/49/68/88/407496888.db2.gz	OAWCYTWTJSHJBT-OAHLLOKOSA-N	1	1	307.350	1.182	20	5		DDBDMO
CC(=O)N1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000178568725	407496894	/nfs/dbraw/zinc/49/68/94/407496894.db2.gz	OAWCYTWTJSHJBT-OAHLLOKOSA-N	1	1	307.350	1.182	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000270967019	407441875	/nfs/dbraw/zinc/44/18/75/407441875.db2.gz	VTLDDFAQAVVHFE-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCOC1	ZINC000128579517	407552333	/nfs/dbraw/zinc/55/23/33/407552333.db2.gz	XRYLBFMZEALRGU-NSHDSACASA-N	1	1	311.313	1.783	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000266555542	407557094	/nfs/dbraw/zinc/55/70/94/407557094.db2.gz	VVLGYKRKLZBDPH-MNOVXSKESA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000266555542	407557098	/nfs/dbraw/zinc/55/70/98/407557098.db2.gz	VVLGYKRKLZBDPH-MNOVXSKESA-N	1	1	313.379	1.279	20	5		DDBDMO
CC[C@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000266397159	407537315	/nfs/dbraw/zinc/53/73/15/407537315.db2.gz	OXUDAIOITGXYOQ-STQMWFEESA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@H]([NH3+])C1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000178812974	407611609	/nfs/dbraw/zinc/61/16/09/407611609.db2.gz	CRKFSHRIHAQEAG-VIFPVBQESA-N	1	1	317.349	1.671	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000266758726	407626062	/nfs/dbraw/zinc/62/60/62/407626062.db2.gz	GUPCUFICYSYZNT-CQSZACIVSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@H]2C1	ZINC000171584489	407711498	/nfs/dbraw/zinc/71/14/98/407711498.db2.gz	NBTVRIHNBQAFBW-NPQIQWPPSA-N	1	1	301.346	1.915	20	5		DDBDMO
CC(C)COC[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000153140632	407762923	/nfs/dbraw/zinc/76/29/23/407762923.db2.gz	UARRHIGTNAZYDN-AWEZNQCLSA-N	1	1	308.378	1.986	20	5		DDBDMO
CC(C)COC[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000153140632	407762929	/nfs/dbraw/zinc/76/29/29/407762929.db2.gz	UARRHIGTNAZYDN-AWEZNQCLSA-N	1	1	308.378	1.986	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000186779784	407769336	/nfs/dbraw/zinc/76/93/36/407769336.db2.gz	ZSQVKANIAPZPIT-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000117295788	407827221	/nfs/dbraw/zinc/82/72/21/407827221.db2.gz	WSISLICBJDJUTI-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000117295788	407827222	/nfs/dbraw/zinc/82/72/22/407827222.db2.gz	WSISLICBJDJUTI-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[NH2+][C@@H](C)C1	ZINC000237692570	407835155	/nfs/dbraw/zinc/83/51/55/407835155.db2.gz	ZGHHCEGUOXKARN-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000187436475	407857505	/nfs/dbraw/zinc/85/75/05/407857505.db2.gz	DZQTUDSYOUPWEN-DOMZBBRYSA-N	1	1	321.377	1.950	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC000117982756	407874712	/nfs/dbraw/zinc/87/47/12/407874712.db2.gz	BSIXMGMMMKRNPE-UHFFFAOYSA-N	1	1	310.310	1.493	20	5		DDBDMO
CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000153982410	407945760	/nfs/dbraw/zinc/94/57/60/407945760.db2.gz	FXAGPSIPIHCXKA-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCC[N@@H+](C)C1	ZINC000118841579	407955216	/nfs/dbraw/zinc/95/52/16/407955216.db2.gz	RZPPKMJOWJODGK-LBPRGKRZSA-N	1	1	320.393	1.467	20	5		DDBDMO
CSC[C@@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000188067383	407915731	/nfs/dbraw/zinc/91/57/31/407915731.db2.gz	QANAIYGPYLXJFD-JQWIXIFHSA-N	1	1	312.395	1.200	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000268162282	407923024	/nfs/dbraw/zinc/92/30/24/407923024.db2.gz	CZEFGTNBLRUUKA-BXUZGUMPSA-N	1	1	303.362	1.736	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000153962724	407943229	/nfs/dbraw/zinc/94/32/29/407943229.db2.gz	TZMOLVKYLBOCPY-HNNXBMFYSA-N	1	1	305.378	1.936	20	5		DDBDMO
Cc1cc(C2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)n[nH]1	ZINC000273039241	408030061	/nfs/dbraw/zinc/03/00/61/408030061.db2.gz	WHMDDLPXWGIKMS-UHFFFAOYSA-N	1	1	304.354	1.702	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ccc([N+](=O)[O-])c(C)n2)CC1	ZINC000268431889	408041376	/nfs/dbraw/zinc/04/13/76/408041376.db2.gz	BGJRRIPLDLQPCI-CYBMUJFWSA-N	1	1	321.425	1.984	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272596235	408002010	/nfs/dbraw/zinc/00/20/10/408002010.db2.gz	IMISXLNLOUTTKI-QMTHXVAHSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC1(CO)CC1	ZINC000190031890	408151278	/nfs/dbraw/zinc/15/12/78/408151278.db2.gz	WBOQRDVOJGWPSQ-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
CCN1CC[NH+](C[C@@H](C)CNc2ncc([N+](=O)[O-])cn2)CC1	ZINC000273587494	408257046	/nfs/dbraw/zinc/25/70/46/408257046.db2.gz	GTGAEZVOYRTFHY-LBPRGKRZSA-N	1	1	308.386	1.070	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1CCN(C(C)=O)C1	ZINC000156522995	408261753	/nfs/dbraw/zinc/26/17/53/408261753.db2.gz	CXHYPRISOWDQAD-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
CC[NH+](CC)[C@H]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C1	ZINC000269481616	408323211	/nfs/dbraw/zinc/32/32/11/408323211.db2.gz	KITZUAOVXDLMHN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000269387387	408292056	/nfs/dbraw/zinc/29/20/56/408292056.db2.gz	LCXLXWTZXXACFI-JTQLQIEISA-N	1	1	307.354	1.362	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000269387387	408292063	/nfs/dbraw/zinc/29/20/63/408292063.db2.gz	LCXLXWTZXXACFI-JTQLQIEISA-N	1	1	307.354	1.362	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000269387387	408292068	/nfs/dbraw/zinc/29/20/68/408292068.db2.gz	LCXLXWTZXXACFI-JTQLQIEISA-N	1	1	307.354	1.362	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000246940322	408372182	/nfs/dbraw/zinc/37/21/82/408372182.db2.gz	ZZXFMGHAUDDOJS-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000246940322	408372187	/nfs/dbraw/zinc/37/21/87/408372187.db2.gz	ZZXFMGHAUDDOJS-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNCC[N@@H+](CC)CCO	ZINC000274433115	408403938	/nfs/dbraw/zinc/40/39/38/408403938.db2.gz	SLHGXBLVLCWONR-UHFFFAOYSA-N	1	1	311.382	1.397	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCN(CC)CCO	ZINC000274433115	408403943	/nfs/dbraw/zinc/40/39/43/408403943.db2.gz	SLHGXBLVLCWONR-UHFFFAOYSA-N	1	1	311.382	1.397	20	5		DDBDMO
CN(C)c1cccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)c1	ZINC000159810932	408436274	/nfs/dbraw/zinc/43/62/74/408436274.db2.gz	OGJUSUNSWRYYIU-UHFFFAOYSA-N	1	1	303.366	1.989	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)n1	ZINC000191772709	408489439	/nfs/dbraw/zinc/48/94/39/408489439.db2.gz	CYNJYGWUYIRUAQ-LLVKDONJSA-N	1	1	309.370	1.273	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177131105	408529197	/nfs/dbraw/zinc/52/91/97/408529197.db2.gz	IPPDAVNWHXXDAH-WCQYABFASA-N	1	1	303.362	1.879	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1O	ZINC000275543103	408595655	/nfs/dbraw/zinc/59/56/55/408595655.db2.gz	ZFKCGJCLFBREOE-IUODEOHRSA-N	1	1	324.377	1.427	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000192795124	408648725	/nfs/dbraw/zinc/64/87/25/408648725.db2.gz	OHIPZHYPJABUSW-VXGBXAGGSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000249256514	408706591	/nfs/dbraw/zinc/70/65/91/408706591.db2.gz	HKTYHIWUIFHJQR-XHDPSFHLSA-N	1	1	318.377	1.733	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)Cc2ccccc2)n1	ZINC000270904578	408733984	/nfs/dbraw/zinc/73/39/84/408733984.db2.gz	AINBKNYBBKXQNN-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@H]1CO	ZINC000249515285	408734799	/nfs/dbraw/zinc/73/47/99/408734799.db2.gz	BZMPORYJMHIJSV-QWHCGFSZSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000249078344	408685545	/nfs/dbraw/zinc/68/55/45/408685545.db2.gz	SEQAWAMGMUYOIR-AYRXBEOTSA-N	1	1	324.377	1.568	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000270827426	408696805	/nfs/dbraw/zinc/69/68/05/408696805.db2.gz	CDHJAPFWEPRQCH-AWEZNQCLSA-N	1	1	319.361	1.670	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000251903107	408789047	/nfs/dbraw/zinc/78/90/47/408789047.db2.gz	SOJYVZOMZFLQHB-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000251903107	408789050	/nfs/dbraw/zinc/78/90/50/408789050.db2.gz	SOJYVZOMZFLQHB-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)[C@@H](C)C1	ZINC000185309836	408794712	/nfs/dbraw/zinc/79/47/12/408794712.db2.gz	MXOZXUWPJWJYAP-CABZTGNLSA-N	1	1	307.354	1.031	20	5		DDBDMO
COCCOCCOCC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000276263454	408828072	/nfs/dbraw/zinc/82/80/72/408828072.db2.gz	PDYPMVSDJAPEDV-UHFFFAOYSA-N	1	1	312.366	1.706	20	5		DDBDMO
COCCOCCOCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000276263454	408828073	/nfs/dbraw/zinc/82/80/73/408828073.db2.gz	PDYPMVSDJAPEDV-UHFFFAOYSA-N	1	1	312.366	1.706	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H](C)OC	ZINC000285682111	408841641	/nfs/dbraw/zinc/84/16/41/408841641.db2.gz	NFNVEUSRUTZVOK-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H](C)OC	ZINC000285682111	408841643	/nfs/dbraw/zinc/84/16/43/408841643.db2.gz	NFNVEUSRUTZVOK-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000286071923	408918562	/nfs/dbraw/zinc/91/85/62/408918562.db2.gz	RWIARSIEYIOKTP-ZFWWWQNUSA-N	1	1	305.378	1.890	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@H]1CCC[N@H+]1CCOC	ZINC000192561864	163226935	/nfs/dbraw/zinc/22/69/35/163226935.db2.gz	QJLYZYOFXGIEJS-GFCCVEGCSA-N	1	1	311.386	1.642	20	5		DDBDMO
COC(=O)c1cc(C(=O)NC[C@H]2CCC[N@H+]2C)cc([N+](=O)[O-])c1	ZINC000194733988	163296076	/nfs/dbraw/zinc/29/60/76/163296076.db2.gz	BWJAWHJZWVXONC-GFCCVEGCSA-N	1	1	321.333	1.205	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1C	ZINC000277482193	408948106	/nfs/dbraw/zinc/94/81/06/408948106.db2.gz	CPGBAXREHGDQDY-QWRGUYRKSA-N	1	1	319.365	1.362	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000286223737	408945111	/nfs/dbraw/zinc/94/51/11/408945111.db2.gz	YVIGNNKPZVQCDH-CJNGLKHVSA-N	1	1	305.378	1.890	20	5		DDBDMO
CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](C)CO	ZINC000292038493	408967880	/nfs/dbraw/zinc/96/78/80/408967880.db2.gz	AFYSJANYDQVGNK-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](C)CO	ZINC000292038493	408967883	/nfs/dbraw/zinc/96/78/83/408967883.db2.gz	AFYSJANYDQVGNK-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)C1	ZINC000292073889	408974556	/nfs/dbraw/zinc/97/45/56/408974556.db2.gz	DVEUVNAISZXJPD-MRXNPFEDSA-N	1	1	318.377	1.221	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+]1C1CC1	ZINC000279231742	409175120	/nfs/dbraw/zinc/17/51/20/409175120.db2.gz	RLXPGRAMGNLHQB-HNNXBMFYSA-N	1	1	303.362	1.880	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283597797	409183608	/nfs/dbraw/zinc/18/36/08/409183608.db2.gz	XZXHYEKADYDQED-SNVBAGLBSA-N	1	1	324.356	1.920	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000280463452	409315897	/nfs/dbraw/zinc/31/58/97/409315897.db2.gz	FUVYPUHMVFLARJ-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
C[C@H]1[C@H](O)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106474	409324174	/nfs/dbraw/zinc/32/41/74/409324174.db2.gz	VODZDWMWYRMMNU-IINYFYTJSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@H]1[C@H](O)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000295106474	409324176	/nfs/dbraw/zinc/32/41/76/409324176.db2.gz	VODZDWMWYRMMNU-IINYFYTJSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000296095418	409429373	/nfs/dbraw/zinc/42/93/73/409429373.db2.gz	HPYZSVHGXGFRKE-MBNYWOFBSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H](C)O	ZINC000303989108	409561007	/nfs/dbraw/zinc/56/10/07/409561007.db2.gz	KJPVPQOYTVXXDL-GFCCVEGCSA-N	1	1	309.366	1.649	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000356835189	409647358	/nfs/dbraw/zinc/64/73/58/409647358.db2.gz	CILRDVXOIWPNKM-WDEREUQCSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000356835189	409647363	/nfs/dbraw/zinc/64/73/63/409647363.db2.gz	CILRDVXOIWPNKM-WDEREUQCSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@@H+]1C	ZINC000356867442	409676983	/nfs/dbraw/zinc/67/69/83/409676983.db2.gz	YRBZYJRZROCSEU-MNOVXSKESA-N	1	1	309.341	1.827	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)C[C@H]1C	ZINC000354439075	409855155	/nfs/dbraw/zinc/85/51/55/409855155.db2.gz	UXKSYRABUQQWQD-VXGBXAGGSA-N	1	1	308.382	1.878	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNc2ccncc2[N+](=O)[O-])C[C@H](C)O1	ZINC000357035897	409807889	/nfs/dbraw/zinc/80/78/89/409807889.db2.gz	JHWWBMXGEAYWCK-RYUDHWBXSA-N	1	1	308.382	1.711	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000317099092	409861673	/nfs/dbraw/zinc/86/16/73/409861673.db2.gz	BIAQNKFBILJHQE-CMPLNLGQSA-N	1	1	306.366	1.849	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1	ZINC000332116292	409902096	/nfs/dbraw/zinc/90/20/96/409902096.db2.gz	VFXLOCWTWBIVLK-UHFFFAOYSA-N	1	1	318.337	1.146	20	5		DDBDMO
Cc1nocc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000351639858	410129942	/nfs/dbraw/zinc/12/99/42/410129942.db2.gz	FXAFKCMVSBTOLD-LBPRGKRZSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1nocc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000351639858	410129948	/nfs/dbraw/zinc/12/99/48/410129948.db2.gz	FXAFKCMVSBTOLD-LBPRGKRZSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H]1CCC[N@@H+]1C	ZINC000357663688	410171982	/nfs/dbraw/zinc/17/19/82/410171982.db2.gz	LZSLZOLLHHSKLM-GFCCVEGCSA-N	1	1	313.379	1.276	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000351923238	410340165	/nfs/dbraw/zinc/34/01/65/410340165.db2.gz	RQVACFLJPPAQGE-CYBMUJFWSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000351923238	410340172	/nfs/dbraw/zinc/34/01/72/410340172.db2.gz	RQVACFLJPPAQGE-CYBMUJFWSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@H]1[C@H](N2CCOCC2)CC[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000351997800	410401862	/nfs/dbraw/zinc/40/18/62/410401862.db2.gz	SNYMPGWFJWOWKC-WCQYABFASA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H]1[C@H](N2CCOCC2)CC[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000351997800	410401864	/nfs/dbraw/zinc/40/18/64/410401864.db2.gz	SNYMPGWFJWOWKC-WCQYABFASA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H]1[C@H]([NH+]2CCOCC2)CCN1Cc1csc([N+](=O)[O-])c1	ZINC000351997800	410401872	/nfs/dbraw/zinc/40/18/72/410401872.db2.gz	SNYMPGWFJWOWKC-WCQYABFASA-N	1	1	311.407	1.951	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC[C@H](O)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000339782699	410459437	/nfs/dbraw/zinc/45/94/37/410459437.db2.gz	HESNXNCXLGUGCK-GJZGRUSLSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343472007	410477885	/nfs/dbraw/zinc/47/78/85/410477885.db2.gz	ZGDWPQBAXGHDIO-OLZOCXBDSA-N	1	1	320.393	1.630	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H]1C	ZINC000347534900	410601550	/nfs/dbraw/zinc/60/15/50/410601550.db2.gz	ZSUSDZOMYRKDBF-QWRGUYRKSA-N	1	1	309.370	1.273	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNc1cc[nH+]c(N(C)C)n1	ZINC000343569819	410540047	/nfs/dbraw/zinc/54/00/47/410540047.db2.gz	YPJHJAYFDLWAHT-UHFFFAOYSA-N	1	1	303.322	2.072	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000330464733	410711752	/nfs/dbraw/zinc/71/17/52/410711752.db2.gz	FGJVMEXIJZIKML-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000330464733	410711758	/nfs/dbraw/zinc/71/17/58/410711758.db2.gz	FGJVMEXIJZIKML-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1(CO)CC1	ZINC000353017500	410736942	/nfs/dbraw/zinc/73/69/42/410736942.db2.gz	CQEKYTIYRXKEOH-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](C[C@@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000337375110	410745412	/nfs/dbraw/zinc/74/54/12/410745412.db2.gz	ZVPPBUKJRAWFPF-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H]2c2ccccc2)c1	ZINC000353046449	410755406	/nfs/dbraw/zinc/75/54/06/410755406.db2.gz	AROHVGADWQJTLB-GJZGRUSLSA-N	1	1	302.334	1.599	20	5		DDBDMO
Cc1sc(S(=O)(=O)NC[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000353055537	410759933	/nfs/dbraw/zinc/75/99/33/410759933.db2.gz	FLDIMNSKWBWSLM-SECBINFHSA-N	1	1	319.408	1.337	20	5		DDBDMO
Cc1sc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000353055537	410759936	/nfs/dbraw/zinc/75/99/36/410759936.db2.gz	FLDIMNSKWBWSLM-SECBINFHSA-N	1	1	319.408	1.337	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000330569430	410784124	/nfs/dbraw/zinc/78/41/24/410784124.db2.gz	MCUIDYLCPHOQLE-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000330572849	410787403	/nfs/dbraw/zinc/78/74/03/410787403.db2.gz	DTAOXANNMQNKOY-QWHCGFSZSA-N	1	1	320.393	1.866	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330628563	410837398	/nfs/dbraw/zinc/83/73/98/410837398.db2.gz	LSAIBLVRRMKWLC-QWHCGFSZSA-N	1	1	305.378	1.997	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344045601	410918277	/nfs/dbraw/zinc/91/82/77/410918277.db2.gz	JYIHZNKDDBGRSQ-NJZAAPMLSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344045601	410918282	/nfs/dbraw/zinc/91/82/82/410918282.db2.gz	JYIHZNKDDBGRSQ-NJZAAPMLSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](C)[C@@H](CN)C2CC2)cccc1[N+](=O)[O-]	ZINC000359884508	410934509	/nfs/dbraw/zinc/93/45/09/410934509.db2.gz	WNXJSVILLBKUPY-HNNXBMFYSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@@H](CN)C2CC2)cccc1[N+](=O)[O-]	ZINC000359884508	410934518	/nfs/dbraw/zinc/93/45/18/410934518.db2.gz	WNXJSVILLBKUPY-HNNXBMFYSA-N	1	1	320.393	1.901	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000344085597	410946557	/nfs/dbraw/zinc/94/65/57/410946557.db2.gz	SLPDWASCHPXQQN-TUKIKUTGSA-N	1	1	319.361	1.260	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])[C@H](C)C1	ZINC000341837821	411070143	/nfs/dbraw/zinc/07/01/43/411070143.db2.gz	GIUFMCKFBRFDNL-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])[C@H](C)C1	ZINC000341837821	411070146	/nfs/dbraw/zinc/07/01/46/411070146.db2.gz	GIUFMCKFBRFDNL-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000356606234	411103821	/nfs/dbraw/zinc/10/38/21/411103821.db2.gz	VSGVTOIFSSXCHE-LLVKDONJSA-N	1	1	311.386	1.661	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOC3CCC3)CC2)cn1	ZINC000580815652	422955004	/nfs/dbraw/zinc/95/50/04/422955004.db2.gz	FGVARGMXXQMYFJ-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000132503784	196260312	/nfs/dbraw/zinc/26/03/12/196260312.db2.gz	BHGAEKZUNHXSMU-JTQLQIEISA-N	1	1	307.325	1.948	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000296776092	226220490	/nfs/dbraw/zinc/22/04/90/226220490.db2.gz	PYVCSRWNPPBLFU-CQSZACIVSA-N	1	1	323.349	1.746	20	5		DDBDMO
Cc1[nH+]ccn1-c1cccc(NCCn2cc([N+](=O)[O-])cn2)n1	ZINC000366507204	418482796	/nfs/dbraw/zinc/48/27/96/418482796.db2.gz	LTFTXDUBUXGSCQ-UHFFFAOYSA-N	1	1	313.321	1.793	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCOC2)O1	ZINC000366597764	418494251	/nfs/dbraw/zinc/49/42/51/418494251.db2.gz	VDYMIOUNMVACLX-CQSZACIVSA-N	1	1	310.354	1.061	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@H](c3[nH+]ccn3C)C2)c1[N+](=O)[O-]	ZINC000360808680	418523015	/nfs/dbraw/zinc/52/30/15/418523015.db2.gz	AZAQPKCYALBNGW-JTQLQIEISA-N	1	1	304.354	1.618	20	5		DDBDMO
COCCOC[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000295421461	418586137	/nfs/dbraw/zinc/58/61/37/418586137.db2.gz	YFHSXLARNGBGMO-CQSZACIVSA-N	1	1	312.366	1.093	20	5		DDBDMO
Nc1ccc(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834581	418642957	/nfs/dbraw/zinc/64/29/57/418642957.db2.gz	GKDITEHNWZUOBW-CHWSQXEVSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834581	418642961	/nfs/dbraw/zinc/64/29/61/418642961.db2.gz	GKDITEHNWZUOBW-CHWSQXEVSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834583	418643036	/nfs/dbraw/zinc/64/30/36/418643036.db2.gz	GKDITEHNWZUOBW-QWHCGFSZSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)c([N+](=O)[O-])c1	ZINC000367834583	418643039	/nfs/dbraw/zinc/64/30/39/418643039.db2.gz	GKDITEHNWZUOBW-QWHCGFSZSA-N	1	1	306.366	1.842	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904685	418738437	/nfs/dbraw/zinc/73/84/37/418738437.db2.gz	PRYPEQPVFFEBJJ-YPMHNXCESA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904685	418738439	/nfs/dbraw/zinc/73/84/39/418738439.db2.gz	PRYPEQPVFFEBJJ-YPMHNXCESA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000364985495	418829250	/nfs/dbraw/zinc/82/92/50/418829250.db2.gz	QYMHSAMEYILDQI-JTQLQIEISA-N	1	1	315.320	1.766	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@](O)(C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000365106187	418838275	/nfs/dbraw/zinc/83/82/75/418838275.db2.gz	CKTBLABIQDJKRP-INIZCTEOSA-N	1	1	319.361	1.770	20	5		DDBDMO
CN(CC1CCN(c2cc[nH+]cc2)CC1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000372839446	418907962	/nfs/dbraw/zinc/90/79/62/418907962.db2.gz	OOYWVLVNBPGOQL-GJZGRUSLSA-N	1	1	318.377	1.422	20	5		DDBDMO
[NH3+][C@@H]1CCCC[C@H]1NCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000424339867	228259180	/nfs/dbraw/zinc/25/91/80/228259180.db2.gz	XACVPQWXWJQSTO-VXGBXAGGSA-N	1	1	306.366	1.783	20	5		DDBDMO
N[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000424339867	228259183	/nfs/dbraw/zinc/25/91/83/228259183.db2.gz	XACVPQWXWJQSTO-VXGBXAGGSA-N	1	1	306.366	1.783	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C[C@H](CC)O1	ZINC000420960103	419384785	/nfs/dbraw/zinc/38/47/85/419384785.db2.gz	RCCAWLUXPIEGAV-MELADBBJSA-N	1	1	312.370	1.042	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421002935	419438012	/nfs/dbraw/zinc/43/80/12/419438012.db2.gz	BYHULHAPJANSOQ-KWCYVHTRSA-N	1	1	310.350	1.180	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000411949197	419517801	/nfs/dbraw/zinc/51/78/01/419517801.db2.gz	NDLJHUYDURLZCJ-VIFPVBQESA-N	1	1	313.304	1.783	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000411949197	419517807	/nfs/dbraw/zinc/51/78/07/419517807.db2.gz	NDLJHUYDURLZCJ-VIFPVBQESA-N	1	1	313.304	1.783	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1ccc([N+](=O)[O-])cc1F	ZINC000418118631	419546834	/nfs/dbraw/zinc/54/68/34/419546834.db2.gz	TVCCGWBNOQIJHB-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000421707062	419694881	/nfs/dbraw/zinc/69/48/81/419694881.db2.gz	WQFZKSXIJQPYKR-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412087445	419642083	/nfs/dbraw/zinc/64/20/83/419642083.db2.gz	GUPYBPWTGXVLJB-BYCMXARLSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000412087445	419642094	/nfs/dbraw/zinc/64/20/94/419642094.db2.gz	GUPYBPWTGXVLJB-BYCMXARLSA-N	1	1	303.362	1.861	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ncn1	ZINC000428378655	419857308	/nfs/dbraw/zinc/85/73/08/419857308.db2.gz	IKQWHBPXNJQORD-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ncn1	ZINC000428378655	419857315	/nfs/dbraw/zinc/85/73/15/419857315.db2.gz	IKQWHBPXNJQORD-LBPRGKRZSA-N	1	1	314.349	1.775	20	5		DDBDMO
CSC[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000429295841	419998679	/nfs/dbraw/zinc/99/86/79/419998679.db2.gz	BGXDXQPPLUGMSP-DGCLKSJQSA-N	1	1	314.411	1.227	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000430787132	420190537	/nfs/dbraw/zinc/19/05/37/420190537.db2.gz	FFLGINURLBHFHV-TZMCWYRMSA-N	1	1	321.377	1.881	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[C@@H]([NH3+])[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000430955628	420221937	/nfs/dbraw/zinc/22/19/37/420221937.db2.gz	MCHQAZPYKWFYPB-WCQYABFASA-N	1	1	320.393	1.901	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CSC[NH2+]1	ZINC000423854799	420228694	/nfs/dbraw/zinc/22/86/94/420228694.db2.gz	VZHSLNOCVHATPY-JTQLQIEISA-N	1	1	301.755	1.527	20	5		DDBDMO
C[C@H]([NH3+])C1CCN([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000430947496	420218829	/nfs/dbraw/zinc/21/88/29/420218829.db2.gz	BHDWQTNXGYSWRK-RYUDHWBXSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@H]1C[NH3+]	ZINC000424014710	420306381	/nfs/dbraw/zinc/30/63/81/420306381.db2.gz	LUQRKTKIYNTXLS-VHSXEESVSA-N	1	1	317.349	1.528	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000420813314	420401679	/nfs/dbraw/zinc/40/16/79/420401679.db2.gz	YGYMQIKJBWLYOC-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](c2nnc[nH]2)C1	ZINC000425553394	420417138	/nfs/dbraw/zinc/41/71/38/420417138.db2.gz	UHMAPFGZPKPUJG-LLVKDONJSA-N	1	1	303.322	1.581	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@H](CC[NH3+])C1	ZINC000443058083	420740840	/nfs/dbraw/zinc/74/08/40/420740840.db2.gz	JBRPLIPMNVTHFZ-CYBMUJFWSA-N	1	1	320.393	1.903	20	5		DDBDMO
Cc1nc(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000447604758	420785072	/nfs/dbraw/zinc/78/50/72/420785072.db2.gz	CTRCRBOHDFFANU-VXGBXAGGSA-N	1	1	319.369	1.534	20	5		DDBDMO
Cc1nnc(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)[nH]1	ZINC000447604758	420785075	/nfs/dbraw/zinc/78/50/75/420785075.db2.gz	CTRCRBOHDFFANU-VXGBXAGGSA-N	1	1	319.369	1.534	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@H](CO)[C@H](O)C3)o2)c1	ZINC000459694207	420849288	/nfs/dbraw/zinc/84/92/88/420849288.db2.gz	GDAOKEYKYPTNSD-IUODEOHRSA-N	1	1	318.329	1.640	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000449696754	421061031	/nfs/dbraw/zinc/06/10/31/421061031.db2.gz	LDYWPVXYQBURSA-DQOPKJQZSA-N	1	1	306.362	1.939	20	5		DDBDMO
CNc1nc(C(=O)NC[C@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000455381106	421004750	/nfs/dbraw/zinc/00/47/50/421004750.db2.gz	JFAOOBPNISPBEF-VIFPVBQESA-N	1	1	307.354	1.244	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@H]2CCn3cc[nH+]c3C2)nc2sccn21	ZINC000489875586	421178001	/nfs/dbraw/zinc/17/80/01/421178001.db2.gz	OMXHENAGDCYHPV-QMMMGPOBSA-N	1	1	304.335	1.927	20	5		DDBDMO
COc1cc(NC[C@@H]2CCC[N@H+]2CCCO)ccc1[N+](=O)[O-]	ZINC000450602008	421216369	/nfs/dbraw/zinc/21/63/69/421216369.db2.gz	ZJGHGKZBZXLEQO-ZDUSSCGKSA-N	1	1	309.366	1.862	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ccncc1[N+](=O)[O-])C(C)C	ZINC000450604473	421216510	/nfs/dbraw/zinc/21/65/10/421216510.db2.gz	WSEXBOWREVGUNL-ZDUSSCGKSA-N	1	1	310.354	1.001	20	5		DDBDMO
Cc1nc(NC2CCN(c3[nH+]ccn3C)CC2)ncc1[N+](=O)[O-]	ZINC000450471517	421201601	/nfs/dbraw/zinc/20/16/01/421201601.db2.gz	CRKXSOITTWVQQS-UHFFFAOYSA-N	1	1	317.353	1.508	20	5		DDBDMO
Cc1nc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450539286	421207638	/nfs/dbraw/zinc/20/76/38/421207638.db2.gz	JMAMGXCROZNZDX-GMXVVIOVSA-N	1	1	305.382	1.860	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000548391238	421432879	/nfs/dbraw/zinc/43/28/79/421432879.db2.gz	NPDCPTKTPVZDLS-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](CCO)[C@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641935	421442061	/nfs/dbraw/zinc/44/20/61/421442061.db2.gz	RHHHKVXYMYQRGN-CHWSQXEVSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](CCO)[C@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641935	421442064	/nfs/dbraw/zinc/44/20/64/421442064.db2.gz	RHHHKVXYMYQRGN-CHWSQXEVSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000577294231	422384574	/nfs/dbraw/zinc/38/45/74/422384574.db2.gz	MGMOGRLPXSVXFO-GHMZBOCLSA-N	1	1	321.381	1.565	20	5		DDBDMO
CNC(=O)CCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000578374865	422559093	/nfs/dbraw/zinc/55/90/93/422559093.db2.gz	TWXMPSKXVFDHAW-LLVKDONJSA-N	1	1	307.354	1.002	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1	ZINC000341682533	271167946	/nfs/dbraw/zinc/16/79/46/271167946.db2.gz	CRDNIDLTWVSBOY-UONOGXRCSA-N	1	1	321.377	1.505	20	5		DDBDMO
CC[N@@H+](CCNc1nc(C(=O)OC)ccc1[N+](=O)[O-])C(C)C	ZINC000342096774	271297126	/nfs/dbraw/zinc/29/71/26/271297126.db2.gz	PDARITOHCSSQLH-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
NC1(C[NH2+]CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CCC1	ZINC000342116767	271302620	/nfs/dbraw/zinc/30/26/20/271302620.db2.gz	YQYJXSLYFXPHQO-UHFFFAOYSA-N	1	1	320.349	1.364	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000345764801	272329382	/nfs/dbraw/zinc/32/93/82/272329382.db2.gz	DVYAOAGINRHOQW-LBPRGKRZSA-N	1	1	322.365	1.745	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964277	272376884	/nfs/dbraw/zinc/37/68/84/272376884.db2.gz	QGPUQGUHNXXJDB-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964277	272376886	/nfs/dbraw/zinc/37/68/86/272376886.db2.gz	QGPUQGUHNXXJDB-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964277	272376890	/nfs/dbraw/zinc/37/68/90/272376890.db2.gz	QGPUQGUHNXXJDB-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964277	272376892	/nfs/dbraw/zinc/37/68/92/272376892.db2.gz	QGPUQGUHNXXJDB-GHMZBOCLSA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])c2cnccc21	ZINC000450955071	274348762	/nfs/dbraw/zinc/34/87/62/274348762.db2.gz	PEQFRNKCTYIOQY-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=C1CCCN1CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000071941666	275016950	/nfs/dbraw/zinc/01/69/50/275016950.db2.gz	HUNLFOJDGPPBAZ-UHFFFAOYSA-N	1	1	318.377	1.339	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222801	276040731	/nfs/dbraw/zinc/04/07/31/276040731.db2.gz	VWDGZNAVKVWCDF-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222801	276040732	/nfs/dbraw/zinc/04/07/32/276040732.db2.gz	VWDGZNAVKVWCDF-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222801	276040733	/nfs/dbraw/zinc/04/07/33/276040733.db2.gz	VWDGZNAVKVWCDF-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222801	276040734	/nfs/dbraw/zinc/04/07/34/276040734.db2.gz	VWDGZNAVKVWCDF-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000273152702	276381264	/nfs/dbraw/zinc/38/12/64/276381264.db2.gz	IGQHTGFELDVGAI-OLZOCXBDSA-N	1	1	323.393	1.885	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)C1	ZINC000493715815	278125726	/nfs/dbraw/zinc/12/57/26/278125726.db2.gz	BLJBJPPVTQTAMZ-IJVDHGTGSA-N	1	1	307.325	1.768	20	5		DDBDMO
C[C@@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+](C2CC2)C1	ZINC000450547692	288264237	/nfs/dbraw/zinc/26/42/37/288264237.db2.gz	OPGRZYWRURVHQF-NSHDSACASA-N	1	1	318.377	1.614	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000353994488	298333859	/nfs/dbraw/zinc/33/38/59/298333859.db2.gz	FTWRESXHQLUGSQ-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000354201871	298360959	/nfs/dbraw/zinc/36/09/59/298360959.db2.gz	YTBFUOYMUASTKP-LLVKDONJSA-N	1	1	309.370	1.558	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1csc([N+](=O)[O-])c1	ZINC000363143935	300218995	/nfs/dbraw/zinc/21/89/95/300218995.db2.gz	OBEHSWREMNLQJW-WDEREUQCSA-N	1	1	311.363	1.249	20	5		DDBDMO
Cn1cc(C[C@@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cn1	ZINC000368405798	301020755	/nfs/dbraw/zinc/02/07/55/301020755.db2.gz	VVLRTGSQJOVRCB-LBPRGKRZSA-N	1	1	304.354	1.089	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000368952733	301109583	/nfs/dbraw/zinc/10/95/83/301109583.db2.gz	XEMHFXPZGJHAJE-GLQYFDAESA-N	1	1	319.361	1.559	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1F	ZINC000377510190	302187904	/nfs/dbraw/zinc/18/79/04/302187904.db2.gz	FKHBQBSVJBESCW-NWDGAFQWSA-N	1	1	323.324	1.327	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CC[C@H]12	ZINC000377717981	302218630	/nfs/dbraw/zinc/21/86/30/302218630.db2.gz	CWZIFSXAVOLACA-DOMZBBRYSA-N	1	1	319.361	1.432	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc2c(c1)OCCO2	ZINC000531143569	303232816	/nfs/dbraw/zinc/23/28/16/303232816.db2.gz	PSMWLHGWWSVMIY-UHFFFAOYSA-N	1	1	318.333	1.695	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000535330000	303346551	/nfs/dbraw/zinc/34/65/51/303346551.db2.gz	NXSFVVGNTOSKBY-UHFFFAOYSA-N	1	1	307.306	1.101	20	5		DDBDMO
C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000364755327	307050388	/nfs/dbraw/zinc/05/03/88/307050388.db2.gz	PSKYWIGMEZPYDL-DAXOMENPSA-N	1	1	317.389	1.993	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](CCOCC(F)F)C2)c1	ZINC000365295491	307064045	/nfs/dbraw/zinc/06/40/45/307064045.db2.gz	XSYRZXASBSABMF-SNVBAGLBSA-N	1	1	304.297	1.710	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CC[N@H+](C)[C@H]2C1	ZINC000376643032	307251101	/nfs/dbraw/zinc/25/11/01/307251101.db2.gz	MSTRXQXZQSUFFX-FZMZJTMJSA-N	1	1	304.350	1.464	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2NC)C1	ZINC000566564116	308057227	/nfs/dbraw/zinc/05/72/27/308057227.db2.gz	RJFBKBMSKNZGBF-CYBMUJFWSA-N	1	1	308.338	1.296	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2NC)C1	ZINC000566564116	308057228	/nfs/dbraw/zinc/05/72/28/308057228.db2.gz	RJFBKBMSKNZGBF-CYBMUJFWSA-N	1	1	308.338	1.296	20	5		DDBDMO
CN(C)C(=O)C(C)(C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000570633712	308174136	/nfs/dbraw/zinc/17/41/36/308174136.db2.gz	AGRZUOUKIFRAEC-UHFFFAOYSA-N	1	1	305.338	1.428	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CN[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168848	308264207	/nfs/dbraw/zinc/26/42/07/308264207.db2.gz	KUTFCXRCVTYYPU-IUODEOHRSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@H](O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168848	308264209	/nfs/dbraw/zinc/26/42/09/308264209.db2.gz	KUTFCXRCVTYYPU-IUODEOHRSA-N	1	1	311.382	1.185	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488732579	484215869	/nfs/dbraw/zinc/21/58/69/484215869.db2.gz	KHRLFTZTGGDMPB-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488732579	484215873	/nfs/dbraw/zinc/21/58/73/484215873.db2.gz	KHRLFTZTGGDMPB-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])c3cccnc32)CC[N@H+]1CCO	ZINC000302378944	533977194	/nfs/dbraw/zinc/97/71/94/533977194.db2.gz	GFOQDYAOEUPNJG-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330915847	534103890	/nfs/dbraw/zinc/10/38/90/534103890.db2.gz	URUDUWLRVLFSNW-RYUDHWBXSA-N	1	1	306.366	1.606	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000330787787	534302732	/nfs/dbraw/zinc/30/27/32/534302732.db2.gz	PTAVYQPDUYVVBD-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
NC(=O)NC(=O)OCCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000494382935	534388368	/nfs/dbraw/zinc/38/83/68/534388368.db2.gz	ULUDUZYMZDFSIN-UHFFFAOYSA-N	1	1	322.321	1.148	20	5		DDBDMO
NC(=O)NC(=O)OCCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000494382935	534388375	/nfs/dbraw/zinc/38/83/75/534388375.db2.gz	ULUDUZYMZDFSIN-UHFFFAOYSA-N	1	1	322.321	1.148	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2csc([N+](=O)[O-])c2)CC1	ZINC000331872647	534793439	/nfs/dbraw/zinc/79/34/39/534793439.db2.gz	FCRQEUCHMIVEKX-UHFFFAOYSA-N	1	1	307.379	1.712	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000735857287	598298188	/nfs/dbraw/zinc/29/81/88/598298188.db2.gz	SBTRCKFJCOQLKE-UHFFFAOYSA-N	1	1	305.342	1.527	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000820668796	599590490	/nfs/dbraw/zinc/59/04/90/599590490.db2.gz	WOKYVNOMPPLBJS-KOLCDFICSA-N	1	1	317.353	1.670	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cn1nccc1[N+](=O)[O-]	ZINC000111171980	696642262	/nfs/dbraw/zinc/64/22/62/696642262.db2.gz	SVZCMNGIWHFQTJ-CQSZACIVSA-N	1	1	315.377	1.955	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000776593581	698124188	/nfs/dbraw/zinc/12/41/88/698124188.db2.gz	YDZBOTWCCZXDSQ-NEPJUHHUSA-N	1	1	320.267	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@](O)(C(F)(F)F)C2)cc1	ZINC000776593581	698124189	/nfs/dbraw/zinc/12/41/89/698124189.db2.gz	YDZBOTWCCZXDSQ-NEPJUHHUSA-N	1	1	320.267	1.627	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)OCCC[NH+]2CCOCC2)c1	ZINC000750885064	700254296	/nfs/dbraw/zinc/25/42/96/700254296.db2.gz	YDNPSNSJWFCIPA-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000732050503	699544901	/nfs/dbraw/zinc/54/49/01/699544901.db2.gz	WAIQASOERYOESS-LLVKDONJSA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000732050503	699544902	/nfs/dbraw/zinc/54/49/02/699544902.db2.gz	WAIQASOERYOESS-LLVKDONJSA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000732050503	699544905	/nfs/dbraw/zinc/54/49/05/699544905.db2.gz	WAIQASOERYOESS-LLVKDONJSA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000732050503	699544906	/nfs/dbraw/zinc/54/49/06/699544906.db2.gz	WAIQASOERYOESS-LLVKDONJSA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000732050506	699544968	/nfs/dbraw/zinc/54/49/68/699544968.db2.gz	WAIQASOERYOESS-NSHDSACASA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000732050506	699544969	/nfs/dbraw/zinc/54/49/69/699544969.db2.gz	WAIQASOERYOESS-NSHDSACASA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000732050506	699544970	/nfs/dbraw/zinc/54/49/70/699544970.db2.gz	WAIQASOERYOESS-NSHDSACASA-N	1	1	321.406	1.862	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000732050506	699544971	/nfs/dbraw/zinc/54/49/71/699544971.db2.gz	WAIQASOERYOESS-NSHDSACASA-N	1	1	321.406	1.862	20	5		DDBDMO
C[C@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000742197774	699866339	/nfs/dbraw/zinc/86/63/39/699866339.db2.gz	ZWKCYUDSZIYRGO-VIFPVBQESA-N	1	1	303.322	1.247	20	5		DDBDMO
C[C@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000742197774	699866342	/nfs/dbraw/zinc/86/63/42/699866342.db2.gz	ZWKCYUDSZIYRGO-VIFPVBQESA-N	1	1	303.322	1.247	20	5		DDBDMO
CCc1[nH]nc(C(=O)OCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000795611115	699878510	/nfs/dbraw/zinc/87/85/10/699878510.db2.gz	DVOUZOQUXZBRAP-UHFFFAOYSA-N	1	1	307.310	1.632	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@@H+]3CCOC[C@H]3C2)c1	ZINC000754081564	700481367	/nfs/dbraw/zinc/48/13/67/700481367.db2.gz	LUOJQPVTSUJMIW-SNVBAGLBSA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@H+]3CCOC[C@H]3C2)c1	ZINC000754081564	700481368	/nfs/dbraw/zinc/48/13/68/700481368.db2.gz	LUOJQPVTSUJMIW-SNVBAGLBSA-N	1	1	311.313	1.263	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@@H+](C)[C@H](C)C1	ZINC000761079108	700840920	/nfs/dbraw/zinc/84/09/20/700840920.db2.gz	PSULDHKXYGXESO-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000804466146	701191965	/nfs/dbraw/zinc/19/19/65/701191965.db2.gz	NBXDRAUNUZIXCX-UHFFFAOYSA-N	1	1	302.338	1.237	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000804520573	701197500	/nfs/dbraw/zinc/19/75/00/701197500.db2.gz	GEWLUOKDGQLKFQ-NSHDSACASA-N	1	1	322.365	1.981	20	5		DDBDMO
C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839568208	701738874	/nfs/dbraw/zinc/73/88/74/701738874.db2.gz	OBYUGTCXURKAEV-FAAHXZRKSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@H](c1ccccc1)[N@@H+]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568208	701738879	/nfs/dbraw/zinc/73/88/79/701738879.db2.gz	OBYUGTCXURKAEV-FAAHXZRKSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568208	701738882	/nfs/dbraw/zinc/73/88/82/701738882.db2.gz	OBYUGTCXURKAEV-FAAHXZRKSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000866073871	706611170	/nfs/dbraw/zinc/61/11/70/706611170.db2.gz	UVXIRYYAJSZOAI-JQWIXIFHSA-N	1	1	309.341	1.875	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC(=O)N1	ZINC000839670016	701774512	/nfs/dbraw/zinc/77/45/12/701774512.db2.gz	REVCMAGDSHXZLG-ZFWWWQNUSA-N	1	1	321.377	1.617	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000839785164	701826181	/nfs/dbraw/zinc/82/61/81/701826181.db2.gz	BHGNFMJJSDRKBC-NUEKZKHPSA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000839785164	701826189	/nfs/dbraw/zinc/82/61/89/701826189.db2.gz	BHGNFMJJSDRKBC-NUEKZKHPSA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000839785164	701826196	/nfs/dbraw/zinc/82/61/96/701826196.db2.gz	BHGNFMJJSDRKBC-NUEKZKHPSA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@H]1CN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)[C@H]1C	ZINC000840058947	701943992	/nfs/dbraw/zinc/94/39/92/701943992.db2.gz	YINZDZRBVSSARF-RYUDHWBXSA-N	1	1	321.381	1.500	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1	ZINC000866210127	706649636	/nfs/dbraw/zinc/64/96/36/706649636.db2.gz	YFGYRTVUFHDXIL-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
CNC(=O)NC[C@@H]1CCCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000879334369	706653061	/nfs/dbraw/zinc/65/30/61/706653061.db2.gz	KBSHRCVTRABWJR-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
CNC(=O)NC[C@@H]1CCCC[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000879334369	706653065	/nfs/dbraw/zinc/65/30/65/706653065.db2.gz	KBSHRCVTRABWJR-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000842160836	702678263	/nfs/dbraw/zinc/67/82/63/702678263.db2.gz	AJMTWPHLFCHMIR-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H](CO)C[NH+]2CCCCC2)c1	ZINC000843113558	702821425	/nfs/dbraw/zinc/82/14/25/702821425.db2.gz	WZPCSHJMYZXRBC-ZBFHGGJFSA-N	1	1	323.393	1.065	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1[NH3+]	ZINC000843353689	702865002	/nfs/dbraw/zinc/86/50/02/702865002.db2.gz	MXRDREDUEFAZAB-MFKMUULPSA-N	1	1	324.356	1.732	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC000843893514	702938889	/nfs/dbraw/zinc/93/88/89/702938889.db2.gz	OGNNCZXIKKXBTD-GWCFXTLKSA-N	1	1	307.325	1.818	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000879571936	706722102	/nfs/dbraw/zinc/72/21/02/706722102.db2.gz	USADZQFHIBHPLU-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
CC1(C)C[C@@H](O)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879614941	706738666	/nfs/dbraw/zinc/73/86/66/706738666.db2.gz	CKUFJPJTQLUXPA-KGLIPLIRSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCOC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000848786281	703589051	/nfs/dbraw/zinc/58/90/51/703589051.db2.gz	KGJBHKUCDWDKDL-SNVBAGLBSA-N	1	1	308.338	1.603	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@@H+](CC(C)(C)O)C2)ccc1[N+](=O)[O-]	ZINC000869786152	703853242	/nfs/dbraw/zinc/85/32/42/703853242.db2.gz	UCRUYQQEGFDGTF-ZDUSSCGKSA-N	1	1	321.377	1.478	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2nnc(C3CC3)[nH]2)c1	ZINC000819341952	704110675	/nfs/dbraw/zinc/11/06/75/704110675.db2.gz	VBGSQTHXUGGRMG-GFCCVEGCSA-N	1	1	303.322	1.414	20	5		DDBDMO
CCC[C@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC000870911415	704165246	/nfs/dbraw/zinc/16/52/46/704165246.db2.gz	WDHOJYJLLRSPSC-GOEBONIOSA-N	1	1	321.377	1.796	20	5		DDBDMO
Cc1noc(CON=C(N)C[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000853665818	704295684	/nfs/dbraw/zinc/29/56/84/704295684.db2.gz	DHSNSWYTJZHRMI-SECBINFHSA-N	1	1	311.342	1.764	20	5		DDBDMO
Cc1noc(CON=C(N)C[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000853665818	704295686	/nfs/dbraw/zinc/29/56/86/704295686.db2.gz	DHSNSWYTJZHRMI-SECBINFHSA-N	1	1	311.342	1.764	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@@]2(C1)CCC[N@H+](C)C2	ZINC000820608430	704309733	/nfs/dbraw/zinc/30/97/33/704309733.db2.gz	IWWVOGYXLYSTMC-HNNXBMFYSA-N	1	1	321.381	1.044	20	5		DDBDMO
Nc1ncc2c(n1)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000857926360	704643659	/nfs/dbraw/zinc/64/36/59/704643659.db2.gz	UBHPETIFHJRCIU-CQSZACIVSA-N	1	1	315.333	1.059	20	5		DDBDMO
Nc1ncc2c(n1)C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000857926360	704643660	/nfs/dbraw/zinc/64/36/60/704643660.db2.gz	UBHPETIFHJRCIU-CQSZACIVSA-N	1	1	315.333	1.059	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000874823244	705182725	/nfs/dbraw/zinc/18/27/25/705182725.db2.gz	GVSKQFHBATWMDZ-KGLIPLIRSA-N	1	1	321.352	1.972	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874830375	705189108	/nfs/dbraw/zinc/18/91/08/705189108.db2.gz	RGOXYZHZWPMWFB-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000874846916	705201075	/nfs/dbraw/zinc/20/10/75/705201075.db2.gz	LNBKUOHJJLRLNO-HUUCEWRRSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825099412	705599443	/nfs/dbraw/zinc/59/94/43/705599443.db2.gz	ZCLTXVLJADWJHE-DOMZBBRYSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000825336862	705649295	/nfs/dbraw/zinc/64/92/95/705649295.db2.gz	ADUCSIAUWATCGN-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
CO[C@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC1	ZINC000876955682	705937383	/nfs/dbraw/zinc/93/73/83/705937383.db2.gz	AMSUYRLCFUEGOZ-HOCLYGCPSA-N	1	1	321.377	1.796	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000827675022	706047242	/nfs/dbraw/zinc/04/72/42/706047242.db2.gz	NHDQVPLWNOXMCS-SMDDNHRTSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000827675022	706047243	/nfs/dbraw/zinc/04/72/43/706047243.db2.gz	NHDQVPLWNOXMCS-SMDDNHRTSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCCC[C@H]2CN2CCCC2=O)c([N+](=O)[O-])n1	ZINC000878097084	706291497	/nfs/dbraw/zinc/29/14/97/706291497.db2.gz	SJMWRDIRMUTJML-ZDUSSCGKSA-N	1	1	321.381	1.305	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@H]2CN2CCCC2=O)c([N+](=O)[O-])n1	ZINC000878097084	706291499	/nfs/dbraw/zinc/29/14/99/706291499.db2.gz	SJMWRDIRMUTJML-ZDUSSCGKSA-N	1	1	321.381	1.305	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1c1nc2ccc([N+](=O)[O-])cc2s1	ZINC000829576556	706359551	/nfs/dbraw/zinc/35/95/51/706359551.db2.gz	CHOCHPCWFVQGIU-SNVBAGLBSA-N	1	1	322.390	1.707	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1nc2ccc([N+](=O)[O-])cc2s1	ZINC000829576556	706359555	/nfs/dbraw/zinc/35/95/55/706359555.db2.gz	CHOCHPCWFVQGIU-SNVBAGLBSA-N	1	1	322.390	1.707	20	5		DDBDMO
Cn1nnnc1CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000878679148	706466873	/nfs/dbraw/zinc/46/68/73/706466873.db2.gz	UJQDLLHFIRTDMZ-CYBMUJFWSA-N	1	1	316.365	1.540	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC=C[C@@H]1CO	ZINC000880489714	706992938	/nfs/dbraw/zinc/99/29/38/706992938.db2.gz	HSWPUFANEYSJAF-CYBMUJFWSA-N	1	1	305.334	1.465	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880528824	707005128	/nfs/dbraw/zinc/00/51/28/707005128.db2.gz	HBIPXIIVAMFXCW-QEJZJMRPSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880528824	707005129	/nfs/dbraw/zinc/00/51/29/707005129.db2.gz	HBIPXIIVAMFXCW-QEJZJMRPSA-N	1	1	319.361	1.229	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614365	707042131	/nfs/dbraw/zinc/04/21/31/707042131.db2.gz	UGYSKXHRVSSTSZ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614365	707042133	/nfs/dbraw/zinc/04/21/33/707042133.db2.gz	UGYSKXHRVSSTSZ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614365	707042134	/nfs/dbraw/zinc/04/21/34/707042134.db2.gz	UGYSKXHRVSSTSZ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000880614365	707042136	/nfs/dbraw/zinc/04/21/36/707042136.db2.gz	UGYSKXHRVSSTSZ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2C[C@@H]3COC[C@@H]3C2)o1	ZINC000872319207	707380526	/nfs/dbraw/zinc/38/05/26/707380526.db2.gz	AJGBCTZOMRXKMA-PHIMTYICSA-N	1	1	316.317	1.723	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCCCCCNC(=O)CC2)cc1[N+](=O)[O-]	ZINC000872667678	707548747	/nfs/dbraw/zinc/54/87/47/707548747.db2.gz	LJLFUXYTDGOLCS-UHFFFAOYSA-N	1	1	309.370	1.440	20	5		DDBDMO
Cc1nn(C[N@H+]2CCCCCCNC(=O)CC2)cc1[N+](=O)[O-]	ZINC000872667678	707548748	/nfs/dbraw/zinc/54/87/48/707548748.db2.gz	LJLFUXYTDGOLCS-UHFFFAOYSA-N	1	1	309.370	1.440	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@H]1C[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000873249859	707785047	/nfs/dbraw/zinc/78/50/47/707785047.db2.gz	MXPVUHPRQSOZTD-OSAQELSMSA-N	1	1	315.377	1.745	20	5		DDBDMO
Cc1ccc(CN[C@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1[N+](=O)[O-]	ZINC000873251849	707786024	/nfs/dbraw/zinc/78/60/24/707786024.db2.gz	LVJODEQCTFBPRN-JKSUJKDBSA-N	1	1	305.378	1.760	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@H]1C[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000873256484	707786712	/nfs/dbraw/zinc/78/67/12/707786712.db2.gz	MXPVUHPRQSOZTD-UXIGCNINSA-N	1	1	315.377	1.745	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[NH+]1CCC(O[C@H]2CCOC2)CC1	ZINC000886032724	708685409	/nfs/dbraw/zinc/68/54/09/708685409.db2.gz	MPTXKLJPGDWDMM-AWEZNQCLSA-N	1	1	307.350	1.760	20	5		DDBDMO
C[C@](O)(C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)C(F)F	ZINC000886067228	708691821	/nfs/dbraw/zinc/69/18/21/708691821.db2.gz	IPYOMZYTXVUBMZ-ZANVPECISA-N	1	1	316.308	1.492	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887922043	709163905	/nfs/dbraw/zinc/16/39/05/709163905.db2.gz	WIXYFBGKYHXDJW-BMIGLBTASA-N	1	1	307.325	1.758	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)c(N)c([N+](=O)[O-])c1	ZINC000887931690	709169056	/nfs/dbraw/zinc/16/90/56/709169056.db2.gz	DLNUSWUSAHFWTP-BZNIZROVSA-N	1	1	318.377	1.509	20	5		DDBDMO
C[N@@H+](CCO)CCNC(=O)c1cc([N+](=O)[O-])cc2ccccc21	ZINC000899740581	709184963	/nfs/dbraw/zinc/18/49/63/709184963.db2.gz	FFLCSALANHGZJD-UHFFFAOYSA-N	1	1	317.345	1.402	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC([NH+]3CCC3)CC2)c1[N+](=O)[O-]	ZINC000912878847	713113306	/nfs/dbraw/zinc/11/33/06/713113306.db2.gz	DSRRXIQORXKDFL-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000890068705	709730344	/nfs/dbraw/zinc/73/03/44/709730344.db2.gz	CFSLWEQWNDBPJL-AWEZNQCLSA-N	1	1	321.377	1.476	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000900812298	709773359	/nfs/dbraw/zinc/77/33/59/709773359.db2.gz	UVXVWWDWHOUBEI-GXTWGEPZSA-N	1	1	320.393	1.267	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104020	713132304	/nfs/dbraw/zinc/13/23/04/713132304.db2.gz	STCAQWJFTNIOJO-KBPBESRZSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104020	713132305	/nfs/dbraw/zinc/13/23/05/713132305.db2.gz	STCAQWJFTNIOJO-KBPBESRZSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105962	713132663	/nfs/dbraw/zinc/13/26/63/713132663.db2.gz	XKHQFWOFKJFFJN-YPMHNXCESA-N	1	1	322.390	1.299	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105962	713132664	/nfs/dbraw/zinc/13/26/64/713132664.db2.gz	XKHQFWOFKJFFJN-YPMHNXCESA-N	1	1	322.390	1.299	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H](CCO)C2)c1[N+](=O)[O-]	ZINC000891949020	710335879	/nfs/dbraw/zinc/33/58/79/710335879.db2.gz	YDQVGKBGZMIPJL-LLVKDONJSA-N	1	1	310.350	1.903	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C	ZINC000928438593	713195820	/nfs/dbraw/zinc/19/58/20/713195820.db2.gz	GIDSEGYKKFEHRN-CABZTGNLSA-N	1	1	324.356	1.622	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](C3OCCO3)C2)c1[N+](=O)[O-]	ZINC000896379803	711714961	/nfs/dbraw/zinc/71/49/61/711714961.db2.gz	FCGZMSXTGNDFEU-LLVKDONJSA-N	1	1	324.333	1.504	20	5		DDBDMO
CCS(=O)(=O)c1cc(Cl)cc(C[NH2+]CC[N+](=O)[O-])c1	ZINC000905287093	711993313	/nfs/dbraw/zinc/99/33/13/711993313.db2.gz	XAPSCHZQBJVTHP-UHFFFAOYSA-N	1	1	306.771	1.500	20	5		DDBDMO
CCO[C@@H](C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)CN(C)C	ZINC000905581901	712085835	/nfs/dbraw/zinc/08/58/35/712085835.db2.gz	ZPCMKYYWNGWQMR-GJZGRUSLSA-N	1	1	311.382	1.185	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@]1(O)CCC[N@H+](C)C1	ZINC000908267259	712724619	/nfs/dbraw/zinc/72/46/19/712724619.db2.gz	FAPHVWNZWJAPDE-MRXNPFEDSA-N	1	1	321.377	1.997	20	5		DDBDMO
C[NH+]1CCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000916142051	713444723	/nfs/dbraw/zinc/44/47/23/713444723.db2.gz	AUHZNXZVFKVPPG-UHFFFAOYSA-N	1	1	312.757	1.434	20	5		DDBDMO
O=C1NCCN1CC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000933575837	714622125	/nfs/dbraw/zinc/62/21/25/714622125.db2.gz	HRLWSLGHYKKCIS-UHFFFAOYSA-N	1	1	319.365	1.227	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121651	714747714	/nfs/dbraw/zinc/74/77/14/714747714.db2.gz	NZZFCBHPBKAFSJ-KGLIPLIRSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121651	714747716	/nfs/dbraw/zinc/74/77/16/714747716.db2.gz	NZZFCBHPBKAFSJ-KGLIPLIRSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4cccc([N+](=O)[O-])c4n3)C[C@@H]21	ZINC001164664735	719390282	/nfs/dbraw/zinc/39/02/82/719390282.db2.gz	COEQLDSSFIOBFM-UONOGXRCSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncnc4cccc([N+](=O)[O-])c43)C[C@@H]21	ZINC000347409210	719474903	/nfs/dbraw/zinc/47/49/03/719474903.db2.gz	GYAWUDBSYJFAFF-QWHCGFSZSA-N	1	1	315.333	1.057	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nccc4cc([N+](=O)[O-])ccc43)C[C@H]21	ZINC000590694494	719481971	/nfs/dbraw/zinc/48/19/71/719481971.db2.gz	XDWXIXXHPVIZHH-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCC2CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063940	734368188	/nfs/dbraw/zinc/36/81/88/734368188.db2.gz	QDVNVDLQOVONRG-LXTVHRRPSA-N	1	1	309.410	1.859	20	5		DDBDMO
OC1(c2nc(-c3ccc4ccc5cccnc5c4n3)no2)C[NH2+]C1	ZINC001211855809	740341602	/nfs/dbraw/zinc/34/16/02/740341602.db2.gz	CFUDBAZLNUISKY-UHFFFAOYSA-N	1	1	319.324	1.624	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2nc(N[C@@H]3CCC[N@@H+](C4COC4)C3)ccc12	ZINC001168366975	742862974	/nfs/dbraw/zinc/86/29/74/742862974.db2.gz	GHLKVFOWDVZDOG-SNVBAGLBSA-N	1	1	317.349	1.746	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2nc(N[C@@H]3CCC[N@H+](C4COC4)C3)ccc12	ZINC001168366975	742862985	/nfs/dbraw/zinc/86/29/85/742862985.db2.gz	GHLKVFOWDVZDOG-SNVBAGLBSA-N	1	1	317.349	1.746	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2Cc3c[nH+]cn3C2)c1[N+](=O)[O-]	ZINC001187198043	744515790	/nfs/dbraw/zinc/51/57/90/744515790.db2.gz	DBAOMCHFMOCAQQ-VIFPVBQESA-N	1	1	317.305	1.318	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)[nH]1	ZINC001195213837	746550806	/nfs/dbraw/zinc/55/08/06/746550806.db2.gz	JPODTERDZCKYOA-NSHDSACASA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n1	ZINC001195213837	746550809	/nfs/dbraw/zinc/55/08/09/746550809.db2.gz	JPODTERDZCKYOA-NSHDSACASA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n1	ZINC001195213837	746550811	/nfs/dbraw/zinc/55/08/11/746550811.db2.gz	JPODTERDZCKYOA-NSHDSACASA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n[nH]1	ZINC001195213837	746550812	/nfs/dbraw/zinc/55/08/12/746550812.db2.gz	JPODTERDZCKYOA-NSHDSACASA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n[nH]1	ZINC001195213837	746550814	/nfs/dbraw/zinc/55/08/14/746550814.db2.gz	JPODTERDZCKYOA-NSHDSACASA-N	1	1	305.342	1.016	20	5		DDBDMO
CNC(=O)N[C@@H]1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759130	747248497	/nfs/dbraw/zinc/24/84/97/747248497.db2.gz	NBKNNJQCOGSYSI-OCCSQVGLSA-N	1	1	322.365	1.022	20	5		DDBDMO
CNC(=O)N[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759130	747248500	/nfs/dbraw/zinc/24/85/00/747248500.db2.gz	NBKNNJQCOGSYSI-OCCSQVGLSA-N	1	1	322.365	1.022	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NC/C=C\CNc1ncccc1[N+](=O)[O-]	ZINC001107280110	749725628	/nfs/dbraw/zinc/72/56/28/749725628.db2.gz	ICJXQZHILLYJHU-PLNGDYQASA-N	1	1	321.381	1.416	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCC2CCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001000675939	762080081	/nfs/dbraw/zinc/08/00/81/762080081.db2.gz	ZBRLAERSXSVXMC-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCC1=CC[N@H+](CCC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000675939	762080089	/nfs/dbraw/zinc/08/00/89/762080089.db2.gz	ZBRLAERSXSVXMC-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000675939	762080096	/nfs/dbraw/zinc/08/00/96/762080096.db2.gz	ZBRLAERSXSVXMC-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038653	762193556	/nfs/dbraw/zinc/19/35/56/762193556.db2.gz	JXKLKTISFAUVFU-CVEARBPZSA-N	1	1	317.389	1.776	20	5		DDBDMO
O=C1C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCN1Cc1ccccc1	ZINC001169038653	762193559	/nfs/dbraw/zinc/19/35/59/762193559.db2.gz	JXKLKTISFAUVFU-CVEARBPZSA-N	1	1	317.389	1.776	20	5		DDBDMO
Cc1ccnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169052443	762207203	/nfs/dbraw/zinc/20/72/03/762207203.db2.gz	FXQUKIUJJHCXMG-MELADBBJSA-N	1	1	306.366	1.684	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccncc2Cl)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020138787	760613160	/nfs/dbraw/zinc/61/31/60/760613160.db2.gz	AJIBGEZTJYTBOP-PRULPYPASA-N	1	1	324.768	1.137	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347075	766278188	/nfs/dbraw/zinc/27/81/88/766278188.db2.gz	QAHMXNMPQXBTEB-FZMZJTMJSA-N	1	1	321.377	1.874	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347075	766278189	/nfs/dbraw/zinc/27/81/89/766278189.db2.gz	QAHMXNMPQXBTEB-FZMZJTMJSA-N	1	1	321.377	1.874	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N	ZINC001134144706	770707780	/nfs/dbraw/zinc/70/77/80/770707780.db2.gz	YIZCTTYTXSRZGD-NSHDSACASA-N	1	1	314.345	1.764	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N	ZINC001134144706	770707789	/nfs/dbraw/zinc/70/77/89/770707789.db2.gz	YIZCTTYTXSRZGD-NSHDSACASA-N	1	1	314.345	1.764	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC001097037350	771590920	/nfs/dbraw/zinc/59/09/20/771590920.db2.gz	NAHWEXPHIFLHOD-HAQNSBGRSA-N	1	1	321.381	1.389	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCCO1	ZINC001173231935	777063949	/nfs/dbraw/zinc/06/39/49/777063949.db2.gz	PAVWENMSIMTQIQ-DOMZBBRYSA-N	1	1	322.361	1.790	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCN1CCN(C)CC1	ZINC001173234050	777065252	/nfs/dbraw/zinc/06/52/52/777065252.db2.gz	OYZLGNAIVSHZSO-OAHLLOKOSA-N	1	1	320.437	1.705	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN1CCN(C)CC1	ZINC001173234050	777065254	/nfs/dbraw/zinc/06/52/54/777065254.db2.gz	OYZLGNAIVSHZSO-OAHLLOKOSA-N	1	1	320.437	1.705	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC001177513507	778629506	/nfs/dbraw/zinc/62/95/06/778629506.db2.gz	DPULUXBIDOFTMU-UHFFFAOYSA-N	1	1	317.349	1.674	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(Cl)c(N)c([N+](=O)[O-])c3)C[C@@H]21	ZINC001119576847	781522048	/nfs/dbraw/zinc/52/20/48/781522048.db2.gz	BSBBDIQSWQQWAE-PELKAZGASA-N	1	1	324.768	1.607	20	5		DDBDMO
O=C(CCCF)N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC001266903697	837034557	/nfs/dbraw/zinc/03/45/57/837034557.db2.gz	QUKKVTVTWTUCDM-VIKVFOODSA-N	1	1	321.352	1.891	20	5		DDBDMO
CCc1ccccc1C[N@@H+](C)CCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001268238111	839876779	/nfs/dbraw/zinc/87/67/79/839876779.db2.gz	WYXHINIHIUXCJO-HZPDHXFCSA-N	1	1	319.405	1.804	20	5		DDBDMO
CCc1ccccc1C[N@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268238111	839876782	/nfs/dbraw/zinc/87/67/82/839876782.db2.gz	WYXHINIHIUXCJO-HZPDHXFCSA-N	1	1	319.405	1.804	20	5		DDBDMO
CCc1ccccc1C[N@@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268238111	839876788	/nfs/dbraw/zinc/87/67/88/839876788.db2.gz	WYXHINIHIUXCJO-HZPDHXFCSA-N	1	1	319.405	1.804	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001293855048	849611511	/nfs/dbraw/zinc/61/15/11/849611511.db2.gz	LHQXWTIHCFXOFB-JGVFFNPUSA-N	1	1	315.761	1.384	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001141946887	860977412	/nfs/dbraw/zinc/97/74/12/860977412.db2.gz	GHWLIOBFRHWRCC-SECBINFHSA-N	1	1	318.337	1.143	20	5		DDBDMO
O=[N+]([O-])C[C@H](OC[C@@H]1C[N@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961845	881611859	/nfs/dbraw/zinc/61/18/59/881611859.db2.gz	SBEBDIARCKVSJI-IRXDYDNUSA-N	1	1	320.389	1.959	20	5		DDBDMO
O=[N+]([O-])C[C@H](OC[C@@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961845	881611869	/nfs/dbraw/zinc/61/18/69/881611869.db2.gz	SBEBDIARCKVSJI-IRXDYDNUSA-N	1	1	320.389	1.959	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC3(CC[NH2+]CC3)C2)c1[N+](=O)[O-]	ZINC001329283677	863576750	/nfs/dbraw/zinc/57/67/50/863576750.db2.gz	NGHFGDMHUOFHEB-UHFFFAOYSA-N	1	1	307.354	1.232	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H]2CCC[N@@H+](C)[C@H]2C1	ZINC001157259094	863688892	/nfs/dbraw/zinc/68/88/92/863688892.db2.gz	CQCIZUODGUGMID-MFKMUULPSA-N	1	1	320.349	1.307	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC001157266083	863696120	/nfs/dbraw/zinc/69/61/20/863696120.db2.gz	NQEOHOJJWFQXQE-GXFFZTMASA-N	1	1	320.349	1.307	20	5		DDBDMO
[NH3+]Cc1ncn(-c2cc(Cl)nc3ccc([N+](=O)[O-])cc32)n1	ZINC001157931540	864277145	/nfs/dbraw/zinc/27/71/45/864277145.db2.gz	RKOKAIJJEIVAHE-UHFFFAOYSA-N	1	1	304.697	1.836	20	5		DDBDMO
[NH3+]Cc1ncn(-c2ccc(-c3ccc(F)c([N+](=O)[O-])c3)nn2)n1	ZINC001157931742	864277524	/nfs/dbraw/zinc/27/75/24/864277524.db2.gz	XKFLMDBIUVRNGG-UHFFFAOYSA-N	1	1	315.268	1.230	20	5		DDBDMO
CN(C)/C=C/c1cc(N2CC[N@H+]3CC[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC001158432321	864652560	/nfs/dbraw/zinc/65/25/60/864652560.db2.gz	JMNFRUIWKJPLIC-MASHWEEQSA-N	1	1	303.366	1.416	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](CC2CCCC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001160090425	865675529	/nfs/dbraw/zinc/67/55/29/865675529.db2.gz	FQYZVGDVUGMKAT-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCCC1=CC[N@H+](CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001160090425	865675534	/nfs/dbraw/zinc/67/55/34/865675534.db2.gz	FQYZVGDVUGMKAT-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001160090425	865675537	/nfs/dbraw/zinc/67/55/37/865675537.db2.gz	FQYZVGDVUGMKAT-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N[C@@H](CCC[NH3+])C(=O)[O-])ncc1[N+](=O)[O-]	ZINC001160597163	865964842	/nfs/dbraw/zinc/96/48/42/865964842.db2.gz	BHAZEVAFKCIVSN-ZRQQLDRUSA-N	1	1	323.353	1.126	20	5		DDBDMO
COC(=O)[C@H]1C[C@H]1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001161042341	866309773	/nfs/dbraw/zinc/30/97/73/866309773.db2.gz	MHTHJFACDMPZMD-XMXMHJJKSA-N	1	1	320.349	1.743	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@H+](C3CCC3)C2)c1[N+](=O)[O-]	ZINC001161176668	866424161	/nfs/dbraw/zinc/42/41/61/866424161.db2.gz	AHBLVHYHLIVSIK-JTQLQIEISA-N	1	1	320.349	1.815	20	5		DDBDMO
CN1CC[NH+](CCCNc2cnc(Cl)cc2[N+](=O)[O-])CC1	ZINC001161703312	866911939	/nfs/dbraw/zinc/91/19/39/866911939.db2.gz	CNSCBLKEMYRXSD-UHFFFAOYSA-N	1	1	313.789	1.693	20	5		DDBDMO
C[NH+]1CCN(CCCNc2cccc3ncc([N+](=O)[O-])n32)CC1	ZINC001161710355	866922546	/nfs/dbraw/zinc/92/25/46/866922546.db2.gz	DGXDCBSFCBTNAK-UHFFFAOYSA-N	1	1	318.381	1.292	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])c2cnccc21	ZINC001333822055	867045090	/nfs/dbraw/zinc/04/50/90/867045090.db2.gz	GASSHMORLGVKEC-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC001225961866	882131675	/nfs/dbraw/zinc/13/16/75/882131675.db2.gz	ASHZMXDHLDKJFL-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2c(F)c(F)ccc2[N+](=O)[O-])C1	ZINC001225961866	882131684	/nfs/dbraw/zinc/13/16/84/882131684.db2.gz	ASHZMXDHLDKJFL-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
C[NH+](C)C=Cc1cc(NC[C@H]2CNC(=O)O2)ncc1[N+](=O)[O-]	ZINC001163022554	868012625	/nfs/dbraw/zinc/01/26/25/868012625.db2.gz	KASRYSMFVBHACG-FSIBCCDJSA-N	1	1	307.310	1.042	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC001335422083	868284856	/nfs/dbraw/zinc/28/48/56/868284856.db2.gz	QPNBIYDLVCBQAI-ZFWWWQNUSA-N	1	1	318.377	1.483	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](Oc2ccc([N+](=O)[O-])cc2C(N)=O)C1	ZINC001226173300	882250992	/nfs/dbraw/zinc/25/09/92/882250992.db2.gz	RXCLVLPOQXMHRD-LBPRGKRZSA-N	1	1	307.350	1.945	20	5		DDBDMO
C[C@H]1CN(c2cc(N)c([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC001336650330	869073893	/nfs/dbraw/zinc/07/38/93/869073893.db2.gz	DKVRFWSGKARLRX-LLVKDONJSA-N	1	1	305.382	1.883	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)ccc1[N+](=O)[O-]	ZINC001337837312	869652648	/nfs/dbraw/zinc/65/26/48/869652648.db2.gz	ZXRKZUFYVVHDNO-HZSPNIEDSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[NH+]1CCN(C(=O)CNc2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC001337840371	869654050	/nfs/dbraw/zinc/65/40/50/869654050.db2.gz	HQSTYIYKJWVDFA-UHFFFAOYSA-N	1	1	312.757	1.434	20	5		DDBDMO
C[C@@H]1C(=O)N(C)CCN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001167038440	870494567	/nfs/dbraw/zinc/49/45/67/870494567.db2.gz	XERRQNRFOGZEJY-MVIFTORASA-N	1	1	319.365	1.189	20	5		DDBDMO
COC(=O)c1cc(O[C@@H]2CC[N@@H+](C)C2)c(OC)cc1[N+](=O)[O-]	ZINC001226440879	882433320	/nfs/dbraw/zinc/43/33/20/882433320.db2.gz	GWJHZQVYZHMNMD-SECBINFHSA-N	1	1	310.306	1.473	20	5		DDBDMO
COC(=O)c1cnc(NC[C@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC001339859039	870740803	/nfs/dbraw/zinc/74/08/03/870740803.db2.gz	ZCHPTVXDNPZOLO-LLVKDONJSA-N	1	1	308.338	1.673	20	5		DDBDMO
CC(C)(C(=O)N1CC([NH2+]C2COC2)C1)c1ccccc1[N+](=O)[O-]	ZINC001304208443	871200907	/nfs/dbraw/zinc/20/09/07/871200907.db2.gz	LZGDLNDGNCNZSF-UHFFFAOYSA-N	1	1	319.361	1.072	20	5		DDBDMO
Cn1c[nH+]cc1CCCn1nnc(-c2ccccc2[N+](=O)[O-])n1	ZINC001307404586	871433878	/nfs/dbraw/zinc/43/38/78/871433878.db2.gz	OCSVRCYEDWPUDO-UHFFFAOYSA-N	1	1	313.321	1.615	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2C)CC1	ZINC001341358558	871620038	/nfs/dbraw/zinc/62/00/38/871620038.db2.gz	IHYNNEIVYHFRGY-LBPRGKRZSA-N	1	1	324.429	1.709	20	5		DDBDMO
COc1c(O)ccc(CN2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC001342829737	872405563	/nfs/dbraw/zinc/40/55/63/872405563.db2.gz	LSUYWYYWQDIBSO-ZDUSSCGKSA-N	1	1	321.377	1.979	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]3CCCC[C@@H]3C2)c1	ZINC001319181580	872482384	/nfs/dbraw/zinc/48/23/84/872482384.db2.gz	MKZCNYDJRIZNDQ-GZBFAFLISA-N	1	1	308.382	1.664	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001348223682	874434342	/nfs/dbraw/zinc/43/43/42/874434342.db2.gz	GCOXVLOSLVBQIX-CUOATXAZSA-N	1	1	305.334	1.370	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001348223682	874434347	/nfs/dbraw/zinc/43/43/47/874434347.db2.gz	GCOXVLOSLVBQIX-CUOATXAZSA-N	1	1	305.334	1.370	20	5		DDBDMO
Cc1nn(C[N@H+](C)CCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-]	ZINC001356022585	878828842	/nfs/dbraw/zinc/82/88/42/878828842.db2.gz	LNZNWORIOJIIAR-UHFFFAOYSA-N	1	1	318.333	1.960	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-]	ZINC001356022585	878828856	/nfs/dbraw/zinc/82/88/56/878828856.db2.gz	LNZNWORIOJIIAR-UHFFFAOYSA-N	1	1	318.333	1.960	20	5		DDBDMO
COCCCC[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001277397777	884039375	/nfs/dbraw/zinc/03/93/75/884039375.db2.gz	VLXZETRBUNHOHK-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
COCCCC[N@@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001277397777	884039359	/nfs/dbraw/zinc/03/93/59/884039359.db2.gz	VLXZETRBUNHOHK-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
COCCCC[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001277397777	884039389	/nfs/dbraw/zinc/03/93/89/884039389.db2.gz	VLXZETRBUNHOHK-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C(F)F)Cc1ccccc1[N+](=O)[O-]	ZINC001231027116	885145551	/nfs/dbraw/zinc/14/55/51/885145551.db2.gz	BTHQNIONRHQGFP-UHFFFAOYSA-N	1	1	301.293	1.798	20	5		DDBDMO
N[C@@H](Cc1[nH]cc[nH+]1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247347712	893169164	/nfs/dbraw/zinc/16/91/64/893169164.db2.gz	VIQSLHYKULFQOH-ZETCQYMHSA-N	1	1	319.256	1.145	20	5		DDBDMO
[NH3+]C1(c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)CC(F)(F)C1	ZINC001248704621	893676039	/nfs/dbraw/zinc/67/60/39/893676039.db2.gz	BUQBTUWUZFFPCO-UHFFFAOYSA-N	1	1	315.211	1.762	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@]2(CCNC2=O)C1	ZINC001254553086	896499638	/nfs/dbraw/zinc/49/96/38/896499638.db2.gz	RWVQEIUHSFCQJW-MLGOLLRUSA-N	1	1	303.362	1.738	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CCCO1	ZINC001254563642	896501870	/nfs/dbraw/zinc/50/18/70/896501870.db2.gz	ABAOWLRLQWYDOQ-SWLSCSKDSA-N	1	1	322.361	1.790	20	5		DDBDMO
CN1CCN(CCC[NH2+][C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254568889	896504941	/nfs/dbraw/zinc/50/49/41/896504941.db2.gz	VURKIACBAZLFKK-INIZCTEOSA-N	1	1	318.421	1.289	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN(CC(F)F)CC1)C2	ZINC001254609550	896530650	/nfs/dbraw/zinc/53/06/50/896530650.db2.gz	XCTGJJVTNKDCRN-AWEZNQCLSA-N	1	1	311.332	1.945	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)n1	ZINC000248671347	282098454	/nfs/dbraw/zinc/09/84/54/282098454.db2.gz	QSCYALNLGWISIQ-NEPJUHHUSA-N	1	1	323.397	1.661	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000305452877	231008908	/nfs/dbraw/zinc/00/89/08/231008908.db2.gz	RZSRBBZBFMRICC-WFASDCNBSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@H]1CO	ZINC000305452877	231008909	/nfs/dbraw/zinc/00/89/09/231008909.db2.gz	RZSRBBZBFMRICC-WFASDCNBSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@]12C[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000451378586	231081371	/nfs/dbraw/zinc/08/13/71/231081371.db2.gz	YLHKBCFTWRHOJX-RMRKRWHISA-N	1	1	315.373	1.901	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)n1	ZINC000451345391	231072876	/nfs/dbraw/zinc/07/28/76/231072876.db2.gz	QROGHMBOQHWSSC-BFHYXJOUSA-N	1	1	308.382	1.807	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249548873	282170255	/nfs/dbraw/zinc/17/02/55/282170255.db2.gz	HDCBNFZNMDSCTB-WBIUFABUSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249548873	282170258	/nfs/dbraw/zinc/17/02/58/282170258.db2.gz	HDCBNFZNMDSCTB-WBIUFABUSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(CCn3cc([N+](=O)[O-])ccc3=O)CC[C@@H]21	ZINC000090552602	185302986	/nfs/dbraw/zinc/30/29/86/185302986.db2.gz	IHEYZFTXTUANNS-ZFWWWQNUSA-N	1	1	320.393	1.173	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000451633433	529798257	/nfs/dbraw/zinc/79/82/57/529798257.db2.gz	PUQNENJIMHVPRW-RISCZKNCSA-N	1	1	304.350	1.169	20	5		DDBDMO
C[C@@H](NC(=O)Cc1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000272748875	210152217	/nfs/dbraw/zinc/15/22/17/210152217.db2.gz	NYZOGGJQKYFWBP-GFCCVEGCSA-N	1	1	303.362	1.904	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000279708058	215079453	/nfs/dbraw/zinc/07/94/53/215079453.db2.gz	HRPSJSAVIJIJMO-GXTWGEPZSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279790387	215148915	/nfs/dbraw/zinc/14/89/15/215148915.db2.gz	OGTRKTFUTSUYRQ-CQSZACIVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1sc(C(=O)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000048383809	352537930	/nfs/dbraw/zinc/53/79/30/352537930.db2.gz	YNQZJVDXQBSOFD-UHFFFAOYSA-N	1	1	313.379	1.417	20	5		DDBDMO
CCOC1CC([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000286995195	219261466	/nfs/dbraw/zinc/26/14/66/219261466.db2.gz	PRWDNCVBAOEPJF-UHFFFAOYSA-N	1	1	307.350	1.693	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000279901197	215220298	/nfs/dbraw/zinc/22/02/98/215220298.db2.gz	VEGGLDNLRKJPGQ-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000279901197	215220301	/nfs/dbraw/zinc/22/03/01/215220301.db2.gz	VEGGLDNLRKJPGQ-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CON1CCC([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000459591238	233344195	/nfs/dbraw/zinc/34/41/95/233344195.db2.gz	TUQNTRBENHDLMJ-UHFFFAOYSA-N	1	1	309.366	1.931	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000266859524	186361976	/nfs/dbraw/zinc/36/19/76/186361976.db2.gz	JEQFMLYMLXLORE-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000266859524	186361978	/nfs/dbraw/zinc/36/19/78/186361978.db2.gz	JEQFMLYMLXLORE-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000531	307113945	/nfs/dbraw/zinc/11/39/45/307113945.db2.gz	ITNSNNQZROEUJL-RYUDHWBXSA-N	1	1	309.370	1.343	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000531	307113946	/nfs/dbraw/zinc/11/39/46/307113946.db2.gz	ITNSNNQZROEUJL-RYUDHWBXSA-N	1	1	309.370	1.343	20	5		DDBDMO
COCC[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccn1	ZINC000287221558	219389458	/nfs/dbraw/zinc/38/94/58/219389458.db2.gz	FKYCKKKMKBHBQL-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccn1	ZINC000287221558	219389461	/nfs/dbraw/zinc/38/94/61/219389461.db2.gz	FKYCKKKMKBHBQL-UHFFFAOYSA-N	1	1	305.338	1.335	20	5		DDBDMO
C[C@@H](c1cccc(O)c1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000072630225	191205160	/nfs/dbraw/zinc/20/51/60/191205160.db2.gz	QFZOFCAXHORIPK-NHYWBVRUSA-N	1	1	320.349	1.551	20	5		DDBDMO
O=C(NCC1([NH+]2CCCCC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000047295365	352489596	/nfs/dbraw/zinc/48/95/96/352489596.db2.gz	BQBZVMXICACNEW-ZIAGYGMSSA-N	1	1	309.410	1.957	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000066137800	352979443	/nfs/dbraw/zinc/97/94/43/352979443.db2.gz	BURPGBDVGAZKQL-LBPRGKRZSA-N	1	1	309.366	1.820	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H](C[NH+](CC)CC)C2)c1[N+](=O)[O-]	ZINC000174759713	198380994	/nfs/dbraw/zinc/38/09/94/198380994.db2.gz	SBWHBDBACCGKJH-LLVKDONJSA-N	1	1	323.397	1.684	20	5		DDBDMO
C[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000077995712	353501186	/nfs/dbraw/zinc/50/11/86/353501186.db2.gz	XATXZHJUWCBTSZ-NSHDSACASA-N	1	1	324.337	1.883	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H](O)C1CC1	ZINC000079769569	353576683	/nfs/dbraw/zinc/57/66/83/353576683.db2.gz	NYPVLZVAOOTCSA-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@H](O)C1CC1	ZINC000079769569	353576684	/nfs/dbraw/zinc/57/66/84/353576684.db2.gz	NYPVLZVAOOTCSA-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccccc2)C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000084259671	353719256	/nfs/dbraw/zinc/71/92/56/353719256.db2.gz	CBXNSHIHRSKCQV-CVEARBPZSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[N@@H+](CCNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000087135694	353747317	/nfs/dbraw/zinc/74/73/17/353747317.db2.gz	AOCJZTDVMOMTCZ-UHFFFAOYSA-N	1	1	318.377	1.757	20	5		DDBDMO
O=C(CC[N@H+]1CCc2n[nH]cc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000091078983	353809240	/nfs/dbraw/zinc/80/92/40/353809240.db2.gz	KJKFOHHVIYQBQU-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000109689360	353957456	/nfs/dbraw/zinc/95/74/56/353957456.db2.gz	KYBLBXUEWPENRT-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
O=c1ccn(Cc2[nH+]ccn2CC(F)(F)F)cc1[N+](=O)[O-]	ZINC000345646273	282999463	/nfs/dbraw/zinc/99/94/63/282999463.db2.gz	UXVCWNIOQBZAJZ-UHFFFAOYSA-N	1	1	302.212	1.564	20	5		DDBDMO
COc1ccc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000142317188	354143972	/nfs/dbraw/zinc/14/39/72/354143972.db2.gz	NYYKIZHHPZHLTE-ZDUSSCGKSA-N	1	1	319.361	1.914	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000319518175	354521829	/nfs/dbraw/zinc/52/18/29/354521829.db2.gz	JGLLNJUTMKWCOV-ZDUSSCGKSA-N	1	1	305.338	1.166	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCO[C@@H](C)C2)c1	ZINC000589497058	354996634	/nfs/dbraw/zinc/99/66/34/354996634.db2.gz	LKRJUTDYVNJRRT-NSHDSACASA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCO[C@@H](C)C2)c1	ZINC000589497058	354996636	/nfs/dbraw/zinc/99/66/36/354996636.db2.gz	LKRJUTDYVNJRRT-NSHDSACASA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590044134	355042415	/nfs/dbraw/zinc/04/24/15/355042415.db2.gz	HGHYQLITGDWLKP-DGCLKSJQSA-N	1	1	305.334	1.136	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC(C[NH+]2CCOCC2)C1	ZINC000590392520	355083930	/nfs/dbraw/zinc/08/39/30/355083930.db2.gz	ZFYRAHPMFQDIRO-UHFFFAOYSA-N	1	1	323.324	1.138	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H]1CCOC1	ZINC000494968481	235108551	/nfs/dbraw/zinc/10/85/51/235108551.db2.gz	CNBYCCQYPBLKFC-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590442839	355096436	/nfs/dbraw/zinc/09/64/36/355096436.db2.gz	HLYSCOOTNPVXSX-SMDDNHRTSA-N	1	1	304.350	1.169	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000590444459	355098686	/nfs/dbraw/zinc/09/86/86/355098686.db2.gz	LZJTWHXXBUCMKJ-UFBFGSQYSA-N	1	1	308.313	1.092	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000590655917	355138942	/nfs/dbraw/zinc/13/89/42/355138942.db2.gz	MZFNRPSVYUMKFS-AAEUAGOBSA-N	1	1	322.361	1.959	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](CCCO)C2)c1	ZINC000590663820	355139994	/nfs/dbraw/zinc/13/99/94/355139994.db2.gz	PRAROIVFINRYHH-LBPRGKRZSA-N	1	1	322.361	1.976	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCCC2)O1	ZINC000592193272	355531395	/nfs/dbraw/zinc/53/13/95/355531395.db2.gz	LDHSYUWCJLTJSM-CYBMUJFWSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCCC2)O1	ZINC000592193272	355531397	/nfs/dbraw/zinc/53/13/97/355531397.db2.gz	LDHSYUWCJLTJSM-CYBMUJFWSA-N	1	1	321.377	1.790	20	5		DDBDMO
CC1([NH3+])CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000592330692	355560474	/nfs/dbraw/zinc/56/04/74/355560474.db2.gz	BGZZVMCSGAHTRV-UHFFFAOYSA-N	1	1	303.322	1.425	20	5		DDBDMO
CCOc1cc(C[N@@H+]2C[C@H](O)C[C@H]2COC)ccc1[N+](=O)[O-]	ZINC000593065296	355784724	/nfs/dbraw/zinc/78/47/24/355784724.db2.gz	YGGCIHJJHWHZGH-QWHCGFSZSA-N	1	1	310.350	1.575	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](O)C[C@H]2COC)ccc1[N+](=O)[O-]	ZINC000593065296	355784726	/nfs/dbraw/zinc/78/47/26/355784726.db2.gz	YGGCIHJJHWHZGH-QWHCGFSZSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593720278	355976393	/nfs/dbraw/zinc/97/63/93/355976393.db2.gz	JPMZGUOOVYVVRN-FZMZJTMJSA-N	1	1	307.325	1.439	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH2+]C[C@H]1c1cccnc1	ZINC000593727840	355977359	/nfs/dbraw/zinc/97/73/59/355977359.db2.gz	TXYVXJRPHXWMGH-INIZCTEOSA-N	1	1	314.345	1.842	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C[C@H]2C1	ZINC000593664339	355959869	/nfs/dbraw/zinc/95/98/69/355959869.db2.gz	PKFABLKIBLWVTB-TXEJJXNPSA-N	1	1	307.325	1.296	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000594418783	356204116	/nfs/dbraw/zinc/20/41/16/356204116.db2.gz	LAWMUTVBSARCJC-NEPJUHHUSA-N	1	1	320.349	1.442	20	5		DDBDMO
CC(C)Oc1nc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000594575990	356253286	/nfs/dbraw/zinc/25/32/86/356253286.db2.gz	NCWHGISEOVUPSR-TXEJJXNPSA-N	1	1	306.366	1.775	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1C[N@@H+](C)CCN1C	ZINC000595017607	356372940	/nfs/dbraw/zinc/37/29/40/356372940.db2.gz	KSTURMJKVCDXLH-OCCSQVGLSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CN(C)CCN1C	ZINC000595017607	356372941	/nfs/dbraw/zinc/37/29/41/356372941.db2.gz	KSTURMJKVCDXLH-OCCSQVGLSA-N	1	1	322.409	1.500	20	5		DDBDMO
COC[C@@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)OC	ZINC000595370250	356468172	/nfs/dbraw/zinc/46/81/72/356468172.db2.gz	FYIHJIZBXWPYNJ-WCQYABFASA-N	1	1	310.354	1.137	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000081519134	192279228	/nfs/dbraw/zinc/27/92/28/192279228.db2.gz	ZIRMKDXYAXURSF-HIFRSBDPSA-N	1	1	324.377	1.693	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](C1CC1)C1(CO)CCC1	ZINC000595533116	356537181	/nfs/dbraw/zinc/53/71/81/356537181.db2.gz	GSYXBFZDNDVCQP-UHFFFAOYSA-N	1	1	307.350	1.136	20	5		DDBDMO
CCCC[C@@H](C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236877140	202048034	/nfs/dbraw/zinc/04/80/34/202048034.db2.gz	SUABWTKFUIIPQK-VIFPVBQESA-N	1	1	305.338	1.718	20	5		DDBDMO
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1OC	ZINC000595664292	356599452	/nfs/dbraw/zinc/59/94/52/356599452.db2.gz	OTJHSWIVHHHBHW-WCQYABFASA-N	1	1	310.306	1.024	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2NC(=O)CC[C@H]2C1	ZINC000595728989	356624872	/nfs/dbraw/zinc/62/48/72/356624872.db2.gz	PGGNRDWJKMDCQK-SMDDNHRTSA-N	1	1	319.361	1.704	20	5		DDBDMO
CC(C)NC(=O)[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000595851410	356677230	/nfs/dbraw/zinc/67/72/30/356677230.db2.gz	SCYNLXNFNMKQAV-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@]1(C)CO	ZINC000595856996	356679487	/nfs/dbraw/zinc/67/94/87/356679487.db2.gz	HERBBDFSXKPMRO-XPKDYRNWSA-N	1	1	324.377	1.285	20	5		DDBDMO
CCn1nccc1C[NH2+]Cc1cc(OC)c(O)cc1[N+](=O)[O-]	ZINC000596061738	356757937	/nfs/dbraw/zinc/75/79/37/356757937.db2.gz	JJEUTSVOCBNXII-UHFFFAOYSA-N	1	1	306.322	1.815	20	5		DDBDMO
NC(=O)c1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)ccc1[N+](=O)[O-]	ZINC000596107400	356774444	/nfs/dbraw/zinc/77/44/44/356774444.db2.gz	HYEHKIAMTWLMFE-JTQLQIEISA-N	1	1	315.333	1.801	20	5		DDBDMO
CCC[C@@H]1CN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000596176188	356802821	/nfs/dbraw/zinc/80/28/21/356802821.db2.gz	AJURIZSYQMSJPE-GFCCVEGCSA-N	1	1	324.381	1.633	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@@H]1C	ZINC000596176408	356803150	/nfs/dbraw/zinc/80/31/50/356803150.db2.gz	FVCYCRMVWFQOGI-QWRGUYRKSA-N	1	1	306.366	1.613	20	5		DDBDMO
Cc1cc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ncc1[N+](=O)[O-]	ZINC000596537186	356910597	/nfs/dbraw/zinc/91/05/97/356910597.db2.gz	BYXHGLCNEMUJQK-ZDUSSCGKSA-N	1	1	306.366	1.334	20	5		DDBDMO
CCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000597946286	357395416	/nfs/dbraw/zinc/39/54/16/357395416.db2.gz	NGJDQWGXGHFURV-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000597947445	357395832	/nfs/dbraw/zinc/39/58/32/357395832.db2.gz	YKUZYVZJNKPYNH-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000598465675	357593115	/nfs/dbraw/zinc/59/31/15/357593115.db2.gz	HTZQVVCRRQHFNU-UHFFFAOYSA-N	1	1	311.386	1.336	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@@]3([NH3+])C2)c1[N+](=O)[O-]	ZINC000598667429	357677266	/nfs/dbraw/zinc/67/72/66/357677266.db2.gz	GPPVAZVBJXFPFM-LKFCYVNXSA-N	1	1	307.354	1.224	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598560485	357632870	/nfs/dbraw/zinc/63/28/70/357632870.db2.gz	MVKYGGNRTHDTFD-NSHDSACASA-N	1	1	307.354	1.170	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598560485	357632873	/nfs/dbraw/zinc/63/28/73/357632873.db2.gz	MVKYGGNRTHDTFD-NSHDSACASA-N	1	1	307.354	1.170	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598560485	357632883	/nfs/dbraw/zinc/63/28/83/357632883.db2.gz	MVKYGGNRTHDTFD-NSHDSACASA-N	1	1	307.354	1.170	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)NC[C@H]1CCC[N@@H+](CC2CC2)C1	ZINC000598562029	357633615	/nfs/dbraw/zinc/63/36/15/357633615.db2.gz	RXHYTUYAFXTHSU-CYBMUJFWSA-N	1	1	321.381	1.030	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H]3CCC[C@@]3([NH3+])C2)c1[N+](=O)[O-]	ZINC000598667432	357677556	/nfs/dbraw/zinc/67/75/56/357677556.db2.gz	GPPVAZVBJXFPFM-YMTOWFKASA-N	1	1	307.354	1.224	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000599567294	357976468	/nfs/dbraw/zinc/97/64/68/357976468.db2.gz	WKZBSUZOZDLZBM-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000599567294	357976472	/nfs/dbraw/zinc/97/64/72/357976472.db2.gz	WKZBSUZOZDLZBM-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
C/C=C/C[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000599689902	358027188	/nfs/dbraw/zinc/02/71/88/358027188.db2.gz	LLRZMWMUWOUTCZ-DQNOIUNYSA-N	1	1	308.382	1.830	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000600309538	358191794	/nfs/dbraw/zinc/19/17/94/358191794.db2.gz	BMYDQAAVCHGWBL-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@H]1CC[N@@H+](C)C1	ZINC000601114530	358407086	/nfs/dbraw/zinc/40/70/86/358407086.db2.gz	QOZQLONNZWLNTL-SSDOTTSWSA-N	1	1	307.276	1.711	20	5		DDBDMO
CN1CCC([N@@H+]2CC[C@H](Nc3ncc(F)cc3[N+](=O)[O-])C2)CC1	ZINC000601115796	358408556	/nfs/dbraw/zinc/40/85/56/358408556.db2.gz	CGRJFHYSYGVUMG-LBPRGKRZSA-N	1	1	323.372	1.709	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@H](Nc3ncc(F)cc3[N+](=O)[O-])C2)CC1	ZINC000601115796	358408561	/nfs/dbraw/zinc/40/85/61/358408561.db2.gz	CGRJFHYSYGVUMG-LBPRGKRZSA-N	1	1	323.372	1.709	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601118634	358410292	/nfs/dbraw/zinc/41/02/92/358410292.db2.gz	OMKGDSBERXDQOF-UHFFFAOYSA-N	1	1	306.301	1.189	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181088099	199251298	/nfs/dbraw/zinc/25/12/98/199251298.db2.gz	FZSSOMMVODAKNJ-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@@H]4COC[C@@H]4C3)n2)cc1	ZINC000601971447	358759621	/nfs/dbraw/zinc/75/96/21/358759621.db2.gz	BNMNUYMFGBAXHP-TXEJJXNPSA-N	1	1	316.317	1.723	20	5		DDBDMO
COCC[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000358938005	299286079	/nfs/dbraw/zinc/28/60/79/299286079.db2.gz	YRGDLWCGRISOIB-UHFFFAOYSA-N	1	1	319.365	1.235	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602665047	359112436	/nfs/dbraw/zinc/11/24/36/359112436.db2.gz	XVQUXWGLSJAHBF-LLVKDONJSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602665047	359112442	/nfs/dbraw/zinc/11/24/42/359112442.db2.gz	XVQUXWGLSJAHBF-LLVKDONJSA-N	1	1	324.381	1.882	20	5		DDBDMO
CCN(C#N)CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602794250	359196865	/nfs/dbraw/zinc/19/68/65/359196865.db2.gz	MXPQUBDBFFMNIN-LBPRGKRZSA-N	1	1	304.354	1.279	20	5		DDBDMO
CCN(C#N)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602794250	359196866	/nfs/dbraw/zinc/19/68/66/359196866.db2.gz	MXPQUBDBFFMNIN-LBPRGKRZSA-N	1	1	304.354	1.279	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](OCC2CC2)C1	ZINC000602813827	359209106	/nfs/dbraw/zinc/20/91/06/359209106.db2.gz	ZXYVGOVKTLVXIL-AWEZNQCLSA-N	1	1	308.382	1.991	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602831418	359223525	/nfs/dbraw/zinc/22/35/25/359223525.db2.gz	XMCZMSJOYGJBJU-GFCCVEGCSA-N	1	1	309.370	1.209	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[C@H]1C(C)(C)C	ZINC000603143291	359432625	/nfs/dbraw/zinc/43/26/25/359432625.db2.gz	SFFPBBSFUOOGHG-LBPRGKRZSA-N	1	1	322.365	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+](CCCO)C3CC3)o2)cc1	ZINC000610140424	360386192	/nfs/dbraw/zinc/38/61/92/360386192.db2.gz	YTIKNPNXGASROF-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CCCO)C3CC3)o2)cc1	ZINC000610140424	360386194	/nfs/dbraw/zinc/38/61/94/360386194.db2.gz	YTIKNPNXGASROF-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000287915391	219804207	/nfs/dbraw/zinc/80/42/07/219804207.db2.gz	ORDVJLSBCQHTSP-UHFFFAOYSA-N	1	1	310.329	1.310	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000610900768	360567604	/nfs/dbraw/zinc/56/76/04/360567604.db2.gz	KOCOVPYYJXNYGU-NOZJJQNGSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000610900768	360567608	/nfs/dbraw/zinc/56/76/08/360567608.db2.gz	KOCOVPYYJXNYGU-NOZJJQNGSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[N@H+](CCn1cccn1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611271656	360685653	/nfs/dbraw/zinc/68/56/53/360685653.db2.gz	IPGOAECHJLOIDI-UHFFFAOYSA-N	1	1	318.333	1.695	20	5		DDBDMO
C[N@@H+](CCn1cccn1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611271656	360685658	/nfs/dbraw/zinc/68/56/58/360685658.db2.gz	IPGOAECHJLOIDI-UHFFFAOYSA-N	1	1	318.333	1.695	20	5		DDBDMO
CN(C)C(=O)CC[NH+]1CCN(c2sccc2[N+](=O)[O-])CC1	ZINC000611413767	360714716	/nfs/dbraw/zinc/71/47/16/360714716.db2.gz	SENFAYVLLHQVCO-UHFFFAOYSA-N	1	1	312.395	1.257	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCOC1	ZINC000612059421	360904351	/nfs/dbraw/zinc/90/43/51/360904351.db2.gz	RSACOTZNVOHBFT-UONOGXRCSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[N@H+](Cc1cn[nH]c1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612108172	360921923	/nfs/dbraw/zinc/92/19/23/360921923.db2.gz	QKZYCFKIEDMEAN-GFCCVEGCSA-N	1	1	306.322	1.190	20	5		DDBDMO
Cc1nn(CCC(=O)NCC2=CC[N@@H+](C)CC2)c(C)c1[N+](=O)[O-]	ZINC000271887855	209297299	/nfs/dbraw/zinc/29/72/99/209297299.db2.gz	OCDXBOCHLFZFGB-UHFFFAOYSA-N	1	1	321.381	1.176	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252440	363945640	/nfs/dbraw/zinc/94/56/40/363945640.db2.gz	LLOSIYFJQIKRRX-HUUCEWRRSA-N	1	1	321.352	1.782	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH2+]Cc1ncccc1O)OCCO2	ZINC000619432189	364006164	/nfs/dbraw/zinc/00/61/64/364006164.db2.gz	FAMHOKVAYQIYRQ-UHFFFAOYSA-N	1	1	317.301	1.756	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000261718796	203101697	/nfs/dbraw/zinc/10/16/97/203101697.db2.gz	FARWWXJNYMPSKJ-GFCCVEGCSA-N	1	1	301.306	1.105	20	5		DDBDMO
NC(=O)c1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1	ZINC000350728557	284250036	/nfs/dbraw/zinc/25/00/36/284250036.db2.gz	IUSHZUDGHGIIFI-UHFFFAOYSA-N	1	1	315.333	1.801	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000264593102	204015941	/nfs/dbraw/zinc/01/59/41/204015941.db2.gz	LUHWOTJXLCGPDA-GFCCVEGCSA-N	1	1	308.338	1.437	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000264662368	204062485	/nfs/dbraw/zinc/06/24/85/204062485.db2.gz	DSOKWQDOWXFTCN-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[N@@H+](CCNC(=O)NCCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC000264779211	204149207	/nfs/dbraw/zinc/14/92/07/204149207.db2.gz	BFKKARQSYNFQIR-UHFFFAOYSA-N	1	1	321.381	1.400	20	5		DDBDMO
C[N@@H+](CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])C1CC1	ZINC000264921006	204271059	/nfs/dbraw/zinc/27/10/59/204271059.db2.gz	MEKDZVLJXPTXPP-UHFFFAOYSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)c1	ZINC000266185632	205167042	/nfs/dbraw/zinc/16/70/42/205167042.db2.gz	CWNDUMWKTNONQB-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)c1	ZINC000266185632	205167046	/nfs/dbraw/zinc/16/70/46/205167046.db2.gz	CWNDUMWKTNONQB-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)C[C@H](C)O	ZINC000159511061	197359900	/nfs/dbraw/zinc/35/99/00/197359900.db2.gz	BNGSIJQWKLOQOQ-UWVGGRQHSA-N	1	1	311.338	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)C[C@H](C)O	ZINC000159511061	197359902	/nfs/dbraw/zinc/35/99/02/197359902.db2.gz	BNGSIJQWKLOQOQ-UWVGGRQHSA-N	1	1	311.338	1.243	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000284931010	218240701	/nfs/dbraw/zinc/24/07/01/218240701.db2.gz	JBRVTSIGGDWBEG-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
Cc1c(C(=O)N2CC[NH+](CC(C)(C)O)CC2)cccc1[N+](=O)[O-]	ZINC000106401402	194208133	/nfs/dbraw/zinc/20/81/33/194208133.db2.gz	LUAZUSDZCTUXRS-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CCOCC[NH+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000110922149	194369856	/nfs/dbraw/zinc/36/98/56/194369856.db2.gz	ICQOFQRHVBNIIQ-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023396	207173288	/nfs/dbraw/zinc/17/32/88/207173288.db2.gz	QIGAAVSCRRJLHH-GHMZBOCLSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023396	207173291	/nfs/dbraw/zinc/17/32/91/207173291.db2.gz	QIGAAVSCRRJLHH-GHMZBOCLSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000269023396	207173295	/nfs/dbraw/zinc/17/32/95/207173295.db2.gz	QIGAAVSCRRJLHH-GHMZBOCLSA-N	1	1	307.354	1.183	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](O)C[C@@H]1C	ZINC000340904200	251267448	/nfs/dbraw/zinc/26/74/48/251267448.db2.gz	JAGOJEHLMOKFGU-JQWIXIFHSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000352660394	285205001	/nfs/dbraw/zinc/20/50/01/285205001.db2.gz	NUEHBPXFQUBLAS-YPMHNXCESA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[C@@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000156475794	197116579	/nfs/dbraw/zinc/11/65/79/197116579.db2.gz	CEBWWFWTNGKCAO-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000156475794	197116581	/nfs/dbraw/zinc/11/65/81/197116581.db2.gz	CEBWWFWTNGKCAO-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H](C(=O)NC(N)=O)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451543172	533237811	/nfs/dbraw/zinc/23/78/11/533237811.db2.gz	BDKDARNXQCSYSH-JQWIXIFHSA-N	1	1	320.349	1.358	20	5		DDBDMO
CO[C@@H]1CCC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000076346136	406965982	/nfs/dbraw/zinc/96/59/82/406965982.db2.gz	JEWYSQHOHHMHJO-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000076346136	406965984	/nfs/dbraw/zinc/96/59/84/406965984.db2.gz	JEWYSQHOHHMHJO-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])CC2	ZINC000078623126	407036447	/nfs/dbraw/zinc/03/64/47/407036447.db2.gz	KKAGHJPONFSQLC-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])CC2	ZINC000078623126	407036450	/nfs/dbraw/zinc/03/64/50/407036450.db2.gz	KKAGHJPONFSQLC-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000124923037	407373908	/nfs/dbraw/zinc/37/39/08/407373908.db2.gz	DUJKMJLQPYTLEM-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000108784684	407390481	/nfs/dbraw/zinc/39/04/81/407390481.db2.gz	GIXPJSDPFCSXGQ-SNVBAGLBSA-N	1	1	307.325	1.948	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000108783240	407390484	/nfs/dbraw/zinc/39/04/84/407390484.db2.gz	VIIXPIBSCVRFOU-LBPRGKRZSA-N	1	1	318.377	1.607	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000125229424	407382599	/nfs/dbraw/zinc/38/25/99/407382599.db2.gz	WCEWVXPVYWNCPV-NSHDSACASA-N	1	1	309.370	1.275	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270980679	407448821	/nfs/dbraw/zinc/44/88/21/407448821.db2.gz	XDCLSMQQAWQUCD-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000270980679	407448830	/nfs/dbraw/zinc/44/88/30/407448830.db2.gz	XDCLSMQQAWQUCD-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H]1c2ccccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266540021	407551250	/nfs/dbraw/zinc/55/12/50/407551250.db2.gz	PRXSKKMKVQBXKL-DOMZBBRYSA-N	1	1	316.361	1.772	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCC[C@H]1CC[NH2+]C1	ZINC000261685018	407577001	/nfs/dbraw/zinc/57/70/01/407577001.db2.gz	MUOBWRBDLVZFLP-SECBINFHSA-N	1	1	317.342	1.012	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000152995891	407730193	/nfs/dbraw/zinc/73/01/93/407730193.db2.gz	DWWHCTPMIMPWSH-DOMZBBRYSA-N	1	1	321.377	1.793	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C(=O)OC)C1	ZINC000266999183	407710981	/nfs/dbraw/zinc/71/09/81/407710981.db2.gz	CCLIRJCGHNPITN-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)OC)C1	ZINC000266999183	407710986	/nfs/dbraw/zinc/71/09/86/407710986.db2.gz	CCLIRJCGHNPITN-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC(C)[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])N1CCN(C)CC1	ZINC000236682746	407749248	/nfs/dbraw/zinc/74/92/48/407749248.db2.gz	SRZUMVHOKHAVCH-KRWDZBQOSA-N	1	1	320.437	1.956	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)Cn1cccn1)C1CC1	ZINC000179241496	407762630	/nfs/dbraw/zinc/76/26/30/407762630.db2.gz	SXTLWBTXCUOJAA-HNNXBMFYSA-N	1	1	316.361	1.817	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000171750440	407758303	/nfs/dbraw/zinc/75/83/03/407758303.db2.gz	SRJIUVTUWHZDJJ-LBPRGKRZSA-N	1	1	306.366	1.736	20	5		DDBDMO
O=C1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]2N1	ZINC000133487305	407852049	/nfs/dbraw/zinc/85/20/49/407852049.db2.gz	BTXKYAHKVXEELQ-GJZGRUSLSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@@H]2N1	ZINC000133487305	407852058	/nfs/dbraw/zinc/85/20/58/407852058.db2.gz	BTXKYAHKVXEELQ-GJZGRUSLSA-N	1	1	303.362	1.880	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173462284	407882564	/nfs/dbraw/zinc/88/25/64/407882564.db2.gz	FYIUYGNXLDKTMC-GFCCVEGCSA-N	1	1	321.381	1.344	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173462284	407882566	/nfs/dbraw/zinc/88/25/66/407882566.db2.gz	FYIUYGNXLDKTMC-GFCCVEGCSA-N	1	1	321.381	1.344	20	5		DDBDMO
CCOC(=O)c1ccnc(NC[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000133474364	407847227	/nfs/dbraw/zinc/84/72/27/407847227.db2.gz	MLHTZLQPTWIMHC-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000268252999	407970459	/nfs/dbraw/zinc/97/04/59/407970459.db2.gz	XGELCMDOAKECKZ-ABAIWWIYSA-N	1	1	319.361	1.573	20	5		DDBDMO
CNC(=O)NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000135221260	407992497	/nfs/dbraw/zinc/99/24/97/407992497.db2.gz	PPRNRZJWJTVZIY-UHFFFAOYSA-N	1	1	320.349	1.405	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000245750658	408061766	/nfs/dbraw/zinc/06/17/66/408061766.db2.gz	TYMIEASKASKGFI-WCQYABFASA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000136205146	408088869	/nfs/dbraw/zinc/08/88/69/408088869.db2.gz	FSWAIRMBJUMVTD-TXEJJXNPSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136205146	408088874	/nfs/dbraw/zinc/08/88/74/408088874.db2.gz	FSWAIRMBJUMVTD-TXEJJXNPSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136205146	408088877	/nfs/dbraw/zinc/08/88/77/408088877.db2.gz	FSWAIRMBJUMVTD-TXEJJXNPSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@](C)(O)C1	ZINC000245916118	408097897	/nfs/dbraw/zinc/09/78/97/408097897.db2.gz	NBZYONFCINZDKK-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](C)(O)C1	ZINC000245916118	408097900	/nfs/dbraw/zinc/09/79/00/408097900.db2.gz	NBZYONFCINZDKK-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cn1cccc1[C@@H]1CCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000175492937	408146599	/nfs/dbraw/zinc/14/65/99/408146599.db2.gz	AKJYTKNBPAHZKU-ZFWWWQNUSA-N	1	1	319.365	1.328	20	5		DDBDMO
Cc1nnc([C@@H](C)[NH2+]CCn2cc([N+](=O)[O-])ccc2=O)s1	ZINC000273537725	408237545	/nfs/dbraw/zinc/23/75/45/408237545.db2.gz	ABDYNTLGJJHJCY-MRVPVSSYSA-N	1	1	309.351	1.267	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+](CCO)[C@@H]2CCc3ccccc32)n1	ZINC000176242630	408322415	/nfs/dbraw/zinc/32/24/15/408322415.db2.gz	FRUCHYSLPTTYSD-OAHLLOKOSA-N	1	1	316.361	1.773	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccccc3O)CC2)n1	ZINC000176189881	408304501	/nfs/dbraw/zinc/30/45/01/408304501.db2.gz	CJDNIGMJXIWVGG-UHFFFAOYSA-N	1	1	317.349	1.319	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1	ZINC000137964310	162129060	/nfs/dbraw/zinc/12/90/60/162129060.db2.gz	LAZAYMYRCBHKNE-JTQLQIEISA-N	1	1	313.379	1.362	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000269535078	408345376	/nfs/dbraw/zinc/34/53/76/408345376.db2.gz	TUIDMRHWNOCFOX-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209154	408355783	/nfs/dbraw/zinc/35/57/83/408355783.db2.gz	IIRBZIFUPCGPBY-TUAOUCFPSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000183209154	408355787	/nfs/dbraw/zinc/35/57/87/408355787.db2.gz	IIRBZIFUPCGPBY-TUAOUCFPSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000183208523	408355814	/nfs/dbraw/zinc/35/58/14/408355814.db2.gz	DSAWPCPXUKTZTM-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1	ZINC000264180453	408392733	/nfs/dbraw/zinc/39/27/33/408392733.db2.gz	BARGSEBCKMNCNW-SNVBAGLBSA-N	1	1	304.350	1.843	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1	ZINC000264180449	408393350	/nfs/dbraw/zinc/39/33/50/408393350.db2.gz	BARGSEBCKMNCNW-JTQLQIEISA-N	1	1	304.350	1.843	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CC[N@H+](C)C[C@H]1C	ZINC000247229793	408432919	/nfs/dbraw/zinc/43/29/19/408432919.db2.gz	CYWCVXRBMAGIBZ-YPMHNXCESA-N	1	1	323.397	1.288	20	5		DDBDMO
C[N@@H+](CCNC(=O)NCCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000270369445	408506889	/nfs/dbraw/zinc/50/68/89/408506889.db2.gz	UTUWPYQBOZXGBQ-UHFFFAOYSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@H]21	ZINC000248067803	408531978	/nfs/dbraw/zinc/53/19/78/408531978.db2.gz	ZXCFQFNQFWDPJU-GXTWGEPZSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)O	ZINC000265165432	408565160	/nfs/dbraw/zinc/56/51/60/408565160.db2.gz	XFXDWDWKFVGANM-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)O	ZINC000265165432	408565167	/nfs/dbraw/zinc/56/51/67/408565167.db2.gz	XFXDWDWKFVGANM-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000248470451	408575004	/nfs/dbraw/zinc/57/50/04/408575004.db2.gz	VCZWPRXSMCASAO-IUODEOHRSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1O	ZINC000249599049	408748958	/nfs/dbraw/zinc/74/89/58/408748958.db2.gz	XQKFUJGWWZLFAB-UXIGCNINSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000285857036	408877656	/nfs/dbraw/zinc/87/76/56/408877656.db2.gz	IJSILTPKOHRNOT-CJNGLKHVSA-N	1	1	305.378	1.890	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000281674573	408907857	/nfs/dbraw/zinc/90/78/57/408907857.db2.gz	LWIYKCOUAJRHLT-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CSc1cccc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000188075900	163040381	/nfs/dbraw/zinc/04/03/81/163040381.db2.gz	CYRHYJRXBRIIIZ-JTQLQIEISA-N	1	1	309.391	1.998	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000286071918	408918521	/nfs/dbraw/zinc/91/85/21/408918521.db2.gz	RWIARSIEYIOKTP-HIFRSBDPSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000194707743	163294601	/nfs/dbraw/zinc/29/46/01/163294601.db2.gz	SWJZDQUOEWHQFA-JTQLQIEISA-N	1	1	303.322	1.295	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292078773	408975683	/nfs/dbraw/zinc/97/56/83/408975683.db2.gz	FLJCKMZLTQYALI-JKSUJKDBSA-N	1	1	305.378	1.656	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[N@H+](C2CCC2)C1	ZINC000292510043	409033906	/nfs/dbraw/zinc/03/39/06/409033906.db2.gz	YAZAOFINFHRENX-GFCCVEGCSA-N	1	1	321.381	1.124	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000287583671	409059599	/nfs/dbraw/zinc/05/95/99/409059599.db2.gz	XPIZZJGOMZSJCN-UHFFFAOYSA-N	1	1	310.373	1.808	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2[NH2+]CC[C@H]2C1	ZINC000293348107	409095172	/nfs/dbraw/zinc/09/51/72/409095172.db2.gz	JVKUNBLDPVIUAQ-CABZTGNLSA-N	1	1	315.333	1.295	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)CN1	ZINC000278916329	409112517	/nfs/dbraw/zinc/11/25/17/409112517.db2.gz	QYMXWAANRKGXTH-OAHLLOKOSA-N	1	1	305.334	1.186	20	5		DDBDMO
C[C@H](NC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C1=CC[N@@H+](C)CC1	ZINC000283246640	409120931	/nfs/dbraw/zinc/12/09/31/409120931.db2.gz	UJYXDYAEQRZHCZ-VIFPVBQESA-N	1	1	322.340	1.696	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CC)CC2)c1	ZINC000283694249	409198042	/nfs/dbraw/zinc/19/80/42/409198042.db2.gz	WDZXRGVNBDVKRB-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280301325	409287521	/nfs/dbraw/zinc/28/75/21/409287521.db2.gz	FTKIORFUJPQEIM-DAXOMENPSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@]2(CCOC2)O1	ZINC000280301325	409287523	/nfs/dbraw/zinc/28/75/23/409287523.db2.gz	FTKIORFUJPQEIM-DAXOMENPSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000284195880	409293924	/nfs/dbraw/zinc/29/39/24/409293924.db2.gz	ZFXGDLQTEGTKKE-UWVGGRQHSA-N	1	1	324.356	1.871	20	5		DDBDMO
O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000290189642	409316466	/nfs/dbraw/zinc/31/64/66/409316466.db2.gz	WGHIJDQWIGMZKQ-UHFFFAOYSA-N	1	1	316.321	1.672	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(C)(C)CO	ZINC000295321183	409432483	/nfs/dbraw/zinc/43/24/83/409432483.db2.gz	WKIJBHZGPVDVNL-LLVKDONJSA-N	1	1	309.366	1.872	20	5		DDBDMO
COCCCNC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285467484	409457146	/nfs/dbraw/zinc/45/71/46/409457146.db2.gz	ZWSUCOYXIYZBJP-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
COCCCNC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285467484	409457150	/nfs/dbraw/zinc/45/71/50/409457150.db2.gz	ZWSUCOYXIYZBJP-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CC(C)(C(=O)N1CC[N@@H+]2CCCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000407986613	164189299	/nfs/dbraw/zinc/18/92/99/164189299.db2.gz	MNFBCDKIQIMNTC-LBPRGKRZSA-N	1	1	321.381	1.223	20	5		DDBDMO
CC(C)(C(=O)N1CC[N@H+]2CCCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000407986613	164189301	/nfs/dbraw/zinc/18/93/01/164189301.db2.gz	MNFBCDKIQIMNTC-LBPRGKRZSA-N	1	1	321.381	1.223	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357038013	409810304	/nfs/dbraw/zinc/81/03/04/409810304.db2.gz	MXMJGVPQAQTVDH-QWRGUYRKSA-N	1	1	307.354	1.027	20	5		DDBDMO
Cc1cnn(CC2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)c1	ZINC000332083935	409862356	/nfs/dbraw/zinc/86/23/56/409862356.db2.gz	CHIOENQGKTYTRV-UHFFFAOYSA-N	1	1	318.381	1.745	20	5		DDBDMO
CNc1ccc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000317348116	409866270	/nfs/dbraw/zinc/86/62/70/409866270.db2.gz	DUGCRXKJKYENGM-LBPRGKRZSA-N	1	1	306.366	1.803	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1O	ZINC000318063390	409872849	/nfs/dbraw/zinc/87/28/49/409872849.db2.gz	ZTCVIGJRRDXHCO-ZIAGYGMSSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1CCNC(=O)[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332215411	409986148	/nfs/dbraw/zinc/98/61/48/409986148.db2.gz	WPRQSTJYAHDYLW-ISVAXAHUSA-N	1	1	303.322	1.085	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000332245576	410009781	/nfs/dbraw/zinc/00/97/81/410009781.db2.gz	APVRWNNOKCWLFY-LBPRGKRZSA-N	1	1	316.361	1.712	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000332245576	410009786	/nfs/dbraw/zinc/00/97/86/410009786.db2.gz	APVRWNNOKCWLFY-LBPRGKRZSA-N	1	1	316.361	1.712	20	5		DDBDMO
COc1cc(CN2CCC[N@H+]([C@@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000346631769	410047378	/nfs/dbraw/zinc/04/73/78/410047378.db2.gz	DGLFEQCGJFKVHB-ZDUSSCGKSA-N	1	1	323.393	1.492	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357553298	410099766	/nfs/dbraw/zinc/09/97/66/410099766.db2.gz	UCIKKZUYVMHIBQ-JTQLQIEISA-N	1	1	307.354	1.375	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000343110957	410154129	/nfs/dbraw/zinc/15/41/29/410154129.db2.gz	YVGJCOIKKMOVCK-NHYWBVRUSA-N	1	1	319.361	1.382	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000299079975	410513221	/nfs/dbraw/zinc/51/32/21/410513221.db2.gz	HAPSXFFRIPEXDP-MNOVXSKESA-N	1	1	321.381	1.621	20	5		DDBDMO
Cc1c(CNC(=O)N[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000358605128	410493615	/nfs/dbraw/zinc/49/36/15/410493615.db2.gz	HULYAEWPPNNNLH-ZDUSSCGKSA-N	1	1	318.377	1.939	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+][C@@H](CO)c2c(F)cccc2F)c1	ZINC000359519366	410705868	/nfs/dbraw/zinc/70/58/68/410705868.db2.gz	GUBCRNOIFFYRRX-LBPRGKRZSA-N	1	1	312.276	1.393	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC1(O)CCC1	ZINC000337312548	410707085	/nfs/dbraw/zinc/70/70/85/410707085.db2.gz	FHQDILMKJFQVRS-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CS[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@@H]1[NH+](C)C	ZINC000330460759	410709039	/nfs/dbraw/zinc/70/90/39/410709039.db2.gz	VZQMDXVCVOLYNS-UONOGXRCSA-N	1	1	311.407	1.778	20	5		DDBDMO
Cc1ccn(CCC[NH+]2CCN(C(C)C)CC2)c(=O)c1[N+](=O)[O-]	ZINC000347707687	410680933	/nfs/dbraw/zinc/68/09/33/410680933.db2.gz	YASYOBDYHSNRQW-UHFFFAOYSA-N	1	1	322.409	1.481	20	5		DDBDMO
Cc1cnn(C)c1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000347848893	410756425	/nfs/dbraw/zinc/75/64/25/410756425.db2.gz	JKDHCJZEVWWJBY-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
CC(C)(CNc1ccc2ncc([N+](=O)[O-])n2n1)[NH+]1CCOCC1	ZINC000301847056	410812721	/nfs/dbraw/zinc/81/27/21/410812721.db2.gz	UQALJPAHTZUQJD-UHFFFAOYSA-N	1	1	320.353	1.160	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000330599615	410813898	/nfs/dbraw/zinc/81/38/98/410813898.db2.gz	ULMZLCIZBONOSL-RYUDHWBXSA-N	1	1	307.350	1.525	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000353175783	410828818	/nfs/dbraw/zinc/82/88/18/410828818.db2.gz	YOZLGXIDXXKJTJ-NSHDSACASA-N	1	1	309.370	1.209	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000353175783	410828825	/nfs/dbraw/zinc/82/88/25/410828825.db2.gz	YOZLGXIDXXKJTJ-NSHDSACASA-N	1	1	309.370	1.209	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(O)CCC1	ZINC000353474768	411013935	/nfs/dbraw/zinc/01/39/35/411013935.db2.gz	WIYNFRRKQXMRKW-ZDUSSCGKSA-N	1	1	310.350	1.181	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000344085596	410945719	/nfs/dbraw/zinc/94/57/19/410945719.db2.gz	SLPDWASCHPXQQN-NILFDRSVSA-N	1	1	319.361	1.260	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2nnc(N)cc2C1	ZINC000360156108	411079404	/nfs/dbraw/zinc/07/94/04/411079404.db2.gz	BVCSHDIJRRYYPE-UHFFFAOYSA-N	1	1	315.333	1.534	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2nnc(N)cc2C1	ZINC000360156108	411079410	/nfs/dbraw/zinc/07/94/10/411079410.db2.gz	BVCSHDIJRRYYPE-UHFFFAOYSA-N	1	1	315.333	1.534	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356444450	411033292	/nfs/dbraw/zinc/03/32/92/411033292.db2.gz	IAEYKMDTXCHADH-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@H](CO)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353499267	411033298	/nfs/dbraw/zinc/03/32/98/411033298.db2.gz	CSPAYDOANSEHGE-FZMZJTMJSA-N	1	1	304.350	1.636	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000129574803	196058471	/nfs/dbraw/zinc/05/84/71/196058471.db2.gz	BPRXYBZLLXHNCM-AWEZNQCLSA-N	1	1	305.378	1.749	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000129574803	196058473	/nfs/dbraw/zinc/05/84/73/196058473.db2.gz	BPRXYBZLLXHNCM-AWEZNQCLSA-N	1	1	305.378	1.749	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000416994085	225151907	/nfs/dbraw/zinc/15/19/07/225151907.db2.gz	JIJLEUREDYTDBI-NWDGAFQWSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000416994085	225151912	/nfs/dbraw/zinc/15/19/12/225151912.db2.gz	JIJLEUREDYTDBI-NWDGAFQWSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1CCOc1cccc([N+](=O)[O-])c1	ZINC000419331832	226121191	/nfs/dbraw/zinc/12/11/91/226121191.db2.gz	RXEGQPRARFJCJK-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCCC1	ZINC000361261200	299829462	/nfs/dbraw/zinc/82/94/62/299829462.db2.gz	PVEOWJBFPJCCCK-UHFFFAOYSA-N	1	1	317.349	1.749	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000366177689	418438200	/nfs/dbraw/zinc/43/82/00/418438200.db2.gz	DWVDFYONYSEMGK-OAHLLOKOSA-N	1	1	319.361	1.593	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000366177689	418438201	/nfs/dbraw/zinc/43/82/01/418438201.db2.gz	DWVDFYONYSEMGK-OAHLLOKOSA-N	1	1	319.361	1.593	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000192568238	418524133	/nfs/dbraw/zinc/52/41/33/418524133.db2.gz	GWUPJDYTQFRAKD-GHMZBOCLSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](C[C@@H](C)O)[C@H](C)C1	ZINC000192568238	418524135	/nfs/dbraw/zinc/52/41/35/418524135.db2.gz	GWUPJDYTQFRAKD-GHMZBOCLSA-N	1	1	311.386	1.011	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ccc(N)cc3[N+](=O)[O-])CC2)CCO1	ZINC000367064702	418557317	/nfs/dbraw/zinc/55/73/17/418557317.db2.gz	COGFSDCZGRDMTK-LBPRGKRZSA-N	1	1	320.393	1.867	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C[N@@H+](C)CC)C2)n1	ZINC000191830421	222109777	/nfs/dbraw/zinc/10/97/77/222109777.db2.gz	WQTYDVDRZAXOKV-NSHDSACASA-N	1	1	309.370	1.225	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290507287	418576846	/nfs/dbraw/zinc/57/68/46/418576846.db2.gz	LGIHTFAFNWQDHY-JTQLQIEISA-N	1	1	307.354	1.375	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CCOc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000375028370	418589881	/nfs/dbraw/zinc/58/98/81/418589881.db2.gz	CJZVNEMITLNGDK-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000361403214	418646028	/nfs/dbraw/zinc/64/60/28/418646028.db2.gz	NFYCZFSURSATDG-TZMCWYRMSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392283	418633302	/nfs/dbraw/zinc/63/33/02/418633302.db2.gz	NNEFQRNJVKMRKE-NEPJUHHUSA-N	1	1	323.397	1.731	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392283	418633304	/nfs/dbraw/zinc/63/33/04/418633304.db2.gz	NNEFQRNJVKMRKE-NEPJUHHUSA-N	1	1	323.397	1.731	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](CCCN3CCOCC3)C2)c1	ZINC000375404194	418636283	/nfs/dbraw/zinc/63/62/83/418636283.db2.gz	NPRMPOYEFKFXGN-AWEZNQCLSA-N	1	1	323.397	1.151	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2C(=O)NC[C@@H]2C1	ZINC000368230638	418707377	/nfs/dbraw/zinc/70/73/77/418707377.db2.gz	DYQZQBXUCHKQSW-OCCSQVGLSA-N	1	1	319.361	1.561	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](n3cccn3)C2)c1	ZINC000368269712	418712945	/nfs/dbraw/zinc/71/29/45/418712945.db2.gz	NADPGSWZQSMRDC-LSDHHAIUSA-N	1	1	302.334	1.772	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904684	418737935	/nfs/dbraw/zinc/73/79/35/418737935.db2.gz	PRYPEQPVFFEBJJ-WCQYABFASA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904684	418737936	/nfs/dbraw/zinc/73/79/36/418737936.db2.gz	PRYPEQPVFFEBJJ-WCQYABFASA-N	1	1	307.350	1.626	20	5		DDBDMO
CC(C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000411148812	418873635	/nfs/dbraw/zinc/87/36/35/418873635.db2.gz	TVARLSWCJWNFGB-UHFFFAOYSA-N	1	1	308.338	1.119	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913826	419365530	/nfs/dbraw/zinc/36/55/30/419365530.db2.gz	GPXRHUQXQLSGAW-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913826	419365535	/nfs/dbraw/zinc/36/55/35/419365535.db2.gz	GPXRHUQXQLSGAW-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[NH2+]C[C@@](C)(F)C2)cccc1[N+](=O)[O-]	ZINC000418084728	419519658	/nfs/dbraw/zinc/51/96/58/419519658.db2.gz	WAYWPJJVKGSNNL-OAHLLOKOSA-N	1	1	324.356	1.746	20	5		DDBDMO
COc1ccc(CN2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000418106334	419534622	/nfs/dbraw/zinc/53/46/22/419534622.db2.gz	CDQSITYMUYCZLW-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC(C)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@H]1CCC(=O)N1	ZINC000412082292	419632132	/nfs/dbraw/zinc/63/21/32/419632132.db2.gz	OZFJOAQHYKSYLW-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
COC(=O)[C@H]1CSCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000412066698	419614647	/nfs/dbraw/zinc/61/46/47/419614647.db2.gz	FTCPKZCENYKQAL-GFCCVEGCSA-N	1	1	310.375	1.933	20	5		DDBDMO
COc1cccc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000421709845	419694902	/nfs/dbraw/zinc/69/49/02/419694902.db2.gz	HKVLXAYGWAEIJC-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCCNC1	ZINC000414866946	419850125	/nfs/dbraw/zinc/85/01/25/419850125.db2.gz	NMYSGJYNAAXFHI-DGCLKSJQSA-N	1	1	306.366	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+](CCO)C3CCOCC3)nc2c1	ZINC000444691498	230121803	/nfs/dbraw/zinc/12/18/03/230121803.db2.gz	ZNMRPCNRJFYFFX-UHFFFAOYSA-N	1	1	320.349	1.444	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](c3nnc[nH]3)C2)c([N+](=O)[O-])cc1F	ZINC000425551742	420414974	/nfs/dbraw/zinc/41/49/74/420414974.db2.gz	QUIDNAVPNSTFFG-VIFPVBQESA-N	1	1	321.312	1.850	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](c3nnc[nH]3)C2)c([N+](=O)[O-])cc1F	ZINC000425551742	420414977	/nfs/dbraw/zinc/41/49/77/420414977.db2.gz	QUIDNAVPNSTFFG-VIFPVBQESA-N	1	1	321.312	1.850	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](c2nnc[nH]2)C1	ZINC000425550239	420416480	/nfs/dbraw/zinc/41/64/80/420416480.db2.gz	OTZBVBMXRYQWNI-SNVBAGLBSA-N	1	1	303.322	1.711	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)[C@H](CO)C1	ZINC000459682947	420846055	/nfs/dbraw/zinc/84/60/55/420846055.db2.gz	FJPRSIVYNTUKFQ-JSGCOSHPSA-N	1	1	310.350	1.167	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)[C@H](CO)C1	ZINC000459682947	420846058	/nfs/dbraw/zinc/84/60/58/420846058.db2.gz	FJPRSIVYNTUKFQ-JSGCOSHPSA-N	1	1	310.350	1.167	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459531592	420836188	/nfs/dbraw/zinc/83/61/88/420836188.db2.gz	QQKQLROFQGJROF-BPNCWPANSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459531592	420836189	/nfs/dbraw/zinc/83/61/89/420836189.db2.gz	QQKQLROFQGJROF-BPNCWPANSA-N	1	1	305.334	1.245	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455363201	421003026	/nfs/dbraw/zinc/00/30/26/421003026.db2.gz	WXSMNQILTLCFPQ-JTQLQIEISA-N	1	1	309.370	1.492	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1CCO	ZINC000456208435	421119860	/nfs/dbraw/zinc/11/98/60/421119860.db2.gz	IJWAWHDFDWVTBA-AOOOYVTPSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2csc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1CCO	ZINC000456208435	421119863	/nfs/dbraw/zinc/11/98/63/421119863.db2.gz	IJWAWHDFDWVTBA-AOOOYVTPSA-N	1	1	313.379	1.183	20	5		DDBDMO
O=C1OCCN1C[C@H]1CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000496156008	421140860	/nfs/dbraw/zinc/14/08/60/421140860.db2.gz	DKJBFBHYSNLWTA-JTQLQIEISA-N	1	1	311.363	1.930	20	5		DDBDMO
O=C1OCCN1C[C@H]1CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000496156008	421140863	/nfs/dbraw/zinc/14/08/63/421140863.db2.gz	DKJBFBHYSNLWTA-JTQLQIEISA-N	1	1	311.363	1.930	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000522811421	421225447	/nfs/dbraw/zinc/22/54/47/421225447.db2.gz	PHXVLNXYJGYXJP-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000560975079	421300562	/nfs/dbraw/zinc/30/05/62/421300562.db2.gz	HLYCAGVNMRDIJF-TUAOUCFPSA-N	1	1	321.381	1.795	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)C1	ZINC000561192800	421310913	/nfs/dbraw/zinc/31/09/13/421310913.db2.gz	WBOGBBWMBUAKAD-JTQLQIEISA-N	1	1	317.349	1.997	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548386068	421431571	/nfs/dbraw/zinc/43/15/71/421431571.db2.gz	YGYPHONTTFSNJH-QWRGUYRKSA-N	1	1	321.381	1.422	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649902	421442417	/nfs/dbraw/zinc/44/24/17/421442417.db2.gz	OCLZXUWIPLSZRH-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649902	421442420	/nfs/dbraw/zinc/44/24/20/421442420.db2.gz	OCLZXUWIPLSZRH-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649902	421442422	/nfs/dbraw/zinc/44/24/22/421442422.db2.gz	OCLZXUWIPLSZRH-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CN[C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418844	421506677	/nfs/dbraw/zinc/50/66/77/421506677.db2.gz	QINQVXDWMRYTBR-DOMZBBRYSA-N	1	1	304.394	1.418	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CN[C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418844	421506681	/nfs/dbraw/zinc/50/66/81/421506681.db2.gz	QINQVXDWMRYTBR-DOMZBBRYSA-N	1	1	304.394	1.418	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)C(C)(C)C1	ZINC000549744258	421506716	/nfs/dbraw/zinc/50/67/16/421506716.db2.gz	QLIJVNNCTLDAFB-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000557919932	421794632	/nfs/dbraw/zinc/79/46/32/421794632.db2.gz	KDRTVCNRCTYFNG-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000597605243	422388728	/nfs/dbraw/zinc/38/87/28/422388728.db2.gz	OTQWARRXCOUBTG-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CCC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000343596264	271812371	/nfs/dbraw/zinc/81/23/71/271812371.db2.gz	GVJTXWZAQRMWTG-CMPLNLGQSA-N	1	1	306.366	1.849	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-]	ZINC000344673730	272086447	/nfs/dbraw/zinc/08/64/47/272086447.db2.gz	MPZMOHGNPARIKT-SNVBAGLBSA-N	1	1	309.370	1.477	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000345933145	272369738	/nfs/dbraw/zinc/36/97/38/272369738.db2.gz	AJOUXZLKUHILBL-NWDGAFQWSA-N	1	1	309.370	1.123	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000345971488	272379634	/nfs/dbraw/zinc/37/96/34/272379634.db2.gz	VEPSMEUYDGFAGB-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
CC(C)(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(N)=O	ZINC000284157728	273500941	/nfs/dbraw/zinc/50/09/41/273500941.db2.gz	PYJFASLTYIPVOB-NSHDSACASA-N	1	1	310.310	1.493	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000273386961	274023052	/nfs/dbraw/zinc/02/30/52/274023052.db2.gz	JHEZJEXCIDBCON-UHFFFAOYSA-N	1	1	314.317	1.434	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H]1c1ccccc1	ZINC000285492490	277136844	/nfs/dbraw/zinc/13/68/44/277136844.db2.gz	AMVVQRPHEXNCQG-BXUZGUMPSA-N	1	1	315.333	1.493	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000290814671	279398369	/nfs/dbraw/zinc/39/83/69/279398369.db2.gz	RQZRQIRZHWGZRH-CMPLNLGQSA-N	1	1	321.381	1.255	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1	ZINC000357911255	299018251	/nfs/dbraw/zinc/01/82/51/299018251.db2.gz	ROWSDEGPZZIVCY-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@@H](C2CC2)C1	ZINC000362577657	300100883	/nfs/dbraw/zinc/10/08/83/300100883.db2.gz	QKJFGHDHQJHFNO-CZUORRHYSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@@H](C2CC2)C1	ZINC000362577657	300100884	/nfs/dbraw/zinc/10/08/84/300100884.db2.gz	QKJFGHDHQJHFNO-CZUORRHYSA-N	1	1	322.361	1.445	20	5		DDBDMO
Cn1nccc1[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000363327063	300251820	/nfs/dbraw/zinc/25/18/20/300251820.db2.gz	IZAHKWPCXLDNTJ-LBPRGKRZSA-N	1	1	304.354	1.404	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)C[C@@H]21	ZINC000364307977	300373132	/nfs/dbraw/zinc/37/31/32/300373132.db2.gz	NTTLXUNWYNSWHL-YGRLFVJLSA-N	1	1	304.350	1.343	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000364454397	300399502	/nfs/dbraw/zinc/39/95/02/300399502.db2.gz	KPTBXFIEPGQNKN-HRCADAONSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000364454397	300399505	/nfs/dbraw/zinc/39/95/05/300399505.db2.gz	KPTBXFIEPGQNKN-HRCADAONSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000364454397	300399506	/nfs/dbraw/zinc/39/95/06/300399506.db2.gz	KPTBXFIEPGQNKN-HRCADAONSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000370215046	301295891	/nfs/dbraw/zinc/29/58/91/301295891.db2.gz	JIUGHIHINDJBTI-OJLVUWQFSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000370215046	301295893	/nfs/dbraw/zinc/29/58/93/301295893.db2.gz	JIUGHIHINDJBTI-OJLVUWQFSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000370215046	301295895	/nfs/dbraw/zinc/29/58/95/301295895.db2.gz	JIUGHIHINDJBTI-OJLVUWQFSA-N	1	1	317.389	1.821	20	5		DDBDMO
Cc1cc(NC(=O)Cn2ccc([N+](=O)[O-])n2)cn2cc[nH+]c12	ZINC000355441007	306801036	/nfs/dbraw/zinc/80/10/36/306801036.db2.gz	RXSNXBZJRJLFMW-UHFFFAOYSA-N	1	1	300.278	1.386	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@H]1C	ZINC000532134477	303276204	/nfs/dbraw/zinc/27/62/04/303276204.db2.gz	ZCMFMQXNBZBRBK-NEPJUHHUSA-N	1	1	306.366	1.983	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-]	ZINC000535282492	303345558	/nfs/dbraw/zinc/34/55/58/303345558.db2.gz	ZANVWTRUTSBCJV-CYBMUJFWSA-N	1	1	314.345	1.850	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-]	ZINC000535282492	303345559	/nfs/dbraw/zinc/34/55/59/303345559.db2.gz	ZANVWTRUTSBCJV-CYBMUJFWSA-N	1	1	314.345	1.850	20	5		DDBDMO
CN1CCC[C@H]([N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000538712078	303389475	/nfs/dbraw/zinc/38/94/75/303389475.db2.gz	PLRAFLFAFQYICM-AAEUAGOBSA-N	1	1	319.365	1.097	20	5		DDBDMO
Cc1c(NC(=O)CC[NH+]2CC(O)(C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000364963429	307054870	/nfs/dbraw/zinc/05/48/70/307054870.db2.gz	PJXHPMZUYNTSJD-UHFFFAOYSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367782058	307104100	/nfs/dbraw/zinc/10/41/00/307104100.db2.gz	TWPFKBLEHSRNIE-QQUHWDOBSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367782058	307104101	/nfs/dbraw/zinc/10/41/01/307104101.db2.gz	TWPFKBLEHSRNIE-QQUHWDOBSA-N	1	1	305.334	1.092	20	5		DDBDMO
CC1(O)C[C@H]2CC[C@@H](C1)[N@H+]2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000371154590	307143408	/nfs/dbraw/zinc/14/34/08/307143408.db2.gz	DZQKIDQQCCQWDN-HBBFGDNQSA-N	1	1	319.361	1.911	20	5		DDBDMO
CC1(O)C[C@H]2CC[C@@H](C1)[N@@H+]2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000371154590	307143409	/nfs/dbraw/zinc/14/34/09/307143409.db2.gz	DZQKIDQQCCQWDN-HBBFGDNQSA-N	1	1	319.361	1.911	20	5		DDBDMO
Cc1nn(C)cc1[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000372737046	307174088	/nfs/dbraw/zinc/17/40/88/307174088.db2.gz	CTUOIWSJGGSPOE-ZDUSSCGKSA-N	1	1	304.354	1.670	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000567110454	308072028	/nfs/dbraw/zinc/07/20/28/308072028.db2.gz	FLERLIYBVIRYFJ-JTQLQIEISA-N	1	1	313.379	1.140	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1F	ZINC000590767511	483927570	/nfs/dbraw/zinc/92/75/70/483927570.db2.gz	ILGYEBQLIKQDOU-ZANVPECISA-N	1	1	323.324	1.519	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820595	521851820	/nfs/dbraw/zinc/85/18/20/521851820.db2.gz	VFVWBQRLPQETAJ-HZMBPMFUSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820595	521851829	/nfs/dbraw/zinc/85/18/29/521851829.db2.gz	VFVWBQRLPQETAJ-HZMBPMFUSA-N	1	1	322.365	1.085	20	5		DDBDMO
CCO[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000451522227	527763968	/nfs/dbraw/zinc/76/39/68/527763968.db2.gz	AWNKHJSKUMDDHU-GXTWGEPZSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000444624992	528935869	/nfs/dbraw/zinc/93/58/69/528935869.db2.gz	YKPXEVWHWBEMJG-UHFFFAOYSA-N	1	1	322.365	1.547	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000820715697	599084506	/nfs/dbraw/zinc/08/45/06/599084506.db2.gz	CQTJEVHWEUTQGW-VIFPVBQESA-N	1	1	318.341	1.066	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122592118	696723622	/nfs/dbraw/zinc/72/36/22/696723622.db2.gz	QXUHNIGBYNJVIV-STQMWFEESA-N	1	1	323.397	1.766	20	5		DDBDMO
CCCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000122592118	696723623	/nfs/dbraw/zinc/72/36/23/696723623.db2.gz	QXUHNIGBYNJVIV-STQMWFEESA-N	1	1	323.397	1.766	20	5		DDBDMO
COCCC[N@@H+](CCOC)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000068963691	696378939	/nfs/dbraw/zinc/37/89/39/696378939.db2.gz	DNUTZIOFAKLQPG-UHFFFAOYSA-N	1	1	322.365	1.887	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000748349067	700112063	/nfs/dbraw/zinc/11/20/63/700112063.db2.gz	APIAFNCZHNBNRB-VIFPVBQESA-N	1	1	322.321	1.588	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000748349067	700112064	/nfs/dbraw/zinc/11/20/64/700112064.db2.gz	APIAFNCZHNBNRB-VIFPVBQESA-N	1	1	322.321	1.588	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000172833268	697372021	/nfs/dbraw/zinc/37/20/21/697372021.db2.gz	CHXAMQBXYBFHJC-SECBINFHSA-N	1	1	311.294	1.744	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000172833268	697372023	/nfs/dbraw/zinc/37/20/23/697372023.db2.gz	CHXAMQBXYBFHJC-SECBINFHSA-N	1	1	311.294	1.744	20	5		DDBDMO
C[N@@H+](C[C@@H](O)C(F)(F)F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776604702	698125840	/nfs/dbraw/zinc/12/58/40/698125840.db2.gz	FDFSJJPFMMKITK-GHMZBOCLSA-N	1	1	308.256	1.483	20	5		DDBDMO
C[N@H+](C[C@@H](O)C(F)(F)F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776604702	698125845	/nfs/dbraw/zinc/12/58/45/698125845.db2.gz	FDFSJJPFMMKITK-GHMZBOCLSA-N	1	1	308.256	1.483	20	5		DDBDMO
COc1ccc(C[NH+]2CCC3(CNC(=O)O3)CC2)cc1[N+](=O)[O-]	ZINC000782000855	698671941	/nfs/dbraw/zinc/67/19/41/698671941.db2.gz	WVMOWQMNEDVFOG-UHFFFAOYSA-N	1	1	321.333	1.678	20	5		DDBDMO
Nc1c(F)c(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000785801484	699102650	/nfs/dbraw/zinc/10/26/50/699102650.db2.gz	RENPUGLXZAKPHK-UWVGGRQHSA-N	1	1	310.329	1.591	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H]1C	ZINC000787237360	699198866	/nfs/dbraw/zinc/19/88/66/699198866.db2.gz	FTZVOTUFUCVZTN-GWCFXTLKSA-N	1	1	318.333	1.785	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+](CC[N+](=O)[O-])Cc1ccccc1	ZINC000791052466	699608881	/nfs/dbraw/zinc/60/88/81/699608881.db2.gz	OGFTZUOPVWSSPZ-HNNXBMFYSA-N	1	1	307.394	1.486	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](CC[N+](=O)[O-])Cc1ccccc1	ZINC000791052466	699608883	/nfs/dbraw/zinc/60/88/83/699608883.db2.gz	OGFTZUOPVWSSPZ-HNNXBMFYSA-N	1	1	307.394	1.486	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000753949281	700470610	/nfs/dbraw/zinc/47/06/10/700470610.db2.gz	HVXKXYCJZOZDOU-LBPRGKRZSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000753949281	700470611	/nfs/dbraw/zinc/47/06/11/700470611.db2.gz	HVXKXYCJZOZDOU-LBPRGKRZSA-N	1	1	308.334	1.861	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](c3nccn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000755790931	700584601	/nfs/dbraw/zinc/58/46/01/700584601.db2.gz	URMFEBXEPAADFZ-GFCCVEGCSA-N	1	1	304.354	1.589	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@@H](c3nccn3C)C2)c(C)c1[N+](=O)[O-]	ZINC000755790931	700584602	/nfs/dbraw/zinc/58/46/02/700584602.db2.gz	URMFEBXEPAADFZ-GFCCVEGCSA-N	1	1	304.354	1.589	20	5		DDBDMO
COc1cc(C)[nH+]c(Cn2cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c2)c1	ZINC000756919002	700648672	/nfs/dbraw/zinc/64/86/72/700648672.db2.gz	ATTCMINQBRUPKX-UHFFFAOYSA-N	1	1	320.261	1.425	20	5		DDBDMO
C/C(=C\C(=O)NC[C@]1(O)CC[N@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000762721748	700904932	/nfs/dbraw/zinc/90/49/32/700904932.db2.gz	NKJAXMPIXPXARU-ONOODXEBSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1C	ZINC000768845677	701209275	/nfs/dbraw/zinc/20/92/75/701209275.db2.gz	MWOLEGWUPHMAAY-ZJUUUORDSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000768845677	701209276	/nfs/dbraw/zinc/20/92/76/701209276.db2.gz	MWOLEGWUPHMAAY-ZJUUUORDSA-N	1	1	322.321	1.668	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000804777732	701211950	/nfs/dbraw/zinc/21/19/50/701211950.db2.gz	JTROREGUPRYRME-LBPRGKRZSA-N	1	1	306.366	1.781	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839669761	701774943	/nfs/dbraw/zinc/77/49/43/701774943.db2.gz	DUIBIMZAIFGEDH-RRFJBIMHSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CC1CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839669761	701774945	/nfs/dbraw/zinc/77/49/45/701774945.db2.gz	DUIBIMZAIFGEDH-RRFJBIMHSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CC1CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839669761	701774950	/nfs/dbraw/zinc/77/49/50/701774950.db2.gz	DUIBIMZAIFGEDH-RRFJBIMHSA-N	1	1	309.410	1.813	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000812336877	702160269	/nfs/dbraw/zinc/16/02/69/702160269.db2.gz	AJQJSNPCSLCXKY-OLZOCXBDSA-N	1	1	319.361	1.627	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)[C@H]2C1	ZINC000816950100	702233922	/nfs/dbraw/zinc/23/39/22/702233922.db2.gz	LVEWAWGJOSJTTG-YGRLFVJLSA-N	1	1	323.324	1.275	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]CCS(=O)(=O)C2CC2)cc1Cl	ZINC000840965441	702295739	/nfs/dbraw/zinc/29/57/39/702295739.db2.gz	HIHTVAJYPCTQMN-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
Cc1nc(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n[nH]1	ZINC000866336479	706676329	/nfs/dbraw/zinc/67/63/29/706676329.db2.gz	JXKKZLTYCYYCPA-VIFPVBQESA-N	1	1	307.329	1.924	20	5		DDBDMO
Cc1nnc(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])[nH]1	ZINC000866336479	706676330	/nfs/dbraw/zinc/67/63/30/706676330.db2.gz	JXKKZLTYCYYCPA-VIFPVBQESA-N	1	1	307.329	1.924	20	5		DDBDMO
C[C@H]([NH3+])[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843365768	702867123	/nfs/dbraw/zinc/86/71/23/702867123.db2.gz	RPCIXLZEMSHCPG-QWRGUYRKSA-N	1	1	324.356	1.732	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@](O)(C3CC3)C2)c1	ZINC000852500984	704064354	/nfs/dbraw/zinc/06/43/54/704064354.db2.gz	HFWBVBZQQYVKLA-HZPDHXFCSA-N	1	1	306.362	1.865	20	5		DDBDMO
O=C1CC[C@H](C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)O1	ZINC000821348757	704394805	/nfs/dbraw/zinc/39/48/05/704394805.db2.gz	QHLPSZHJAUYQKW-GFCCVEGCSA-N	1	1	305.334	1.422	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CC[N@@H+](C)C1	ZINC000855360481	704480975	/nfs/dbraw/zinc/48/09/75/704480975.db2.gz	LYIQVGCUCRLZCY-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000874850083	705203267	/nfs/dbraw/zinc/20/32/67/705203267.db2.gz	NUJBKPZLAIGDOE-CHWSQXEVSA-N	1	1	304.350	1.486	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)c1cccc([N+](=O)[O-])c1	ZINC000861033845	705353755	/nfs/dbraw/zinc/35/37/55/705353755.db2.gz	VJQYAPQCDXCXAE-AWEZNQCLSA-N	1	1	308.334	1.862	20	5		DDBDMO
Cc1nn(C[N@H+](C)[C@H]2C[C@@H](C(N)=O)C2)c2ccc([N+](=O)[O-])cc12	ZINC000863322856	705901650	/nfs/dbraw/zinc/90/16/50/705901650.db2.gz	RVKFRQWTGPESIL-KLPPZKSPSA-N	1	1	317.349	1.406	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827252911	705960397	/nfs/dbraw/zinc/96/03/97/705960397.db2.gz	ALTDZYPUZWNRQK-CMPLNLGQSA-N	1	1	319.365	1.198	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2[C@H](CC[N@@H+]2C)C1	ZINC000827328343	705976386	/nfs/dbraw/zinc/97/63/86/705976386.db2.gz	DWTPPJCEGZMBLM-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](Nc2nc3ccccn3c2[N+](=O)[O-])C1	ZINC000865998977	706589849	/nfs/dbraw/zinc/58/98/49/706589849.db2.gz	GKDMNOTVYCJWHU-NSHDSACASA-N	1	1	319.365	1.500	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](CCn1cc([N+](=O)[O-])cn1)CC2	ZINC000880181262	706903342	/nfs/dbraw/zinc/90/33/42/706903342.db2.gz	TWWHOPVKYWGBLM-OCCSQVGLSA-N	1	1	308.338	1.209	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000880609105	707039086	/nfs/dbraw/zinc/03/90/86/707039086.db2.gz	QJOGTHWXXNENRK-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000880609105	707039090	/nfs/dbraw/zinc/03/90/90/707039090.db2.gz	QJOGTHWXXNENRK-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000880609105	707039092	/nfs/dbraw/zinc/03/90/92/707039092.db2.gz	QJOGTHWXXNENRK-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000880609105	707039095	/nfs/dbraw/zinc/03/90/95/707039095.db2.gz	QJOGTHWXXNENRK-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
O=C1CC2(CCOCC2)[N@H+](Cc2ccc([N+](=O)[O-])cc2)CCN1	ZINC000872289846	707366786	/nfs/dbraw/zinc/36/67/86/707366786.db2.gz	RBJZNMOZGQYFQW-UHFFFAOYSA-N	1	1	319.361	1.466	20	5		DDBDMO
O=C1CC2(CCOCC2)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CCN1	ZINC000872289846	707366791	/nfs/dbraw/zinc/36/67/91/707366791.db2.gz	RBJZNMOZGQYFQW-UHFFFAOYSA-N	1	1	319.361	1.466	20	5		DDBDMO
Cc1cc(N2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)c(F)cc1[N+](=O)[O-]	ZINC000872757857	707587311	/nfs/dbraw/zinc/58/73/11/707587311.db2.gz	MZSGXWMZYRYHFO-NWDGAFQWSA-N	1	1	309.341	1.688	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000837178386	707592300	/nfs/dbraw/zinc/59/23/00/707592300.db2.gz	ZWYDMHKEGDTTQS-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000882765658	707782463	/nfs/dbraw/zinc/78/24/63/707782463.db2.gz	GRTQNNJWHCGDGJ-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000882765658	707782469	/nfs/dbraw/zinc/78/24/69/707782469.db2.gz	GRTQNNJWHCGDGJ-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1C	ZINC000883598519	708034678	/nfs/dbraw/zinc/03/46/78/708034678.db2.gz	JNDRGSAELUHLSG-ZDUSSCGKSA-N	1	1	306.366	1.797	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897219632	708257212	/nfs/dbraw/zinc/25/72/12/708257212.db2.gz	MEXGMYHIKGALJH-QWHCGFSZSA-N	1	1	322.365	1.034	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000886340010	708745742	/nfs/dbraw/zinc/74/57/42/708745742.db2.gz	ABHHQHLSXGYARC-PHIMTYICSA-N	1	1	305.334	1.884	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887924457	709165155	/nfs/dbraw/zinc/16/51/55/709165155.db2.gz	LQJLTKJLGMWHBP-WBMJQRKESA-N	1	1	321.352	1.687	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2C)[C@H](C)C1	ZINC000910291686	709870904	/nfs/dbraw/zinc/87/09/04/709870904.db2.gz	DUHQUBQGQZAVEW-LLVKDONJSA-N	1	1	306.366	1.855	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000910296676	709874366	/nfs/dbraw/zinc/87/43/66/709874366.db2.gz	ODCXGZFXUTUIRD-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[N@H+]2CCN1CCC2)c1ccc([N+](=O)[O-])cc1	ZINC000928249272	713157344	/nfs/dbraw/zinc/15/73/44/713157344.db2.gz	RFGYLYCKLAEGKR-DOMZBBRYSA-N	1	1	318.377	1.162	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000892418665	710434245	/nfs/dbraw/zinc/43/42/45/710434245.db2.gz	RZWLIUXWTUALKB-TZMCWYRMSA-N	1	1	304.350	1.440	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000928452605	713203690	/nfs/dbraw/zinc/20/36/90/713203690.db2.gz	NFAFISGKRFEFLQ-PWSUYJOCSA-N	1	1	307.350	1.816	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CCC(C)(CO)CC2)c1[N+](=O)[O-]	ZINC000893605159	710739292	/nfs/dbraw/zinc/73/92/92/710739292.db2.gz	JNOCIUVSIPAKII-UHFFFAOYSA-N	1	1	310.350	1.903	20	5		DDBDMO
COc1cc([C@H](C)NC[C@@H]2C[N@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091853	711029745	/nfs/dbraw/zinc/02/97/45/711029745.db2.gz	BMJJVKYGMXKSJU-SWLSCSKDSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([C@H](C)NC[C@@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091853	711029747	/nfs/dbraw/zinc/02/97/47/711029747.db2.gz	BMJJVKYGMXKSJU-SWLSCSKDSA-N	1	1	322.409	1.500	20	5		DDBDMO
CCOc1cc(C(=O)NC[C@@H]2CC[N@@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928568934	713232341	/nfs/dbraw/zinc/23/23/41/713232341.db2.gz	QHDRWTMDKOWJPY-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
CCOc1cc(C(=O)NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000928568934	713232344	/nfs/dbraw/zinc/23/23/44/713232344.db2.gz	QHDRWTMDKOWJPY-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000913538941	713249347	/nfs/dbraw/zinc/24/93/47/713249347.db2.gz	WTEYIADUBDQRMM-BETUJISGSA-N	1	1	305.334	1.279	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000913538941	713249349	/nfs/dbraw/zinc/24/93/49/713249349.db2.gz	WTEYIADUBDQRMM-BETUJISGSA-N	1	1	305.334	1.279	20	5		DDBDMO
C[C@@H](Nc1c(Cl)cncc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895248269	711465026	/nfs/dbraw/zinc/46/50/26/711465026.db2.gz	ZPOXDGLMTYDWIL-SKDRFNHKSA-N	1	1	313.789	1.111	20	5		DDBDMO
C[C@H]1[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737533	711590882	/nfs/dbraw/zinc/59/08/82/711590882.db2.gz	AZFLAUXCEGRXHF-GXFFZTMASA-N	1	1	318.377	1.992	20	5		DDBDMO
CC[C@@H](C[NH+]1CCOCC1)Nc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000895801536	711609466	/nfs/dbraw/zinc/60/94/66/711609466.db2.gz	KFKOKOHMORZJHN-NSHDSACASA-N	1	1	319.365	1.994	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000905018264	711910691	/nfs/dbraw/zinc/91/06/91/711910691.db2.gz	UUKKLEZUXWPALY-UHFFFAOYSA-N	1	1	311.769	1.955	20	5		DDBDMO
CC1(C)CC[N@H+](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000905680497	712116343	/nfs/dbraw/zinc/11/63/43/712116343.db2.gz	XATSKXFJMVAODL-OAHLLOKOSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000905680497	712116347	/nfs/dbraw/zinc/11/63/47/712116347.db2.gz	XATSKXFJMVAODL-OAHLLOKOSA-N	1	1	307.394	1.950	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C	ZINC000908123564	712693366	/nfs/dbraw/zinc/69/33/66/712693366.db2.gz	CUROJBWGSDJAMX-XJKSGUPXSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[N@H+]1CCC[C@H]1Cn1nc(-c2ccccc2[N+](=O)[O-])oc1=O	ZINC000917605647	713506459	/nfs/dbraw/zinc/50/64/59/713506459.db2.gz	IDPRGSNBKIORPI-JTQLQIEISA-N	1	1	304.306	1.506	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000930651589	713887481	/nfs/dbraw/zinc/88/74/81/713887481.db2.gz	YVXJTMNOYPWJIS-HUUCEWRRSA-N	1	1	303.362	1.909	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOC[C@H]1CC1CC1	ZINC000933209229	714537548	/nfs/dbraw/zinc/53/75/48/714537548.db2.gz	CYYGTESYEAJATG-CQSZACIVSA-N	1	1	307.350	1.257	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOC[C@H]1CC1CC1	ZINC000933209229	714537549	/nfs/dbraw/zinc/53/75/49/714537549.db2.gz	CYYGTESYEAJATG-CQSZACIVSA-N	1	1	307.350	1.257	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933218346	714539361	/nfs/dbraw/zinc/53/93/61/714539361.db2.gz	QVGVFUVUDKIYSE-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933218346	714539365	/nfs/dbraw/zinc/53/93/65/714539365.db2.gz	QVGVFUVUDKIYSE-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
CN1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000933997465	714718898	/nfs/dbraw/zinc/71/88/98/714718898.db2.gz	WBXNRLIRTQCERK-UHFFFAOYSA-N	1	1	310.373	1.413	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117633	714745919	/nfs/dbraw/zinc/74/59/19/714745919.db2.gz	HROOBCPPKROSOL-GJZGRUSLSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117633	714745921	/nfs/dbraw/zinc/74/59/21/714745921.db2.gz	HROOBCPPKROSOL-GJZGRUSLSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120302	714747337	/nfs/dbraw/zinc/74/73/37/714747337.db2.gz	SXFWWODOEKMBNS-KBPBESRZSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120302	714747339	/nfs/dbraw/zinc/74/73/39/714747339.db2.gz	SXFWWODOEKMBNS-KBPBESRZSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000934131121	714751395	/nfs/dbraw/zinc/75/13/95/714751395.db2.gz	KBRRFIBMVMTPOZ-VHDGCEQUSA-N	1	1	310.350	1.444	20	5		DDBDMO
CN1C[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)CCC1=O	ZINC001167249320	732864016	/nfs/dbraw/zinc/86/40/16/732864016.db2.gz	DJQVQLVHPPLQAS-NSHDSACASA-N	1	1	318.377	1.615	20	5		DDBDMO
CN1C[C@@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)CCC1=O	ZINC001167249320	732864017	/nfs/dbraw/zinc/86/40/17/732864017.db2.gz	DJQVQLVHPPLQAS-NSHDSACASA-N	1	1	318.377	1.615	20	5		DDBDMO
O=C(NCC[NH2+]Cc1c(F)cccc1Cl)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001126931858	742774570	/nfs/dbraw/zinc/77/45/70/742774570.db2.gz	CFMCYMPBVOWTJC-PRHODGIISA-N	1	1	315.732	1.350	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC001192490996	745795351	/nfs/dbraw/zinc/79/53/51/745795351.db2.gz	XTNDZGZBUZBVPO-QWRGUYRKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC001197748166	747257294	/nfs/dbraw/zinc/25/72/94/747257294.db2.gz	FUHOXDCGGBAONO-LBPRGKRZSA-N	1	1	322.365	1.367	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCN1C	ZINC000823784947	758361575	/nfs/dbraw/zinc/36/15/75/758361575.db2.gz	UIEZYFQHNVDZSL-HZMBPMFUSA-N	1	1	324.356	1.098	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)C1CC1	ZINC001136592419	772031542	/nfs/dbraw/zinc/03/15/42/772031542.db2.gz	ZBFNCLICAZPSQF-UHFFFAOYSA-N	1	1	301.734	1.185	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(CC)c1ccc([N+](=O)[O-])cn1	ZINC001100576556	776320107	/nfs/dbraw/zinc/32/01/07/776320107.db2.gz	ILCPWKXLFBECPV-UHFFFAOYSA-N	1	1	323.397	1.274	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@H]2CCOC2)CC1	ZINC001173224866	777059529	/nfs/dbraw/zinc/05/95/29/777059529.db2.gz	HLLUUNVAUXLRFI-YOEHRIQHSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1cnccn1)c1ccccc1[N+](=O)[O-]	ZINC001175890607	777945054	/nfs/dbraw/zinc/94/50/54/777945054.db2.gz	GBXKXMRHFTXGFD-JTQLQIEISA-N	1	1	301.306	1.674	20	5		DDBDMO
O=C(CN1CCCC1)NCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC001176095602	778022671	/nfs/dbraw/zinc/02/26/71/778022671.db2.gz	FSFBAPXCQHKLLS-UHFFFAOYSA-N	1	1	320.393	1.287	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001178709986	779154493	/nfs/dbraw/zinc/15/44/93/779154493.db2.gz	UAWOKBKEAMLKOV-ZDUSSCGKSA-N	1	1	306.366	1.463	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC001119450846	781458119	/nfs/dbraw/zinc/45/81/19/781458119.db2.gz	YYYKXEORJGUMPI-CQSZACIVSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC001119984890	781709047	/nfs/dbraw/zinc/70/90/47/781709047.db2.gz	WZNLULNCDVLPPQ-QWHCGFSZSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC(C)[N@H+](C)CC(=O)N(C)CCNCc1ccccc1[N+](=O)[O-]	ZINC001267116565	837381597	/nfs/dbraw/zinc/38/15/97/837381597.db2.gz	DMGSMHCZOXLOOP-UHFFFAOYSA-N	1	1	322.409	1.483	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCNCc1ccccc1[N+](=O)[O-]	ZINC001267116565	837381605	/nfs/dbraw/zinc/38/16/05/837381605.db2.gz	DMGSMHCZOXLOOP-UHFFFAOYSA-N	1	1	322.409	1.483	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H]2C[N@@H+](C3CC3)C[C@@H]2C)n1	ZINC001150120264	862100276	/nfs/dbraw/zinc/10/02/76/862100276.db2.gz	UWVZJAYITBMNDV-XPTSAGLGSA-N	1	1	304.350	1.511	20	5		DDBDMO
CC(C)=C(C)CC(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001132446650	850646209	/nfs/dbraw/zinc/64/62/09/850646209.db2.gz	DDYYXXRSUBARIB-UHFFFAOYSA-N	1	1	309.370	1.281	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC001141747792	860927712	/nfs/dbraw/zinc/92/77/12/860927712.db2.gz	IWQQCAPIFBBLQD-MNOVXSKESA-N	1	1	306.322	1.052	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C(C)(C)C1	ZINC001156827368	863372700	/nfs/dbraw/zinc/37/27/00/863372700.db2.gz	CCFZCYYAUYSMGK-LBPRGKRZSA-N	1	1	324.356	1.776	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001329416379	863654352	/nfs/dbraw/zinc/65/43/52/863654352.db2.gz	LLEKPUMEEMDPAA-TZMCWYRMSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cc1cc(-n2cnc(C[NH3+])n2)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC001157931783	864277352	/nfs/dbraw/zinc/27/73/52/864277352.db2.gz	ZPWOTLJQEZJFAY-UHFFFAOYSA-N	1	1	311.305	1.400	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ccc([N+](=O)[O-])c(OC)n2)CC[NH2+]C1	ZINC001159453020	865308323	/nfs/dbraw/zinc/30/83/23/865308323.db2.gz	MMKJBAYTEIVSOY-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001332403319	865816682	/nfs/dbraw/zinc/81/66/82/865816682.db2.gz	PVVNHMYDBNDLAQ-HZMBPMFUSA-N	1	1	304.350	1.713	20	5		DDBDMO
Cc1nc(N[C@@H]2CCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160721466	866065719	/nfs/dbraw/zinc/06/57/19/866065719.db2.gz	YUSPWAUVMWAWBT-TZMCWYRMSA-N	1	1	306.366	1.963	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1F	ZINC001325167087	867835027	/nfs/dbraw/zinc/83/50/27/867835027.db2.gz	WBZOQVGGGQYCPN-VIFPVBQESA-N	1	1	311.313	1.519	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1F	ZINC001325167087	867835032	/nfs/dbraw/zinc/83/50/32/867835032.db2.gz	WBZOQVGGGQYCPN-VIFPVBQESA-N	1	1	311.313	1.519	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001335230801	868158130	/nfs/dbraw/zinc/15/81/30/868158130.db2.gz	REBSTVOKKFOCFN-ABAIWWIYSA-N	1	1	318.377	1.755	20	5		DDBDMO
C[N@@H+](C1CN(c2cc([N+](=O)[O-])cc(Cl)n2)C1)[C@@H]1CCOC1	ZINC001165203976	869426255	/nfs/dbraw/zinc/42/62/55/869426255.db2.gz	PEWNZTMFPYQYSC-SECBINFHSA-N	1	1	312.757	1.553	20	5		DDBDMO
COc1cc(C)nc(N2CC([N@@H+](C)[C@@H]3CCOC3)C2)c1[N+](=O)[O-]	ZINC001165205892	869430766	/nfs/dbraw/zinc/43/07/66/869430766.db2.gz	XCDCZZDVROYCDE-LLVKDONJSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNc2ncnc3[nH]cc([N+](=O)[O-])c32)C1	ZINC001165262516	869476712	/nfs/dbraw/zinc/47/67/12/869476712.db2.gz	VTDVYXVCAOTRJM-SNVBAGLBSA-N	1	1	304.354	1.962	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC001339264380	870427209	/nfs/dbraw/zinc/42/72/09/870427209.db2.gz	KWMAYMIZBVQCHB-LLVKDONJSA-N	1	1	321.333	1.538	20	5		DDBDMO
C[C@@H]1C[C@H](O)CCN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001166963206	870427651	/nfs/dbraw/zinc/42/76/51/870427651.db2.gz	GFGVMDSKULDBCJ-CBHWHFHUSA-N	1	1	306.366	1.872	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C	ZINC001339265101	870427763	/nfs/dbraw/zinc/42/77/63/870427763.db2.gz	OXYCMCCZRVYGIL-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@H](NC(=O)NCC[N@H+]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC001313286555	871785624	/nfs/dbraw/zinc/78/56/24/871785624.db2.gz	LXXSTVFRKHLJQZ-FZMZJTMJSA-N	1	1	322.365	1.022	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc3n[nH]cc3cc2[N+](=O)[O-])C1	ZINC001230601304	884641234	/nfs/dbraw/zinc/64/12/34/884641234.db2.gz	LWLPWVMEGNLOSS-LLVKDONJSA-N	1	1	306.322	1.571	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2cc3[nH]ncc3cc2[N+](=O)[O-])C1	ZINC001230601304	884641240	/nfs/dbraw/zinc/64/12/40/884641240.db2.gz	LWLPWVMEGNLOSS-LLVKDONJSA-N	1	1	306.322	1.571	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc3[nH]ncc3cc2[N+](=O)[O-])C1	ZINC001230601304	884641247	/nfs/dbraw/zinc/64/12/47/884641247.db2.gz	LWLPWVMEGNLOSS-LLVKDONJSA-N	1	1	306.322	1.571	20	5		DDBDMO
[NH3+]C1(c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)CCC(O)CC1	ZINC001248281159	893585140	/nfs/dbraw/zinc/58/51/40/893585140.db2.gz	LWYUUMVIRRBUPC-UHFFFAOYSA-N	1	1	323.284	1.268	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@@H](N3CCOCC3)C1)C2	ZINC001254601427	896524160	/nfs/dbraw/zinc/52/41/60/896524160.db2.gz	ZSBKLWOGNIYUIX-SJORKVTESA-N	1	1	317.389	1.469	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1CO	ZINC000248994365	282125227	/nfs/dbraw/zinc/12/52/27/282125227.db2.gz	XTJXPORVIIWHPV-ZLDLUXBVSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1ccc(NC(=O)NCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000272860131	210254897	/nfs/dbraw/zinc/25/48/97/210254897.db2.gz	RVXUFATZHAPYTO-UHFFFAOYSA-N	1	1	319.321	1.930	20	5		DDBDMO
CCn1nccc1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278661866	214310046	/nfs/dbraw/zinc/31/00/46/214310046.db2.gz	KTGIZNAKOHJLFS-UHFFFAOYSA-N	1	1	300.322	1.977	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000495209182	529442090	/nfs/dbraw/zinc/44/20/90/529442090.db2.gz	APFPIHFKAFOCKW-DOMZBBRYSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072387	231290973	/nfs/dbraw/zinc/29/09/73/231290973.db2.gz	WPPMAFWQJZSQIP-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072387	231290975	/nfs/dbraw/zinc/29/09/75/231290975.db2.gz	WPPMAFWQJZSQIP-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000451155094	529503703	/nfs/dbraw/zinc/50/37/03/529503703.db2.gz	ALBPEHQJIQOODX-NSHDSACASA-N	1	1	323.349	1.596	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CCCC[N@@H+]1CCO	ZINC000452390051	231375111	/nfs/dbraw/zinc/37/51/11/231375111.db2.gz	NLVLBCCDCHXJHM-CQSZACIVSA-N	1	1	321.377	1.100	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000614925180	362081895	/nfs/dbraw/zinc/08/18/95/362081895.db2.gz	VZFKFDJGOIWRFF-NSHDSACASA-N	1	1	322.287	1.835	20	5		DDBDMO
CO[C@@]1(C(F)(F)F)CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000614925180	362081898	/nfs/dbraw/zinc/08/18/98/362081898.db2.gz	VZFKFDJGOIWRFF-NSHDSACASA-N	1	1	322.287	1.835	20	5		DDBDMO
CCO[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090550317	185302275	/nfs/dbraw/zinc/30/22/75/185302275.db2.gz	SVLIWMZTHGHALV-KBPBESRZSA-N	1	1	323.393	1.892	20	5		DDBDMO
CO[C@@]1(C)C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090551327	185302962	/nfs/dbraw/zinc/30/29/62/185302962.db2.gz	FCFXUGVRJZIKLR-BBRMVZONSA-N	1	1	323.393	1.892	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCC3(C2)OCCO3)c1	ZINC000090564068	185303752	/nfs/dbraw/zinc/30/37/52/185303752.db2.gz	QXRBRMAWLGPDRJ-CQSZACIVSA-N	1	1	308.334	1.467	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCCC3(C2)OCCO3)c1	ZINC000090564068	185303753	/nfs/dbraw/zinc/30/37/53/185303753.db2.gz	QXRBRMAWLGPDRJ-CQSZACIVSA-N	1	1	308.334	1.467	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccncc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272773857	210179076	/nfs/dbraw/zinc/17/90/76/210179076.db2.gz	XYOUQOCCGWOGKU-JTQLQIEISA-N	1	1	305.338	1.762	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000458170333	530054454	/nfs/dbraw/zinc/05/44/54/530054454.db2.gz	PCCWDXMWRRDVLL-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000458219190	530054754	/nfs/dbraw/zinc/05/47/54/530054754.db2.gz	OTLWCQQERAHNFD-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3ncc([N+](=O)[O-])cc3C(N)=O)C2)C1	ZINC000292819015	530059965	/nfs/dbraw/zinc/05/99/65/530059965.db2.gz	OTCJIYDFULUHKX-OAHLLOKOSA-N	1	1	319.365	1.011	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000458176619	530060293	/nfs/dbraw/zinc/06/02/93/530060293.db2.gz	UONDAZAHOVQLQT-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330923162	232167488	/nfs/dbraw/zinc/16/74/88/232167488.db2.gz	SGBLICMNESKOFL-CHWSQXEVSA-N	1	1	320.393	1.630	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1C	ZINC000616322134	362636918	/nfs/dbraw/zinc/63/69/18/362636918.db2.gz	BVDOLXZZPMUOAH-LBPRGKRZSA-N	1	1	307.350	1.736	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000041951290	352319683	/nfs/dbraw/zinc/31/96/83/352319683.db2.gz	OZSNHBNSRHESLX-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@H](C)[N@@H+](C)C2CC2)c(C)c1[N+](=O)[O-]	ZINC000057703852	352825104	/nfs/dbraw/zinc/82/51/04/352825104.db2.gz	XYJMGRRSNZLRFR-JTQLQIEISA-N	1	1	323.397	1.397	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccncc1[N+](=O)[O-]	ZINC000066812064	353017853	/nfs/dbraw/zinc/01/78/53/353017853.db2.gz	SCNGHNNSLNDCBZ-CYBMUJFWSA-N	1	1	321.381	1.344	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000067711408	353064005	/nfs/dbraw/zinc/06/40/05/353064005.db2.gz	FAHRYWYIOOCWBP-LLVKDONJSA-N	1	1	304.350	1.603	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000073786987	353270769	/nfs/dbraw/zinc/27/07/69/353270769.db2.gz	UKLBSJLPLOQZBI-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000174105007	198292042	/nfs/dbraw/zinc/29/20/42/198292042.db2.gz	MAQIPKSCXZQCPZ-AWEZNQCLSA-N	1	1	324.377	1.959	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C1	ZINC000074326559	353307116	/nfs/dbraw/zinc/30/71/16/353307116.db2.gz	YYKDLXVOEFZACD-GFCCVEGCSA-N	1	1	307.350	1.992	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)s1	ZINC000075712776	353377520	/nfs/dbraw/zinc/37/75/20/353377520.db2.gz	UXOFPUZTJBCWPH-LBPRGKRZSA-N	1	1	310.379	1.654	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCc3sccc3C2)c1	ZINC000075718575	353378308	/nfs/dbraw/zinc/37/83/08/353378308.db2.gz	ATDQLKUIRBZFFP-CYBMUJFWSA-N	1	1	322.390	1.662	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCOC3(CCCCC3)C2)c1	ZINC000075832657	353381059	/nfs/dbraw/zinc/38/10/59/353381059.db2.gz	BCBFAKCRJOUUJT-CQSZACIVSA-N	1	1	324.381	1.187	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(NCCC[NH+]2CCOCC2)c1	ZINC000080530413	353613780	/nfs/dbraw/zinc/61/37/80/353613780.db2.gz	OGAHHXUOGCZODY-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]([C@@H](C)O)C1	ZINC000089932303	353784575	/nfs/dbraw/zinc/78/45/75/353784575.db2.gz	PFCXZYMTTOADHT-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]([C@@H](C)O)C1	ZINC000089932303	353784577	/nfs/dbraw/zinc/78/45/77/353784577.db2.gz	PFCXZYMTTOADHT-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000142137767	354143303	/nfs/dbraw/zinc/14/33/03/354143303.db2.gz	LYCKUTBKOAKPNE-CYBMUJFWSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154685910	354207430	/nfs/dbraw/zinc/20/74/30/354207430.db2.gz	HTJOYPOEBNDORL-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154685910	354207434	/nfs/dbraw/zinc/20/74/34/354207434.db2.gz	HTJOYPOEBNDORL-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@H](CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000292896207	354452603	/nfs/dbraw/zinc/45/26/03/354452603.db2.gz	ACFNPOSTOPGWTI-CYBMUJFWSA-N	1	1	321.377	1.652	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1	ZINC000402689146	354669285	/nfs/dbraw/zinc/66/92/85/354669285.db2.gz	KULYZJVUGORGST-UHFFFAOYSA-N	1	1	313.304	1.851	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCN(c3[nH]cc[nH+]3)CC2)n1	ZINC000585701844	354829360	/nfs/dbraw/zinc/82/93/60/354829360.db2.gz	LAGXOURTWFEBQP-UHFFFAOYSA-N	1	1	302.338	1.656	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](CC(N)=O)C1	ZINC000588977180	354953840	/nfs/dbraw/zinc/95/38/40/354953840.db2.gz	HCDHIOKFWJTPQJ-NSHDSACASA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000588977180	354953844	/nfs/dbraw/zinc/95/38/44/354953844.db2.gz	HCDHIOKFWJTPQJ-NSHDSACASA-N	1	1	320.349	1.039	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](CCO)C2)c1	ZINC000589499647	354996940	/nfs/dbraw/zinc/99/69/40/354996940.db2.gz	ZMKHWPTWADCKBE-LBPRGKRZSA-N	1	1	322.361	1.976	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)[C@H]2C1	ZINC000590444454	355098364	/nfs/dbraw/zinc/09/83/64/355098364.db2.gz	LZJTWHXXBUCMKJ-PELKAZGASA-N	1	1	308.313	1.092	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)[C@@H]2C1	ZINC000590445620	355098869	/nfs/dbraw/zinc/09/88/69/355098869.db2.gz	QZZRWDQHDMEHRP-JOYOIKCWSA-N	1	1	319.317	1.100	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([C@@H]3CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256114	355548483	/nfs/dbraw/zinc/54/84/83/355548483.db2.gz	ZJMFTGMECAGLEG-MNOVXSKESA-N	1	1	307.354	1.088	20	5		DDBDMO
C[NH+]1CCC2(CC1)CN(Cc1cc(O)ccc1[N+](=O)[O-])CCO2	ZINC000592184222	355527587	/nfs/dbraw/zinc/52/75/87/355527587.db2.gz	HASHIWZKPDVZEE-UHFFFAOYSA-N	1	1	321.377	1.597	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593109385	355801211	/nfs/dbraw/zinc/80/12/11/355801211.db2.gz	IWIBUZYRYAJFKV-PHIMTYICSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593499002	355904598	/nfs/dbraw/zinc/90/45/98/355904598.db2.gz	KPIBXVOZMQALDS-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594025432	356093273	/nfs/dbraw/zinc/09/32/73/356093273.db2.gz	LFSIHTKIQZFGKR-AEGPPILISA-N	1	1	305.378	1.715	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)C1CC1	ZINC000594732460	356300652	/nfs/dbraw/zinc/30/06/52/356300652.db2.gz	LDWPHHRFYIJBHA-GFCCVEGCSA-N	1	1	317.349	1.308	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N(C)CC2C[NH+](C)C2)cc1[N+](=O)[O-]	ZINC000594847194	356336093	/nfs/dbraw/zinc/33/60/93/356336093.db2.gz	OTSIMMZMFSYSQL-UHFFFAOYSA-N	1	1	313.379	1.085	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH+](C2CCOCC2)CC1	ZINC000081032557	192217899	/nfs/dbraw/zinc/21/78/99/192217899.db2.gz	RWRUBOGLHMBQEY-UHFFFAOYSA-N	1	1	309.322	1.125	20	5		DDBDMO
C[N@@H+](Cc1cnccn1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000080980427	192208132	/nfs/dbraw/zinc/20/81/32/192208132.db2.gz	KZNMTNDLJXURTH-AWEZNQCLSA-N	1	1	318.333	1.257	20	5		DDBDMO
C[N@H+](Cc1cnccn1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000080980427	192208133	/nfs/dbraw/zinc/20/81/33/192208133.db2.gz	KZNMTNDLJXURTH-AWEZNQCLSA-N	1	1	318.333	1.257	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCCNC1=O	ZINC000595005614	356371492	/nfs/dbraw/zinc/37/14/92/356371492.db2.gz	BMXKOQXGMWFYJK-MFKMUULPSA-N	1	1	307.350	1.923	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-]	ZINC000595485258	356512429	/nfs/dbraw/zinc/51/24/29/356512429.db2.gz	WWIQJBXZWJOXLD-NSHDSACASA-N	1	1	310.354	1.772	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000595447612	356496869	/nfs/dbraw/zinc/49/68/69/356496869.db2.gz	OIBVAXJFTXVUDW-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000595575692	356559159	/nfs/dbraw/zinc/55/91/59/356559159.db2.gz	WHEGWVPPAIVPTF-CQSZACIVSA-N	1	1	320.393	1.921	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H]3NC(=O)CC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000595744274	356632190	/nfs/dbraw/zinc/63/21/90/356632190.db2.gz	VHQBGQPZIFARMN-STQMWFEESA-N	1	1	319.361	1.704	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCOCC1	ZINC000595727881	356623900	/nfs/dbraw/zinc/62/39/00/356623900.db2.gz	FOSQDKMFFULPQU-UHFFFAOYSA-N	1	1	313.741	1.372	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595771470	356645740	/nfs/dbraw/zinc/64/57/40/356645740.db2.gz	PJEUYFDCULYJAL-UXIGCNINSA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](CCF)C2)c1	ZINC000595756852	356638388	/nfs/dbraw/zinc/63/83/88/356638388.db2.gz	XXSCJCMIZZNOBZ-WCQYABFASA-N	1	1	300.334	1.224	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595836583	356671333	/nfs/dbraw/zinc/67/13/33/356671333.db2.gz	WTHODXSOAQQDCG-STQMWFEESA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595836583	356671337	/nfs/dbraw/zinc/67/13/37/356671337.db2.gz	WTHODXSOAQQDCG-STQMWFEESA-N	1	1	319.361	1.810	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596141635	356788922	/nfs/dbraw/zinc/78/89/22/356788922.db2.gz	ILHHAVQUNFXOQX-LBPRGKRZSA-N	1	1	320.393	1.862	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000597669414	357276674	/nfs/dbraw/zinc/27/66/74/357276674.db2.gz	SWZDMYLSNMDUGE-CYBMUJFWSA-N	1	1	307.350	1.871	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000597669414	357276675	/nfs/dbraw/zinc/27/66/75/357276675.db2.gz	SWZDMYLSNMDUGE-CYBMUJFWSA-N	1	1	307.350	1.871	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598592794	357645584	/nfs/dbraw/zinc/64/55/84/357645584.db2.gz	NFYWTOABGQUJHH-LLVKDONJSA-N	1	1	322.365	1.919	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1nccc(C(=O)OC)c1[N+](=O)[O-]	ZINC000598592919	357645855	/nfs/dbraw/zinc/64/58/55/357645855.db2.gz	NDEAINCJYVNSOB-JTQLQIEISA-N	1	1	310.354	1.919	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@H](CO)C2)c1	ZINC000598649095	357670547	/nfs/dbraw/zinc/67/05/47/357670547.db2.gz	VLVYQGHSLOKOAF-RISCZKNCSA-N	1	1	322.361	1.832	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000599561860	357973907	/nfs/dbraw/zinc/97/39/07/357973907.db2.gz	CUBPXRDFHKVQSW-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000599561860	357973910	/nfs/dbraw/zinc/97/39/10/357973910.db2.gz	CUBPXRDFHKVQSW-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-]	ZINC000600227484	358162416	/nfs/dbraw/zinc/16/24/16/358162416.db2.gz	DBHRLEXFSZGEKG-GFCCVEGCSA-N	1	1	321.381	1.763	20	5		DDBDMO
C[N@@H+]1CCCC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000600312040	358192035	/nfs/dbraw/zinc/19/20/35/358192035.db2.gz	DNWRNFVOKCRHDD-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000600312040	358192039	/nfs/dbraw/zinc/19/20/39/358192039.db2.gz	DNWRNFVOKCRHDD-LLVKDONJSA-N	1	1	307.350	1.762	20	5		DDBDMO
O=C(NCCC[NH+]1CCOCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000600890368	358340594	/nfs/dbraw/zinc/34/05/94/358340594.db2.gz	FEVFTCHKTQZPEL-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C1CCCN1CCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601099063	358401731	/nfs/dbraw/zinc/40/17/31/358401731.db2.gz	QQLBHQJASKGRHM-UHFFFAOYSA-N	1	1	314.345	1.989	20	5		DDBDMO
O=C1C[C@]2(CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)CN1	ZINC000601155807	358424523	/nfs/dbraw/zinc/42/45/23/358424523.db2.gz	GPWXLBPOHRCSTP-MRXNPFEDSA-N	1	1	312.329	1.859	20	5		DDBDMO
CO[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@H]1OC	ZINC000601156391	358425821	/nfs/dbraw/zinc/42/58/21/358425821.db2.gz	VZAYCADTYAAPDD-GASCZTMLSA-N	1	1	303.318	1.993	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@@H](CO)C3CCOCC3)c2c1	ZINC000601158688	358427068	/nfs/dbraw/zinc/42/70/68/358427068.db2.gz	AUHZAMZIQLKVJI-INIZCTEOSA-N	1	1	317.345	1.764	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000601162694	358428046	/nfs/dbraw/zinc/42/80/46/358428046.db2.gz	UDRHXBXEAVZRHX-LBPRGKRZSA-N	1	1	324.356	1.678	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601971495	358759614	/nfs/dbraw/zinc/75/96/14/358759614.db2.gz	CRVRUBOAJZECRE-BETUJISGSA-N	1	1	319.361	1.810	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602662263	359109533	/nfs/dbraw/zinc/10/95/33/359109533.db2.gz	NKACZYITYMIHOT-LBPRGKRZSA-N	1	1	309.370	1.067	20	5		DDBDMO
CO[C@@]1(C[NH+]2CC(Oc3ccc([N+](=O)[O-])cc3)C2)CCOC1	ZINC000602689585	359127071	/nfs/dbraw/zinc/12/70/71/359127071.db2.gz	XXRSPIKHGQWYBM-OAHLLOKOSA-N	1	1	308.334	1.463	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3csc([N+](=O)[O-])c3)C[C@@]1(C)C(=O)NC2=O	ZINC000602733715	359155448	/nfs/dbraw/zinc/15/54/48/359155448.db2.gz	YJQCFZDDWMOBKZ-BETUJISGSA-N	1	1	309.347	1.141	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@H]1CC1CCC1	ZINC000602830977	359223911	/nfs/dbraw/zinc/22/39/11/359223911.db2.gz	DNDYQFLUYXYZME-CQSZACIVSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@H]1CC1CCC1	ZINC000602830977	359223915	/nfs/dbraw/zinc/22/39/15/359223915.db2.gz	DNDYQFLUYXYZME-CQSZACIVSA-N	1	1	308.382	1.991	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C[C@H]1C	ZINC000602952564	359318554	/nfs/dbraw/zinc/31/85/54/359318554.db2.gz	NPJYSFWTXFODPX-NEPJUHHUSA-N	1	1	321.381	1.667	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2C[C@@]2(O)C1	ZINC000603089674	359395869	/nfs/dbraw/zinc/39/58/69/359395869.db2.gz	SGNPGQZTCDIGCQ-IAQYHMDHSA-N	1	1	305.334	1.298	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000186787274	200010173	/nfs/dbraw/zinc/01/01/73/200010173.db2.gz	RYCHDWKQRXKZHQ-RISCZKNCSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1O	ZINC000186912455	200030504	/nfs/dbraw/zinc/03/05/04/200030504.db2.gz	AXUIWIAXEJUMSC-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[C@@H]1O	ZINC000186912455	200030506	/nfs/dbraw/zinc/03/05/06/200030506.db2.gz	AXUIWIAXEJUMSC-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000186939506	200034239	/nfs/dbraw/zinc/03/42/39/200034239.db2.gz	HGYMJYAGONHQEE-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC000603403711	359619247	/nfs/dbraw/zinc/61/92/47/359619247.db2.gz	UHKRMGQBMLCXBK-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
CC1(C)[C@@H](Nc2ccc([N+](=O)[O-])nc2)C[C@@H]1[NH+]1CCOCC1	ZINC000603407692	359621208	/nfs/dbraw/zinc/62/12/08/359621208.db2.gz	SPOXAQZFCVGVCK-STQMWFEESA-N	1	1	306.366	1.901	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000281062392	216054669	/nfs/dbraw/zinc/05/46/69/216054669.db2.gz	KDJQBMTXJZSTDR-HNNXBMFYSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[NH+]1CCC(N2CCC(Nc3cccnc3[N+](=O)[O-])CC2)CC1	ZINC000604520404	359760198	/nfs/dbraw/zinc/76/01/98/359760198.db2.gz	XSIQTMXWBCKXTI-UHFFFAOYSA-N	1	1	319.409	1.960	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609383035	360303548	/nfs/dbraw/zinc/30/35/48/360303548.db2.gz	IKNJFHXSHAPXKU-LBPRGKRZSA-N	1	1	319.361	1.818	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@@H]1C	ZINC000611515354	360743320	/nfs/dbraw/zinc/74/33/20/360743320.db2.gz	ORPTWDJLKVCEOV-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@@H]1C	ZINC000611515354	360743323	/nfs/dbraw/zinc/74/33/23/360743323.db2.gz	ORPTWDJLKVCEOV-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000618898195	363787490	/nfs/dbraw/zinc/78/74/90/363787490.db2.gz	ZYFLWGBOGOPOMC-IAQYHMDHSA-N	1	1	320.393	1.590	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000194033307	201166811	/nfs/dbraw/zinc/16/68/11/201166811.db2.gz	MWAARNMVPSRLOB-AWEZNQCLSA-N	1	1	323.305	1.888	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000194033307	201166815	/nfs/dbraw/zinc/16/68/15/201166815.db2.gz	MWAARNMVPSRLOB-AWEZNQCLSA-N	1	1	323.305	1.888	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000275353033	212285652	/nfs/dbraw/zinc/28/56/52/212285652.db2.gz	KDNZTUBVVMWABI-NXEZZACHSA-N	1	1	315.320	1.764	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@H](C)C1	ZINC000275353033	212285655	/nfs/dbraw/zinc/28/56/55/212285655.db2.gz	KDNZTUBVVMWABI-NXEZZACHSA-N	1	1	315.320	1.764	20	5		DDBDMO
Nc1ccc(N2CCN(c3ccc([N+](=O)[O-])cn3)CC2)c[nH+]1	ZINC000264656566	204057830	/nfs/dbraw/zinc/05/78/30/204057830.db2.gz	PYCYIZDQCJJVMG-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000264954367	204300904	/nfs/dbraw/zinc/30/09/04/204300904.db2.gz	VCLHFWKWQWDHLX-NSHDSACASA-N	1	1	323.397	1.875	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H](O)Cn1cccn1	ZINC000282557771	217086843	/nfs/dbraw/zinc/08/68/43/217086843.db2.gz	YACNZTLJNMTOCI-HNNXBMFYSA-N	1	1	304.350	1.327	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000266185633	205167961	/nfs/dbraw/zinc/16/79/61/205167961.db2.gz	CWNDUMWKTNONQB-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)c1	ZINC000266185633	205167966	/nfs/dbraw/zinc/16/79/66/205167966.db2.gz	CWNDUMWKTNONQB-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1[C@@H]1CCCO1	ZINC000284669826	218125266	/nfs/dbraw/zinc/12/52/66/218125266.db2.gz	GUTZNXJURBHRSG-KBPBESRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000106786758	194251509	/nfs/dbraw/zinc/25/15/09/194251509.db2.gz	JXKQSIOHIHFUAJ-NSHDSACASA-N	1	1	321.381	1.383	20	5		DDBDMO
C[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@@H+](C)C1CC1	ZINC000057706794	184048348	/nfs/dbraw/zinc/04/83/48/184048348.db2.gz	AECBYLULQWFWTM-MRVPVSSYSA-N	1	1	310.329	1.529	20	5		DDBDMO
CC[N@H+](CCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000119921583	195062329	/nfs/dbraw/zinc/06/23/29/195062329.db2.gz	RLXQKIRVDXXKGI-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
CC[N@@H+](CCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000119921583	195062332	/nfs/dbraw/zinc/06/23/32/195062332.db2.gz	RLXQKIRVDXXKGI-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
C[C@@H](NC(=O)Cc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1	ZINC000273000412	210379261	/nfs/dbraw/zinc/37/92/61/210379261.db2.gz	REUVRNAYUIJANC-GFCCVEGCSA-N	1	1	303.362	1.904	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC000352590970	285161683	/nfs/dbraw/zinc/16/16/83/285161683.db2.gz	PPLSADPEGVGDJS-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1CO	ZINC000298134939	533138194	/nfs/dbraw/zinc/13/81/94/533138194.db2.gz	NVABQJQNCSTDFI-GFCCVEGCSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@H](C)O	ZINC000156302729	197102867	/nfs/dbraw/zinc/10/28/67/197102867.db2.gz	QCNAANTULNRZHO-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000569353121	304349775	/nfs/dbraw/zinc/34/97/75/304349775.db2.gz	MAZNVGUQHXQKDW-UHFFFAOYSA-N	1	1	319.296	1.419	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2[C@H]2CCCOC2)c1	ZINC000569453294	304355196	/nfs/dbraw/zinc/35/51/96/304355196.db2.gz	UVMIDDYHOWZRER-NWANDNLSSA-N	1	1	324.381	1.043	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)c1	ZINC000266326250	286382754	/nfs/dbraw/zinc/38/27/54/286382754.db2.gz	GGUIRBWWCXXQEK-NEPJUHHUSA-N	1	1	309.366	1.495	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000054776291	407188524	/nfs/dbraw/zinc/18/85/24/407188524.db2.gz	ADDNRASNAMJVOX-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000106865786	407363753	/nfs/dbraw/zinc/36/37/53/407363753.db2.gz	GPYKWJJWLXWZFD-NOLJZWGESA-N	1	1	324.377	1.570	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000107894251	407381294	/nfs/dbraw/zinc/38/12/94/407381294.db2.gz	BDRMFZCXPUSGFH-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000271010971	407466575	/nfs/dbraw/zinc/46/65/75/407466575.db2.gz	ZSXFOQLZQMCTIK-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000112924241	407447016	/nfs/dbraw/zinc/44/70/16/407447016.db2.gz	SJUBYGVDMPESJT-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H]1CO)Nc1cc([N+](=O)[O-])ccc1F	ZINC000128372649	407529217	/nfs/dbraw/zinc/52/92/17/407529217.db2.gz	FPJCAMSMRUYDNP-LLVKDONJSA-N	1	1	311.313	1.519	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@H]1CCc2ccccc21	ZINC000266419205	407537768	/nfs/dbraw/zinc/53/77/68/407537768.db2.gz	IKDZKBBSJWMWAF-HOCLYGCPSA-N	1	1	316.361	1.772	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000266953172	407690608	/nfs/dbraw/zinc/69/06/08/407690608.db2.gz	UXZBTVJOFDYGOH-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000130476153	407692633	/nfs/dbraw/zinc/69/26/33/407692633.db2.gz	GBZRXHIMMBEIFF-UHFFFAOYSA-N	1	1	317.349	1.892	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000131985960	407765353	/nfs/dbraw/zinc/76/53/53/407765353.db2.gz	DWCSYAKUUCNZGZ-PHIMTYICSA-N	1	1	311.386	1.182	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000131985960	407765359	/nfs/dbraw/zinc/76/53/59/407765359.db2.gz	DWCSYAKUUCNZGZ-PHIMTYICSA-N	1	1	311.386	1.182	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCCNC1=O	ZINC000153985493	407946349	/nfs/dbraw/zinc/94/63/49/407946349.db2.gz	INPQNSPQKYHIRA-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCCCNC1=O	ZINC000153985493	407946355	/nfs/dbraw/zinc/94/63/55/407946355.db2.gz	INPQNSPQKYHIRA-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
CCCCC[N@@H+](CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000118825508	407949860	/nfs/dbraw/zinc/94/98/60/407949860.db2.gz	PIAKUGUMXMEUTN-UHFFFAOYSA-N	1	1	309.366	1.678	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154015022	407952094	/nfs/dbraw/zinc/95/20/94/407952094.db2.gz	LSQNYWKGZOECNO-GUTXKFCHSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1OC[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000154015022	407952100	/nfs/dbraw/zinc/95/21/00/407952100.db2.gz	LSQNYWKGZOECNO-GUTXKFCHSA-N	1	1	324.377	1.752	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)c1	ZINC000268213360	407952332	/nfs/dbraw/zinc/95/23/32/407952332.db2.gz	AZOSRUCRJISFRS-TZMCWYRMSA-N	1	1	320.349	1.972	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000119012320	407975862	/nfs/dbraw/zinc/97/58/62/407975862.db2.gz	DQOZWHKLPQQVJN-UHFFFAOYSA-N	1	1	308.382	1.777	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000272439934	407923254	/nfs/dbraw/zinc/92/32/54/407923254.db2.gz	MIVJWKNXQIGBEQ-UHFFFAOYSA-N	1	1	303.322	1.502	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCC[N@H+]1CCCOCC1	ZINC000189448138	408022225	/nfs/dbraw/zinc/02/22/25/408022225.db2.gz	DBEMQWBPMZFMFN-QPJJXVBHSA-N	1	1	319.361	1.447	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190093415	408161812	/nfs/dbraw/zinc/16/18/12/408161812.db2.gz	CZQCZPOLZLBHOQ-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190093415	408161816	/nfs/dbraw/zinc/16/18/16/408161816.db2.gz	CZQCZPOLZLBHOQ-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]2CCCC[C@H]12	ZINC000182472362	408172050	/nfs/dbraw/zinc/17/20/50/408172050.db2.gz	AIGNUCMCBSSGLY-BEAPCOKYSA-N	1	1	308.382	1.663	20	5		DDBDMO
C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C[NH+]1CCOCC1	ZINC000121392909	408200486	/nfs/dbraw/zinc/20/04/86/408200486.db2.gz	GUMOVMNPIGCTLS-GFCCVEGCSA-N	1	1	322.365	1.685	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000246819003	408348450	/nfs/dbraw/zinc/34/84/50/408348450.db2.gz	SIZUWVKBBFPGAA-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccccc1	ZINC000158946487	408371425	/nfs/dbraw/zinc/37/14/25/408371425.db2.gz	VFXVVWUATPWWTL-LBPRGKRZSA-N	1	1	317.349	1.221	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000173118761	162322581	/nfs/dbraw/zinc/32/25/81/162322581.db2.gz	VZKKAUQMUWBCIL-OAHLLOKOSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[N@H+](CCN1CCOCC1)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000177070649	408511861	/nfs/dbraw/zinc/51/18/61/408511861.db2.gz	KZQPOSDZACOOMK-UHFFFAOYSA-N	1	1	320.349	1.500	20	5		DDBDMO
C[N@@H+](CCN1CCOCC1)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000177070649	408511866	/nfs/dbraw/zinc/51/18/66/408511866.db2.gz	KZQPOSDZACOOMK-UHFFFAOYSA-N	1	1	320.349	1.500	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CC[N@H+]2CCC[C@H]2C1	ZINC000248374873	408552939	/nfs/dbraw/zinc/55/29/39/408552939.db2.gz	USQXRHZWBVNUCK-UONOGXRCSA-N	1	1	321.377	1.115	20	5		DDBDMO
CCc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000192497206	408599692	/nfs/dbraw/zinc/59/96/92/408599692.db2.gz	NVQNTFUCDVWALF-OKILXGFUSA-N	1	1	303.362	1.791	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCCNc2ccc(C)c[nH+]2)c1[N+](=O)[O-]	ZINC000265493387	408671586	/nfs/dbraw/zinc/67/15/86/408671586.db2.gz	BQBVBTKPGFHGRH-UHFFFAOYSA-N	1	1	318.337	1.562	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3c(Cl)cccc3[N+](=O)[O-])C[C@H]2C1	ZINC000192538787	408607607	/nfs/dbraw/zinc/60/76/07/408607607.db2.gz	XGTCFEKGEWGOHZ-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249558774	408744002	/nfs/dbraw/zinc/74/40/02/408744002.db2.gz	KVSLQAPEGLWDSI-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000249558774	408744007	/nfs/dbraw/zinc/74/40/07/408744007.db2.gz	KVSLQAPEGLWDSI-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000185238064	408785132	/nfs/dbraw/zinc/78/51/32/408785132.db2.gz	VSWROTAXWRPQDR-UHFFFAOYSA-N	1	1	313.379	1.310	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@@H]1CCO	ZINC000194363763	408778949	/nfs/dbraw/zinc/77/89/49/408778949.db2.gz	RRXQJFBHQZREMB-KGLIPLIRSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000251477741	408781253	/nfs/dbraw/zinc/78/12/53/408781253.db2.gz	CTDNJNKHJHUNAT-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000251477741	408781257	/nfs/dbraw/zinc/78/12/57/408781257.db2.gz	CTDNJNKHJHUNAT-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
Cc1nc(N2C[C@@H]([NH+]3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000286175884	408936672	/nfs/dbraw/zinc/93/66/72/408936672.db2.gz	ADLRXUBZKVNDQH-YPMHNXCESA-N	1	1	306.366	1.598	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2NC[C@H]2C[NH+]3CCN2CC3)s1	ZINC000286216571	408943854	/nfs/dbraw/zinc/94/38/54/408943854.db2.gz	NFPTWEJHKMKSQH-VIFPVBQESA-N	1	1	320.378	1.011	20	5		DDBDMO
COc1cc(N2C[C@H]([NH+]3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000286288197	408957244	/nfs/dbraw/zinc/95/72/44/408957244.db2.gz	INMOJJBZXSBDOX-GXTWGEPZSA-N	1	1	321.377	1.903	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]2CO)cn1	ZINC000277860936	409025467	/nfs/dbraw/zinc/02/54/67/409025467.db2.gz	UEIBAXCCOCEKLX-GJZGRUSLSA-N	1	1	316.361	1.536	20	5		DDBDMO
CC1(C)COCC[N@@H+]1CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278403342	409080284	/nfs/dbraw/zinc/08/02/84/409080284.db2.gz	GXRAGBUDPUEECT-UHFFFAOYSA-N	1	1	319.365	1.994	20	5		DDBDMO
CC1(C)COCC[N@H+]1CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278403342	409080286	/nfs/dbraw/zinc/08/02/86/409080286.db2.gz	GXRAGBUDPUEECT-UHFFFAOYSA-N	1	1	319.365	1.994	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@]3(CC[N@H+](C)C3)C2)c(N)c([N+](=O)[O-])c1	ZINC000293592312	409144102	/nfs/dbraw/zinc/14/41/02/409144102.db2.gz	BETPJGDQDAICFN-INIZCTEOSA-N	1	1	318.377	1.653	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C2)C1	ZINC000293658820	409156225	/nfs/dbraw/zinc/15/62/25/409156225.db2.gz	HQKKBJHMAXEYDE-OAHLLOKOSA-N	1	1	304.350	1.345	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000280497851	409328942	/nfs/dbraw/zinc/32/89/42/409328942.db2.gz	BAQXHSBFIMSXJI-HNNXBMFYSA-N	1	1	307.350	1.432	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000295626689	409357267	/nfs/dbraw/zinc/35/72/67/409357267.db2.gz	FNDFZSDHFYNVLT-NSHDSACASA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000295626689	409357270	/nfs/dbraw/zinc/35/72/70/409357270.db2.gz	FNDFZSDHFYNVLT-NSHDSACASA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC(C)(C)CO	ZINC000295293469	409415901	/nfs/dbraw/zinc/41/59/01/409415901.db2.gz	UJFAOYZZPYKVTK-NSHDSACASA-N	1	1	309.366	1.872	20	5		DDBDMO
COc1ccc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000295323746	409434934	/nfs/dbraw/zinc/43/49/34/409434934.db2.gz	XAUPUVOBVRTMMU-AWEZNQCLSA-N	1	1	311.313	1.377	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCCC[NH+]2CCOCC2)c1	ZINC000322260397	164045833	/nfs/dbraw/zinc/04/58/33/164045833.db2.gz	GXRSQZKKJLMHNF-UHFFFAOYSA-N	1	1	323.349	1.516	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000354371978	409802688	/nfs/dbraw/zinc/80/26/88/409802688.db2.gz	LCBIOUGEKGJWLR-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357534209	410088468	/nfs/dbraw/zinc/08/84/68/410088468.db2.gz	QSAFVXGTPYHUAP-VHSXEESVSA-N	1	1	304.350	1.731	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000351822067	410263607	/nfs/dbraw/zinc/26/36/07/410263607.db2.gz	VIVZJHOXUKJORL-JTQLQIEISA-N	1	1	315.320	1.371	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](O)[C@@H](C)C1	ZINC000351776426	410224237	/nfs/dbraw/zinc/22/42/37/410224237.db2.gz	BAXXJDIMACJHPG-GWCFXTLKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[N@@H+](C)CC1	ZINC000298654287	410330480	/nfs/dbraw/zinc/33/04/80/410330480.db2.gz	FRFWSRYFYGJODF-UHFFFAOYSA-N	1	1	322.365	1.179	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343464887	410474806	/nfs/dbraw/zinc/47/48/06/410474806.db2.gz	YVUPJVFNUCZCRI-NEPJUHHUSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@@]12CCC[N@H+]1C[C@H](c1noc(-c3ccc([N+](=O)[O-])[nH]3)n1)OC2	ZINC000347343744	410484334	/nfs/dbraw/zinc/48/43/34/410484334.db2.gz	SSYNBEYMYRCTFS-YGRLFVJLSA-N	1	1	319.321	1.899	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343612232	410570351	/nfs/dbraw/zinc/57/03/51/410570351.db2.gz	VNXXGSLPKKRKBI-SMDDNHRTSA-N	1	1	306.366	1.877	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSC1	ZINC000339974930	410589976	/nfs/dbraw/zinc/58/99/76/410589976.db2.gz	FETCZKXPOUJPCO-CYBMUJFWSA-N	1	1	309.391	1.648	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2C[NH2+]C[C@H]2C1	ZINC000359308991	410596930	/nfs/dbraw/zinc/59/69/30/410596930.db2.gz	OSVPQFNWOGKSNK-BETUJISGSA-N	1	1	318.377	1.383	20	5		DDBDMO
CC[N@@H+](CCCO)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000343689499	410623278	/nfs/dbraw/zinc/62/32/78/410623278.db2.gz	QASGIZVWILSDKE-AWEZNQCLSA-N	1	1	307.350	1.404	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1	ZINC000301075482	410649723	/nfs/dbraw/zinc/64/97/23/410649723.db2.gz	BLLYGSMMXQVQSX-JTQLQIEISA-N	1	1	320.349	1.679	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@H](C(C)C)N1CC[NH+](C)CC1	ZINC000301087135	410652549	/nfs/dbraw/zinc/65/25/49/410652549.db2.gz	FGKXYKZPYIVPPS-OAHLLOKOSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ncccc3[N+](=O)[O-])CC2)CCO1	ZINC000301117292	410658283	/nfs/dbraw/zinc/65/82/83/410658283.db2.gz	WWHHFCPAILHPDO-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
CCC(=O)c1ccc(NC[C@]2(O)CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000359564391	410733405	/nfs/dbraw/zinc/73/34/05/410733405.db2.gz	KWNWROSKKMKORO-OAHLLOKOSA-N	1	1	307.350	1.666	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H]2c2ccccc2)c1	ZINC000353046451	410755592	/nfs/dbraw/zinc/75/55/92/410755592.db2.gz	AROHVGADWQJTLB-LSDHHAIUSA-N	1	1	302.334	1.599	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NCCC[N@@H+](C)C1CCCCC1	ZINC000356165999	410873911	/nfs/dbraw/zinc/87/39/11/410873911.db2.gz	JUQMZPVLIDEFJC-UHFFFAOYSA-N	1	1	323.397	1.713	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000341165065	410909197	/nfs/dbraw/zinc/90/91/97/410909197.db2.gz	JKIFTSWBIGPKFM-GFCCVEGCSA-N	1	1	321.381	1.717	20	5		DDBDMO
CC(=O)N[C@H](C)C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000331137274	410972538	/nfs/dbraw/zinc/97/25/38/410972538.db2.gz	SFXPZNAGUUNRKZ-SNVBAGLBSA-N	1	1	309.370	1.065	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331189893	411007341	/nfs/dbraw/zinc/00/73/41/411007341.db2.gz	ZTTJHIQPUJUPRU-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331189893	411007358	/nfs/dbraw/zinc/00/73/58/411007358.db2.gz	ZTTJHIQPUJUPRU-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331189893	411007365	/nfs/dbraw/zinc/00/73/65/411007365.db2.gz	ZTTJHIQPUJUPRU-NSHDSACASA-N	1	1	323.397	1.854	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CC[C@H](CO)C1	ZINC000348568599	411021149	/nfs/dbraw/zinc/02/11/49/411021149.db2.gz	CDHHQECVRZDVKG-NSHDSACASA-N	1	1	321.333	1.207	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000360256301	411114225	/nfs/dbraw/zinc/11/42/25/411114225.db2.gz	FKMBFQJJFSNNOS-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000360256301	411114231	/nfs/dbraw/zinc/11/42/31/411114231.db2.gz	FKMBFQJJFSNNOS-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000417223377	225251352	/nfs/dbraw/zinc/25/13/52/225251352.db2.gz	GNAKEGACOAVSOW-HNNXBMFYSA-N	1	1	324.356	1.480	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2C(=O)NC(=O)[C@H]2C1	ZINC000366332972	418458714	/nfs/dbraw/zinc/45/87/14/418458714.db2.gz	PNBADEOIFUWTCF-JLLWLGSASA-N	1	1	303.318	1.250	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000366907716	418534701	/nfs/dbraw/zinc/53/47/01/418534701.db2.gz	BEPIGPRCFAWMFM-LBPRGKRZSA-N	1	1	311.357	1.622	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCC[NH+]1CCN(C)CC1	ZINC000360892227	418541920	/nfs/dbraw/zinc/54/19/20/418541920.db2.gz	BOSQOBWGXSKDNR-UHFFFAOYSA-N	1	1	310.402	1.169	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000189383695	222043723	/nfs/dbraw/zinc/04/37/23/222043723.db2.gz	CQDLYYBIXDRMAC-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000189383695	222043727	/nfs/dbraw/zinc/04/37/27/222043727.db2.gz	CQDLYYBIXDRMAC-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000195442160	222201966	/nfs/dbraw/zinc/20/19/66/222201966.db2.gz	SWXNBUFDDUAHGZ-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000291190120	222208353	/nfs/dbraw/zinc/20/83/53/222208353.db2.gz	SRLAKKSUEBRMHP-JTQLQIEISA-N	1	1	309.370	1.621	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)N[C@@H]1CCC[NH2+]CC1	ZINC000375621053	418663323	/nfs/dbraw/zinc/66/33/23/418663323.db2.gz	NYLVHJSBMHCKPI-SECBINFHSA-N	1	1	317.342	1.154	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000361630094	418693891	/nfs/dbraw/zinc/69/38/91/418693891.db2.gz	SILWVMMRZGCPMN-NEPJUHHUSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681241	418893408	/nfs/dbraw/zinc/89/34/08/418893408.db2.gz	VYPRJWANGMBASF-JSGCOSHPSA-N	1	1	321.337	1.286	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681241	418893411	/nfs/dbraw/zinc/89/34/11/418893411.db2.gz	VYPRJWANGMBASF-JSGCOSHPSA-N	1	1	321.337	1.286	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@H]2C[N@@H+](C3CC3)CCO2)c2nonc21	ZINC000365162520	418841434	/nfs/dbraw/zinc/84/14/34/418841434.db2.gz	BEEXRYWHUIQHDL-SNVBAGLBSA-N	1	1	319.321	1.406	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@H]2C[N@H+](C3CC3)CCO2)c2nonc21	ZINC000365162520	418841437	/nfs/dbraw/zinc/84/14/37/418841437.db2.gz	BEEXRYWHUIQHDL-SNVBAGLBSA-N	1	1	319.321	1.406	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000420929416	419362295	/nfs/dbraw/zinc/36/22/95/419362295.db2.gz	BJNRJJAFFNBGPT-HZSPNIEDSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000421002937	419442680	/nfs/dbraw/zinc/44/26/80/419442680.db2.gz	BYHULHAPJANSOQ-MRVWCRGKSA-N	1	1	310.350	1.180	20	5		DDBDMO
COC(=O)[C@H]1CN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411910613	419469132	/nfs/dbraw/zinc/46/91/32/419469132.db2.gz	SLBXIWUVPZYWHL-GXTWGEPZSA-N	1	1	321.377	1.692	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CO)[C@H]1C	ZINC000412063463	419611630	/nfs/dbraw/zinc/61/16/30/419611630.db2.gz	BBSACGKTVXDMOM-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CO)[C@H]1C	ZINC000412063463	419611636	/nfs/dbraw/zinc/61/16/36/419611636.db2.gz	BBSACGKTVXDMOM-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299529278	229184571	/nfs/dbraw/zinc/18/45/71/229184571.db2.gz	LJMHPMTVSDYRGR-VHSXEESVSA-N	1	1	309.370	1.477	20	5		DDBDMO
CCNC(=O)NC(=O)[C@H](C)[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000429254485	419993354	/nfs/dbraw/zinc/99/33/54/419993354.db2.gz	FRVSMAHHPJVMSF-JTQLQIEISA-N	1	1	322.365	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CNCCO2)o1	ZINC000415095186	419939040	/nfs/dbraw/zinc/93/90/40/419939040.db2.gz	LRVNQKZYXDLGFH-ZDUSSCGKSA-N	1	1	317.345	1.933	20	5		DDBDMO
CC[C@@H]([NH2+]CCC(=O)N1CCNCC1)c1cccc([N+](=O)[O-])c1	ZINC000420393954	420258545	/nfs/dbraw/zinc/25/85/45/420258545.db2.gz	CFCOYKMFYXEVST-OAHLLOKOSA-N	1	1	320.393	1.457	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000420804828	420398133	/nfs/dbraw/zinc/39/81/33/420398133.db2.gz	ACLCDAYYTZZNJT-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CCO)C1CCC1	ZINC000439273819	420505227	/nfs/dbraw/zinc/50/52/27/420505227.db2.gz	MVAMDVSXEQJXGL-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CCO)C1CCC1	ZINC000439273819	420505229	/nfs/dbraw/zinc/50/52/29/420505229.db2.gz	MVAMDVSXEQJXGL-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1	ZINC000492384912	420540808	/nfs/dbraw/zinc/54/08/08/420540808.db2.gz	HBKMBITUWLKJSG-AATRIKPKSA-N	1	1	301.346	1.986	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1c1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450959209	420571470	/nfs/dbraw/zinc/57/14/70/420571470.db2.gz	XTZNQWDTXQNFGK-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1nc2ccccc2cc1[N+](=O)[O-]	ZINC000450959209	420571474	/nfs/dbraw/zinc/57/14/74/420571474.db2.gz	XTZNQWDTXQNFGK-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000452985396	420695258	/nfs/dbraw/zinc/69/52/58/420695258.db2.gz	HUKKOUKKBIKCMM-GXFFZTMASA-N	1	1	305.334	1.380	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](CC[NH3+])C1	ZINC000443065776	420742042	/nfs/dbraw/zinc/74/20/42/420742042.db2.gz	CRPMLZFNSRDGPR-OLZOCXBDSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC[NH3+])C1	ZINC000443078021	420743309	/nfs/dbraw/zinc/74/33/09/420743309.db2.gz	VVVDAVACYRRMRL-OLZOCXBDSA-N	1	1	320.393	1.983	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](O)[C@H](CO)C1	ZINC000459682945	420844661	/nfs/dbraw/zinc/84/46/61/420844661.db2.gz	FJPRSIVYNTUKFQ-GXTWGEPZSA-N	1	1	310.350	1.167	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](O)[C@H](CO)C1	ZINC000459682945	420844668	/nfs/dbraw/zinc/84/46/68/420844668.db2.gz	FJPRSIVYNTUKFQ-GXTWGEPZSA-N	1	1	310.350	1.167	20	5		DDBDMO
Cc1nc(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000447604755	420785364	/nfs/dbraw/zinc/78/53/64/420785364.db2.gz	CTRCRBOHDFFANU-NEPJUHHUSA-N	1	1	319.369	1.534	20	5		DDBDMO
Cc1nnc(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)[nH]1	ZINC000447604755	420785367	/nfs/dbraw/zinc/78/53/67/420785367.db2.gz	CTRCRBOHDFFANU-NEPJUHHUSA-N	1	1	319.369	1.534	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000487494258	421031750	/nfs/dbraw/zinc/03/17/50/421031750.db2.gz	DDJFZZMCEULKSW-GXSJLCMTSA-N	1	1	317.349	1.285	20	5		DDBDMO
CCOc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000456173580	421113498	/nfs/dbraw/zinc/11/34/98/421113498.db2.gz	ULUQZDFVRBNBFH-GXTWGEPZSA-N	1	1	319.361	1.770	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1OC	ZINC000488018707	421063353	/nfs/dbraw/zinc/06/33/53/421063353.db2.gz	UHGOGQASTJXRFN-OKILXGFUSA-N	1	1	323.349	1.269	20	5		DDBDMO
Cc1nc(N2CCC(Cc3[nH+]ccn3C)CC2)ncc1[N+](=O)[O-]	ZINC000450321848	421182376	/nfs/dbraw/zinc/18/23/76/421182376.db2.gz	VGSXOPCGCHGMAP-UHFFFAOYSA-N	1	1	316.365	1.886	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NC[C@H]1CCC[N@@H+]1CCCO)CCN2	ZINC000450591776	421214399	/nfs/dbraw/zinc/21/43/99/421214399.db2.gz	GKZLZZNYXYFARS-GFCCVEGCSA-N	1	1	320.393	1.822	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000562393869	421361773	/nfs/dbraw/zinc/36/17/73/421361773.db2.gz	ZOGVRMRSAAEJKA-ZDUSSCGKSA-N	1	1	323.393	1.783	20	5		DDBDMO
CCOC(=O)C[N@H+](CC)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000548783683	421473060	/nfs/dbraw/zinc/47/30/60/421473060.db2.gz	DZCZFLLGLWCJQU-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
CCOC(=O)C[N@@H+](CC)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000548783683	421473064	/nfs/dbraw/zinc/47/30/64/421473064.db2.gz	DZCZFLLGLWCJQU-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000515310698	421491279	/nfs/dbraw/zinc/49/12/79/421491279.db2.gz	YJCRQJQQVAEOII-PHIMTYICSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000553556998	421620098	/nfs/dbraw/zinc/62/00/98/421620098.db2.gz	QQTHRDVLZRLAFE-GFCCVEGCSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H](C)C1	ZINC000554128842	421633262	/nfs/dbraw/zinc/63/32/62/421633262.db2.gz	SWZXXCGQGZBWGH-SGMGOOAPSA-N	1	1	320.393	1.736	20	5		DDBDMO
C[C@@H](C(=O)N1CC[NH+](C[C@H](C)O)CC1)c1cccc([N+](=O)[O-])c1	ZINC000559390348	421834371	/nfs/dbraw/zinc/83/43/71/421834371.db2.gz	SLCXCTWOLYOSIY-QWHCGFSZSA-N	1	1	321.377	1.223	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000543580428	421838938	/nfs/dbraw/zinc/83/89/38/421838938.db2.gz	BLQOTUPONTYYMR-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000332253289	271033556	/nfs/dbraw/zinc/03/35/56/271033556.db2.gz	MJJUUVWLZXSUKG-KBPBESRZSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H](Cc1[nH]cc[nH+]1)OCc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000344628896	272073823	/nfs/dbraw/zinc/07/38/23/272073823.db2.gz	FNBMILJPOFSADT-SECBINFHSA-N	1	1	304.306	1.565	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+](C2CCC2)C1	ZINC000344779120	272116154	/nfs/dbraw/zinc/11/61/54/272116154.db2.gz	UBHLKWZQEUIXSO-LBPRGKRZSA-N	1	1	320.393	1.880	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)[NH+]1CCOCC1	ZINC000278376200	274264866	/nfs/dbraw/zinc/26/48/66/274264866.db2.gz	DTEKGMJHBFBTON-MNOVXSKESA-N	1	1	319.365	1.992	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](CCO)CC2)c(C(F)(F)F)c1	ZINC000413024693	275041066	/nfs/dbraw/zinc/04/10/66/275041066.db2.gz	NRSLGPORRKOFCC-UHFFFAOYSA-N	1	1	320.271	1.123	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N1CCC[C@H](c2[nH]cc[nH+]2)C1	ZINC000420586176	295189711	/nfs/dbraw/zinc/18/97/11/295189711.db2.gz	OPCUEQXDUGEUTL-JTQLQIEISA-N	1	1	315.333	1.801	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)c1	ZINC000353991329	298331705	/nfs/dbraw/zinc/33/17/05/298331705.db2.gz	AVOPKSMFDRAQBV-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000362762442	300133870	/nfs/dbraw/zinc/13/38/70/300133870.db2.gz	JARWMHHVLVEUCH-VIFPVBQESA-N	1	1	313.304	1.626	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC000363104346	300211980	/nfs/dbraw/zinc/21/19/80/300211980.db2.gz	OHGOWMDTQZUFLJ-ZDUSSCGKSA-N	1	1	321.381	1.187	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000363379601	300259743	/nfs/dbraw/zinc/25/97/43/300259743.db2.gz	SWXVLXMPISWTMG-UHFFFAOYSA-N	1	1	307.350	1.954	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000367286691	300822051	/nfs/dbraw/zinc/82/20/51/300822051.db2.gz	MJQDXRKJYRKIGC-UXONFWTHSA-N	1	1	311.288	1.674	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1F	ZINC000377510189	302187910	/nfs/dbraw/zinc/18/79/10/302187910.db2.gz	FKHBQBSVJBESCW-NEPJUHHUSA-N	1	1	323.324	1.327	20	5		DDBDMO
NC(=O)C1([NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1	ZINC000377579110	302196065	/nfs/dbraw/zinc/19/60/65/302196065.db2.gz	DPKZPXKQLZBFPS-UHFFFAOYSA-N	1	1	318.377	1.515	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]12	ZINC000377673048	302209056	/nfs/dbraw/zinc/20/90/56/302209056.db2.gz	RLMNOGOHGSYJAW-SMDDNHRTSA-N	1	1	305.334	1.042	20	5		DDBDMO
Cn1nccc1[C@H](CO)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000514873871	302752003	/nfs/dbraw/zinc/75/20/03/302752003.db2.gz	YYGNUXSJHKYICJ-STQMWFEESA-N	1	1	302.334	1.639	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362080612	307013062	/nfs/dbraw/zinc/01/30/62/307013062.db2.gz	YGRBIKKXWWFXOJ-CHWSQXEVSA-N	1	1	321.377	1.792	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000363593316	307032370	/nfs/dbraw/zinc/03/23/70/307032370.db2.gz	XYTZNWXWUQWIMD-KGLIPLIRSA-N	1	1	321.381	1.267	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000363939923	307038247	/nfs/dbraw/zinc/03/82/47/307038247.db2.gz	VKHWGRNMCGBCGF-QWHCGFSZSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000370888501	307139151	/nfs/dbraw/zinc/13/91/51/307139151.db2.gz	HNSGKCOPMKZXFZ-GFCCVEGCSA-N	1	1	321.381	1.267	20	5		DDBDMO
CC[C@H](C)NC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373248113	307182575	/nfs/dbraw/zinc/18/25/75/307182575.db2.gz	WIVKSSIRKSMZCN-NSHDSACASA-N	1	1	309.370	1.343	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CCC2(CCC[N@@H+]2C)CC1	ZINC000374875178	307215372	/nfs/dbraw/zinc/21/53/72/307215372.db2.gz	LAOSLBWBKXVJTN-UHFFFAOYSA-N	1	1	318.377	1.999	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000378496199	307289857	/nfs/dbraw/zinc/28/98/57/307289857.db2.gz	MSWJLAFXDJTAKL-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](c3ccncc3)C2)c1	ZINC000570118839	308159577	/nfs/dbraw/zinc/15/95/77/308159577.db2.gz	YWHNPMKLKOUCEF-DZGCQCFKSA-N	1	1	317.349	1.037	20	5		DDBDMO
CO[C@@H]1COC[C@H]1[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000579954051	308569426	/nfs/dbraw/zinc/56/94/26/308569426.db2.gz	ZNFCFRXEXCGENW-MPKXVKKWSA-N	1	1	323.349	1.234	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000337572710	490736145	/nfs/dbraw/zinc/73/61/45/490736145.db2.gz	DKVCTWZOKSVFEF-UHFFFAOYSA-N	1	1	315.333	1.216	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)C(C)(C)C(N)=O)cccc1[N+](=O)[O-]	ZINC000295598073	533900569	/nfs/dbraw/zinc/90/05/69/533900569.db2.gz	BYOZUFAGIZIWCP-UHFFFAOYSA-N	1	1	322.365	1.428	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000319016651	533938759	/nfs/dbraw/zinc/93/87/59/533938759.db2.gz	CPKLVXMJPCGWLS-PSASIEDQSA-N	1	1	310.329	1.529	20	5		DDBDMO
CC[N@H+]1CC[C@@H](NC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000493700487	527758103	/nfs/dbraw/zinc/75/81/03/527758103.db2.gz	XREIQTVPRSKORQ-RYWCDNDXSA-N	1	1	307.325	1.958	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)[C@]2(CO)CCOC2)ccc1[N+](=O)[O-]	ZINC000491606734	528262248	/nfs/dbraw/zinc/26/22/48/528262248.db2.gz	IJGSDUAODRQTCX-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@@H+](C)C1CC1	ZINC000736027084	598500362	/nfs/dbraw/zinc/50/03/62/598500362.db2.gz	XABOFAGOOXGYJF-MRVPVSSYSA-N	1	1	318.341	1.065	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000820668797	599589693	/nfs/dbraw/zinc/58/96/93/599589693.db2.gz	WOKYVNOMPPLBJS-MWLCHTKSSA-N	1	1	317.353	1.670	20	5		DDBDMO
C[N@H+](C[C@H]1CCCO1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000151736111	696889920	/nfs/dbraw/zinc/88/99/20/696889920.db2.gz	STUNQGUKOKPENT-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@@H+](C[C@H]1CCCO1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000151736111	696889921	/nfs/dbraw/zinc/88/99/21/696889921.db2.gz	STUNQGUKOKPENT-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2CC3(CCC3)C2)CC1	ZINC000981138136	697015611	/nfs/dbraw/zinc/01/56/11/697015611.db2.gz	MCVLRXNCRTVELE-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2CC3(CCC3)C2)CC1	ZINC000981138136	697015613	/nfs/dbraw/zinc/01/56/13/697015613.db2.gz	MCVLRXNCRTVELE-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2CC3(CCC3)C2)CC1	ZINC000981138136	697015616	/nfs/dbraw/zinc/01/56/16/697015616.db2.gz	MCVLRXNCRTVELE-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3CCC[N@@H+](CCF)CC3)nc2c1	ZINC000775672430	698020970	/nfs/dbraw/zinc/02/09/70/698020970.db2.gz	GLELAKJXBBWWJA-UHFFFAOYSA-N	1	1	307.329	1.953	20	5		DDBDMO
CCOC[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749959910	700195245	/nfs/dbraw/zinc/19/52/45/700195245.db2.gz	SEKHETXHGGGZQL-GFCCVEGCSA-N	1	1	319.365	1.964	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(c3nc[nH]n3)CC2)cc1	ZINC000776593627	698124239	/nfs/dbraw/zinc/12/42/39/698124239.db2.gz	YSHJJKCVRPFIAH-CQSZACIVSA-N	1	1	317.349	1.626	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776596655	698124771	/nfs/dbraw/zinc/12/47/71/698124771.db2.gz	HJOGIWSAIQDWNO-GJZGRUSLSA-N	1	1	319.361	1.325	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000778145196	698244897	/nfs/dbraw/zinc/24/48/97/698244897.db2.gz	IXJABNWAYKWGRA-UHFFFAOYSA-N	1	1	304.306	1.929	20	5		DDBDMO
C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000778295537	698258093	/nfs/dbraw/zinc/25/80/93/698258093.db2.gz	QRBZYAUOVZVNFY-LERXQTSPSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000778295537	698258094	/nfs/dbraw/zinc/25/80/94/698258094.db2.gz	QRBZYAUOVZVNFY-LERXQTSPSA-N	1	1	307.350	1.214	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000778393787	698270563	/nfs/dbraw/zinc/27/05/63/698270563.db2.gz	LTTPPSLHCJCDNU-UHFFFAOYSA-N	1	1	307.335	1.035	20	5		DDBDMO
CCCCC[N@@H+](CC(N)=O)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000780340960	698508365	/nfs/dbraw/zinc/50/83/65/698508365.db2.gz	CGSDTSDVLIHWEM-CQSZACIVSA-N	1	1	309.366	1.606	20	5		DDBDMO
CCCCC[N@H+](CC(N)=O)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000780340960	698508366	/nfs/dbraw/zinc/50/83/66/698508366.db2.gz	CGSDTSDVLIHWEM-CQSZACIVSA-N	1	1	309.366	1.606	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](CO)[C@H](CO)C2)c(Cl)c1	ZINC000705386893	699241014	/nfs/dbraw/zinc/24/10/14/699241014.db2.gz	IXHCRSNTSNJYPH-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](CO)[C@H](CO)C2)c(Cl)c1	ZINC000705386893	699241017	/nfs/dbraw/zinc/24/10/17/699241017.db2.gz	IXHCRSNTSNJYPH-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])OCCC[NH+]1CCOCC1	ZINC000735894295	699708830	/nfs/dbraw/zinc/70/88/30/699708830.db2.gz	PYOCPCPYZVPJBH-UHFFFAOYSA-N	1	1	323.349	1.272	20	5		DDBDMO
CO[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000751942785	700328617	/nfs/dbraw/zinc/32/86/17/700328617.db2.gz	XDHTXQPFCMLQQT-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000751942785	700328621	/nfs/dbraw/zinc/32/86/21/700328621.db2.gz	XDHTXQPFCMLQQT-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801936492	700357597	/nfs/dbraw/zinc/35/75/97/700357597.db2.gz	UQLUYMBZWILDMA-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801936492	700357600	/nfs/dbraw/zinc/35/76/00/700357600.db2.gz	UQLUYMBZWILDMA-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C1	ZINC000762719245	700904320	/nfs/dbraw/zinc/90/43/20/700904320.db2.gz	RCJQGNXUCGHGLD-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1	ZINC000764903036	700990794	/nfs/dbraw/zinc/99/07/94/700990794.db2.gz	WNXPVFHZXSYDGV-LLVKDONJSA-N	1	1	318.333	1.705	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1	ZINC000764903036	700990796	/nfs/dbraw/zinc/99/07/96/700990796.db2.gz	WNXPVFHZXSYDGV-LLVKDONJSA-N	1	1	318.333	1.705	20	5		DDBDMO
O=c1c([N+](=O)[O-])cn(Cc2cn3ccccc3[nH+]2)cc1[N+](=O)[O-]	ZINC000768457486	701179097	/nfs/dbraw/zinc/17/90/97/701179097.db2.gz	FATMQQKNGOXXTI-UHFFFAOYSA-N	1	1	315.245	1.361	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000768787352	701202608	/nfs/dbraw/zinc/20/26/08/701202608.db2.gz	ZJPOSWABLKOZBD-UHFFFAOYSA-N	1	1	312.395	1.195	20	5		DDBDMO
C[C@@]1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000839751967	701809947	/nfs/dbraw/zinc/80/99/47/701809947.db2.gz	VGJHKYJTWGZXBS-INMHGKMJSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000839751967	701809953	/nfs/dbraw/zinc/80/99/53/701809953.db2.gz	VGJHKYJTWGZXBS-INMHGKMJSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000839751967	701809960	/nfs/dbraw/zinc/80/99/60/701809960.db2.gz	VGJHKYJTWGZXBS-INMHGKMJSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCOC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000840222260	702033409	/nfs/dbraw/zinc/03/34/09/702033409.db2.gz	BYJMBODSGDPZBW-GFCCVEGCSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@H]21	ZINC000866206765	706648721	/nfs/dbraw/zinc/64/87/21/706648721.db2.gz	NAYJROBUMLTZJL-NWDGAFQWSA-N	1	1	304.350	1.224	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@](O)(C(F)F)C2)cc1	ZINC000831175542	706650449	/nfs/dbraw/zinc/65/04/49/706650449.db2.gz	LMYQXBGVAGAOLT-AAEUAGOBSA-N	1	1	302.277	1.330	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000816953613	702237734	/nfs/dbraw/zinc/23/77/34/702237734.db2.gz	KJWUOKUPMYUVMQ-ZWNOBZJWSA-N	1	1	307.325	1.818	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000816954723	702238689	/nfs/dbraw/zinc/23/86/89/702238689.db2.gz	JJNZEHZHEDHZFL-ZANVPECISA-N	1	1	320.305	1.279	20	5		DDBDMO
CCN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000869240244	702527856	/nfs/dbraw/zinc/52/78/56/702527856.db2.gz	YKTQGIPMKXJAJE-LBPRGKRZSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000842163530	702678738	/nfs/dbraw/zinc/67/87/38/702678738.db2.gz	PEVFRQXIONNIRI-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]2CSC[C@H]2C1	ZINC000879564389	706719014	/nfs/dbraw/zinc/71/90/14/706719014.db2.gz	ZQNKABISTZYTBL-VXGBXAGGSA-N	1	1	309.391	1.441	20	5		DDBDMO
CN(C(=O)C[N@@H+]1C[C@H](O)CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000879620955	706741524	/nfs/dbraw/zinc/74/15/24/706741524.db2.gz	MVJWFCPTKJXLII-CQSZACIVSA-N	1	1	321.377	1.650	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@H](O)CC(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000879620955	706741525	/nfs/dbraw/zinc/74/15/25/706741525.db2.gz	MVJWFCPTKJXLII-CQSZACIVSA-N	1	1	321.377	1.650	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000848351486	703542137	/nfs/dbraw/zinc/54/21/37/703542137.db2.gz	DMEYMQSLYYIMTC-HUUCEWRRSA-N	1	1	318.377	1.924	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC[N@H+](CC3CC3)C2)c1	ZINC000819040289	704057199	/nfs/dbraw/zinc/05/71/99/704057199.db2.gz	ZAQDOKWNMAOFQM-ZBFHGGJFSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000819040289	704057200	/nfs/dbraw/zinc/05/72/00/704057200.db2.gz	ZAQDOKWNMAOFQM-ZBFHGGJFSA-N	1	1	305.378	1.702	20	5		DDBDMO
CN(C)c1nc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cs1	ZINC000819128926	704073504	/nfs/dbraw/zinc/07/35/04/704073504.db2.gz	URFCXWXCMZKCPQ-ZDUSSCGKSA-N	1	1	322.390	1.941	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000852571173	704078221	/nfs/dbraw/zinc/07/82/21/704078221.db2.gz	JWWTZKGZZVSNNZ-UHFFFAOYSA-N	1	1	311.338	1.604	20	5		DDBDMO
CN(C[C@@H]1CCCO1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870879116	704155052	/nfs/dbraw/zinc/15/50/52/704155052.db2.gz	UCHZNNDLMHUFNP-ZFWWWQNUSA-N	1	1	307.350	1.406	20	5		DDBDMO
COC[C@@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870886301	704157957	/nfs/dbraw/zinc/15/79/57/704157957.db2.gz	CRFDFFPHGWWVQO-MLGOLLRUSA-N	1	1	321.377	1.654	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC000853540714	704263362	/nfs/dbraw/zinc/26/33/62/704263362.db2.gz	LBIPCGIBHSMMLO-JTQLQIEISA-N	1	1	303.322	1.813	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000855284601	704477339	/nfs/dbraw/zinc/47/73/39/704477339.db2.gz	WDBKTWSLNQZIFM-OCCSQVGLSA-N	1	1	321.377	1.617	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000874836917	705194209	/nfs/dbraw/zinc/19/42/09/705194209.db2.gz	IDKKXSPBGAGTDT-VXGBXAGGSA-N	1	1	304.350	1.486	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000823985931	705349413	/nfs/dbraw/zinc/34/94/13/705349413.db2.gz	FGIWWIRHWPWGDE-NSHDSACASA-N	1	1	321.381	1.983	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000824765245	705526157	/nfs/dbraw/zinc/52/61/57/705526157.db2.gz	VDFCIOMRRAQTMU-NSHDSACASA-N	1	1	309.370	1.089	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000827231536	705956437	/nfs/dbraw/zinc/95/64/37/705956437.db2.gz	HIHXYACCLVHVAP-OCCSQVGLSA-N	1	1	321.352	1.829	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC[C@@H]21	ZINC000827269313	705964954	/nfs/dbraw/zinc/96/49/54/705964954.db2.gz	WQWOONNHLACERH-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297891	705970536	/nfs/dbraw/zinc/97/05/36/705970536.db2.gz	HNVKQNOYTMYAAQ-QWRGUYRKSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297891	705970537	/nfs/dbraw/zinc/97/05/37/705970537.db2.gz	HNVKQNOYTMYAAQ-QWRGUYRKSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827297891	705970538	/nfs/dbraw/zinc/97/05/38/705970538.db2.gz	HNVKQNOYTMYAAQ-QWRGUYRKSA-N	1	1	321.381	1.608	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@@H]2CCC[N@@H+]2CCCO)nc2ccccn21	ZINC000828422926	706176538	/nfs/dbraw/zinc/17/65/38/706176538.db2.gz	SPDBRJKOEHKDDE-LBPRGKRZSA-N	1	1	319.365	1.501	20	5		DDBDMO
C[C@@H]1CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@H](C)[N@H+]1CCO	ZINC000829019233	706274887	/nfs/dbraw/zinc/27/48/87/706274887.db2.gz	BKKVPXSIWKZEGM-PHIMTYICSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000829019233	706274890	/nfs/dbraw/zinc/27/48/90/706274890.db2.gz	BKKVPXSIWKZEGM-PHIMTYICSA-N	1	1	324.337	1.394	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000880047168	706862956	/nfs/dbraw/zinc/86/29/56/706862956.db2.gz	IZXYLPDYXRTKKL-JTQLQIEISA-N	1	1	308.260	1.445	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCO[C@H](C(F)(F)F)CC2)c1	ZINC000880047168	706862957	/nfs/dbraw/zinc/86/29/57/706862957.db2.gz	IZXYLPDYXRTKKL-JTQLQIEISA-N	1	1	308.260	1.445	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000880134031	706886471	/nfs/dbraw/zinc/88/64/71/706886471.db2.gz	LIXPZBIFJYGJHD-ZIAGYGMSSA-N	1	1	318.377	1.362	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000836948108	707553018	/nfs/dbraw/zinc/55/30/18/707553018.db2.gz	XYOZIVQWMZZCNK-LBPRGKRZSA-N	1	1	306.366	1.733	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000836947560	707553098	/nfs/dbraw/zinc/55/30/98/707553098.db2.gz	IZTRXDGKUCYRCE-JTQLQIEISA-N	1	1	324.356	1.872	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)CC[C@H]21	ZINC000872725088	707573284	/nfs/dbraw/zinc/57/32/84/707573284.db2.gz	ORLJVDWTQBFOKT-IUODEOHRSA-N	1	1	315.377	1.928	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000872779130	707596723	/nfs/dbraw/zinc/59/67/23/707596723.db2.gz	MYCHKUCDGUVBFQ-ZIAGYGMSSA-N	1	1	304.350	1.367	20	5		DDBDMO
O=[N+]([O-])c1cn(C[N@@H+]2C[C@@H]3COC[C@@H]3C2)nc1-c1ccncc1	ZINC000872785350	707599941	/nfs/dbraw/zinc/59/99/41/707599941.db2.gz	AMJAQTIMTBDNGH-BETUJISGSA-N	1	1	315.333	1.389	20	5		DDBDMO
O=[N+]([O-])c1cn(C[N@H+]2C[C@@H]3COC[C@@H]3C2)nc1-c1ccncc1	ZINC000872785350	707599944	/nfs/dbraw/zinc/59/99/44/707599944.db2.gz	AMJAQTIMTBDNGH-BETUJISGSA-N	1	1	315.333	1.389	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000837224551	707601651	/nfs/dbraw/zinc/60/16/51/707601651.db2.gz	DNHOLORPAXSLGM-HNNXBMFYSA-N	1	1	321.377	1.619	20	5		DDBDMO
CC(C)(C)OCCC[NH+]1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC000882931544	707858157	/nfs/dbraw/zinc/85/81/57/707858157.db2.gz	LYLGXQSBGXMABA-UHFFFAOYSA-N	1	1	323.397	1.712	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]([C@H]3CCCO3)C2)c([N+](=O)[O-])c1	ZINC000886827922	708855520	/nfs/dbraw/zinc/85/55/20/708855520.db2.gz	UFWDTHKRSMIRMS-DZGCQCFKSA-N	1	1	319.361	1.695	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC23CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000889224481	709464288	/nfs/dbraw/zinc/46/42/88/709464288.db2.gz	KYBBAOZPHPMQNU-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000928093324	713127522	/nfs/dbraw/zinc/12/75/22/713127522.db2.gz	BWEZXWBDDKIEJL-PWSUYJOCSA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000928093324	713127523	/nfs/dbraw/zinc/12/75/23/713127523.db2.gz	BWEZXWBDDKIEJL-PWSUYJOCSA-N	1	1	324.406	1.243	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)ccc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000900804822	709767368	/nfs/dbraw/zinc/76/73/68/709767368.db2.gz	NNNONYGNGYBRSE-IINYFYTJSA-N	1	1	324.356	1.098	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000910296679	709874383	/nfs/dbraw/zinc/87/43/83/709874383.db2.gz	ODCXGZFXUTUIRD-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOC(=O)CCC(C)(C)[N+](=O)[O-])CCO1	ZINC000893386503	710627857	/nfs/dbraw/zinc/62/78/57/710627857.db2.gz	VIFYRYXUALODBZ-LBPRGKRZSA-N	1	1	302.371	1.476	20	5		DDBDMO
CCO[C@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000902527614	710782584	/nfs/dbraw/zinc/78/25/84/710782584.db2.gz	KAJYATZODCOYAQ-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000902527614	710782588	/nfs/dbraw/zinc/78/25/88/710782588.db2.gz	KAJYATZODCOYAQ-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
COc1cc([C@H](C)[NH2+]CC(=O)NCC(F)F)cc([N+](=O)[O-])c1	ZINC000903168591	711053626	/nfs/dbraw/zinc/05/36/26/711053626.db2.gz	YGPRNSTULKEDLP-QMMMGPOBSA-N	1	1	317.292	1.635	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@@H]2CC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000928558880	713226538	/nfs/dbraw/zinc/22/65/38/713226538.db2.gz	YEBNUEOFQRBWKB-VIFPVBQESA-N	1	1	310.329	1.234	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000928558880	713226540	/nfs/dbraw/zinc/22/65/40/713226540.db2.gz	YEBNUEOFQRBWKB-VIFPVBQESA-N	1	1	310.329	1.234	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cccnc32)C[C@H]1CO	ZINC000894887644	711308912	/nfs/dbraw/zinc/30/89/12/711308912.db2.gz	HPTMYPZNQHIIDG-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[NH+](Cc2ccc(O)cc2)CC1	ZINC000894997479	711357656	/nfs/dbraw/zinc/35/76/56/711357656.db2.gz	QZKZGBQNUQTPGA-UHFFFAOYSA-N	1	1	317.349	1.356	20	5		DDBDMO
O=C(NC12CC[NH+](CC1)C2)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000913627423	713271607	/nfs/dbraw/zinc/27/16/07/713271607.db2.gz	JVFFDFQLOUSMKF-UHFFFAOYSA-N	1	1	301.302	1.919	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1NC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC000896526574	711738925	/nfs/dbraw/zinc/73/89/25/711738925.db2.gz	YXEGEJLLAPNSRL-NSHDSACASA-N	1	1	310.329	1.794	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCO[C@@H]3CCOC3)CC2)cc1	ZINC000929154078	713558073	/nfs/dbraw/zinc/55/80/73/713558073.db2.gz	HKAKXMFCQUTPCK-MRXNPFEDSA-N	1	1	321.377	1.522	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929228692	713571552	/nfs/dbraw/zinc/57/15/52/713571552.db2.gz	RBOJWTAZQKGVQU-LSDHHAIUSA-N	1	1	303.362	1.862	20	5		DDBDMO
Cn1cc(CN2CCC([N@H+]3CCCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000931284593	714057386	/nfs/dbraw/zinc/05/73/86/714057386.db2.gz	VWWLQEDSTPTJLV-UHFFFAOYSA-N	1	1	323.397	1.015	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@H]1C=C[C@@H]2C1	ZINC000933707301	714652498	/nfs/dbraw/zinc/65/24/98/714652498.db2.gz	YCSRAVJDXLUOAI-PTNZTPPNSA-N	1	1	318.377	1.296	20	5		DDBDMO
CC[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCC(=O)NC	ZINC000933860496	714685409	/nfs/dbraw/zinc/68/54/09/714685409.db2.gz	LVJXTKKRCWJKLI-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000934121145	714747286	/nfs/dbraw/zinc/74/72/86/714747286.db2.gz	KOUPFODPQIFTKG-GXTWGEPZSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@H]2CC[C@H]2OC)c([N+](=O)[O-])c1	ZINC000934121145	714747287	/nfs/dbraw/zinc/74/72/87/714747287.db2.gz	KOUPFODPQIFTKG-GXTWGEPZSA-N	1	1	323.349	1.651	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)c1	ZINC000934255652	714776499	/nfs/dbraw/zinc/77/64/99/714776499.db2.gz	UYKMPXXWQJCOLF-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1C	ZINC000925309437	714803172	/nfs/dbraw/zinc/80/31/72/714803172.db2.gz	ZYLBKTMLDMCLLC-MWLCHTKSSA-N	1	1	308.338	1.818	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1CC[N@H+](CC(C)C)C1	ZINC000934547764	714848510	/nfs/dbraw/zinc/84/85/10/714848510.db2.gz	JEJQFWUGRDZFLK-ZDUSSCGKSA-N	1	1	323.397	1.194	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2CC2CCOCC2)c1	ZINC000934637805	714867942	/nfs/dbraw/zinc/86/79/42/714867942.db2.gz	NRFWPUGJDBDNCU-AWEZNQCLSA-N	1	1	324.381	1.309	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2CC2CCOCC2)c1	ZINC000934637805	714867943	/nfs/dbraw/zinc/86/79/43/714867943.db2.gz	NRFWPUGJDBDNCU-AWEZNQCLSA-N	1	1	324.381	1.309	20	5		DDBDMO
CC1([NH2+]Cc2cncs2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000940107708	716626881	/nfs/dbraw/zinc/62/68/81/716626881.db2.gz	PPADDPHYWIRGJU-VXGBXAGGSA-N	1	1	324.406	1.279	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)C[C@H]2C)n1	ZINC001164631979	719256084	/nfs/dbraw/zinc/25/60/84/719256084.db2.gz	GSTXIWXRZISQES-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)n1	ZINC001164631979	719256088	/nfs/dbraw/zinc/25/60/88/719256088.db2.gz	GSTXIWXRZISQES-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(N3CCc4[nH+]ccn4CC3)c21	ZINC001167182022	732809582	/nfs/dbraw/zinc/80/95/82/732809582.db2.gz	KNXOXBNXSCEKBC-UHFFFAOYSA-N	1	1	310.317	1.797	20	5		DDBDMO
O=C(NC1CC2(C1)CC([NH2+]C/C=C/Cl)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC001121087660	782351024	/nfs/dbraw/zinc/35/10/24/782351024.db2.gz	SNFVQOUUTSGQLS-CKLPMJENSA-N	1	1	313.785	1.421	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC001121198267	782404594	/nfs/dbraw/zinc/40/45/94/782404594.db2.gz	GKCMRVLRHFYRKH-MJBXVCDLSA-N	1	1	303.362	1.594	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018272	762198973	/nfs/dbraw/zinc/19/89/73/762198973.db2.gz	ALHFUMMMBAYKHI-AVGNSLFASA-N	1	1	323.397	1.196	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018272	762198979	/nfs/dbraw/zinc/19/89/79/762198979.db2.gz	ALHFUMMMBAYKHI-AVGNSLFASA-N	1	1	323.397	1.196	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018277	762199060	/nfs/dbraw/zinc/19/90/60/762199060.db2.gz	ALHFUMMMBAYKHI-RWMBFGLXSA-N	1	1	323.397	1.196	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2nnn(C)c21	ZINC001169018277	762199065	/nfs/dbraw/zinc/19/90/65/762199065.db2.gz	ALHFUMMMBAYKHI-RWMBFGLXSA-N	1	1	323.397	1.196	20	5		DDBDMO
Cc1cc(N(C)CCNC(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC001100149480	765466374	/nfs/dbraw/zinc/46/63/74/765466374.db2.gz	JCSMJFQMYWCTNR-UHFFFAOYSA-N	1	1	322.409	1.796	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001136922227	772211199	/nfs/dbraw/zinc/21/11/99/772211199.db2.gz	AMYYMIPUZRVKFL-HZMBPMFUSA-N	1	1	306.366	1.589	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001093770637	775066824	/nfs/dbraw/zinc/06/68/24/775066824.db2.gz	AOPBKFFUJAUZBU-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC001116230209	780487254	/nfs/dbraw/zinc/48/72/54/780487254.db2.gz	URPUVMHRCBKOMS-GHMZBOCLSA-N	1	1	318.377	1.992	20	5		DDBDMO
O=C(CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)N1CCCC1	ZINC001118987484	781291243	/nfs/dbraw/zinc/29/12/43/781291243.db2.gz	VTVQRMQGEKRNSF-UHFFFAOYSA-N	1	1	300.318	1.599	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](C(=O)NC2CC2)C1	ZINC001119305541	781399099	/nfs/dbraw/zinc/39/90/99/781399099.db2.gz	CHTNRNDKEGTXGM-GFCCVEGCSA-N	1	1	321.381	1.090	20	5		DDBDMO
Cc1ccc(CC[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001268791182	840818536	/nfs/dbraw/zinc/81/85/36/840818536.db2.gz	LWDBPXODHZHZIE-HZPDHXFCSA-N	1	1	319.405	1.641	20	5		DDBDMO
Cc1nc(N2CCN(c3[nH+]cccc3N)CC2)ccc1[N+](=O)[O-]	ZINC001154782206	861447830	/nfs/dbraw/zinc/44/78/30/861447830.db2.gz	INMZMFCQQNLJTG-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@H]2CCNC(=O)C2)ncc1[N+](=O)[O-]	ZINC001154940072	861589102	/nfs/dbraw/zinc/58/91/02/861589102.db2.gz	LFRQGHVFDLXTIR-MALLOTDXSA-N	1	1	319.365	1.460	20	5		DDBDMO
O=[N+]([O-])c1cc(NCC2([NH+]3CCCC3)COC2)nc2[nH]ccc21	ZINC001157656022	864021652	/nfs/dbraw/zinc/02/16/52/864021652.db2.gz	RQXTYCZNFHXJEI-UHFFFAOYSA-N	1	1	317.349	1.748	20	5		DDBDMO
Cc1ccccc1CCC[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775045	864129343	/nfs/dbraw/zinc/12/93/43/864129343.db2.gz	JFJNWAZZYJCOPA-HZPDHXFCSA-N	1	1	319.405	1.689	20	5		DDBDMO
C[C@H]1CN(c2ncc([N+](=O)[O-])c3ccccc32)CC[N@H+]1CCO	ZINC001331599359	865174904	/nfs/dbraw/zinc/17/49/04/865174904.db2.gz	CPNPWDXUWHTRBQ-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
Cc1cccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC001277054372	881889983	/nfs/dbraw/zinc/88/99/83/881889983.db2.gz	DFPXIIQSFGRJKS-ZIAGYGMSSA-N	1	1	303.362	1.399	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C1	ZINC001160160794	865704841	/nfs/dbraw/zinc/70/48/41/865704841.db2.gz	RPTGJWNSXCGWES-AWEZNQCLSA-N	1	1	305.378	1.998	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@H]1[NH+]1CCOCC1	ZINC001160724981	866072790	/nfs/dbraw/zinc/07/27/90/866072790.db2.gz	NMQYNTXITJZPPM-QWHCGFSZSA-N	1	1	307.354	1.237	20	5		DDBDMO
COC(=O)N1CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC001319846184	866336579	/nfs/dbraw/zinc/33/65/79/866336579.db2.gz	SJBJPTRVMQWWOQ-AWEZNQCLSA-N	1	1	323.349	1.402	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC001319846184	866336599	/nfs/dbraw/zinc/33/65/99/866336599.db2.gz	SJBJPTRVMQWWOQ-AWEZNQCLSA-N	1	1	323.349	1.402	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCC[C@H](CF)C1)c1cccc([N+](=O)[O-])c1	ZINC001333216285	866527374	/nfs/dbraw/zinc/52/73/74/866527374.db2.gz	UUNXPZIEIZNOLN-IAQYHMDHSA-N	1	1	309.341	1.977	20	5		DDBDMO
C[N@@H+]1CCN(c2cc([N+](=O)[O-])cc[n+]2[O-])[C@H](c2ccccc2)C1	ZINC001163668762	868611303	/nfs/dbraw/zinc/61/13/03/868611303.db2.gz	DUYFTYCLTONGJZ-HNNXBMFYSA-N	1	1	314.345	1.721	20	5		DDBDMO
C[N@H+]1CCN(c2cc([N+](=O)[O-])cc[n+]2[O-])[C@H](c2ccccc2)C1	ZINC001163668762	868611308	/nfs/dbraw/zinc/61/13/08/868611308.db2.gz	DUYFTYCLTONGJZ-HNNXBMFYSA-N	1	1	314.345	1.721	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccnc(Cl)c2[N+](=O)[O-])C1	ZINC001228061829	883309647	/nfs/dbraw/zinc/30/96/47/883309647.db2.gz	XKRQZGGDODRQOZ-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
COc1ncc([N+](=O)[O-])cc1NCC1(N(C)C)CC[NH+](C)CC1	ZINC001164210301	869017840	/nfs/dbraw/zinc/01/78/40/869017840.db2.gz	BGVAJZIUUJXZAW-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
CC(C)Oc1nc(N2CCC(F)(F)[C@H]([NH3+])C2)ccc1[N+](=O)[O-]	ZINC001164325903	869129545	/nfs/dbraw/zinc/12/95/45/869129545.db2.gz	ABYAPOHLYJFXEC-SNVBAGLBSA-N	1	1	316.308	1.950	20	5		DDBDMO
COCCC[NH+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC001165095118	869371372	/nfs/dbraw/zinc/37/13/72/869371372.db2.gz	RSIYUELTCRHSKN-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12	ZINC001337837202	869651368	/nfs/dbraw/zinc/65/13/68/869651368.db2.gz	YYQGGKGDUZPYOX-LERXQTSPSA-N	1	1	304.350	1.368	20	5		DDBDMO
Cc1nc(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)ncc1[N+](=O)[O-]	ZINC001166032481	869809275	/nfs/dbraw/zinc/80/92/75/869809275.db2.gz	ZCIJBLSJQZQKEZ-UHFFFAOYSA-N	1	1	320.353	1.328	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC[C@@]1(CO)COC[C@@H]2CCC[N@H+]21	ZINC001338162363	869842032	/nfs/dbraw/zinc/84/20/32/869842032.db2.gz	INNDGLOMTNNDQS-XJKSGUPXSA-N	1	1	321.377	1.541	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@]23CCCOC3)c1	ZINC001308171586	871478570	/nfs/dbraw/zinc/47/85/70/871478570.db2.gz	VKCLWKIADIORFB-LSDHHAIUSA-N	1	1	324.381	1.187	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+](CCO)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC001311322773	871693944	/nfs/dbraw/zinc/69/39/44/871693944.db2.gz	LRFQIUIRUUCTRB-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC001311322773	871693951	/nfs/dbraw/zinc/69/39/51/871693951.db2.gz	LRFQIUIRUUCTRB-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1c(C(=O)NCC[NH+]2CC=CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC001319027943	872403646	/nfs/dbraw/zinc/40/36/46/872403646.db2.gz	KDCPYMBUSJNIAF-UHFFFAOYSA-N	1	1	320.305	1.413	20	5		DDBDMO
Cc1cc(NC(=O)NCC[N@H+]2CCCOCC2)cc([N+](=O)[O-])c1	ZINC001346655055	873838152	/nfs/dbraw/zinc/83/81/52/873838152.db2.gz	DMJLOZUZWUJRGA-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
NC(=O)c1cc(N2CCC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC001350441023	875692263	/nfs/dbraw/zinc/69/22/63/875692263.db2.gz	OYDUAHJYZYJKBT-LBPRGKRZSA-N	1	1	304.350	1.368	20	5		DDBDMO
COC(=O)c1cc(CO[C@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001223689054	881057696	/nfs/dbraw/zinc/05/76/96/881057696.db2.gz	SYAGNIRAJSMFGO-AWEZNQCLSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1c(OCC[N@@H+]2CC[C@@H](OC)C2)cccc1[N+](=O)[O-]	ZINC001229049782	883792412	/nfs/dbraw/zinc/79/24/12/883792412.db2.gz	LEGKUKKKUQHXPT-LLVKDONJSA-N	1	1	324.333	1.481	20	5		DDBDMO
COC(=O)c1cc(O[C@@H]2CCC[N@@H+](C)C2)c(F)cc1[N+](=O)[O-]	ZINC001229942921	884239820	/nfs/dbraw/zinc/23/98/20/884239820.db2.gz	RHZOZWAZWOTFJM-SECBINFHSA-N	1	1	312.297	1.994	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CCCC[C@](O)(C[NH3+])C1	ZINC001246559071	892697362	/nfs/dbraw/zinc/69/73/62/892697362.db2.gz	NFEMFNYYOHHEDD-BBRMVZONSA-N	1	1	307.394	1.702	20	5		DDBDMO
N[C@@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC[C@H]1O	ZINC001246570256	892703489	/nfs/dbraw/zinc/70/34/89/892703489.db2.gz	FODGUVSEYDJIPZ-FVQBIDKESA-N	1	1	305.378	1.236	20	5		DDBDMO
N[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC[C@H]1O	ZINC001246570256	892703498	/nfs/dbraw/zinc/70/34/98/892703498.db2.gz	FODGUVSEYDJIPZ-FVQBIDKESA-N	1	1	305.378	1.236	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)CC[C@@H]2C1	ZINC001254559270	896502210	/nfs/dbraw/zinc/50/22/10/896502210.db2.gz	JYIGVSUVLYJDND-GXTWGEPZSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)CC[C@@H]2C1	ZINC001254559270	896502217	/nfs/dbraw/zinc/50/22/17/896502217.db2.gz	JYIGVSUVLYJDND-GXTWGEPZSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC(=O)N1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254601095	896525083	/nfs/dbraw/zinc/52/50/83/896525083.db2.gz	ZGLCGSBFIFJSJL-INIZCTEOSA-N	1	1	303.362	1.616	20	5		DDBDMO
CCNC(=O)[C@@H]1CCC[N@H+]1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254605225	896526542	/nfs/dbraw/zinc/52/65/42/896526542.db2.gz	AKDKZKQSCQPJNW-GJZGRUSLSA-N	1	1	303.362	1.663	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254605016	896528104	/nfs/dbraw/zinc/52/81/04/896528104.db2.gz	ZTGIHZHPVJIJNU-SWLSCSKDSA-N	1	1	304.346	1.947	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)ccc1[N+](=O)[O-]	ZINC001262826283	900387583	/nfs/dbraw/zinc/38/75/83/900387583.db2.gz	GXWCKKDOLBDUGO-FRRDWIJNSA-N	1	1	319.361	1.673	20	5		DDBDMO
COc1ccc(CNC(=O)[C@H]2CCC[N@H+]2C2CC2)cc1[N+](=O)[O-]	ZINC000278396057	214139955	/nfs/dbraw/zinc/13/99/55/214139955.db2.gz	FGJSMZMFOGGZSJ-CYBMUJFWSA-N	1	1	319.361	1.846	20	5		DDBDMO
COc1cc(C[N@H+](C[C@@H](C)O)[C@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000248904755	282117077	/nfs/dbraw/zinc/11/70/77/282117077.db2.gz	HUHFHAIQEAUHPR-NXEZZACHSA-N	1	1	316.329	1.306	20	5		DDBDMO
COc1cc(C[N@@H+](C[C@@H](C)O)[C@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000248904755	282117078	/nfs/dbraw/zinc/11/70/78/282117078.db2.gz	HUHFHAIQEAUHPR-NXEZZACHSA-N	1	1	316.329	1.306	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000278571749	214245493	/nfs/dbraw/zinc/24/54/93/214245493.db2.gz	XJYRFYYSQMGONE-LLVKDONJSA-N	1	1	323.349	1.513	20	5		DDBDMO
Cc1cnc(N2CC[N@@H+](C3CCOCC3)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000278684253	214324501	/nfs/dbraw/zinc/32/45/01/214324501.db2.gz	DONPPXDIJPIHRP-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H](C)C(C)(C)O	ZINC000451358755	231075653	/nfs/dbraw/zinc/07/56/53/231075653.db2.gz	HBLJBFZDUFYVNF-LLVKDONJSA-N	1	1	309.366	1.933	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@](O)(C(F)F)C1	ZINC000451433786	231094267	/nfs/dbraw/zinc/09/42/67/231094267.db2.gz	PGHHBMQSLSLVPN-CYBMUJFWSA-N	1	1	302.277	1.805	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@](O)(C(F)F)C1	ZINC000451433786	231094270	/nfs/dbraw/zinc/09/42/70/231094270.db2.gz	PGHHBMQSLSLVPN-CYBMUJFWSA-N	1	1	302.277	1.805	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000451925623	231235308	/nfs/dbraw/zinc/23/53/08/231235308.db2.gz	LDZHPZPYBIMJSJ-HNNXBMFYSA-N	1	1	310.350	1.304	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452064913	231288177	/nfs/dbraw/zinc/28/81/77/231288177.db2.gz	GVJCZNSNDVTOCR-BXUZGUMPSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC1(C)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1O	ZINC000615141185	362170589	/nfs/dbraw/zinc/17/05/89/362170589.db2.gz	HDBZAKZEMKNWJR-OAHLLOKOSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1O	ZINC000615141185	362170592	/nfs/dbraw/zinc/17/05/92/362170592.db2.gz	HDBZAKZEMKNWJR-OAHLLOKOSA-N	1	1	322.361	1.959	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1(CO)CC1	ZINC000615140478	362170649	/nfs/dbraw/zinc/17/06/49/362170649.db2.gz	INSMVNXJPFSQKQ-UHFFFAOYSA-N	1	1	308.334	1.570	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)CC1(CO)CC1	ZINC000615140478	362170652	/nfs/dbraw/zinc/17/06/52/362170652.db2.gz	INSMVNXJPFSQKQ-UHFFFAOYSA-N	1	1	308.334	1.570	20	5		DDBDMO
C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(S(C)(=O)=O)C1	ZINC000292364635	529995705	/nfs/dbraw/zinc/99/57/05/529995705.db2.gz	YFKKZWMUYVJUOW-ZDUSSCGKSA-N	1	1	313.379	1.061	20	5		DDBDMO
C[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCN(S(C)(=O)=O)C1	ZINC000292364635	529995706	/nfs/dbraw/zinc/99/57/06/529995706.db2.gz	YFKKZWMUYVJUOW-ZDUSSCGKSA-N	1	1	313.379	1.061	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000330909832	232156151	/nfs/dbraw/zinc/15/61/51/232156151.db2.gz	PCAOEXHMXVKKFG-PWSUYJOCSA-N	1	1	309.370	1.089	20	5		DDBDMO
C[C@H]([NH3+])C[C@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000320233252	290819682	/nfs/dbraw/zinc/81/96/82/290819682.db2.gz	HQWCRHGZFNNQIQ-YUMQZZPRSA-N	1	1	305.331	1.138	20	5		DDBDMO
CC(C)(C)[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000279943290	215258988	/nfs/dbraw/zinc/25/89/88/215258988.db2.gz	XIMQYDXRCOQRQG-ZDUSSCGKSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC(C)(C)[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC000279943290	215258990	/nfs/dbraw/zinc/25/89/90/215258990.db2.gz	XIMQYDXRCOQRQG-ZDUSSCGKSA-N	1	1	309.366	1.503	20	5		DDBDMO
Cc1cc(N2CCN(c3[nH+]ccn3C)CC2)ncc1[N+](=O)[O-]	ZINC000266845484	186357449	/nfs/dbraw/zinc/35/74/49/186357449.db2.gz	OOQHJUDOFIUYRT-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-]	ZINC000025136191	352194600	/nfs/dbraw/zinc/19/46/00/352194600.db2.gz	HKFGFSHPMMFDOI-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000028013109	352225606	/nfs/dbraw/zinc/22/56/06/352225606.db2.gz	VKVRQILRABDBTC-ZDUSSCGKSA-N	1	1	321.377	1.681	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1	ZINC000579287593	422741702	/nfs/dbraw/zinc/74/17/02/422741702.db2.gz	LWSSVLNWJJHFPX-NWDGAFQWSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000331719399	234042485	/nfs/dbraw/zinc/04/24/85/234042485.db2.gz	QXIRWGVNCCZTAQ-LSDHHAIUSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000054352463	352688383	/nfs/dbraw/zinc/68/83/83/352688383.db2.gz	DNHXZBWOMKTHBS-UHFFFAOYSA-N	1	1	302.334	1.849	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[NH+](CC)CC2)cc1[N+](=O)[O-]	ZINC000060500079	352873961	/nfs/dbraw/zinc/87/39/61/352873961.db2.gz	IVMWZDUBIVHJBX-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000063852179	352927568	/nfs/dbraw/zinc/92/75/68/352927568.db2.gz	TUBMIAMPHDXFNI-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CCO)CC3CC3)n2)c1	ZINC000064516641	352939831	/nfs/dbraw/zinc/93/98/31/352939831.db2.gz	PFXSUOQUFRAPAL-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+](CCO)CC3CC3)n2)c1	ZINC000064516641	352939832	/nfs/dbraw/zinc/93/98/32/352939832.db2.gz	PFXSUOQUFRAPAL-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000069370708	353159042	/nfs/dbraw/zinc/15/90/42/353159042.db2.gz	OVKGAJRFPXTFTJ-ZDUSSCGKSA-N	1	1	321.377	1.746	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)CC[C@@H](C)O	ZINC000072712803	353210702	/nfs/dbraw/zinc/21/07/02/353210702.db2.gz	RELKZPODHMGUMS-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
CCC[N@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000072953372	353227554	/nfs/dbraw/zinc/22/75/54/353227554.db2.gz	MKVPRVRILSATQE-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000072953372	353227556	/nfs/dbraw/zinc/22/75/56/353227556.db2.gz	MKVPRVRILSATQE-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000332018955	234394635	/nfs/dbraw/zinc/39/46/35/234394635.db2.gz	HYJWIIMMGVFQRA-HIFRSBDPSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C(C[NH+]1CCC(CO)CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000076991726	353447421	/nfs/dbraw/zinc/44/74/21/353447421.db2.gz	ZQPUSWWJARYGIA-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000080430511	353607353	/nfs/dbraw/zinc/60/73/53/353607353.db2.gz	OLHCNYXWHCGFPV-CQSZACIVSA-N	1	1	321.402	1.858	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000091742978	353835251	/nfs/dbraw/zinc/83/52/51/353835251.db2.gz	ITWBEZSZLFXIID-DGCLKSJQSA-N	1	1	307.398	1.811	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)NCc1cccc([N+](=O)[O-])c1C	ZINC000358629446	299209472	/nfs/dbraw/zinc/20/94/72/299209472.db2.gz	CJCHQXBOFPWJGY-UHFFFAOYSA-N	1	1	324.381	1.281	20	5		DDBDMO
Cc1cnn(CC[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c1	ZINC000358647142	299213573	/nfs/dbraw/zinc/21/35/73/299213573.db2.gz	CACYJRRPZWUUOR-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000157921036	354227998	/nfs/dbraw/zinc/22/79/98/354227998.db2.gz	PZQGPLAJVNMBNZ-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000157921036	354228000	/nfs/dbraw/zinc/22/80/00/354228000.db2.gz	PZQGPLAJVNMBNZ-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc(C[N@@H+](C)C[C@@H](O)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000589198180	354972419	/nfs/dbraw/zinc/97/24/19/354972419.db2.gz	PNVPPHVINKQKKL-CYBMUJFWSA-N	1	1	310.350	1.815	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCCN1CCOCC1)CC2	ZINC000332494018	235033029	/nfs/dbraw/zinc/03/30/29/235033029.db2.gz	YNXDJSSQENOOBN-UHFFFAOYSA-N	1	1	306.366	1.070	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@@H]2C[N@H+](C)C[C@@H]21	ZINC000590010365	355039112	/nfs/dbraw/zinc/03/91/12/355039112.db2.gz	CIDCVFWUCWCRRI-DOMZBBRYSA-N	1	1	318.377	1.478	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[N@H+]2CCN1CCC2	ZINC000590541654	355110639	/nfs/dbraw/zinc/11/06/39/355110639.db2.gz	JMJKAUAKVJNUTA-ZDUSSCGKSA-N	1	1	318.377	1.023	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590443488	355097205	/nfs/dbraw/zinc/09/72/05/355097205.db2.gz	KMXMLCYFLYROCA-VHSXEESVSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590443488	355097206	/nfs/dbraw/zinc/09/72/06/355097206.db2.gz	KMXMLCYFLYROCA-VHSXEESVSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000590443488	355097207	/nfs/dbraw/zinc/09/72/07/355097207.db2.gz	KMXMLCYFLYROCA-VHSXEESVSA-N	1	1	307.354	1.217	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC000590444455	355098864	/nfs/dbraw/zinc/09/88/64/355098864.db2.gz	LZJTWHXXBUCMKJ-PRHODGIISA-N	1	1	308.313	1.092	20	5		DDBDMO
CN1C[C@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591037765	355236547	/nfs/dbraw/zinc/23/65/47/355236547.db2.gz	ZMZDFWANZDYMPK-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591037765	355236550	/nfs/dbraw/zinc/23/65/50/355236550.db2.gz	ZMZDFWANZDYMPK-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591037765	355236555	/nfs/dbraw/zinc/23/65/55/355236555.db2.gz	ZMZDFWANZDYMPK-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=[N+]([O-])c1ncccc1NCC1([NH+]2CCOCC2)CCOCC1	ZINC000591175298	355261211	/nfs/dbraw/zinc/26/12/11/355261211.db2.gz	QMSHXIFOGDSGEN-UHFFFAOYSA-N	1	1	322.365	1.283	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)C1	ZINC000591147176	355254952	/nfs/dbraw/zinc/25/49/52/355254952.db2.gz	BRTZVXQXCRBBSK-LBPRGKRZSA-N	1	1	323.372	1.345	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000592533590	355618353	/nfs/dbraw/zinc/61/83/53/355618353.db2.gz	UMBNYLVHFREOQY-GNXSNYGWSA-N	1	1	320.345	1.464	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000592533590	355618356	/nfs/dbraw/zinc/61/83/56/355618356.db2.gz	UMBNYLVHFREOQY-GNXSNYGWSA-N	1	1	320.345	1.464	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)[C@@H]2CO)c1	ZINC000593024743	355772378	/nfs/dbraw/zinc/77/23/78/355772378.db2.gz	LOCXTLDBABTFBF-YGRLFVJLSA-N	1	1	308.334	1.584	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593032863	355774923	/nfs/dbraw/zinc/77/49/23/355774923.db2.gz	DAUUQBMDOSPIEV-UHFFFAOYSA-N	1	1	323.349	1.386	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000593857401	356025745	/nfs/dbraw/zinc/02/57/45/356025745.db2.gz	ZNEZWWRAGJVQAM-CYBMUJFWSA-N	1	1	319.361	1.103	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593857401	356025747	/nfs/dbraw/zinc/02/57/47/356025747.db2.gz	ZNEZWWRAGJVQAM-CYBMUJFWSA-N	1	1	319.361	1.103	20	5		DDBDMO
C[C@@H](C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1)[NH+]1CC(C)C1	ZINC000594360114	356181994	/nfs/dbraw/zinc/18/19/94/356181994.db2.gz	DKNGJRPVYKRVCT-LBPRGKRZSA-N	1	1	319.361	1.656	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1	ZINC000594357516	356182016	/nfs/dbraw/zinc/18/20/16/356182016.db2.gz	OSMOWHWMNQZRJQ-CYBMUJFWSA-N	1	1	305.378	1.938	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000594604527	356262445	/nfs/dbraw/zinc/26/24/45/356262445.db2.gz	XHYHPDJBCLKTQL-NWDGAFQWSA-N	1	1	322.365	1.032	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019556	356372771	/nfs/dbraw/zinc/37/27/71/356372771.db2.gz	QXZWBVXBCNAQGA-QWHCGFSZSA-N	1	1	323.393	1.975	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000595019556	356372772	/nfs/dbraw/zinc/37/27/72/356372772.db2.gz	QXZWBVXBCNAQGA-QWHCGFSZSA-N	1	1	323.393	1.975	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCOCC[NH+](C)C	ZINC000595038977	356375128	/nfs/dbraw/zinc/37/51/28/356375128.db2.gz	AAJJADUMYWULLR-LBPRGKRZSA-N	1	1	311.382	1.832	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000595387620	356474461	/nfs/dbraw/zinc/47/44/61/356474461.db2.gz	FWHIGYOCGWFEMY-AWEZNQCLSA-N	1	1	309.341	1.640	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595551446	356546356	/nfs/dbraw/zinc/54/63/56/356546356.db2.gz	LZMGPXFKDXOHES-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000081556695	192292101	/nfs/dbraw/zinc/29/21/01/192292101.db2.gz	SXDVPVAYEIDZFY-MNOVXSKESA-N	1	1	322.365	1.236	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000595745623	356633480	/nfs/dbraw/zinc/63/34/80/356633480.db2.gz	YSSWJUZDQKGQDK-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000595769522	356645122	/nfs/dbraw/zinc/64/51/22/356645122.db2.gz	JJRAVAQVHYVWTM-IINYFYTJSA-N	1	1	308.334	1.807	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC(C3CC3)(C3CC3)C2)c1	ZINC000595821787	356663597	/nfs/dbraw/zinc/66/35/97/356663597.db2.gz	GCCCJJGFSNILQH-UHFFFAOYSA-N	1	1	306.366	1.682	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1	ZINC000595826784	356666170	/nfs/dbraw/zinc/66/61/70/356666170.db2.gz	IOEKLKUNKQGBAJ-JSGCOSHPSA-N	1	1	320.345	1.850	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)c1	ZINC000595864530	356682907	/nfs/dbraw/zinc/68/29/07/356682907.db2.gz	BQCZIXPAKAMREY-INIZCTEOSA-N	1	1	305.378	1.626	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C2)C1	ZINC000596242810	356829696	/nfs/dbraw/zinc/82/96/96/356829696.db2.gz	ZKLKYILTWWOEJI-HNNXBMFYSA-N	1	1	304.350	1.226	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000596267057	356838911	/nfs/dbraw/zinc/83/89/11/356838911.db2.gz	VPRQCQFBWGCGJA-AOOOYVTPSA-N	1	1	312.757	1.340	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000597856817	357360266	/nfs/dbraw/zinc/36/02/66/357360266.db2.gz	AQPXHTWZPZPRBO-NSHDSACASA-N	1	1	309.370	1.170	20	5		DDBDMO
CCN(C(=O)Cc1cccc([N+](=O)[O-])c1C)[C@H]1CC[N@@H+](C)C1	ZINC000597947572	357396319	/nfs/dbraw/zinc/39/63/19/357396319.db2.gz	ZBUFXGKJFLTBDE-AWEZNQCLSA-N	1	1	305.378	1.998	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[NH+](C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000598594688	357645512	/nfs/dbraw/zinc/64/55/12/357645512.db2.gz	CKAUWZNABQWWCJ-UHFFFAOYSA-N	1	1	320.349	1.451	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598622117	357658152	/nfs/dbraw/zinc/65/81/52/357658152.db2.gz	ZMUDIPLUJBQFMB-GFCCVEGCSA-N	1	1	322.365	1.553	20	5		DDBDMO
Cc1cc(N2CC(CN3CC[NH+](C)CC3)C2)c([N+](=O)[O-])s1	ZINC000599109915	357818395	/nfs/dbraw/zinc/81/83/95/357818395.db2.gz	XMWFHKMZPXILGG-UHFFFAOYSA-N	1	1	310.423	1.648	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H]2C[C@@H](C(N)=O)C2)c([N+](=O)[O-])cc1F	ZINC000599651349	358008463	/nfs/dbraw/zinc/00/84/63/358008463.db2.gz	GIBFDOLTMLIIAC-WAAGHKOSSA-N	1	1	311.313	1.438	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c1	ZINC000599680546	358022457	/nfs/dbraw/zinc/02/24/57/358022457.db2.gz	GBCFAVZVJLQRTJ-DDUYRFODSA-N	1	1	322.361	1.180	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000600470053	358233052	/nfs/dbraw/zinc/23/30/52/358233052.db2.gz	DYRXFMAJAUKHBL-NSHDSACASA-N	1	1	307.354	1.075	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)n1	ZINC000600474011	358234835	/nfs/dbraw/zinc/23/48/35/358234835.db2.gz	WCKNKPKIEPYOEG-LLVKDONJSA-N	1	1	307.354	1.075	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000180838256	199216624	/nfs/dbraw/zinc/21/66/24/199216624.db2.gz	XRPMOQFJBMVXQJ-VIFPVBQESA-N	1	1	307.306	1.005	20	5		DDBDMO
CN(c1c([N+](=O)[O-])c(C(F)(F)F)nn1C)[C@@H]1CCC[N@@H+](C)C1	ZINC000601119849	358410379	/nfs/dbraw/zinc/41/03/79/358410379.db2.gz	XQYMOFLRNWMYCT-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601136472	358416747	/nfs/dbraw/zinc/41/67/47/358416747.db2.gz	FLTNWQYPPPAFOG-JGVFFNPUSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601136472	358416750	/nfs/dbraw/zinc/41/67/50/358416750.db2.gz	FLTNWQYPPPAFOG-JGVFFNPUSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1CN(c2ncc(F)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000601151288	358423258	/nfs/dbraw/zinc/42/32/58/358423258.db2.gz	VJMKLFZJPNBAKO-SNVBAGLBSA-N	1	1	312.345	1.410	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)C[C@@H]2C1	ZINC000601183698	358437749	/nfs/dbraw/zinc/43/77/49/358437749.db2.gz	CNTFDKHEURFBIN-NEPJUHHUSA-N	1	1	313.361	1.926	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@@H]2CC[N@H+](C)C2)c([N+](=O)[O-])s1	ZINC000601434229	358551678	/nfs/dbraw/zinc/55/16/78/358551678.db2.gz	NOIKOOXFYAHVGA-VIFPVBQESA-N	1	1	319.408	1.195	20	5		DDBDMO
C[NH+](C)[C@@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1(C)C	ZINC000602174238	358863592	/nfs/dbraw/zinc/86/35/92/358863592.db2.gz	SQUSVGQQXAZXRV-CHWSQXEVSA-N	1	1	307.350	1.759	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH2+]CCCCN2CCOCC2)cc1	ZINC000602514852	359021246	/nfs/dbraw/zinc/02/12/46/359021246.db2.gz	RBGSCAUTNMANOG-UHFFFAOYSA-N	1	1	307.394	1.839	20	5		DDBDMO
CO[C@]1(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCOC1	ZINC000602472602	359001456	/nfs/dbraw/zinc/00/14/56/359001456.db2.gz	JBTCOSOISMCYIR-DOMZBBRYSA-N	1	1	322.365	1.282	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000602669469	359115147	/nfs/dbraw/zinc/11/51/47/359115147.db2.gz	XOAODBILAHYYAQ-CHWSQXEVSA-N	1	1	308.382	1.967	20	5		DDBDMO
C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CN(C)CCO1	ZINC000602575400	359051421	/nfs/dbraw/zinc/05/14/21/359051421.db2.gz	HJBNSAKSFUQUQE-QMTHXVAHSA-N	1	1	320.349	1.545	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC(C)(C)[C@H]1[C@@H]1CCCO1	ZINC000602835137	359226800	/nfs/dbraw/zinc/22/68/00/359226800.db2.gz	XVKOMGXTCAAMNZ-GXTWGEPZSA-N	1	1	308.382	1.989	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C	ZINC000602829546	359221545	/nfs/dbraw/zinc/22/15/45/359221545.db2.gz	LMOZDJXJHPNZPX-PBWFPOADSA-N	1	1	307.398	1.657	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C1C[C@H]2CC[C@@H](C1)[NH+]2C	ZINC000602829546	359221551	/nfs/dbraw/zinc/22/15/51/359221551.db2.gz	LMOZDJXJHPNZPX-PBWFPOADSA-N	1	1	307.398	1.657	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000186778602	200009349	/nfs/dbraw/zinc/00/93/49/200009349.db2.gz	WIGVZTKVJHAXBD-UHFFFAOYSA-N	1	1	321.377	1.987	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000187041817	200051328	/nfs/dbraw/zinc/05/13/28/200051328.db2.gz	OYZNXPGTUOUNDN-NSHDSACASA-N	1	1	322.365	1.546	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000187273286	200087109	/nfs/dbraw/zinc/08/71/09/200087109.db2.gz	QOMOFGOVFPBIEH-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cnc2C)C1	ZINC000609268853	360286112	/nfs/dbraw/zinc/28/61/12/360286112.db2.gz	GPOWWALPDFSGAM-LBPRGKRZSA-N	1	1	322.365	1.139	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(Cc3csc([N+](=O)[O-])c3)CC2)C1	ZINC000609672351	360342638	/nfs/dbraw/zinc/34/26/38/360342638.db2.gz	BFBVSPAOFBYEFH-AWEZNQCLSA-N	1	1	324.450	1.868	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000609479006	360311070	/nfs/dbraw/zinc/31/10/70/360311070.db2.gz	HJXOLPJPVPIJDT-JTQLQIEISA-N	1	1	307.354	1.094	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000609476806	360311197	/nfs/dbraw/zinc/31/11/97/360311197.db2.gz	VPQJTNKWJOMZQG-VIFPVBQESA-N	1	1	307.354	1.237	20	5		DDBDMO
CCn1cc(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)cn1	ZINC000609826089	360352854	/nfs/dbraw/zinc/35/28/54/360352854.db2.gz	QHXKWIAZPGWLAQ-UHFFFAOYSA-N	1	1	318.333	1.872	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOCC3CC3)CC2)cn1	ZINC000610212751	360390631	/nfs/dbraw/zinc/39/06/31/360390631.db2.gz	XBJVUDVIYVMJLI-UHFFFAOYSA-N	1	1	306.366	1.538	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](CCCO)C2CC2)c([N+](=O)[O-])c1	ZINC000609846189	360354694	/nfs/dbraw/zinc/35/46/94/360354694.db2.gz	XDHYDNUCYYVJDS-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](CCCO)C2CC2)c([N+](=O)[O-])c1	ZINC000609846189	360354700	/nfs/dbraw/zinc/35/47/00/360354700.db2.gz	XDHYDNUCYYVJDS-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](C2CC2)C2CCCCC2)c1	ZINC000610367653	360423244	/nfs/dbraw/zinc/42/32/44/360423244.db2.gz	PRLKUQMPLYNZDW-HNNXBMFYSA-N	1	1	308.382	1.949	20	5		DDBDMO
CC[N@H+]1CCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611092301	360621725	/nfs/dbraw/zinc/62/17/25/360621725.db2.gz	ODQPXSBFMFBKHQ-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCc2cn[nH]c2C1	ZINC000612104123	360921139	/nfs/dbraw/zinc/92/11/39/360921139.db2.gz	CAFQKZNNNVDNCK-GFCCVEGCSA-N	1	1	318.333	1.116	20	5		DDBDMO
CNc1c(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613235006	361341970	/nfs/dbraw/zinc/34/19/70/361341970.db2.gz	LBZPWBGKJCSWPO-MFKMUULPSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613235006	361341975	/nfs/dbraw/zinc/34/19/75/361341975.db2.gz	LBZPWBGKJCSWPO-MFKMUULPSA-N	1	1	322.365	1.085	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CNc2ccnn2C1	ZINC000619265364	363953688	/nfs/dbraw/zinc/95/36/88/363953688.db2.gz	QBTOUDLFZQLZEA-LBPRGKRZSA-N	1	1	301.350	1.965	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@@H]2CCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000271763063	209191684	/nfs/dbraw/zinc/19/16/84/209191684.db2.gz	PFPYHVIJNFOAMJ-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288205025	220017070	/nfs/dbraw/zinc/01/70/70/220017070.db2.gz	CAXGOXISPFUSLE-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCCN(CC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000104530796	194013999	/nfs/dbraw/zinc/01/39/99/194013999.db2.gz	AWTPZUJSPCGTHO-UHFFFAOYSA-N	1	1	319.365	1.885	20	5		DDBDMO
Cc1ccc(CN2CCO[C@H]3CC[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000284719166	218147836	/nfs/dbraw/zinc/14/78/36/218147836.db2.gz	UTHHUGJRDMOMSA-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@H](CO)[N@@H+]1CCCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000339116765	250301282	/nfs/dbraw/zinc/30/12/82/250301282.db2.gz	BCWQEHFEBFOJOR-GFCCVEGCSA-N	1	1	309.366	1.189	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000339116765	250301284	/nfs/dbraw/zinc/30/12/84/250301284.db2.gz	BCWQEHFEBFOJOR-GFCCVEGCSA-N	1	1	309.366	1.189	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCC[C@@H]1CC(N)=O	ZINC000339138255	250310084	/nfs/dbraw/zinc/31/00/84/250310084.db2.gz	ZTPJQTQEMANPEP-GFCCVEGCSA-N	1	1	307.350	1.833	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000567435192	304218558	/nfs/dbraw/zinc/21/85/58/304218558.db2.gz	JPFVJIOMRYWUKH-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000106401011	194207840	/nfs/dbraw/zinc/20/78/40/194207840.db2.gz	KSAMPHPOZUEKAY-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285202322	218330923	/nfs/dbraw/zinc/33/09/23/218330923.db2.gz	OVLGHGZQVVSING-PHIMTYICSA-N	1	1	309.370	1.416	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000106791617	194253348	/nfs/dbraw/zinc/25/33/48/194253348.db2.gz	RUYWCFUMTFOBIK-LBPRGKRZSA-N	1	1	318.377	1.924	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](C)O)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340792998	251215232	/nfs/dbraw/zinc/21/52/32/251215232.db2.gz	RSKKZYYRHIROAK-OCCSQVGLSA-N	1	1	312.366	1.426	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000066137776	184392474	/nfs/dbraw/zinc/39/24/74/184392474.db2.gz	NYNBOBGREXTQHP-JTQLQIEISA-N	1	1	324.337	1.963	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@H](CNC(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000352425675	285041713	/nfs/dbraw/zinc/04/17/13/285041713.db2.gz	MORRKXVFAZCYDC-CQSZACIVSA-N	1	1	321.377	1.952	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@@H]2CCC=CO2)CC1	ZINC000296032887	285166002	/nfs/dbraw/zinc/16/60/02/285166002.db2.gz	OHSYDVYVSNWBPT-ZDUSSCGKSA-N	1	1	304.350	1.805	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@@H](CO)C1	ZINC000248374767	285164283	/nfs/dbraw/zinc/16/42/83/285164283.db2.gz	TYTJKUCFSCMHCS-OLZOCXBDSA-N	1	1	310.350	1.039	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@H]2CCC[C@H]2O)c([N+](=O)[O-])c1	ZINC000352659517	285204027	/nfs/dbraw/zinc/20/40/27/285204027.db2.gz	NQFRHLXOIABREJ-GXTWGEPZSA-N	1	1	310.350	1.827	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC2([NH+]3CCOCC3)CCOCC2)cc1	ZINC000413396576	224188650	/nfs/dbraw/zinc/18/86/50/224188650.db2.gz	FFCQPBMEDFZSBD-UHFFFAOYSA-N	1	1	321.377	1.888	20	5		DDBDMO
COCCCC[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000419378135	533252111	/nfs/dbraw/zinc/25/21/11/533252111.db2.gz	DCLDEVFYBYMZNF-UHFFFAOYSA-N	1	1	309.366	1.916	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-]	ZINC000299441402	533665903	/nfs/dbraw/zinc/66/59/03/533665903.db2.gz	KJQYUKBEXOGCRX-VIFPVBQESA-N	1	1	307.310	1.252	20	5		DDBDMO
C[C@H](CO)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353499269	285771367	/nfs/dbraw/zinc/77/13/67/285771367.db2.gz	CSPAYDOANSEHGE-SMDDNHRTSA-N	1	1	304.350	1.636	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000026711249	406906197	/nfs/dbraw/zinc/90/61/97/406906197.db2.gz	RNABSOVOMPQBII-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000026711249	406906198	/nfs/dbraw/zinc/90/61/98/406906198.db2.gz	RNABSOVOMPQBII-SCRDCRAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[NH+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000076413451	406967838	/nfs/dbraw/zinc/96/78/38/406967838.db2.gz	GXYLFMRRCKOACI-UHFFFAOYSA-N	1	1	317.349	1.782	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1)C1CC1	ZINC000077389314	406989062	/nfs/dbraw/zinc/98/90/62/406989062.db2.gz	BSTJBDGJPSPGDN-UHFFFAOYSA-N	1	1	319.408	1.419	20	5		DDBDMO
CC(=O)N1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000055897376	407207742	/nfs/dbraw/zinc/20/77/42/407207742.db2.gz	WIRPTCDEBRCVHE-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000124134788	407349856	/nfs/dbraw/zinc/34/98/56/407349856.db2.gz	VBHZHDNBKSZFOV-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000124134788	407349858	/nfs/dbraw/zinc/34/98/58/407349858.db2.gz	VBHZHDNBKSZFOV-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000103283666	407336315	/nfs/dbraw/zinc/33/63/15/407336315.db2.gz	ROGFRWFIJNZMQZ-STQMWFEESA-N	1	1	321.377	1.950	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000124811744	407370225	/nfs/dbraw/zinc/37/02/25/407370225.db2.gz	LLPVMHOMXAFNEL-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](CC(=O)N(C)C)CC2)n1	ZINC000125403060	407387259	/nfs/dbraw/zinc/38/72/59/407387259.db2.gz	UXESFWBEDMCUAC-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000107892518	407381133	/nfs/dbraw/zinc/38/11/33/407381133.db2.gz	AGVLSJVTKKGBLC-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000170782846	407503009	/nfs/dbraw/zinc/50/30/09/407503009.db2.gz	SMJDWJYNUCIBBU-NSHDSACASA-N	1	1	322.365	1.298	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271087333	407507600	/nfs/dbraw/zinc/50/76/00/407507600.db2.gz	HHESQRVOXDFPQW-GFCCVEGCSA-N	1	1	323.397	1.570	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000185973960	407557685	/nfs/dbraw/zinc/55/76/85/407557685.db2.gz	PTKVMDNXRUNWII-ZFWWWQNUSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000185973960	407557691	/nfs/dbraw/zinc/55/76/91/407557691.db2.gz	PTKVMDNXRUNWII-ZFWWWQNUSA-N	1	1	307.350	1.358	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000266111909	407532472	/nfs/dbraw/zinc/53/24/72/407532472.db2.gz	VGVKNXXJQLGLJW-MWLCHTKSSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000266111909	407532478	/nfs/dbraw/zinc/53/24/78/407532478.db2.gz	VGVKNXXJQLGLJW-MWLCHTKSSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@H](C)C1	ZINC000266111909	407532484	/nfs/dbraw/zinc/53/24/84/407532484.db2.gz	VGVKNXXJQLGLJW-MWLCHTKSSA-N	1	1	309.370	1.429	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000114063542	407540099	/nfs/dbraw/zinc/54/00/99/407540099.db2.gz	BYOAASGWJBPKBY-LLVKDONJSA-N	1	1	323.349	1.664	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271152508	407540366	/nfs/dbraw/zinc/54/03/66/407540366.db2.gz	ITQUOXXUPVTEFU-AWEZNQCLSA-N	1	1	309.366	1.332	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+](C)CC[C@H](C)O)cccc1[N+](=O)[O-]	ZINC000266715973	407612092	/nfs/dbraw/zinc/61/20/92/407612092.db2.gz	FZJDZVBFMYRHMB-CMPLNLGQSA-N	1	1	309.366	1.933	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@@H]1O	ZINC000271347250	407647641	/nfs/dbraw/zinc/64/76/41/407647641.db2.gz	PGOWBHLFANAJPY-GWCFXTLKSA-N	1	1	310.350	1.815	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000115439649	407681379	/nfs/dbraw/zinc/68/13/79/407681379.db2.gz	SATXPXGZKKXFRT-ZDUSSCGKSA-N	1	1	320.393	1.807	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000230142542	407682708	/nfs/dbraw/zinc/68/27/08/407682708.db2.gz	CETQWCZGDSOHQG-UHFFFAOYSA-N	1	1	306.771	1.773	20	5		DDBDMO
CCC(=O)N[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000130384221	407683938	/nfs/dbraw/zinc/68/39/38/407683938.db2.gz	KIRUGGZGXTZFRZ-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1ncsc1C[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000179213160	407756018	/nfs/dbraw/zinc/75/60/18/407756018.db2.gz	PSFOHTFZIMZMGB-UHFFFAOYSA-N	1	1	308.363	1.653	20	5		DDBDMO
Cc1ncsc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000179213160	407756022	/nfs/dbraw/zinc/75/60/22/407756022.db2.gz	PSFOHTFZIMZMGB-UHFFFAOYSA-N	1	1	308.363	1.653	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000171809616	407773379	/nfs/dbraw/zinc/77/33/79/407773379.db2.gz	QRLBGLQSJMWMTL-UHFFFAOYSA-N	1	1	309.370	1.294	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc[nH+]c(N(C)C)c1	ZINC000267251694	407806009	/nfs/dbraw/zinc/80/60/09/407806009.db2.gz	OGZHVLCMIJJICC-UHFFFAOYSA-N	1	1	304.310	1.199	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1	ZINC000272327758	407870406	/nfs/dbraw/zinc/87/04/06/407870406.db2.gz	MWTBJAVEHRDNLF-UHFFFAOYSA-N	1	1	321.333	1.491	20	5		DDBDMO
C[C@@H]1Cc2ccccc2C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000173801517	407897765	/nfs/dbraw/zinc/89/77/65/407897765.db2.gz	GLQMLHMIUYTUQV-WBMJQRKESA-N	1	1	316.361	1.599	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000154060434	407966447	/nfs/dbraw/zinc/96/64/47/407966447.db2.gz	OOHUVZBFGXWWDP-AWEZNQCLSA-N	1	1	321.377	1.772	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000268276226	407981401	/nfs/dbraw/zinc/98/14/01/407981401.db2.gz	WGHODFVLYIRGOD-XHDPSFHLSA-N	1	1	303.362	1.736	20	5		DDBDMO
C[C@@H]1CSCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000190451049	408247575	/nfs/dbraw/zinc/24/75/75/408247575.db2.gz	QSXMNISTQQEOBK-JTQLQIEISA-N	1	1	309.391	1.879	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O	ZINC000246736799	408327601	/nfs/dbraw/zinc/32/76/01/408327601.db2.gz	FXMPYNZSXRJGBW-JSGCOSHPSA-N	1	1	321.377	1.512	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H](C[N@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000176086678	408282535	/nfs/dbraw/zinc/28/25/35/408282535.db2.gz	RFVXITRVHUGMQD-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H](C[N@@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000176086678	408282542	/nfs/dbraw/zinc/28/25/42/408282542.db2.gz	RFVXITRVHUGMQD-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H](C[N@H+](C)CC)C2)c1[N+](=O)[O-]	ZINC000176086678	408282544	/nfs/dbraw/zinc/28/25/44/408282544.db2.gz	RFVXITRVHUGMQD-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000269390663	408291894	/nfs/dbraw/zinc/29/18/94/408291894.db2.gz	RHAFSSABJVZSFO-MNOVXSKESA-N	1	1	321.381	1.798	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC[C@@H](c2[nH]cc[nH+]2)C1	ZINC000263902013	408307185	/nfs/dbraw/zinc/30/71/85/408307185.db2.gz	BQWOQZPEQPAXAJ-SECBINFHSA-N	1	1	316.321	1.196	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000183196548	408348868	/nfs/dbraw/zinc/34/88/68/408348868.db2.gz	QYLOCRBARMMPDC-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269549192	408351086	/nfs/dbraw/zinc/35/10/86/408351086.db2.gz	XJARPNMCFVNIPB-QWRGUYRKSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269549192	408351092	/nfs/dbraw/zinc/35/10/92/408351092.db2.gz	XJARPNMCFVNIPB-QWRGUYRKSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269549192	408351095	/nfs/dbraw/zinc/35/10/95/408351095.db2.gz	XJARPNMCFVNIPB-QWRGUYRKSA-N	1	1	323.397	1.854	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000171807615	162243286	/nfs/dbraw/zinc/24/32/86/162243286.db2.gz	FWNHPVVADIPLJZ-SNVBAGLBSA-N	1	1	307.354	1.191	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@H]1CCC[C@@H]1O	ZINC000159532989	408414429	/nfs/dbraw/zinc/41/44/29/408414429.db2.gz	BNBSKHRHMQIHPM-JSGCOSHPSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@@H]1O	ZINC000159532989	408414437	/nfs/dbraw/zinc/41/44/37/408414437.db2.gz	BNBSKHRHMQIHPM-JSGCOSHPSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc(N[C@@H](C)CCN2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000274526537	408439231	/nfs/dbraw/zinc/43/92/31/408439231.db2.gz	XSVCGDVLLBPTMK-ZDUSSCGKSA-N	1	1	307.398	1.736	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@]3(CC=CCC3)C2)c1	ZINC000247707397	408505182	/nfs/dbraw/zinc/50/51/82/408505182.db2.gz	ZHBOBZRHYAULQB-HZPDHXFCSA-N	1	1	320.393	1.975	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248441389	408565020	/nfs/dbraw/zinc/56/50/20/408565020.db2.gz	DQGXXAUHODJIDV-HZSPNIEDSA-N	1	1	324.377	1.570	20	5		DDBDMO
COc1cc(C[N@H+](C)CC(C)(CO)CO)c([N+](=O)[O-])cc1F	ZINC000184239158	408575508	/nfs/dbraw/zinc/57/55/08/408575508.db2.gz	RFOYNCLXWFNORO-UHFFFAOYSA-N	1	1	316.329	1.165	20	5		DDBDMO
COc1cc(C[N@@H+](C)CC(C)(CO)CO)c([N+](=O)[O-])cc1F	ZINC000184239158	408575513	/nfs/dbraw/zinc/57/55/13/408575513.db2.gz	RFOYNCLXWFNORO-UHFFFAOYSA-N	1	1	316.329	1.165	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cnc1N)C1CCCC1	ZINC000184383712	408602132	/nfs/dbraw/zinc/60/21/32/408602132.db2.gz	UFXWIHPJMTUUSD-UHFFFAOYSA-N	1	1	307.354	1.176	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000192506102	408600717	/nfs/dbraw/zinc/60/07/17/408600717.db2.gz	DXDULVNLEWDGIB-RNBGUABESA-N	1	1	301.346	1.628	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+](CCO)C2CCOCC2)c1	ZINC000275615712	408620236	/nfs/dbraw/zinc/62/02/36/408620236.db2.gz	SZXRRCRUZUXBID-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CC(C)OC(=O)C[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000184453445	408620396	/nfs/dbraw/zinc/62/03/96/408620396.db2.gz	XTUUMZBHAFCUBC-ZDUSSCGKSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC[C@H](NC(=O)[C@H]1C[N@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796398	408715638	/nfs/dbraw/zinc/71/56/38/408715638.db2.gz	QNEJPXFNMUPRQG-UONOGXRCSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[C@H](NC(=O)[C@H]1C[N@@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796398	408715645	/nfs/dbraw/zinc/71/56/45/408715645.db2.gz	QNEJPXFNMUPRQG-UONOGXRCSA-N	1	1	307.350	1.493	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000265756983	408772575	/nfs/dbraw/zinc/77/25/75/408772575.db2.gz	GITOOJMKOJQUNZ-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H](C(=O)NC[C@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000185183489	408775642	/nfs/dbraw/zinc/77/56/42/408775642.db2.gz	NWUZMFDDRQWAGM-GHMZBOCLSA-N	1	1	309.341	1.905	20	5		DDBDMO
O=C(CC[N@H+](CCO)C1CCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000281948426	408959033	/nfs/dbraw/zinc/95/90/33/408959033.db2.gz	FKRIWPOPCUFQMI-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000246122141	163458788	/nfs/dbraw/zinc/45/87/88/163458788.db2.gz	NMZBZPAPDWCOTL-UKRRQHHQSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1(CO)CCC1	ZINC000292261202	409011838	/nfs/dbraw/zinc/01/18/38/409011838.db2.gz	YRJZBCFBZHUFDC-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1(CO)CCC1	ZINC000292261202	409011841	/nfs/dbraw/zinc/01/18/41/409011841.db2.gz	YRJZBCFBZHUFDC-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@H]1[C@H]([NH+]2CCCC2)CCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000287306780	409016307	/nfs/dbraw/zinc/01/63/07/409016307.db2.gz	UNXZXRSNFZCFKW-IAQYHMDHSA-N	1	1	319.361	1.999	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](O)CC3)n2)cc1	ZINC000293269559	409079606	/nfs/dbraw/zinc/07/96/06/409079606.db2.gz	UVRDGSZVUWRKOD-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](O)CC3)n2)cc1	ZINC000293269559	409079610	/nfs/dbraw/zinc/07/96/10/409079610.db2.gz	UVRDGSZVUWRKOD-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+](C)C2)c1	ZINC000283411235	409151559	/nfs/dbraw/zinc/15/15/59/409151559.db2.gz	HYTWVARPICUUDJ-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@H](C)[N@H+]1C	ZINC000294115413	409243096	/nfs/dbraw/zinc/24/30/96/409243096.db2.gz	ZIRXMKIUXDDCJZ-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C[C@H](C)[N@@H+]1C	ZINC000294115413	409243098	/nfs/dbraw/zinc/24/30/98/409243098.db2.gz	ZIRXMKIUXDDCJZ-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCCN1CCN(C)CC1	ZINC000289375225	409256844	/nfs/dbraw/zinc/25/68/44/409256844.db2.gz	BSFDQNHTOCTOFF-UHFFFAOYSA-N	1	1	320.437	1.973	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCCN1CCN(C)CC1	ZINC000289375225	409256846	/nfs/dbraw/zinc/25/68/46/409256846.db2.gz	BSFDQNHTOCTOFF-UHFFFAOYSA-N	1	1	320.437	1.973	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355625	409297875	/nfs/dbraw/zinc/29/78/75/409297875.db2.gz	INBBEKHMKYFMFE-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCO2	ZINC000280355625	409297878	/nfs/dbraw/zinc/29/78/78/409297878.db2.gz	INBBEKHMKYFMFE-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CC(N)=O)c1ccccc1	ZINC000280552668	409356219	/nfs/dbraw/zinc/35/62/19/409356219.db2.gz	QOLNLTLCHXZCDS-CYBMUJFWSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[C@@H]1CCOCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000373280173	164169399	/nfs/dbraw/zinc/16/93/99/164169399.db2.gz	JMGOGFHUOUVIAQ-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000354081312	409636388	/nfs/dbraw/zinc/63/63/88/409636388.db2.gz	DAJYRUQQQBEKJD-UHFFFAOYSA-N	1	1	309.370	1.079	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000345043248	409602873	/nfs/dbraw/zinc/60/28/73/409602873.db2.gz	GIYCFNXHGKJRRY-JTQLQIEISA-N	1	1	314.773	1.536	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)CC[N@H+]1CCOC	ZINC000296923781	409709262	/nfs/dbraw/zinc/70/92/62/409709262.db2.gz	AVFAXAYQNGQORS-GFCCVEGCSA-N	1	1	309.370	1.240	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC000342783807	409903838	/nfs/dbraw/zinc/90/38/38/409903838.db2.gz	JUWLTVCTVIYAHA-FOSCPWQOSA-N	1	1	321.381	1.508	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000317099097	409862583	/nfs/dbraw/zinc/86/25/83/409862583.db2.gz	BIAQNKFBILJHQE-PWSUYJOCSA-N	1	1	306.366	1.849	20	5		DDBDMO
O=C([C@@H]1CC[NH2+]CC1(F)F)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000342758492	409883799	/nfs/dbraw/zinc/88/37/99/409883799.db2.gz	XMEWIDYOTRAFNV-JTQLQIEISA-N	1	1	311.288	1.729	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)C1	ZINC000342870934	409962437	/nfs/dbraw/zinc/96/24/37/409962437.db2.gz	BXMBYNJVOBLLNZ-SNVBAGLBSA-N	1	1	302.334	1.758	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000342880489	409968843	/nfs/dbraw/zinc/96/88/43/409968843.db2.gz	IYAOBOMUWNYMKK-UHFFFAOYSA-N	1	1	320.349	1.384	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CC[N@@H+](C3CC3)C2)c1	ZINC000354623294	409973687	/nfs/dbraw/zinc/97/36/87/409973687.db2.gz	MBAQRRFIYKJIDQ-SNVBAGLBSA-N	1	1	311.363	1.110	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000354623294	409973693	/nfs/dbraw/zinc/97/36/93/409973693.db2.gz	MBAQRRFIYKJIDQ-SNVBAGLBSA-N	1	1	311.363	1.110	20	5		DDBDMO
COC(=O)c1cc(C(=O)NCC[N@@H+](C)C(C)C)cc([N+](=O)[O-])c1	ZINC000338422076	409976255	/nfs/dbraw/zinc/97/62/55/409976255.db2.gz	KZAJMCMROABGQD-UHFFFAOYSA-N	1	1	323.349	1.451	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354630933	409979779	/nfs/dbraw/zinc/97/97/79/409979779.db2.gz	WRYSSJZDLMOFIV-UHFFFAOYSA-N	1	1	315.395	1.605	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1OC[C@H](O)C[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000339322364	410089922	/nfs/dbraw/zinc/08/99/22/410089922.db2.gz	ZPEPUSSEUVKUTB-KCQAQPDRSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@H]1CN(CC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CCO1	ZINC000332585872	410185049	/nfs/dbraw/zinc/18/50/49/410185049.db2.gz	HRAPPWSIXVKDJF-LBPRGKRZSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@H]1CN(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CCO1	ZINC000332585872	410185053	/nfs/dbraw/zinc/18/50/53/410185053.db2.gz	HRAPPWSIXVKDJF-LBPRGKRZSA-N	1	1	306.366	1.069	20	5		DDBDMO
CN(C)c1nc(N2CCOc3ccc([N+](=O)[O-])cc3C2)cc[nH+]1	ZINC000357827414	410274577	/nfs/dbraw/zinc/27/45/77/410274577.db2.gz	NDCPQUULQMCLJW-UHFFFAOYSA-N	1	1	315.333	1.850	20	5		DDBDMO
CCOc1ccc([C@H](C)NC[C@@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358251982	410419917	/nfs/dbraw/zinc/41/99/17/410419917.db2.gz	NDFMMNRJFANMOT-LRDDRELGSA-N	1	1	323.393	1.711	20	5		DDBDMO
CCOc1ccc([C@H](C)[NH2+]C[C@@]2(O)CCN(C)C2)cc1[N+](=O)[O-]	ZINC000358251982	410419923	/nfs/dbraw/zinc/41/99/23/410419923.db2.gz	NDFMMNRJFANMOT-LRDDRELGSA-N	1	1	323.393	1.711	20	5		DDBDMO
COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@@H](C)C(N)=O	ZINC000347313628	410463863	/nfs/dbraw/zinc/46/38/63/410463863.db2.gz	IIUHGGSENQCYKO-SUIFULHWSA-N	1	1	321.377	1.820	20	5		DDBDMO
COCC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)[C@@H](C)C(N)=O	ZINC000347313628	410463865	/nfs/dbraw/zinc/46/38/65/410463865.db2.gz	IIUHGGSENQCYKO-SUIFULHWSA-N	1	1	321.377	1.820	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000299015268	410486109	/nfs/dbraw/zinc/48/61/09/410486109.db2.gz	QQVBMPDLQAPTEH-UHFFFAOYSA-N	1	1	302.334	1.849	20	5		DDBDMO
COC1CC([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000352231084	410565730	/nfs/dbraw/zinc/56/57/30/410565730.db2.gz	ORGBHTCMHRWAQX-UHFFFAOYSA-N	1	1	307.350	1.951	20	5		DDBDMO
COC1CC([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000352231084	410565735	/nfs/dbraw/zinc/56/57/35/410565735.db2.gz	ORGBHTCMHRWAQX-UHFFFAOYSA-N	1	1	307.350	1.951	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000299246880	410578328	/nfs/dbraw/zinc/57/83/28/410578328.db2.gz	ZNZYZGNMRJXYML-UHFFFAOYSA-N	1	1	307.350	1.389	20	5		DDBDMO
CC(C)C[C@@H](CNc1ncc([N+](=O)[O-])c(N)n1)[NH+]1CCOCC1	ZINC000301124062	410662218	/nfs/dbraw/zinc/66/22/18/410662218.db2.gz	VDTKCSOLLJFGJV-NSHDSACASA-N	1	1	324.385	1.126	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000301212218	410679000	/nfs/dbraw/zinc/67/90/00/410679000.db2.gz	XLTXFZYIEXFZKO-JTQLQIEISA-N	1	1	319.365	1.518	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000330572847	410788913	/nfs/dbraw/zinc/78/89/13/410788913.db2.gz	DTAOXANNMQNKOY-OLZOCXBDSA-N	1	1	320.393	1.866	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2C)[N@H+](C)C1	ZINC000330586910	410801430	/nfs/dbraw/zinc/80/14/30/410801430.db2.gz	WZWRLYRPSQCZLL-JSGCOSHPSA-N	1	1	307.350	1.239	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)NCc2cccc([N+](=O)[O-])c2C)[N@@H+](C)C1	ZINC000330586910	410801445	/nfs/dbraw/zinc/80/14/45/410801445.db2.gz	WZWRLYRPSQCZLL-JSGCOSHPSA-N	1	1	307.350	1.239	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000344054460	410923116	/nfs/dbraw/zinc/92/31/16/410923116.db2.gz	IXZSRJJQWUKLAJ-WHOFXGATSA-N	1	1	322.361	1.685	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000331113754	410957805	/nfs/dbraw/zinc/95/78/05/410957805.db2.gz	JKJYWGGVMMUSOP-SECBINFHSA-N	1	1	313.304	1.578	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000331113754	410957807	/nfs/dbraw/zinc/95/78/07/410957807.db2.gz	JKJYWGGVMMUSOP-SECBINFHSA-N	1	1	313.304	1.578	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000331125793	410965255	/nfs/dbraw/zinc/96/52/55/410965255.db2.gz	HQRADMAHUDFHLH-OAHLLOKOSA-N	1	1	321.377	1.772	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000359947545	410966270	/nfs/dbraw/zinc/96/62/70/410966270.db2.gz	BSOFMWVIXBKDJG-JTQLQIEISA-N	1	1	308.338	1.300	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@H](C[NH+]2CCCCCC2)C1	ZINC000360221014	411106023	/nfs/dbraw/zinc/10/60/23/411106023.db2.gz	CKHJPGCUOBCYFM-RBSFLKMASA-N	1	1	309.410	1.766	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCc3ccccc3[C@H]2CO)n1	ZINC000130866097	196117960	/nfs/dbraw/zinc/11/79/60/196117960.db2.gz	SOMAIPSBEVAFIL-CQSZACIVSA-N	1	1	302.334	1.383	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000362068728	307012606	/nfs/dbraw/zinc/01/26/06/307012606.db2.gz	CPMRGUWYRXHPAV-VXGBXAGGSA-N	1	1	307.350	1.118	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H](C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC000134065998	196358434	/nfs/dbraw/zinc/35/84/34/196358434.db2.gz	IBGZSPCMMYGAPS-CYBMUJFWSA-N	1	1	321.377	1.601	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC1	ZINC000360449309	418438317	/nfs/dbraw/zinc/43/83/17/418438317.db2.gz	QIGNIUMJCHXUHA-UHFFFAOYSA-N	1	1	320.393	1.981	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)CCCn2cc[nH+]c2C)n1	ZINC000191864067	222111331	/nfs/dbraw/zinc/11/13/31/222111331.db2.gz	FPONZRNHAATEPV-UHFFFAOYSA-N	1	1	320.353	1.478	20	5		DDBDMO
O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000195190702	222193199	/nfs/dbraw/zinc/19/31/99/222193199.db2.gz	XAOYPCVFGWFEDS-GFCCVEGCSA-N	1	1	314.345	1.996	20	5		DDBDMO
CO[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371884	418639130	/nfs/dbraw/zinc/63/91/30/418639130.db2.gz	JEAOLWLJVZJYHA-ZIAGYGMSSA-N	1	1	305.334	1.421	20	5		DDBDMO
CO[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000361371884	418639131	/nfs/dbraw/zinc/63/91/31/418639131.db2.gz	JEAOLWLJVZJYHA-ZIAGYGMSSA-N	1	1	305.334	1.421	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000361588125	418687897	/nfs/dbraw/zinc/68/78/97/418687897.db2.gz	XQZHCFNGGAAHAH-BBRMVZONSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[N@@H+]2CCCC[C@@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056013	418783871	/nfs/dbraw/zinc/78/38/71/418783871.db2.gz	ZXDBQFPOGNWTQW-GHMZBOCLSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056013	418783873	/nfs/dbraw/zinc/78/38/73/418783873.db2.gz	ZXDBQFPOGNWTQW-GHMZBOCLSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000371372159	418785536	/nfs/dbraw/zinc/78/55/36/418785536.db2.gz	VTLXCJRIQNWDBQ-CQSZACIVSA-N	1	1	315.333	1.094	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000371372159	418785538	/nfs/dbraw/zinc/78/55/38/418785538.db2.gz	VTLXCJRIQNWDBQ-CQSZACIVSA-N	1	1	315.333	1.094	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000408102231	418787388	/nfs/dbraw/zinc/78/73/88/418787388.db2.gz	BYOHAAPZWDSVHM-VIFPVBQESA-N	1	1	303.322	1.384	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000364924586	418822838	/nfs/dbraw/zinc/82/28/38/418822838.db2.gz	AXJYWWQSPNTYKW-SNPRPXQTSA-N	1	1	303.362	1.723	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)NC)C1	ZINC000420968514	419391026	/nfs/dbraw/zinc/39/10/26/419391026.db2.gz	CBAUIEUKQBPRAV-LLVKDONJSA-N	1	1	307.350	1.561	20	5		DDBDMO
Cc1c(CNC(=O)NCC(F)(F)C[NH3+])cccc1[N+](=O)[O-]	ZINC000418085312	419520610	/nfs/dbraw/zinc/52/06/10/419520610.db2.gz	XOMLLGPWYWEQOW-UHFFFAOYSA-N	1	1	302.281	1.296	20	5		DDBDMO
COc1ccc(CN2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000418106336	419534308	/nfs/dbraw/zinc/53/43/08/419534308.db2.gz	CDQSITYMUYCZLW-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000421237753	419534731	/nfs/dbraw/zinc/53/47/31/419534731.db2.gz	LBQFJLADEOKKBT-ZDUSSCGKSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000418109209	419537423	/nfs/dbraw/zinc/53/74/23/419537423.db2.gz	HXOVKGSHVRNCKP-IPKOWEFYSA-N	1	1	319.405	1.995	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C[C@H]2C1	ZINC000427780013	419733995	/nfs/dbraw/zinc/73/39/95/419733995.db2.gz	QAOQVUQYCZQCJC-TXEJJXNPSA-N	1	1	307.325	1.296	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCC(F)(F)C[NH3+]	ZINC000418527809	419858821	/nfs/dbraw/zinc/85/88/21/419858821.db2.gz	UJVIKIKLDKQAPX-UHFFFAOYSA-N	1	1	302.281	1.330	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@H]2[C@@H](C)CCN[C@H]2C)c([N+](=O)[O-])c1	ZINC000420364685	420237706	/nfs/dbraw/zinc/23/77/06/420237706.db2.gz	KLBYWHVIRVIXEP-MQIPJXDCSA-N	1	1	323.393	1.958	20	5		DDBDMO
CNC(=O)c1ccc(N(C)C[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000420629993	420334541	/nfs/dbraw/zinc/33/45/41/420334541.db2.gz	DATJHWNBJKYMSK-GFCCVEGCSA-N	1	1	306.366	1.485	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000416493202	420392882	/nfs/dbraw/zinc/39/28/82/420392882.db2.gz	CXVPPMXMZNOPII-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@H+]2CCCC2(C)C)c1[N+](=O)[O-]	ZINC000457070360	420601828	/nfs/dbraw/zinc/60/18/28/420601828.db2.gz	GOGRTRSTWNPANE-UHFFFAOYSA-N	1	1	309.370	1.241	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000450957339	420569985	/nfs/dbraw/zinc/56/99/85/420569985.db2.gz	UESGXLNEGPUQLI-JTQLQIEISA-N	1	1	307.354	1.008	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H](O)[C@H](CO)C2)o1	ZINC000459712828	420854982	/nfs/dbraw/zinc/85/49/82/420854982.db2.gz	RTXHBDLSVLIVMA-XHDPSFHLSA-N	1	1	318.329	1.640	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@](O)(CO)C1	ZINC000459727664	420858397	/nfs/dbraw/zinc/85/83/97/420858397.db2.gz	RADGWICRIFVNAM-WDBUWWRISA-N	1	1	306.362	1.817	20	5		DDBDMO
CC1(C)[NH2+]CC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000449749699	421075140	/nfs/dbraw/zinc/07/51/40/421075140.db2.gz	GSJFRTDPOGCROD-NSHDSACASA-N	1	1	303.322	1.341	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000489396196	421152475	/nfs/dbraw/zinc/15/24/75/421152475.db2.gz	MJYDABSNKUOQSS-CYBMUJFWSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)C[C@H]1[NH+]1CCOCC1	ZINC000450388645	421191161	/nfs/dbraw/zinc/19/11/61/421191161.db2.gz	IKMBISLBKFSKEU-GXTWGEPZSA-N	1	1	321.381	1.240	20	5		DDBDMO
COc1ccc(CC(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000525524752	421292674	/nfs/dbraw/zinc/29/26/74/421292674.db2.gz	JHXJAXUSJHUEMV-CYBMUJFWSA-N	1	1	321.377	1.699	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000548442488	421439354	/nfs/dbraw/zinc/43/93/54/421439354.db2.gz	AIPCYKFBIHBBSO-OAHLLOKOSA-N	1	1	308.334	1.267	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000548442488	421439358	/nfs/dbraw/zinc/43/93/58/421439358.db2.gz	AIPCYKFBIHBBSO-OAHLLOKOSA-N	1	1	308.334	1.267	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCC2)O1	ZINC000563080878	421452593	/nfs/dbraw/zinc/45/25/93/421452593.db2.gz	IHAQWKIPSPSCOG-LBPRGKRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCC2)O1	ZINC000563080878	421452594	/nfs/dbraw/zinc/45/25/94/421452594.db2.gz	IHAQWKIPSPSCOG-LBPRGKRZSA-N	1	1	307.350	1.400	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000531482988	421635207	/nfs/dbraw/zinc/63/52/07/421635207.db2.gz	JXPUARZCZCYKNO-CMPLNLGQSA-N	1	1	318.377	1.992	20	5		DDBDMO
O=C(Nc1c[nH+]ccc1-n1cccn1)c1ccc([N+](=O)[O-])cn1	ZINC000532392317	421659294	/nfs/dbraw/zinc/65/92/94/421659294.db2.gz	FAFPLQLMYCMIDW-UHFFFAOYSA-N	1	1	310.273	1.823	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1(C)C	ZINC000574583341	422140242	/nfs/dbraw/zinc/14/02/42/422140242.db2.gz	IBVJICAEIAQGTL-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1(C)C	ZINC000574583341	422140243	/nfs/dbraw/zinc/14/02/43/422140243.db2.gz	IBVJICAEIAQGTL-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1C[C@@H](C)O	ZINC000574857980	422196282	/nfs/dbraw/zinc/19/62/82/422196282.db2.gz	OSHACRCQLAQGLC-MNOVXSKESA-N	1	1	312.345	1.410	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1C[C@@H](C)O	ZINC000574857980	422196289	/nfs/dbraw/zinc/19/62/89/422196289.db2.gz	OSHACRCQLAQGLC-MNOVXSKESA-N	1	1	312.345	1.410	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N(C)C[C@@H]1C[C@H](OC)C[N@H+]1C	ZINC000578663572	422621701	/nfs/dbraw/zinc/62/17/01/422621701.db2.gz	QJZQSUSWAPVVAM-RYUDHWBXSA-N	1	1	311.386	1.275	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C	ZINC000344593445	272066458	/nfs/dbraw/zinc/06/64/58/272066458.db2.gz	CCUIQKISQUWMBO-GFCCVEGCSA-N	1	1	323.397	1.336	20	5		DDBDMO
CC(C)CC[C@@H](O)C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298146612	273509237	/nfs/dbraw/zinc/50/92/37/273509237.db2.gz	RFQPMBBMGNTMFF-CQSZACIVSA-N	1	1	322.409	1.909	20	5		DDBDMO
COCC[N@@H+]1CCN(c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000266443984	274030664	/nfs/dbraw/zinc/03/06/64/274030664.db2.gz	WNDAFMBMUUTCMA-GFCCVEGCSA-N	1	1	309.366	1.760	20	5		DDBDMO
COCC[N@H+]1CCN(c2cc(OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000266443984	274030665	/nfs/dbraw/zinc/03/06/65/274030665.db2.gz	WNDAFMBMUUTCMA-GFCCVEGCSA-N	1	1	309.366	1.760	20	5		DDBDMO
C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000182689188	274336150	/nfs/dbraw/zinc/33/61/50/274336150.db2.gz	CNIDEYGKRCTDMW-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC(C)([NH2+]CC(=O)NC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000298124516	275552400	/nfs/dbraw/zinc/55/24/00/275552400.db2.gz	KNKIAHSPWIFFSK-GFCCVEGCSA-N	1	1	321.377	1.715	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000429695775	277142481	/nfs/dbraw/zinc/14/24/81/277142481.db2.gz	IGIJXLLQGVAEKF-OAHLLOKOSA-N	1	1	308.334	1.483	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000285380469	277152725	/nfs/dbraw/zinc/15/27/25/277152725.db2.gz	WLXVHSFMWGBZFQ-KBPBESRZSA-N	1	1	305.334	1.140	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1c(N)cccc1[N+](=O)[O-])C2	ZINC000180835443	277215213	/nfs/dbraw/zinc/21/52/13/277215213.db2.gz	BUHVYSOMIGZUJH-WDEREUQCSA-N	1	1	304.350	1.486	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](C2CCOCC2)C1	ZINC000362471778	300072106	/nfs/dbraw/zinc/07/21/06/300072106.db2.gz	SSNJAWXJCZQIKV-AWEZNQCLSA-N	1	1	321.377	1.505	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000363265558	300242092	/nfs/dbraw/zinc/24/20/92/300242092.db2.gz	FYFAKBOAEKPFSW-GJZGRUSLSA-N	1	1	319.361	1.117	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000368587930	301059397	/nfs/dbraw/zinc/05/93/97/301059397.db2.gz	BUQQVMYWXKYPHJ-GXTWGEPZSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000368596674	301061134	/nfs/dbraw/zinc/06/11/34/301061134.db2.gz	VVHQXTMTTFQXKN-IUODEOHRSA-N	1	1	303.362	1.690	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000368964177	301111382	/nfs/dbraw/zinc/11/13/82/301111382.db2.gz	NDCQJJJAVVZLIA-ZOWXZIJZSA-N	1	1	319.361	1.559	20	5		DDBDMO
C[NH+]1CCN(C[C@@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000369028594	301121882	/nfs/dbraw/zinc/12/18/82/301121882.db2.gz	XHQWPJFHGWCGLR-AWEZNQCLSA-N	1	1	319.409	1.454	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000370045341	301265146	/nfs/dbraw/zinc/26/51/46/301265146.db2.gz	KYXDZWRJKJQYTJ-UHFFFAOYSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000537598612	303375200	/nfs/dbraw/zinc/37/52/00/303375200.db2.gz	OKDKOLQQSGPOCL-NSHDSACASA-N	1	1	311.769	1.859	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](c2ccncn2)C1	ZINC000363496451	307029720	/nfs/dbraw/zinc/02/97/20/307029720.db2.gz	PZCDQEPXOXMIQY-LLVKDONJSA-N	1	1	302.338	1.498	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](c2ccncn2)C1	ZINC000363496451	307029721	/nfs/dbraw/zinc/02/97/21/307029721.db2.gz	PZCDQEPXOXMIQY-LLVKDONJSA-N	1	1	302.338	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000368813319	307110390	/nfs/dbraw/zinc/11/03/90/307110390.db2.gz	FLKNFBMWDIWPML-SJDLMVEWSA-N	1	1	303.362	1.624	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCN2CCOC[C@H]2C1	ZINC000368813319	307110391	/nfs/dbraw/zinc/11/03/91/307110391.db2.gz	FLKNFBMWDIWPML-SJDLMVEWSA-N	1	1	303.362	1.624	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@@H]2CCc3[nH+]c[nH]c3C2)nc2sccn21	ZINC000370861359	307138534	/nfs/dbraw/zinc/13/85/34/307138534.db2.gz	MUEURBKEJDHIKI-SSDOTTSWSA-N	1	1	304.335	1.997	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](CCO[C@@H]3CCCCO3)C2)c1	ZINC000373107709	307178915	/nfs/dbraw/zinc/17/89/15/307178915.db2.gz	WBPSBGHYKJVNMN-UKRRQHHQSA-N	1	1	324.381	1.971	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CN[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168847	308263951	/nfs/dbraw/zinc/26/39/51/308263951.db2.gz	KUTFCXRCVTYYPU-DOMZBBRYSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@@H](O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168847	308263952	/nfs/dbraw/zinc/26/39/52/308263952.db2.gz	KUTFCXRCVTYYPU-DOMZBBRYSA-N	1	1	311.382	1.185	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cnc2cc3ccccc3cc2c1=O	ZINC000582616703	337115296	/nfs/dbraw/zinc/11/52/96/337115296.db2.gz	PHIWMXRPJOZIRL-OAHLLOKOSA-N	1	1	311.385	1.862	20	5		DDBDMO
Cc1nn(C)c(N[C@@H]2CC[N@@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000361680001	484522513	/nfs/dbraw/zinc/52/25/13/484522513.db2.gz	ASONWBOSDWKQJU-GFCCVEGCSA-N	1	1	322.413	1.217	20	5		DDBDMO
Cc1nn(C)c(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000361680001	484522517	/nfs/dbraw/zinc/52/25/17/484522517.db2.gz	ASONWBOSDWKQJU-GFCCVEGCSA-N	1	1	322.413	1.217	20	5		DDBDMO
COC(=O)c1ccc(OCCc2c[nH+]cn2C)c([N+](=O)[O-])c1	ZINC000287405658	490723163	/nfs/dbraw/zinc/72/31/63/490723163.db2.gz	BZAUOKNYYZEOBR-UHFFFAOYSA-N	1	1	305.290	1.736	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000305816459	534339902	/nfs/dbraw/zinc/33/99/02/534339902.db2.gz	AFEQTHIZEVAROK-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000305816459	534339909	/nfs/dbraw/zinc/33/99/09/534339909.db2.gz	AFEQTHIZEVAROK-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000154783763	525711580	/nfs/dbraw/zinc/71/15/80/525711580.db2.gz	ALQFSOYTBYEBRJ-NOZJJQNGSA-N	1	1	310.310	1.634	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000154783763	525711586	/nfs/dbraw/zinc/71/15/86/525711586.db2.gz	ALQFSOYTBYEBRJ-NOZJJQNGSA-N	1	1	310.310	1.634	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000459581335	526515123	/nfs/dbraw/zinc/51/51/23/526515123.db2.gz	KXWRZPFJMFAOIP-HNNXBMFYSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000294915959	527798234	/nfs/dbraw/zinc/79/82/34/527798234.db2.gz	JNHCNQHXAQEUPR-UHFFFAOYSA-N	1	1	317.349	1.666	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)[C@@H](C)C[N@H+]1C	ZINC000824992263	608554826	/nfs/dbraw/zinc/55/48/26/608554826.db2.gz	LDGWTFLUANGXPZ-ZJUUUORDSA-N	1	1	317.353	1.304	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CCC[N@@H+](Cc3ccccc3)CC2)c1	ZINC000075581630	696422048	/nfs/dbraw/zinc/42/20/48/696422048.db2.gz	OWXTYQQIIYLHTF-UHFFFAOYSA-N	1	1	315.377	1.957	20	5		DDBDMO
CC[N@@H+]1CCCN(S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000119720211	696684573	/nfs/dbraw/zinc/68/45/73/696684573.db2.gz	WPEVTLLHSNCKQG-UHFFFAOYSA-N	1	1	319.408	1.373	20	5		DDBDMO
CC[N@H+]1CCCN(S(=O)(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000119720211	696684575	/nfs/dbraw/zinc/68/45/75/696684575.db2.gz	WPEVTLLHSNCKQG-UHFFFAOYSA-N	1	1	319.408	1.373	20	5		DDBDMO
[NH3+]C1CCC(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000123550527	696732538	/nfs/dbraw/zinc/73/25/38/696732538.db2.gz	DGYQLWOPQBKQJS-UHFFFAOYSA-N	1	1	317.342	1.282	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776590324	698122951	/nfs/dbraw/zinc/12/29/51/698122951.db2.gz	ZNRKORDBTXXAMA-BBRMVZONSA-N	1	1	324.377	1.613	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776596654	698124819	/nfs/dbraw/zinc/12/48/19/698124819.db2.gz	HJOGIWSAIQDWNO-CABCVRRESA-N	1	1	319.361	1.325	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@@H](n3cncn3)C2)c1	ZINC000776777805	698139400	/nfs/dbraw/zinc/13/94/00/698139400.db2.gz	RNUWTAGEGVZFEG-CYBMUJFWSA-N	1	1	313.321	1.441	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H](n3cncn3)C2)c1	ZINC000776777805	698139401	/nfs/dbraw/zinc/13/94/01/698139401.db2.gz	RNUWTAGEGVZFEG-CYBMUJFWSA-N	1	1	313.321	1.441	20	5		DDBDMO
CC1(C)CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000781960991	698666476	/nfs/dbraw/zinc/66/64/76/698666476.db2.gz	PKLFSXRWKGWKOU-HNNXBMFYSA-N	1	1	323.393	1.017	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@H]1C	ZINC000787187631	699195035	/nfs/dbraw/zinc/19/50/35/699195035.db2.gz	TUFJOXFXHPPYAT-GHMZBOCLSA-N	1	1	306.366	1.732	20	5		DDBDMO
O=c1c([N+](=O)[O-])cc(Br)cn1CC[NH+]1CCCC1	ZINC000789930903	699423325	/nfs/dbraw/zinc/42/33/25/699423325.db2.gz	WMMZZRQVOAXXEO-UHFFFAOYSA-N	1	1	316.155	1.615	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(=O)NC	ZINC000735869543	699707515	/nfs/dbraw/zinc/70/75/15/699707515.db2.gz	IVYNYXQAVMVXTH-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)Cn1nccc1[N+](=O)[O-]	ZINC000795751878	699889325	/nfs/dbraw/zinc/88/93/25/699889325.db2.gz	KZSXRIGOVRGCCM-UHFFFAOYSA-N	1	1	307.354	1.796	20	5		DDBDMO
CNc1c(C(=O)OCCn2cc[nH+]c2C)cccc1[N+](=O)[O-]	ZINC000765514931	701017335	/nfs/dbraw/zinc/01/73/35/701017335.db2.gz	OCJQDGHCEJSAHX-UHFFFAOYSA-N	1	1	304.306	1.998	20	5		DDBDMO
Cn1ccnc1[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000767116956	701085078	/nfs/dbraw/zinc/08/50/78/701085078.db2.gz	OSEKGCIFCAJLBZ-ZFWWWQNUSA-N	1	1	316.361	1.851	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845769	701140622	/nfs/dbraw/zinc/14/06/22/701140622.db2.gz	YKKIIYRLIWBMAT-FBWDIHGXSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845769	701140624	/nfs/dbraw/zinc/14/06/24/701140624.db2.gz	YKKIIYRLIWBMAT-FBWDIHGXSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804429194	701188335	/nfs/dbraw/zinc/18/83/35/701188335.db2.gz	ABKLQHRPAOHRSU-SNVBAGLBSA-N	1	1	310.310	1.006	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000804504736	701196894	/nfs/dbraw/zinc/19/68/94/701196894.db2.gz	RPMVACPYSIVAOB-UHFFFAOYSA-N	1	1	312.326	1.883	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000771873409	701335010	/nfs/dbraw/zinc/33/50/10/701335010.db2.gz	IDUNYIDNUNPTEE-UHFFFAOYSA-N	1	1	319.273	1.685	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000867982198	701871884	/nfs/dbraw/zinc/87/18/84/701871884.db2.gz	LXRYOIAYZOPOAF-SGIREYDYSA-N	1	1	321.377	1.795	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCOC[C@@H](C)C2)c1	ZINC000811466791	701992048	/nfs/dbraw/zinc/99/20/48/701992048.db2.gz	YNQRALJQBYYGBS-NSHDSACASA-N	1	1	308.334	1.850	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCOC[C@@H](C)C2)c1	ZINC000811466791	701992051	/nfs/dbraw/zinc/99/20/51/701992051.db2.gz	YNQRALJQBYYGBS-NSHDSACASA-N	1	1	308.334	1.850	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866206649	706648581	/nfs/dbraw/zinc/64/85/81/706648581.db2.gz	FDJOIRCKPAVCPR-PWSUYJOCSA-N	1	1	320.349	1.307	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC000816953654	702237918	/nfs/dbraw/zinc/23/79/18/702237918.db2.gz	LOOSPBQXZXQKGV-ABAIWWIYSA-N	1	1	318.377	1.437	20	5		DDBDMO
CC(C)[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@H](O)CO	ZINC000817417830	702376521	/nfs/dbraw/zinc/37/65/21/702376521.db2.gz	RQANTAJKHDDSQN-NSHDSACASA-N	1	1	302.758	1.812	20	5		DDBDMO
CCCN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000843987274	702949283	/nfs/dbraw/zinc/94/92/83/702949283.db2.gz	DLDPBLSKNZATNL-LSDHHAIUSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000879572791	706723022	/nfs/dbraw/zinc/72/30/22/706723022.db2.gz	RIDSMFZWWURFQI-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC[NH+](CCCO)CC1	ZINC000845476517	703161963	/nfs/dbraw/zinc/16/19/63/703161963.db2.gz	MEUGHEQXJCWXSI-UHFFFAOYSA-N	1	1	317.748	1.892	20	5		DDBDMO
C[C@@H]1CN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000845517482	703167051	/nfs/dbraw/zinc/16/70/51/703167051.db2.gz	ARJOMKOHTKFFTA-SECBINFHSA-N	1	1	317.748	1.890	20	5		DDBDMO
C[C@@H]1CN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000845517482	703167054	/nfs/dbraw/zinc/16/70/54/703167054.db2.gz	ARJOMKOHTKFFTA-SECBINFHSA-N	1	1	317.748	1.890	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000846972751	703359154	/nfs/dbraw/zinc/35/91/54/703359154.db2.gz	MMWKJAPOBYVRCG-ZFWWWQNUSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@H+]1CC[C@H](CCOC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000847823021	703472871	/nfs/dbraw/zinc/47/28/71/703472871.db2.gz	JJWQTJQZDWESGM-SNVBAGLBSA-N	1	1	322.317	1.822	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000848351485	703542060	/nfs/dbraw/zinc/54/20/60/703542060.db2.gz	DMEYMQSLYYIMTC-GJZGRUSLSA-N	1	1	318.377	1.924	20	5		DDBDMO
CCOCC[N@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848483239	703555869	/nfs/dbraw/zinc/55/58/69/703555869.db2.gz	AGIWAFXOPCBKEI-OAHLLOKOSA-N	1	1	321.377	1.837	20	5		DDBDMO
CCOCC[N@@H+](C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848483239	703555871	/nfs/dbraw/zinc/55/58/71/703555871.db2.gz	AGIWAFXOPCBKEI-OAHLLOKOSA-N	1	1	321.377	1.837	20	5		DDBDMO
CC1(C)OC[C@@H](C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)O1	ZINC000851730107	703839380	/nfs/dbraw/zinc/83/93/80/703839380.db2.gz	VDPWQPDIXBHEGK-OAHLLOKOSA-N	1	1	321.377	1.868	20	5		DDBDMO
COCC[NH+]1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000818974930	704039630	/nfs/dbraw/zinc/03/96/30/704039630.db2.gz	ICUFDBVSYKDCOW-INIZCTEOSA-N	1	1	323.393	1.329	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000852463943	704054547	/nfs/dbraw/zinc/05/45/47/704054547.db2.gz	ZIWGZGSJUJXOCD-HRCADAONSA-N	1	1	306.362	1.987	20	5		DDBDMO
CCOC[C@@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870897302	704161277	/nfs/dbraw/zinc/16/12/77/704161277.db2.gz	BGUMDMIEIRNJSI-WBMJQRKESA-N	1	1	321.377	1.654	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@H](C)O)CC2)c([N+](=O)[O-])cc1C	ZINC000853265485	704226863	/nfs/dbraw/zinc/22/68/63/704226863.db2.gz	VPJZYDYZHGOMLM-LBPRGKRZSA-N	1	1	309.366	1.415	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ncn(C[N@@H+]3CCC4(COC4)C3)n2)cc1	ZINC000853597985	704281576	/nfs/dbraw/zinc/28/15/76/704281576.db2.gz	NAXCEEXKQLHKTG-UHFFFAOYSA-N	1	1	315.333	1.533	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC4(COC4)C3)n2)cc1	ZINC000853597985	704281578	/nfs/dbraw/zinc/28/15/78/704281578.db2.gz	NAXCEEXKQLHKTG-UHFFFAOYSA-N	1	1	315.333	1.533	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000855287656	704477347	/nfs/dbraw/zinc/47/73/47/704477347.db2.gz	RHCHINRYFBOAFH-LLVKDONJSA-N	1	1	306.366	1.780	20	5		DDBDMO
C[NH+]1CCN(CC2CN(c3ccc([N+](=O)[O-])cc3Cl)C2)CC1	ZINC000858612164	704734526	/nfs/dbraw/zinc/73/45/26/704734526.db2.gz	XXYSMWHRVAMCQC-UHFFFAOYSA-N	1	1	324.812	1.932	20	5		DDBDMO
C[C@]1(CO)C[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@]1(C)CO	ZINC000859832983	705015925	/nfs/dbraw/zinc/01/59/25/705015925.db2.gz	PJHFUJYERIWUQY-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
C[C@]1(CO)C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C[C@@]1(C)CO	ZINC000859832983	705015931	/nfs/dbraw/zinc/01/59/31/705015931.db2.gz	PJHFUJYERIWUQY-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179373	705163326	/nfs/dbraw/zinc/16/33/26/705163326.db2.gz	MMGGOYZBLMYHMD-HOTGVXAUSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179373	705163328	/nfs/dbraw/zinc/16/33/28/705163328.db2.gz	MMGGOYZBLMYHMD-HOTGVXAUSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@@H]1CN(C)CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179373	705163330	/nfs/dbraw/zinc/16/33/30/705163330.db2.gz	MMGGOYZBLMYHMD-HOTGVXAUSA-N	1	1	307.394	1.900	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H]1CCC[N@H+]2C	ZINC000874845028	705199525	/nfs/dbraw/zinc/19/95/25/705199525.db2.gz	FFHMFTMKXKPHGU-KGLIPLIRSA-N	1	1	319.361	1.912	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848398	705202222	/nfs/dbraw/zinc/20/22/22/705202222.db2.gz	SGBVGBZXBBYDNV-ZIAGYGMSSA-N	1	1	318.377	1.945	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823927159	705340691	/nfs/dbraw/zinc/34/06/91/705340691.db2.gz	OMDOCJGYNQVRNN-LLVKDONJSA-N	1	1	307.354	1.735	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000824003220	705353268	/nfs/dbraw/zinc/35/32/68/705353268.db2.gz	SYPNBSUMTQFFHB-CHWSQXEVSA-N	1	1	319.365	1.925	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NCC[NH+]2CCC2)cc1[N+](=O)[O-]	ZINC000827238694	705957745	/nfs/dbraw/zinc/95/77/45/705957745.db2.gz	VWVGWTXTKDKBIP-UHFFFAOYSA-N	1	1	310.329	1.235	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827244435	705958911	/nfs/dbraw/zinc/95/89/11/705958911.db2.gz	AKXCSFVTEVAQMZ-VHDGCEQUSA-N	1	1	319.361	1.181	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328917	705976363	/nfs/dbraw/zinc/97/63/63/705976363.db2.gz	FTMIGKANZPNMFK-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328917	705976365	/nfs/dbraw/zinc/97/63/65/705976365.db2.gz	FTMIGKANZPNMFK-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328917	705976366	/nfs/dbraw/zinc/97/63/66/705976366.db2.gz	FTMIGKANZPNMFK-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CCN1c1cc[nH+]cc1	ZINC000880263332	706925358	/nfs/dbraw/zinc/92/53/58/706925358.db2.gz	WUZOKPGCOBETAL-CYBMUJFWSA-N	1	1	316.365	1.397	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C2	ZINC000880329124	706942294	/nfs/dbraw/zinc/94/22/94/706942294.db2.gz	JTTSWBRNHWCIRV-WFASDCNBSA-N	1	1	322.365	1.375	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@@H](C)CC[C@H]2CO)c1	ZINC000880443889	706978794	/nfs/dbraw/zinc/97/87/94/706978794.db2.gz	NILAMROTXTUOEP-GWCFXTLKSA-N	1	1	308.334	1.727	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])[C@@H]12	ZINC000880528600	707005110	/nfs/dbraw/zinc/00/51/10/707005110.db2.gz	FMNQXOKFKALGIU-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCOc3ccccc3[N+](=O)[O-])[C@@H]12	ZINC000880528600	707005111	/nfs/dbraw/zinc/00/51/11/707005111.db2.gz	FMNQXOKFKALGIU-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000833458978	707008596	/nfs/dbraw/zinc/00/85/96/707008596.db2.gz	RIGODNAOMYOISR-ZBFHGGJFSA-N	1	1	319.361	1.182	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000872779127	707596597	/nfs/dbraw/zinc/59/65/97/707596597.db2.gz	MYCHKUCDGUVBFQ-KBPBESRZSA-N	1	1	304.350	1.367	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897218459	708256742	/nfs/dbraw/zinc/25/67/42/708256742.db2.gz	CUFOEWYKWTUBCP-OLZOCXBDSA-N	1	1	323.397	1.155	20	5		DDBDMO
Cc1cc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)ncc1[N+](=O)[O-]	ZINC000897220417	708258806	/nfs/dbraw/zinc/25/88/06/708258806.db2.gz	AYBTWJRBMLILOM-QWHCGFSZSA-N	1	1	306.366	1.334	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c1C	ZINC000898436688	708639630	/nfs/dbraw/zinc/63/96/30/708639630.db2.gz	HTEFEVHIKSJOKS-QWHCGFSZSA-N	1	1	319.361	1.103	20	5		DDBDMO
CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285383	708735786	/nfs/dbraw/zinc/73/57/86/708735786.db2.gz	HJPGMCNWJVQRPD-CYBMUJFWSA-N	1	1	306.366	1.726	20	5		DDBDMO
CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285383	708735787	/nfs/dbraw/zinc/73/57/87/708735787.db2.gz	HJPGMCNWJVQRPD-CYBMUJFWSA-N	1	1	306.366	1.726	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886338512	708745395	/nfs/dbraw/zinc/74/53/95/708745395.db2.gz	LZBWPCGAXPWQJE-MXWKQRLJSA-N	1	1	305.334	1.882	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886338512	708745396	/nfs/dbraw/zinc/74/53/96/708745396.db2.gz	LZBWPCGAXPWQJE-MXWKQRLJSA-N	1	1	305.334	1.882	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@]1(O)CCC[N@H+](C)C1	ZINC000899936888	709243281	/nfs/dbraw/zinc/24/32/81/709243281.db2.gz	JFNRWHOERAFCPU-MRXNPFEDSA-N	1	1	321.377	1.997	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000900812301	709773303	/nfs/dbraw/zinc/77/33/03/709773303.db2.gz	UVXVWWDWHOUBEI-TZMCWYRMSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928435839	713194885	/nfs/dbraw/zinc/19/48/85/713194885.db2.gz	DEAFQGRXNCMFBS-VXGBXAGGSA-N	1	1	306.366	1.240	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452036	713203123	/nfs/dbraw/zinc/20/31/23/713203123.db2.gz	MNJPKXBZVBTAQL-SWLSCSKDSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000928568249	713231936	/nfs/dbraw/zinc/23/19/36/713231936.db2.gz	KGARYNUWIXEKOG-GFCCVEGCSA-N	1	1	304.350	1.603	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000928568249	713231938	/nfs/dbraw/zinc/23/19/38/713231938.db2.gz	KGARYNUWIXEKOG-GFCCVEGCSA-N	1	1	304.350	1.603	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@@H+](C)[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545977	713252726	/nfs/dbraw/zinc/25/27/26/713252726.db2.gz	DZAWFIZLIYTBBQ-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@H+](C)[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545977	713252728	/nfs/dbraw/zinc/25/27/28/713252728.db2.gz	DZAWFIZLIYTBBQ-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895249672	711466307	/nfs/dbraw/zinc/46/63/07/711466307.db2.gz	WOFKARMZULHBHF-NEPJUHHUSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1CN(C)CC[N@@H+]1C	ZINC000895249672	711466311	/nfs/dbraw/zinc/46/63/11/711466311.db2.gz	WOFKARMZULHBHF-NEPJUHHUSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1CN(C)CC[N@H+]1C	ZINC000895249672	711466313	/nfs/dbraw/zinc/46/63/13/711466313.db2.gz	WOFKARMZULHBHF-NEPJUHHUSA-N	1	1	318.381	1.289	20	5		DDBDMO
Cc1ccc(CNC(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000896219939	711693505	/nfs/dbraw/zinc/69/35/05/711693505.db2.gz	JMEWOKOFZXWPCK-DZGCQCFKSA-N	1	1	318.377	1.749	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000914432055	713394945	/nfs/dbraw/zinc/39/49/45/713394945.db2.gz	IWYYCLUMCLAQID-PHIMTYICSA-N	1	1	315.333	1.390	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000914432055	713394947	/nfs/dbraw/zinc/39/49/47/713394947.db2.gz	IWYYCLUMCLAQID-PHIMTYICSA-N	1	1	315.333	1.390	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000929407748	713604612	/nfs/dbraw/zinc/60/46/12/713604612.db2.gz	HCTQLHOSXZKNOF-HNNXBMFYSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000919801729	713635757	/nfs/dbraw/zinc/63/57/57/713635757.db2.gz	GOVQGUVSABXBIU-OAHLLOKOSA-N	1	1	320.393	1.921	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C	ZINC000929778928	713688572	/nfs/dbraw/zinc/68/85/72/713688572.db2.gz	KSNRRSVNOIAULF-VXGBXAGGSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])[C@@H]1CNC(=O)OC(C)(C)C	ZINC000929778928	713688574	/nfs/dbraw/zinc/68/85/74/713688574.db2.gz	KSNRRSVNOIAULF-VXGBXAGGSA-N	1	1	301.387	1.888	20	5		DDBDMO
CC[N@H+](CCOC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000921045721	713710119	/nfs/dbraw/zinc/71/01/19/713710119.db2.gz	CYFIXOYXDWWAOP-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
CC[N@@H+](CCOC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000921045721	713710120	/nfs/dbraw/zinc/71/01/20/713710120.db2.gz	CYFIXOYXDWWAOP-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC[N+](=O)[O-])C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000930684314	713896038	/nfs/dbraw/zinc/89/60/38/713896038.db2.gz	OVJANDGHURFVPJ-NEPJUHHUSA-N	1	1	301.387	1.746	20	5		DDBDMO
C[C@@H]1C[C@H](C)N(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C[NH3+]	ZINC000923379848	714334879	/nfs/dbraw/zinc/33/48/79/714334879.db2.gz	ABGFVIVNJNLOMI-TWJWRFFLSA-N	1	1	307.394	1.933	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOc3ccccc3[C@@H]2CO)n1	ZINC000933383087	714577401	/nfs/dbraw/zinc/57/74/01/714577401.db2.gz	KXQQAEPZBFQNCN-ZDUSSCGKSA-N	1	1	318.333	1.219	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOc3ccccc3[C@@H]2CO)n1	ZINC000933383087	714577402	/nfs/dbraw/zinc/57/74/02/714577402.db2.gz	KXQQAEPZBFQNCN-ZDUSSCGKSA-N	1	1	318.333	1.219	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@]2(C)C1	ZINC000933732370	714657637	/nfs/dbraw/zinc/65/76/37/714657637.db2.gz	PFHDHDFZVRIRPM-BZNIZROVSA-N	1	1	315.377	1.855	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)c1	ZINC000934832314	714912920	/nfs/dbraw/zinc/91/29/20/714912920.db2.gz	AXMPUKYQDCYDRH-ZIAGYGMSSA-N	1	1	308.382	1.930	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001164638885	719216819	/nfs/dbraw/zinc/21/68/19/719216819.db2.gz	PSXUZRQZNFFMPY-DTWKUNHWSA-N	1	1	300.746	1.410	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001164638885	719216832	/nfs/dbraw/zinc/21/68/32/719216832.db2.gz	PSXUZRQZNFFMPY-DTWKUNHWSA-N	1	1	300.746	1.410	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3nc4ccccc4cc3[N+](=O)[O-])C[C@@H]21	ZINC000352355706	719413754	/nfs/dbraw/zinc/41/37/54/719413754.db2.gz	JIQZEOKLQLWFFL-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
CCc1occc1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001126500449	740436820	/nfs/dbraw/zinc/43/68/20/740436820.db2.gz	FGRBRDNPDYJOJB-UHFFFAOYSA-N	1	1	321.337	1.003	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCN(C)c1ccccc1[N+](=O)[O-]	ZINC001105460154	741855507	/nfs/dbraw/zinc/85/55/07/741855507.db2.gz	RNRGFFNYWGELFO-UHFFFAOYSA-N	1	1	322.409	1.831	20	5		DDBDMO
Cc1cncc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000996429311	749588036	/nfs/dbraw/zinc/58/80/36/749588036.db2.gz	PAUDCDNEBFWLIK-HUUCEWRRSA-N	1	1	318.377	1.136	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169035716	762191728	/nfs/dbraw/zinc/19/17/28/762191728.db2.gz	LGZDZDYTFSIANP-XGFWRYKXSA-N	1	1	312.366	1.084	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@H+]2[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169035716	762191730	/nfs/dbraw/zinc/19/17/30/762191730.db2.gz	LGZDZDYTFSIANP-XGFWRYKXSA-N	1	1	312.366	1.084	20	5		DDBDMO
[NH3+]Cc1ccc2nnn(-c3ccc4[nH]cnc4c3[N+](=O)[O-])c2c1	ZINC001170024595	764113529	/nfs/dbraw/zinc/11/35/29/764113529.db2.gz	WFDLXMKYIUDIHG-UHFFFAOYSA-N	1	1	309.289	1.664	20	5		DDBDMO
COC(=O)C1C[NH+]([C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC001170335474	766257943	/nfs/dbraw/zinc/25/79/43/766257943.db2.gz	OGBGPKBJTGCHCV-JTQLQIEISA-N	1	1	308.334	1.639	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC001170354408	766260357	/nfs/dbraw/zinc/26/03/57/766260357.db2.gz	KUXFFEQXLMAXRJ-RISCZKNCSA-N	1	1	321.377	1.745	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC001170354409	766260841	/nfs/dbraw/zinc/26/08/41/766260841.db2.gz	KUXFFEQXLMAXRJ-SMDDNHRTSA-N	1	1	321.377	1.745	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001094008724	775325292	/nfs/dbraw/zinc/32/52/92/775325292.db2.gz	VBBJWFPSLCIBCJ-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@H](O)C[C@@H]1CO)CC2	ZINC001172908876	776917870	/nfs/dbraw/zinc/91/78/70/776917870.db2.gz	AZJVLYNMDYOMSZ-FVQBIDKESA-N	1	1	306.362	1.270	20	5		DDBDMO
Cc1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)nn1	ZINC001175324171	777751312	/nfs/dbraw/zinc/75/13/12/777751312.db2.gz	SRITZCBTPWUQQA-MRXNPFEDSA-N	1	1	316.361	1.999	20	5		DDBDMO
Cc1cc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])no1	ZINC001178458760	779059144	/nfs/dbraw/zinc/05/91/44/779059144.db2.gz	WWYFHNBJMOMWRO-ZIAGYGMSSA-N	1	1	324.381	1.414	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)C1(O)CCCC1)CC2	ZINC001119684610	781562753	/nfs/dbraw/zinc/56/27/53/781562753.db2.gz	CPEJOVPFKCPDHM-OAHLLOKOSA-N	1	1	306.362	1.619	20	5		DDBDMO
CCc1cccc(C[N@@H+](C)CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001267193733	837510449	/nfs/dbraw/zinc/51/04/49/837510449.db2.gz	BMAMSKAXMGNOSF-HUUCEWRRSA-N	1	1	305.378	1.462	20	5		DDBDMO
CCc1cccc(C[N@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001267193733	837510454	/nfs/dbraw/zinc/51/04/54/837510454.db2.gz	BMAMSKAXMGNOSF-HUUCEWRRSA-N	1	1	305.378	1.462	20	5		DDBDMO
CCc1cccc(C[N@@H+](C)CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001267193733	837510459	/nfs/dbraw/zinc/51/04/59/837510459.db2.gz	BMAMSKAXMGNOSF-HUUCEWRRSA-N	1	1	305.378	1.462	20	5		DDBDMO
CC(=O)N(C)CC[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001267605242	838426380	/nfs/dbraw/zinc/42/63/80/838426380.db2.gz	PFDVYWMXHIXXBY-UHFFFAOYSA-N	1	1	320.393	1.191	20	5		DDBDMO
CC1(C(=O)NCC2C[NH+](Cc3ccccc3[N+](=O)[O-])C2)CC1	ZINC001267682683	838635299	/nfs/dbraw/zinc/63/52/99/838635299.db2.gz	CVQYTLALIAWKDB-UHFFFAOYSA-N	1	1	303.362	1.943	20	5		DDBDMO
O=C(NCC1([NH2+]CCC2CCCC2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001326823745	861633885	/nfs/dbraw/zinc/63/38/85/861633885.db2.gz	YDVCHINYGKKMEM-ZIAGYGMSSA-N	1	1	309.410	1.860	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@@]12CC[N@@H+](C1)CCC2	ZINC001123031532	859063190	/nfs/dbraw/zinc/06/31/90/859063190.db2.gz	PYNZNAAHLCQLII-AWEZNQCLSA-N	1	1	308.338	1.129	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CO[C@@H](C[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC001224829522	881549322	/nfs/dbraw/zinc/54/93/22/881549322.db2.gz	JXUROGUQHXMQFO-WFASDCNBSA-N	1	1	308.334	1.844	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2ccnc(NC)c2[N+](=O)[O-])C(C)(C)C1	ZINC001156837420	863384238	/nfs/dbraw/zinc/38/42/38/863384238.db2.gz	UGBDMTKTINKLLG-NSHDSACASA-N	1	1	321.381	1.492	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001154022538	864326976	/nfs/dbraw/zinc/32/69/76/864326976.db2.gz	LBJNKABUFLTMNJ-HTQZYQBOSA-N	1	1	313.745	1.280	20	5		DDBDMO
CSc1nc(Cl)nc(N2CC[N@@H+]3CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001158434994	864652624	/nfs/dbraw/zinc/65/26/24/864652624.db2.gz	UGOBRYGOIGEUJM-SSDOTTSWSA-N	1	1	315.786	1.654	20	5		DDBDMO
CSc1nc(Cl)nc(N2CC[N@H+]3CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001158434994	864652627	/nfs/dbraw/zinc/65/26/27/864652627.db2.gz	UGOBRYGOIGEUJM-SSDOTTSWSA-N	1	1	315.786	1.654	20	5		DDBDMO
C[NH+]1CCN(CCCNc2ccc3c([N+](=O)[O-])c[nH]c3n2)CC1	ZINC001161700643	866907005	/nfs/dbraw/zinc/90/70/05/866907005.db2.gz	OFULSYVFZNOOBF-UHFFFAOYSA-N	1	1	318.381	1.521	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@H]2[C@H](CCC[N@H+]2C)C1	ZINC001333710521	866954368	/nfs/dbraw/zinc/95/43/68/866954368.db2.gz	LHTNYPBFYRVNIE-DGCLKSJQSA-N	1	1	306.366	1.919	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC001335117120	868076581	/nfs/dbraw/zinc/07/65/81/868076581.db2.gz	KNCAUYVTBUACJQ-STQMWFEESA-N	1	1	309.341	1.769	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C[C@@H](OC)C(F)(F)F)c1[N+](=O)[O-]	ZINC001335441809	868299955	/nfs/dbraw/zinc/29/99/55/868299955.db2.gz	UQERIECOBLWFCI-SECBINFHSA-N	1	1	324.255	1.976	20	5		DDBDMO
COC(=O)c1cc(NCCn2cc[nH+]c2C)cc([N+](=O)[O-])c1	ZINC001163927725	868798516	/nfs/dbraw/zinc/79/85/16/868798516.db2.gz	ABFBVLAWMVPDQA-UHFFFAOYSA-N	1	1	304.306	1.998	20	5		DDBDMO
COc1cc(C)nc(N2CCC(F)(F)[C@H]([NH3+])C2)c1[N+](=O)[O-]	ZINC001164319510	869124365	/nfs/dbraw/zinc/12/43/65/869124365.db2.gz	IMWNLTJWIYYZRQ-SECBINFHSA-N	1	1	302.281	1.480	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC001337837205	869651044	/nfs/dbraw/zinc/65/10/44/869651044.db2.gz	YYQGGKGDUZPYOX-ZLKJLUDKSA-N	1	1	304.350	1.368	20	5		DDBDMO
COc1cc(CCNc2cc(N)[nH+]cn2)c([N+](=O)[O-])cc1OC	ZINC001338592434	870061359	/nfs/dbraw/zinc/06/13/59/870061359.db2.gz	SCNUTQSMPMFTFH-UHFFFAOYSA-N	1	1	319.321	1.639	20	5		DDBDMO
COc1cc(CCNc2cc(N)nc[nH+]2)c([N+](=O)[O-])cc1OC	ZINC001338592434	870061369	/nfs/dbraw/zinc/06/13/69/870061369.db2.gz	SCNUTQSMPMFTFH-UHFFFAOYSA-N	1	1	319.321	1.639	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)c1	ZINC001226443545	882434480	/nfs/dbraw/zinc/43/44/80/882434480.db2.gz	XWBRNLVRLWEXJB-FZZIBODNSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c1	ZINC001226443545	882434495	/nfs/dbraw/zinc/43/44/95/882434495.db2.gz	XWBRNLVRLWEXJB-FZZIBODNSA-N	1	1	306.318	1.786	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CCCC[N@@H+]1C	ZINC001353895341	877635580	/nfs/dbraw/zinc/63/55/80/877635580.db2.gz	TVOYUUWNPPFVLM-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
COc1cc(CO[C@@H](C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC001223397128	880946855	/nfs/dbraw/zinc/94/68/55/880946855.db2.gz	VMDRJYIHAZEIFR-LBPRGKRZSA-N	1	1	310.350	1.841	20	5		DDBDMO
N#CN1CC[NH+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1	ZINC001254483860	896455606	/nfs/dbraw/zinc/45/56/06/896455606.db2.gz	WZYBLAPRZZSANE-UHFFFAOYSA-N	1	1	315.377	1.662	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CCO[C@H](CO)C3)CC2)cc1	ZINC001254474071	896455650	/nfs/dbraw/zinc/45/56/50/896455650.db2.gz	KVHBWBSJOSQSFL-INIZCTEOSA-N	1	1	321.377	1.257	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCN(C)CC1	ZINC001254532675	896488627	/nfs/dbraw/zinc/48/86/27/896488627.db2.gz	PYFOIEFYMXLTMU-CQSZACIVSA-N	1	1	306.410	1.363	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC(N2CCOCC2)C1	ZINC001254558482	896501605	/nfs/dbraw/zinc/50/16/05/896501605.db2.gz	BNHZQHUPRIVVOT-CYBMUJFWSA-N	1	1	305.378	1.542	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254599696	896525365	/nfs/dbraw/zinc/52/53/65/896525365.db2.gz	PAFWHLFEUPVTHR-IUODEOHRSA-N	1	1	304.346	1.947	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCC[C@H](n3cncn3)C1)C2	ZINC001254604344	896527312	/nfs/dbraw/zinc/52/73/12/896527312.db2.gz	VUOYQSNAEDPGDC-JKSUJKDBSA-N	1	1	313.361	1.991	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC001263980017	900853237	/nfs/dbraw/zinc/85/32/37/900853237.db2.gz	LEJBWASZLQXSAR-TUKIKUTGSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[C@@H]1CN(c2ncnc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000614529942	361909544	/nfs/dbraw/zinc/90/95/44/361909544.db2.gz	CVKUUXSOYXPAOS-LLVKDONJSA-N	1	1	317.349	1.041	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000319016654	231177627	/nfs/dbraw/zinc/17/76/27/231177627.db2.gz	CPKLVXMJPCGWLS-WPRPVWTQSA-N	1	1	310.329	1.529	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CCCC[N@H+]2CCO)ccc1[N+](=O)[O-]	ZINC000452387918	231373745	/nfs/dbraw/zinc/37/37/45/231373745.db2.gz	IGRRYVFBYPVOES-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1ccc[nH]1	ZINC000090553167	185302754	/nfs/dbraw/zinc/30/27/54/185302754.db2.gz	OEXYANWFTKDWMP-AWEZNQCLSA-N	1	1	302.334	1.922	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)c1ncc([N+](=O)[O-])cc1F	ZINC000413141606	529887830	/nfs/dbraw/zinc/88/78/30/529887830.db2.gz	KHHKXLMGWWLSFY-UHFFFAOYSA-N	1	1	311.361	1.203	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCSc2ncccc2[N+](=O)[O-])CC1	ZINC000286755617	219148764	/nfs/dbraw/zinc/14/87/64/219148764.db2.gz	XDGWEQDWMGBXDI-UHFFFAOYSA-N	1	1	310.379	1.246	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000330889568	232140556	/nfs/dbraw/zinc/14/05/56/232140556.db2.gz	BMNRAYCQQARCQI-GHMZBOCLSA-N	1	1	309.370	1.125	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330895786	232143157	/nfs/dbraw/zinc/14/31/57/232143157.db2.gz	GJWAYHMYYYVHRG-NWDGAFQWSA-N	1	1	307.350	1.573	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000330889532	232139810	/nfs/dbraw/zinc/13/98/10/232139810.db2.gz	BJXQGIRQTPTWCZ-GWCFXTLKSA-N	1	1	323.397	1.397	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358416999	299147127	/nfs/dbraw/zinc/14/71/27/299147127.db2.gz	WJTZSBJHICPBPC-FZMZJTMJSA-N	1	1	321.352	1.972	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=CCC1	ZINC000279769397	215131267	/nfs/dbraw/zinc/13/12/67/215131267.db2.gz	BJBLJOCZBXTMBP-UHFFFAOYSA-N	1	1	318.377	1.653	20	5		DDBDMO
C[C@@]1(O)CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000280008699	215308507	/nfs/dbraw/zinc/30/85/07/215308507.db2.gz	JROQQGVIUDUXHW-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000280008699	215308510	/nfs/dbraw/zinc/30/85/10/215308510.db2.gz	JROQQGVIUDUXHW-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000047145556	352484013	/nfs/dbraw/zinc/48/40/13/352484013.db2.gz	LLENYMKGDNZZHQ-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000491236701	234111756	/nfs/dbraw/zinc/11/17/56/234111756.db2.gz	LFLATDWQKVCQAT-IRBQFCFKSA-N	1	1	301.346	1.961	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c1C	ZINC000053686177	352664789	/nfs/dbraw/zinc/66/47/89/352664789.db2.gz	WNAIZIQVCNJWIP-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c1C	ZINC000053686177	352664792	/nfs/dbraw/zinc/66/47/92/352664792.db2.gz	WNAIZIQVCNJWIP-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000063852158	352927607	/nfs/dbraw/zinc/92/76/07/352927607.db2.gz	VXMYXAHCMPQJNL-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
COCC[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])s1	ZINC000069530355	353165607	/nfs/dbraw/zinc/16/56/07/353165607.db2.gz	PWUPQLIXZYUGKU-SNVBAGLBSA-N	1	1	313.379	1.497	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])s1	ZINC000069530355	353165610	/nfs/dbraw/zinc/16/56/10/353165610.db2.gz	PWUPQLIXZYUGKU-SNVBAGLBSA-N	1	1	313.379	1.497	20	5		DDBDMO
C[C@H](CNC(=O)Cc1cccc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000173868701	198262061	/nfs/dbraw/zinc/26/20/61/198262061.db2.gz	JNSJNBKBZXSGJD-CYBMUJFWSA-N	1	1	321.377	1.222	20	5		DDBDMO
Cc1ncc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)s1	ZINC000174738275	198377900	/nfs/dbraw/zinc/37/79/00/198377900.db2.gz	OKLAZSYZRVYCJF-NSHDSACASA-N	1	1	311.367	1.049	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[NH+]2CCC(c3nc[nH]n3)CC2)c1	ZINC000083444804	353710053	/nfs/dbraw/zinc/71/00/53/353710053.db2.gz	OTQDKALIYVNGJR-UHFFFAOYSA-N	1	1	317.349	1.971	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000089267232	353763779	/nfs/dbraw/zinc/76/37/79/353763779.db2.gz	DVGTVCJZRXIXNC-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000089267232	353763780	/nfs/dbraw/zinc/76/37/80/353763780.db2.gz	DVGTVCJZRXIXNC-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCN(c2ccc(N)[nH+]c2)CC1	ZINC000092624633	353864065	/nfs/dbraw/zinc/86/40/65/353864065.db2.gz	SVNLSYMLSRZMGH-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000093332539	353895887	/nfs/dbraw/zinc/89/58/87/353895887.db2.gz	UCLVTWYQWLQXTK-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000093332539	353895889	/nfs/dbraw/zinc/89/58/89/353895889.db2.gz	UCLVTWYQWLQXTK-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346192524	283017406	/nfs/dbraw/zinc/01/74/06/283017406.db2.gz	NLMHDWPAINVCFG-GARJFASQSA-N	1	1	307.354	1.120	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2cc(N)c([N+](=O)[O-])c(CO)c2)C[C@@H]1C	ZINC000588009277	354893368	/nfs/dbraw/zinc/89/33/68/354893368.db2.gz	DSMJUAXWGLCCQJ-QWRGUYRKSA-N	1	1	308.382	1.588	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)C2)C1	ZINC000589879248	355028726	/nfs/dbraw/zinc/02/87/26/355028726.db2.gz	WLZNZBRYIADHQN-HNNXBMFYSA-N	1	1	306.366	1.201	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000590631900	355133838	/nfs/dbraw/zinc/13/38/38/355133838.db2.gz	FFAQWNMULUELII-CYBMUJFWSA-N	1	1	319.361	1.768	20	5		DDBDMO
CCc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000590776517	355176317	/nfs/dbraw/zinc/17/63/17/355176317.db2.gz	INXICYCJDJFKRV-DZGCQCFKSA-N	1	1	303.362	1.933	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@@H](C[NH+]3CCOCC3)C2)c(F)c1	ZINC000591147748	355254927	/nfs/dbraw/zinc/25/49/27/355254927.db2.gz	LFMJFGXHONZIEV-NSHDSACASA-N	1	1	310.329	1.287	20	5		DDBDMO
CN(C)C1(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000591357445	355299053	/nfs/dbraw/zinc/29/90/53/355299053.db2.gz	PFAGHLARGVXPLV-UHFFFAOYSA-N	1	1	307.350	1.550	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000591579971	355330410	/nfs/dbraw/zinc/33/04/10/355330410.db2.gz	CANMMXMXMLDAPC-GVXVVHGQSA-N	1	1	324.356	1.602	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@H](C)[N@@H+](C)C[C@H]2C)c1	ZINC000593018890	355771213	/nfs/dbraw/zinc/77/12/13/355771213.db2.gz	BRLLJQBFZKGJGX-NWDGAFQWSA-N	1	1	321.377	1.906	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000593060994	355783804	/nfs/dbraw/zinc/78/38/04/355783804.db2.gz	MMBVZCKYSCOZFC-UONOGXRCSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@H]1C	ZINC000593187604	355820054	/nfs/dbraw/zinc/82/00/54/355820054.db2.gz	MKHPHXODYNUZKI-ADEWGFFLSA-N	1	1	306.366	1.851	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593414967	355878213	/nfs/dbraw/zinc/87/82/13/355878213.db2.gz	HLEDRYYSONNNKN-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1	ZINC000593517950	355911647	/nfs/dbraw/zinc/91/16/47/355911647.db2.gz	LTPANERAMSKGMH-UHFFFAOYSA-N	1	1	324.381	1.083	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593519672	355912098	/nfs/dbraw/zinc/91/20/98/355912098.db2.gz	AOBQPXFRMSGWTM-HZMBPMFUSA-N	1	1	321.352	1.875	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)CC2	ZINC000593424481	355881097	/nfs/dbraw/zinc/88/10/97/355881097.db2.gz	IAOWLUCOUHSLQP-CYBMUJFWSA-N	1	1	314.345	1.979	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594094116	356111128	/nfs/dbraw/zinc/11/11/28/356111128.db2.gz	HCCSTJJEKKQJJL-QWHCGFSZSA-N	1	1	320.349	1.186	20	5		DDBDMO
[NH3+]C1(CNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCCC1	ZINC000595119558	356386036	/nfs/dbraw/zinc/38/60/36/356386036.db2.gz	HAQJFHBEUQAFBI-UHFFFAOYSA-N	1	1	317.342	1.284	20	5		DDBDMO
CC(C)[C@H]([NH3+])CCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000595120606	356386059	/nfs/dbraw/zinc/38/60/59/356386059.db2.gz	JGGOPRWYUUSUGP-SNVBAGLBSA-N	1	1	319.358	1.386	20	5		DDBDMO
CCC[N@@H+]1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000595355724	356462255	/nfs/dbraw/zinc/46/22/55/356462255.db2.gz	QPCNSTOIFMFHSH-SECBINFHSA-N	1	1	319.408	1.419	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000595355724	356462258	/nfs/dbraw/zinc/46/22/58/356462258.db2.gz	QPCNSTOIFMFHSH-SECBINFHSA-N	1	1	319.408	1.419	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(C(=O)N(C)C(C)C)CC2)c1[N+](=O)[O-]	ZINC000595291900	356436123	/nfs/dbraw/zinc/43/61/23/356436123.db2.gz	XBQDAYMJESDYHT-UHFFFAOYSA-N	1	1	324.381	1.970	20	5		DDBDMO
O=C1NCCN1C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000595292888	356436568	/nfs/dbraw/zinc/43/65/68/356436568.db2.gz	DFXFJKQWZBDVBA-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595742454	356631243	/nfs/dbraw/zinc/63/12/43/356631243.db2.gz	GOZQKZSFLSYNOP-VXGBXAGGSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755612	356637104	/nfs/dbraw/zinc/63/71/04/356637104.db2.gz	BJOQBJIHWVLDEH-BONVTDFDSA-N	1	1	302.334	1.939	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755612	356637109	/nfs/dbraw/zinc/63/71/09/356637109.db2.gz	BJOQBJIHWVLDEH-BONVTDFDSA-N	1	1	302.334	1.939	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(CO)(CO)C1	ZINC000595799186	356656193	/nfs/dbraw/zinc/65/61/93/356656193.db2.gz	JDZFUQBAJHRCDH-UHFFFAOYSA-N	1	1	324.377	1.559	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC(CO)(CO)C1	ZINC000595799186	356656195	/nfs/dbraw/zinc/65/61/95/356656195.db2.gz	JDZFUQBAJHRCDH-UHFFFAOYSA-N	1	1	324.377	1.559	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595836634	356672765	/nfs/dbraw/zinc/67/27/65/356672765.db2.gz	XOVZGFKYJLBIMI-JHJVBQTASA-N	1	1	319.361	1.890	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H]2COC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829827	356668328	/nfs/dbraw/zinc/66/83/28/356668328.db2.gz	ILBFDPUHCPWWIL-VXGBXAGGSA-N	1	1	305.334	1.502	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]2COC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829827	356668331	/nfs/dbraw/zinc/66/83/31/356668331.db2.gz	ILBFDPUHCPWWIL-VXGBXAGGSA-N	1	1	305.334	1.502	20	5		DDBDMO
CCOc1cc(C[N@@H+](CC(N)=O)CC(C)C)ccc1[N+](=O)[O-]	ZINC000276890417	213158299	/nfs/dbraw/zinc/15/82/99/213158299.db2.gz	JYHKYDRGESTCKD-UHFFFAOYSA-N	1	1	309.366	1.937	20	5		DDBDMO
CCOc1cc(C[N@H+](CC(N)=O)CC(C)C)ccc1[N+](=O)[O-]	ZINC000276890417	213158301	/nfs/dbraw/zinc/15/83/01/213158301.db2.gz	JYHKYDRGESTCKD-UHFFFAOYSA-N	1	1	309.366	1.937	20	5		DDBDMO
CCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000597947446	357396297	/nfs/dbraw/zinc/39/62/97/357396297.db2.gz	YKUZYVZJNKPYNH-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+](CCNc1nccc(C(=O)OC)c1[N+](=O)[O-])C1CC1	ZINC000598593402	357645619	/nfs/dbraw/zinc/64/56/19/357645619.db2.gz	SKOVFUFRUIOAJL-UHFFFAOYSA-N	1	1	308.338	1.673	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CC1(C)COC1	ZINC000599571617	357979281	/nfs/dbraw/zinc/97/92/81/357979281.db2.gz	NTRXYRBSLJNPRJ-UHFFFAOYSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CC1(C)COC1	ZINC000599571617	357979284	/nfs/dbraw/zinc/97/92/84/357979284.db2.gz	NTRXYRBSLJNPRJ-UHFFFAOYSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+](C)C1	ZINC000600309483	358191774	/nfs/dbraw/zinc/19/17/74/358191774.db2.gz	AISYIBJKKWDQPM-LBPRGKRZSA-N	1	1	306.366	1.760	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000600533312	358249925	/nfs/dbraw/zinc/24/99/25/358249925.db2.gz	KNBQDRMXMPJFOQ-SECBINFHSA-N	1	1	313.741	1.045	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@H]2COCCN2)c1	ZINC000600677246	358280242	/nfs/dbraw/zinc/28/02/42/358280242.db2.gz	CWZAPKYVJPKINT-JTQLQIEISA-N	1	1	317.292	1.274	20	5		DDBDMO
CNC(=O)[C@@H](Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C(C)C	ZINC000601132428	358415419	/nfs/dbraw/zinc/41/54/19/358415419.db2.gz	GNHFMWAIXUYGFJ-AWEZNQCLSA-N	1	1	302.334	1.747	20	5		DDBDMO
Cn1cc(C[NH+]2CCC([C@@H]3NC(=O)C3(C)C)CC2)c([N+](=O)[O-])n1	ZINC000602704767	359135880	/nfs/dbraw/zinc/13/58/80/359135880.db2.gz	IHWRFEIISCWDFL-LBPRGKRZSA-N	1	1	321.381	1.065	20	5		DDBDMO
C[C@@H]1CN(Cc2cn(C)nc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000602843061	359231256	/nfs/dbraw/zinc/23/12/56/359231256.db2.gz	YRDOOUHBFMXWQU-GFCCVEGCSA-N	1	1	307.398	1.635	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@]1(CO)CC(C)C	ZINC000602817648	359212829	/nfs/dbraw/zinc/21/28/29/359212829.db2.gz	UZKLBQSFNGMILN-OAHLLOKOSA-N	1	1	310.398	1.973	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCc2ncnn21	ZINC000602823420	359217416	/nfs/dbraw/zinc/21/74/16/359217416.db2.gz	KOQPCSHDTOTGLP-CQSZACIVSA-N	1	1	301.350	1.848	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000602904258	359284478	/nfs/dbraw/zinc/28/44/78/359284478.db2.gz	VRUXAUOCZMLZIR-CYBMUJFWSA-N	1	1	323.397	1.336	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C[C@H]1C	ZINC000602953161	359318011	/nfs/dbraw/zinc/31/80/11/359318011.db2.gz	PHZRKVNZCQLMME-LLVKDONJSA-N	1	1	307.354	1.278	20	5		DDBDMO
CC1(C)C[N@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccco1	ZINC000602928003	359298954	/nfs/dbraw/zinc/29/89/54/359298954.db2.gz	VJCRVTDUNVVFBU-GXTWGEPZSA-N	1	1	320.349	1.828	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccco1	ZINC000602928003	359298955	/nfs/dbraw/zinc/29/89/55/359298955.db2.gz	VJCRVTDUNVVFBU-GXTWGEPZSA-N	1	1	320.349	1.828	20	5		DDBDMO
Cn1cc(C2=CCC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)cn1	ZINC000602883181	359266899	/nfs/dbraw/zinc/26/68/99/359266899.db2.gz	NWCXYASZICGFCW-UHFFFAOYSA-N	1	1	302.338	1.351	20	5		DDBDMO
Cn1cc(C2=CCC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)cn1	ZINC000602883181	359266904	/nfs/dbraw/zinc/26/69/04/359266904.db2.gz	NWCXYASZICGFCW-UHFFFAOYSA-N	1	1	302.338	1.351	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@@]2(CC[N@H+](C)C2)C1	ZINC000602961511	359323939	/nfs/dbraw/zinc/32/39/39/359323939.db2.gz	UUKSYINBAUEHPO-OAHLLOKOSA-N	1	1	319.365	1.280	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000187007408	200046684	/nfs/dbraw/zinc/04/66/84/200046684.db2.gz	LGRKVBSWWMXUKK-WDEREUQCSA-N	1	1	322.365	1.546	20	5		DDBDMO
COC[C@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000603426020	359633197	/nfs/dbraw/zinc/63/31/97/359633197.db2.gz	BPCLIZRBMCRQPH-VIFPVBQESA-N	1	1	306.265	1.293	20	5		DDBDMO
C[N@H+]1CCN(C(=O)NCc2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000603433739	359637270	/nfs/dbraw/zinc/63/72/70/359637270.db2.gz	VUOAQKZQXYVDAY-UHFFFAOYSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1CC(C)(C)O	ZINC000188643938	200280462	/nfs/dbraw/zinc/28/04/62/200280462.db2.gz	BZUYFVWLEAHQEU-JTQLQIEISA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1CC(C)(C)O	ZINC000188643938	200280463	/nfs/dbraw/zinc/28/04/63/200280463.db2.gz	BZUYFVWLEAHQEU-JTQLQIEISA-N	1	1	311.338	1.105	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000189329906	200382973	/nfs/dbraw/zinc/38/29/73/200382973.db2.gz	BIDIYOISNYOWCL-NSHDSACASA-N	1	1	322.365	1.554	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1	ZINC000608985025	360255982	/nfs/dbraw/zinc/25/59/82/360255982.db2.gz	HPJXELQTLJTQAA-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](CCCO)C2CC2)c1	ZINC000609848230	360356689	/nfs/dbraw/zinc/35/66/89/360356689.db2.gz	MPJGUSOVMNTSKN-AWEZNQCLSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=C(C[N@@H+]1C[C@H]2CCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762769	360531569	/nfs/dbraw/zinc/53/15/69/360531569.db2.gz	UDRNEYHHSZMTFO-OCCSQVGLSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@H]2CCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762769	360531573	/nfs/dbraw/zinc/53/15/73/360531573.db2.gz	UDRNEYHHSZMTFO-OCCSQVGLSA-N	1	1	301.346	1.968	20	5		DDBDMO
CNc1c(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613235005	361342043	/nfs/dbraw/zinc/34/20/43/361342043.db2.gz	LBZPWBGKJCSWPO-GXFFZTMASA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613235005	361342047	/nfs/dbraw/zinc/34/20/47/361342047.db2.gz	LBZPWBGKJCSWPO-GXFFZTMASA-N	1	1	322.365	1.085	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)[C@H]2[NH2+]CCO[C@@H]2C)cc1[N+](=O)[O-]	ZINC000261926685	203154228	/nfs/dbraw/zinc/15/42/28/203154228.db2.gz	LDRIVWUNASBBSZ-GYSYKLTISA-N	1	1	307.350	1.457	20	5		DDBDMO
C[C@@H]1C[C@@H]1N1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1=O	ZINC000350290216	284178920	/nfs/dbraw/zinc/17/89/20/284178920.db2.gz	UKJSNPDWBKUEHM-UDZFHETQSA-N	1	1	307.325	1.833	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2ccc([N+](=O)[O-])c(C(C)=O)c2)CC1	ZINC000288503197	220185734	/nfs/dbraw/zinc/18/57/34/220185734.db2.gz	SFJOYBSYMOJDKB-CYBMUJFWSA-N	1	1	321.377	1.690	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000261993352	296227642	/nfs/dbraw/zinc/22/76/42/296227642.db2.gz	PDYQANYAAVAKEZ-NSHDSACASA-N	1	1	302.290	1.370	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000334047272	249193055	/nfs/dbraw/zinc/19/30/55/249193055.db2.gz	BECTZVWVHOSCIZ-RYUDHWBXSA-N	1	1	306.366	1.968	20	5		DDBDMO
CC(C)[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])N1CCN(C)CC1	ZINC000064620233	184301593	/nfs/dbraw/zinc/30/15/93/184301593.db2.gz	SRZUMVHOKHAVCH-QGZVFWFLSA-N	1	1	320.437	1.956	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCC1(F)F	ZINC000289664189	221138346	/nfs/dbraw/zinc/13/83/46/221138346.db2.gz	FNCAMXUEVXLLEI-SNVBAGLBSA-N	1	1	301.293	1.734	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000569041921	304331931	/nfs/dbraw/zinc/33/19/31/304331931.db2.gz	VIUTZWFLIJLKRY-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@]1(C)CO)c1ccc([N+](=O)[O-])cc1	ZINC000569862158	304383412	/nfs/dbraw/zinc/38/34/12/304383412.db2.gz	ZXCZMLFGNFKVHF-OAHLLOKOSA-N	1	1	307.350	1.404	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000069035020	406677803	/nfs/dbraw/zinc/67/78/03/406677803.db2.gz	ULHQOSXDNYIFJD-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+][C@H](C)C2)cc1C	ZINC000088059691	407120486	/nfs/dbraw/zinc/12/04/86/407120486.db2.gz	MVGHFIXWQYTIKP-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[C@H](CSC)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000091097021	407177752	/nfs/dbraw/zinc/17/77/52/407177752.db2.gz	LXXCGKVFGDGFLH-PWSUYJOCSA-N	1	1	302.400	1.226	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C(C)C)CC2)c1	ZINC000067547214	407275532	/nfs/dbraw/zinc/27/55/32/407275532.db2.gz	MUSIIYYPXBUAPR-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H](C[S@@](C)=O)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159545	407407074	/nfs/dbraw/zinc/40/70/74/407407074.db2.gz	DBVNIYMGBRDROW-WWHJXGCHSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@@H](C[S@@](C)=O)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159545	407407075	/nfs/dbraw/zinc/40/70/75/407407075.db2.gz	DBVNIYMGBRDROW-WWHJXGCHSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc([S@@](C)=O)cc1	ZINC000178420524	407451976	/nfs/dbraw/zinc/45/19/76/407451976.db2.gz	ONSTYBKVSHSKLK-JOCHJYFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc([S@@](C)=O)cc1	ZINC000178420524	407451981	/nfs/dbraw/zinc/45/19/81/407451981.db2.gz	ONSTYBKVSHSKLK-JOCHJYFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
CC[N@H+](Cc1ccncc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270998746	407460169	/nfs/dbraw/zinc/46/01/69/407460169.db2.gz	JWLTXNHXNIQTSG-AWEZNQCLSA-N	1	1	305.338	1.069	20	5		DDBDMO
C[C@]1(CCCO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000271173368	407553410	/nfs/dbraw/zinc/55/34/10/407553410.db2.gz	DUZLUPTXNLJIGG-MRXNPFEDSA-N	1	1	321.377	1.821	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H]1CCOC1	ZINC000178758331	407587622	/nfs/dbraw/zinc/58/76/22/407587622.db2.gz	DOSLYBLMUIBPIB-LBPRGKRZSA-N	1	1	319.361	1.452	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+]2CCC[C@@H]2C1	ZINC000178623873	407518050	/nfs/dbraw/zinc/51/80/50/407518050.db2.gz	ANFSWBMDTWCALO-CQSZACIVSA-N	1	1	318.377	1.622	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)Cn1cccn1	ZINC000171637167	407729016	/nfs/dbraw/zinc/72/90/16/407729016.db2.gz	NDWXUFDFDTWYCH-ZDUSSCGKSA-N	1	1	324.768	1.938	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@H](O)Cn1cccn1	ZINC000171637167	407729024	/nfs/dbraw/zinc/72/90/24/407729024.db2.gz	NDWXUFDFDTWYCH-ZDUSSCGKSA-N	1	1	324.768	1.938	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CC1(CO)CC1	ZINC000186786567	407768548	/nfs/dbraw/zinc/76/85/48/407768548.db2.gz	USRBEUYGTNZQDC-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CC1(CO)CC1	ZINC000186786567	407768553	/nfs/dbraw/zinc/76/85/53/407768553.db2.gz	USRBEUYGTNZQDC-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000268216211	407951750	/nfs/dbraw/zinc/95/17/50/407951750.db2.gz	PNXGBLYEUFLPCL-BXKDBHETSA-N	1	1	304.350	1.390	20	5		DDBDMO
CC[N@@H+]1CCCC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272542557	407970776	/nfs/dbraw/zinc/97/07/76/407970776.db2.gz	OBFZMDZAHAUTDN-LBPRGKRZSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272542557	407970783	/nfs/dbraw/zinc/97/07/83/407970783.db2.gz	OBFZMDZAHAUTDN-LBPRGKRZSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000272551633	407979436	/nfs/dbraw/zinc/97/94/36/407979436.db2.gz	YZHHRYHZBYRZKB-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1	ZINC000189677328	408077633	/nfs/dbraw/zinc/07/76/33/408077633.db2.gz	HNODVCDYVHVARO-GFUIURDCSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182220800	408098186	/nfs/dbraw/zinc/09/81/86/408098186.db2.gz	DQGXXAUHODJIDV-RDBSUJKOSA-N	1	1	324.377	1.570	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+](C)CC2(CO)CC2)cccc1[N+](=O)[O-]	ZINC000190031992	408150744	/nfs/dbraw/zinc/15/07/44/408150744.db2.gz	WUNRGZWWLALBSE-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)CC2(CO)CC2)cccc1[N+](=O)[O-]	ZINC000190031992	408150750	/nfs/dbraw/zinc/15/07/50/408150750.db2.gz	WUNRGZWWLALBSE-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246280443	408204140	/nfs/dbraw/zinc/20/41/40/408204140.db2.gz	NLYGOXXKLVNOLB-UKRRQHHQSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H]1C[NH+](CCCNc2ncc([N+](=O)[O-])s2)C[C@@H](C)O1	ZINC000190312657	408218975	/nfs/dbraw/zinc/21/89/75/408218975.db2.gz	DFGLEORXZWKCOC-NXEZZACHSA-N	1	1	300.384	1.963	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000190365677	408229921	/nfs/dbraw/zinc/22/99/21/408229921.db2.gz	IXZDEASTPPHPHQ-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)C2(CCCCC2)C1	ZINC000176244456	408322702	/nfs/dbraw/zinc/32/27/02/408322702.db2.gz	KEJWJPQFEZHJFX-UHFFFAOYSA-N	1	1	321.381	1.268	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)C[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269330190	408269933	/nfs/dbraw/zinc/26/99/33/408269933.db2.gz	DYUBOUYKGAWOFI-SNVBAGLBSA-N	1	1	309.370	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000269330190	408269939	/nfs/dbraw/zinc/26/99/39/408269939.db2.gz	DYUBOUYKGAWOFI-SNVBAGLBSA-N	1	1	309.370	1.465	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269330190	408269942	/nfs/dbraw/zinc/26/99/42/408269942.db2.gz	DYUBOUYKGAWOFI-SNVBAGLBSA-N	1	1	309.370	1.465	20	5		DDBDMO
NC(=O)c1ccc(C[NH2+][C@@H](CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000182915985	408283921	/nfs/dbraw/zinc/28/39/21/408283921.db2.gz	KHORAWIKOZHTAY-AWEZNQCLSA-N	1	1	315.329	1.517	20	5		DDBDMO
Cc1noc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000176214805	408313439	/nfs/dbraw/zinc/31/34/39/408313439.db2.gz	PLNZNMSQJIPMRR-LLVKDONJSA-N	1	1	306.326	1.362	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000134133879	162072094	/nfs/dbraw/zinc/07/20/94/162072094.db2.gz	MNVLZXJKYFCIFL-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CC2)CC1	ZINC000173337350	162333821	/nfs/dbraw/zinc/33/38/21/162333821.db2.gz	HDTBCMQPBLHPFC-UHFFFAOYSA-N	1	1	303.362	1.834	20	5		DDBDMO
O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCC[N@H+]1C1CCCC1	ZINC000269743849	408414186	/nfs/dbraw/zinc/41/41/86/408414186.db2.gz	XXPVOWQDCPYLDH-AWEZNQCLSA-N	1	1	321.381	1.315	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)n1	ZINC000191783820	408491244	/nfs/dbraw/zinc/49/12/44/408491244.db2.gz	KHRLFCIDMYATHE-NWDGAFQWSA-N	1	1	323.397	1.661	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000176868388	408462466	/nfs/dbraw/zinc/46/24/66/408462466.db2.gz	NKLJEFKFQBVKBO-MNOVXSKESA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000248683818	408616530	/nfs/dbraw/zinc/61/65/30/408616530.db2.gz	XXCHNHFZLGYWLR-NEPJUHHUSA-N	1	1	321.381	1.510	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1	ZINC000184610803	408655753	/nfs/dbraw/zinc/65/57/53/408655753.db2.gz	JBPMTJZFJXQGHB-UHFFFAOYSA-N	1	1	310.354	1.339	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(N)c2F)[C@H](C)C1	ZINC000281611749	408896270	/nfs/dbraw/zinc/89/62/70/408896270.db2.gz	ZEULRBKZEWHTSF-ZJUUUORDSA-N	1	1	312.345	1.207	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000277368849	408928368	/nfs/dbraw/zinc/92/83/68/408928368.db2.gz	CWCTUDUOHDYKCQ-NSHDSACASA-N	1	1	323.349	1.054	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1CO	ZINC000190926540	163165100	/nfs/dbraw/zinc/16/51/00/163165100.db2.gz	AWVJWLBRHGXFAU-XUJVJEKNSA-N	1	1	319.361	1.260	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000277386081	408930799	/nfs/dbraw/zinc/93/07/99/408930799.db2.gz	BOCNNUTYQIFZAA-LLVKDONJSA-N	1	1	321.381	1.627	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C2(CO)CCC2)c([N+](=O)[O-])c1	ZINC000292251369	409009976	/nfs/dbraw/zinc/00/99/76/409009976.db2.gz	XSEYDZDJXBDWEJ-UHFFFAOYSA-N	1	1	310.350	1.829	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCS[C@@H]3COCC[C@@H]32)c1	ZINC000246283004	163473295	/nfs/dbraw/zinc/47/32/95/163473295.db2.gz	NVVMKYAMGGBPLV-RRFJBIMHSA-N	1	1	324.402	1.835	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1c2c(ccc1[N+](=O)[O-])NCC2	ZINC000278483367	409084381	/nfs/dbraw/zinc/08/43/81/409084381.db2.gz	VPGSPOJZVOEPRR-NSHDSACASA-N	1	1	305.382	1.221	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000283104570	409088993	/nfs/dbraw/zinc/08/89/93/409088993.db2.gz	WUOBBMLRHXXXIJ-GFCCVEGCSA-N	1	1	307.350	1.262	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000283104570	409088996	/nfs/dbraw/zinc/08/89/96/409088996.db2.gz	WUOBBMLRHXXXIJ-GFCCVEGCSA-N	1	1	307.350	1.262	20	5		DDBDMO
C[C@H]1C[C@@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000279275597	409182702	/nfs/dbraw/zinc/18/27/02/409182702.db2.gz	VYRDHFIKWPLGHR-JSGCOSHPSA-N	1	1	305.378	1.984	20	5		DDBDMO
C[C@@H]1CN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293899384	409202878	/nfs/dbraw/zinc/20/28/78/409202878.db2.gz	FEAKNUCATPGQJN-BETUJISGSA-N	1	1	320.393	1.582	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[N@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000284269191	409307484	/nfs/dbraw/zinc/30/74/84/409307484.db2.gz	GUUBLVWFPPMXQL-UONOGXRCSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@H]2CCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000280470162	409317237	/nfs/dbraw/zinc/31/72/37/409317237.db2.gz	GKMZEDMYQVVGQO-GFCCVEGCSA-N	1	1	307.350	1.492	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000295716167	409364957	/nfs/dbraw/zinc/36/49/57/409364957.db2.gz	NPCIKBZWBGXZGR-GFCCVEGCSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000295221549	409382582	/nfs/dbraw/zinc/38/25/82/409382582.db2.gz	MSWMQAVOMITKRP-AWEZNQCLSA-N	1	1	311.313	1.134	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000290448222	409406052	/nfs/dbraw/zinc/40/60/52/409406052.db2.gz	CWCJKQDCJIMTLG-WDEREUQCSA-N	1	1	305.338	1.127	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)c1	ZINC000295333568	409439737	/nfs/dbraw/zinc/43/97/37/409439737.db2.gz	XTJFFXHUEZTAHQ-CQSZACIVSA-N	1	1	311.313	1.377	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000321723620	164045428	/nfs/dbraw/zinc/04/54/28/164045428.db2.gz	ZXTUUSQAZQLYMG-QWHCGFSZSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[C@H]1C[N@@H+]2CCCC[C@@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056020	164211294	/nfs/dbraw/zinc/21/12/94/164211294.db2.gz	ZXDBQFPOGNWTQW-WDEREUQCSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056020	164211296	/nfs/dbraw/zinc/21/12/96/164211296.db2.gz	ZXDBQFPOGNWTQW-WDEREUQCSA-N	1	1	307.354	1.027	20	5		DDBDMO
Cc1nc(NCC(C)(C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000296453157	409566750	/nfs/dbraw/zinc/56/67/50/409566750.db2.gz	IWHUKZBRKONVSM-PHIMTYICSA-N	1	1	323.397	1.993	20	5		DDBDMO
Cc1nc(NCC(C)(C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000296453157	409566753	/nfs/dbraw/zinc/56/67/53/409566753.db2.gz	IWHUKZBRKONVSM-PHIMTYICSA-N	1	1	323.397	1.993	20	5		DDBDMO
COC(=O)c1cc(OC[C@@H](O)C[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000290750589	409507754	/nfs/dbraw/zinc/50/77/54/409507754.db2.gz	ISCFUJJJPHANIL-NSHDSACASA-N	1	1	324.333	1.215	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356747720	409568745	/nfs/dbraw/zinc/56/87/45/409568745.db2.gz	TZXKCFJVOHCXCO-VIFPVBQESA-N	1	1	312.345	1.775	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCCC[C@H]3CO)o2)cc1	ZINC000303049558	409530229	/nfs/dbraw/zinc/53/02/29/409530229.db2.gz	ZMJDAUYJFGGLSF-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC[C@H]3CO)o2)cc1	ZINC000303049558	409530237	/nfs/dbraw/zinc/53/02/37/409530237.db2.gz	ZMJDAUYJFGGLSF-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
Cc1c(C[N@@H+](CCO)CCN2CCOCC2)cccc1[N+](=O)[O-]	ZINC000304670830	409636782	/nfs/dbraw/zinc/63/67/82/409636782.db2.gz	CBRRLTVCDLRENH-UHFFFAOYSA-N	1	1	323.393	1.030	20	5		DDBDMO
Cc1nccn1CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000342604848	409758514	/nfs/dbraw/zinc/75/85/14/409758514.db2.gz	FXKTZMKAVIHLED-CYBMUJFWSA-N	1	1	316.365	1.681	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@@H]2COCCO2)CC1	ZINC000354616988	409971707	/nfs/dbraw/zinc/97/17/07/409971707.db2.gz	WHRLLDXQHIETOP-CYBMUJFWSA-N	1	1	307.350	1.132	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357425037	410032571	/nfs/dbraw/zinc/03/25/71/410032571.db2.gz	RNABGSZGIMXGOO-QWHCGFSZSA-N	1	1	321.377	1.963	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1C	ZINC000346691741	410087012	/nfs/dbraw/zinc/08/70/12/410087012.db2.gz	WAZSXXSPSZRMFJ-BXKDBHETSA-N	1	1	321.333	1.077	20	5		DDBDMO
C[C@H]([NH3+])[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000351753342	410212134	/nfs/dbraw/zinc/21/21/34/410212134.db2.gz	FDSJLQOFXHIFOL-IUCAKERBSA-N	1	1	303.322	1.280	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc(F)cc1[N+](=O)[O-]	ZINC000299002305	410480428	/nfs/dbraw/zinc/48/04/28/410480428.db2.gz	JWXRWTRYIVHTFN-NEPJUHHUSA-N	1	1	322.340	1.673	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243507	410670591	/nfs/dbraw/zinc/67/05/91/410670591.db2.gz	HGVHLLITUISMBA-NEPJUHHUSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243507	410670594	/nfs/dbraw/zinc/67/05/94/410670594.db2.gz	HGVHLLITUISMBA-NEPJUHHUSA-N	1	1	323.349	1.005	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000352361591	410647017	/nfs/dbraw/zinc/64/70/17/410647017.db2.gz	RXPYLRRIZCLCNP-UHFFFAOYSA-N	1	1	318.377	2.523	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCC[NH+]1CCN(C)CC1	ZINC000359414120	410649060	/nfs/dbraw/zinc/64/90/60/410649060.db2.gz	GKAHNHFIIYAPAP-UHFFFAOYSA-N	1	1	310.402	1.169	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1	ZINC000343829903	410731737	/nfs/dbraw/zinc/73/17/37/410731737.db2.gz	NHUCSGXQWPTVRC-HZMBPMFUSA-N	1	1	319.361	1.816	20	5		DDBDMO
CC[C@@]1(C)COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762175	410677728	/nfs/dbraw/zinc/67/77/28/410677728.db2.gz	KUQLDNKEIYNLCT-CJNGLKHVSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762175	410677735	/nfs/dbraw/zinc/67/77/35/410677735.db2.gz	KUQLDNKEIYNLCT-CJNGLKHVSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCOc1cc(N2C[C@H]3OCC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000301633395	410759470	/nfs/dbraw/zinc/75/94/70/410759470.db2.gz	DIZVMCFTQYDSSY-DZGCQCFKSA-N	1	1	307.350	1.513	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330581322	410798092	/nfs/dbraw/zinc/79/80/92/410798092.db2.gz	JBGSCRZQYMPNPB-RYUDHWBXSA-N	1	1	305.378	1.997	20	5		DDBDMO
Cc1nn(C)c(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301884953	410822666	/nfs/dbraw/zinc/82/26/66/410822666.db2.gz	ZEUDTZFHPMEKEJ-NWDGAFQWSA-N	1	1	309.370	1.302	20	5		DDBDMO
Cc1nn(C)c(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301884953	410822673	/nfs/dbraw/zinc/82/26/73/410822673.db2.gz	ZEUDTZFHPMEKEJ-NWDGAFQWSA-N	1	1	309.370	1.302	20	5		DDBDMO
C[C@@H]1[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@@H+]1C	ZINC000343962749	410854679	/nfs/dbraw/zinc/85/46/79/410854679.db2.gz	CNBDLTGLTFYFNN-GHMZBOCLSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H]1[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343962749	410854689	/nfs/dbraw/zinc/85/46/89/410854689.db2.gz	CNBDLTGLTFYFNN-GHMZBOCLSA-N	1	1	313.379	1.356	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)n1	ZINC000356253895	410924598	/nfs/dbraw/zinc/92/45/98/410924598.db2.gz	NKZSBITVCYXNFV-HNNXBMFYSA-N	1	1	321.381	1.369	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344068253	410934767	/nfs/dbraw/zinc/93/47/67/410934767.db2.gz	QIRRRIFZUGCELZ-SFDCQRBFSA-N	1	1	322.361	1.037	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000331111880	410955855	/nfs/dbraw/zinc/95/58/55/410955855.db2.gz	LMHTXUFSHZBTBD-STQMWFEESA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000331111880	410955857	/nfs/dbraw/zinc/95/58/57/410955857.db2.gz	LMHTXUFSHZBTBD-STQMWFEESA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1C	ZINC000353490964	411027009	/nfs/dbraw/zinc/02/70/09/411027009.db2.gz	LOKGZRXUJWUTON-WDEREUQCSA-N	1	1	321.381	1.517	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C1CC(O)C1	ZINC000353500889	411035574	/nfs/dbraw/zinc/03/55/74/411035574.db2.gz	YFZZDNRSPNRTRE-UHFFFAOYSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000358062408	299062192	/nfs/dbraw/zinc/06/21/92/299062192.db2.gz	HTVXAXXVGZNKIE-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[C@@H]1C[C@@]2(CCO1)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H](C)O2	ZINC000374018909	418483865	/nfs/dbraw/zinc/48/38/65/418483865.db2.gz	QCDWTCAAEFIBHI-IPYPFGDCSA-N	1	1	324.381	1.450	20	5		DDBDMO
C[C@@H]1C[C@@]2(CCO1)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H](C)O2	ZINC000374018909	418483867	/nfs/dbraw/zinc/48/38/67/418483867.db2.gz	QCDWTCAAEFIBHI-IPYPFGDCSA-N	1	1	324.381	1.450	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1CC[NH2+]C(C)(C)C1	ZINC000212577584	418559301	/nfs/dbraw/zinc/55/93/01/418559301.db2.gz	DPMQPCQGZBUZNP-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]12	ZINC000367840327	418644182	/nfs/dbraw/zinc/64/41/82/418644182.db2.gz	QDSKXAXHFFTWHW-QWRGUYRKSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]12	ZINC000367840327	418644183	/nfs/dbraw/zinc/64/41/83/418644183.db2.gz	QDSKXAXHFFTWHW-QWRGUYRKSA-N	1	1	323.736	1.343	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000361293310	418619431	/nfs/dbraw/zinc/61/94/31/418619431.db2.gz	WNBCFRFCADELGR-SMDDNHRTSA-N	1	1	304.350	1.546	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@H](O)c3ccccc3C2)c1	ZINC000368224466	418706980	/nfs/dbraw/zinc/70/69/80/418706980.db2.gz	UHJFAIAKTIKXIE-HNNXBMFYSA-N	1	1	302.334	1.731	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]2C(=O)NC[C@@H]2C1	ZINC000368072062	418684725	/nfs/dbraw/zinc/68/47/25/418684725.db2.gz	ODNKGJJCUICUSI-DGCLKSJQSA-N	1	1	305.334	1.171	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](CC(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000368134956	418694187	/nfs/dbraw/zinc/69/41/87/418694187.db2.gz	NRKSZIISJLEGLB-JTQLQIEISA-N	1	1	323.349	1.309	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H]3OCC[N@H+](C)[C@@H]3C2)n1	ZINC000408025347	418782482	/nfs/dbraw/zinc/78/24/82/418782482.db2.gz	BCEFJGYNIBODNU-CHWSQXEVSA-N	1	1	306.366	1.516	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990172	418755491	/nfs/dbraw/zinc/75/54/91/418755491.db2.gz	BZKUJDSQYWJIFQ-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370990172	418755494	/nfs/dbraw/zinc/75/54/94/418755494.db2.gz	BZKUJDSQYWJIFQ-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990172	418755496	/nfs/dbraw/zinc/75/54/96/418755496.db2.gz	BZKUJDSQYWJIFQ-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]([C@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000371232283	418770056	/nfs/dbraw/zinc/77/00/56/418770056.db2.gz	ROBIQQXDXUMAES-OLZOCXBDSA-N	1	1	319.361	1.892	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000364468283	418778444	/nfs/dbraw/zinc/77/84/44/418778444.db2.gz	ZOLKBZIFPFNPDL-ZIAGYGMSSA-N	1	1	305.334	1.188	20	5		DDBDMO
CC(C)CNC(=O)[C@@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290152	418851531	/nfs/dbraw/zinc/85/15/31/418851531.db2.gz	VRYMMDBOGHEVIL-OLZOCXBDSA-N	1	1	323.397	1.589	20	5		DDBDMO
CC(C)CNC(=O)[C@@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372290152	418851533	/nfs/dbraw/zinc/85/15/33/418851533.db2.gz	VRYMMDBOGHEVIL-OLZOCXBDSA-N	1	1	323.397	1.589	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@H]1C[C@@H]1[N+](=O)[O-])CC2)C1CC1	ZINC000372840211	418907461	/nfs/dbraw/zinc/90/74/61/418907461.db2.gz	VWHYNTQPSQAING-UBHSHLNASA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@H+](C[C@@H]1CC12CCN(C(=O)[C@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840211	418907465	/nfs/dbraw/zinc/90/74/65/418907465.db2.gz	VWHYNTQPSQAING-UBHSHLNASA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@@H+](C[C@@H]1CC12CCN(C(=O)[C@H]1CC1[N+](=O)[O-])CC2)C1CC1	ZINC000372840211	418907468	/nfs/dbraw/zinc/90/74/68/418907468.db2.gz	VWHYNTQPSQAING-UBHSHLNASA-N	1	1	307.394	1.375	20	5		DDBDMO
O=C1CCCN1C[C@@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000365833395	418914570	/nfs/dbraw/zinc/91/45/70/418914570.db2.gz	FSSZVOCZGFZNQM-ZDUSSCGKSA-N	1	1	321.381	1.268	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420996431	419431686	/nfs/dbraw/zinc/43/16/86/419431686.db2.gz	ATNUYQRECVNQAN-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000420997700	419434159	/nfs/dbraw/zinc/43/41/59/419434159.db2.gz	BCLNCNVTXGJOHY-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000420997700	419434169	/nfs/dbraw/zinc/43/41/69/419434169.db2.gz	BCLNCNVTXGJOHY-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@@H]1CCC(=O)N1	ZINC000412093750	419651049	/nfs/dbraw/zinc/65/10/49/419651049.db2.gz	WPIXOVYHDZAWFK-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[NH+](C3CCC3)CC2)n1	ZINC000427845453	419751121	/nfs/dbraw/zinc/75/11/21/419751121.db2.gz	XMLVHJKMJXJXKI-UHFFFAOYSA-N	1	1	307.354	1.122	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000299527698	229182580	/nfs/dbraw/zinc/18/25/80/229182580.db2.gz	MMYFZXQYICRNLT-UHFFFAOYSA-N	1	1	317.349	1.596	20	5		DDBDMO
C[C@@H]1CN(CCn2ccc([N+](=O)[O-])n2)CC[N@H+](C2CCC2)C1	ZINC000429354202	420008206	/nfs/dbraw/zinc/00/82/06/420008206.db2.gz	MICGVRSKNSCSTK-CYBMUJFWSA-N	1	1	307.398	1.598	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)CCOC1	ZINC000430198463	420089459	/nfs/dbraw/zinc/08/94/59/420089459.db2.gz	YNWHQGFIFJYYCB-OAHLLOKOSA-N	1	1	324.333	1.415	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)C1CC([NH3+])C1	ZINC000420330621	420215248	/nfs/dbraw/zinc/21/52/48/420215248.db2.gz	LJENYVGGMHGRQY-UHFFFAOYSA-N	1	1	306.366	1.653	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000420383080	420250868	/nfs/dbraw/zinc/25/08/68/420250868.db2.gz	BGDBFWLMQSQMEP-UHFFFAOYSA-N	1	1	324.381	1.473	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CSc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000453023684	420702713	/nfs/dbraw/zinc/70/27/13/420702713.db2.gz	DKCMXPLENMHPKS-YPMHNXCESA-N	1	1	321.402	1.849	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CCO)C[C@@H]1C	ZINC000454139182	420805449	/nfs/dbraw/zinc/80/54/49/420805449.db2.gz	DLWVXWGJWBYVAH-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](CCO)C[C@@H]1C	ZINC000454139182	420805454	/nfs/dbraw/zinc/80/54/54/420805454.db2.gz	DLWVXWGJWBYVAH-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000493392997	420837001	/nfs/dbraw/zinc/83/70/01/420837001.db2.gz	RGDQNIDBGATEGH-WXJAXGNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000493392997	420837002	/nfs/dbraw/zinc/83/70/02/420837002.db2.gz	RGDQNIDBGATEGH-WXJAXGNASA-N	1	1	319.361	1.133	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456017553	421090053	/nfs/dbraw/zinc/09/00/53/421090053.db2.gz	ZBKHHBNCDGUFIE-ZJUUUORDSA-N	1	1	307.354	1.244	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456357982	421149035	/nfs/dbraw/zinc/14/90/35/421149035.db2.gz	STPCNWPTICWYJX-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000450279458	421176372	/nfs/dbraw/zinc/17/63/72/421176372.db2.gz	VHGUUFITBFQCBR-LBPRGKRZSA-N	1	1	319.361	1.959	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCn2cc[nH+]c2C1	ZINC000489925374	421180816	/nfs/dbraw/zinc/18/08/16/421180816.db2.gz	OEBJIKQXLCZAEG-SNVBAGLBSA-N	1	1	315.333	1.578	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@]1(C)CO	ZINC000546103786	421285340	/nfs/dbraw/zinc/28/53/40/421285340.db2.gz	YTCNARAZFZTCBF-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@]1(C)CO	ZINC000546103786	421285343	/nfs/dbraw/zinc/28/53/43/421285343.db2.gz	YTCNARAZFZTCBF-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548386069	421431764	/nfs/dbraw/zinc/43/17/64/421431764.db2.gz	YGYPHONTTFSNJH-WDEREUQCSA-N	1	1	321.381	1.422	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](Cc3c([N+](=O)[O-])ncn3C)CC2(C)C)cn1	ZINC000571341435	421706831	/nfs/dbraw/zinc/70/68/31/421706831.db2.gz	LEBARNAKWSGBFX-LBPRGKRZSA-N	1	1	318.381	1.687	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000581414159	421965321	/nfs/dbraw/zinc/96/53/21/421965321.db2.gz	QFKPYJBCDJWJMO-CYBMUJFWSA-N	1	1	306.366	1.830	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccnc(NC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000584788293	422300867	/nfs/dbraw/zinc/30/08/67/422300867.db2.gz	KNBGKSYFTYFFLN-WDEREUQCSA-N	1	1	321.381	1.586	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2ccnc(NC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000584788292	422301402	/nfs/dbraw/zinc/30/14/02/422301402.db2.gz	KNBGKSYFTYFFLN-QWRGUYRKSA-N	1	1	321.381	1.586	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](c3ccnc(N)n3)C2)c1[N+](=O)[O-]	ZINC000595461061	422356663	/nfs/dbraw/zinc/35/66/63/422356663.db2.gz	LGJONEBMITWOHM-SNVBAGLBSA-N	1	1	318.337	1.643	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](c3ccnc(N)n3)C2)c1[N+](=O)[O-]	ZINC000595461061	422356671	/nfs/dbraw/zinc/35/66/71/422356671.db2.gz	LGJONEBMITWOHM-SNVBAGLBSA-N	1	1	318.337	1.643	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(N)c2F)CC1	ZINC000345004406	272154786	/nfs/dbraw/zinc/15/47/86/272154786.db2.gz	ANZCOJNAMTWKAZ-JTQLQIEISA-N	1	1	312.345	1.209	20	5		DDBDMO
C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H]1C[NH3+]	ZINC000156654502	274289822	/nfs/dbraw/zinc/28/98/22/274289822.db2.gz	FIMBZDGVSAXHPG-NOZJJQNGSA-N	1	1	317.349	1.671	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N1CC[NH+](CCCO)CC1	ZINC000269340700	275033574	/nfs/dbraw/zinc/03/35/74/275033574.db2.gz	CBSWNMUKKDHOHY-UHFFFAOYSA-N	1	1	300.746	1.148	20	5		DDBDMO
CCOC[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000459711059	276330563	/nfs/dbraw/zinc/33/05/63/276330563.db2.gz	LVONBXMSGVPNAT-AWEZNQCLSA-N	1	1	309.366	1.648	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3cccc(C(N)=O)c3[N+](=O)[O-])C2)C1	ZINC000488767897	277161101	/nfs/dbraw/zinc/16/11/01/277161101.db2.gz	LJRPKPDSVWXJPK-OAHLLOKOSA-N	1	1	304.350	1.226	20	5		DDBDMO
COc1cccc(N2CCC([N@@H+](C)CCCO)CC2)c1[N+](=O)[O-]	ZINC000185425702	278015702	/nfs/dbraw/zinc/01/57/02/278015702.db2.gz	KHAPILNSLWAZTI-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000122605134	281158939	/nfs/dbraw/zinc/15/89/39/281158939.db2.gz	OUCRHFDGFCBMEJ-HNNXBMFYSA-N	1	1	318.377	1.757	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000125286492	281205804	/nfs/dbraw/zinc/20/58/04/281205804.db2.gz	LJSJMAZWIYLTEW-CYBMUJFWSA-N	1	1	318.377	1.757	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H]1CCOC1	ZINC000247212256	282038536	/nfs/dbraw/zinc/03/85/36/282038536.db2.gz	XZCLADODYOWOBH-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)C1	ZINC000362940575	300183778	/nfs/dbraw/zinc/18/37/78/300183778.db2.gz	GMQFHPVMTOFILI-QGZVFWFLSA-N	1	1	318.421	1.807	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@H]21	ZINC000368590253	301060198	/nfs/dbraw/zinc/06/01/98/301060198.db2.gz	KJKJCAFWGXTFHR-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000368590251	301060281	/nfs/dbraw/zinc/06/02/81/301060281.db2.gz	KJKJCAFWGXTFHR-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
CC[C@@H]1C[N@H+]2CCCC[C@H]2CN1Cc1c([N+](=O)[O-])ncn1C	ZINC000375869458	302007715	/nfs/dbraw/zinc/00/77/15/302007715.db2.gz	AGBULJABLODGJF-OLZOCXBDSA-N	1	1	307.398	1.777	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000531829408	303259916	/nfs/dbraw/zinc/25/99/16/303259916.db2.gz	HIDDBKIFLGPWJN-ZDUSSCGKSA-N	1	1	312.366	1.691	20	5		DDBDMO
O=C(N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1)c1cc([N+](=O)[O-])c[nH]1	ZINC000531918227	303266068	/nfs/dbraw/zinc/26/60/68/303266068.db2.gz	APWQKZBWFCKHIR-JSGCOSHPSA-N	1	1	322.365	1.296	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C)Cc2ccccc21	ZINC000536033719	303354254	/nfs/dbraw/zinc/35/42/54/303354254.db2.gz	AMOXTZPMIOVJPC-AWEZNQCLSA-N	1	1	314.345	1.850	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21	ZINC000536033719	303354257	/nfs/dbraw/zinc/35/42/57/303354257.db2.gz	AMOXTZPMIOVJPC-AWEZNQCLSA-N	1	1	314.345	1.850	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362073542	307012837	/nfs/dbraw/zinc/01/28/37/307012837.db2.gz	XNAXAFUMIYSNRX-RYUDHWBXSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362073542	307012838	/nfs/dbraw/zinc/01/28/38/307012838.db2.gz	XNAXAFUMIYSNRX-RYUDHWBXSA-N	1	1	307.350	1.402	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000363593315	307032278	/nfs/dbraw/zinc/03/22/78/307032278.db2.gz	XYTZNWXWUQWIMD-KBPBESRZSA-N	1	1	321.381	1.267	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000366117965	307068316	/nfs/dbraw/zinc/06/83/16/307068316.db2.gz	GQLBEYOIFDGWQS-LBPRGKRZSA-N	1	1	322.390	1.253	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](OCC2CC2)C1	ZINC000368793276	307109899	/nfs/dbraw/zinc/10/98/99/307109899.db2.gz	URGHSFCMPWFLND-HNNXBMFYSA-N	1	1	321.377	1.648	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@@H](CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000374040292	307200128	/nfs/dbraw/zinc/20/01/28/307200128.db2.gz	UQNBGZKKTULFLK-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@@H](CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000374040292	307200129	/nfs/dbraw/zinc/20/01/29/307200129.db2.gz	UQNBGZKKTULFLK-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C[C@H]21	ZINC000375047436	307217979	/nfs/dbraw/zinc/21/79/79/307217979.db2.gz	DDQQTRDWIAFFNO-WDEREUQCSA-N	1	1	302.338	1.168	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000570120485	308159750	/nfs/dbraw/zinc/15/97/50/308159750.db2.gz	SPSHJSYSRREYTL-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000570120485	308159752	/nfs/dbraw/zinc/15/97/52/308159752.db2.gz	SPSHJSYSRREYTL-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N2CC[NH2+]C[C@H]2C)cc1[N+](=O)[O-]	ZINC000576943378	308351202	/nfs/dbraw/zinc/35/12/02/308351202.db2.gz	FLERLIYBVIRYFJ-SNVBAGLBSA-N	1	1	313.379	1.140	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000582540389	337106751	/nfs/dbraw/zinc/10/67/51/337106751.db2.gz	XKJSXQGFHZFHIV-BETUJISGSA-N	1	1	303.362	1.845	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3cccnc3)C2)c1	ZINC000582724548	337125603	/nfs/dbraw/zinc/12/56/03/337125603.db2.gz	ZVZXYFQCZZVFDK-HIFRSBDPSA-N	1	1	317.349	1.037	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CO)[C@H]1C	ZINC000488732582	484215355	/nfs/dbraw/zinc/21/53/55/484215355.db2.gz	KHRLFTZTGGDMPB-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CO)[C@H]1C	ZINC000488732582	484215352	/nfs/dbraw/zinc/21/53/52/484215352.db2.gz	KHRLFTZTGGDMPB-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000575474894	484351561	/nfs/dbraw/zinc/35/15/61/484351561.db2.gz	KJZOYGYPTBENIY-NSHDSACASA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000575474894	484351568	/nfs/dbraw/zinc/35/15/68/484351568.db2.gz	KJZOYGYPTBENIY-NSHDSACASA-N	1	1	321.333	1.490	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@]1(C)CO	ZINC000595874492	490371963	/nfs/dbraw/zinc/37/19/63/490371963.db2.gz	PCNNODFNRQTKFK-ZBEGNZNMSA-N	1	1	322.361	1.912	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000452136163	533810449	/nfs/dbraw/zinc/81/04/49/533810449.db2.gz	XMFXCRPNSWORDN-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N[C@@H]3CCC[N@H+](CCCO)C3)nc2c1	ZINC000295006584	534883609	/nfs/dbraw/zinc/88/36/09/534883609.db2.gz	SAZSWNVOVMZRPG-LLVKDONJSA-N	1	1	319.365	1.730	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H](CO)C3)o2)cc1	ZINC000157406195	527344531	/nfs/dbraw/zinc/34/45/31/527344531.db2.gz	MCMZYSASHYQJSD-JTQLQIEISA-N	1	1	304.306	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@H](CO)C3)o2)cc1	ZINC000157406195	527344536	/nfs/dbraw/zinc/34/45/36/527344536.db2.gz	MCMZYSASHYQJSD-JTQLQIEISA-N	1	1	304.306	1.459	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCCC[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000433826384	527999618	/nfs/dbraw/zinc/99/96/18/527999618.db2.gz	OCIYMLYDMOHRSB-UHFFFAOYSA-N	1	1	311.386	1.901	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c[nH]1)CCC(F)(F)F	ZINC000493366032	528504212	/nfs/dbraw/zinc/50/42/12/528504212.db2.gz	RKNVSOLJERBIAP-UHFFFAOYSA-N	1	1	322.287	1.927	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CCC[N@@H+](CCO)CC2)c1	ZINC000747216172	700060580	/nfs/dbraw/zinc/06/05/80/700060580.db2.gz	MYDKKNGUBGFPLP-UHFFFAOYSA-N	1	1	313.329	1.247	20	5		DDBDMO
C[N@@H+]1CCN(Cn2nccc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000054519539	696277005	/nfs/dbraw/zinc/27/70/05/696277005.db2.gz	JYMVKUPQXKHQFU-AWEZNQCLSA-N	1	1	301.350	1.738	20	5		DDBDMO
C[N@H+]1CCN(Cn2nccc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000054519539	696277006	/nfs/dbraw/zinc/27/70/06/696277006.db2.gz	JYMVKUPQXKHQFU-AWEZNQCLSA-N	1	1	301.350	1.738	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC3(C2)OCCO3)cc1	ZINC000118957132	696675817	/nfs/dbraw/zinc/67/58/17/696675817.db2.gz	NDEYZCKNMQZWSV-UHFFFAOYSA-N	1	1	308.334	1.813	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@@H+]1C	ZINC000748351297	700112809	/nfs/dbraw/zinc/11/28/09/700112809.db2.gz	SUJBOSKCRRXZQX-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000748351297	700112810	/nfs/dbraw/zinc/11/28/10/700112810.db2.gz	SUJBOSKCRRXZQX-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1F	ZINC000164564110	697336948	/nfs/dbraw/zinc/33/69/48/697336948.db2.gz	FTJQSONDZGXEON-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)cc([N+](=O)[O-])c1F	ZINC000164564110	697336949	/nfs/dbraw/zinc/33/69/49/697336949.db2.gz	FTJQSONDZGXEON-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
CC1(O)CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1	ZINC000177188951	697410448	/nfs/dbraw/zinc/41/04/48/697410448.db2.gz	ZHLLJOCALMYWQP-UHFFFAOYSA-N	1	1	317.349	1.658	20	5		DDBDMO
CC1(O)CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1	ZINC000177189726	697410499	/nfs/dbraw/zinc/41/04/99/697410499.db2.gz	NHCYQILAELORGU-UHFFFAOYSA-N	1	1	317.349	1.658	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000177212782	697410671	/nfs/dbraw/zinc/41/06/71/697410671.db2.gz	JPSVRABOQQTTFA-HNNXBMFYSA-N	1	1	318.333	1.787	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC[NH+](CCO)CC1	ZINC000236494734	697796101	/nfs/dbraw/zinc/79/61/01/697796101.db2.gz	CNUAWZFEBUTZDY-UHFFFAOYSA-N	1	1	303.721	1.502	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582146	698120962	/nfs/dbraw/zinc/12/09/62/698120962.db2.gz	RKFKOZGLDACWKR-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582146	698120965	/nfs/dbraw/zinc/12/09/65/698120965.db2.gz	RKFKOZGLDACWKR-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[C@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000778355891	698267919	/nfs/dbraw/zinc/26/79/19/698267919.db2.gz	MICBHXBNMNHETL-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)C1	ZINC000779708787	698455084	/nfs/dbraw/zinc/45/50/84/698455084.db2.gz	XYWHYOGIKJSHCV-NWDGAFQWSA-N	1	1	319.365	1.134	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc(O)cc([N+](=O)[O-])c1)[NH+]1CCCCC1	ZINC000780394350	698515304	/nfs/dbraw/zinc/51/53/04/698515304.db2.gz	JVJKOPNVYNQDBP-NSHDSACASA-N	1	1	307.350	1.905	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000729285982	699475849	/nfs/dbraw/zinc/47/58/49/699475849.db2.gz	VUCIOSRFKZBLCH-JTQLQIEISA-N	1	1	304.350	1.452	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)c(N)c([N+](=O)[O-])c1	ZINC000729527396	699481599	/nfs/dbraw/zinc/48/15/99/699481599.db2.gz	MGAFKUUHQFIUCR-GFCCVEGCSA-N	1	1	320.393	1.946	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000729681861	699484874	/nfs/dbraw/zinc/48/48/74/699484874.db2.gz	LIZCFPPYOMBUBT-SNVBAGLBSA-N	1	1	301.293	1.990	20	5		DDBDMO
C[N@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000729681861	699484876	/nfs/dbraw/zinc/48/48/76/699484876.db2.gz	LIZCFPPYOMBUBT-SNVBAGLBSA-N	1	1	301.293	1.990	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCn2cc[nH+]c2C(C)C)c1[N+](=O)[O-]	ZINC000732960442	699575820	/nfs/dbraw/zinc/57/58/20/699575820.db2.gz	JPOQLMMMLWMJIM-UHFFFAOYSA-N	1	1	320.353	1.387	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@H+]2CCC[C@@H]2C)c([N+](=O)[O-])c1	ZINC000790773812	699596323	/nfs/dbraw/zinc/59/63/23/699596323.db2.gz	ZAYJQKMHSCKZKK-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCC1	ZINC000792871922	699720117	/nfs/dbraw/zinc/72/01/17/699720117.db2.gz	NWIASTXSANDPNL-UHFFFAOYSA-N	1	1	322.321	1.651	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@](C)(C(N)=O)C2)c2cc([N+](=O)[O-])ccc12	ZINC000794710631	699826811	/nfs/dbraw/zinc/82/68/11/699826811.db2.gz	HPMPSGBWVFMPDA-HNNXBMFYSA-N	1	1	317.349	1.408	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000744350066	699946350	/nfs/dbraw/zinc/94/63/50/699946350.db2.gz	PYYQNEJXNNFMHK-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000754210411	700489762	/nfs/dbraw/zinc/48/97/62/700489762.db2.gz	MPBSRIOXIMCMOD-UHFFFAOYSA-N	1	1	318.293	1.153	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839719796	701796635	/nfs/dbraw/zinc/79/66/35/701796635.db2.gz	AUPCEZWOSJWTOI-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000839719796	701796641	/nfs/dbraw/zinc/79/66/41/701796641.db2.gz	AUPCEZWOSJWTOI-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839719796	701796647	/nfs/dbraw/zinc/79/66/47/701796647.db2.gz	AUPCEZWOSJWTOI-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
Nc1ccc(C(=O)O[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000810850731	701862450	/nfs/dbraw/zinc/86/24/50/701862450.db2.gz	NXBIWAGIPBWRCM-NWDGAFQWSA-N	1	1	305.334	1.961	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cn3nc(C)c([N+](=O)[O-])c3C)[C@H]2C1	ZINC000840084188	701958617	/nfs/dbraw/zinc/95/86/17/701958617.db2.gz	QMDJHMFFUIMEJU-UONOGXRCSA-N	1	1	323.397	1.161	20	5		DDBDMO
Cc1cccc(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812337497	702161743	/nfs/dbraw/zinc/16/17/43/702161743.db2.gz	GGERNZFMGWUMSA-OLZOCXBDSA-N	1	1	303.362	1.927	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@H](CO)[C@H](CO)C3)c2c1	ZINC000866253300	706658171	/nfs/dbraw/zinc/65/81/71/706658171.db2.gz	ATZQEERHMLKPEM-PHIMTYICSA-N	1	1	303.318	1.180	20	5		DDBDMO
O=C1CC[C@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000831538569	706728062	/nfs/dbraw/zinc/72/80/62/706728062.db2.gz	FEQNXDSZNFNWOX-JSGCOSHPSA-N	1	1	317.345	1.579	20	5		DDBDMO
CO[C@H]1CC[N@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481549	703555645	/nfs/dbraw/zinc/55/56/45/703555645.db2.gz	ZZZVOGHIYCQCMF-GJZGRUSLSA-N	1	1	319.361	1.589	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481549	703555647	/nfs/dbraw/zinc/55/56/47/703555647.db2.gz	ZZZVOGHIYCQCMF-GJZGRUSLSA-N	1	1	319.361	1.589	20	5		DDBDMO
C[C@@H]1C[C@H]1C(N)=[NH+]O[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000848518519	703560396	/nfs/dbraw/zinc/56/03/96/703560396.db2.gz	KRVCARVVVUYWBQ-WQAKAFBOSA-N	1	1	318.333	1.855	20	5		DDBDMO
CO[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000852096437	703922204	/nfs/dbraw/zinc/92/22/04/703922204.db2.gz	KVULTFPKRPABQG-TVYUQYBPSA-N	1	1	314.363	1.057	20	5		DDBDMO
O=C(c1cccc(Cl)c1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000818585449	703931074	/nfs/dbraw/zinc/93/10/74/703931074.db2.gz	CQTHPRJXJTURED-SECBINFHSA-N	1	1	319.695	1.927	20	5		DDBDMO
Cc1cc(C[C@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000819176518	704081757	/nfs/dbraw/zinc/08/17/57/704081757.db2.gz	FCIVOQBBWVMQDM-ZUZCIYMTSA-N	1	1	304.350	1.881	20	5		DDBDMO
Cc1cc(C[C@@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819177546	704082182	/nfs/dbraw/zinc/08/21/82/704082182.db2.gz	OFNDMLVRVBEVSI-BMIGLBTASA-N	1	1	304.350	1.881	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000852651392	704092260	/nfs/dbraw/zinc/09/22/60/704092260.db2.gz	BDZORCBHIRHVRE-GLQYFDAESA-N	1	1	322.361	1.759	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CCC1(C)C	ZINC000871149253	704230733	/nfs/dbraw/zinc/23/07/33/704230733.db2.gz	CTEJAAMOQOLLCC-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000855285678	704477387	/nfs/dbraw/zinc/47/73/87/704477387.db2.gz	ICYWRCVLKSVKJF-VIFPVBQESA-N	1	1	324.356	1.919	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)C(=O)N(C)OC	ZINC000858588778	704731476	/nfs/dbraw/zinc/73/14/76/704731476.db2.gz	OWTGEUWCVHQBCD-NXEZZACHSA-N	1	1	311.338	1.662	20	5		DDBDMO
CON1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000835076680	707167671	/nfs/dbraw/zinc/16/76/71/707167671.db2.gz	UIZSSGCYMCUVDB-UHFFFAOYSA-N	1	1	324.337	1.961	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000861338952	705433224	/nfs/dbraw/zinc/43/32/24/705433224.db2.gz	KMKMRHBCANVRCQ-UKRRQHHQSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000824714703	705513166	/nfs/dbraw/zinc/51/31/66/705513166.db2.gz	FCZBSDQLHNOESJ-AWEZNQCLSA-N	1	1	307.350	1.181	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000825526997	705687569	/nfs/dbraw/zinc/68/75/69/705687569.db2.gz	KVCMCOYSMUXBHL-LSDHHAIUSA-N	1	1	321.377	1.081	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC000827269756	705964807	/nfs/dbraw/zinc/96/48/07/705964807.db2.gz	ZUSKEJGTJNQOAH-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
NC(=O)[C@@H](F)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000879041563	706570333	/nfs/dbraw/zinc/57/03/33/706570333.db2.gz	HGIMBYQIQUNJPM-ZDUSSCGKSA-N	1	1	313.304	1.769	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000880424637	706969657	/nfs/dbraw/zinc/96/96/57/706969657.db2.gz	JQTHRXHCUKVXBF-HUUCEWRRSA-N	1	1	310.350	1.709	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880434019	706975156	/nfs/dbraw/zinc/97/51/56/706975156.db2.gz	VOMMNTDVPXIFIM-RBSFLKMASA-N	1	1	310.350	1.364	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880526040	707003756	/nfs/dbraw/zinc/00/37/56/707003756.db2.gz	BIXFRWVOPSLYHB-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880526040	707003759	/nfs/dbraw/zinc/00/37/59/707003759.db2.gz	BIXFRWVOPSLYHB-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2ncncc2C1	ZINC000880594152	707032300	/nfs/dbraw/zinc/03/23/00/707032300.db2.gz	PHQPAIACDNDPAM-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2ncncc2C1	ZINC000880594152	707032303	/nfs/dbraw/zinc/03/23/03/707032303.db2.gz	PHQPAIACDNDPAM-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1CCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000872770857	707592516	/nfs/dbraw/zinc/59/25/16/707592516.db2.gz	ASCFOBCKSSVNKI-LBPRGKRZSA-N	1	1	319.365	1.765	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1CCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000872770857	707592519	/nfs/dbraw/zinc/59/25/19/707592519.db2.gz	ASCFOBCKSSVNKI-LBPRGKRZSA-N	1	1	319.365	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@](O)(CO)C2)cc1Cl	ZINC000839160688	708031657	/nfs/dbraw/zinc/03/16/57/708031657.db2.gz	SMWUVKUJBBMUBT-CYBMUJFWSA-N	1	1	300.742	1.567	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@](O)(CO)C2)cc1Cl	ZINC000839160688	708031659	/nfs/dbraw/zinc/03/16/59/708031659.db2.gz	SMWUVKUJBBMUBT-CYBMUJFWSA-N	1	1	300.742	1.567	20	5		DDBDMO
C[C@@H](CNC(=O)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000897078920	708224327	/nfs/dbraw/zinc/22/43/27/708224327.db2.gz	YSGUZDFKCHLTRS-LBPRGKRZSA-N	1	1	306.366	1.655	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c1	ZINC000897221124	708259526	/nfs/dbraw/zinc/25/95/26/708259526.db2.gz	HMEGXJYBBURCKT-OLZOCXBDSA-N	1	1	306.366	1.212	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2CC[C@@H](O)C2)c2ccccc21	ZINC000884566644	708330813	/nfs/dbraw/zinc/33/08/13/708330813.db2.gz	PSBJDDQYGULHIL-LLVKDONJSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[N@H+](CCCNC(=O)C1CCC1)Cc1cccnc1[N+](=O)[O-]	ZINC000886171512	708709411	/nfs/dbraw/zinc/70/94/11/708709411.db2.gz	IICCZSOYBGFUIU-UHFFFAOYSA-N	1	1	306.366	1.728	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C1CCC1)Cc1cccnc1[N+](=O)[O-]	ZINC000886171512	708709414	/nfs/dbraw/zinc/70/94/14/708709414.db2.gz	IICCZSOYBGFUIU-UHFFFAOYSA-N	1	1	306.366	1.728	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000886574152	708779318	/nfs/dbraw/zinc/77/93/18/708779318.db2.gz	QIRRRIFZUGCELZ-XPCVCDNBSA-N	1	1	322.361	1.037	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2[C@H](O)CC[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000886577143	708780112	/nfs/dbraw/zinc/78/01/12/708780112.db2.gz	XVGBWYJJIGANLG-BYCMXARLSA-N	1	1	319.361	1.626	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@H]([C@H]2CCCCN2Cc2cccnc2[N+](=O)[O-])C1	ZINC000886841647	708859425	/nfs/dbraw/zinc/85/94/25/708859425.db2.gz	RLAJDBNPGDCLFN-KFWWJZLASA-N	1	1	320.393	1.851	20	5		DDBDMO
CC1(C)CC[N@H+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000890075260	709735837	/nfs/dbraw/zinc/73/58/37/709735837.db2.gz	FMVKJNBQJFTPEK-UHFFFAOYSA-N	1	1	307.350	1.762	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000890075260	709735841	/nfs/dbraw/zinc/73/58/41/709735841.db2.gz	FMVKJNBQJFTPEK-UHFFFAOYSA-N	1	1	307.350	1.762	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000928438154	713196014	/nfs/dbraw/zinc/19/60/14/713196014.db2.gz	SQQVRENQUJVQMG-YPMHNXCESA-N	1	1	307.350	1.491	20	5		DDBDMO
C[C@H]1C[N@H+](CCCOC(=O)c2ccccc2[N+](=O)[O-])CCO1	ZINC000893392358	710633715	/nfs/dbraw/zinc/63/37/15/710633715.db2.gz	QUHPPNAJERUCQH-LBPRGKRZSA-N	1	1	308.334	1.862	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOC(=O)c2ccccc2[N+](=O)[O-])CCO1	ZINC000893392358	710633717	/nfs/dbraw/zinc/63/37/17/710633717.db2.gz	QUHPPNAJERUCQH-LBPRGKRZSA-N	1	1	308.334	1.862	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000928559604	713226470	/nfs/dbraw/zinc/22/64/70/713226470.db2.gz	ZYDDPLYNRUCVLR-GFCCVEGCSA-N	1	1	302.334	1.439	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1c2cc(F)ccc2ncc1[N+](=O)[O-]	ZINC000894591146	711199033	/nfs/dbraw/zinc/19/90/33/711199033.db2.gz	KFDAMNSBHBZBET-UHFFFAOYSA-N	1	1	322.340	1.642	20	5		DDBDMO
C[N@@H+]1CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])C[C@H]1CO	ZINC000894881217	711306691	/nfs/dbraw/zinc/30/66/91/711306691.db2.gz	LMBMWOMIJGWTAN-VIFPVBQESA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])C[C@H]1CO	ZINC000894881217	711306694	/nfs/dbraw/zinc/30/66/94/711306694.db2.gz	LMBMWOMIJGWTAN-VIFPVBQESA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1CO	ZINC000894884925	711308461	/nfs/dbraw/zinc/30/84/61/711308461.db2.gz	LYMBOQPYBFKPHG-SNVBAGLBSA-N	1	1	308.363	1.317	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1CO	ZINC000894884925	711308465	/nfs/dbraw/zinc/30/84/65/711308465.db2.gz	LYMBOQPYBFKPHG-SNVBAGLBSA-N	1	1	308.363	1.317	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1	ZINC000894958197	711338919	/nfs/dbraw/zinc/33/89/19/711338919.db2.gz	NMSJXUBIURPQKD-KBPBESRZSA-N	1	1	313.361	1.791	20	5		DDBDMO
Cc1ccc(N(C)CC(=O)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000894959560	711339949	/nfs/dbraw/zinc/33/99/49/711339949.db2.gz	YJWPIGGDEFXOFS-UHFFFAOYSA-N	1	1	306.366	1.113	20	5		DDBDMO
CC1=NO[C@H](C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000895310989	711480680	/nfs/dbraw/zinc/48/06/80/711480680.db2.gz	LHBKXANUUQYPBO-NSHDSACASA-N	1	1	307.306	1.620	20	5		DDBDMO
CC1=NO[C@@H](C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000895310988	711480904	/nfs/dbraw/zinc/48/09/04/711480904.db2.gz	LHBKXANUUQYPBO-LLVKDONJSA-N	1	1	307.306	1.620	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000895701616	711581691	/nfs/dbraw/zinc/58/16/91/711581691.db2.gz	AYAUYZQTIRRUQW-OAHLLOKOSA-N	1	1	308.334	1.321	20	5		DDBDMO
CCOC(=O)c1ccnc(N[C@H]2CC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000895739040	711591775	/nfs/dbraw/zinc/59/17/75/711591775.db2.gz	AMOJNYWTCWUWIP-ONGXEEELSA-N	1	1	308.338	1.671	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2CC[N@H+]2C2CCOCC2)c1[N+](=O)[O-]	ZINC000896521583	711737624	/nfs/dbraw/zinc/73/76/24/711737624.db2.gz	JZBBSBZQMRCDST-GFCCVEGCSA-N	1	1	323.397	1.556	20	5		DDBDMO
CCO[C@H](C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)CN(C)C	ZINC000905581900	712085847	/nfs/dbraw/zinc/08/58/47/712085847.db2.gz	ZPCMKYYWNGWQMR-CABCVRRESA-N	1	1	311.382	1.185	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)c1C	ZINC000908347225	712748143	/nfs/dbraw/zinc/74/81/43/712748143.db2.gz	KRPHHXCWHVBQRK-GXTWGEPZSA-N	1	1	303.362	1.988	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cn2ccc([N+](=O)[O-])n2)CC12CCCCC2	ZINC000908576436	712812493	/nfs/dbraw/zinc/81/24/93/712812493.db2.gz	DFHFGUCAYJMCRP-UHFFFAOYSA-N	1	1	321.381	1.268	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000929411492	713604899	/nfs/dbraw/zinc/60/48/99/713604899.db2.gz	JXVFFXMCIUJKHD-HNNXBMFYSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=[N+]([O-])CC[NH+]1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000929478475	713621015	/nfs/dbraw/zinc/62/10/15/713621015.db2.gz	AOMQCLYGXPYNBI-UHFFFAOYSA-N	1	1	303.322	1.588	20	5		DDBDMO
COC(OC)[C@H](C)[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000922312166	714018183	/nfs/dbraw/zinc/01/81/83/714018183.db2.gz	TYJGNWIENZDGCW-VIFPVBQESA-N	1	1	312.322	1.463	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)N2CCn3cc[nH+]c32)cccc1[N+](=O)[O-]	ZINC000931523422	714118677	/nfs/dbraw/zinc/11/86/77/714118677.db2.gz	SLRARXUAFHOHKH-NSHDSACASA-N	1	1	315.333	1.947	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000931609184	714137578	/nfs/dbraw/zinc/13/75/78/714137578.db2.gz	DDQFAIYHSHJTTG-NOZJJQNGSA-N	1	1	308.313	1.902	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000931641420	714147690	/nfs/dbraw/zinc/14/76/90/714147690.db2.gz	FALIPGCRDOTEOH-FZMZJTMJSA-N	1	1	310.350	1.712	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000932638778	714372115	/nfs/dbraw/zinc/37/21/15/714372115.db2.gz	KMHPREFYQPWBMJ-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000932638778	714372117	/nfs/dbraw/zinc/37/21/17/714372117.db2.gz	KMHPREFYQPWBMJ-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000933372683	714574929	/nfs/dbraw/zinc/57/49/29/714574929.db2.gz	UPNUBXYBWPCHSM-DGCLKSJQSA-N	1	1	323.397	1.431	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934260298	714778285	/nfs/dbraw/zinc/77/82/85/714778285.db2.gz	WDBIAULKMYMJLT-HZPDHXFCSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934272227	714783271	/nfs/dbraw/zinc/78/32/71/714783271.db2.gz	IISXQMYKXHFQDK-LSDHHAIUSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934275914	714784486	/nfs/dbraw/zinc/78/44/86/714784486.db2.gz	RXEXAESRAXJRFJ-UONOGXRCSA-N	1	1	306.366	1.021	20	5		DDBDMO
CC(C)=CC[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589127	718843949	/nfs/dbraw/zinc/84/39/49/718843949.db2.gz	HPXUCZFQKSESRN-QKPAOTATSA-N	1	1	321.421	1.788	20	5		DDBDMO
CC(C)=CC[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589127	718843954	/nfs/dbraw/zinc/84/39/54/718843954.db2.gz	HPXUCZFQKSESRN-QKPAOTATSA-N	1	1	321.421	1.788	20	5		DDBDMO
CC(C)=CC[N@@H+]1C[C@@H]2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC[C@@H]2C1	ZINC000946589127	718843959	/nfs/dbraw/zinc/84/39/59/718843959.db2.gz	HPXUCZFQKSESRN-QKPAOTATSA-N	1	1	321.421	1.788	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001120873811	782201373	/nfs/dbraw/zinc/20/13/73/782201373.db2.gz	GYEXGHRHKQUKQF-MLGOLLRUSA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)[C@H]1CN(C)CC[N@@H+]1C	ZINC001120873811	782201382	/nfs/dbraw/zinc/20/13/82/782201382.db2.gz	GYEXGHRHKQUKQF-MLGOLLRUSA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H](C)[C@H]1CN(C)CC[N@H+]1C	ZINC001120873811	782201392	/nfs/dbraw/zinc/20/13/92/782201392.db2.gz	GYEXGHRHKQUKQF-MLGOLLRUSA-N	1	1	322.409	1.787	20	5		DDBDMO
CCOC(=O)CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC1CC1	ZINC001167261671	732875663	/nfs/dbraw/zinc/87/56/63/732875663.db2.gz	GDPKBVZBGNFENF-UHFFFAOYSA-N	1	1	324.381	1.765	20	5		DDBDMO
Cc1cc(C)cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001022063706	734368368	/nfs/dbraw/zinc/36/83/68/734368368.db2.gz	IHEABKHUGWXSCV-QKPAOTATSA-N	1	1	317.389	1.705	20	5		DDBDMO
C[N@@H+]1CCc2c(NCC3(O)CCOCC3)ccc([N+](=O)[O-])c2C1	ZINC001167555157	734708407	/nfs/dbraw/zinc/70/84/07/734708407.db2.gz	CBRIAVQDMIBWJP-UHFFFAOYSA-N	1	1	321.377	1.536	20	5		DDBDMO
C[N@H+]1CCc2c(NCC3(O)CCOCC3)ccc([N+](=O)[O-])c2C1	ZINC001167555157	734708410	/nfs/dbraw/zinc/70/84/10/734708410.db2.gz	CBRIAVQDMIBWJP-UHFFFAOYSA-N	1	1	321.377	1.536	20	5		DDBDMO
CCOC(=O)c1cccc([N+](=O)[O-])c1NC(=N)NCCCC[NH3+]	ZINC001167881085	739173762	/nfs/dbraw/zinc/17/37/62/739173762.db2.gz	DDFNLHYCEDONJQ-UHFFFAOYSA-N	1	1	323.353	1.447	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001105460015	741849344	/nfs/dbraw/zinc/84/93/44/741849344.db2.gz	PLYVDDDLSNQTGP-UHFFFAOYSA-N	1	1	322.409	1.831	20	5		DDBDMO
O=C(NCC[NH2+]CC/C=C\c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936869	742853888	/nfs/dbraw/zinc/85/38/88/742853888.db2.gz	VGZSLUAHJPXVKA-JFCGUDLGSA-N	1	1	303.362	1.461	20	5		DDBDMO
COc1cc(N2CC([NH2+]C3COC3)C2)c(Cl)cc1[N+](=O)[O-]	ZINC001187724802	744597069	/nfs/dbraw/zinc/59/70/69/744597069.db2.gz	QHJJWRTUYFEOJT-UHFFFAOYSA-N	1	1	313.741	1.434	20	5		DDBDMO
CC1(C)CC(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC000996430111	749588835	/nfs/dbraw/zinc/58/88/35/749588835.db2.gz	ZYSNXHONDGUSBN-ZIAGYGMSSA-N	1	1	309.410	1.668	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NC/C=C/CNc1ncccc1[N+](=O)[O-]	ZINC001107280111	749725916	/nfs/dbraw/zinc/72/59/16/749725916.db2.gz	ICJXQZHILLYJHU-SNAWJCMRSA-N	1	1	321.381	1.416	20	5		DDBDMO
CCNC(=O)CO[C@@H]1CCC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169039939	762193566	/nfs/dbraw/zinc/19/35/66/762193566.db2.gz	WAXJDACLXJLFCZ-HZSPNIEDSA-N	1	1	313.398	1.049	20	5		DDBDMO
Cc1nccnc1O[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169051992	762207108	/nfs/dbraw/zinc/20/71/08/762207108.db2.gz	DYYQVNSAPAUZHP-MGPQQGTHSA-N	1	1	306.366	1.684	20	5		DDBDMO
O=C(NCC1CC[NH+](CCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001399027	762825497	/nfs/dbraw/zinc/82/54/97/762825497.db2.gz	HQJXIRDXZZOLNK-GHMZBOCLSA-N	1	1	323.315	1.432	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(CC)c1ccc([N+](=O)[O-])cc1	ZINC001100576526	776320160	/nfs/dbraw/zinc/32/01/60/776320160.db2.gz	HGHNZSRWMTYUFW-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
CN(CCO)CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172906306	776917116	/nfs/dbraw/zinc/91/71/16/776917116.db2.gz	NXMNGBRYGRMOCH-MRXNPFEDSA-N	1	1	321.421	1.746	20	5		DDBDMO
CC[NH+](CC)C1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC001116016335	780467423	/nfs/dbraw/zinc/46/74/23/780467423.db2.gz	WPQDCOZYJMGJRC-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
Cc1c[nH]nc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001267194670	837513149	/nfs/dbraw/zinc/51/31/49/837513149.db2.gz	CKVIXOGSVSEJRZ-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
Cc1c[nH]nc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001267194670	837513157	/nfs/dbraw/zinc/51/31/57/837513157.db2.gz	CKVIXOGSVSEJRZ-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
CCC[N@@H+](CCOC)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001269639689	841885413	/nfs/dbraw/zinc/88/54/13/841885413.db2.gz	JZSRBDRVQRSSBF-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CCC[N@H+](CCOC)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001269639689	841885422	/nfs/dbraw/zinc/88/54/22/841885422.db2.gz	JZSRBDRVQRSSBF-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CCC[N@@H+](CCOC)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001269639689	841885432	/nfs/dbraw/zinc/88/54/32/841885432.db2.gz	JZSRBDRVQRSSBF-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC001326489240	861403419	/nfs/dbraw/zinc/40/34/19/861403419.db2.gz	PLPNIQUVRHFISD-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1cccc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)c1	ZINC001122991316	859043509	/nfs/dbraw/zinc/04/35/09/859043509.db2.gz	OSPRDMHDGHJEEO-UHFFFAOYSA-N	1	1	317.349	1.156	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC001124109343	859583706	/nfs/dbraw/zinc/58/37/06/859583706.db2.gz	MLWUUPLRAARESF-YNEHKIRRSA-N	1	1	318.377	1.707	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2CC[N@@H+](C(C)C)[C@@H](C)C2)n1	ZINC001158495049	864688403	/nfs/dbraw/zinc/68/84/03/864688403.db2.gz	VLYNTGDRRGBMHN-JTQLQIEISA-N	1	1	309.370	1.621	20	5		DDBDMO
CN1CC[NH+](CCCNc2cc(F)cc(F)c2[N+](=O)[O-])CC1	ZINC001161708181	866920427	/nfs/dbraw/zinc/92/04/27/866920427.db2.gz	AOVKAINIAOIBKX-UHFFFAOYSA-N	1	1	314.336	1.922	20	5		DDBDMO
CN1CC[NH+](CCCNc2ccc3nc[nH]c3c2[N+](=O)[O-])CC1	ZINC001161709996	866923672	/nfs/dbraw/zinc/92/36/72/866923672.db2.gz	MGADFZKEHPTZML-UHFFFAOYSA-N	1	1	318.381	1.521	20	5		DDBDMO
COC(=O)c1cnc(N[C@]2(C)CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001162341844	867477433	/nfs/dbraw/zinc/47/74/33/867477433.db2.gz	PGFAJDHGCMHYOP-CQSZACIVSA-N	1	1	308.338	1.673	20	5		DDBDMO
Cn1cc[nH+]c1C[C@@H]1CCCN(c2c([N+](=O)[O-])cnn2C)C1	ZINC001334951696	867941661	/nfs/dbraw/zinc/94/16/61/867941661.db2.gz	LITKOBKVEHJLNP-NSHDSACASA-N	1	1	304.354	1.521	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC001335116695	868077075	/nfs/dbraw/zinc/07/70/75/868077075.db2.gz	JMWMXWUYEKKRKK-QWHCGFSZSA-N	1	1	309.341	1.769	20	5		DDBDMO
CC[N@H+]1CCCN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])CC1	ZINC001163774676	868695022	/nfs/dbraw/zinc/69/50/22/868695022.db2.gz	OYGVGZWWZVNVRT-UHFFFAOYSA-N	1	1	300.746	1.414	20	5		DDBDMO
COc1c(O)ccc(CNC[C@@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC001336716146	869107088	/nfs/dbraw/zinc/10/70/88/869107088.db2.gz	DCLYOTDEKPCLSM-SNVBAGLBSA-N	1	1	309.366	1.881	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C[C@@H](C)N(C)C2CC2)c1[N+](=O)[O-]	ZINC001336716146	869107093	/nfs/dbraw/zinc/10/70/93/869107093.db2.gz	DCLYOTDEKPCLSM-SNVBAGLBSA-N	1	1	309.366	1.881	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@]2(CO)COC[C@@H]3CCC[N@@H+]32)s1	ZINC001336872010	869193403	/nfs/dbraw/zinc/19/34/03/869193403.db2.gz	OSODKGIXZRCSCJ-GXFFZTMASA-N	1	1	313.379	1.294	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@]2(CO)COC[C@@H]3CCC[N@H+]32)s1	ZINC001336872010	869193408	/nfs/dbraw/zinc/19/34/08/869193408.db2.gz	OSODKGIXZRCSCJ-GXFFZTMASA-N	1	1	313.379	1.294	20	5		DDBDMO
CC(=O)c1c(N[C@H](C)[C@@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085164	869791551	/nfs/dbraw/zinc/79/15/51/869791551.db2.gz	VLQABJDAHZELAA-ABAIWWIYSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1c(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC001338085164	869791555	/nfs/dbraw/zinc/79/15/55/869791555.db2.gz	VLQABJDAHZELAA-ABAIWWIYSA-N	1	1	320.393	1.844	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@]2(CO)COC[C@@H]3CCC[N@H+]32)c1	ZINC001338298309	869909696	/nfs/dbraw/zinc/90/96/96/869909696.db2.gz	RXLRVYCVLBUEST-XJKSGUPXSA-N	1	1	321.377	1.541	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2c(OC)cc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001226360225	882384000	/nfs/dbraw/zinc/38/40/00/882384000.db2.gz	CGIZYUQCPBZPOL-NSHDSACASA-N	1	1	324.333	1.863	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3cc(Cl)c([N+](=O)[O-])cn3)[C@H]1CC(=O)C2	ZINC001226917489	882720591	/nfs/dbraw/zinc/72/05/91/882720591.db2.gz	KTSXKBJMMYWYJA-HNBZJPLGSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3cc(Cl)c([N+](=O)[O-])cn3)[C@H]1CC(=O)C2	ZINC001226917489	882720599	/nfs/dbraw/zinc/72/05/99/882720599.db2.gz	KTSXKBJMMYWYJA-HNBZJPLGSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1CC[C@@H](Oc2ccc3c(c2)oc2cc(=O)ccc-2[n+]3[O-])C1	ZINC001227448633	883025630	/nfs/dbraw/zinc/02/56/30/883025630.db2.gz	HODLYXMZJYBFKL-CYBMUJFWSA-N	1	1	312.325	1.614	20	5		DDBDMO
CCc1nc2c(c(O[C@@H](C[N+](=O)[O-])c3cccnc3)n1)C[NH2+]C2	ZINC001218296173	877449357	/nfs/dbraw/zinc/44/93/57/877449357.db2.gz	KEIRVPZAMSKMRD-ZDUSSCGKSA-N	1	1	315.333	1.434	20	5		DDBDMO
COCC[N@@H+](C)CCNc1c2cc(F)ccc2ncc1[N+](=O)[O-]	ZINC001355232402	878472777	/nfs/dbraw/zinc/47/27/77/878472777.db2.gz	JIOWJPONJAPOBL-UHFFFAOYSA-N	1	1	322.340	1.694	20	5		DDBDMO
C[N@H+]1CCC[C@H](C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584220	879114336	/nfs/dbraw/zinc/11/43/36/879114336.db2.gz	NDXCLLYAJIYGRM-KGLIPLIRSA-N	1	1	323.393	1.266	20	5		DDBDMO
CN1CCC[C@H](C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584220	879114345	/nfs/dbraw/zinc/11/43/45/879114345.db2.gz	NDXCLLYAJIYGRM-KGLIPLIRSA-N	1	1	323.393	1.266	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](COCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC001223487749	880982947	/nfs/dbraw/zinc/98/29/47/880982947.db2.gz	JQKUYIVPBGUQLV-CYBMUJFWSA-N	1	1	311.294	1.350	20	5		DDBDMO
C[N@H+]1CCO[C@@H](COCc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC001223487749	880982956	/nfs/dbraw/zinc/98/29/56/880982956.db2.gz	JQKUYIVPBGUQLV-CYBMUJFWSA-N	1	1	311.294	1.350	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@]12CC[N@@H+](C1)CCC2	ZINC001288003824	912658948	/nfs/dbraw/zinc/65/89/48/912658948.db2.gz	FCZHTWBDEISFQF-OUOZUETKSA-N	1	1	301.346	1.963	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](Oc1ncc([N+](=O)[O-])c3nc[nH]c31)C2	ZINC001227692958	883136392	/nfs/dbraw/zinc/13/63/92/883136392.db2.gz	HLHDHJXAVAEUKP-ILWJIGKKSA-N	1	1	303.322	1.870	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@H](C)Oc1[nH+][nH]cc2nncc1-2	ZINC001230900246	885029551	/nfs/dbraw/zinc/02/95/51/885029551.db2.gz	FYBTYPYSOCGVKM-ZETCQYMHSA-N	1	1	303.282	1.234	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1cn[nH]c1)Cc1cccc([N+](=O)[O-])c1	ZINC001234369289	887911221	/nfs/dbraw/zinc/91/12/21/887911221.db2.gz	UOQWLZOABDRWMW-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
N[C@@]12C[C@@H]1CC[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246662023	892774374	/nfs/dbraw/zinc/77/43/74/892774374.db2.gz	VDVFBMISEKRBKS-SUMWQHHRSA-N	1	1	316.405	1.987	20	5		DDBDMO
N[C@@]12C[C@@H]1CC[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246662023	892774383	/nfs/dbraw/zinc/77/43/83/892774383.db2.gz	VDVFBMISEKRBKS-SUMWQHHRSA-N	1	1	316.405	1.987	20	5		DDBDMO
NC[C@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001246908112	892982935	/nfs/dbraw/zinc/98/29/35/892982935.db2.gz	LDPKDJWUIWZNSF-MRXNPFEDSA-N	1	1	304.394	1.987	20	5		DDBDMO
[NH3+]C[C@H]1CCCN1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001246908112	892982967	/nfs/dbraw/zinc/98/29/67/892982967.db2.gz	LDPKDJWUIWZNSF-MRXNPFEDSA-N	1	1	304.394	1.987	20	5		DDBDMO
[NH3+]Cc1ncn(C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)n1	ZINC001254466595	896453338	/nfs/dbraw/zinc/45/33/38/896453338.db2.gz	GUPCYTSCSOLIMJ-UHFFFAOYSA-N	1	1	302.338	1.487	20	5		DDBDMO
C[C@]1(CO)C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC[C@@H]1O	ZINC001254593353	896522612	/nfs/dbraw/zinc/52/26/12/896522612.db2.gz	LILUJHRMWPUFED-HRCADAONSA-N	1	1	306.362	1.127	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000249002292	282126137	/nfs/dbraw/zinc/12/61/37/282126137.db2.gz	YYGXMRRHQPYISJ-BZPMIXESSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1cc(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000272850719	210247663	/nfs/dbraw/zinc/24/76/63/210247663.db2.gz	HHWWLDMZFVOCRB-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
COC[C@@H]1CCCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000452035168	231276838	/nfs/dbraw/zinc/27/68/38/231276838.db2.gz	GDRVOODIDLLGDF-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090551752	185302675	/nfs/dbraw/zinc/30/26/75/185302675.db2.gz	NJHWJFBSJJFHIV-ZDUSSCGKSA-N	1	1	308.382	1.030	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@@H]2C1	ZINC000255417901	282256021	/nfs/dbraw/zinc/25/60/21/282256021.db2.gz	NBTVRIHNBQAFBW-WBTMPAOCSA-N	1	1	301.346	1.915	20	5		DDBDMO
C[N@@H+](CCCCNc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1	ZINC000413350656	529884126	/nfs/dbraw/zinc/88/41/26/529884126.db2.gz	XJMFMGCVUZROAX-UHFFFAOYSA-N	1	1	306.366	1.980	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCOC1	ZINC000181862084	199364527	/nfs/dbraw/zinc/36/45/27/199364527.db2.gz	PTSJNEOHNTWFTD-KBPBESRZSA-N	1	1	324.377	1.693	20	5		DDBDMO
C[N@@H+](CCCCCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000279697329	215070154	/nfs/dbraw/zinc/07/01/54/215070154.db2.gz	IFZAQRTVGZPJKT-UHFFFAOYSA-N	1	1	321.377	1.578	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000279755238	215118797	/nfs/dbraw/zinc/11/87/97/215118797.db2.gz	LUQYLYLCXHMVLE-FZMZJTMJSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000331383853	233252321	/nfs/dbraw/zinc/25/23/21/233252321.db2.gz	HNQDVPPOZQNSPO-SNVBAGLBSA-N	1	1	307.354	1.373	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000152435256	186072708	/nfs/dbraw/zinc/07/27/08/186072708.db2.gz	OBEUTALDTNONOQ-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000152494770	186078739	/nfs/dbraw/zinc/07/87/39/186078739.db2.gz	RGPWYZMFGICDPI-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOC[C@@H]1C	ZINC000026452172	352209092	/nfs/dbraw/zinc/20/90/92/352209092.db2.gz	GAGHHUOBKOXPLW-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@@H]1C	ZINC000026452172	352209098	/nfs/dbraw/zinc/20/90/98/352209098.db2.gz	GAGHHUOBKOXPLW-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@H+]2C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000331736785	234063981	/nfs/dbraw/zinc/06/39/81/234063981.db2.gz	VNCQDYDPAPGEDV-YYAKZPHOSA-N	1	1	301.346	1.818	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@@H+]2C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000331736785	234063983	/nfs/dbraw/zinc/06/39/83/234063983.db2.gz	VNCQDYDPAPGEDV-YYAKZPHOSA-N	1	1	301.346	1.818	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccccc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000067837661	353070316	/nfs/dbraw/zinc/07/03/16/353070316.db2.gz	SONSJJQFVUKQLN-JKSUJKDBSA-N	1	1	317.389	1.680	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000072986872	191265901	/nfs/dbraw/zinc/26/59/01/191265901.db2.gz	AVNOIIBWGRTLRJ-FZMZJTMJSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000072986872	191265903	/nfs/dbraw/zinc/26/59/03/191265903.db2.gz	AVNOIIBWGRTLRJ-FZMZJTMJSA-N	1	1	307.350	1.493	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CCn2cccn2)c([N+](=O)[O-])c1	ZINC000173726766	198244641	/nfs/dbraw/zinc/24/46/41/198244641.db2.gz	ROOFEBBZTIEICC-UHFFFAOYSA-N	1	1	320.349	1.811	20	5		DDBDMO
CN(CC(=O)N1CC[NH+](C2CC2)CC1)c1ccccc1[N+](=O)[O-]	ZINC000173875387	198262758	/nfs/dbraw/zinc/26/27/58/198262758.db2.gz	NOCVOCRZYDXWMD-UHFFFAOYSA-N	1	1	318.377	1.338	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2ccc([N+](=O)[O-])cc2)n1C	ZINC000074095947	353290215	/nfs/dbraw/zinc/29/02/15/353290215.db2.gz	NVCNMCVUKYQRGJ-UHFFFAOYSA-N	1	1	303.322	1.324	20	5		DDBDMO
CN(C)c1nc(NCCOc2ccc([N+](=O)[O-])cc2)cc[nH+]1	ZINC000077219383	353458058	/nfs/dbraw/zinc/45/80/58/353458058.db2.gz	NURHTPNDJGYHOG-UHFFFAOYSA-N	1	1	303.322	1.942	20	5		DDBDMO
COc1cc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000114007395	353978708	/nfs/dbraw/zinc/97/87/08/353978708.db2.gz	QXXYHGJJGSTCOW-AWEZNQCLSA-N	1	1	321.377	1.639	20	5		DDBDMO
C[C@H]1CO[C@H](CO)C[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119253	354196472	/nfs/dbraw/zinc/19/64/72/354196472.db2.gz	YKYWFEOVEGBPRU-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1CO[C@H](CO)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119253	354196474	/nfs/dbraw/zinc/19/64/74/354196474.db2.gz	YKYWFEOVEGBPRU-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@]2(CCOC2)C1	ZINC000153916708	354201661	/nfs/dbraw/zinc/20/16/61/354201661.db2.gz	HQDVEVTYBSZYHE-MRXNPFEDSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@]2(CCOC2)C1	ZINC000153916708	354201664	/nfs/dbraw/zinc/20/16/64/354201664.db2.gz	HQDVEVTYBSZYHE-MRXNPFEDSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@H](O)C1CC1	ZINC000156578904	354220434	/nfs/dbraw/zinc/22/04/34/354220434.db2.gz	NRPGWWLZJMTLQR-CQSZACIVSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H](O)C1CC1	ZINC000156578904	354220438	/nfs/dbraw/zinc/22/04/38/354220438.db2.gz	NRPGWWLZJMTLQR-CQSZACIVSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@H](CO)CC1	ZINC000293056318	354453247	/nfs/dbraw/zinc/45/32/47/354453247.db2.gz	IFHQJXOLRKTUPR-KBPBESRZSA-N	1	1	324.377	1.429	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@@H]2N1	ZINC000320069208	354524998	/nfs/dbraw/zinc/52/49/98/354524998.db2.gz	KAMSHELKFOBSKW-RISCZKNCSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@@H]2N1	ZINC000320069208	354525000	/nfs/dbraw/zinc/52/50/00/354525000.db2.gz	KAMSHELKFOBSKW-RISCZKNCSA-N	1	1	307.325	1.834	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000589209266	354973940	/nfs/dbraw/zinc/97/39/40/354973940.db2.gz	BLLWSSUWDRGVKZ-SNVBAGLBSA-N	1	1	321.333	1.063	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC([C@H](C)O)CC2)c1	ZINC000589496996	354995973	/nfs/dbraw/zinc/99/59/73/354995973.db2.gz	AHCAGJKRQVUJSX-NSHDSACASA-N	1	1	322.361	1.974	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1O	ZINC000589505437	354997607	/nfs/dbraw/zinc/99/76/07/354997607.db2.gz	IHHOEQQDYYBZGI-HZMBPMFUSA-N	1	1	308.334	1.584	20	5		DDBDMO
CN1C[C@@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590011980	355040676	/nfs/dbraw/zinc/04/06/76/355040676.db2.gz	NSJXUWKXIVKKHC-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590011980	355040679	/nfs/dbraw/zinc/04/06/79/355040679.db2.gz	NSJXUWKXIVKKHC-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590011980	355040683	/nfs/dbraw/zinc/04/06/83/355040683.db2.gz	NSJXUWKXIVKKHC-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000590045781	355043257	/nfs/dbraw/zinc/04/32/57/355043257.db2.gz	WDLCLIMWJLGGEL-DOMZBBRYSA-N	1	1	319.361	1.445	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C2)C1	ZINC000590141947	355053152	/nfs/dbraw/zinc/05/31/52/355053152.db2.gz	VWQFUFAALZEUKO-HNNXBMFYSA-N	1	1	316.365	1.560	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@](O)(CO)C2)cc1	ZINC000590970139	355226263	/nfs/dbraw/zinc/22/62/63/355226263.db2.gz	FIFSYNUHPOIHCU-OAHLLOKOSA-N	1	1	310.350	1.183	20	5		DDBDMO
CC(C)O[C@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000593055558	355781677	/nfs/dbraw/zinc/78/16/77/355781677.db2.gz	LQBZPPXGOBDPGM-KGLIPLIRSA-N	1	1	312.370	1.042	20	5		DDBDMO
CC[C@H]1COC(C)(C)C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000593056739	355782550	/nfs/dbraw/zinc/78/25/50/355782550.db2.gz	OLCVDUASFLFFDJ-AAEUAGOBSA-N	1	1	312.370	1.042	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000593108005	355799916	/nfs/dbraw/zinc/79/99/16/355799916.db2.gz	SRQCSIQKBUJKLE-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000593108005	355799921	/nfs/dbraw/zinc/79/99/21/355799921.db2.gz	SRQCSIQKBUJKLE-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1C	ZINC000593187545	355819897	/nfs/dbraw/zinc/81/98/97/355819897.db2.gz	LQYORTDHMSBWMH-XQQFMLRXSA-N	1	1	321.377	1.913	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccnc2cc([N+](=O)[O-])ccc21	ZINC000593463002	355893455	/nfs/dbraw/zinc/89/34/55/355893455.db2.gz	JZVPSJWITSQPSW-ZDUSSCGKSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ccnc3cc([N+](=O)[O-])ccc32)C1	ZINC000593463002	355893459	/nfs/dbraw/zinc/89/34/59/355893459.db2.gz	JZVPSJWITSQPSW-ZDUSSCGKSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ccnc3cc([N+](=O)[O-])ccc32)C1	ZINC000593463002	355893464	/nfs/dbraw/zinc/89/34/64/355893464.db2.gz	JZVPSJWITSQPSW-ZDUSSCGKSA-N	1	1	315.377	1.801	20	5		DDBDMO
CNc1c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)cccc1[N+](=O)[O-]	ZINC000594360515	356182770	/nfs/dbraw/zinc/18/27/70/356182770.db2.gz	KKQMVPCKZWXTJV-NWDGAFQWSA-N	1	1	318.377	1.945	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594418449	356204302	/nfs/dbraw/zinc/20/43/02/356204302.db2.gz	JBAFFCZSRDJNJH-MNOVXSKESA-N	1	1	307.354	1.373	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1C[N@@H+](C)CCN1C	ZINC000595017605	356373111	/nfs/dbraw/zinc/37/31/11/356373111.db2.gz	KSTURMJKVCDXLH-GXTWGEPZSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CN(C)CCN1C	ZINC000595017605	356373114	/nfs/dbraw/zinc/37/31/14/356373114.db2.gz	KSTURMJKVCDXLH-GXTWGEPZSA-N	1	1	322.409	1.500	20	5		DDBDMO
Cc1noc(C[NH+]2CCC([C@H]3NC(=O)C3(C)C)CC2)c1[N+](=O)[O-]	ZINC000595505942	356523256	/nfs/dbraw/zinc/52/32/56/356523256.db2.gz	XXGIVYIQBBLKLS-CYBMUJFWSA-N	1	1	322.365	1.628	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC[C@@H]([NH3+])C(C)C)c1[N+](=O)[O-]	ZINC000236858135	202040984	/nfs/dbraw/zinc/04/09/84/202040984.db2.gz	RNEAGYFOJUPRQK-SNVBAGLBSA-N	1	1	311.386	1.716	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)C[C@H]2COCCO2)ccc1[N+](=O)[O-]	ZINC000595736584	356628267	/nfs/dbraw/zinc/62/82/67/356628267.db2.gz	MSGBRJPSGQBOEQ-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595833835	356670626	/nfs/dbraw/zinc/67/06/26/356670626.db2.gz	RZRUGRHRWBHWCM-JHJVBQTASA-N	1	1	319.361	1.890	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3COC[C@H]3C2)c1	ZINC000595826783	356665731	/nfs/dbraw/zinc/66/57/31/356665731.db2.gz	IOEKLKUNKQGBAJ-GXTWGEPZSA-N	1	1	320.345	1.850	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](CCC2CC2)CC2CC2)c1	ZINC000595871469	356686956	/nfs/dbraw/zinc/68/69/56/356686956.db2.gz	OOEQDYFTQKZFIX-OAHLLOKOSA-N	1	1	308.382	1.664	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000596074491	356762277	/nfs/dbraw/zinc/76/22/77/356762277.db2.gz	AZGODRKAXQHARE-GXTWGEPZSA-N	1	1	304.350	1.732	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596076202	356763546	/nfs/dbraw/zinc/76/35/46/356763546.db2.gz	MVNMVAAVWOYGEN-NSHDSACASA-N	1	1	306.366	1.980	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000596432285	356879033	/nfs/dbraw/zinc/87/90/33/356879033.db2.gz	RTUXGABZVDQRSF-MNOVXSKESA-N	1	1	324.381	1.190	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000596432285	356879040	/nfs/dbraw/zinc/87/90/40/356879040.db2.gz	RTUXGABZVDQRSF-MNOVXSKESA-N	1	1	324.381	1.190	20	5		DDBDMO
Cc1ccnc(N2CCC([N@H+]3CCCOCC3)CC2)c1[N+](=O)[O-]	ZINC000596267885	356838582	/nfs/dbraw/zinc/83/85/82/356838582.db2.gz	BGJHODSUHJMVOL-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
Cn1ncc2c1CC(C)(C)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000596598129	356930535	/nfs/dbraw/zinc/93/05/35/356930535.db2.gz	BWRTVRCDHUJKST-UHFFFAOYSA-N	1	1	318.381	1.609	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCN(c2[nH+]ccn2C)CC1	ZINC000597249943	357109410	/nfs/dbraw/zinc/10/94/10/357109410.db2.gz	OMTGWPYKEPHOBJ-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cc1cc3c(cc1[N+](=O)[O-])OCCO3)C2	ZINC000597209899	357094808	/nfs/dbraw/zinc/09/48/08/357094808.db2.gz	FJOFLBIOCGYQFG-LRDDRELGSA-N	1	1	320.345	1.834	20	5		DDBDMO
CC(C)(C)[N@@H+]1CC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597858108	357361267	/nfs/dbraw/zinc/36/12/67/357361267.db2.gz	JQDGAGBXAZMYSQ-LLVKDONJSA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597858108	357361272	/nfs/dbraw/zinc/36/12/72/357361272.db2.gz	JQDGAGBXAZMYSQ-LLVKDONJSA-N	1	1	307.350	1.903	20	5		DDBDMO
CCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](CC)C1	ZINC000598040871	357438186	/nfs/dbraw/zinc/43/81/86/357438186.db2.gz	IEBRLNFSCDHNGY-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598220994	357497404	/nfs/dbraw/zinc/49/74/04/357497404.db2.gz	SZSJEJXPOOVWLF-JTQLQIEISA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598220994	357497407	/nfs/dbraw/zinc/49/74/07/357497407.db2.gz	SZSJEJXPOOVWLF-JTQLQIEISA-N	1	1	307.354	1.455	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000598220994	357497411	/nfs/dbraw/zinc/49/74/11/357497411.db2.gz	SZSJEJXPOOVWLF-JTQLQIEISA-N	1	1	307.354	1.455	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC(CN3CC[NH+](C)CC3)C2)n1	ZINC000599109349	357818423	/nfs/dbraw/zinc/81/84/23/357818423.db2.gz	UUSRDKPQNZXMCV-UHFFFAOYSA-N	1	1	319.409	1.290	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1(C)COC1	ZINC000599571303	357979790	/nfs/dbraw/zinc/97/97/90/357979790.db2.gz	BNLXOKWAEMDJKL-UHFFFAOYSA-N	1	1	308.334	1.930	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000599694163	358029098	/nfs/dbraw/zinc/02/90/98/358029098.db2.gz	DVTVBAUDVMXYLP-LBPRGKRZSA-N	1	1	308.338	1.091	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000180531250	199172124	/nfs/dbraw/zinc/17/21/24/199172124.db2.gz	WCYCXPHWKCXJRY-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1	ZINC000276627926	213009987	/nfs/dbraw/zinc/00/99/87/213009987.db2.gz	VRYGDUKREGRVPS-VXGBXAGGSA-N	1	1	320.349	1.815	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000180839725	199216668	/nfs/dbraw/zinc/21/66/68/199216668.db2.gz	QKJOVRZAOWGIBF-SNVBAGLBSA-N	1	1	321.333	1.395	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000601006289	358379141	/nfs/dbraw/zinc/37/91/41/358379141.db2.gz	UNHAHNGHXWANRE-JTQLQIEISA-N	1	1	307.325	1.948	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CC[N@@H+]4CCOC[C@H]4C3)c2c1	ZINC000601142459	358418362	/nfs/dbraw/zinc/41/83/62/358418362.db2.gz	RSQXNDFCECBZKB-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CC[N@H+]4CCOC[C@H]4C3)c2c1	ZINC000601142459	358418364	/nfs/dbraw/zinc/41/83/64/358418364.db2.gz	RSQXNDFCECBZKB-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[C@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000601150111	358422453	/nfs/dbraw/zinc/42/24/53/358422453.db2.gz	WHPMIOILKLYEPC-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@H](CO)O1	ZINC000601153500	358424163	/nfs/dbraw/zinc/42/41/63/358424163.db2.gz	PKDHRIZRXRFWSB-CMPLNLGQSA-N	1	1	303.318	1.729	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974938	358760932	/nfs/dbraw/zinc/76/09/32/358760932.db2.gz	UECNCOORUKSVSR-BETUJISGSA-N	1	1	319.361	1.810	20	5		DDBDMO
O=C1[C@@H]([N@H+]2C[C@@H]3COC[C@@H]3C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000601975501	358762010	/nfs/dbraw/zinc/76/20/10/358762010.db2.gz	WJOAFGPUCVUYEV-ZOWXZIJZSA-N	1	1	317.345	1.278	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000602043664	358788989	/nfs/dbraw/zinc/78/89/89/358788989.db2.gz	FXGUFTSJWSTJGA-AWEZNQCLSA-N	1	1	306.366	1.607	20	5		DDBDMO
Cn1cc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)c([N+](=O)[O-])n1	ZINC000602442589	358979063	/nfs/dbraw/zinc/97/90/63/358979063.db2.gz	ZNJCOQOJUNQXSC-CQSZACIVSA-N	1	1	323.397	1.015	20	5		DDBDMO
C[C@@H](CCN1CCN(C)CC1)[NH2+]CCc1ccc([N+](=O)[O-])cc1	ZINC000602613974	359074565	/nfs/dbraw/zinc/07/45/65/359074565.db2.gz	BZRUMSBBCKWTLS-HNNXBMFYSA-N	1	1	320.437	1.753	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCN(C(=O)C(C)C)CC1	ZINC000602773517	359180528	/nfs/dbraw/zinc/18/05/28/359180528.db2.gz	QDPOLLZRQVJOQR-UHFFFAOYSA-N	1	1	323.397	1.290	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCCN(C(=O)C(C)C)CC1	ZINC000602773517	359180532	/nfs/dbraw/zinc/18/05/32/359180532.db2.gz	QDPOLLZRQVJOQR-UHFFFAOYSA-N	1	1	323.397	1.290	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000602782540	359187682	/nfs/dbraw/zinc/18/76/82/359187682.db2.gz	CSJMQSHSYFHWGH-KBPBESRZSA-N	1	1	307.398	1.516	20	5		DDBDMO
Cc1cnn([C@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)c1	ZINC000602836781	359227659	/nfs/dbraw/zinc/22/76/59/359227659.db2.gz	ISGUJEIBPDHLCZ-ZDUSSCGKSA-N	1	1	304.354	1.552	20	5		DDBDMO
Cn1cc(C[N@@H+]2C[C@H](O)C[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839130	359228842	/nfs/dbraw/zinc/22/88/42/359228842.db2.gz	HIYUBLTVPDNQLB-KGLIPLIRSA-N	1	1	302.334	1.636	20	5		DDBDMO
Cn1cc(C[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839130	359228846	/nfs/dbraw/zinc/22/88/46/359228846.db2.gz	HIYUBLTVPDNQLB-KGLIPLIRSA-N	1	1	302.334	1.636	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@@H]1CCCOC1	ZINC000602851688	359239247	/nfs/dbraw/zinc/23/92/47/359239247.db2.gz	CAFQMLHOOUUXRD-ZIAGYGMSSA-N	1	1	308.382	1.991	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOCC2(CCCC2)C1	ZINC000602820289	359214499	/nfs/dbraw/zinc/21/44/99/359214499.db2.gz	RVUWFPDZNPPMFL-UHFFFAOYSA-N	1	1	308.382	1.992	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCc2ncnn21	ZINC000602823419	359217361	/nfs/dbraw/zinc/21/73/61/359217361.db2.gz	KOQPCSHDTOTGLP-AWEZNQCLSA-N	1	1	301.350	1.848	20	5		DDBDMO
Cn1cc(C[N@H+]2CC3(CCOCC3)CC[C@@H]2CO)c([N+](=O)[O-])n1	ZINC000602917644	359293809	/nfs/dbraw/zinc/29/38/09/359293809.db2.gz	SVEZTOGQHJXZTJ-CYBMUJFWSA-N	1	1	324.381	1.082	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602963069	359326881	/nfs/dbraw/zinc/32/68/81/359326881.db2.gz	SUXQZCXHFSPJPB-HOCLYGCPSA-N	1	1	307.394	1.876	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000603941241	359706877	/nfs/dbraw/zinc/70/68/77/359706877.db2.gz	BGOULKMXUAMCOX-UHFFFAOYSA-N	1	1	321.333	1.491	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000188455503	200250053	/nfs/dbraw/zinc/25/00/53/200250053.db2.gz	HKTYHIWUIFHJQR-IAQYHMDHSA-N	1	1	318.377	1.733	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@@H]1C	ZINC000611092426	360621114	/nfs/dbraw/zinc/62/11/14/360621114.db2.gz	UESDFZPNADHCDF-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611091892	360621537	/nfs/dbraw/zinc/62/15/37/360621537.db2.gz	BUTZGNGYRDEOGJ-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000611148671	360638250	/nfs/dbraw/zinc/63/82/50/360638250.db2.gz	RQSCMGDPGSUGAF-GFCCVEGCSA-N	1	1	316.361	1.829	20	5		DDBDMO
C[C@H](NC(=O)[C@H]1C[N@H+]2CCN1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000611201350	360657603	/nfs/dbraw/zinc/65/76/03/360657603.db2.gz	UAPCPWTVCHOIQV-SWLSCSKDSA-N	1	1	318.377	1.162	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc([N+](=O)[O-])c1C	ZINC000192466578	200882571	/nfs/dbraw/zinc/88/25/71/200882571.db2.gz	DQBOYRMSWXKMNS-BETUJISGSA-N	1	1	319.361	1.545	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000194608872	201262194	/nfs/dbraw/zinc/26/21/94/201262194.db2.gz	HAXNPMKCYRVHAW-UHFFFAOYSA-N	1	1	308.338	1.391	20	5		DDBDMO
Cc1cn(C[C@@H](O)C[N@H+](C)Cc2ccccc2)nc1[N+](=O)[O-]	ZINC000619525395	364048022	/nfs/dbraw/zinc/04/80/22/364048022.db2.gz	NSEGZLAVJQVBDZ-AWEZNQCLSA-N	1	1	304.350	1.593	20	5		DDBDMO
COc1cc(NCC[N@@H+]2CCCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000275432084	212328431	/nfs/dbraw/zinc/32/84/31/212328431.db2.gz	IZRHGDDGTSPSLV-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
COc1cc(NCC[N@H+]2CCCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000275432084	212328434	/nfs/dbraw/zinc/32/84/34/212328434.db2.gz	IZRHGDDGTSPSLV-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000359224454	299364182	/nfs/dbraw/zinc/36/41/82/299364182.db2.gz	IKCVZFYGXOTTEJ-LBPRGKRZSA-N	1	1	304.350	1.631	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000349774434	284047833	/nfs/dbraw/zinc/04/78/33/284047833.db2.gz	HXZPEWUNFFGMDS-SECBINFHSA-N	1	1	321.424	1.663	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000349876669	284090315	/nfs/dbraw/zinc/09/03/15/284090315.db2.gz	RERGZJGAGNXRDF-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[NH+](C)CCCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000264899276	204250371	/nfs/dbraw/zinc/25/03/71/204250371.db2.gz	LCDOWPJKXLREOA-UHFFFAOYSA-N	1	1	305.338	1.543	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000274885982	212009747	/nfs/dbraw/zinc/00/97/47/212009747.db2.gz	ORXOYJQCMHZSAQ-JTQLQIEISA-N	1	1	300.318	1.797	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2n[nH]c(=O)cc2C1	ZINC000274885982	212009749	/nfs/dbraw/zinc/00/97/49/212009749.db2.gz	ORXOYJQCMHZSAQ-JTQLQIEISA-N	1	1	300.318	1.797	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2cc([N+](=O)[O-])cnc2N)cc[nH+]1	ZINC000351113187	284303249	/nfs/dbraw/zinc/30/32/49/284303249.db2.gz	HWRJFGZVSCZAKI-UHFFFAOYSA-N	1	1	302.294	1.285	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000266073821	205077070	/nfs/dbraw/zinc/07/70/70/205077070.db2.gz	XMIBDSICGHPCCZ-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H]3CC[C@H]([NH3+])[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000351501993	284349056	/nfs/dbraw/zinc/34/90/56/284349056.db2.gz	YQKLZXUMUABKEY-YUTCNCBUSA-N	1	1	321.377	1.651	20	5		DDBDMO
CCOC(=O)COCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000351536486	284365580	/nfs/dbraw/zinc/36/55/80/284365580.db2.gz	GRLKCJXTPOYKFW-UHFFFAOYSA-N	1	1	308.334	1.533	20	5		DDBDMO
CCOC(=O)COCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000351536486	284365583	/nfs/dbraw/zinc/36/55/83/284365583.db2.gz	GRLKCJXTPOYKFW-UHFFFAOYSA-N	1	1	308.334	1.533	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCOCC1	ZINC000026159850	248183226	/nfs/dbraw/zinc/18/32/26/248183226.db2.gz	YJEFJSVPIXUBIH-UHFFFAOYSA-N	1	1	309.322	1.264	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000284795938	218180318	/nfs/dbraw/zinc/18/03/18/218180318.db2.gz	OGZBJKJROSBOJF-HIFRSBDPSA-N	1	1	319.361	1.837	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1	ZINC000106396255	194206772	/nfs/dbraw/zinc/20/67/72/194206772.db2.gz	XFQZXFYWQDMLGY-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+](C)C2CCCC2)c1[N+](=O)[O-]	ZINC000109628239	194278390	/nfs/dbraw/zinc/27/83/90/194278390.db2.gz	CPRDEQXJKRMHTA-UHFFFAOYSA-N	1	1	323.397	1.875	20	5		DDBDMO
CC(C)[N@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H](C)O	ZINC000340792996	251215218	/nfs/dbraw/zinc/21/52/18/251215218.db2.gz	RSKKZYYRHIROAK-GXTWGEPZSA-N	1	1	312.366	1.426	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCC[C@H]1O	ZINC000352661253	285205454	/nfs/dbraw/zinc/20/54/54/285205454.db2.gz	RNRJCJHJGZXACX-QWHCGFSZSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCC[C@H]1O	ZINC000352661253	285205459	/nfs/dbraw/zinc/20/54/59/285205459.db2.gz	RNRJCJHJGZXACX-QWHCGFSZSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCC[C@H]1O	ZINC000352660156	285204814	/nfs/dbraw/zinc/20/48/14/285204814.db2.gz	MUFZGFYNYZMIQM-LSDHHAIUSA-N	1	1	319.361	1.329	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])c1	ZINC000352662262	285206331	/nfs/dbraw/zinc/20/63/31/285206331.db2.gz	XZCYHPJLRHQGIV-OCCSQVGLSA-N	1	1	323.349	1.387	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000451578803	533416769	/nfs/dbraw/zinc/41/67/69/533416769.db2.gz	XRDYSKLTIYLPEE-KCQAQPDRSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000068476291	406643061	/nfs/dbraw/zinc/64/30/61/406643061.db2.gz	MTEDCFXTRIGYGB-OCCSQVGLSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000068476291	406643064	/nfs/dbraw/zinc/64/30/64/406643064.db2.gz	MTEDCFXTRIGYGB-OCCSQVGLSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC(C)[N@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000078681605	407041558	/nfs/dbraw/zinc/04/15/58/407041558.db2.gz	XJBQJXJEEXBRSQ-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000078681605	407041559	/nfs/dbraw/zinc/04/15/59/407041559.db2.gz	XJBQJXJEEXBRSQ-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000102332208	407321528	/nfs/dbraw/zinc/32/15/28/407321528.db2.gz	VQGWXXKMWYQUGJ-GFCCVEGCSA-N	1	1	323.397	1.517	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000098104765	407306024	/nfs/dbraw/zinc/30/60/24/407306024.db2.gz	SYARJVSSKLPADA-SNVBAGLBSA-N	1	1	309.370	1.241	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@](C)(O)C1	ZINC000124109695	407348027	/nfs/dbraw/zinc/34/80/27/407348027.db2.gz	NNRSDIUZLRWUQW-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@](C)(O)C1	ZINC000124109695	407348029	/nfs/dbraw/zinc/34/80/29/407348029.db2.gz	NNRSDIUZLRWUQW-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000124480983	407359425	/nfs/dbraw/zinc/35/94/25/407359425.db2.gz	DBZZVXKEZWXKQB-ZFWWWQNUSA-N	1	1	310.350	1.181	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@H]2CCC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000108330944	407383808	/nfs/dbraw/zinc/38/38/08/407383808.db2.gz	UECLASYXDNFCFX-CYBMUJFWSA-N	1	1	323.397	1.256	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000271075377	407502810	/nfs/dbraw/zinc/50/28/10/407502810.db2.gz	GQCPYZXXGJRMEK-SNVBAGLBSA-N	1	1	324.333	1.607	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000271075377	407502814	/nfs/dbraw/zinc/50/28/14/407502814.db2.gz	GQCPYZXXGJRMEK-SNVBAGLBSA-N	1	1	324.333	1.607	20	5		DDBDMO
C[C@H]1C[C@H](C[NH3+])CN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000261693764	407580206	/nfs/dbraw/zinc/58/02/06/407580206.db2.gz	IUGYHNRMWCWOSX-DTWKUNHWSA-N	1	1	303.322	1.280	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000128548215	407548618	/nfs/dbraw/zinc/54/86/18/407548618.db2.gz	CLDIVELLORBZQE-QWRGUYRKSA-N	1	1	323.397	1.487	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000117293624	407822136	/nfs/dbraw/zinc/82/21/36/407822136.db2.gz	AAZIQNCRMSPTET-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000117293624	407822143	/nfs/dbraw/zinc/82/21/43/407822143.db2.gz	AAZIQNCRMSPTET-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337973	407840270	/nfs/dbraw/zinc/84/02/70/407840270.db2.gz	KQNNCLBQOFLXCO-XHDPSFHLSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@](C)(O)C2)cccc1[N+](=O)[O-]	ZINC000267337973	407840273	/nfs/dbraw/zinc/84/02/73/407840273.db2.gz	KQNNCLBQOFLXCO-XHDPSFHLSA-N	1	1	307.350	1.687	20	5		DDBDMO
CCCNC(=O)C[N@H+](CCC)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153754004	407894159	/nfs/dbraw/zinc/89/41/59/407894159.db2.gz	KSZVHCISYZIHQV-HNNXBMFYSA-N	1	1	323.393	1.866	20	5		DDBDMO
CCCNC(=O)C[N@@H+](CCC)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153754004	407894163	/nfs/dbraw/zinc/89/41/63/407894163.db2.gz	KSZVHCISYZIHQV-HNNXBMFYSA-N	1	1	323.393	1.866	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000268135976	407906938	/nfs/dbraw/zinc/90/69/38/407906938.db2.gz	CIGUGXFLKUAGKB-TVQRCGJNSA-N	1	1	304.350	1.390	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000268245215	407968806	/nfs/dbraw/zinc/96/88/06/407968806.db2.gz	VYBAKZSZCWKZTC-SKDRFNHKSA-N	1	1	321.381	1.483	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@H+](C)C[C@@H]1C	ZINC000121206201	408164712	/nfs/dbraw/zinc/16/47/12/408164712.db2.gz	LMOXTLVGWZTGPC-HZMBPMFUSA-N	1	1	306.366	1.710	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c[nH]c3=O)CC[C@@H]21	ZINC000150969524	408234608	/nfs/dbraw/zinc/23/46/08/408234608.db2.gz	TVIXZFJGYRUCQB-MFKMUULPSA-N	1	1	320.349	1.252	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269475176	408322431	/nfs/dbraw/zinc/32/24/31/408322431.db2.gz	VADLOVBIBFEREC-SNVBAGLBSA-N	1	1	311.386	1.901	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@H]1O	ZINC000246760637	408332238	/nfs/dbraw/zinc/33/22/38/408332238.db2.gz	OVGNKEVTBYGJGD-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@H]1O	ZINC000246760637	408332242	/nfs/dbraw/zinc/33/22/42/408332242.db2.gz	OVGNKEVTBYGJGD-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000134133632	162072572	/nfs/dbraw/zinc/07/25/72/162072572.db2.gz	MNVLZXJKYFCIFL-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000246816987	408348088	/nfs/dbraw/zinc/34/80/88/408348088.db2.gz	SIZUWVKBBFPGAA-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205983	408388418	/nfs/dbraw/zinc/38/84/18/408388418.db2.gz	ROBLWIBQQIZFCS-WXHSDQCUSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205983	408388426	/nfs/dbraw/zinc/38/84/26/408388426.db2.gz	ROBLWIBQQIZFCS-WXHSDQCUSA-N	1	1	308.338	1.065	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2C[N@@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000247318318	408448234	/nfs/dbraw/zinc/44/82/34/408448234.db2.gz	MIJYZYZAUUQHTQ-KOLCDFICSA-N	1	1	309.370	1.095	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000274667562	408489494	/nfs/dbraw/zinc/48/94/94/408489494.db2.gz	RPJRIBKTIRXOBK-MRXNPFEDSA-N	1	1	322.361	1.873	20	5		DDBDMO
CCOc1cc(N2CC[NH+]([C@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000269927945	408472757	/nfs/dbraw/zinc/47/27/57/408472757.db2.gz	CCUNQGALRVCQPZ-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCS1	ZINC000248458030	408572098	/nfs/dbraw/zinc/57/20/98/408572098.db2.gz	MRQHJUHRJATQIE-VXGBXAGGSA-N	1	1	312.391	1.772	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000265202225	408577350	/nfs/dbraw/zinc/57/73/50/408577350.db2.gz	REIWBFUYTHTKIP-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000265202225	408577351	/nfs/dbraw/zinc/57/73/51/408577351.db2.gz	REIWBFUYTHTKIP-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000265202225	408577355	/nfs/dbraw/zinc/57/73/55/408577355.db2.gz	REIWBFUYTHTKIP-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184269860	408580978	/nfs/dbraw/zinc/58/09/78/408580978.db2.gz	VFVKJWINLGQFTK-UHFFFAOYSA-N	1	1	313.329	1.701	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NCCC[N@@H+](C)C1CCCCC1	ZINC000161326202	408586091	/nfs/dbraw/zinc/58/60/91/408586091.db2.gz	YBWANSIEBUSDRG-UHFFFAOYSA-N	1	1	323.397	1.713	20	5		DDBDMO
C[C@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@@H+]1CC(C)(C)O	ZINC000192543043	408609016	/nfs/dbraw/zinc/60/90/16/408609016.db2.gz	UYPIGKHIUNQWTJ-VIFPVBQESA-N	1	1	300.384	1.333	20	5		DDBDMO
C[C@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@H+]1CC(C)(C)O	ZINC000192543043	408609020	/nfs/dbraw/zinc/60/90/20/408609020.db2.gz	UYPIGKHIUNQWTJ-VIFPVBQESA-N	1	1	300.384	1.333	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000192660940	408626878	/nfs/dbraw/zinc/62/68/78/408626878.db2.gz	VDCMCLVLVQQJEK-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C[C@H]1O	ZINC000270900179	408732929	/nfs/dbraw/zinc/73/29/29/408732929.db2.gz	MKEAOHQIRUNWSD-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+](CCN2CCOCC2)C2CC2)cc1	ZINC000270915053	408740390	/nfs/dbraw/zinc/74/03/90/408740390.db2.gz	QTHFYORETAJAAB-UHFFFAOYSA-N	1	1	305.378	1.891	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000270840117	408703115	/nfs/dbraw/zinc/70/31/15/408703115.db2.gz	DXEKGTVXRFHTLQ-OSAQELSMSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@H]1CCOC1	ZINC000178350474	408810454	/nfs/dbraw/zinc/81/04/54/408810454.db2.gz	KUARZKSILNRHRI-NSHDSACASA-N	1	1	308.334	1.930	20	5		DDBDMO
NC(=O)NC(=O)CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000177999048	408754931	/nfs/dbraw/zinc/75/49/31/408754931.db2.gz	WXGRLVOESCHOPZ-UHFFFAOYSA-N	1	1	320.349	1.534	20	5		DDBDMO
C[C@H]1C[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000290863217	408846250	/nfs/dbraw/zinc/84/62/50/408846250.db2.gz	YVJJQCLEYDRNKA-VHSXEESVSA-N	1	1	307.354	1.008	20	5		DDBDMO
C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCCO	ZINC000281818071	408934291	/nfs/dbraw/zinc/93/42/91/408934291.db2.gz	LMZIBWXBVRSNJP-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCCO	ZINC000281818071	408934293	/nfs/dbraw/zinc/93/42/93/408934293.db2.gz	LMZIBWXBVRSNJP-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000277398569	408933829	/nfs/dbraw/zinc/93/38/29/408933829.db2.gz	GSTKLRWIPYNXIM-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CCCOCC1	ZINC000277398569	408933835	/nfs/dbraw/zinc/93/38/35/408933835.db2.gz	GSTKLRWIPYNXIM-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H](C)CO	ZINC000292046208	408969561	/nfs/dbraw/zinc/96/95/61/408969561.db2.gz	AWBHLRGUMRGRBD-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H](C)CO	ZINC000292046208	408969563	/nfs/dbraw/zinc/96/95/63/408969563.db2.gz	AWBHLRGUMRGRBD-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCC[C@H]1O	ZINC000286390128	408975042	/nfs/dbraw/zinc/97/50/42/408975042.db2.gz	GZAWORRXVKCKKC-ZIAGYGMSSA-N	1	1	308.334	1.807	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1CCCNc1c(F)cccc1[N+](=O)[O-]	ZINC000286410665	408980761	/nfs/dbraw/zinc/98/07/61/408980761.db2.gz	ASKCDFXAJYSORA-LBPRGKRZSA-N	1	1	310.329	1.486	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCNC1=O	ZINC000282178777	409006259	/nfs/dbraw/zinc/00/62/59/409006259.db2.gz	VPHUGUMMVZRXPQ-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000279281720	409184212	/nfs/dbraw/zinc/18/42/12/409184212.db2.gz	WWTQROIHFVCQPC-CHWSQXEVSA-N	1	1	322.340	1.673	20	5		DDBDMO
CC(C)[N@H+](CCOCCO)Cc1ccc([N+](=O)[O-])cc1F	ZINC000283815817	409221994	/nfs/dbraw/zinc/22/19/94/409221994.db2.gz	YHWMJAHHJNMYFB-UHFFFAOYSA-N	1	1	300.330	1.953	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)Cc1ccc([N+](=O)[O-])cc1F	ZINC000283815817	409221997	/nfs/dbraw/zinc/22/19/97/409221997.db2.gz	YHWMJAHHJNMYFB-UHFFFAOYSA-N	1	1	300.330	1.953	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000294026129	409227771	/nfs/dbraw/zinc/22/77/71/409227771.db2.gz	RACSTCVHHRLMNZ-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000294026129	409227774	/nfs/dbraw/zinc/22/77/74/409227774.db2.gz	RACSTCVHHRLMNZ-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]([N@@H+](C)CCO)[C@H]2C)cc([N+](=O)[O-])c1	ZINC000294751899	409299161	/nfs/dbraw/zinc/29/91/61/409299161.db2.gz	WGFNAKCMSHEELS-IUODEOHRSA-N	1	1	321.377	1.430	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cc([N+](=O)[O-])ccc2C)[N@@H+](C)C1	ZINC000284758699	409362182	/nfs/dbraw/zinc/36/21/82/409362182.db2.gz	WEUUPWOQXBMZMB-KBPBESRZSA-N	1	1	321.377	1.694	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000280497853	409330977	/nfs/dbraw/zinc/33/09/77/409330977.db2.gz	BAQXHSBFIMSXJI-OAHLLOKOSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H](C)C(C)(C)O	ZINC000295154012	409347687	/nfs/dbraw/zinc/34/76/87/409347687.db2.gz	MHKYSUWCFVEPEA-NSHDSACASA-N	1	1	309.366	1.933	20	5		DDBDMO
CCCNC(=O)NC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285393971	409426227	/nfs/dbraw/zinc/42/62/27/409426227.db2.gz	SRCLMZKKQSFTBT-UHFFFAOYSA-N	1	1	322.365	1.305	20	5		DDBDMO
CCCNC(=O)NC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285393971	409426233	/nfs/dbraw/zinc/42/62/33/409426233.db2.gz	SRCLMZKKQSFTBT-UHFFFAOYSA-N	1	1	322.365	1.305	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000285417059	409438102	/nfs/dbraw/zinc/43/81/02/409438102.db2.gz	VIVZJHOXUKJORL-SNVBAGLBSA-N	1	1	315.320	1.371	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471798	409658550	/nfs/dbraw/zinc/65/85/50/409658550.db2.gz	LMBGWJCXWGIIQI-RISCZKNCSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471798	409658558	/nfs/dbraw/zinc/65/85/58/409658558.db2.gz	LMBGWJCXWGIIQI-RISCZKNCSA-N	1	1	307.350	1.493	20	5		DDBDMO
CN(C(=O)c1ccc([N+](=O)[O-])n1C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000342479650	409666679	/nfs/dbraw/zinc/66/66/79/409666679.db2.gz	DYPLGCKOZQPGHF-FOSCPWQOSA-N	1	1	306.366	1.631	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@H+](C)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000315647407	409847680	/nfs/dbraw/zinc/84/76/80/409847680.db2.gz	BFWFXXXBZNLXKE-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000315647407	409847685	/nfs/dbraw/zinc/84/76/85/409847685.db2.gz	BFWFXXXBZNLXKE-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000338428309	409982293	/nfs/dbraw/zinc/98/22/93/409982293.db2.gz	XYLUGPQHBBTCBT-UHFFFAOYSA-N	1	1	305.338	1.541	20	5		DDBDMO
CC(C)[N@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000338428309	409982297	/nfs/dbraw/zinc/98/22/97/409982297.db2.gz	XYLUGPQHBBTCBT-UHFFFAOYSA-N	1	1	305.338	1.541	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000338428309	409982302	/nfs/dbraw/zinc/98/23/02/409982302.db2.gz	XYLUGPQHBBTCBT-UHFFFAOYSA-N	1	1	305.338	1.541	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2OC)CC1	ZINC000332337273	410076267	/nfs/dbraw/zinc/07/62/67/410076267.db2.gz	QEUZKAIFJDCZCX-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357513638	410078515	/nfs/dbraw/zinc/07/85/15/410078515.db2.gz	NPRREUVXTCNYLQ-DTWKUNHWSA-N	1	1	305.338	1.126	20	5		DDBDMO
Cc1c(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000339328074	410097909	/nfs/dbraw/zinc/09/79/09/410097909.db2.gz	NSXBPFQOMKQSSA-SGMGOOAPSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC[N@@H+](CC(=O)NCCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000343099241	410141401	/nfs/dbraw/zinc/14/14/01/410141401.db2.gz	NEPTZVJWPLOCNE-UHFFFAOYSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000332587652	410187102	/nfs/dbraw/zinc/18/71/02/410187102.db2.gz	IHNVKPZXXGFGCG-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000332587652	410187104	/nfs/dbraw/zinc/18/71/04/410187104.db2.gz	IHNVKPZXXGFGCG-CYBMUJFWSA-N	1	1	305.378	1.674	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C)[C@@H](C(C)C)C2)n1	ZINC000343224017	410250361	/nfs/dbraw/zinc/25/03/61/410250361.db2.gz	IDWNFSHMZGGLDR-CYBMUJFWSA-N	1	1	322.365	1.553	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3ncc[nH]3)CC2)cc1	ZINC000357743460	410222774	/nfs/dbraw/zinc/22/27/74/410222774.db2.gz	SSZOQCUUCGYANZ-UHFFFAOYSA-N	1	1	315.377	1.678	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H](CC)CN1C(C)=O	ZINC000357907365	410321557	/nfs/dbraw/zinc/32/15/57/410321557.db2.gz	FEJWCSRNMBXCBN-KBPBESRZSA-N	1	1	323.397	1.513	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H](C)O1	ZINC000298840250	410420880	/nfs/dbraw/zinc/42/08/80/410420880.db2.gz	HKWJQPAIXSAQGC-PHIMTYICSA-N	1	1	324.381	1.541	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@H](C)O1	ZINC000298840250	410420884	/nfs/dbraw/zinc/42/08/84/410420884.db2.gz	HKWJQPAIXSAQGC-PHIMTYICSA-N	1	1	324.381	1.541	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H](C[N@@H+](C)CC2CC2)C1	ZINC000355335628	410450875	/nfs/dbraw/zinc/45/08/75/410450875.db2.gz	TYYMQOIXIOXHGC-ZDUSSCGKSA-N	1	1	307.398	1.492	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=C(C)CC1	ZINC000355527582	410565872	/nfs/dbraw/zinc/56/58/72/410565872.db2.gz	ZQQBZUGFKIWHTN-UHFFFAOYSA-N	1	1	304.350	1.680	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000359045732	410545165	/nfs/dbraw/zinc/54/51/65/410545165.db2.gz	WKTQNQXUGIQSDD-UHFFFAOYSA-N	1	1	317.292	1.878	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343802149	410713137	/nfs/dbraw/zinc/71/31/37/410713137.db2.gz	SORXJRVKRHHPSW-SWLSCSKDSA-N	1	1	320.393	1.919	20	5		DDBDMO
Cc1sc(S(=O)(=O)NCC[NH+]2CCCC2)cc1[N+](=O)[O-]	ZINC000353043174	410757009	/nfs/dbraw/zinc/75/70/09/410757009.db2.gz	JFGJKQKYLVYUIH-UHFFFAOYSA-N	1	1	319.408	1.339	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000347885062	410773874	/nfs/dbraw/zinc/77/38/74/410773874.db2.gz	ZKLRCVGHKBUSOF-TXEJJXNPSA-N	1	1	318.381	2.312	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330628562	410839657	/nfs/dbraw/zinc/83/96/57/410839657.db2.gz	LSAIBLVRRMKWLC-OLZOCXBDSA-N	1	1	305.378	1.997	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])cnc3N)C2)C1	ZINC000356279249	410941268	/nfs/dbraw/zinc/94/12/68/410941268.db2.gz	LJWPDHMAVAXMJQ-OAHLLOKOSA-N	1	1	319.365	1.130	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)n1	ZINC000331208543	411016698	/nfs/dbraw/zinc/01/66/98/411016698.db2.gz	PVKWYRCXJZNDRV-LLVKDONJSA-N	1	1	309.370	1.225	20	5		DDBDMO
Cc1nc(NC[C@@H](C(C)C)[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000296586889	226020644	/nfs/dbraw/zinc/02/06/44/226020644.db2.gz	RODVWLSNXJOBLW-LBPRGKRZSA-N	1	1	309.370	1.462	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296695825	226133331	/nfs/dbraw/zinc/13/33/31/226133331.db2.gz	METGVWBEINTYQI-XJKSGUPXSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])[C@H](C)C1	ZINC000290814717	221943556	/nfs/dbraw/zinc/94/35/56/221943556.db2.gz	RQZRQIRZHWGZRH-ZYHUDNBSSA-N	1	1	321.381	1.255	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360945987	418552308	/nfs/dbraw/zinc/55/23/08/418552308.db2.gz	SUXNAGYZENRUNZ-GWCFXTLKSA-N	1	1	318.377	1.849	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000375025226	418590246	/nfs/dbraw/zinc/59/02/46/418590246.db2.gz	YNFVPYGAQJSDTH-DZGCQCFKSA-N	1	1	318.377	1.830	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](n3cncn3)C2)cc1	ZINC000375316546	418628240	/nfs/dbraw/zinc/62/82/40/418628240.db2.gz	DRSMKMMDGJHUDN-CYBMUJFWSA-N	1	1	303.322	1.512	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](O)C2(CC2)C1	ZINC000375311223	418628359	/nfs/dbraw/zinc/62/83/59/418628359.db2.gz	VTVRYFFLLPZQHS-CQSZACIVSA-N	1	1	319.361	1.689	20	5		DDBDMO
CCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC000361364975	418635250	/nfs/dbraw/zinc/63/52/50/418635250.db2.gz	CSLDUOQXZSMXOY-OLZOCXBDSA-N	1	1	324.381	1.080	20	5		DDBDMO
COC(=O)[C@]12CCC[C@@H]1C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)C2	ZINC000367796407	418635885	/nfs/dbraw/zinc/63/58/85/418635885.db2.gz	RIMFLMHQOWPCCW-YGRLFVJLSA-N	1	1	308.338	1.103	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[N@@H+](CCO)CC1	ZINC000367943790	418661716	/nfs/dbraw/zinc/66/17/16/418661716.db2.gz	JARVTHOVAFIKDW-UHFFFAOYSA-N	1	1	307.350	1.302	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000367984789	418668992	/nfs/dbraw/zinc/66/89/92/418668992.db2.gz	YWLSZLINJMBRJP-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000361569345	418680506	/nfs/dbraw/zinc/68/05/06/418680506.db2.gz	YDMYTSPGMMIUQO-OAHLLOKOSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000361569345	418680508	/nfs/dbraw/zinc/68/05/08/418680508.db2.gz	YDMYTSPGMMIUQO-OAHLLOKOSA-N	1	1	320.349	1.039	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362052229	418744918	/nfs/dbraw/zinc/74/49/18/418744918.db2.gz	DKEPZBCAXYRCFU-IJLUTSLNSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1CO	ZINC000362067896	418747889	/nfs/dbraw/zinc/74/78/89/418747889.db2.gz	RHVBBMQRZZTPEB-CMPLNLGQSA-N	1	1	318.333	1.705	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000408067307	418785071	/nfs/dbraw/zinc/78/50/71/418785071.db2.gz	BNZRVIHDUNNBKK-VHSXEESVSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000408067307	418785073	/nfs/dbraw/zinc/78/50/73/418785073.db2.gz	BNZRVIHDUNNBKK-VHSXEESVSA-N	1	1	309.370	1.606	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365840935	418915148	/nfs/dbraw/zinc/91/51/48/418915148.db2.gz	XBJOLLCGFALCMQ-BDJLRTHQSA-N	1	1	319.361	1.769	20	5		DDBDMO
COC(=O)[C@@H]1CN([C@H](C)c2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411910616	419469373	/nfs/dbraw/zinc/46/93/73/419469373.db2.gz	SLBXIWUVPZYWHL-OCCSQVGLSA-N	1	1	321.377	1.692	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)[nH]1	ZINC000412023009	419568557	/nfs/dbraw/zinc/56/85/57/419568557.db2.gz	BMFQKNTXCICOJY-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000412023009	419568564	/nfs/dbraw/zinc/56/85/64/419568564.db2.gz	BMFQKNTXCICOJY-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n1	ZINC000412023009	419568570	/nfs/dbraw/zinc/56/85/70/419568570.db2.gz	BMFQKNTXCICOJY-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000412023009	419568577	/nfs/dbraw/zinc/56/85/77/419568577.db2.gz	BMFQKNTXCICOJY-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)n[nH]1	ZINC000412023009	419568584	/nfs/dbraw/zinc/56/85/84/419568584.db2.gz	BMFQKNTXCICOJY-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044267	419587096	/nfs/dbraw/zinc/58/70/96/419587096.db2.gz	WOWDKWGVMPHBNU-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412044267	419587103	/nfs/dbraw/zinc/58/71/03/419587103.db2.gz	WOWDKWGVMPHBNU-SDDRHHMPSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000427389768	419653285	/nfs/dbraw/zinc/65/32/85/419653285.db2.gz	HDNWIFRADPAFRD-UHFFFAOYSA-N	1	1	305.338	2.397	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@H]2[C@H](C)CCN[C@H]2C)c([N+](=O)[O-])c1	ZINC000420364683	420239121	/nfs/dbraw/zinc/23/91/21/420239121.db2.gz	KLBYWHVIRVIXEP-BFQNTYOBSA-N	1	1	323.393	1.958	20	5		DDBDMO
C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@@H]1C[NH3+]	ZINC000424014632	420306795	/nfs/dbraw/zinc/30/67/95/420306795.db2.gz	LUQRKTKIYNTXLS-UWVGGRQHSA-N	1	1	317.349	1.528	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000420590586	420325390	/nfs/dbraw/zinc/32/53/90/420325390.db2.gz	VUFNGXOBNLBSIO-MNOVXSKESA-N	1	1	304.350	1.732	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1c(C(N)=O)cccc1[N+](=O)[O-])CC2	ZINC000420611918	420331071	/nfs/dbraw/zinc/33/10/71/420331071.db2.gz	OCTJMDVKTRTKEZ-UHFFFAOYSA-N	1	1	318.377	1.758	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000492664093	420621830	/nfs/dbraw/zinc/62/18/30/420621830.db2.gz	SYAJZLSPPHLKHE-CFHLNLSMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000492664093	420621834	/nfs/dbraw/zinc/62/18/34/420621834.db2.gz	SYAJZLSPPHLKHE-CFHLNLSMSA-N	1	1	319.361	1.133	20	5		DDBDMO
COC(=O)[C@H](C1CC1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000488722515	421108004	/nfs/dbraw/zinc/10/80/04/421108004.db2.gz	OQVRURUYZDJYPC-ZDUSSCGKSA-N	1	1	308.338	1.380	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](CO)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000488753104	421111377	/nfs/dbraw/zinc/11/13/77/421111377.db2.gz	QHDPAOIMYJIDDM-RYUDHWBXSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC000456222376	421126225	/nfs/dbraw/zinc/12/62/25/421126225.db2.gz	HLCBNTUVNFGJTE-BETUJISGSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)ncc1[N+](=O)[O-]	ZINC000450264340	421173176	/nfs/dbraw/zinc/17/31/76/421173176.db2.gz	ZIUDDAKWGQZTIQ-LLVKDONJSA-N	1	1	321.381	1.383	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[NH+]([C@@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000456535990	421180581	/nfs/dbraw/zinc/18/05/81/421180581.db2.gz	URLNYMVCOPQZKW-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH+]([C@@H](C)CC)CC2)c1[N+](=O)[O-]	ZINC000456535990	421180586	/nfs/dbraw/zinc/18/05/86/421180586.db2.gz	URLNYMVCOPQZKW-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000524720013	421266843	/nfs/dbraw/zinc/26/68/43/421266843.db2.gz	UQERUYDFQHVAER-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1c[nH]nc1[N+](=O)[O-])C1CCCCC1	ZINC000549156744	421495564	/nfs/dbraw/zinc/49/55/64/421495564.db2.gz	LZNOFSXQFNCIJD-UHFFFAOYSA-N	1	1	309.370	1.702	20	5		DDBDMO
Cc1cc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)no1	ZINC000552836445	421596129	/nfs/dbraw/zinc/59/61/29/421596129.db2.gz	CCWSGBVJIBSSDX-ZDUSSCGKSA-N	1	1	307.306	1.421	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000519643598	421712988	/nfs/dbraw/zinc/71/29/88/421712988.db2.gz	WSUGYLISVYPOJL-CHWSQXEVSA-N	1	1	320.393	1.996	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000556724986	421728111	/nfs/dbraw/zinc/72/81/11/421728111.db2.gz	ZGMBLVAOEIUGBU-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cn1c(C(=O)N2CCC[N@H+](C(C)(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000520150300	421738476	/nfs/dbraw/zinc/73/84/76/421738476.db2.gz	ANJHESBCKFPOCD-UHFFFAOYSA-N	1	1	308.382	1.880	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1	ZINC000521718129	421797886	/nfs/dbraw/zinc/79/78/86/421797886.db2.gz	AANLVGZJSPHFAU-UHFFFAOYSA-N	1	1	317.349	1.916	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+]3CCOC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000543479867	421838273	/nfs/dbraw/zinc/83/82/73/421838273.db2.gz	FOMPBDGOGJSGCW-ZDUSSCGKSA-N	1	1	307.350	1.514	20	5		DDBDMO
CCOc1cc(N2CC[N@H+]3CCOC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000543479867	421838274	/nfs/dbraw/zinc/83/82/74/421838274.db2.gz	FOMPBDGOGJSGCW-ZDUSSCGKSA-N	1	1	307.350	1.514	20	5		DDBDMO
Cc1cc(CO)cc(NCCNc2ccc([N+](=O)[O-])cc2)[nH+]1	ZINC000596063142	422361485	/nfs/dbraw/zinc/36/14/85/422361485.db2.gz	YJRSXPWNBXWOJU-UHFFFAOYSA-N	1	1	302.334	2.315	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCNC1	ZINC000423193935	533686110	/nfs/dbraw/zinc/68/61/10/533686110.db2.gz	RCQRFWBUISWOOY-DGCLKSJQSA-N	1	1	306.366	1.654	20	5		DDBDMO
CC[NH+](CC)C[C@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000341691090	271172046	/nfs/dbraw/zinc/17/20/46/271172046.db2.gz	BBXOTGUADMPNNG-JTQLQIEISA-N	1	1	319.365	1.931	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](C)O)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343511145	271788329	/nfs/dbraw/zinc/78/83/29/271788329.db2.gz	NCZAJAZJKPNJRE-STQMWFEESA-N	1	1	312.366	1.426	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000346654073	272510622	/nfs/dbraw/zinc/51/06/22/272510622.db2.gz	RFIDNXQITWUKML-GFCCVEGCSA-N	1	1	311.357	1.622	20	5		DDBDMO
COC(=O)c1cnc(N(C)C[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000420643886	274008119	/nfs/dbraw/zinc/00/81/19/274008119.db2.gz	XPYUJPGSWOFAHT-LLVKDONJSA-N	1	1	308.338	1.307	20	5		DDBDMO
C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@H]1C[NH3+]	ZINC000424014630	274299819	/nfs/dbraw/zinc/29/98/19/274299819.db2.gz	LUQRKTKIYNTXLS-NXEZZACHSA-N	1	1	317.349	1.528	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ncc([N+](=O)[O-])cn1	ZINC000278667843	274344851	/nfs/dbraw/zinc/34/48/51/274344851.db2.gz	FVNKGXLQSHWPBB-LLVKDONJSA-N	1	1	307.354	1.074	20	5		DDBDMO
C[C@@H]1CN(c2ncnc3cccc([N+](=O)[O-])c32)CC[N@H+]1CCO	ZINC000490064920	274371612	/nfs/dbraw/zinc/37/16/12/274371612.db2.gz	VHUPFYGVTHPDDS-LLVKDONJSA-N	1	1	317.349	1.041	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCCc2c1cnn2CCO	ZINC000320025602	275040134	/nfs/dbraw/zinc/04/01/34/275040134.db2.gz	GNSFRGUAJRYJIG-CQSZACIVSA-N	1	1	316.361	1.951	20	5		DDBDMO
CCN1CC[NH+]([C@H]2CCN(c3ccc(N)cc3[N+](=O)[O-])C2)CC1	ZINC000287222677	276201932	/nfs/dbraw/zinc/20/19/32/276201932.db2.gz	ITYHSJKMISFBTO-AWEZNQCLSA-N	1	1	319.409	1.393	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[NH+](CC)CC2)c1[N+](=O)[O-]	ZINC000077902134	276300676	/nfs/dbraw/zinc/30/06/76/276300676.db2.gz	FOKVXCYSDBZMEE-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC1	ZINC000272631092	277049663	/nfs/dbraw/zinc/04/96/63/277049663.db2.gz	ZXGTYGRMEDRXJM-UHFFFAOYSA-N	1	1	321.362	1.377	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cc([N+](=O)[O-])c1	ZINC000363125568	300215397	/nfs/dbraw/zinc/21/53/97/300215397.db2.gz	RFBOOHWYROVARE-UKRRQHHQSA-N	1	1	319.361	1.496	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000364325931	300376772	/nfs/dbraw/zinc/37/67/72/300376772.db2.gz	SJTXKJWATKGJJN-ZDUSSCGKSA-N	1	1	321.381	1.439	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000367994108	300929098	/nfs/dbraw/zinc/92/90/98/300929098.db2.gz	POBLPBXNZIBATG-ITKZLYELSA-N	1	1	311.288	1.674	20	5		DDBDMO
COc1cccc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000368486704	301038802	/nfs/dbraw/zinc/03/88/02/301038802.db2.gz	OVOOCYZDYUSQDC-NEPJUHHUSA-N	1	1	307.350	1.879	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@H]2C1	ZINC000370044617	301264825	/nfs/dbraw/zinc/26/48/25/301264825.db2.gz	FQRNQKQOVVRJCI-FRRDWIJNSA-N	1	1	305.382	1.244	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCC[C@@H](C)C1	ZINC000532134260	303276136	/nfs/dbraw/zinc/27/61/36/303276136.db2.gz	VLVVJCLGMXDMNM-NEPJUHHUSA-N	1	1	306.366	1.840	20	5		DDBDMO
COc1ccc(CC(=O)NC2C[NH+](C(C)C)C2)cc1[N+](=O)[O-]	ZINC000556715279	303750746	/nfs/dbraw/zinc/75/07/46/303750746.db2.gz	HTNPNBZWYVSYON-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
COc1cccc(N2CCC[N@@H+](CC(C)(C)O)CC2)c1[N+](=O)[O-]	ZINC000368713526	307108358	/nfs/dbraw/zinc/10/83/58/307108358.db2.gz	WAUBUXFNUFMHMS-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279336	307205032	/nfs/dbraw/zinc/20/50/32/307205032.db2.gz	VGJHKYJTWGZXBS-HLLBOEOZSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000374279336	307205033	/nfs/dbraw/zinc/20/50/33/307205033.db2.gz	VGJHKYJTWGZXBS-HLLBOEOZSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279336	307205034	/nfs/dbraw/zinc/20/50/34/307205034.db2.gz	VGJHKYJTWGZXBS-HLLBOEOZSA-N	1	1	317.389	1.680	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC3(CCC[N@H+]3C)CC2)n1	ZINC000575238285	308273861	/nfs/dbraw/zinc/27/38/61/308273861.db2.gz	CQPNWUOVTPNQPL-UHFFFAOYSA-N	1	1	321.381	1.512	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000576610775	308327400	/nfs/dbraw/zinc/32/74/00/308327400.db2.gz	PPCGYPSVCCBADJ-LLVKDONJSA-N	1	1	309.370	1.275	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1ncccn1	ZINC000584666082	337377842	/nfs/dbraw/zinc/37/78/42/337377842.db2.gz	JGTXNGRNSOSIOI-LLVKDONJSA-N	1	1	315.333	1.892	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444661223	533724318	/nfs/dbraw/zinc/72/43/18/533724318.db2.gz	UGVKHEOYCLKJJL-SNVBAGLBSA-N	1	1	318.333	1.999	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444661223	533724320	/nfs/dbraw/zinc/72/43/20/533724320.db2.gz	UGVKHEOYCLKJJL-SNVBAGLBSA-N	1	1	318.333	1.999	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nn1	ZINC000414399103	533947458	/nfs/dbraw/zinc/94/74/58/533947458.db2.gz	VBSFKXBNZPZTIG-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)nn1	ZINC000414399103	533947453	/nfs/dbraw/zinc/94/74/53/533947453.db2.gz	VBSFKXBNZPZTIG-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1nc(N(C)CC[N@@H+]2CCOC(C)(C)C2)ncc1[N+](=O)[O-]	ZINC000296676121	534437730	/nfs/dbraw/zinc/43/77/30/534437730.db2.gz	AQTJOMNSDGGQQZ-UHFFFAOYSA-N	1	1	309.370	1.240	20	5		DDBDMO
Cc1nc(N(C)CC[N@H+]2CCOC(C)(C)C2)ncc1[N+](=O)[O-]	ZINC000296676121	534437732	/nfs/dbraw/zinc/43/77/32/534437732.db2.gz	AQTJOMNSDGGQQZ-UHFFFAOYSA-N	1	1	309.370	1.240	20	5		DDBDMO
COc1ncnc2c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000160431083	525084186	/nfs/dbraw/zinc/08/41/86/525084186.db2.gz	FESBERDPCIUOGM-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1ncnc2c1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000160431083	525084194	/nfs/dbraw/zinc/08/41/94/525084194.db2.gz	FESBERDPCIUOGM-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
CCC[N@@H+](CC)CCNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119913307	696687578	/nfs/dbraw/zinc/68/75/78/696687578.db2.gz	BSDKGSBZKKTTHN-UHFFFAOYSA-N	1	1	321.424	1.667	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@H+]2Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000748264942	700108568	/nfs/dbraw/zinc/10/85/68/700108568.db2.gz	SSDPZIRPDHCXSK-YPMHNXCESA-N	1	1	315.333	1.255	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000748264942	700108570	/nfs/dbraw/zinc/10/85/70/700108570.db2.gz	SSDPZIRPDHCXSK-YPMHNXCESA-N	1	1	315.333	1.255	20	5		DDBDMO
C[C@@H]1C[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCCO1	ZINC000172494543	697368318	/nfs/dbraw/zinc/36/83/18/697368318.db2.gz	DBSJCIXCPMOKBA-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCCO1	ZINC000172494543	697368320	/nfs/dbraw/zinc/36/83/20/697368320.db2.gz	DBSJCIXCPMOKBA-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000749964874	700195227	/nfs/dbraw/zinc/19/52/27/700195227.db2.gz	RIJQUABPNXJQET-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582148	698121235	/nfs/dbraw/zinc/12/12/35/698121235.db2.gz	RKFKOZGLDACWKR-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582148	698121236	/nfs/dbraw/zinc/12/12/36/698121236.db2.gz	RKFKOZGLDACWKR-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776596657	698124722	/nfs/dbraw/zinc/12/47/22/698124722.db2.gz	HJOGIWSAIQDWNO-HUUCEWRRSA-N	1	1	319.361	1.325	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](n3cncn3)C2)cc1	ZINC000776879242	698145234	/nfs/dbraw/zinc/14/52/34/698145234.db2.gz	SKVWYKBZUYXXPZ-KGLIPLIRSA-N	1	1	303.322	1.167	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000786846006	699172755	/nfs/dbraw/zinc/17/27/55/699172755.db2.gz	SIUALXVJNHTJGZ-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cn1cc([N+](=O)[O-])c(C)n1	ZINC000789518344	699392480	/nfs/dbraw/zinc/39/24/80/699392480.db2.gz	FQSXYDSVNYOCGP-LBPRGKRZSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1Cn1cc([N+](=O)[O-])c(C)n1	ZINC000789518344	699392483	/nfs/dbraw/zinc/39/24/83/699392483.db2.gz	FQSXYDSVNYOCGP-LBPRGKRZSA-N	1	1	309.370	1.438	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1(CO)CCOCC1	ZINC000792409829	699695771	/nfs/dbraw/zinc/69/57/71/699695771.db2.gz	QRHZVSKVOJLVKB-CQSZACIVSA-N	1	1	310.350	1.102	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=CCC1	ZINC000801972489	700361399	/nfs/dbraw/zinc/36/13/99/700361399.db2.gz	RLBXLUJGEKIFFF-UHFFFAOYSA-N	1	1	308.313	1.308	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000802140573	700372608	/nfs/dbraw/zinc/37/26/08/700372608.db2.gz	KOQVTHRDOPPZEZ-LBPRGKRZSA-N	1	1	311.338	1.199	20	5		DDBDMO
O=c1[nH]ccc2c1C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000755208489	700556099	/nfs/dbraw/zinc/55/60/99/700556099.db2.gz	XWKUGUKDHQKDKC-OAHLLOKOSA-N	1	1	315.329	1.787	20	5		DDBDMO
Cc1nn(C[NH+]2CCC(C)(O)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000759751267	700769932	/nfs/dbraw/zinc/76/99/32/700769932.db2.gz	ISKGCWOWJMHTIJ-UHFFFAOYSA-N	1	1	305.338	1.452	20	5		DDBDMO
C[C@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@@H+]1C	ZINC000760158141	700794192	/nfs/dbraw/zinc/79/41/92/700794192.db2.gz	UOCVYJNVJPPZOF-NSHDSACASA-N	1	1	316.361	1.781	20	5		DDBDMO
C[C@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000760158141	700794195	/nfs/dbraw/zinc/79/41/95/700794195.db2.gz	UOCVYJNVJPPZOF-NSHDSACASA-N	1	1	316.361	1.781	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@@H+]1C	ZINC000761096187	700843270	/nfs/dbraw/zinc/84/32/70/700843270.db2.gz	ZPAVYKYHYHAZJS-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C	ZINC000761096187	700843272	/nfs/dbraw/zinc/84/32/72/700843272.db2.gz	ZPAVYKYHYHAZJS-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000762720662	700904669	/nfs/dbraw/zinc/90/46/69/700904669.db2.gz	YPCWMVQWVDHTRT-HMWXGYMHSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@]1(CO)CCOC1	ZINC000763880993	700951511	/nfs/dbraw/zinc/95/15/11/700951511.db2.gz	KRTHVYCOCOKXLP-ZDUSSCGKSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@]1(CO)CCOC1	ZINC000763880993	700951513	/nfs/dbraw/zinc/95/15/13/700951513.db2.gz	KRTHVYCOCOKXLP-ZDUSSCGKSA-N	1	1	300.742	1.831	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000768845676	701209311	/nfs/dbraw/zinc/20/93/11/701209311.db2.gz	MWOLEGWUPHMAAY-VHSXEESVSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000768845676	701209312	/nfs/dbraw/zinc/20/93/12/701209312.db2.gz	MWOLEGWUPHMAAY-VHSXEESVSA-N	1	1	322.321	1.668	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000879133814	706595960	/nfs/dbraw/zinc/59/59/60/706595960.db2.gz	JGSYVNZEKIQZKM-PJODQICGSA-N	1	1	322.361	1.759	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839747727	701808635	/nfs/dbraw/zinc/80/86/35/701808635.db2.gz	DNOMXMNIDZOPBW-RBSFLKMASA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839747727	701808642	/nfs/dbraw/zinc/80/86/42/701808642.db2.gz	DNOMXMNIDZOPBW-RBSFLKMASA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839747727	701808647	/nfs/dbraw/zinc/80/86/47/701808647.db2.gz	DNOMXMNIDZOPBW-RBSFLKMASA-N	1	1	303.362	1.290	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000812323627	702149595	/nfs/dbraw/zinc/14/95/95/702149595.db2.gz	JHGPNSZLBHJVMJ-OLZOCXBDSA-N	1	1	319.361	1.384	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)n1	ZINC000866209053	706649244	/nfs/dbraw/zinc/64/92/44/706649244.db2.gz	PBMVOPDXBBHGPZ-CMPLNLGQSA-N	1	1	320.349	1.307	20	5		DDBDMO
Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@@H]1N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000841024394	702314567	/nfs/dbraw/zinc/31/45/67/702314567.db2.gz	SNAQHXUZKQFKST-LUYZLQTOSA-N	1	1	315.373	1.795	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c3nonc32)[C@@H](C)C[N@H+]1CCO	ZINC000842046642	702663547	/nfs/dbraw/zinc/66/35/47/702663547.db2.gz	FTNOBBLOPYTYCA-ZJUUUORDSA-N	1	1	321.337	1.022	20	5		DDBDMO
Nc1ccc2c(c1)OCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000866690460	706766157	/nfs/dbraw/zinc/76/61/57/706766157.db2.gz	ZGYCJAOLZNCZCY-UHFFFAOYSA-N	1	1	303.322	1.268	20	5		DDBDMO
Nc1ccc2c(c1)OCC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000866690460	706766158	/nfs/dbraw/zinc/76/61/58/706766158.db2.gz	ZGYCJAOLZNCZCY-UHFFFAOYSA-N	1	1	303.322	1.268	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)cc1F	ZINC000852313304	704007430	/nfs/dbraw/zinc/00/74/30/704007430.db2.gz	GFOQTVRTBYHCGZ-LBPRGKRZSA-N	1	1	305.313	1.848	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](Cn3ccnn3)C2)c1	ZINC000852314408	704008220	/nfs/dbraw/zinc/00/82/20/704008220.db2.gz	SKLMQWZKHGTNQG-SWLSCSKDSA-N	1	1	317.349	1.242	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000852495722	704062299	/nfs/dbraw/zinc/06/22/99/704062299.db2.gz	MTMYJOHZMGXXQE-YUELXQCFSA-N	1	1	319.361	1.229	20	5		DDBDMO
CCc1nc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)co1	ZINC000819353236	704111655	/nfs/dbraw/zinc/11/16/55/704111655.db2.gz	AZBYNRBHPKWSRE-CYBMUJFWSA-N	1	1	321.333	1.675	20	5		DDBDMO
CCO[C@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870873421	704152822	/nfs/dbraw/zinc/15/28/22/704152822.db2.gz	CUDKDDWXHPKDOJ-GOEBONIOSA-N	1	1	321.377	1.796	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3N)[C@@H]2C1	ZINC000819719170	704164540	/nfs/dbraw/zinc/16/45/40/704164540.db2.gz	NNXCATRZNTWKPL-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cn1ncc3ccc([N+](=O)[O-])cc31)C2	ZINC000853565928	704271726	/nfs/dbraw/zinc/27/17/26/704271726.db2.gz	KQZQQFKFJRNRFM-SWLSCSKDSA-N	1	1	302.334	1.870	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000855163809	704471960	/nfs/dbraw/zinc/47/19/60/704471960.db2.gz	GIXVDKDEPLLODO-LLVKDONJSA-N	1	1	306.366	1.780	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000823975090	705348549	/nfs/dbraw/zinc/34/85/49/705348549.db2.gz	ZTUHSIBGFWBXCX-JTQLQIEISA-N	1	1	307.354	1.735	20	5		DDBDMO
Nc1ccc(NC(=O)N2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-]	ZINC000823988320	705350269	/nfs/dbraw/zinc/35/02/69/705350269.db2.gz	WADMPCAUOIVSOB-UHFFFAOYSA-N	1	1	305.338	1.489	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](c3ccnn3C)C2)c([N+](=O)[O-])n1	ZINC000876626864	705790376	/nfs/dbraw/zinc/79/03/76/705790376.db2.gz	KRLJXMAGRFBONE-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000863506095	705945251	/nfs/dbraw/zinc/94/52/51/705945251.db2.gz	XIEMTASGAXGOAJ-ZDUSSCGKSA-N	1	1	317.349	1.155	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)nc2ccccn21	ZINC000829010288	706272845	/nfs/dbraw/zinc/27/28/45/706272845.db2.gz	QBGPNGLFNWEZIV-TXEJJXNPSA-N	1	1	317.349	1.518	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000865028919	706329206	/nfs/dbraw/zinc/32/92/06/706329206.db2.gz	BOYHTSWSQLSNCB-UHFFFAOYSA-N	1	1	307.325	1.583	20	5		DDBDMO
O=C1OCCN1CCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865505368	706448212	/nfs/dbraw/zinc/44/82/12/706448212.db2.gz	GCDZSWCOSINMPH-UHFFFAOYSA-N	1	1	316.317	1.819	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)[C@@H](CO)C1	ZINC000872605004	707508871	/nfs/dbraw/zinc/50/88/71/707508871.db2.gz	BMLWGKUDGYNNPR-SNVBAGLBSA-N	1	1	308.363	1.317	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)[C@@H](CO)C1	ZINC000872605004	707508872	/nfs/dbraw/zinc/50/88/72/707508872.db2.gz	BMLWGKUDGYNNPR-SNVBAGLBSA-N	1	1	308.363	1.317	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000832359085	706896969	/nfs/dbraw/zinc/89/69/69/706896969.db2.gz	BTCDHDOMXOUJHS-SMDDNHRTSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000832359085	706896972	/nfs/dbraw/zinc/89/69/72/706896972.db2.gz	BTCDHDOMXOUJHS-SMDDNHRTSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1ccc(C[N@H+](CC(N)=O)C2CCOCC2)cc1[N+](=O)[O-]	ZINC000880397500	706963955	/nfs/dbraw/zinc/96/39/55/706963955.db2.gz	OEMMUQZDMSJSTP-UHFFFAOYSA-N	1	1	307.350	1.370	20	5		DDBDMO
Cc1ccc(C[N@@H+](CC(N)=O)C2CCOCC2)cc1[N+](=O)[O-]	ZINC000880397500	706963957	/nfs/dbraw/zinc/96/39/57/706963957.db2.gz	OEMMUQZDMSJSTP-UHFFFAOYSA-N	1	1	307.350	1.370	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832870302	706997087	/nfs/dbraw/zinc/99/70/87/706997087.db2.gz	HJAFSZMXKGDSKJ-FZMZJTMJSA-N	1	1	309.366	1.473	20	5		DDBDMO
C[C@H]([NH2+]CC1(S(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872068875	707287177	/nfs/dbraw/zinc/28/71/77/707287177.db2.gz	JTGXBXDQMPAAFO-VIFPVBQESA-N	1	1	316.354	1.962	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1CCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000872770856	707591822	/nfs/dbraw/zinc/59/18/22/707591822.db2.gz	ASCFOBCKSSVNKI-GFCCVEGCSA-N	1	1	319.365	1.765	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1CCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000872770856	707591824	/nfs/dbraw/zinc/59/18/24/707591824.db2.gz	ASCFOBCKSSVNKI-GFCCVEGCSA-N	1	1	319.365	1.765	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCN1CCN(C)CC1	ZINC000873008994	707692394	/nfs/dbraw/zinc/69/23/94/707692394.db2.gz	FEDSVWFQEPWWKA-UHFFFAOYSA-N	1	1	320.437	1.939	20	5		DDBDMO
C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1F)CCOCCO	ZINC000882950994	707867606	/nfs/dbraw/zinc/86/76/06/707867606.db2.gz	JYQBZZWWSMNAFN-UHFFFAOYSA-N	1	1	301.318	1.087	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000886592998	708785726	/nfs/dbraw/zinc/78/57/26/708785726.db2.gz	GMYOLXGHHNUJGO-LBPRGKRZSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000886592998	708785729	/nfs/dbraw/zinc/78/57/29/708785729.db2.gz	GMYOLXGHHNUJGO-LBPRGKRZSA-N	1	1	320.393	1.979	20	5		DDBDMO
O=C1C[C@@H]([N@@H+]2CC[C@@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303591	709012339	/nfs/dbraw/zinc/01/23/39/709012339.db2.gz	XFUJJEKFCRKDRJ-GXFFZTMASA-N	1	1	321.308	1.518	20	5		DDBDMO
O=C1C[C@@H]([N@H+]2CC[C@@H](CF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000887303591	709012341	/nfs/dbraw/zinc/01/23/41/709012341.db2.gz	XFUJJEKFCRKDRJ-GXFFZTMASA-N	1	1	321.308	1.518	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000900331139	709541961	/nfs/dbraw/zinc/54/19/61/709541961.db2.gz	BUKMARVYYKJZJD-INIZCTEOSA-N	1	1	321.377	1.100	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000889780165	709631267	/nfs/dbraw/zinc/63/12/67/709631267.db2.gz	IPIMDYMXYREFAD-HUUCEWRRSA-N	1	1	319.361	1.266	20	5		DDBDMO
C[C@H](NC(=O)C[C@@]1(O)CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000901328964	710011588	/nfs/dbraw/zinc/01/15/88/710011588.db2.gz	JVNSWJRBOHIIPU-LRDDRELGSA-N	1	1	321.377	1.619	20	5		DDBDMO
CC[N@@H+](CCNCc1ccc(O)c(OC)c1[N+](=O)[O-])C1CC1	ZINC000892792320	710500337	/nfs/dbraw/zinc/50/03/37/710500337.db2.gz	LPCCEUHRAVBUDX-UHFFFAOYSA-N	1	1	309.366	1.883	20	5		DDBDMO
CCN(CC[NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])C1CC1	ZINC000892792320	710500338	/nfs/dbraw/zinc/50/03/38/710500338.db2.gz	LPCCEUHRAVBUDX-UHFFFAOYSA-N	1	1	309.366	1.883	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928430893	713192166	/nfs/dbraw/zinc/19/21/66/713192166.db2.gz	JUQJTQLZXFDYKF-HPEDKQMDSA-N	1	1	303.362	1.907	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000928445238	713199450	/nfs/dbraw/zinc/19/94/50/713199450.db2.gz	PQLCXAPPUCZAIA-SMDDNHRTSA-N	1	1	316.361	1.758	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000928452603	713203788	/nfs/dbraw/zinc/20/37/88/713203788.db2.gz	NFAFISGKRFEFLQ-CMPLNLGQSA-N	1	1	307.350	1.816	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@@H]2Cc3c[nH+]cn3C2)c([N+](=O)[O-])c1	ZINC000894996027	711357100	/nfs/dbraw/zinc/35/71/00/711357100.db2.gz	IYASMIWNUOIOCP-LLVKDONJSA-N	1	1	316.317	1.544	20	5		DDBDMO
Cc1cccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000896581024	711758119	/nfs/dbraw/zinc/75/81/19/711758119.db2.gz	FUJHYOMQCJFABI-GXTWGEPZSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1c(CNC(=O)C[C@]2(O)CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000907695769	712615127	/nfs/dbraw/zinc/61/51/27/712615127.db2.gz	PMMQYGUPWOKQPD-MRXNPFEDSA-N	1	1	321.377	1.366	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)NC[C@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000921336892	713738340	/nfs/dbraw/zinc/73/83/40/713738340.db2.gz	ZLTQDTUEILAPKS-DGCLKSJQSA-N	1	1	306.366	1.968	20	5		DDBDMO
COc1ccc(NC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000930770386	713916211	/nfs/dbraw/zinc/91/62/11/713916211.db2.gz	WOJZUFSSDSCPJA-KOLCDFICSA-N	1	1	308.338	1.818	20	5		DDBDMO
Cc1c(CNC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000922167840	713981007	/nfs/dbraw/zinc/98/10/07/713981007.db2.gz	GYRKRBHXFFHQOL-DGCLKSJQSA-N	1	1	306.366	1.795	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000931389431	714081905	/nfs/dbraw/zinc/08/19/05/714081905.db2.gz	DEFFTWLKPHDWPM-BETUJISGSA-N	1	1	306.322	1.781	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@H]1CNC(=O)OC(C)(C)C	ZINC000932710158	714394758	/nfs/dbraw/zinc/39/47/58/714394758.db2.gz	LFXLZLXKEMBGPC-NEPJUHHUSA-N	1	1	301.387	1.746	20	5		DDBDMO
CCO[C@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000932973825	714447265	/nfs/dbraw/zinc/44/72/65/714447265.db2.gz	LQKSXHUSAMGPCD-GJZGRUSLSA-N	1	1	319.361	1.811	20	5		DDBDMO
CCO[C@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000932973825	714447266	/nfs/dbraw/zinc/44/72/66/714447266.db2.gz	LQKSXHUSAMGPCD-GJZGRUSLSA-N	1	1	319.361	1.811	20	5		DDBDMO
COC[C@@H]1COCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000933330005	714563768	/nfs/dbraw/zinc/56/37/68/714563768.db2.gz	FJKNDDDLGBPOCW-CQSZACIVSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@@H]1COCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000933330005	714563771	/nfs/dbraw/zinc/56/37/71/714563771.db2.gz	FJKNDDDLGBPOCW-CQSZACIVSA-N	1	1	323.349	1.271	20	5		DDBDMO
Cc1c(CN2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)cccc1[N+](=O)[O-]	ZINC000934257979	714777837	/nfs/dbraw/zinc/77/78/37/714777837.db2.gz	KSAIBTGNYBTRMG-IAGOWNOFSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@@H]3[C@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257979	714777838	/nfs/dbraw/zinc/77/78/38/714777838.db2.gz	KSAIBTGNYBTRMG-IAGOWNOFSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H]3[C@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257979	714777840	/nfs/dbraw/zinc/77/78/40/714777840.db2.gz	KSAIBTGNYBTRMG-IAGOWNOFSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1cscc1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001125374875	732970464	/nfs/dbraw/zinc/97/04/64/732970464.db2.gz	ATRMPYFUUHIILT-UHFFFAOYSA-N	1	1	323.378	1.218	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc2ncccc2c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932040	742775311	/nfs/dbraw/zinc/77/53/11/742775311.db2.gz	GBSHOUMIXFSSON-UKRRQHHQSA-N	1	1	314.345	1.106	20	5		DDBDMO
Cc1nccnc1O[C@@H]1CC[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169051990	762206759	/nfs/dbraw/zinc/20/67/59/762206759.db2.gz	DYYQVNSAPAUZHP-HZSPNIEDSA-N	1	1	306.366	1.684	20	5		DDBDMO
Cc1nc(Cl)nc(N2C[C@H]3CCC[N@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001157261460	764729159	/nfs/dbraw/zinc/72/91/59/764729159.db2.gz	RJNHITOONJUISB-NXEZZACHSA-N	1	1	311.773	1.877	20	5		DDBDMO
Cc1nc(Cl)nc(N2C[C@H]3CCC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001157261463	764729385	/nfs/dbraw/zinc/72/93/85/764729385.db2.gz	RJNHITOONJUISB-ZJUUUORDSA-N	1	1	311.773	1.877	20	5		DDBDMO
CCOC(=O)C1=C(Nc2nccc(OC)c2[N+](=O)[O-])CC[NH2+]C1	ZINC001170513017	767720988	/nfs/dbraw/zinc/72/09/88/767720988.db2.gz	DJZPNUCTUILYDZ-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1	ZINC001048812128	769929824	/nfs/dbraw/zinc/92/98/24/769929824.db2.gz	BJVNCPQHKGEFDR-XJFOESAGSA-N	1	1	321.402	1.304	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](Cc3ccsc3)C[C@@H]2C1	ZINC001048812128	769929829	/nfs/dbraw/zinc/92/98/29/769929829.db2.gz	BJVNCPQHKGEFDR-XJFOESAGSA-N	1	1	321.402	1.304	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](Cc3ccsc3)C[C@@H]2C1	ZINC001048812128	769929833	/nfs/dbraw/zinc/92/98/33/769929833.db2.gz	BJVNCPQHKGEFDR-XJFOESAGSA-N	1	1	321.402	1.304	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001093840359	775123971	/nfs/dbraw/zinc/12/39/71/775123971.db2.gz	IZGKUVHUCZWHDU-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCCNc1ccc([N+](=O)[O-])cc1	ZINC001094434374	775858901	/nfs/dbraw/zinc/85/89/01/775858901.db2.gz	FZENWLJDGOVHJU-UHFFFAOYSA-N	1	1	317.349	1.718	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCn3nncc3C1)CC2	ZINC001172920581	776930986	/nfs/dbraw/zinc/93/09/86/776930986.db2.gz	KTLVYNWRQYGPTQ-CQSZACIVSA-N	1	1	313.361	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCn3nncc3C1)CC2	ZINC001172920581	776930989	/nfs/dbraw/zinc/93/09/89/776930989.db2.gz	KTLVYNWRQYGPTQ-CQSZACIVSA-N	1	1	313.361	1.950	20	5		DDBDMO
Cc1n[nH]cc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC001175183102	777712659	/nfs/dbraw/zinc/71/26/59/777712659.db2.gz	GMDPDELLTYBGCN-CYBMUJFWSA-N	1	1	320.349	1.498	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CC1	ZINC001110193615	778067515	/nfs/dbraw/zinc/06/75/15/778067515.db2.gz	PDUBSKQRPAJDBX-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CC1	ZINC001110193742	778068039	/nfs/dbraw/zinc/06/80/39/778068039.db2.gz	VHOHSGREYZUSQB-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)NCC[NH+]1CC=CC1	ZINC001117793747	780901412	/nfs/dbraw/zinc/90/14/12/780901412.db2.gz	AFJXBDGYELPUTH-UHFFFAOYSA-N	1	1	317.345	1.546	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1=CCCCC1	ZINC001267314078	837810024	/nfs/dbraw/zinc/81/00/24/837810024.db2.gz	HYVJKZQWAJVSLN-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1=CCCCC1	ZINC001267314078	837810034	/nfs/dbraw/zinc/81/00/34/837810034.db2.gz	HYVJKZQWAJVSLN-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1=CCCCC1	ZINC001267314078	837810040	/nfs/dbraw/zinc/81/00/40/837810040.db2.gz	HYVJKZQWAJVSLN-HUUCEWRRSA-N	1	1	309.410	1.980	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C/CNC(=O)CC1CCC1	ZINC001268519869	840362788	/nfs/dbraw/zinc/36/27/88/840362788.db2.gz	GNNVKIDRVXLTDC-NSCUHMNNSA-N	1	1	321.381	1.281	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1ccn[nH]1	ZINC001269379265	841581789	/nfs/dbraw/zinc/58/17/89/841581789.db2.gz	FUZHBRMYFFNNNL-UHFFFAOYSA-N	1	1	321.362	1.432	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001326482969	861401170	/nfs/dbraw/zinc/40/11/70/861401170.db2.gz	RPNNPAOIBDOEBH-UGFHNGPFSA-N	1	1	321.377	1.427	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N[C@H]2CCSC2=O)ncc1[N+](=O)[O-]	ZINC001157179173	863636458	/nfs/dbraw/zinc/63/64/58/863636458.db2.gz	NTPRNKULYOMYPY-GFAPAMAISA-N	1	1	308.363	1.966	20	5		DDBDMO
CCOc1nc(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC001157271749	863700746	/nfs/dbraw/zinc/70/07/46/863700746.db2.gz	JEPFBZOOKHSRLO-WCQYABFASA-N	1	1	306.366	1.919	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3ncc(OC)cc3[N+](=O)[O-])C[C@H]2C1	ZINC001157692233	864053849	/nfs/dbraw/zinc/05/38/49/864053849.db2.gz	VDMQLDWDDMHYAV-TXEJJXNPSA-N	1	1	306.366	1.776	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1cc([N+](=O)[O-])c2cc[nH]c2n1	ZINC001159299960	865209124	/nfs/dbraw/zinc/20/91/24/865209124.db2.gz	INCMLFGPFLWQJR-UHFFFAOYSA-N	1	1	302.294	1.172	20	5		DDBDMO
COC(=O)N1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC001321369801	867536124	/nfs/dbraw/zinc/53/61/24/867536124.db2.gz	YGKGWRROWWMFJP-UHFFFAOYSA-N	1	1	323.349	1.748	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CC1	ZINC001321369801	867536138	/nfs/dbraw/zinc/53/61/38/867536138.db2.gz	YGKGWRROWWMFJP-UHFFFAOYSA-N	1	1	323.349	1.748	20	5		DDBDMO
CCn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c(=O)[nH]c1=O	ZINC001474758392	867598565	/nfs/dbraw/zinc/59/85/65/867598565.db2.gz	HZVAZVZTXSPBQF-UHFFFAOYSA-N	1	1	322.296	1.306	20	5		DDBDMO
Nc1nc(NCC[C@@H]2CC[NH2+]CC2(F)F)ccc1[N+](=O)[O-]	ZINC001162811774	867847240	/nfs/dbraw/zinc/84/72/40/867847240.db2.gz	FJBGAYGEVAJDBT-QMMMGPOBSA-N	1	1	301.297	1.619	20	5		DDBDMO
Cc1[nH+]ccn1CCNc1cc2c(c([N+](=O)[O-])c1)NN(C)C2	ZINC001163932763	868804331	/nfs/dbraw/zinc/80/43/31/868804331.db2.gz	BZLJSOVYBBRBQJ-UHFFFAOYSA-N	1	1	302.338	1.984	20	5		DDBDMO
C[C@@H]1CCN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C[C@H]1O	ZINC001164273812	869078883	/nfs/dbraw/zinc/07/88/83/869078883.db2.gz	VWSXDUQBTGJWDW-VYBLIETJSA-N	1	1	306.366	1.729	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2C)c1	ZINC001336743981	869120495	/nfs/dbraw/zinc/12/04/95/869120495.db2.gz	CAQGNFOTLICCIS-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)cc1	ZINC001337289148	869417947	/nfs/dbraw/zinc/41/79/47/869417947.db2.gz	MJAGDDMYRLENJR-XFDYKOMQSA-N	1	1	306.362	1.721	20	5		DDBDMO
COC(=O)c1cc(O[C@H]2CCC[N@@H+](C)C2)c(OC)cc1[N+](=O)[O-]	ZINC001226440225	882433517	/nfs/dbraw/zinc/43/35/17/882433517.db2.gz	TZBHQXRBAFDRKI-JTQLQIEISA-N	1	1	324.333	1.863	20	5		DDBDMO
Cc1ccc(F)c(C[NH2+]CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001317584413	871141672	/nfs/dbraw/zinc/14/16/72/871141672.db2.gz	BJRJZVBBNBZWTH-TZMCWYRMSA-N	1	1	309.341	1.347	20	5		DDBDMO
COCc1cccc(C[NH2+]CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001317585813	871146451	/nfs/dbraw/zinc/14/64/51/871146451.db2.gz	WDXBQYVCXOWXKN-HUUCEWRRSA-N	1	1	321.377	1.046	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC001308003185	871462360	/nfs/dbraw/zinc/46/23/60/871462360.db2.gz	QBLXKRCTPWAZNO-CQSZACIVSA-N	1	1	318.333	1.126	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@H](CO)[C@H](CCO)C2)cc1[N+](=O)[O-]	ZINC001308164981	871476526	/nfs/dbraw/zinc/47/65/26/871476526.db2.gz	WWGLQOVHGPDMKT-CHWSQXEVSA-N	1	1	310.350	1.026	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC001318815851	872286640	/nfs/dbraw/zinc/28/66/40/872286640.db2.gz	UEHBQLRXBUXWOK-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
NC(=O)COC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC001319129380	872452616	/nfs/dbraw/zinc/45/26/16/872452616.db2.gz	ZFCWPUZYCNNKRJ-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1C[C@H]2CC[N@H+](C)[C@H]2C1	ZINC001348954250	874893786	/nfs/dbraw/zinc/89/37/86/874893786.db2.gz	IMNVEJUEFSEOIL-OCCSQVGLSA-N	1	1	303.362	1.988	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001227463219	883030754	/nfs/dbraw/zinc/03/07/54/883030754.db2.gz	ONHPYUGMIXMPTP-DRCTWCGVSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001227463219	883030777	/nfs/dbraw/zinc/03/07/77/883030777.db2.gz	ONHPYUGMIXMPTP-DRCTWCGVSA-N	1	1	321.289	1.686	20	5		DDBDMO
C[C@H](OCC(=O)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC001222542504	880549505	/nfs/dbraw/zinc/54/95/05/880549505.db2.gz	GMDGLRFWLCILPN-LBPRGKRZSA-N	1	1	307.350	1.446	20	5		DDBDMO
C[C@@H](C[NH+](C)C)Oc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC001228659695	883600439	/nfs/dbraw/zinc/60/04/39/883600439.db2.gz	BKQXPMUWLVGCAO-VIFPVBQESA-N	1	1	302.352	1.327	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3cc4n[nH]cc4cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230594495	884631278	/nfs/dbraw/zinc/63/12/78/884631278.db2.gz	FZYSZPLWTIPDON-MRCXROJRSA-N	1	1	316.317	1.654	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3cc4n[nH]cc4cc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230594495	884631283	/nfs/dbraw/zinc/63/12/83/884631283.db2.gz	FZYSZPLWTIPDON-MRCXROJRSA-N	1	1	316.317	1.654	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1	ZINC001234361136	887904736	/nfs/dbraw/zinc/90/47/36/887904736.db2.gz	ZJVOHBQQUTYRQP-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
O=C1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]2CCCN12	ZINC001254605311	896527060	/nfs/dbraw/zinc/52/70/60/896527060.db2.gz	BDLKYZGGFSAPOD-JKSUJKDBSA-N	1	1	315.373	1.759	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ncc([N+](=O)[O-])c2ccccc21	ZINC001262059739	899923107	/nfs/dbraw/zinc/92/31/07/899923107.db2.gz	IIHYGXMGMDFGIC-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CCN(C)[C@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001262059739	899923112	/nfs/dbraw/zinc/92/31/12/899923112.db2.gz	IIHYGXMGMDFGIC-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001262059739	899923119	/nfs/dbraw/zinc/92/31/19/899923119.db2.gz	IIHYGXMGMDFGIC-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001262059739	899923127	/nfs/dbraw/zinc/92/31/27/899923127.db2.gz	IIHYGXMGMDFGIC-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c(N(C)C)n1C	ZINC000358072183	299067783	/nfs/dbraw/zinc/06/77/83/299067783.db2.gz	CHCAAXSLZQOBHK-UHFFFAOYSA-N	1	1	318.337	1.028	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ncccc1[N+](=O)[O-]	ZINC000278773011	214391135	/nfs/dbraw/zinc/39/11/35/214391135.db2.gz	OPSCMGPOXAVDLG-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000444260993	529465311	/nfs/dbraw/zinc/46/53/11/529465311.db2.gz	PYIDFOUHGSIRQS-QWRGUYRKSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000444260993	529465315	/nfs/dbraw/zinc/46/53/15/529465315.db2.gz	PYIDFOUHGSIRQS-QWRGUYRKSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000444260993	529465316	/nfs/dbraw/zinc/46/53/16/529465316.db2.gz	PYIDFOUHGSIRQS-QWRGUYRKSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)n1	ZINC000452173050	231324210	/nfs/dbraw/zinc/32/42/10/231324210.db2.gz	LVZPTVKMRNOAJE-NSHDSACASA-N	1	1	321.381	1.368	20	5		DDBDMO
COC[C@@](C)(CCO)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000286587228	219067872	/nfs/dbraw/zinc/06/78/72/219067872.db2.gz	WXSUTTDIMLHPLW-CYBMUJFWSA-N	1	1	304.293	1.750	20	5		DDBDMO
Cc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@H]3C2)c1[N+](=O)[O-]	ZINC000301324761	282272451	/nfs/dbraw/zinc/27/24/51/282272451.db2.gz	ACWCFPCQNVDJRL-RWMBFGLXSA-N	1	1	305.382	1.557	20	5		DDBDMO
COC(=O)c1cc(C)nc(N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000286894637	219213952	/nfs/dbraw/zinc/21/39/52/219213952.db2.gz	OUXOGQGFJQJCJW-UHFFFAOYSA-N	1	1	322.365	1.615	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000272609436	210009515	/nfs/dbraw/zinc/00/95/15/210009515.db2.gz	SDKVKSJVSJUMLD-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1	ZINC000048427494	352538836	/nfs/dbraw/zinc/53/88/36/352538836.db2.gz	HCSDRVCTBXEEEL-UHFFFAOYSA-N	1	1	322.365	1.093	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000287096625	219310513	/nfs/dbraw/zinc/31/05/13/219310513.db2.gz	YZSKYRPDTZJVRU-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000287096625	219310516	/nfs/dbraw/zinc/31/05/16/219310516.db2.gz	YZSKYRPDTZJVRU-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
C[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O	ZINC000189934945	186251829	/nfs/dbraw/zinc/25/18/29/186251829.db2.gz	USDGHNLPZYFILW-LLVKDONJSA-N	1	1	313.423	1.933	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000265988620	186350027	/nfs/dbraw/zinc/35/00/27/186350027.db2.gz	MCRHJEZBCNONIT-NSHDSACASA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCC[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000041886315	352317181	/nfs/dbraw/zinc/31/71/81/352317181.db2.gz	WXVBURMFQPYVBI-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000042286701	352333240	/nfs/dbraw/zinc/33/32/40/352333240.db2.gz	WXFJIQWSDCGWCJ-NEPJUHHUSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2CCC[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000042286701	352333242	/nfs/dbraw/zinc/33/32/42/352333242.db2.gz	WXFJIQWSDCGWCJ-NEPJUHHUSA-N	1	1	307.350	1.687	20	5		DDBDMO
CCn1cnnc1C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000331875278	234221825	/nfs/dbraw/zinc/22/18/25/234221825.db2.gz	FMLNYIZHMYPUEG-UHFFFAOYSA-N	1	1	319.369	1.319	20	5		DDBDMO
CN([C@@H]1CCC[N@H+](C)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000173405688	198211428	/nfs/dbraw/zinc/21/14/28/198211428.db2.gz	HXIQFYPBYRRSOG-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
CN([C@@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000173405688	198211430	/nfs/dbraw/zinc/21/14/30/198211430.db2.gz	HXIQFYPBYRRSOG-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](C)N1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000173390562	198209520	/nfs/dbraw/zinc/20/95/20/198209520.db2.gz	NLXSAWLBIPJLLC-UONOGXRCSA-N	1	1	306.410	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1	ZINC000068800548	353131535	/nfs/dbraw/zinc/13/15/35/353131535.db2.gz	NRYLHEISFBAXBQ-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCc3ccccc3C2)c1	ZINC000173712826	198243145	/nfs/dbraw/zinc/24/31/45/198243145.db2.gz	YNZWNYLWNZFDAY-INIZCTEOSA-N	1	1	316.361	1.601	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1	ZINC000070714930	353181420	/nfs/dbraw/zinc/18/14/20/353181420.db2.gz	FKJGXSAZSULMOD-UHFFFAOYSA-N	1	1	309.391	1.851	20	5		DDBDMO
CN(CC(=O)NC[C@@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000080127678	353592924	/nfs/dbraw/zinc/59/29/24/353592924.db2.gz	UNFDVFSHWBCPIZ-ZDUSSCGKSA-N	1	1	320.393	1.489	20	5		DDBDMO
Cc1ccc(N2CCC[N@@H+](CCN(C)C)CC2)c([N+](=O)[O-])c1	ZINC000080611820	353618266	/nfs/dbraw/zinc/61/82/66/353618266.db2.gz	GZGOHDXOZDEQGH-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
Cc1ccc(N2CCC[N@H+](CCN(C)C)CC2)c([N+](=O)[O-])c1	ZINC000080611820	353618269	/nfs/dbraw/zinc/61/82/69/353618269.db2.gz	GZGOHDXOZDEQGH-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000093342907	353896424	/nfs/dbraw/zinc/89/64/24/353896424.db2.gz	ANSTWDJEZUYFLX-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000093342907	353896428	/nfs/dbraw/zinc/89/64/28/353896428.db2.gz	ANSTWDJEZUYFLX-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C[C@H]1C	ZINC000280788917	354423847	/nfs/dbraw/zinc/42/38/47/354423847.db2.gz	QUZKNBNUZMGBNX-ZWNOBZJWSA-N	1	1	308.334	1.844	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H](CO)CC2)c([N+](=O)[O-])c1	ZINC000293092925	354453911	/nfs/dbraw/zinc/45/39/11/354453911.db2.gz	KMLIRUHSONPMPN-LLVKDONJSA-N	1	1	307.350	1.288	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H](O)C(C)(C)C2)c1	ZINC000589514252	354998648	/nfs/dbraw/zinc/99/86/48/354998648.db2.gz	OURBPKYJXGIJOT-ZDUSSCGKSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](O)C(C)(C)C2)c1	ZINC000589514252	354998652	/nfs/dbraw/zinc/99/86/52/354998652.db2.gz	OURBPKYJXGIJOT-ZDUSSCGKSA-N	1	1	308.334	1.584	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000589941445	355033966	/nfs/dbraw/zinc/03/39/66/355033966.db2.gz	INYUWYGNPWEOTJ-ZANVPECISA-N	1	1	308.313	1.902	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000590631901	355133642	/nfs/dbraw/zinc/13/36/42/355133642.db2.gz	FFAQWNMULUELII-ZDUSSCGKSA-N	1	1	319.361	1.768	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000590655896	355138520	/nfs/dbraw/zinc/13/85/20/355138520.db2.gz	CRLUBNDLXSHCSK-TZMCWYRMSA-N	1	1	322.361	1.974	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH+]1CC3(C1)CCOCC3)OCCO2	ZINC000590968985	355226323	/nfs/dbraw/zinc/22/63/23/355226323.db2.gz	YAWSBQKDTIVNFN-UHFFFAOYSA-N	1	1	320.345	1.978	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c1	ZINC000591505242	355322226	/nfs/dbraw/zinc/32/22/26/355322226.db2.gz	TUHUIZSJGQFRAO-VXGBXAGGSA-N	1	1	322.361	1.832	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN(Cc3ccon3)CC2)cc1	ZINC000075857190	191524501	/nfs/dbraw/zinc/52/45/01/191524501.db2.gz	FILNCOYTTOXUQJ-UHFFFAOYSA-N	1	1	316.361	1.943	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC2(CCCC2)O1	ZINC000592196859	355532580	/nfs/dbraw/zinc/53/25/80/355532580.db2.gz	ZBTSKBUMEQDYDC-OCCSQVGLSA-N	1	1	324.381	1.186	20	5		DDBDMO
CC[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1[NH3+]	ZINC000592489676	355598543	/nfs/dbraw/zinc/59/85/43/355598543.db2.gz	ZMKOUBPUZMGZFT-CHWSQXEVSA-N	1	1	320.393	1.983	20	5		DDBDMO
O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc4n(n3)CCC4)CC2)n1	ZINC000593027097	355773385	/nfs/dbraw/zinc/77/33/85/355773385.db2.gz	MEZVALFBCIJZSY-UHFFFAOYSA-N	1	1	316.365	1.771	20	5		DDBDMO
CC(C)O[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000593055711	355781179	/nfs/dbraw/zinc/78/11/79/355781179.db2.gz	NEUBJXSYZHWDBN-CQSZACIVSA-N	1	1	309.366	1.646	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000593517421	355910670	/nfs/dbraw/zinc/91/06/70/355910670.db2.gz	KHBJIGQEEXAQLM-UHFFFAOYSA-N	1	1	323.393	1.688	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000595193280	356404302	/nfs/dbraw/zinc/40/43/02/356404302.db2.gz	RUTDYVREINBROX-GFCCVEGCSA-N	1	1	320.349	1.134	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c1[N+](=O)[O-]	ZINC000595309170	356443544	/nfs/dbraw/zinc/44/35/44/356443544.db2.gz	QVVRCMDMCBHNRO-GFCCVEGCSA-N	1	1	324.381	1.875	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](CNC(=O)C(C)C)C2)c1[N+](=O)[O-]	ZINC000595309170	356443548	/nfs/dbraw/zinc/44/35/48/356443548.db2.gz	QVVRCMDMCBHNRO-GFCCVEGCSA-N	1	1	324.381	1.875	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000081579878	192295461	/nfs/dbraw/zinc/29/54/61/192295461.db2.gz	SWCXIPBGAUJXEB-LBPRGKRZSA-N	1	1	309.366	1.678	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1=CCCOC1	ZINC000595750354	356635302	/nfs/dbraw/zinc/63/53/02/356635302.db2.gz	ATBZHXUCGTWYHE-UHFFFAOYSA-N	1	1	305.334	1.472	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1=CCCOC1	ZINC000595750354	356635304	/nfs/dbraw/zinc/63/53/04/356635304.db2.gz	ATBZHXUCGTWYHE-UHFFFAOYSA-N	1	1	305.334	1.472	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595766301	356644361	/nfs/dbraw/zinc/64/43/61/356644361.db2.gz	OFTDNABOBQIQBA-SMDDNHRTSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000595754984	356637696	/nfs/dbraw/zinc/63/76/96/356637696.db2.gz	DOMQTFNESKNIKO-INWMFGNUSA-N	1	1	322.361	1.303	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595762100	356641735	/nfs/dbraw/zinc/64/17/35/356641735.db2.gz	ZYDPHSWCRAVKSJ-LRDDRELGSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595762100	356641738	/nfs/dbraw/zinc/64/17/38/356641738.db2.gz	ZYDPHSWCRAVKSJ-LRDDRELGSA-N	1	1	319.361	1.810	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@H]2C1	ZINC000596189723	356807121	/nfs/dbraw/zinc/80/71/21/356807121.db2.gz	QGHLRECYVULPHF-HZMBPMFUSA-N	1	1	304.350	1.224	20	5		DDBDMO
Cc1cc(CO)cc(N2CCC(n3ccc([N+](=O)[O-])n3)CC2)[nH+]1	ZINC000596213956	356817324	/nfs/dbraw/zinc/81/73/24/356817324.db2.gz	LPGZRXAEPPYJAT-UHFFFAOYSA-N	1	1	317.349	1.829	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000596334535	356860201	/nfs/dbraw/zinc/86/02/01/356860201.db2.gz	BIOMOBGIIRDYHU-SECBINFHSA-N	1	1	307.354	1.373	20	5		DDBDMO
Cc1ccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1[N+](=O)[O-]	ZINC000597237410	357105578	/nfs/dbraw/zinc/10/55/78/357105578.db2.gz	ZWZVAIHQTSAOTD-MRXNPFEDSA-N	1	1	319.405	1.934	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@H]3C[C@H]3C2)cc1[N+](=O)[O-]	ZINC000597223815	357100472	/nfs/dbraw/zinc/10/04/72/357100472.db2.gz	UBBHKKQLORKJOJ-STQMWFEESA-N	1	1	320.345	1.988	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000597856856	357359770	/nfs/dbraw/zinc/35/97/70/357359770.db2.gz	BJQOLYIXFJQOTR-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC([NH+](C)C)C2)c(C)c1[N+](=O)[O-]	ZINC000598606258	357651891	/nfs/dbraw/zinc/65/18/91/357651891.db2.gz	GHHYTEZDDBWGTA-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1CO	ZINC000598646908	357668590	/nfs/dbraw/zinc/66/85/90/357668590.db2.gz	AVPAXNZJYHFJBK-GWCFXTLKSA-N	1	1	307.350	1.144	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598647155	357669448	/nfs/dbraw/zinc/66/94/48/357669448.db2.gz	CEBZUTZWMUNWBW-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598647155	357669449	/nfs/dbraw/zinc/66/94/49/357669449.db2.gz	CEBZUTZWMUNWBW-UPJWGTAASA-N	1	1	321.377	1.872	20	5		DDBDMO
COC(=O)c1cc(NCC[N@H+]2CC[C@@H](O)C2)cc(C)c1[N+](=O)[O-]	ZINC000599176761	357840532	/nfs/dbraw/zinc/84/05/32/357840532.db2.gz	WXFUCCUVFZSSPY-GFCCVEGCSA-N	1	1	323.349	1.168	20	5		DDBDMO
COc1cc(NCC[N@@H+]2CC[C@H](O)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000599198972	357847909	/nfs/dbraw/zinc/84/79/09/357847909.db2.gz	DDYOGIJAIUPXRP-VIFPVBQESA-N	1	1	315.757	1.735	20	5		DDBDMO
COc1cc(NCC[N@H+]2CC[C@H](O)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000599198972	357847913	/nfs/dbraw/zinc/84/79/13/357847913.db2.gz	DDYOGIJAIUPXRP-VIFPVBQESA-N	1	1	315.757	1.735	20	5		DDBDMO
COC(=O)c1ccc(C[N@H+](C)CCn2cc([N+](=O)[O-])cn2)nc1	ZINC000599442954	357938444	/nfs/dbraw/zinc/93/84/44/357938444.db2.gz	FPMNHECXLXGUNH-UHFFFAOYSA-N	1	1	319.321	1.105	20	5		DDBDMO
COC(=O)c1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)nc1	ZINC000599442954	357938447	/nfs/dbraw/zinc/93/84/47/357938447.db2.gz	FPMNHECXLXGUNH-UHFFFAOYSA-N	1	1	319.321	1.105	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)c1ccc([N+](=O)[O-])cc1	ZINC000599682029	358023086	/nfs/dbraw/zinc/02/30/86/358023086.db2.gz	VNGFRGDIKQECKI-SGIREYDYSA-N	1	1	319.361	1.403	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH+](CCCF)CC1	ZINC000600072131	358115545	/nfs/dbraw/zinc/11/55/45/358115545.db2.gz	MPDCTRUMCUAWEZ-UHFFFAOYSA-N	1	1	324.356	1.511	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000601361918	358516425	/nfs/dbraw/zinc/51/64/25/358516425.db2.gz	BNHPGQIMZQVUFD-UHFFFAOYSA-N	1	1	303.362	1.838	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000601125507	358412228	/nfs/dbraw/zinc/41/22/28/358412228.db2.gz	NOIFZAXJHDYEJY-SNVBAGLBSA-N	1	1	311.313	1.184	20	5		DDBDMO
CN(CC(C)(CO)CO)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601131047	358415098	/nfs/dbraw/zinc/41/50/98/358415098.db2.gz	FLJQSIKQXGVXMI-UHFFFAOYSA-N	1	1	305.334	1.570	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4sccn4c3[N+](=O)[O-])C[C@@H]2C1	ZINC000601184356	358437635	/nfs/dbraw/zinc/43/76/35/358437635.db2.gz	KUEGKEPTPSACGT-ZJUUUORDSA-N	1	1	307.379	1.692	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602455890	358989254	/nfs/dbraw/zinc/98/92/54/358989254.db2.gz	ZCBBORNLBMGDSI-NSHDSACASA-N	1	1	309.370	1.067	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(O[C@H]3CCOC3)CC2)c([N+](=O)[O-])n1	ZINC000602480301	359006200	/nfs/dbraw/zinc/00/62/00/359006200.db2.gz	FURUIBDRGJSQLO-ZDUSSCGKSA-N	1	1	310.354	1.098	20	5		DDBDMO
CCOC(=O)CC[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602483275	359008960	/nfs/dbraw/zinc/00/89/60/359008960.db2.gz	FZGWVILPTIHFJM-GFCCVEGCSA-N	1	1	324.381	1.884	20	5		DDBDMO
C[C@]12C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@]1(C)C(=O)NC2=O	ZINC000602732243	359153843	/nfs/dbraw/zinc/15/38/43/359153843.db2.gz	REJMGFWBPMFZGH-GASCZTMLSA-N	1	1	303.318	1.079	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1	ZINC000602837808	359227769	/nfs/dbraw/zinc/22/77/69/359227769.db2.gz	AAEUEOCDPILXJZ-MWLCHTKSSA-N	1	1	322.287	1.345	20	5		DDBDMO
CO[C@H]1C[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C12CCC2	ZINC000602839813	359228620	/nfs/dbraw/zinc/22/86/20/359228620.db2.gz	LWLCLUUFYHDRQI-STQMWFEESA-N	1	1	308.382	1.989	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](n2ccnn2)C1	ZINC000602848521	359235480	/nfs/dbraw/zinc/23/54/80/359235480.db2.gz	VXRNMFDHIXDHOK-GFCCVEGCSA-N	1	1	305.342	1.028	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1	ZINC000602796888	359198699	/nfs/dbraw/zinc/19/86/99/359198699.db2.gz	ALCHBFJFLALGSF-ZIAGYGMSSA-N	1	1	308.382	1.848	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@@H](C)O[C@]2(CCCOC2)C1	ZINC000602831138	359223482	/nfs/dbraw/zinc/22/34/82/359223482.db2.gz	ZCKKLFJEWGBIME-IUODEOHRSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@@H](C)O[C@]2(CCCOC2)C1	ZINC000602831138	359223485	/nfs/dbraw/zinc/22/34/85/359223485.db2.gz	ZCKKLFJEWGBIME-IUODEOHRSA-N	1	1	324.381	1.370	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](n3ccnn3)CC2)n1	ZINC000602889805	359273678	/nfs/dbraw/zinc/27/36/78/359273678.db2.gz	WAMAFVLVYFUWOO-GFCCVEGCSA-N	1	1	305.342	1.110	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](O)[C@H]2CCCC[C@H]21	ZINC000602997600	359346848	/nfs/dbraw/zinc/34/68/48/359346848.db2.gz	NKDLRMNACFFHFG-MJBXVCDLSA-N	1	1	308.382	1.725	20	5		DDBDMO
COc1cc([N+](=O)[O-])cn(CC[N@@H+](C)Cc2ccccc2)c1=O	ZINC000603358347	359591310	/nfs/dbraw/zinc/59/13/10/359591310.db2.gz	IDPUNHRXHZENAC-UHFFFAOYSA-N	1	1	317.345	1.897	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000604199320	359725335	/nfs/dbraw/zinc/72/53/35/359725335.db2.gz	PRVKXRFVNBBYSD-GFCCVEGCSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000188455529	200249940	/nfs/dbraw/zinc/24/99/40/200249940.db2.gz	HKTYHIWUIFHJQR-ABAIWWIYSA-N	1	1	318.377	1.733	20	5		DDBDMO
COc1cc(NCC[N@H+]2CCCOCC2)c([N+](=O)[O-])cc1F	ZINC000188501165	200256920	/nfs/dbraw/zinc/25/69/20/200256920.db2.gz	GUCJUJFNMIHKPI-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
COCC[N@@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000609269240	360285217	/nfs/dbraw/zinc/28/52/17/360285217.db2.gz	NMQARNAOPIDAIC-JTQLQIEISA-N	1	1	313.379	1.497	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000609269240	360285220	/nfs/dbraw/zinc/28/52/20/360285220.db2.gz	NMQARNAOPIDAIC-JTQLQIEISA-N	1	1	313.379	1.497	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@@H](CCO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000610213578	360391978	/nfs/dbraw/zinc/39/19/78/360391978.db2.gz	GGNFBFJRQBXDTC-ZDUSSCGKSA-N	1	1	321.377	1.652	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@H](CCO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000610213578	360391982	/nfs/dbraw/zinc/39/19/82/360391982.db2.gz	GGNFBFJRQBXDTC-ZDUSSCGKSA-N	1	1	321.377	1.652	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000610409273	360429504	/nfs/dbraw/zinc/42/95/04/360429504.db2.gz	FVPNIKMULIAKFE-NSHDSACASA-N	1	1	313.379	1.215	20	5		DDBDMO
CC[N@H+]1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C[C@H]1C	ZINC000611084807	360617638	/nfs/dbraw/zinc/61/76/38/360617638.db2.gz	VLSWOQBVNRSCQN-SNVBAGLBSA-N	1	1	317.349	1.774	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000611268419	360684543	/nfs/dbraw/zinc/68/45/43/360684543.db2.gz	LNIPCCMFWJOJDE-HOTGVXAUSA-N	1	1	321.377	1.331	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000611211030	360661309	/nfs/dbraw/zinc/66/13/09/360661309.db2.gz	HDJFWTHBGXEURE-LLVKDONJSA-N	1	1	307.354	1.122	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC(C)(C)O)c1ccc([N+](=O)[O-])cc1	ZINC000611560961	360760202	/nfs/dbraw/zinc/76/02/02/360760202.db2.gz	VLLQXUPYMMJTGS-ZDUSSCGKSA-N	1	1	304.350	1.778	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](n3cc(CO)nn3)C2)c1	ZINC000293041668	223366863	/nfs/dbraw/zinc/36/68/63/223366863.db2.gz	SIFLOJPBDFODPC-HNNXBMFYSA-N	1	1	317.349	1.516	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](n3cc(CO)nn3)C2)c1	ZINC000293041668	223366865	/nfs/dbraw/zinc/36/68/65/223366865.db2.gz	SIFLOJPBDFODPC-HNNXBMFYSA-N	1	1	317.349	1.516	20	5		DDBDMO
Cc1c(NC(=O)NC[C@@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000264599942	204019612	/nfs/dbraw/zinc/01/96/12/204019612.db2.gz	BHGXGTJOXGTKNZ-GFCCVEGCSA-N	1	1	321.381	1.271	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCC[NH+]1CCSCC1	ZINC000264749338	204124659	/nfs/dbraw/zinc/12/46/59/204124659.db2.gz	AJKGJIQHFJJFTI-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[NH+]1CCCC1	ZINC000012141748	181732323	/nfs/dbraw/zinc/73/23/23/181732323.db2.gz	KOMWRTZNOHOHHI-UHFFFAOYSA-N	1	1	313.379	1.277	20	5		DDBDMO
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](C)CC1	ZINC000351500275	284347996	/nfs/dbraw/zinc/34/79/96/284347996.db2.gz	RUIRJCVHVHEHLB-CQSZACIVSA-N	1	1	305.378	1.938	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c(N)c([N+](=O)[O-])c1	ZINC000267365953	206014355	/nfs/dbraw/zinc/01/43/55/206014355.db2.gz	XHZBLBNREQWVGU-CHWSQXEVSA-N	1	1	318.377	1.842	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000267750396	206258896	/nfs/dbraw/zinc/25/88/96/206258896.db2.gz	DLPCIWCGZTTYHS-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
COC(=O)c1cc(C[N@H+](C)CCn2cc([N+](=O)[O-])cn2)oc1C	ZINC000174813430	248383552	/nfs/dbraw/zinc/38/35/52/248383552.db2.gz	QFPFMRXTGBVWBV-UHFFFAOYSA-N	1	1	322.321	1.611	20	5		DDBDMO
COC(=O)c1cc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)oc1C	ZINC000174813430	248383556	/nfs/dbraw/zinc/38/35/56/248383556.db2.gz	QFPFMRXTGBVWBV-UHFFFAOYSA-N	1	1	322.321	1.611	20	5		DDBDMO
CC[C@H]1CN(Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000105825725	194138960	/nfs/dbraw/zinc/13/89/60/194138960.db2.gz	XGLYJJYLFLZQPJ-HIFRSBDPSA-N	1	1	307.394	1.872	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000109620157	194277565	/nfs/dbraw/zinc/27/75/65/194277565.db2.gz	UPMFSWGECRFXRM-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000110695936	194350380	/nfs/dbraw/zinc/35/03/80/194350380.db2.gz	UBRFXKAASZQNPM-QMMMGPOBSA-N	1	1	312.757	1.607	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000110695936	194350381	/nfs/dbraw/zinc/35/03/81/194350381.db2.gz	UBRFXKAASZQNPM-QMMMGPOBSA-N	1	1	312.757	1.607	20	5		DDBDMO
CNC(=O)c1ccc(NCCC[N@@H+](C)CCOC)c([N+](=O)[O-])c1	ZINC000064914172	184306133	/nfs/dbraw/zinc/30/61/33/184306133.db2.gz	KLGHYJISMYUDTF-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
COCCNC(=O)C1([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000459753134	532997290	/nfs/dbraw/zinc/99/72/90/532997290.db2.gz	KIKVEUGBAZZIQW-UHFFFAOYSA-N	1	1	307.350	1.288	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288614041	220289842	/nfs/dbraw/zinc/28/98/42/220289842.db2.gz	XHIYPXYBKWDFDG-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1[C@@H]2CC[C@H]1CN(C)C(=O)C2	ZINC000451869191	533137148	/nfs/dbraw/zinc/13/71/48/533137148.db2.gz	NSRKDUPWCIYVLF-OCCSQVGLSA-N	1	1	319.361	1.799	20	5		DDBDMO
CC[C@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000156475922	197116464	/nfs/dbraw/zinc/11/64/64/197116464.db2.gz	CEBWWFWTNGKCAO-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000156475922	197116465	/nfs/dbraw/zinc/11/64/65/197116465.db2.gz	CEBWWFWTNGKCAO-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)[C@H](C)C1	ZINC000352670846	285213392	/nfs/dbraw/zinc/21/33/92/285213392.db2.gz	GXGNJBGSUSHJKV-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
CN(C)S(=O)(=O)CC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000289474419	221001170	/nfs/dbraw/zinc/00/11/70/221001170.db2.gz	DSZZHBZLVGCXEH-UHFFFAOYSA-N	1	1	321.786	1.229	20	5		DDBDMO
COC(=O)COc1ccc(C[NH2+]Cc2ccno2)cc1[N+](=O)[O-]	ZINC000569363518	304351270	/nfs/dbraw/zinc/35/12/70/304351270.db2.gz	BKMIDMUFWPNPRR-UHFFFAOYSA-N	1	1	321.289	1.424	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000054987138	407192114	/nfs/dbraw/zinc/19/21/14/407192114.db2.gz	IPACYHGRJIEKNL-HNNXBMFYSA-N	1	1	303.362	1.880	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](C)C1	ZINC000108335413	407384343	/nfs/dbraw/zinc/38/43/43/407384343.db2.gz	DXAOHONTHQNMBJ-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CCN1CCOCC1	ZINC000112407197	407429065	/nfs/dbraw/zinc/42/90/65/407429065.db2.gz	VFZAULCLPHKTRT-UHFFFAOYSA-N	1	1	309.366	1.238	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccc[nH]2)c1	ZINC000266624927	407582304	/nfs/dbraw/zinc/58/23/04/407582304.db2.gz	HAULTVOPEKZBFP-TZMCWYRMSA-N	1	1	305.338	1.317	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H]1CCOC1	ZINC000178758345	407586814	/nfs/dbraw/zinc/58/68/14/407586814.db2.gz	DOSLYBLMUIBPIB-GFCCVEGCSA-N	1	1	319.361	1.452	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000114062606	407534899	/nfs/dbraw/zinc/53/48/99/407534899.db2.gz	SOLKBCFSRANGBQ-MNOVXSKESA-N	1	1	323.349	1.663	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000115435574	407681997	/nfs/dbraw/zinc/68/19/97/407681997.db2.gz	PPDZJVOHHBJMFH-LBPRGKRZSA-N	1	1	323.397	1.327	20	5		DDBDMO
CCC[C@H]1C(=O)NCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000152621785	407662208	/nfs/dbraw/zinc/66/22/08/407662208.db2.gz	JGIGVUSUADGCCS-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC[C@H]1C(=O)NCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000152621785	407662215	/nfs/dbraw/zinc/66/22/15/407662215.db2.gz	JGIGVUSUADGCCS-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000171804067	407770006	/nfs/dbraw/zinc/77/00/06/407770006.db2.gz	FOJNVNBWKUVECF-SECBINFHSA-N	1	1	320.353	1.451	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C[N@H+]1C1CC1	ZINC000133592416	407862598	/nfs/dbraw/zinc/86/25/98/407862598.db2.gz	BIXNSZRZIVMUNB-RKDXNWHRSA-N	1	1	306.322	1.050	20	5		DDBDMO
Cc1ccc(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000153659295	407870436	/nfs/dbraw/zinc/87/04/36/407870436.db2.gz	XOXYRYKYLLQBGX-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000153659295	407870442	/nfs/dbraw/zinc/87/04/42/407870442.db2.gz	XOXYRYKYLLQBGX-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1c(CC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796960	407873698	/nfs/dbraw/zinc/87/36/98/407873698.db2.gz	ZJVYPMFOOOKJHT-IUODEOHRSA-N	1	1	321.377	1.281	20	5		DDBDMO
Cc1c(CC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796960	407873703	/nfs/dbraw/zinc/87/37/03/407873703.db2.gz	ZJVYPMFOOOKJHT-IUODEOHRSA-N	1	1	321.377	1.281	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1	ZINC000173612018	407892092	/nfs/dbraw/zinc/89/20/92/407892092.db2.gz	CJXWMULNIDMJFY-AWEZNQCLSA-N	1	1	307.350	1.871	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)C1	ZINC000173612018	407892098	/nfs/dbraw/zinc/89/20/98/407892098.db2.gz	CJXWMULNIDMJFY-AWEZNQCLSA-N	1	1	307.350	1.871	20	5		DDBDMO
Cc1ccc(NC(=O)C(=O)NC[C@@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000118107022	407892508	/nfs/dbraw/zinc/89/25/08/407892508.db2.gz	BQQCOTGYCCIVPF-LBPRGKRZSA-N	1	1	320.349	1.052	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000173715065	407895148	/nfs/dbraw/zinc/89/51/48/407895148.db2.gz	KNMYGBMURUTIJY-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2C)C1	ZINC000174518122	407956157	/nfs/dbraw/zinc/95/61/57/407956157.db2.gz	LOYUCVCHVFAGQJ-GFCCVEGCSA-N	1	1	306.366	1.712	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000154089330	407968622	/nfs/dbraw/zinc/96/86/22/407968622.db2.gz	PMDWWHDUJLPHIJ-OAHLLOKOSA-N	1	1	321.377	1.772	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000272451585	407925501	/nfs/dbraw/zinc/92/55/01/407925501.db2.gz	NPPYYGUIWXXNMR-NEPJUHHUSA-N	1	1	304.350	1.534	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CCC[N@H+](C3CCCC3)CC2)c1	ZINC000174870776	407996981	/nfs/dbraw/zinc/99/69/81/407996981.db2.gz	NDVMUNRVMVSVKU-UHFFFAOYSA-N	1	1	307.398	1.742	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000155144446	408130490	/nfs/dbraw/zinc/13/04/90/408130490.db2.gz	JYARAQKLTALJQB-PHIMTYICSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[C@H]1C[NH+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000273317009	408150535	/nfs/dbraw/zinc/15/05/35/408150535.db2.gz	JPNBVBLOKNNHTG-RYUDHWBXSA-N	1	1	312.391	1.956	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000175834765	408218123	/nfs/dbraw/zinc/21/81/23/408218123.db2.gz	QPSMXRCQJXKQCU-UHFFFAOYSA-N	1	1	319.321	1.411	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000246799069	408340450	/nfs/dbraw/zinc/34/04/50/408340450.db2.gz	REURMGBCFKZUCO-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000246799069	408340454	/nfs/dbraw/zinc/34/04/54/408340454.db2.gz	REURMGBCFKZUCO-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000134733315	162085642	/nfs/dbraw/zinc/08/56/42/162085642.db2.gz	OGUKWXBWHYYDBV-CYBMUJFWSA-N	1	1	307.398	1.740	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000173953198	162380596	/nfs/dbraw/zinc/38/05/96/162380596.db2.gz	IZLJKNFXBJRSFE-AWEZNQCLSA-N	1	1	321.377	1.510	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H](N3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000173953198	162380603	/nfs/dbraw/zinc/38/06/03/162380603.db2.gz	IZLJKNFXBJRSFE-AWEZNQCLSA-N	1	1	321.377	1.510	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000269727841	408406744	/nfs/dbraw/zinc/40/67/44/408406744.db2.gz	RMTDWKHSJAXCTE-UHFFFAOYSA-N	1	1	321.377	1.236	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000160412358	408480708	/nfs/dbraw/zinc/48/07/08/408480708.db2.gz	TZFWIXZZRBKJAF-LLVKDONJSA-N	1	1	309.370	1.323	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000177022545	408499269	/nfs/dbraw/zinc/49/92/69/408499269.db2.gz	HKNNZNIFEJLEQE-LLVKDONJSA-N	1	1	309.370	1.193	20	5		DDBDMO
C[C@H](c1ccncc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270551589	408575414	/nfs/dbraw/zinc/57/54/14/408575414.db2.gz	BLHSPPCOVNJLTH-BXUZGUMPSA-N	1	1	305.338	1.240	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000161273795	408580577	/nfs/dbraw/zinc/58/05/77/408580577.db2.gz	GFTGUXUIHIDTMX-AAEUAGOBSA-N	1	1	309.370	1.026	20	5		DDBDMO
CC(C)[N@H+]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000270469871	408542453	/nfs/dbraw/zinc/54/24/53/408542453.db2.gz	BYLSKVYNCOUEHD-UHFFFAOYSA-N	1	1	308.382	1.173	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)CCn3cc([N+](=O)[O-])cn3)CC[C@H]21	ZINC000248178044	408544086	/nfs/dbraw/zinc/54/40/86/408544086.db2.gz	VYMZUZPTLAMBIX-GXTWGEPZSA-N	1	1	321.381	1.124	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000248662449	408612205	/nfs/dbraw/zinc/61/22/05/408612205.db2.gz	GWUPJDYTQFRAKD-WDEREUQCSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[N@@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000248662449	408612208	/nfs/dbraw/zinc/61/22/08/408612208.db2.gz	GWUPJDYTQFRAKD-WDEREUQCSA-N	1	1	311.386	1.011	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000177426335	408612708	/nfs/dbraw/zinc/61/27/08/408612708.db2.gz	FVKIOIVZSOOQPS-HNNXBMFYSA-N	1	1	321.333	1.079	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000177434628	408615018	/nfs/dbraw/zinc/61/50/18/408615018.db2.gz	JYTVBBBYUOJFKO-HNNXBMFYSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC(C)C[C@H](CO)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000185333657	408795705	/nfs/dbraw/zinc/79/57/05/408795705.db2.gz	NYAXTKNOZBSZME-GFCCVEGCSA-N	1	1	309.366	1.872	20	5		DDBDMO
CC(C)C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000185333657	408795708	/nfs/dbraw/zinc/79/57/08/408795708.db2.gz	NYAXTKNOZBSZME-GFCCVEGCSA-N	1	1	309.366	1.872	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@@H]2C[N@@H+](C)CC[C@@H]21	ZINC000164563749	408799790	/nfs/dbraw/zinc/79/97/90/408799790.db2.gz	DWCUXHPOLMRTLQ-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H]3[C@@H](C2)NC(=O)N3C)cccc1[N+](=O)[O-]	ZINC000285853393	408876665	/nfs/dbraw/zinc/87/66/65/408876665.db2.gz	QKJOPQMOCQUFGR-OCCSQVGLSA-N	1	1	304.350	1.501	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H]3[C@@H](C2)NC(=O)N3C)cccc1[N+](=O)[O-]	ZINC000285853393	408876667	/nfs/dbraw/zinc/87/66/67/408876667.db2.gz	QKJOPQMOCQUFGR-OCCSQVGLSA-N	1	1	304.350	1.501	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cn(CCC[NH+]2CCN(C(C)C)CC2)c1=O	ZINC000276332035	408836963	/nfs/dbraw/zinc/83/69/63/408836963.db2.gz	LIXYPICPNCKQKH-UHFFFAOYSA-N	1	1	322.409	1.481	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@H](C)C[N@@H+](C)C[C@@H]1C	ZINC000277362796	408926173	/nfs/dbraw/zinc/92/61/73/408926173.db2.gz	CKBMXQOAIOQJFW-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@H](C)C[N@H+](C)C[C@@H]1C	ZINC000277362796	408926176	/nfs/dbraw/zinc/92/61/76/408926176.db2.gz	CKBMXQOAIOQJFW-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)NCCF	ZINC000281832934	408937989	/nfs/dbraw/zinc/93/79/89/408937989.db2.gz	ABQWWGSZXURJNI-QMMMGPOBSA-N	1	1	303.721	1.812	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000286375500	408972295	/nfs/dbraw/zinc/97/22/95/408972295.db2.gz	COUSGFPLILJUNV-UHFFFAOYSA-N	1	1	321.337	1.505	20	5		DDBDMO
Cc1cc(N(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000278948008	409117757	/nfs/dbraw/zinc/11/77/57/409117757.db2.gz	WZBDNMKMYSNNSJ-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1cc(N(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000278948008	409117761	/nfs/dbraw/zinc/11/77/61/409117761.db2.gz	WZBDNMKMYSNNSJ-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C[C@H](O)C[N@@H+](C)C1CC1	ZINC000289447474	409273475	/nfs/dbraw/zinc/27/34/75/409273475.db2.gz	ULJVSGFOCCMMBA-INIZCTEOSA-N	1	1	307.394	1.524	20	5		DDBDMO
CN(C[C@@H](O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000289447474	409273479	/nfs/dbraw/zinc/27/34/79/409273479.db2.gz	ULJVSGFOCCMMBA-INIZCTEOSA-N	1	1	307.394	1.524	20	5		DDBDMO
CN(C[C@@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000289447474	409273480	/nfs/dbraw/zinc/27/34/80/409273480.db2.gz	ULJVSGFOCCMMBA-INIZCTEOSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(C)(C)CO	ZINC000295321188	409432652	/nfs/dbraw/zinc/43/26/52/409432652.db2.gz	WKIJBHZGPVDVNL-NSHDSACASA-N	1	1	309.366	1.872	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000321888212	164045950	/nfs/dbraw/zinc/04/59/50/164045950.db2.gz	RMGHKINCVIRRAP-RYUDHWBXSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000408128958	164236298	/nfs/dbraw/zinc/23/62/98/164236298.db2.gz	MLEWTVLSYRLYIP-KOLCDFICSA-N	1	1	309.370	1.049	20	5		DDBDMO
C[N@H+](Cc1cccc(F)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304386549	409617719	/nfs/dbraw/zinc/61/77/19/409617719.db2.gz	ZRMLRFUGCALLNA-CQSZACIVSA-N	1	1	308.313	1.423	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+](CCO)C1CC1	ZINC000304244770	409587295	/nfs/dbraw/zinc/58/72/95/409587295.db2.gz	UTLZFHPPFWBTQV-UHFFFAOYSA-N	1	1	321.333	1.350	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000354441831	409859156	/nfs/dbraw/zinc/85/91/56/409859156.db2.gz	WXDPGXVXYTWESE-VXGBXAGGSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](C)C1	ZINC000346244112	409870547	/nfs/dbraw/zinc/87/05/47/409870547.db2.gz	UNJPEFOYRLLDEA-TUAOUCFPSA-N	1	1	321.381	1.131	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346254939	409878299	/nfs/dbraw/zinc/87/82/99/409878299.db2.gz	HSTLVKNXIPQTTC-SDDRHHMPSA-N	1	1	321.381	1.131	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000324475721	409925763	/nfs/dbraw/zinc/92/57/63/409925763.db2.gz	FFXSXINBBXHEFF-SNVBAGLBSA-N	1	1	324.356	1.776	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000332238078	410003900	/nfs/dbraw/zinc/00/39/00/410003900.db2.gz	HQWZMQHBXGCXIT-QWHCGFSZSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1COC[C@@H]1O	ZINC000339192478	410068085	/nfs/dbraw/zinc/06/80/85/410068085.db2.gz	GDTHDUPFQOHNEI-NEPJUHHUSA-N	1	1	320.267	1.805	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1COC[C@@H]1O	ZINC000339192478	410068088	/nfs/dbraw/zinc/06/80/88/410068088.db2.gz	GDTHDUPFQOHNEI-NEPJUHHUSA-N	1	1	320.267	1.805	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000339399028	410160921	/nfs/dbraw/zinc/16/09/21/410160921.db2.gz	YNBATDFBURBILB-JKSUJKDBSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCN(CCO)CC1	ZINC000357646143	410161693	/nfs/dbraw/zinc/16/16/93/410161693.db2.gz	KRRNVSYIVRFTSF-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CN(CCOc1ccccc1[N+](=O)[O-])C1CC[NH+](CCO)CC1	ZINC000357646143	410161701	/nfs/dbraw/zinc/16/17/01/410161701.db2.gz	KRRNVSYIVRFTSF-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347015011	410314841	/nfs/dbraw/zinc/31/48/41/410314841.db2.gz	UZWCWBRYIQEHCE-CYBMUJFWSA-N	1	1	319.361	1.669	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](O)[C@@H](C)C1	ZINC000351945775	410356286	/nfs/dbraw/zinc/35/62/86/410356286.db2.gz	ULEJACICEDUGJC-GWCFXTLKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](C)[C@H]1C	ZINC000343432241	410449295	/nfs/dbraw/zinc/44/92/95/410449295.db2.gz	KLEQWZGKIDVONH-GWCFXTLKSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343464888	410473677	/nfs/dbraw/zinc/47/36/77/410473677.db2.gz	YVUPJVFNUCZCRI-NWDGAFQWSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@@]12CCC[N@H+]1C[C@@H](c1noc(-c3ccc([N+](=O)[O-])[nH]3)n1)OC2	ZINC000347343706	410485864	/nfs/dbraw/zinc/48/58/64/410485864.db2.gz	SSYNBEYMYRCTFS-HZMBPMFUSA-N	1	1	319.321	1.899	20	5		DDBDMO
C[C@@H](O)CCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000339738357	410427681	/nfs/dbraw/zinc/42/76/81/410427681.db2.gz	HBRRZQMYYAWZEL-CYBMUJFWSA-N	1	1	321.377	1.514	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)CC(C)(CO)CO	ZINC000347354426	410493142	/nfs/dbraw/zinc/49/31/42/410493142.db2.gz	BEYOAFAPHLXPPP-QPEQYQDCSA-N	1	1	308.378	1.921	20	5		DDBDMO
COC1CC([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000352233805	410568702	/nfs/dbraw/zinc/56/87/02/410568702.db2.gz	ZMWXZBODZKNBCN-UHFFFAOYSA-N	1	1	307.350	1.667	20	5		DDBDMO
COC1CC([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000352233805	410568708	/nfs/dbraw/zinc/56/87/08/410568708.db2.gz	ZMWXZBODZKNBCN-UHFFFAOYSA-N	1	1	307.350	1.667	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])cc3F)CC2)C1	ZINC000301304083	410695731	/nfs/dbraw/zinc/69/57/31/410695731.db2.gz	SVEFHFGTTUBOCR-AWEZNQCLSA-N	1	1	322.384	1.950	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(C)(C)O)CCN1Cc1cc(O)ccc1[N+](=O)[O-]	ZINC000330450118	410698563	/nfs/dbraw/zinc/69/85/63/410698563.db2.gz	ILXYBLBIUZGOSY-GFCCVEGCSA-N	1	1	323.393	1.577	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1cc(O)ccc1[N+](=O)[O-]	ZINC000330450118	410698568	/nfs/dbraw/zinc/69/85/68/410698568.db2.gz	ILXYBLBIUZGOSY-GFCCVEGCSA-N	1	1	323.393	1.577	20	5		DDBDMO
CN(C(=O)c1cc([O-])ccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000352956299	410699789	/nfs/dbraw/zinc/69/97/89/410699789.db2.gz	LBHLDINZVFHWBY-NSHDSACASA-N	1	1	305.334	1.609	20	5		DDBDMO
CC(C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[NH+]1CCOCC1	ZINC000330427710	410684654	/nfs/dbraw/zinc/68/46/54/410684654.db2.gz	GFVVLWWOPGMIND-ZDUSSCGKSA-N	1	1	324.381	1.020	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000355824088	410688521	/nfs/dbraw/zinc/68/85/21/410688521.db2.gz	GSTXLWVEXGRNQB-NSHDSACASA-N	1	1	323.349	1.054	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)ccc1[N+](=O)[O-]	ZINC000301659660	410764345	/nfs/dbraw/zinc/76/43/45/410764345.db2.gz	TWNSYRMWLSPTLW-GFCCVEGCSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356157854	410870360	/nfs/dbraw/zinc/87/03/60/410870360.db2.gz	MGWOXURJOYPKIK-LBPRGKRZSA-N	1	1	323.397	1.570	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000348349483	410929873	/nfs/dbraw/zinc/92/98/73/410929873.db2.gz	ZRLKLIGVPYCQNR-UHFFFAOYSA-N	1	1	303.362	1.906	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344070169	410935648	/nfs/dbraw/zinc/93/56/48/410935648.db2.gz	QCESWHXJBJBEJF-SCRDCRAPSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344070169	410935653	/nfs/dbraw/zinc/93/56/53/410935653.db2.gz	QCESWHXJBJBEJF-SCRDCRAPSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CO)C[C@@H]1C	ZINC000344121042	410969645	/nfs/dbraw/zinc/96/96/45/410969645.db2.gz	DZRQLJBNZDCQAO-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CO)C[C@@H]1C	ZINC000344121042	410969650	/nfs/dbraw/zinc/96/96/50/410969650.db2.gz	DZRQLJBNZDCQAO-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[NH+]1CCC(N(C)C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000331163353	410991133	/nfs/dbraw/zinc/99/11/33/410991133.db2.gz	AIAMPCHLGWSENI-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
COc1cc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)ccc1[N+](=O)[O-]	ZINC000580723940	422950116	/nfs/dbraw/zinc/95/01/16/422950116.db2.gz	OUCRWJOKNJXYRL-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000375038647	418593488	/nfs/dbraw/zinc/59/34/88/418593488.db2.gz	MAZJASZGVMQJJD-WFASDCNBSA-N	1	1	319.361	1.526	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@@H+](CCOC)C2)cccc1[N+](=O)[O-]	ZINC000361213210	418606789	/nfs/dbraw/zinc/60/67/89/418606789.db2.gz	QCHLAQITNSQUEA-NSHDSACASA-N	1	1	322.365	1.087	20	5		DDBDMO
C[C@H]1COCCN1CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375610808	418661727	/nfs/dbraw/zinc/66/17/27/418661727.db2.gz	HDTQXXZUGZGHKB-KBPBESRZSA-N	1	1	323.397	1.149	20	5		DDBDMO
CCOc1cc(C[N@@H+](CCO)[C@@H]2CCO[C@H]2C)ccc1[N+](=O)[O-]	ZINC000361584682	418685802	/nfs/dbraw/zinc/68/58/02/418685802.db2.gz	FXXXBGZECLMMND-GXTWGEPZSA-N	1	1	324.377	1.965	20	5		DDBDMO
COc1cc(CNc2nc(N(C)C)cc[nH+]2)c([N+](=O)[O-])cc1O	ZINC000361614123	418691958	/nfs/dbraw/zinc/69/19/58/418691958.db2.gz	AWKHKQYSXKUGSO-UHFFFAOYSA-N	1	1	319.321	1.777	20	5		DDBDMO
Nc1cc2c(nn1)CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)C2	ZINC000369762445	418737985	/nfs/dbraw/zinc/73/79/85/418737985.db2.gz	YDGZLUDBBIJKAN-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
Nc1cc2c(nn1)CC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C2	ZINC000369762445	418737988	/nfs/dbraw/zinc/73/79/88/418737988.db2.gz	YDGZLUDBBIJKAN-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904682	418738543	/nfs/dbraw/zinc/73/85/43/418738543.db2.gz	PRYPEQPVFFEBJJ-AAEUAGOBSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904682	418738544	/nfs/dbraw/zinc/73/85/44/418738544.db2.gz	PRYPEQPVFFEBJJ-AAEUAGOBSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000362058656	418746232	/nfs/dbraw/zinc/74/62/32/418746232.db2.gz	DLHBHDLOSCFXCP-QWRGUYRKSA-N	1	1	309.322	1.171	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000362058656	418746234	/nfs/dbraw/zinc/74/62/34/418746234.db2.gz	DLHBHDLOSCFXCP-QWRGUYRKSA-N	1	1	309.322	1.171	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000371338593	418779944	/nfs/dbraw/zinc/77/99/44/418779944.db2.gz	FKNXCAUQTBRILU-ZDUSSCGKSA-N	1	1	324.344	2.236	20	5		DDBDMO
Nc1cc2c(nn1)CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2	ZINC000371376780	418787089	/nfs/dbraw/zinc/78/70/89/418787089.db2.gz	ZTJAIFXFWXWSTO-HWKANZROSA-N	1	1	311.345	2.039	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000364939821	418826250	/nfs/dbraw/zinc/82/62/50/418826250.db2.gz	ZMDYSVNXNAXNBL-SNVBAGLBSA-N	1	1	313.379	1.185	20	5		DDBDMO
CC(C)(C)[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000411318490	418892750	/nfs/dbraw/zinc/89/27/50/418892750.db2.gz	CGJKFGLUPNIWPF-UHFFFAOYSA-N	1	1	322.365	1.509	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712160	418893493	/nfs/dbraw/zinc/89/34/93/418893493.db2.gz	FDIZQUSVGWEYTQ-QWHCGFSZSA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712160	418893495	/nfs/dbraw/zinc/89/34/95/418893495.db2.gz	FDIZQUSVGWEYTQ-QWHCGFSZSA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712161	418893779	/nfs/dbraw/zinc/89/37/79/418893779.db2.gz	FDIZQUSVGWEYTQ-STQMWFEESA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N1CCC[C@H]1[C@@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000372712161	418893780	/nfs/dbraw/zinc/89/37/80/418893780.db2.gz	FDIZQUSVGWEYTQ-STQMWFEESA-N	1	1	321.381	1.304	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](CO)C[C@H](C)C1	ZINC000420930535	419361843	/nfs/dbraw/zinc/36/18/43/419361843.db2.gz	CKRPACNPDIIOSE-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](CO)C[C@H](C)C1	ZINC000420930535	419361847	/nfs/dbraw/zinc/36/18/47/419361847.db2.gz	CKRPACNPDIIOSE-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc(NC(=O)C(=O)NC[C@@H]2CCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000298156613	228385556	/nfs/dbraw/zinc/38/55/56/228385556.db2.gz	PGDMFRSEKBFBIG-LBPRGKRZSA-N	1	1	320.349	1.052	20	5		DDBDMO
CC(C)C[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000421005403	419439694	/nfs/dbraw/zinc/43/96/94/419439694.db2.gz	GHMSVVSDHFSLBE-UHFFFAOYSA-N	1	1	315.395	1.461	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000427324492	419638425	/nfs/dbraw/zinc/63/84/25/419638425.db2.gz	MWISOVJMMYOAGZ-WDEREUQCSA-N	1	1	307.354	1.168	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)[nH]1	ZINC000412033736	419576690	/nfs/dbraw/zinc/57/66/90/419576690.db2.gz	SFUVQOMIDIIIJJ-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)n1	ZINC000412033736	419576695	/nfs/dbraw/zinc/57/66/95/419576695.db2.gz	SFUVQOMIDIIIJJ-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)n1	ZINC000412033736	419576704	/nfs/dbraw/zinc/57/67/04/419576704.db2.gz	SFUVQOMIDIIIJJ-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](CCOc3ccccc3[N+](=O)[O-])C2)n[nH]1	ZINC000412033736	419576710	/nfs/dbraw/zinc/57/67/10/419576710.db2.gz	SFUVQOMIDIIIJJ-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](CCOc3ccccc3[N+](=O)[O-])C2)n[nH]1	ZINC000412033736	419576719	/nfs/dbraw/zinc/57/67/19/419576719.db2.gz	SFUVQOMIDIIIJJ-GFCCVEGCSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000416294353	420310296	/nfs/dbraw/zinc/31/02/96/420310296.db2.gz	KVODYNCPAXUXRG-VXGBXAGGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000416294353	420310300	/nfs/dbraw/zinc/31/03/00/420310300.db2.gz	KVODYNCPAXUXRG-VXGBXAGGSA-N	1	1	321.377	1.430	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000420804829	420399097	/nfs/dbraw/zinc/39/90/97/420399097.db2.gz	ACLCDAYYTZZNJT-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=C1CC[C@@H](C[N@@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)CCN1	ZINC000451048465	420588993	/nfs/dbraw/zinc/58/89/93/420588993.db2.gz	KAMLRUBOUZGQKL-GFCCVEGCSA-N	1	1	319.361	1.706	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1C(C)C	ZINC000453041969	420706411	/nfs/dbraw/zinc/70/64/11/420706411.db2.gz	SBRBRONHRZNGNX-QLFBSQMISA-N	1	1	310.398	1.765	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[C@@H](CC[NH3+])C1	ZINC000443078024	420742816	/nfs/dbraw/zinc/74/28/16/420742816.db2.gz	VVVDAVACYRRMRL-STQMWFEESA-N	1	1	320.393	1.983	20	5		DDBDMO
CNc1nc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000455381105	421004599	/nfs/dbraw/zinc/00/45/99/421004599.db2.gz	JFAOOBPNISPBEF-SECBINFHSA-N	1	1	307.354	1.244	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@]1(C)CO	ZINC000546809800	421311304	/nfs/dbraw/zinc/31/13/04/421311304.db2.gz	DUQYXVVSLHGNNJ-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@]1(C)CO	ZINC000546809800	421311306	/nfs/dbraw/zinc/31/13/06/421311306.db2.gz	DUQYXVVSLHGNNJ-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000524783283	421273120	/nfs/dbraw/zinc/27/31/20/421273120.db2.gz	FTGMFNKPELCJOC-AAEUAGOBSA-N	1	1	306.366	1.877	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000546878069	421314008	/nfs/dbraw/zinc/31/40/08/421314008.db2.gz	BKQCDTDOSNFNRJ-LLVKDONJSA-N	1	1	313.379	1.215	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000548387371	421431619	/nfs/dbraw/zinc/43/16/19/421431619.db2.gz	CTLKNYBTXCAPMK-UHFFFAOYSA-N	1	1	319.296	1.419	20	5		DDBDMO
O=C1NCC[C@@]12CCC[N@@H+]2CCOc1cccc([N+](=O)[O-])c1	ZINC000516875017	421574423	/nfs/dbraw/zinc/57/44/23/421574423.db2.gz	BIXMRMJCNIHQLY-HNNXBMFYSA-N	1	1	305.334	1.328	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000518792704	421668403	/nfs/dbraw/zinc/66/84/03/421668403.db2.gz	QCMQAAMSJCDGSR-LBPRGKRZSA-N	1	1	303.362	1.821	20	5		DDBDMO
CCOCC[NH+]1CCN(c2c(OC)cccc2[N+](=O)[O-])CC1	ZINC000521068434	421773275	/nfs/dbraw/zinc/77/32/75/421773275.db2.gz	YUEQUYHCTHANLR-UHFFFAOYSA-N	1	1	309.366	1.762	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)C(C)(C)C2)c(C)c1[N+](=O)[O-]	ZINC000580966231	421875025	/nfs/dbraw/zinc/87/50/25/421875025.db2.gz	YUYPQQIEKOWMEI-UHFFFAOYSA-N	1	1	323.397	1.351	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000582098119	422107798	/nfs/dbraw/zinc/10/77/98/422107798.db2.gz	XFOMUTWEMQWSBS-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000582098119	422107804	/nfs/dbraw/zinc/10/78/04/422107804.db2.gz	XFOMUTWEMQWSBS-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000583703071	422213978	/nfs/dbraw/zinc/21/39/78/422213978.db2.gz	MDQHSDKUVKRHKG-LLVKDONJSA-N	1	1	323.397	1.882	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000592201831	422331340	/nfs/dbraw/zinc/33/13/40/422331340.db2.gz	WDTKQPMHNPKIDS-QJPTWQEYSA-N	1	1	308.334	1.512	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H]2CCc3c[nH+]cn3C2)ccc1[N+](=O)[O-]	ZINC000594581377	422349888	/nfs/dbraw/zinc/34/98/88/422349888.db2.gz	QTGZWQQDTVOWMG-LLVKDONJSA-N	1	1	317.349	2.400	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCS1	ZINC000076066451	263328776	/nfs/dbraw/zinc/32/87/76/263328776.db2.gz	DKFYHXZEQKVNIN-QWHCGFSZSA-N	1	1	314.411	1.226	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000342365447	271391129	/nfs/dbraw/zinc/39/11/29/271391129.db2.gz	VYYKYQXPAUYICL-WDEREUQCSA-N	1	1	322.365	1.979	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC[N@H+](C2CCC2)C1	ZINC000344732967	272103607	/nfs/dbraw/zinc/10/36/07/272103607.db2.gz	ULVQEXCAVYWYKK-NSHDSACASA-N	1	1	321.381	1.275	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CCC[N@H+]1C	ZINC000345321781	272219311	/nfs/dbraw/zinc/21/93/11/272219311.db2.gz	OUQYRXIADAGGPE-KCJUWKMLSA-N	1	1	310.329	1.529	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+](CC)C2)c1[N+](=O)[O-]	ZINC000345925022	272366821	/nfs/dbraw/zinc/36/68/21/272366821.db2.gz	LDPMHUSLQDSQDQ-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
C[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000302401062	274369529	/nfs/dbraw/zinc/36/95/29/274369529.db2.gz	JXXBVDFFEWCDHN-SECBINFHSA-N	1	1	300.746	1.146	20	5		DDBDMO
C[C@@H]1CN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000302401062	274369530	/nfs/dbraw/zinc/36/95/30/274369530.db2.gz	JXXBVDFFEWCDHN-SECBINFHSA-N	1	1	300.746	1.146	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CCC[N@H+](CCO)CC3)c2c1	ZINC000413125971	275038843	/nfs/dbraw/zinc/03/88/43/275038843.db2.gz	RPLAATMDOZDVIP-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000179710537	278179943	/nfs/dbraw/zinc/17/99/43/278179943.db2.gz	ODCGDVVUYJLXJR-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@H](C[N@H+](C)Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000179710537	278179944	/nfs/dbraw/zinc/17/99/44/278179944.db2.gz	ODCGDVVUYJLXJR-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000179710537	278179946	/nfs/dbraw/zinc/17/99/46/278179946.db2.gz	ODCGDVVUYJLXJR-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290732646	290182307	/nfs/dbraw/zinc/18/23/07/290182307.db2.gz	GCQVBDUUNXUHKH-ZYHUDNBSSA-N	1	1	319.365	1.009	20	5		DDBDMO
CCOc1ccc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000354233671	298375664	/nfs/dbraw/zinc/37/56/64/298375664.db2.gz	AMGAJODIZOSZPC-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000357965269	299034795	/nfs/dbraw/zinc/03/47/95/299034795.db2.gz	QTTVCIBXTITYGH-MNOVXSKESA-N	1	1	309.370	1.321	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C[C@H]21	ZINC000362279590	300042880	/nfs/dbraw/zinc/04/28/80/300042880.db2.gz	HQQQUWXEYODFOY-TVQRCGJNSA-N	1	1	322.340	1.482	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@H](C2CC2)C1	ZINC000362577656	300100850	/nfs/dbraw/zinc/10/08/50/300100850.db2.gz	QKJFGHDHQJHFNO-CJNGLKHVSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@H](C2CC2)C1	ZINC000362577656	300100852	/nfs/dbraw/zinc/10/08/52/300100852.db2.gz	QKJFGHDHQJHFNO-CJNGLKHVSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363305886	300248746	/nfs/dbraw/zinc/24/87/46/300248746.db2.gz	UNPPXEBNRRDBIT-HZPDHXFCSA-N	1	1	317.389	1.475	20	5		DDBDMO
CCN1C(=O)[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000363328693	300252142	/nfs/dbraw/zinc/25/21/42/300252142.db2.gz	OOCCLZIJMQNXAY-CYBMUJFWSA-N	1	1	318.333	1.063	20	5		DDBDMO
CCN1C(=O)[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000363328693	300252146	/nfs/dbraw/zinc/25/21/46/300252146.db2.gz	OOCCLZIJMQNXAY-CYBMUJFWSA-N	1	1	318.333	1.063	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000364209510	300357388	/nfs/dbraw/zinc/35/73/88/300357388.db2.gz	BRJBKHCNFVXUJK-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC(C)NC(=O)CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000364322584	300376187	/nfs/dbraw/zinc/37/61/87/300376187.db2.gz	GRIWGSLDIYEUDT-LBPRGKRZSA-N	1	1	309.370	1.343	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCCN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000366548311	300714586	/nfs/dbraw/zinc/71/45/86/300714586.db2.gz	ZTXOZHCLWVQWHQ-AWEZNQCLSA-N	1	1	321.377	1.380	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CC[N@@H+](C)C2)C1	ZINC000368351025	301008683	/nfs/dbraw/zinc/00/86/83/301008683.db2.gz	ADTGRRZVQIYQJF-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[C@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC12CCOCC2	ZINC000368810581	301091875	/nfs/dbraw/zinc/09/18/75/301091875.db2.gz	OOECYWHQNRSTFQ-TZMCWYRMSA-N	1	1	324.381	1.043	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369972655	301249098	/nfs/dbraw/zinc/24/90/98/301249098.db2.gz	HTVLPBIZLYYOMT-GFCCVEGCSA-N	1	1	309.370	1.297	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369972655	301249100	/nfs/dbraw/zinc/24/91/00/301249100.db2.gz	HTVLPBIZLYYOMT-GFCCVEGCSA-N	1	1	309.370	1.297	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCCC[C@@H]2CN1Cc1c([N+](=O)[O-])ncn1C	ZINC000375869461	302007723	/nfs/dbraw/zinc/00/77/23/302007723.db2.gz	AGBULJABLODGJF-QWHCGFSZSA-N	1	1	307.398	1.777	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000377481812	302183991	/nfs/dbraw/zinc/18/39/91/302183991.db2.gz	OPIPQXOXQITNGV-CABCVRRESA-N	1	1	319.361	1.117	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](CC(N)=O)C1	ZINC000377604870	302197406	/nfs/dbraw/zinc/19/74/06/302197406.db2.gz	JTLIBOBPEWBVQI-MNOVXSKESA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000377604870	302197409	/nfs/dbraw/zinc/19/74/09/302197409.db2.gz	JTLIBOBPEWBVQI-MNOVXSKESA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000531804458	303257904	/nfs/dbraw/zinc/25/79/04/303257904.db2.gz	ZPGCKLGGYGKRCB-NHYWBVRUSA-N	1	1	318.377	1.877	20	5		DDBDMO
C[C@H](c1ccccc1)[NH+]1CCC(NC(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000364755329	307050431	/nfs/dbraw/zinc/05/04/31/307050431.db2.gz	PSKYWIGMEZPYDL-UHOFOFEASA-N	1	1	317.389	1.993	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1nnc2n1CCOC2	ZINC000373613654	307192283	/nfs/dbraw/zinc/19/22/83/307192283.db2.gz	WEEJNEALMAQTCO-HWKANZROSA-N	1	1	315.333	1.520	20	5		DDBDMO
Cn1cc(C2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)cn1	ZINC000374051197	307201031	/nfs/dbraw/zinc/20/10/31/307201031.db2.gz	QCKIOLHGRMDEEZ-UHFFFAOYSA-N	1	1	304.354	1.441	20	5		DDBDMO
C[C@@H]1[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCC12CCOCC2	ZINC000375243277	307219483	/nfs/dbraw/zinc/21/94/83/307219483.db2.gz	WICBLJBSSBMTMH-ZDUSSCGKSA-N	1	1	321.377	1.648	20	5		DDBDMO
CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301689	307242553	/nfs/dbraw/zinc/24/25/53/307242553.db2.gz	HTFUGVZZEAGRCO-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000376301689	307242554	/nfs/dbraw/zinc/24/25/54/307242554.db2.gz	HTFUGVZZEAGRCO-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301689	307242555	/nfs/dbraw/zinc/24/25/55/307242555.db2.gz	HTFUGVZZEAGRCO-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CC[N@H+](C)[C@@H]2C1	ZINC000376643034	307251148	/nfs/dbraw/zinc/25/11/48/307251148.db2.gz	MSTRXQXZQSUFFX-SMDDNHRTSA-N	1	1	304.350	1.464	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000376875152	307257518	/nfs/dbraw/zinc/25/75/18/307257518.db2.gz	ILLOSPNNURBPIE-WDEREUQCSA-N	1	1	305.338	1.160	20	5		DDBDMO
COc1cccc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000584301065	332228828	/nfs/dbraw/zinc/22/88/28/332228828.db2.gz	ISIYLWPUAARCTN-NWDGAFQWSA-N	1	1	319.361	1.912	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000451900845	534481542	/nfs/dbraw/zinc/48/15/42/534481542.db2.gz	MGBFDXBGVUIBOV-MRXNPFEDSA-N	1	1	319.361	1.696	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000445132746	527969389	/nfs/dbraw/zinc/96/93/89/527969389.db2.gz	GYHZMFCAICFXRB-UWVGGRQHSA-N	1	1	308.338	1.250	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]2COC[C@@H]21	ZINC000452126293	529120798	/nfs/dbraw/zinc/12/07/98/529120798.db2.gz	ZXQCBBFMCRBTQT-QWHCGFSZSA-N	1	1	307.350	1.113	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000246383740	698348678	/nfs/dbraw/zinc/34/86/78/698348678.db2.gz	OVAIUKVHOSXOKK-WFASDCNBSA-N	1	1	305.382	1.698	20	5		DDBDMO
Nc1c(F)c(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000785801486	699102672	/nfs/dbraw/zinc/10/26/72/699102672.db2.gz	RENPUGLXZAKPHK-VHSXEESVSA-N	1	1	310.329	1.591	20	5		DDBDMO
Cc1c(C[N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)cnn1C	ZINC000790453192	699461379	/nfs/dbraw/zinc/46/13/79/699461379.db2.gz	QBNQBNQYZDONHU-OAHLLOKOSA-N	1	1	304.350	1.802	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C	ZINC000792876160	699720419	/nfs/dbraw/zinc/72/04/19/699720419.db2.gz	MEBOXLGAEDYCOJ-LBPRGKRZSA-N	1	1	310.310	1.363	20	5		DDBDMO
COC[C@H]1CC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1	ZINC000742153835	699861987	/nfs/dbraw/zinc/86/19/87/699861987.db2.gz	VXPGLBKSPOTYJO-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1	ZINC000742153835	699861990	/nfs/dbraw/zinc/86/19/90/699861990.db2.gz	VXPGLBKSPOTYJO-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000751947720	700328920	/nfs/dbraw/zinc/32/89/20/700328920.db2.gz	UULXJUBGHWDPRT-LLVKDONJSA-N	1	1	305.338	1.716	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@H]1C	ZINC000754227528	700490766	/nfs/dbraw/zinc/49/07/66/700490766.db2.gz	ZFNMQHCAFNPXMS-GFCCVEGCSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@H]1C	ZINC000754227528	700490767	/nfs/dbraw/zinc/49/07/67/700490767.db2.gz	ZFNMQHCAFNPXMS-GFCCVEGCSA-N	1	1	320.393	1.827	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1	ZINC000764903039	700990747	/nfs/dbraw/zinc/99/07/47/700990747.db2.gz	WNXPVFHZXSYDGV-NSHDSACASA-N	1	1	318.333	1.705	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1	ZINC000764903039	700990748	/nfs/dbraw/zinc/99/07/48/700990748.db2.gz	WNXPVFHZXSYDGV-NSHDSACASA-N	1	1	318.333	1.705	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCCN2CCC[N@H+](C)CC2)n1	ZINC000765483510	701015013	/nfs/dbraw/zinc/01/50/13/701015013.db2.gz	SZZSKMYCRVFFDW-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCCN(C)CC2)n1	ZINC000765483510	701015016	/nfs/dbraw/zinc/01/50/16/701015016.db2.gz	SZZSKMYCRVFFDW-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@@H+]2CCCN(C)CC2)n1	ZINC000765483510	701015019	/nfs/dbraw/zinc/01/50/19/701015019.db2.gz	SZZSKMYCRVFFDW-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1nonc1C[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000809744593	701685074	/nfs/dbraw/zinc/68/50/74/701685074.db2.gz	TVIOOFILXUBCDL-VIFPVBQESA-N	1	1	319.321	1.793	20	5		DDBDMO
Nc1ncc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)s1	ZINC000768152860	701160821	/nfs/dbraw/zinc/16/08/21/701160821.db2.gz	QLKZZZOYFFABRL-UHFFFAOYSA-N	1	1	319.390	1.956	20	5		DDBDMO
O=[N+]([O-])c1cc(S(=O)(=O)N[C@@H]2CC[N@@H+](C3CC3)C2)cs1	ZINC000768810761	701205025	/nfs/dbraw/zinc/20/50/25/701205025.db2.gz	MMGXRGIYPOKGPI-MRVPVSSYSA-N	1	1	317.392	1.171	20	5		DDBDMO
O=[N+]([O-])c1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cs1	ZINC000768810761	701205030	/nfs/dbraw/zinc/20/50/30/701205030.db2.gz	MMGXRGIYPOKGPI-MRVPVSSYSA-N	1	1	317.392	1.171	20	5		DDBDMO
O=C(N[C@H](C[NH+]1CCCCC1)c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839689148	701784151	/nfs/dbraw/zinc/78/41/51/701784151.db2.gz	KJRUVWAFVXYWDJ-BZUAXINKSA-N	1	1	317.389	1.995	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCCCCNC(=O)CC1	ZINC000879257697	706631331	/nfs/dbraw/zinc/63/13/31/706631331.db2.gz	RDDSGROJEVLFPO-UHFFFAOYSA-N	1	1	323.397	1.482	20	5		DDBDMO
C[C@H]1CN(Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1	ZINC000840179365	702015751	/nfs/dbraw/zinc/01/57/51/702015751.db2.gz	RBXMSAWBLNSXOK-AWEZNQCLSA-N	1	1	315.377	1.955	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCOC(=O)Cn1cc([N+](=O)[O-])ccc1=O	ZINC000840218222	702032587	/nfs/dbraw/zinc/03/25/87/702032587.db2.gz	CBAKMWCWASWULI-GFCCVEGCSA-N	1	1	323.349	1.174	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000814173773	702490407	/nfs/dbraw/zinc/49/04/07/702490407.db2.gz	QASSBLYOYYLOKV-OVHMKQCGSA-N	1	1	302.330	1.959	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000814173773	702490412	/nfs/dbraw/zinc/49/04/12/702490412.db2.gz	QASSBLYOYYLOKV-OVHMKQCGSA-N	1	1	302.330	1.959	20	5		DDBDMO
CSCC[C@H]([NH3+])c1nc(Cc2ccc([N+](=O)[O-])cn2)no1	ZINC000843191549	702837981	/nfs/dbraw/zinc/83/79/81/702837981.db2.gz	IYFXCWYIIJYUNS-JTQLQIEISA-N	1	1	309.351	1.717	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000843461995	702887323	/nfs/dbraw/zinc/88/73/23/702887323.db2.gz	WNBDNFOSEZCAFG-UHFFFAOYSA-N	1	1	318.236	1.135	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H]1C	ZINC000844018590	702955861	/nfs/dbraw/zinc/95/58/61/702955861.db2.gz	OEYOZHVEKDZSFT-PHIMTYICSA-N	1	1	310.354	1.104	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H]1C	ZINC000844018590	702955863	/nfs/dbraw/zinc/95/58/63/702955863.db2.gz	OEYOZHVEKDZSFT-PHIMTYICSA-N	1	1	310.354	1.104	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H]2CSC[C@@H]2C1	ZINC000879564386	706718873	/nfs/dbraw/zinc/71/88/73/706718873.db2.gz	ZQNKABISTZYTBL-NEPJUHHUSA-N	1	1	309.391	1.441	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000845514099	703166498	/nfs/dbraw/zinc/16/64/98/703166498.db2.gz	DMSFRLPRSOQXKJ-VIFPVBQESA-N	1	1	315.732	1.908	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000845514099	703166500	/nfs/dbraw/zinc/16/65/00/703166500.db2.gz	DMSFRLPRSOQXKJ-VIFPVBQESA-N	1	1	315.732	1.908	20	5		DDBDMO
COc1ccnc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1F	ZINC000849331217	703635982	/nfs/dbraw/zinc/63/59/82/703635982.db2.gz	NHBJMXQVNVFNQA-ZDUSSCGKSA-N	1	1	321.308	1.961	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1	ZINC000852313494	704007239	/nfs/dbraw/zinc/00/72/39/704007239.db2.gz	IHIBQZHFUCGHFS-IUODEOHRSA-N	1	1	317.349	1.242	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534771	704069993	/nfs/dbraw/zinc/06/99/93/704069993.db2.gz	PNXFOWLMAUMQOX-SMDDNHRTSA-N	1	1	307.306	1.971	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534771	704069996	/nfs/dbraw/zinc/06/99/96/704069996.db2.gz	PNXFOWLMAUMQOX-SMDDNHRTSA-N	1	1	307.306	1.971	20	5		DDBDMO
CC(C)(C)n1ncnc1C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819289648	704101632	/nfs/dbraw/zinc/10/16/32/704101632.db2.gz	NAIPURLBDBKQDN-ZDUSSCGKSA-N	1	1	319.365	1.765	20	5		DDBDMO
C[C@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000870789515	704132604	/nfs/dbraw/zinc/13/26/04/704132604.db2.gz	HFZLOLUEBLJUSD-OLZOCXBDSA-N	1	1	324.381	1.988	20	5		DDBDMO
CN(C[C@H]1CCCCO1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870871634	704152051	/nfs/dbraw/zinc/15/20/51/704152051.db2.gz	IXGPRTFMIMCAFM-GDBMZVCRSA-N	1	1	321.377	1.796	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871158048	704234458	/nfs/dbraw/zinc/23/44/58/704234458.db2.gz	LRUDZIDFZQPUOC-UHFFFAOYSA-N	1	1	321.381	1.588	20	5		DDBDMO
Cc1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000853965079	704341298	/nfs/dbraw/zinc/34/12/98/704341298.db2.gz	DLYYIRYQHBVFKB-CQSZACIVSA-N	1	1	305.378	1.939	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000855163131	704471730	/nfs/dbraw/zinc/47/17/30/704471730.db2.gz	SYCVAGYSIKKEFR-KGLIPLIRSA-N	1	1	321.377	1.617	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cn2c(C)ncc2[N+](=O)[O-])[C@@H](C)C1	ZINC000822568764	704976775	/nfs/dbraw/zinc/97/67/75/704976775.db2.gz	HZMHUUJOONQETQ-NSHDSACASA-N	1	1	309.370	1.042	20	5		DDBDMO
CN(C(=O)NCCc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC000893877085	710871164	/nfs/dbraw/zinc/87/11/64/710871164.db2.gz	RXYLAKIAGIKINF-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825098963	705599386	/nfs/dbraw/zinc/59/93/86/705599386.db2.gz	RAHWASLORUWKMO-WFASDCNBSA-N	1	1	321.377	1.476	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825471960	705677347	/nfs/dbraw/zinc/67/73/47/705677347.db2.gz	FVZGOJPTJOZFHC-SWLSCSKDSA-N	1	1	321.377	1.475	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([N+](=O)[O-])n1	ZINC000877316030	706061284	/nfs/dbraw/zinc/06/12/84/706061284.db2.gz	HBEABNBFTSWBIB-GFCCVEGCSA-N	1	1	310.354	1.303	20	5		DDBDMO
CCOC(=O)[C@@H](C)C1C[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000871993206	707272182	/nfs/dbraw/zinc/27/21/82/707272182.db2.gz	MQTQIZYNXVNXQL-XHDPSFHLSA-N	1	1	322.361	1.759	20	5		DDBDMO
CO[C@H]1C[C@@H](C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000878251477	706338981	/nfs/dbraw/zinc/33/89/81/706338981.db2.gz	MZYFDUJSHNFIDQ-SGMGOOAPSA-N	1	1	306.366	1.901	20	5		DDBDMO
CN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000865718307	706504702	/nfs/dbraw/zinc/50/47/02/706504702.db2.gz	XXVAVMNAPLHXSH-ZDUSSCGKSA-N	1	1	321.352	1.972	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000880145948	706891461	/nfs/dbraw/zinc/89/14/61/706891461.db2.gz	SFJFMPQBJHBXKV-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)O)C1	ZINC000880145948	706891463	/nfs/dbraw/zinc/89/14/63/706891463.db2.gz	SFJFMPQBJHBXKV-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[NH+](CC)Cc1cn(C[C@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000881410805	707243877	/nfs/dbraw/zinc/24/38/77/707243877.db2.gz	LVNNOEWBWQRCCG-HNNXBMFYSA-N	1	1	319.365	1.762	20	5		DDBDMO
O=C1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1CC1CC1	ZINC000883403048	707991339	/nfs/dbraw/zinc/99/13/39/707991339.db2.gz	IVRRSDLSZMZCPC-GFCCVEGCSA-N	1	1	307.325	1.834	20	5		DDBDMO
CON1CCC([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000839131964	708028979	/nfs/dbraw/zinc/02/89/79/708028979.db2.gz	SDERXQQMHXIZHO-HNNXBMFYSA-N	1	1	309.366	1.586	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c2ccccc21	ZINC000884548958	708327545	/nfs/dbraw/zinc/32/75/45/708327545.db2.gz	WNVFXQLYNWBHRL-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
COc1cc(NCC[N@@H+](C)CCO)c(Cl)cc1[N+](=O)[O-]	ZINC000884826003	708388878	/nfs/dbraw/zinc/38/88/78/708388878.db2.gz	CKVJKSUNKRMTES-UHFFFAOYSA-N	1	1	303.746	1.593	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]Cc2cnc3n2CCOC3)c(F)c1	ZINC000898271227	708593760	/nfs/dbraw/zinc/59/37/60/708593760.db2.gz	VVUIGOZXRAGRBM-UHFFFAOYSA-N	1	1	306.297	1.750	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H](N2CCOCC2)C1	ZINC000886220302	708717823	/nfs/dbraw/zinc/71/78/23/708717823.db2.gz	GEFRBSDXYDCFIL-CQSZACIVSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](N2CCOCC2)C1	ZINC000886220302	708717824	/nfs/dbraw/zinc/71/78/24/708717824.db2.gz	GEFRBSDXYDCFIL-CQSZACIVSA-N	1	1	306.366	1.286	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000886590858	708784387	/nfs/dbraw/zinc/78/43/87/708784387.db2.gz	FZOCKLBRXKVZFQ-GFCCVEGCSA-N	1	1	308.382	1.736	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000886590858	708784390	/nfs/dbraw/zinc/78/43/90/708784390.db2.gz	FZOCKLBRXKVZFQ-GFCCVEGCSA-N	1	1	308.382	1.736	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000891741798	710280720	/nfs/dbraw/zinc/28/07/20/710280720.db2.gz	UICQHVBPOZOTMI-GFCCVEGCSA-N	1	1	309.370	1.019	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000902425917	710750226	/nfs/dbraw/zinc/75/02/26/710750226.db2.gz	PJRFRINHKONPGF-LLVKDONJSA-N	1	1	318.333	1.787	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000902425917	710750229	/nfs/dbraw/zinc/75/02/29/710750229.db2.gz	PJRFRINHKONPGF-LLVKDONJSA-N	1	1	318.333	1.787	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000902635598	710830595	/nfs/dbraw/zinc/83/05/95/710830595.db2.gz	AWYHMDWWNQMIRW-OLZOCXBDSA-N	1	1	305.338	1.715	20	5		DDBDMO
CCNc1ccc(C(=O)NC[C@@H]2CC[N@H+]2CC)cc1[N+](=O)[O-]	ZINC000893872823	710867604	/nfs/dbraw/zinc/86/76/04/710867604.db2.gz	WMJZUPMFQCTJOO-LBPRGKRZSA-N	1	1	306.366	1.851	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC000893942029	710894671	/nfs/dbraw/zinc/89/46/71/710894671.db2.gz	YQFCSHAPEIVHQU-ZYHUDNBSSA-N	1	1	320.349	1.225	20	5		DDBDMO
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H]1CC[N@H+]1C	ZINC000928560789	713227152	/nfs/dbraw/zinc/22/71/52/713227152.db2.gz	VLOUWVGMLIPRFL-HIFRSBDPSA-N	1	1	305.378	1.984	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@@H]1Cc2c[nH+]cn2C1	ZINC000894997044	711357793	/nfs/dbraw/zinc/35/77/93/711357793.db2.gz	LSVBHURPCGGWGZ-ZCFIWIBFSA-N	1	1	316.243	1.580	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C	ZINC000895737877	711591335	/nfs/dbraw/zinc/59/13/35/711591335.db2.gz	GDCHUZWKTVPIMR-KOLCDFICSA-N	1	1	304.350	1.984	20	5		DDBDMO
Cc1ccc(CNC(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000896219941	711693494	/nfs/dbraw/zinc/69/34/94/711693494.db2.gz	JMEWOKOFZXWPCK-UKRRQHHQSA-N	1	1	318.377	1.749	20	5		DDBDMO
CCO[C@H](C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)CN(C)C	ZINC000905577775	712084150	/nfs/dbraw/zinc/08/41/50/712084150.db2.gz	BOORPHKLJLUQNL-CABCVRRESA-N	1	1	311.382	1.185	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000931627341	714141769	/nfs/dbraw/zinc/14/17/69/714141769.db2.gz	NVLMIROGUDLLCA-CABCVRRESA-N	1	1	321.377	1.393	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934258285	714777482	/nfs/dbraw/zinc/77/74/82/714777482.db2.gz	CMKGNSJLIGXJAX-JKSUJKDBSA-N	1	1	323.368	1.765	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000935479317	715065778	/nfs/dbraw/zinc/06/57/78/715065778.db2.gz	SQXNEUMYGXWSBY-GJZGRUSLSA-N	1	1	303.362	1.907	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000935694701	715118747	/nfs/dbraw/zinc/11/87/47/715118747.db2.gz	ZPIWXMCAEPAHCR-PHIMTYICSA-N	1	1	321.402	1.950	20	5		DDBDMO
CC(C)[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000957550086	715951062	/nfs/dbraw/zinc/95/10/62/715951062.db2.gz	JAVGTRPRNGHDHZ-ZIAGYGMSSA-N	1	1	309.410	1.765	20	5		DDBDMO
Cc1cccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001022061909	734367898	/nfs/dbraw/zinc/36/78/98/734367898.db2.gz	ZJUNEQVMXPERPY-LXTVHRRPSA-N	1	1	303.362	1.397	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3F)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775376	736852774	/nfs/dbraw/zinc/85/27/74/736852774.db2.gz	UBZFKFHAJDHALR-AMVBZWJASA-N	1	1	319.336	1.037	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccccc3F)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775376	736852775	/nfs/dbraw/zinc/85/27/75/736852775.db2.gz	UBZFKFHAJDHALR-AMVBZWJASA-N	1	1	319.336	1.037	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3F)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775376	736852777	/nfs/dbraw/zinc/85/27/77/736852777.db2.gz	UBZFKFHAJDHALR-AMVBZWJASA-N	1	1	319.336	1.037	20	5		DDBDMO
CCOc1cnc(NCC[NH+]2CCSCC2)c([N+](=O)[O-])c1	ZINC001167833033	738957376	/nfs/dbraw/zinc/95/73/76/738957376.db2.gz	VWMSDOLEEMRVNP-UHFFFAOYSA-N	1	1	312.395	1.849	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NCCC[NH+]2CCN(C)CC2)n1	ZINC001161700675	740661986	/nfs/dbraw/zinc/66/19/86/740661986.db2.gz	PAJLYVSICUBWDE-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC001121698904	744859754	/nfs/dbraw/zinc/85/97/54/744859754.db2.gz	LUVJVWAONGESML-SRVKXCTJSA-N	1	1	308.386	1.166	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(CC)CCNc1ncccc1[N+](=O)[O-]	ZINC001106809529	746138685	/nfs/dbraw/zinc/13/86/85/746138685.db2.gz	WVEKPILTOIRYHN-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
COCCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001194622040	746427935	/nfs/dbraw/zinc/42/79/35/746427935.db2.gz	RCAXUQCESAWFDL-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
COCCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001194622040	746427938	/nfs/dbraw/zinc/42/79/38/746427938.db2.gz	RCAXUQCESAWFDL-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3C[C@H](CCO)[C@H](CO)C3)nc2c1	ZINC001198754688	747599779	/nfs/dbraw/zinc/59/97/79/747599779.db2.gz	VLPXWCDZUSVHHR-QWRGUYRKSA-N	1	1	321.333	1.159	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCC(F)(F)F)CC1	ZINC001200472533	748265155	/nfs/dbraw/zinc/26/51/55/748265155.db2.gz	QVNJYHNFOBPPJC-NXEZZACHSA-N	1	1	309.288	1.185	20	5		DDBDMO
[NH3+]Cc1ncn(-c2c(Br)cc(F)cc2[N+](=O)[O-])n1	ZINC001168753264	750357420	/nfs/dbraw/zinc/35/74/20/750357420.db2.gz	ANNYCLKYDCEZPI-UHFFFAOYSA-N	1	1	316.090	1.536	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cnn(C)c21	ZINC001169018951	762199158	/nfs/dbraw/zinc/19/91/58/762199158.db2.gz	FROZHUPOLHAYDY-VHDGCEQUSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CCS1	ZINC001169046743	762204737	/nfs/dbraw/zinc/20/47/37/762204737.db2.gz	MKCKNRQCOBDCHI-SRVKXCTJSA-N	1	1	302.396	1.412	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@@H](N3CCOCC3)[C@@H](F)C2)C1	ZINC001169055291	762210322	/nfs/dbraw/zinc/21/03/22/762210322.db2.gz	PBRGGDSERKFASP-APIJFGDWSA-N	1	1	315.389	1.176	20	5		DDBDMO
Cc1cc(F)ccc1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001020138935	760612917	/nfs/dbraw/zinc/61/29/17/760612917.db2.gz	ISUPNFGMBCKZDE-KBUPBQIOSA-N	1	1	321.352	1.536	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172899761	776914791	/nfs/dbraw/zinc/91/47/91/776914791.db2.gz	PFUIZBCSQWCEOY-AWEZNQCLSA-N	1	1	313.361	1.850	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCN(C)C(=O)C[N@H+](C)C(C)C	ZINC001101657841	777354898	/nfs/dbraw/zinc/35/48/98/777354898.db2.gz	SUVLSADPMSKHSS-UHFFFAOYSA-N	1	1	323.397	1.509	20	5		DDBDMO
CC(=O)N(C)CC[NH+]1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC001102409752	778121676	/nfs/dbraw/zinc/12/16/76/778121676.db2.gz	UBBWYXKVLXMHPJ-UHFFFAOYSA-N	1	1	320.393	1.504	20	5		DDBDMO
Cn1cc([C@H]2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)nn1	ZINC001176887850	778295713	/nfs/dbraw/zinc/29/57/13/778295713.db2.gz	VEPWSPBGWYDVPP-NSHDSACASA-N	1	1	302.338	1.498	20	5		DDBDMO
Cn1cc([C@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)nn1	ZINC001176887850	778295714	/nfs/dbraw/zinc/29/57/14/778295714.db2.gz	VEPWSPBGWYDVPP-NSHDSACASA-N	1	1	302.338	1.498	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCC1(Nc2ccc([N+](=O)[O-])cn2)CC1	ZINC001110227876	779267897	/nfs/dbraw/zinc/26/78/97/779267897.db2.gz	QBPLLFFVLWHJLF-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
CN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@@H+](C)C1	ZINC001119938552	781689461	/nfs/dbraw/zinc/68/94/61/781689461.db2.gz	IWDQMPZJCPLLAZ-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC001122253108	858725893	/nfs/dbraw/zinc/72/58/93/858725893.db2.gz	JPEWXZSXYKDPDM-ABAIWWIYSA-N	1	1	307.350	1.406	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC([N@H+](C)[C@H]3CCOC3)C2)n1	ZINC001158731688	864867526	/nfs/dbraw/zinc/86/75/26/864867526.db2.gz	UJFJTIOBIQDIGN-LBPRGKRZSA-N	1	1	306.366	1.516	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1ccc(-c2ccc(F)c([N+](=O)[O-])c2)nn1	ZINC001159788822	865525436	/nfs/dbraw/zinc/52/54/36/865525436.db2.gz	MPZWYXBMOSXBFE-ZDUSSCGKSA-N	1	1	320.328	1.627	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001332403320	865815373	/nfs/dbraw/zinc/81/53/73/865815373.db2.gz	PVVNHMYDBNDLAQ-IINYFYTJSA-N	1	1	304.350	1.713	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCNc1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001160970630	866232326	/nfs/dbraw/zinc/23/23/26/866232326.db2.gz	MVODAUPGENPINI-SECBINFHSA-N	1	1	300.746	1.778	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@H]1C[N@@H+](CC(C)C)CCO1	ZINC001321169935	867372554	/nfs/dbraw/zinc/37/25/54/867372554.db2.gz	LRWNAVKLDVUEPG-ZDUSSCGKSA-N	1	1	308.382	1.489	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162690168	867739106	/nfs/dbraw/zinc/73/91/06/867739106.db2.gz	TWVKZBSWVMJOPM-CYBMUJFWSA-N	1	1	323.349	1.053	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162690168	867739112	/nfs/dbraw/zinc/73/91/12/867739112.db2.gz	TWVKZBSWVMJOPM-CYBMUJFWSA-N	1	1	323.349	1.053	20	5		DDBDMO
Cc1[nH+]cc2n1CCN(c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-])C2	ZINC001165386079	869559278	/nfs/dbraw/zinc/55/92/78/869559278.db2.gz	XKAXPEANJAQBRJ-UHFFFAOYSA-N	1	1	309.713	1.407	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC001337735037	869610943	/nfs/dbraw/zinc/61/09/43/869610943.db2.gz	RRJVFKFRLHUQKX-GJZGRUSLSA-N	1	1	318.377	1.993	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H](CC(N)=O)C2)c1[N+](=O)[O-]	ZINC001308578352	871514175	/nfs/dbraw/zinc/51/41/75/871514175.db2.gz	NREQHTIYHPCCPM-SNVBAGLBSA-N	1	1	323.349	1.396	20	5		DDBDMO
O=C(NC1CC[NH+](CCCCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001227258284	882938454	/nfs/dbraw/zinc/93/84/54/882938454.db2.gz	MRTUOVHGOBJLLA-CHWSQXEVSA-N	1	1	301.362	1.372	20	5		DDBDMO
CCC(=O)NCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001222189135	880314347	/nfs/dbraw/zinc/31/43/47/880314347.db2.gz	AOIPRGVVTAGAQX-UHFFFAOYSA-N	1	1	309.370	1.067	20	5		DDBDMO
COC(=O)c1c(CO[C@@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC001223292872	880908612	/nfs/dbraw/zinc/90/86/12/880908612.db2.gz	BEYTXJHGYXPQCT-GFCCVEGCSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1cccc(O[C@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-]	ZINC001227897114	883219247	/nfs/dbraw/zinc/21/92/47/883219247.db2.gz	NIKDEKDVTZGSCL-JTQLQIEISA-N	1	1	317.301	1.972	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2[nH]c(=O)nc3cc([N+](=O)[O-])ccc32)C1	ZINC001228242787	883404223	/nfs/dbraw/zinc/40/42/23/883404223.db2.gz	RQCCDTDCWGZGRN-SNVBAGLBSA-N	1	1	304.306	1.717	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(Cl)n3)[C@H]1CC(=O)C2	ZINC001228934449	883736845	/nfs/dbraw/zinc/73/68/45/883736845.db2.gz	PNPULZODFKTVKZ-XROYCOCOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])c(Cl)n3)[C@H]1CC(=O)C2	ZINC001228934449	883736857	/nfs/dbraw/zinc/73/68/57/883736857.db2.gz	PNPULZODFKTVKZ-XROYCOCOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nc4c[nH]cc([N+](=O)[O-])c-4n3)[C@H]1CC(=O)C2	ZINC001230230131	884382279	/nfs/dbraw/zinc/38/22/79/884382279.db2.gz	LJZMMSNYPGQDHQ-HNBZJPLGSA-N	1	1	317.305	1.049	20	5		DDBDMO
C[N@H+]1CC[C@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1	ZINC001234361079	887905328	/nfs/dbraw/zinc/90/53/28/887905328.db2.gz	XGEBWMVCIITNMU-ZDUSSCGKSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@@H]3CC[NH2+]C[C@@H]3F)CC2)cc1	ZINC001246085804	892408275	/nfs/dbraw/zinc/40/82/75/892408275.db2.gz	IZMYRNDSEVCMNT-JKSUJKDBSA-N	1	1	322.384	1.853	20	5		DDBDMO
CCC[N@H+]1CCCC[C@H]1C(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC001252527201	895243832	/nfs/dbraw/zinc/24/38/32/895243832.db2.gz	NJXHKAFZSFNWPL-LBPRGKRZSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(CCNC2=O)C1	ZINC001254553087	896498574	/nfs/dbraw/zinc/49/85/74/896498574.db2.gz	RWVQEIUHSFCQJW-WBMJQRKESA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC(N(C)C2COC2)C1	ZINC001254559175	896502245	/nfs/dbraw/zinc/50/22/45/896502245.db2.gz	JGVVTCJCINSFCH-LBPRGKRZSA-N	1	1	305.378	1.541	20	5		DDBDMO
CC(=O)N[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254600392	896524432	/nfs/dbraw/zinc/52/44/32/896524432.db2.gz	PNCYLLMBLZESCU-ZBFHGGJFSA-N	1	1	303.362	1.663	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCCO1	ZINC001254610916	896530965	/nfs/dbraw/zinc/53/09/65/896530965.db2.gz	MTWOTTIBRBDBGM-GJZGRUSLSA-N	1	1	320.345	1.326	20	5		DDBDMO
CCCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC001265709902	902328698	/nfs/dbraw/zinc/32/86/98/902328698.db2.gz	WHWSLWXLGLKUNK-FOLVSLTJSA-N	1	1	303.362	1.941	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)n1	ZINC000248671350	282098526	/nfs/dbraw/zinc/09/85/26/282098526.db2.gz	QSCYALNLGWISIQ-VXGBXAGGSA-N	1	1	323.397	1.661	20	5		DDBDMO
CC1(C)C[N@H+](CCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCO1	ZINC000278578767	214249936	/nfs/dbraw/zinc/24/99/36/214249936.db2.gz	XXJNAOOFVRLIPM-UHFFFAOYSA-N	1	1	319.365	1.994	20	5		DDBDMO
CC1(C)C[N@@H+](CCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCO1	ZINC000278578767	214249939	/nfs/dbraw/zinc/24/99/39/214249939.db2.gz	XXJNAOOFVRLIPM-UHFFFAOYSA-N	1	1	319.365	1.994	20	5		DDBDMO
C[C@H](O)CC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000451083864	231006341	/nfs/dbraw/zinc/00/63/41/231006341.db2.gz	WWDULYIXZDBMHK-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249548869	282170369	/nfs/dbraw/zinc/17/03/69/282170369.db2.gz	HDCBNFZNMDSCTB-IFUGULHKSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249548869	282170372	/nfs/dbraw/zinc/17/03/72/282170372.db2.gz	HDCBNFZNMDSCTB-IFUGULHKSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452071334	231289731	/nfs/dbraw/zinc/28/97/31/231289731.db2.gz	UMKDNEFYWOJEQQ-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452071334	231289735	/nfs/dbraw/zinc/28/97/35/231289735.db2.gz	UMKDNEFYWOJEQQ-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
CC1(C)CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000614895151	362066976	/nfs/dbraw/zinc/06/69/76/362066976.db2.gz	PFAACIWFMOJYEP-UHFFFAOYSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000294423930	529792777	/nfs/dbraw/zinc/79/27/77/529792777.db2.gz	GATYDGOCHQUQTF-LBPRGKRZSA-N	1	1	319.361	1.626	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000286722005	219129318	/nfs/dbraw/zinc/12/93/18/219129318.db2.gz	BDIBOCNDWIXKTF-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@@H]1[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851886	232112099	/nfs/dbraw/zinc/11/20/99/232112099.db2.gz	QGAUUEZTJRLKKA-QWHCGFSZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCOC1(C)C	ZINC000330851886	232112102	/nfs/dbraw/zinc/11/21/02/232112102.db2.gz	QGAUUEZTJRLKKA-QWHCGFSZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H](C(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CC[NH+](C)CC1	ZINC000331013449	232339738	/nfs/dbraw/zinc/33/97/38/232339738.db2.gz	KNHPSMRBQBVBHC-SNVBAGLBSA-N	1	1	310.329	1.308	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000272635808	210038740	/nfs/dbraw/zinc/03/87/40/210038740.db2.gz	NRQJBUXITCRVNH-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
CNC(=O)OC[C@@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000286953363	219241738	/nfs/dbraw/zinc/24/17/38/219241738.db2.gz	MRQHCLLDCDXYES-NSHDSACASA-N	1	1	311.342	1.002	20	5		DDBDMO
O=C(Nc1ccc([N+](=O)[O-])cc1)N1CC(C[NH+]2CCOCC2)C1	ZINC000601227392	358455903	/nfs/dbraw/zinc/45/59/03/358455903.db2.gz	ZNDJLNWJPOXRLI-UHFFFAOYSA-N	1	1	320.349	1.391	20	5		DDBDMO
Cc1[nH+]cn(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c1C	ZINC000171993277	198021969	/nfs/dbraw/zinc/02/19/69/198021969.db2.gz	NEFLGTQTGYRWBM-UHFFFAOYSA-N	1	1	300.318	1.997	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCO[C@H](C)C1	ZINC000026342651	352207782	/nfs/dbraw/zinc/20/77/82/352207782.db2.gz	RORUIZWVOSQKBP-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C)C1	ZINC000026342651	352207785	/nfs/dbraw/zinc/20/77/85/352207785.db2.gz	RORUIZWVOSQKBP-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000046858788	352465132	/nfs/dbraw/zinc/46/51/32/352465132.db2.gz	YZUAWMVPFIWOMA-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000052875436	352629833	/nfs/dbraw/zinc/62/98/33/352629833.db2.gz	NDPPWKFJSRTWAH-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)N1CCCC1	ZINC000065209127	352948950	/nfs/dbraw/zinc/94/89/50/352948950.db2.gz	KXPMGKLQSFNJHD-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)N1CCCC1	ZINC000065209127	352948951	/nfs/dbraw/zinc/94/89/51/352948951.db2.gz	KXPMGKLQSFNJHD-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
COc1ccc(OCC[N@H+](C)CC(=O)NC2CC2)c([N+](=O)[O-])c1	ZINC000173501306	198221699	/nfs/dbraw/zinc/22/16/99/198221699.db2.gz	XEFHDRWMHRCTKU-UHFFFAOYSA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CC(=O)NC2CC2)c([N+](=O)[O-])c1	ZINC000173501306	198221700	/nfs/dbraw/zinc/22/17/00/198221700.db2.gz	XEFHDRWMHRCTKU-UHFFFAOYSA-N	1	1	323.349	1.193	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000067292732	353043014	/nfs/dbraw/zinc/04/30/14/353043014.db2.gz	RVHYUOHTBHMKPO-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000074105049	353293021	/nfs/dbraw/zinc/29/30/21/353293021.db2.gz	LGOXGBKTHOBZIN-LBPRGKRZSA-N	1	1	307.350	1.435	20	5		DDBDMO
C[N@@H+](CCc1ccc(F)cc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174749003	198379664	/nfs/dbraw/zinc/37/96/64/198379664.db2.gz	JHDNCOZFFNPRIG-HNNXBMFYSA-N	1	1	322.340	1.466	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000174810654	198388322	/nfs/dbraw/zinc/38/83/22/198388322.db2.gz	XYPKGJFPVWWVOV-UHFFFAOYSA-N	1	1	320.349	1.811	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2[nH]nc(C)c2[N+](=O)[O-])C1	ZINC000081363239	353666749	/nfs/dbraw/zinc/66/67/49/353666749.db2.gz	RASBCSCPTOVDFO-NSHDSACASA-N	1	1	309.370	1.430	20	5		DDBDMO
CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1	ZINC000081363239	353666753	/nfs/dbraw/zinc/66/67/53/353666753.db2.gz	RASBCSCPTOVDFO-NSHDSACASA-N	1	1	309.370	1.430	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1	ZINC000081363239	353666757	/nfs/dbraw/zinc/66/67/57/353666757.db2.gz	RASBCSCPTOVDFO-NSHDSACASA-N	1	1	309.370	1.430	20	5		DDBDMO
CC[N@@H+](C)CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000091461326	353827169	/nfs/dbraw/zinc/82/71/69/353827169.db2.gz	RWWGLYIIMMGUSA-UHFFFAOYSA-N	1	1	306.366	1.851	20	5		DDBDMO
Cc1[nH+]ccn1-c1cncc(NCCn2cc([N+](=O)[O-])cn2)n1	ZINC000092923315	353876515	/nfs/dbraw/zinc/87/65/15/353876515.db2.gz	PZAMDBRUVXUFSG-UHFFFAOYSA-N	1	1	314.309	1.188	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000156826823	354222763	/nfs/dbraw/zinc/22/27/63/354222763.db2.gz	SHGWGBVPXFSMOK-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000156826823	354222768	/nfs/dbraw/zinc/22/27/68/354222768.db2.gz	SHGWGBVPXFSMOK-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
COc1cccc(N2CC[C@@H]3OCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000585781960	354841457	/nfs/dbraw/zinc/84/14/57/354841457.db2.gz	GTKLYKWYLNOSMY-OLZOCXBDSA-N	1	1	307.350	1.513	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000588158183	354906545	/nfs/dbraw/zinc/90/65/45/354906545.db2.gz	KPMBOFJAQDMCSL-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(=O)OC)C2)c1	ZINC000589496337	354995713	/nfs/dbraw/zinc/99/57/13/354995713.db2.gz	QCLUDLDQQVFFLE-LLVKDONJSA-N	1	1	322.317	1.376	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C(=O)OC)C2)c1	ZINC000589496337	354995716	/nfs/dbraw/zinc/99/57/16/354995716.db2.gz	QCLUDLDQQVFFLE-LLVKDONJSA-N	1	1	322.317	1.376	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2CCCOC2)c1	ZINC000589516671	354998627	/nfs/dbraw/zinc/99/86/27/354998627.db2.gz	OOHQXABZDHWACI-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2CCCOC2)c1	ZINC000589516671	354998629	/nfs/dbraw/zinc/99/86/29/354998629.db2.gz	OOHQXABZDHWACI-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](CC(N)=O)C2)c1	ZINC000589517081	354998986	/nfs/dbraw/zinc/99/89/86/354998986.db2.gz	TZQFXYPMBVDGCI-JTQLQIEISA-N	1	1	321.333	1.079	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000591147452	355254747	/nfs/dbraw/zinc/25/47/47/355254747.db2.gz	ONHWGTPLHZZWPF-UHFFFAOYSA-N	1	1	306.301	1.189	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000593061325	355784157	/nfs/dbraw/zinc/78/41/57/355784157.db2.gz	IOOPWKWXSNSPQH-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CO1	ZINC000593061325	355784159	/nfs/dbraw/zinc/78/41/59/355784159.db2.gz	IOOPWKWXSNSPQH-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000593071884	355787415	/nfs/dbraw/zinc/78/74/15/355787415.db2.gz	VMYXVCQUPFIUKS-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(=O)c1cc(N2CC([N@@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000593502959	355905650	/nfs/dbraw/zinc/90/56/50/355905650.db2.gz	GHGOOLPWBFVJGM-CYBMUJFWSA-N	1	1	305.334	1.053	20	5		DDBDMO
CC(=O)c1cc(N2CC([N@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000593502959	355905652	/nfs/dbraw/zinc/90/56/52/355905652.db2.gz	GHGOOLPWBFVJGM-CYBMUJFWSA-N	1	1	305.334	1.053	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C[C@H]1C	ZINC000593555492	355924054	/nfs/dbraw/zinc/92/40/54/355924054.db2.gz	BKCJPFOQCNGHNB-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H](C[NH3+])[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000601327567	358499464	/nfs/dbraw/zinc/49/94/64/358499464.db2.gz	WUYMWVZXQWPGRZ-VXGBXAGGSA-N	1	1	309.366	1.509	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C[C@@H](C)O)C1CC1	ZINC000594065473	356103314	/nfs/dbraw/zinc/10/33/14/356103314.db2.gz	PYAAJNFXOZPKHJ-LLVKDONJSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C[C@@H](C)O)C1CC1	ZINC000594065473	356103317	/nfs/dbraw/zinc/10/33/17/356103317.db2.gz	PYAAJNFXOZPKHJ-LLVKDONJSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](C(=O)NCC3CC3)C2)c1[N+](=O)[O-]	ZINC000595289533	356435004	/nfs/dbraw/zinc/43/50/04/356435004.db2.gz	DWAPIZBRRBSCBO-GFCCVEGCSA-N	1	1	322.365	1.629	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](C(=O)NCC3CC3)C2)c1[N+](=O)[O-]	ZINC000595289533	356435008	/nfs/dbraw/zinc/43/50/08/356435008.db2.gz	DWAPIZBRRBSCBO-GFCCVEGCSA-N	1	1	322.365	1.629	20	5		DDBDMO
O=C1C[C@H](C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000595521965	356531890	/nfs/dbraw/zinc/53/18/90/356531890.db2.gz	HHNSATOMPDZWQN-GXTWGEPZSA-N	1	1	303.362	1.910	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)c(F)c1	ZINC000595608463	356575161	/nfs/dbraw/zinc/57/51/61/356575161.db2.gz	QOCXKCFXVNPXGE-NSHDSACASA-N	1	1	305.313	1.848	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000595744989	356632411	/nfs/dbraw/zinc/63/24/11/356632411.db2.gz	XPLWGVKCKBYEPX-UKRRQHHQSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595767445	356644270	/nfs/dbraw/zinc/64/42/70/356644270.db2.gz	XKZTXERIGOUDCY-JHJVBQTASA-N	1	1	310.350	1.180	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595765911	356644352	/nfs/dbraw/zinc/64/43/52/356644352.db2.gz	LMOMSJMVDSRSRK-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595765911	356644353	/nfs/dbraw/zinc/64/43/53/356644353.db2.gz	LMOMSJMVDSRSRK-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC2(COC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000595835144	356671443	/nfs/dbraw/zinc/67/14/43/356671443.db2.gz	RWBFNNZZHYUGFS-UHFFFAOYSA-N	1	1	305.334	1.280	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC2(COC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000595835144	356671446	/nfs/dbraw/zinc/67/14/46/356671446.db2.gz	RWBFNNZZHYUGFS-UHFFFAOYSA-N	1	1	305.334	1.280	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000595836997	356672104	/nfs/dbraw/zinc/67/21/04/356672104.db2.gz	ZQIPEGFZQVMEAB-MGPQQGTHSA-N	1	1	322.361	1.303	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000595826499	356666094	/nfs/dbraw/zinc/66/60/94/356666094.db2.gz	ABFDGELDKBEDBR-OLZOCXBDSA-N	1	1	322.361	1.951	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CCC([N@@H+]2CC[C@H](O)C2)CC1	ZINC000595862391	356682254	/nfs/dbraw/zinc/68/22/54/356682254.db2.gz	BISFALALHOIQMB-HNNXBMFYSA-N	1	1	321.377	1.331	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000595862391	356682257	/nfs/dbraw/zinc/68/22/57/356682257.db2.gz	BISFALALHOIQMB-HNNXBMFYSA-N	1	1	321.377	1.331	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)c(F)c1	ZINC000595864800	356683116	/nfs/dbraw/zinc/68/31/16/356683116.db2.gz	CTHSHAMWLGUZEJ-OAHLLOKOSA-N	1	1	323.368	1.765	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596117155	356779937	/nfs/dbraw/zinc/77/99/37/356779937.db2.gz	XDESJUKSJYHIHW-GFCCVEGCSA-N	1	1	322.365	1.216	20	5		DDBDMO
NC(=O)c1cc(N2CCC(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000596103642	356772722	/nfs/dbraw/zinc/77/27/22/356772722.db2.gz	XFQGMZJEPGVBGY-UHFFFAOYSA-N	1	1	315.333	1.801	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596537901	356910225	/nfs/dbraw/zinc/91/02/25/356910225.db2.gz	JLHXGRCLCIBOHX-CYBMUJFWSA-N	1	1	321.377	1.639	20	5		DDBDMO
CCN(C(=O)Cn1cc([N+](=O)[O-])nc1C)[C@H]1CC[N@@H+](CC)C1	ZINC000598043209	357440870	/nfs/dbraw/zinc/44/08/70/357440870.db2.gz	RYFBXXWLUQISPZ-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000598342051	357543911	/nfs/dbraw/zinc/54/39/11/357543911.db2.gz	CNGAUUSPDFLLBU-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000598341579	357543995	/nfs/dbraw/zinc/54/39/95/357543995.db2.gz	CVABFNGSDJPNQT-GFCCVEGCSA-N	1	1	306.366	1.607	20	5		DDBDMO
Cn1c(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000598562523	357633549	/nfs/dbraw/zinc/63/35/49/357633549.db2.gz	VRYZBSYCVJXJEH-ZDUSSCGKSA-N	1	1	320.393	1.785	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](C)C1(F)F	ZINC000599513106	357960766	/nfs/dbraw/zinc/96/07/66/357960766.db2.gz	RAFFLGZMKUZIBH-PHIMTYICSA-N	1	1	315.320	1.980	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1C[C@@H](O)C1	ZINC000599671893	358018491	/nfs/dbraw/zinc/01/84/91/358018491.db2.gz	KIZSHVWGALSCCO-KWCYVHTRSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1cc(C[NH2+][C@@H]2COC[C@H]2OC)c([N+](=O)[O-])cc1F	ZINC000565479094	304070814	/nfs/dbraw/zinc/07/08/14/304070814.db2.gz	IRESZQBBHYBZLG-ZWNOBZJWSA-N	1	1	300.286	1.246	20	5		DDBDMO
C[C@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@H+](C)CCO1	ZINC000601130823	358415618	/nfs/dbraw/zinc/41/56/18/358415618.db2.gz	CHCBZVWZOUYXHE-ZBEGNZNMSA-N	1	1	316.361	1.696	20	5		DDBDMO
C[C@H](Nc1ccnc2ccc([N+](=O)[O-])cc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000601130823	358415623	/nfs/dbraw/zinc/41/56/23/358415623.db2.gz	CHCBZVWZOUYXHE-ZBEGNZNMSA-N	1	1	316.361	1.696	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601144198	358419550	/nfs/dbraw/zinc/41/95/50/358419550.db2.gz	QGZVANUDKBIZLS-UHFFFAOYSA-N	1	1	321.303	1.878	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ncnc4sc([N+](=O)[O-])cc43)C[C@@H]2C1	ZINC000601184126	358437779	/nfs/dbraw/zinc/43/77/79/358437779.db2.gz	HSQYJGRNRUWTKW-ZJUUUORDSA-N	1	1	319.390	1.987	20	5		DDBDMO
CC[N@@H+](CC(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000601782221	358693023	/nfs/dbraw/zinc/69/30/23/358693023.db2.gz	XLHWYSVBWFSDBF-INIZCTEOSA-N	1	1	321.377	1.403	20	5		DDBDMO
O=[N+]([O-])c1nccn1C[C@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000601961867	358754489	/nfs/dbraw/zinc/75/44/89/358754489.db2.gz	AYGQTNSNRPSYHX-CQSZACIVSA-N	1	1	302.334	1.211	20	5		DDBDMO
CC(C)(F)C[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000601968970	358758437	/nfs/dbraw/zinc/75/84/37/358758437.db2.gz	PTRKIICTKXSQOB-UHFFFAOYSA-N	1	1	304.343	1.706	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000602045168	358789368	/nfs/dbraw/zinc/78/93/68/358789368.db2.gz	KYOVQFFXBJXILI-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
CCCN1CCC([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])CC1	ZINC000602777681	359183518	/nfs/dbraw/zinc/18/35/18/359183518.db2.gz	KBTWSZGYZSZRBS-UHFFFAOYSA-N	1	1	309.414	1.906	20	5		DDBDMO
CCCN1CCC([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])CC1	ZINC000602777681	359183519	/nfs/dbraw/zinc/18/35/19/359183519.db2.gz	KBTWSZGYZSZRBS-UHFFFAOYSA-N	1	1	309.414	1.906	20	5		DDBDMO
O=c1ccc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)c[nH]1	ZINC000602688227	359126301	/nfs/dbraw/zinc/12/63/01/359126301.db2.gz	PLXCVXQEGPHDAU-UHFFFAOYSA-N	1	1	315.333	1.413	20	5		DDBDMO
Cn1cc([C@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C(C)(C)C)cn1	ZINC000602806015	359203944	/nfs/dbraw/zinc/20/39/44/359203944.db2.gz	RKFCKJABCGFTSC-LBPRGKRZSA-N	1	1	306.370	1.939	20	5		DDBDMO
COC[C@@](C)(CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000602933119	359303042	/nfs/dbraw/zinc/30/30/42/359303042.db2.gz	RTMCSMKWNGUMQJ-OAHLLOKOSA-N	1	1	312.366	1.869	20	5		DDBDMO
C[N@@H+](Cc1ccns1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000602879629	359264305	/nfs/dbraw/zinc/26/43/05/359264305.db2.gz	IVIQWDXGYSRGKC-LBPRGKRZSA-N	1	1	323.374	1.923	20	5		DDBDMO
C[N@H+](Cc1ccns1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000602879629	359264311	/nfs/dbraw/zinc/26/43/11/359264311.db2.gz	IVIQWDXGYSRGKC-LBPRGKRZSA-N	1	1	323.374	1.923	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1C[C@@H](C)[N@@H+](C)[C@@H](C)C1	ZINC000602960009	359322286	/nfs/dbraw/zinc/32/22/86/359322286.db2.gz	HDBUZIJSNYTPIC-PHIMTYICSA-N	1	1	307.354	1.276	20	5		DDBDMO
C[N@H+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000603430822	359635127	/nfs/dbraw/zinc/63/51/27/359635127.db2.gz	DAQQBRGCXSBQDV-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000187200713	200076668	/nfs/dbraw/zinc/07/66/68/200076668.db2.gz	DQHOIPGYAIYAHO-UHFFFAOYSA-N	1	1	319.321	1.363	20	5		DDBDMO
COc1ccc(CNC(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604290928	359733110	/nfs/dbraw/zinc/73/31/10/359733110.db2.gz	QWKPTCCSHRUJMQ-GFCCVEGCSA-N	1	1	322.365	1.497	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000604533252	359762044	/nfs/dbraw/zinc/76/20/44/359762044.db2.gz	DYNCJTDNKHXWPX-ZDUSSCGKSA-N	1	1	321.377	1.820	20	5		DDBDMO
CO[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1C	ZINC000189326647	200382294	/nfs/dbraw/zinc/38/22/94/200382294.db2.gz	HTRFWMIFWMOBLC-XEZPLFJOSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cc1ccc(C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1	ZINC000610367740	360422819	/nfs/dbraw/zinc/42/28/19/360422819.db2.gz	OAWBGNSKJDUQKC-CQSZACIVSA-N	1	1	320.349	1.718	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762768	360531134	/nfs/dbraw/zinc/53/11/34/360531134.db2.gz	UDRNEYHHSZMTFO-JSGCOSHPSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CCC[C@@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762768	360531137	/nfs/dbraw/zinc/53/11/37/360531137.db2.gz	UDRNEYHHSZMTFO-JSGCOSHPSA-N	1	1	301.346	1.968	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000610900771	360567751	/nfs/dbraw/zinc/56/77/51/360567751.db2.gz	KOCOVPYYJXNYGU-ZANVPECISA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000610900771	360567754	/nfs/dbraw/zinc/56/77/54/360567754.db2.gz	KOCOVPYYJXNYGU-ZANVPECISA-N	1	1	311.313	1.183	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Nc2ccncc2[N+](=O)[O-])C[C@@H]1C	ZINC000359027175	299311011	/nfs/dbraw/zinc/31/10/11/299311011.db2.gz	NAHPDXIYIUGYBF-WDEREUQCSA-N	1	1	307.354	1.358	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000611513695	360742975	/nfs/dbraw/zinc/74/29/75/360742975.db2.gz	WGFKQGQMDFWOSL-SNVBAGLBSA-N	1	1	307.306	1.148	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000281287261	216211594	/nfs/dbraw/zinc/21/15/94/216211594.db2.gz	GTLNBITZTVPLCQ-LSDHHAIUSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000281291883	216215865	/nfs/dbraw/zinc/21/58/65/216215865.db2.gz	GXTOBPPXXVPZPQ-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@H](CCO)C1	ZINC000612070176	360909181	/nfs/dbraw/zinc/90/91/81/360909181.db2.gz	DAYJUXDTKYMMGY-ZIAGYGMSSA-N	1	1	324.377	1.429	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CCC[N@H+](C)C2)c1	ZINC000619583490	364071890	/nfs/dbraw/zinc/07/18/90/364071890.db2.gz	PFABUTWZUHWVCO-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccon1	ZINC000349245486	283881823	/nfs/dbraw/zinc/88/18/23/283881823.db2.gz	RLKKTMFBUXWDFM-ZYHUDNBSSA-N	1	1	307.306	1.673	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000264662365	204063334	/nfs/dbraw/zinc/06/33/34/204063334.db2.gz	DSOKWQDOWXFTCN-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
COCCCNC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282502083	217045210	/nfs/dbraw/zinc/04/52/10/217045210.db2.gz	QZTDICKPJQUYRV-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
COCCCNC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282502083	217045215	/nfs/dbraw/zinc/04/52/15/217045215.db2.gz	QZTDICKPJQUYRV-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCn1cc([N+](=O)[O-])cn1	ZINC000282506565	217048341	/nfs/dbraw/zinc/04/83/41/217048341.db2.gz	RLSNGCJVUBKSRO-UHFFFAOYSA-N	1	1	319.321	1.874	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000266210212	205185664	/nfs/dbraw/zinc/18/56/64/205185664.db2.gz	XSVFDSGCWVYEHG-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
C[N@H+](Cc1ccc(Cl)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266381962	205304423	/nfs/dbraw/zinc/30/44/23/205304423.db2.gz	AXAXNQDQOGCESE-CQSZACIVSA-N	1	1	324.768	1.938	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C(C)C)CC2)c(N)c([N+](=O)[O-])c1	ZINC000104842450	194046056	/nfs/dbraw/zinc/04/60/56/194046056.db2.gz	IYKJAJBRUVUBGX-UHFFFAOYSA-N	1	1	306.366	1.652	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCO[C@H]2CC[N@H+](C)C[C@H]21	ZINC000284715644	218147237	/nfs/dbraw/zinc/14/72/37/218147237.db2.gz	ULZRFXDBGTWFQS-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@@H]1CCNC(=O)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000284739771	218155402	/nfs/dbraw/zinc/15/54/02/218155402.db2.gz	KUCWSWWEFRROMB-PELKAZGASA-N	1	1	308.294	1.117	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000076491652	207352190	/nfs/dbraw/zinc/35/21/90/207352190.db2.gz	YIPSKNDDUFMRJG-OCCSQVGLSA-N	1	1	323.397	1.370	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCOCC2CCC2)CC1	ZINC000419280342	285165934	/nfs/dbraw/zinc/16/59/34/285165934.db2.gz	KABDVEDJHJOGDB-UHFFFAOYSA-N	1	1	320.393	1.929	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCC[C@@H]1O	ZINC000352660155	285204649	/nfs/dbraw/zinc/20/46/49/285204649.db2.gz	MUFZGFYNYZMIQM-GJZGRUSLSA-N	1	1	319.361	1.329	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000154863075	197000118	/nfs/dbraw/zinc/00/01/18/197000118.db2.gz	MPIRBIBVYGPGJR-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)C1	ZINC000352914893	285384476	/nfs/dbraw/zinc/38/44/76/285384476.db2.gz	MSIUHKSGNYGFSV-SNVBAGLBSA-N	1	1	304.306	1.363	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000451539476	533414339	/nfs/dbraw/zinc/41/43/39/533414339.db2.gz	FISFUGJRPFNBHY-JGGQBBKZSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000569589578	304366833	/nfs/dbraw/zinc/36/68/33/304366833.db2.gz	LOIORXISWQQANY-UHFFFAOYSA-N	1	1	320.393	1.881	20	5		DDBDMO
CCN(C)C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000266578623	407566657	/nfs/dbraw/zinc/56/66/57/407566657.db2.gz	GWZRUFYGQQJVBM-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1	ZINC000078596878	407035716	/nfs/dbraw/zinc/03/57/16/407035716.db2.gz	JOUORLZKNRYPCB-UHFFFAOYSA-N	1	1	320.393	1.829	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000087259161	407118635	/nfs/dbraw/zinc/11/86/35/407118635.db2.gz	GFWAQPZLQXVOQL-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1	ZINC000051556033	407141591	/nfs/dbraw/zinc/14/15/91/407141591.db2.gz	AAESGRFUUFXDJT-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000102486960	407323514	/nfs/dbraw/zinc/32/35/14/407323514.db2.gz	WQHLALCCZDXHMF-NSHDSACASA-N	1	1	309.370	1.127	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000067292762	407270499	/nfs/dbraw/zinc/27/04/99/407270499.db2.gz	UIIVEMZYTREJQV-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000124657338	407365965	/nfs/dbraw/zinc/36/59/65/407365965.db2.gz	QQFZDHFRQCDQDG-LLVKDONJSA-N	1	1	307.354	1.795	20	5		DDBDMO
CCOCC[N@H+](CC)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000107678709	407378374	/nfs/dbraw/zinc/37/83/74/407378374.db2.gz	WEXSGRDEHYXJNZ-UHFFFAOYSA-N	1	1	321.377	1.842	20	5		DDBDMO
CCOCC[N@@H+](CC)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000107678709	407378375	/nfs/dbraw/zinc/37/83/75/407378375.db2.gz	WEXSGRDEHYXJNZ-UHFFFAOYSA-N	1	1	321.377	1.842	20	5		DDBDMO
COCC1=CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000185824215	407511628	/nfs/dbraw/zinc/51/16/28/407511628.db2.gz	IXVRDDLIJRUQQO-HNNXBMFYSA-N	1	1	322.361	1.613	20	5		DDBDMO
CC[N@H+](Cc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266511433	407540979	/nfs/dbraw/zinc/54/09/79/407540979.db2.gz	YIOXSEUTBXAFPN-HNNXBMFYSA-N	1	1	304.350	1.674	20	5		DDBDMO
C[NH+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCC[N@H+](C)C1	ZINC000178863948	407629461	/nfs/dbraw/zinc/62/94/61/407629461.db2.gz	DEWIOKVQXNOGIW-BBRMVZONSA-N	1	1	307.394	1.902	20	5		DDBDMO
C[NH+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H]1CCC[N@@H+](C)C1	ZINC000178863948	407629466	/nfs/dbraw/zinc/62/94/66/407629466.db2.gz	DEWIOKVQXNOGIW-BBRMVZONSA-N	1	1	307.394	1.902	20	5		DDBDMO
CC[N@@H+](CCCO)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000266873378	407656343	/nfs/dbraw/zinc/65/63/43/407656343.db2.gz	RMHMYGHVJGJZHB-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)Cn1cccn1	ZINC000171637171	407730862	/nfs/dbraw/zinc/73/08/62/407730862.db2.gz	NDWXUFDFDTWYCH-CYBMUJFWSA-N	1	1	324.768	1.938	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)Cn1cccn1	ZINC000171637171	407730868	/nfs/dbraw/zinc/73/08/68/407730868.db2.gz	NDWXUFDFDTWYCH-CYBMUJFWSA-N	1	1	324.768	1.938	20	5		DDBDMO
CC(C)C[C@](C)(C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236707152	407758271	/nfs/dbraw/zinc/75/82/71/407758271.db2.gz	MUBRYTPUTQFSHN-OAHLLOKOSA-N	1	1	319.365	1.964	20	5		DDBDMO
C[C@@H](CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1	ZINC000186935556	407799375	/nfs/dbraw/zinc/79/93/75/407799375.db2.gz	OYBWMSRIWBFEHZ-MNOVXSKESA-N	1	1	322.365	1.546	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H]([C@@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000272499378	407949368	/nfs/dbraw/zinc/94/93/68/407949368.db2.gz	DLLOUYOSBCQEPA-YNEHKIRRSA-N	1	1	321.377	1.933	20	5		DDBDMO
CS[C@@H]1CCCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000134616584	407916276	/nfs/dbraw/zinc/91/62/76/407916276.db2.gz	OZUOWPPISNWEDN-QWHCGFSZSA-N	1	1	314.411	1.370	20	5		DDBDMO
CC(C)(C)[NH2+]CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000153854962	407917112	/nfs/dbraw/zinc/91/71/12/407917112.db2.gz	GVNXGWXEXGUUNL-UHFFFAOYSA-N	1	1	305.338	1.589	20	5		DDBDMO
C[N@@H+](CCOCc1ccccc1)CCn1cc([N+](=O)[O-])cn1	ZINC000154608531	408060122	/nfs/dbraw/zinc/06/01/22/408060122.db2.gz	NDXFWMKDKVNDAV-UHFFFAOYSA-N	1	1	304.350	1.940	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000189665654	408073228	/nfs/dbraw/zinc/07/32/28/408073228.db2.gz	WVXCYPYYHCCJSO-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[NH+](C[C@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000189722183	408090511	/nfs/dbraw/zinc/09/05/11/408090511.db2.gz	ZPDDVQYTDYNISJ-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
CC(C)(C)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1O	ZINC000273244439	408123239	/nfs/dbraw/zinc/12/32/39/408123239.db2.gz	GERNIQHYFXWIGT-ZIAGYGMSSA-N	1	1	323.393	1.485	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000156333724	408251708	/nfs/dbraw/zinc/25/17/08/408251708.db2.gz	FKOKSKWIAHDQNR-AWEZNQCLSA-N	1	1	321.377	1.774	20	5		DDBDMO
Cc1n[nH]cc1C[NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000273491880	408219989	/nfs/dbraw/zinc/21/99/89/408219989.db2.gz	NMBQNHYHUOZNQD-UHFFFAOYSA-N	1	1	324.362	1.190	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1CO	ZINC000190371945	408231030	/nfs/dbraw/zinc/23/10/30/408231030.db2.gz	JUXRGGWZYHVNBA-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000269322685	408268682	/nfs/dbraw/zinc/26/86/82/408268682.db2.gz	BTBHBPLJDJFSNT-SECBINFHSA-N	1	1	309.370	1.654	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1F)CCn1ccc([N+](=O)[O-])n1	ZINC000176198801	408306140	/nfs/dbraw/zinc/30/61/40/408306140.db2.gz	DFFGIKNIKZROJD-UHFFFAOYSA-N	1	1	308.313	1.941	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)Nc3ccncc3[N+](=O)[O-])CC[C@@H]21	ZINC000183612290	408455063	/nfs/dbraw/zinc/45/50/63/408455063.db2.gz	SAYDBMBTINCZTD-AAEUAGOBSA-N	1	1	319.365	1.938	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177121121	408525515	/nfs/dbraw/zinc/52/55/15/408525515.db2.gz	UMKKDXRQWQXLLT-VHSXEESVSA-N	1	1	304.350	1.532	20	5		DDBDMO
COc1cc(C[NH2+]C[C@](C)(O)C(F)(F)F)c([N+](=O)[O-])cc1O	ZINC000270566143	408581855	/nfs/dbraw/zinc/58/18/55/408581855.db2.gz	RSPHULVCQSUPCH-NSHDSACASA-N	1	1	324.255	1.712	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000265270501	408600226	/nfs/dbraw/zinc/60/02/26/408600226.db2.gz	GLKIWLCSIADWGC-CYBMUJFWSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1C1CC1	ZINC000184486866	408627252	/nfs/dbraw/zinc/62/72/52/408627252.db2.gz	NHFFPKODVWPKTA-ZJUUUORDSA-N	1	1	304.350	1.532	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000192792426	408649354	/nfs/dbraw/zinc/64/93/54/408649354.db2.gz	YKVWBMOXBAESOJ-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000192792426	408649359	/nfs/dbraw/zinc/64/93/59/408649359.db2.gz	YKVWBMOXBAESOJ-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000192792426	408649364	/nfs/dbraw/zinc/64/93/64/408649364.db2.gz	YKVWBMOXBAESOJ-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000270882013	408724817	/nfs/dbraw/zinc/72/48/17/408724817.db2.gz	KGILFXLFFMUKSD-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000270882013	408724822	/nfs/dbraw/zinc/72/48/22/408724822.db2.gz	KGILFXLFFMUKSD-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCOC1	ZINC000178343338	408808316	/nfs/dbraw/zinc/80/83/16/408808316.db2.gz	LSBBIXZBEFWHTH-OCCSQVGLSA-N	1	1	310.350	1.303	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000249699165	408756545	/nfs/dbraw/zinc/75/65/45/408756545.db2.gz	WSMVRVBBLCIGSJ-UHFFFAOYSA-N	1	1	303.322	1.249	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(OC[C@H](O)C[N@@H+](C)C2CC2)c1	ZINC000290780819	408830766	/nfs/dbraw/zinc/83/07/66/408830766.db2.gz	MXICEMYAPLZDIB-GFCCVEGCSA-N	1	1	324.333	1.215	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@@H]2C1	ZINC000285826303	408872284	/nfs/dbraw/zinc/87/22/84/408872284.db2.gz	PDGPJDBCRMDJGP-ZJUUUORDSA-N	1	1	311.363	1.201	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@@H]2C1	ZINC000285826303	408872287	/nfs/dbraw/zinc/87/22/87/408872287.db2.gz	PDGPJDBCRMDJGP-ZJUUUORDSA-N	1	1	311.363	1.201	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000190667911	163151689	/nfs/dbraw/zinc/15/16/89/163151689.db2.gz	BWNJPGVKWPCEKO-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[C@H](C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000192464648	163223564	/nfs/dbraw/zinc/22/35/64/163223564.db2.gz	OLQVQBQVYJPGRG-SDDRHHMPSA-N	1	1	321.352	1.857	20	5		DDBDMO
C[N@H+]1C[C@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000193636009	163261105	/nfs/dbraw/zinc/26/11/05/163261105.db2.gz	KHJPYDFBUZTWHT-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000193636009	163261107	/nfs/dbraw/zinc/26/11/07/163261107.db2.gz	KHJPYDFBUZTWHT-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
CN1C[C@@H]2C[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193636009	163261110	/nfs/dbraw/zinc/26/11/10/163261110.db2.gz	KHJPYDFBUZTWHT-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
CN1C[C@@H]2C[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193636009	163261112	/nfs/dbraw/zinc/26/11/12/163261112.db2.gz	KHJPYDFBUZTWHT-BETUJISGSA-N	1	1	318.377	1.417	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000292099541	408980676	/nfs/dbraw/zinc/98/06/76/408980676.db2.gz	HUFMFAYEKOQQBW-LBPRGKRZSA-N	1	1	312.366	1.691	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[C@H]1O	ZINC000286454144	408987549	/nfs/dbraw/zinc/98/75/49/408987549.db2.gz	JZUVJRYQXCGMNN-BPLDGKMQSA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H](O)CC3)n2)c1	ZINC000293282623	409082648	/nfs/dbraw/zinc/08/26/48/409082648.db2.gz	VMMUHFASLSIMCY-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](O)CC3)n2)c1	ZINC000293282623	409082650	/nfs/dbraw/zinc/08/26/50/409082650.db2.gz	VMMUHFASLSIMCY-CYBMUJFWSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@H](n3cc(Cl)cn3)C2)n1	ZINC000289410581	409266173	/nfs/dbraw/zinc/26/61/73/409266173.db2.gz	AGVHIKSNKUIJTR-NSHDSACASA-N	1	1	310.745	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](n3cc(Cl)cn3)C2)n1	ZINC000289410581	409266174	/nfs/dbraw/zinc/26/61/74/409266174.db2.gz	AGVHIKSNKUIJTR-NSHDSACASA-N	1	1	310.745	1.588	20	5		DDBDMO
CC(C)(CCC[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000314388758	164014757	/nfs/dbraw/zinc/01/47/57/164014757.db2.gz	RWAIVHDSRUHLHY-UHFFFAOYSA-N	1	1	319.358	1.530	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290684378	409486229	/nfs/dbraw/zinc/48/62/29/409486229.db2.gz	SUOMGKJCRMMDKA-GHMZBOCLSA-N	1	1	321.381	1.621	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@]1(O)CC[N@@H+](C)C1	ZINC000353914489	409557945	/nfs/dbraw/zinc/55/79/45/409557945.db2.gz	RSCQQWDXOVVLKO-OAHLLOKOSA-N	1	1	322.365	1.345	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000346617238	410038931	/nfs/dbraw/zinc/03/89/31/410038931.db2.gz	AOHJVMKKAWJGIR-GFCCVEGCSA-N	1	1	308.382	1.784	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000343525033	410509730	/nfs/dbraw/zinc/50/97/30/410509730.db2.gz	LSZZEVSEIMJNMJ-CMPLNLGQSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H](C)O	ZINC000352232549	410566427	/nfs/dbraw/zinc/56/64/27/410566427.db2.gz	VMQDASVPSBRZRL-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C[C@@H](C)O	ZINC000352232549	410566431	/nfs/dbraw/zinc/56/64/31/410566431.db2.gz	VMQDASVPSBRZRL-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
Cc1cc(NC(=O)c2c([N+](=O)[O-])cnn2C)cn2cc[nH+]c12	ZINC000355474049	410537386	/nfs/dbraw/zinc/53/73/86/410537386.db2.gz	HROQPJSPPIQXJS-UHFFFAOYSA-N	1	1	300.278	1.537	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000359354890	410619406	/nfs/dbraw/zinc/61/94/06/410619406.db2.gz	VEYHAIPMODNPCT-CYBMUJFWSA-N	1	1	318.377	1.673	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000355678131	410636218	/nfs/dbraw/zinc/63/62/18/410636218.db2.gz	ICMIHNDPEXSMJP-HNNXBMFYSA-N	1	1	321.333	1.159	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337299228	410699757	/nfs/dbraw/zinc/69/97/57/410699757.db2.gz	MGDUOFBPHNPWIR-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000337299228	410699762	/nfs/dbraw/zinc/69/97/62/410699762.db2.gz	MGDUOFBPHNPWIR-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000337299228	410699771	/nfs/dbraw/zinc/69/97/71/410699771.db2.gz	MGDUOFBPHNPWIR-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
O=c1[n-]c(C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)n[nH]1	ZINC000343762876	410678585	/nfs/dbraw/zinc/67/85/85/410678585.db2.gz	HQQZBVCILZAQPJ-UHFFFAOYSA-N	1	1	309.351	1.860	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000301234100	410681454	/nfs/dbraw/zinc/68/14/54/410681454.db2.gz	GUXYDRWVNZPVHD-SNVBAGLBSA-N	1	1	307.354	1.375	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]2c2ccccc2)c1	ZINC000353046450	410756650	/nfs/dbraw/zinc/75/66/50/410756650.db2.gz	AROHVGADWQJTLB-HUUCEWRRSA-N	1	1	302.334	1.599	20	5		DDBDMO
Cc1c[nH]nc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000356122418	410847948	/nfs/dbraw/zinc/84/79/48/410847948.db2.gz	HAGYRKHJGPVAEJ-NSHDSACASA-N	1	1	302.338	1.708	20	5		DDBDMO
Cc1c[nH]nc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000356122418	410847953	/nfs/dbraw/zinc/84/79/53/410847953.db2.gz	HAGYRKHJGPVAEJ-NSHDSACASA-N	1	1	302.338	1.708	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000359781633	410875967	/nfs/dbraw/zinc/87/59/67/410875967.db2.gz	FGKSBYLGLZIWTM-LBPRGKRZSA-N	1	1	311.386	1.418	20	5		DDBDMO
CC(=O)N[C@@H](C)C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000331137272	410973234	/nfs/dbraw/zinc/97/32/34/410973234.db2.gz	SFXPZNAGUUNRKZ-JTQLQIEISA-N	1	1	309.370	1.065	20	5		DDBDMO
Cc1cc(=O)n(Cc2[nH+]ccn2CC(F)(F)F)cc1[N+](=O)[O-]	ZINC000353816195	411133113	/nfs/dbraw/zinc/13/31/13/411133113.db2.gz	OPPCHPFORCCGSD-UHFFFAOYSA-N	1	1	316.239	1.872	20	5		DDBDMO
C[N@@H+](CCC1CCOCC1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000132559456	196265462	/nfs/dbraw/zinc/26/54/62/196265462.db2.gz	WRNSUKNDDYDBIG-UHFFFAOYSA-N	1	1	309.366	1.505	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3ccsc3C2)c1	ZINC000132593957	196268719	/nfs/dbraw/zinc/26/87/19/196268719.db2.gz	YVJJYHMUPZPFBU-LBPRGKRZSA-N	1	1	308.363	1.272	20	5		DDBDMO
CNc1nccc(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600311701	416618191	/nfs/dbraw/zinc/61/81/91/416618191.db2.gz	CEDWRHYLTIJWEK-LLVKDONJSA-N	1	1	321.381	1.493	20	5		DDBDMO
O=C1CO[C@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]2N1	ZINC000366784187	418517845	/nfs/dbraw/zinc/51/78/45/418517845.db2.gz	UKSZQTFYRKLPCA-BBZUXEQDSA-N	1	1	317.345	1.197	20	5		DDBDMO
O=C1CO[C@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]2N1	ZINC000366784187	418517849	/nfs/dbraw/zinc/51/78/49/418517849.db2.gz	UKSZQTFYRKLPCA-BBZUXEQDSA-N	1	1	317.345	1.197	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2c([N+](=O)[O-])c(C)nn2CC)CC1	ZINC000192633660	418524707	/nfs/dbraw/zinc/52/47/07/418524707.db2.gz	AQEHFZGJMMHUGP-LBPRGKRZSA-N	1	1	311.386	1.013	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000189663921	222051410	/nfs/dbraw/zinc/05/14/10/222051410.db2.gz	YFCCRSQYJXZUGB-OAHLLOKOSA-N	1	1	307.350	1.431	20	5		DDBDMO
COCCO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000189726083	222053327	/nfs/dbraw/zinc/05/33/27/222053327.db2.gz	VAJMSNPBWLGNAJ-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000189726083	222053328	/nfs/dbraw/zinc/05/33/28/222053328.db2.gz	VAJMSNPBWLGNAJ-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000375036889	418593092	/nfs/dbraw/zinc/59/30/92/418593092.db2.gz	IJGGVTLPBJRZJV-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H]2C(=O)NC[C@@H]2C1	ZINC000368232017	418707795	/nfs/dbraw/zinc/70/77/95/418707795.db2.gz	YVSRPARRAMNZRF-YPMHNXCESA-N	1	1	305.334	1.171	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1	ZINC000368305464	418717820	/nfs/dbraw/zinc/71/78/20/418717820.db2.gz	VZCQDLSTRJNEEB-OAHLLOKOSA-N	1	1	320.349	1.308	20	5		DDBDMO
CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000361578138	418684994	/nfs/dbraw/zinc/68/49/94/418684994.db2.gz	PPEZKZSEMQWNAD-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000361578138	418684996	/nfs/dbraw/zinc/68/49/96/418684996.db2.gz	PPEZKZSEMQWNAD-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC1CC[NH+](C2CCC(NC(=O)[C@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000370938557	418751452	/nfs/dbraw/zinc/75/14/52/418751452.db2.gz	BFUBWUIXPRNQAS-PFSRBDOWSA-N	1	1	309.410	1.811	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000365055773	418834451	/nfs/dbraw/zinc/83/44/51/418834451.db2.gz	WJBLFOZWVNJZTE-NWDGAFQWSA-N	1	1	320.349	1.815	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)O1	ZINC000364788201	418809991	/nfs/dbraw/zinc/80/99/91/418809991.db2.gz	JAKKZRVUJNSOGK-OAHLLOKOSA-N	1	1	321.333	1.548	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@@H](O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000411420299	418902697	/nfs/dbraw/zinc/90/26/97/418902697.db2.gz	JIUDIBBQMPHMIF-QWRGUYRKSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(NC(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000372964918	418916930	/nfs/dbraw/zinc/91/69/30/418916930.db2.gz	AISGHFNCFSCVSN-UHFFFAOYSA-N	1	1	319.321	1.320	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411656132	419373593	/nfs/dbraw/zinc/37/35/93/419373593.db2.gz	PJPSQIHSGCPQHB-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[C@@H]1C[NH+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](CC)O1	ZINC000420945690	419376848	/nfs/dbraw/zinc/37/68/48/419376848.db2.gz	BFVXQEIQXYDMNX-ZIAGYGMSSA-N	1	1	309.366	1.646	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000420948119	419378188	/nfs/dbraw/zinc/37/81/88/419378188.db2.gz	VJWNIIKPZQWSPE-UMVBOHGHSA-N	1	1	324.377	1.285	20	5		DDBDMO
CN(CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC[N@H+]1C	ZINC000421011131	419445666	/nfs/dbraw/zinc/44/56/66/419445666.db2.gz	RZYMNIVETGQFCH-HNNXBMFYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000412079773	419633482	/nfs/dbraw/zinc/63/34/82/419633482.db2.gz	NATDXKPYNVKAED-IPYPFGDCSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)[C@H](C)C1	ZINC000421878630	419754201	/nfs/dbraw/zinc/75/42/01/419754201.db2.gz	VSPPQAMWKSZDSB-CYBMUJFWSA-N	1	1	321.377	1.350	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000421878630	419754209	/nfs/dbraw/zinc/75/42/09/419754209.db2.gz	VSPPQAMWKSZDSB-CYBMUJFWSA-N	1	1	321.377	1.350	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CNCC[C@@H]1C	ZINC000414932428	419879831	/nfs/dbraw/zinc/87/98/31/419879831.db2.gz	RBXQHEKUBICHDF-YWPYICTPSA-N	1	1	320.393	1.900	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](OCCO)C1	ZINC000430192116	420088998	/nfs/dbraw/zinc/08/89/98/420088998.db2.gz	ACIUTEAEKKRSAZ-AWEZNQCLSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](OCCO)C1	ZINC000430192116	420089002	/nfs/dbraw/zinc/08/90/02/420089002.db2.gz	ACIUTEAEKKRSAZ-AWEZNQCLSA-N	1	1	310.350	1.577	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[C@H]([NH3+])[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000430955385	420221988	/nfs/dbraw/zinc/22/19/88/420221988.db2.gz	MCHQAZPYKWFYPB-AAEUAGOBSA-N	1	1	320.393	1.901	20	5		DDBDMO
COc1cccc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000435871609	420291517	/nfs/dbraw/zinc/29/15/17/420291517.db2.gz	UCKPNRVQGZRRHH-LBPRGKRZSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@@H+](C[C@H](O)CNCCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC001120569875	782028209	/nfs/dbraw/zinc/02/82/09/782028209.db2.gz	LGYHYTVYHLCQGT-CYBMUJFWSA-N	1	1	308.382	1.051	20	5		DDBDMO
CN(C[C@H](O)C[NH2+]CCNc1ccccc1[N+](=O)[O-])C1CC1	ZINC001120569875	782028217	/nfs/dbraw/zinc/02/82/17/782028217.db2.gz	LGYHYTVYHLCQGT-CYBMUJFWSA-N	1	1	308.382	1.051	20	5		DDBDMO
CC(C)(C[NH+]1CCCC1)NCCn1cc([N+](=O)[O-])ccc1=O	ZINC000452091390	420623843	/nfs/dbraw/zinc/62/38/43/420623843.db2.gz	BJFNTCLYWIACQA-UHFFFAOYSA-N	1	1	308.382	1.221	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@@H](NC(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000492874498	420697266	/nfs/dbraw/zinc/69/72/66/420697266.db2.gz	PQUFSJKTSICSNE-GFCCVEGCSA-N	1	1	322.365	1.497	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](NC(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000492874498	420697269	/nfs/dbraw/zinc/69/72/69/420697269.db2.gz	PQUFSJKTSICSNE-GFCCVEGCSA-N	1	1	322.365	1.497	20	5		DDBDMO
CC1(CC(F)(F)F)C[NH+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000453031658	420704821	/nfs/dbraw/zinc/70/48/21/420704821.db2.gz	HOIMEXRPQIQWGX-JTQLQIEISA-N	1	1	322.287	1.427	20	5		DDBDMO
CC1(CC(F)(F)F)C[NH+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000453031673	420704051	/nfs/dbraw/zinc/70/40/51/420704051.db2.gz	HOIMEXRPQIQWGX-SNVBAGLBSA-N	1	1	322.287	1.427	20	5		DDBDMO
CCOC[C@@H]1CCCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000459706765	420853461	/nfs/dbraw/zinc/85/34/61/420853461.db2.gz	JEAHJLPCSPMOSU-GXTWGEPZSA-N	1	1	312.370	1.043	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])c1	ZINC000488753102	421112132	/nfs/dbraw/zinc/11/21/32/421112132.db2.gz	QHDPAOIMYJIDDM-NEPJUHHUSA-N	1	1	310.350	1.685	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455867805	421070625	/nfs/dbraw/zinc/07/06/25/421070625.db2.gz	XIPIUWQMVHWIMH-UHFFFAOYSA-N	1	1	309.370	1.493	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NC[C@H]3CCCC[N@@H+]3CCO)[nH]c2c1	ZINC000450613304	421216943	/nfs/dbraw/zinc/21/69/43/421216943.db2.gz	LQJFJAAUGADEBW-GFCCVEGCSA-N	1	1	319.365	1.152	20	5		DDBDMO
C[C@H]1CN(c2nccc3c2cccc3[N+](=O)[O-])CC[N@H+]1CCO	ZINC000450452368	421199621	/nfs/dbraw/zinc/19/96/21/421199621.db2.gz	MIZOZAXEHKOIAU-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H]2CCC(=O)N(C)C2)cc1[N+](=O)[O-]	ZINC000563363915	421492873	/nfs/dbraw/zinc/49/28/73/421492873.db2.gz	NABPMAOJBBGZCZ-LBPRGKRZSA-N	1	1	307.350	1.656	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000581768126	422042482	/nfs/dbraw/zinc/04/24/82/422042482.db2.gz	HDXGPWWSONVRPA-HIFRSBDPSA-N	1	1	303.362	1.608	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565852	422350686	/nfs/dbraw/zinc/35/06/86/422350686.db2.gz	ISIVTQRRTQGGBC-WCQYABFASA-N	1	1	324.381	1.908	20	5		DDBDMO
CC(C)Oc1nc(N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565852	422350690	/nfs/dbraw/zinc/35/06/90/422350690.db2.gz	ISIVTQRRTQGGBC-WCQYABFASA-N	1	1	324.381	1.908	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1NCC[N@@H+]1CC[C@H](O)C1	ZINC000599199476	422404943	/nfs/dbraw/zinc/40/49/43/422404943.db2.gz	MBHXNIJWPBNIQC-LBPRGKRZSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@@H](C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)[NH+](C)C	ZINC000610541634	422467874	/nfs/dbraw/zinc/46/78/74/422467874.db2.gz	YIVWTBGSLFDQAY-VIFPVBQESA-N	1	1	303.322	1.874	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@@H](C)C[NH+](CC)C[C@@H]2C)n1	ZINC000344419522	272021250	/nfs/dbraw/zinc/02/12/50/272021250.db2.gz	GDOQXNXYRBTPQR-QWRGUYRKSA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)n1	ZINC000344738695	272104992	/nfs/dbraw/zinc/10/49/92/272104992.db2.gz	ZSXYMHLSRLKIHT-GFCCVEGCSA-N	1	1	323.397	1.661	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000345901805	272362456	/nfs/dbraw/zinc/36/24/56/272362456.db2.gz	HYEOVJBUCXZQFD-VHSXEESVSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000345901805	272362457	/nfs/dbraw/zinc/36/24/57/272362457.db2.gz	HYEOVJBUCXZQFD-VHSXEESVSA-N	1	1	309.370	1.191	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000413471734	274017161	/nfs/dbraw/zinc/01/71/61/274017161.db2.gz	FVANARKKHHXCDA-UHFFFAOYSA-N	1	1	323.393	1.687	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCN(c3[nH]cc[nH+]3)CC2)c(Cl)c1	ZINC000278677459	275041096	/nfs/dbraw/zinc/04/10/96/275041096.db2.gz	KQMMKYIVRLMUOB-UHFFFAOYSA-N	1	1	308.729	1.693	20	5		DDBDMO
CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CC(=O)N(C)C1=O	ZINC000338327237	276002206	/nfs/dbraw/zinc/00/22/06/276002206.db2.gz	XQMUUSOIGDWSSC-CQSZACIVSA-N	1	1	319.361	1.873	20	5		DDBDMO
CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1CC(=O)N(C)C1=O	ZINC000338327237	276002207	/nfs/dbraw/zinc/00/22/07/276002207.db2.gz	XQMUUSOIGDWSSC-CQSZACIVSA-N	1	1	319.361	1.873	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(CCn3cc([N+](=O)[O-])ccc3=O)C2)C1	ZINC000292976502	277086631	/nfs/dbraw/zinc/08/66/31/277086631.db2.gz	MRKKWAMWTUDXML-INIZCTEOSA-N	1	1	320.393	1.174	20	5		DDBDMO
COC(=O)[C@H]1CN(c2ccc(F)cc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000413492092	277362800	/nfs/dbraw/zinc/36/28/00/277362800.db2.gz	CBLBCJWBCQDFEQ-SNVBAGLBSA-N	1	1	311.313	1.275	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000185934646	279156590	/nfs/dbraw/zinc/15/65/90/279156590.db2.gz	XCIVVWYZUYQLOZ-HNNXBMFYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000185934646	279156592	/nfs/dbraw/zinc/15/65/92/279156592.db2.gz	XCIVVWYZUYQLOZ-HNNXBMFYSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000119537244	281101698	/nfs/dbraw/zinc/10/16/98/281101698.db2.gz	DUMQAJWTSHUZTD-OAHLLOKOSA-N	1	1	319.361	1.200	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000119537244	281101700	/nfs/dbraw/zinc/10/17/00/281101700.db2.gz	DUMQAJWTSHUZTD-OAHLLOKOSA-N	1	1	319.361	1.200	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCCO1	ZINC000126074493	281225510	/nfs/dbraw/zinc/22/55/10/281225510.db2.gz	SMHWWKJPEYKESD-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCCO1	ZINC000126074493	281225513	/nfs/dbraw/zinc/22/55/13/281225513.db2.gz	SMHWWKJPEYKESD-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000425286672	290281246	/nfs/dbraw/zinc/28/12/46/290281246.db2.gz	QQBFEXNCMQDKRZ-SMDDNHRTSA-N	1	1	304.350	1.224	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000423966243	304551395	/nfs/dbraw/zinc/55/13/95/304551395.db2.gz	IIRKNMBROUZEID-OAHLLOKOSA-N	1	1	312.329	1.777	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000357918988	299019759	/nfs/dbraw/zinc/01/97/59/299019759.db2.gz	ZKYZQTFJWIASOF-PHIMTYICSA-N	1	1	309.370	1.321	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000362769779	300136230	/nfs/dbraw/zinc/13/62/30/300136230.db2.gz	OBDAWTSCYFVTFJ-UHFFFAOYSA-N	1	1	301.293	1.483	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124899	300215493	/nfs/dbraw/zinc/21/54/93/300215493.db2.gz	DHMOEQNNMWIJQT-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000363124899	300215494	/nfs/dbraw/zinc/21/54/94/300215494.db2.gz	DHMOEQNNMWIJQT-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124899	300215496	/nfs/dbraw/zinc/21/54/96/300215496.db2.gz	DHMOEQNNMWIJQT-KBMXLJTQSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN1C(=O)[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000363328694	300252315	/nfs/dbraw/zinc/25/23/15/300252315.db2.gz	OOCCLZIJMQNXAY-ZDUSSCGKSA-N	1	1	318.333	1.063	20	5		DDBDMO
CCN1C(=O)[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000363328694	300252317	/nfs/dbraw/zinc/25/23/17/300252317.db2.gz	OOCCLZIJMQNXAY-ZDUSSCGKSA-N	1	1	318.333	1.063	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000363564388	300282979	/nfs/dbraw/zinc/28/29/79/300282979.db2.gz	TXAHQHKEHIWWFB-ZIAGYGMSSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367286690	300822291	/nfs/dbraw/zinc/82/22/91/300822291.db2.gz	MJQDXRKJYRKIGC-MJRJWQSSSA-N	1	1	311.288	1.674	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000368823391	301092749	/nfs/dbraw/zinc/09/27/49/301092749.db2.gz	IJVUKGLMHYOHMZ-OAHLLOKOSA-N	1	1	321.377	1.510	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCN2CCOC[C@H]2C1	ZINC000368823391	301092753	/nfs/dbraw/zinc/09/27/53/301092753.db2.gz	IJVUKGLMHYOHMZ-OAHLLOKOSA-N	1	1	321.377	1.510	20	5		DDBDMO
CCN1C(=O)[C@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])CCN2C1=O	ZINC000369441275	301186222	/nfs/dbraw/zinc/18/62/22/301186222.db2.gz	TYMHFXJSGAZLFW-CYBMUJFWSA-N	1	1	318.333	1.063	20	5		DDBDMO
CCN1C(=O)[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])CCN2C1=O	ZINC000369441275	301186225	/nfs/dbraw/zinc/18/62/25/301186225.db2.gz	TYMHFXJSGAZLFW-CYBMUJFWSA-N	1	1	318.333	1.063	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)n1	ZINC000450786543	301205471	/nfs/dbraw/zinc/20/54/71/301205471.db2.gz	AKZYSXPBFZCCNZ-BETUJISGSA-N	1	1	308.382	1.498	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)n1	ZINC000450786543	301205474	/nfs/dbraw/zinc/20/54/74/301205474.db2.gz	AKZYSXPBFZCCNZ-BETUJISGSA-N	1	1	308.382	1.498	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000377475392	302182737	/nfs/dbraw/zinc/18/27/37/302182737.db2.gz	MBRLWJCLNUGEMC-ZIAGYGMSSA-N	1	1	319.361	1.117	20	5		DDBDMO
Cc1[nH+]cc2n1CC[C@H](C(=O)NCc1cccc([N+](=O)[O-])c1)C2	ZINC000516354496	302789260	/nfs/dbraw/zinc/78/92/60/302789260.db2.gz	PNFQNGSAKFNURZ-ZDUSSCGKSA-N	1	1	314.345	1.979	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000536608801	303365538	/nfs/dbraw/zinc/36/55/38/303365538.db2.gz	RRAFJVGRAVLPBN-RYUDHWBXSA-N	1	1	321.377	1.697	20	5		DDBDMO
Cc1ccc2c(c1)[C@H]1C[N@@H+](C)CC[C@H]1N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000373798669	307195376	/nfs/dbraw/zinc/19/53/76/307195376.db2.gz	SNAQHXUZKQFKST-XOUADPBQSA-N	1	1	315.373	1.795	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCN([C@@H]2CCC[N@H+](C)C2)CC1	ZINC000374221002	307204239	/nfs/dbraw/zinc/20/42/39/307204239.db2.gz	TYMFFXVXVZLTPF-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[N@H+](C)[C@H]3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000376663594	307252360	/nfs/dbraw/zinc/25/23/60/307252360.db2.gz	LJGVZJBHDXMSEJ-PWSUYJOCSA-N	1	1	320.349	1.170	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000565959802	308039474	/nfs/dbraw/zinc/03/94/74/308039474.db2.gz	TUVSDFDDUUNSQC-LLVKDONJSA-N	1	1	304.350	1.216	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000571263524	308192954	/nfs/dbraw/zinc/19/29/54/308192954.db2.gz	FLZDGTPQOAMEIC-GXFFZTMASA-N	1	1	319.365	1.407	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)c1[N+](=O)[O-]	ZINC000576457294	308315558	/nfs/dbraw/zinc/31/55/58/308315558.db2.gz	FHXKRLNJTUVTPD-SECBINFHSA-N	1	1	315.276	1.283	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000582676587	337120980	/nfs/dbraw/zinc/12/09/80/337120980.db2.gz	ZSRNMHXSLDRRIA-JTQLQIEISA-N	1	1	317.349	1.429	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](CO)[C@@H]1C	ZINC000488801833	484219410	/nfs/dbraw/zinc/21/94/10/484219410.db2.gz	NHVIXJIZBKDJLO-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1ccc([N+](=O)[O-])cn1	ZINC000517484685	501057526	/nfs/dbraw/zinc/05/75/26/501057526.db2.gz	VGKKCMJFIPZISG-GFCCVEGCSA-N	1	1	304.350	1.737	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H]2CCN3CCO[C@H]2C3)ccc1[N+](=O)[O-]	ZINC000451136256	533794751	/nfs/dbraw/zinc/79/47/51/533794751.db2.gz	FIZQDMPEAORWIN-BBRMVZONSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])n2C)CC[N@H+](C2CC2)C1	ZINC000452171275	533877646	/nfs/dbraw/zinc/87/76/46/533877646.db2.gz	POLDLVLVTKBHCP-LLVKDONJSA-N	1	1	306.366	1.490	20	5		DDBDMO
Cc1nc(N(C)CC(C)(C)C[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000297562143	534437969	/nfs/dbraw/zinc/43/79/69/534437969.db2.gz	ROBMHEARIFJBAJ-UHFFFAOYSA-N	1	1	323.397	1.488	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000451940702	527784927	/nfs/dbraw/zinc/78/49/27/527784927.db2.gz	VFRVWUMRLMKRJX-ZIAGYGMSSA-N	1	1	323.349	1.235	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C	ZINC000451522229	528061414	/nfs/dbraw/zinc/06/14/14/528061414.db2.gz	AWNKHJSKUMDDHU-OCCSQVGLSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC(C)[C@@H]([NH3+])CN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803803	528532457	/nfs/dbraw/zinc/53/24/57/528532457.db2.gz	WVXWYEILVWPLLG-FZMZJTMJSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@@H](N)C[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803803	528532463	/nfs/dbraw/zinc/53/24/63/528532463.db2.gz	WVXWYEILVWPLLG-FZMZJTMJSA-N	1	1	308.382	1.885	20	5		DDBDMO
NC(=O)C[NH+]1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000122589916	696723645	/nfs/dbraw/zinc/72/36/45/696723645.db2.gz	FTQYCRHLNOFRSC-UHFFFAOYSA-N	1	1	312.757	1.610	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000151977087	696893319	/nfs/dbraw/zinc/89/33/19/696893319.db2.gz	UABXLJLYLCNYEC-UHFFFAOYSA-N	1	1	306.322	1.787	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])OCCC[NH+]1CCOCC1	ZINC000748491054	700121468	/nfs/dbraw/zinc/12/14/68/700121468.db2.gz	GLNGDJOFWSXNME-UHFFFAOYSA-N	1	1	308.334	1.403	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2nnc3n2CCCC3)c1	ZINC000749675169	700176418	/nfs/dbraw/zinc/17/64/18/700176418.db2.gz	JAAZODVCTXJBDV-CYBMUJFWSA-N	1	1	317.349	1.346	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1CCO[C@@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000775577630	698011509	/nfs/dbraw/zinc/01/15/09/698011509.db2.gz	QEKFTLUOSJBKQD-NWDGAFQWSA-N	1	1	307.350	1.493	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2C2OCCO2)cc1	ZINC000776582588	698121421	/nfs/dbraw/zinc/12/14/21/698121421.db2.gz	VSHLTWYEIJEWJW-CABCVRRESA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCC[C@@H]2C2OCCO2)cc1	ZINC000776582588	698121425	/nfs/dbraw/zinc/12/14/25/698121425.db2.gz	VSHLTWYEIJEWJW-CABCVRRESA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCOC3(CCOCC3)C2)cc1	ZINC000776587550	698122606	/nfs/dbraw/zinc/12/26/06/698122606.db2.gz	WKDIXBLAYNSSMY-HNNXBMFYSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCOC3(CCOCC3)C2)cc1	ZINC000776587550	698122608	/nfs/dbraw/zinc/12/26/08/698122608.db2.gz	WKDIXBLAYNSSMY-HNNXBMFYSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c(F)c1	ZINC000750885172	700254404	/nfs/dbraw/zinc/25/44/04/700254404.db2.gz	JFUVCMBFVCJNTB-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
Cc1ccc(NCCNC(=O)c2cc([N+](=O)[O-])cn2C)[nH+]c1	ZINC000786843416	699172674	/nfs/dbraw/zinc/17/26/74/699172674.db2.gz	WFGPSFIHXHPATL-UHFFFAOYSA-N	1	1	303.322	1.479	20	5		DDBDMO
CS(=O)(=O)[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000714244521	699269706	/nfs/dbraw/zinc/26/97/06/699269706.db2.gz	KSMOTCIUTSUOBH-HOMQSWHASA-N	1	1	302.327	1.399	20	5		DDBDMO
CO[C@@H]1C[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C[C@@H]1OC	ZINC000792710861	699708553	/nfs/dbraw/zinc/70/85/53/699708553.db2.gz	SXPHYMRWBLFSCG-GASCZTMLSA-N	1	1	320.349	1.556	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C[C@@H]1OC	ZINC000792710861	699708554	/nfs/dbraw/zinc/70/85/54/699708554.db2.gz	SXPHYMRWBLFSCG-GASCZTMLSA-N	1	1	320.349	1.556	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000739873057	699781623	/nfs/dbraw/zinc/78/16/23/699781623.db2.gz	ROSULBUHVMKFBW-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000794709145	699826015	/nfs/dbraw/zinc/82/60/15/699826015.db2.gz	CQBLKGSHFSOTSU-CQSZACIVSA-N	1	1	303.322	1.099	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000795749626	699889185	/nfs/dbraw/zinc/88/91/85/699889185.db2.gz	GWQUKICIUHEAOI-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000795749626	699889187	/nfs/dbraw/zinc/88/91/87/699889187.db2.gz	GWQUKICIUHEAOI-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000771950307	701338004	/nfs/dbraw/zinc/33/80/04/701338004.db2.gz	LLOIGYLMLRVWCP-UHFFFAOYSA-N	1	1	304.306	1.847	20	5		DDBDMO
C[NH+](C)CCN(Cc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839708648	701792021	/nfs/dbraw/zinc/79/20/21/701792021.db2.gz	YMYZZWDXLJFJKW-TZMCWYRMSA-N	1	1	309.341	1.381	20	5		DDBDMO
CC[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCOC1	ZINC000812296364	702140887	/nfs/dbraw/zinc/14/08/87/702140887.db2.gz	PTMAWDSXNROMTO-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCOC1	ZINC000812296364	702140889	/nfs/dbraw/zinc/14/08/89/702140889.db2.gz	PTMAWDSXNROMTO-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812339546	702163605	/nfs/dbraw/zinc/16/36/05/702163605.db2.gz	UUBUCAWYJRMZIJ-WDEREUQCSA-N	1	1	321.381	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CC[N@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812339546	702163608	/nfs/dbraw/zinc/16/36/08/702163608.db2.gz	UUBUCAWYJRMZIJ-WDEREUQCSA-N	1	1	321.381	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812339546	702163612	/nfs/dbraw/zinc/16/36/12/702163612.db2.gz	UUBUCAWYJRMZIJ-WDEREUQCSA-N	1	1	321.381	1.294	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000817282550	702326271	/nfs/dbraw/zinc/32/62/71/702326271.db2.gz	GGUYXLVRDXNQJK-JTQLQIEISA-N	1	1	308.294	1.071	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000817282550	702326279	/nfs/dbraw/zinc/32/62/79/702326279.db2.gz	GGUYXLVRDXNQJK-JTQLQIEISA-N	1	1	308.294	1.071	20	5		DDBDMO
[NH3+]C1(CNCCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCC1	ZINC000843367632	702867412	/nfs/dbraw/zinc/86/74/12/702867412.db2.gz	GRXWEYVUVMEZFQ-UHFFFAOYSA-N	1	1	310.329	1.534	20	5		DDBDMO
NC1(C[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCC1	ZINC000843367632	702867413	/nfs/dbraw/zinc/86/74/13/702867413.db2.gz	GRXWEYVUVMEZFQ-UHFFFAOYSA-N	1	1	310.329	1.534	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN2CCN(c3[nH]cc[nH+]3)CC2)c1	ZINC000846876606	703345393	/nfs/dbraw/zinc/34/53/93/703345393.db2.gz	BMWJJSXEDPAJLB-CQSZACIVSA-N	1	1	317.349	1.174	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCN(c3[nH]cc[nH+]3)CC2)cc1F	ZINC000846876471	703345521	/nfs/dbraw/zinc/34/55/21/703345521.db2.gz	UEEUEFAKCUGHQA-UHFFFAOYSA-N	1	1	305.313	1.779	20	5		DDBDMO
CC1(C)C[C@H](O)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879614942	706738752	/nfs/dbraw/zinc/73/87/52/706738752.db2.gz	CKUFJPJTQLUXPA-UONOGXRCSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[N@H+]1CC[C@H](CCOC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000847827862	703474107	/nfs/dbraw/zinc/47/41/07/703474107.db2.gz	YYYSGYPKYILLSW-LLVKDONJSA-N	1	1	310.354	1.411	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000869801139	703854807	/nfs/dbraw/zinc/85/48/07/703854807.db2.gz	FGDYLNBIFMJXDH-ARLBYUKCSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801139	703854809	/nfs/dbraw/zinc/85/48/09/703854809.db2.gz	FGDYLNBIFMJXDH-ARLBYUKCSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801139	703854810	/nfs/dbraw/zinc/85/48/10/703854810.db2.gz	FGDYLNBIFMJXDH-ARLBYUKCSA-N	1	1	317.389	1.536	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)CN1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000851869837	703874627	/nfs/dbraw/zinc/87/46/27/703874627.db2.gz	SOEMWIHKIKLJLD-AWEZNQCLSA-N	1	1	307.394	1.654	20	5		DDBDMO
O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000818585463	703931365	/nfs/dbraw/zinc/93/13/65/703931365.db2.gz	CYLGMIOQQIMPAS-JTQLQIEISA-N	1	1	319.695	1.927	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2C[N@H+]3CCC[C@H]3CO2)c1	ZINC000818986352	704043581	/nfs/dbraw/zinc/04/35/81/704043581.db2.gz	MDRQUWGJTPBOFQ-HRCADAONSA-N	1	1	321.377	1.081	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CN3CCC[C@H]3CO2)c1	ZINC000818986352	704043586	/nfs/dbraw/zinc/04/35/86/704043586.db2.gz	MDRQUWGJTPBOFQ-HRCADAONSA-N	1	1	321.377	1.081	20	5		DDBDMO
C[C@H]1C[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)C1O	ZINC000852500946	704064030	/nfs/dbraw/zinc/06/40/30/704064030.db2.gz	UMCWJZTUEHMVBC-UWVGGRQHSA-N	1	1	309.322	1.952	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000870885054	704157087	/nfs/dbraw/zinc/15/70/87/704157087.db2.gz	AGLRRNHDFYEVGA-DJSGYFEHSA-N	1	1	321.377	1.795	20	5		DDBDMO
Nc1ccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000853964789	704341427	/nfs/dbraw/zinc/34/14/27/704341427.db2.gz	APXVDNZTLNQIOM-CYBMUJFWSA-N	1	1	306.366	1.212	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874827846	705185874	/nfs/dbraw/zinc/18/58/74/705185874.db2.gz	DULZTCRMSKXMSF-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000874846915	705201545	/nfs/dbraw/zinc/20/15/45/705201545.db2.gz	LNBKUOHJJLRLNO-GJZGRUSLSA-N	1	1	319.361	1.669	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000861339491	705433301	/nfs/dbraw/zinc/43/33/01/705433301.db2.gz	CDWSWBMNCLSUOB-NHYWBVRUSA-N	1	1	308.334	1.861	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000863032405	705852467	/nfs/dbraw/zinc/85/24/67/705852467.db2.gz	ODUKBJYEQVPWBM-CYBMUJFWSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827290329	705969641	/nfs/dbraw/zinc/96/96/41/705969641.db2.gz	SWEQCZYCCNCYMZ-PWSUYJOCSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827310038	705972714	/nfs/dbraw/zinc/97/27/14/705972714.db2.gz	JJKDZNCTCYJWRH-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@H]21	ZINC000827313255	705973398	/nfs/dbraw/zinc/97/33/98/705973398.db2.gz	YVPSQBRDAZHKJP-ZYHUDNBSSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827371929	705988272	/nfs/dbraw/zinc/98/82/72/705988272.db2.gz	BELWJINKVDYOSD-AAEUAGOBSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000827808259	706070006	/nfs/dbraw/zinc/07/00/06/706070006.db2.gz	XULJHHRWXLKRDA-LBPRGKRZSA-N	1	1	321.377	1.841	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000865006260	706324087	/nfs/dbraw/zinc/32/40/87/706324087.db2.gz	HGPWXLSHZCGZIP-NSHDSACASA-N	1	1	307.325	1.629	20	5		DDBDMO
C[C@@](O)(C[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303410	706352425	/nfs/dbraw/zinc/35/24/25/706352425.db2.gz	PYUXGDIMAGHWMI-RHSMWYFYSA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@@](O)(C[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303410	706352428	/nfs/dbraw/zinc/35/24/28/706352428.db2.gz	PYUXGDIMAGHWMI-RHSMWYFYSA-N	1	1	320.389	1.865	20	5		DDBDMO
O=C1NCCCC[C@@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865459686	706437296	/nfs/dbraw/zinc/43/72/96/706437296.db2.gz	JJGKXMRYFOZZMP-AWEZNQCLSA-N	1	1	300.318	1.646	20	5		DDBDMO
CCN(CC)C(=O)CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865466800	706439046	/nfs/dbraw/zinc/43/90/46/706439046.db2.gz	OHNPQWHABVFFJP-UHFFFAOYSA-N	1	1	302.334	1.845	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)C1	ZINC000865642047	706484939	/nfs/dbraw/zinc/48/49/39/706484939.db2.gz	QMJYXYZBFLCTKS-SNVBAGLBSA-N	1	1	320.324	1.954	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1	ZINC000867229990	706932114	/nfs/dbraw/zinc/93/21/14/706932114.db2.gz	NACAKDMVFNQYFS-UHFFFAOYSA-N	1	1	307.325	1.655	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432284	706973795	/nfs/dbraw/zinc/97/37/95/706973795.db2.gz	NAQPICPLXRZSMY-KBPBESRZSA-N	1	1	320.349	1.707	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432284	706973797	/nfs/dbraw/zinc/97/37/97/706973797.db2.gz	NAQPICPLXRZSMY-KBPBESRZSA-N	1	1	320.349	1.707	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832845579	706996041	/nfs/dbraw/zinc/99/60/41/706996041.db2.gz	PCUXPUDCXYGGFE-SWLSCSKDSA-N	1	1	323.393	1.865	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880526043	707003515	/nfs/dbraw/zinc/00/35/15/707003515.db2.gz	BIXFRWVOPSLYHB-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880526043	707003517	/nfs/dbraw/zinc/00/35/17/707003517.db2.gz	BIXFRWVOPSLYHB-WFASDCNBSA-N	1	1	319.361	1.574	20	5		DDBDMO
CCO[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CN(C)C	ZINC000926964186	712923195	/nfs/dbraw/zinc/92/31/95/712923195.db2.gz	WKIYALGJDGAGJN-WCQYABFASA-N	1	1	310.398	1.794	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CC[N@H+](CCO)C(C)(C)C1	ZINC000882231562	707550153	/nfs/dbraw/zinc/55/01/53/707550153.db2.gz	BGDSECRHYNGMBA-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000882231562	707550156	/nfs/dbraw/zinc/55/01/56/707550156.db2.gz	BGDSECRHYNGMBA-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c2cc([N+](=O)[O-])ccc12	ZINC000872786021	707601124	/nfs/dbraw/zinc/60/11/24/707601124.db2.gz	OGCUDETWFYVXHY-TXEJJXNPSA-N	1	1	302.334	1.789	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@H+](Cn1cc([N+](=O)[O-])c(C)n1)CC2	ZINC000872828353	707618055	/nfs/dbraw/zinc/61/80/55/707618055.db2.gz	ZYMJKMAANOCVSI-OCCSQVGLSA-N	1	1	308.338	1.475	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](Cn1cc([N+](=O)[O-])c(C)n1)CC2	ZINC000872828353	707618057	/nfs/dbraw/zinc/61/80/57/707618057.db2.gz	ZYMJKMAANOCVSI-OCCSQVGLSA-N	1	1	308.338	1.475	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@H]1C[C@@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000873249858	707784615	/nfs/dbraw/zinc/78/46/15/707784615.db2.gz	MXPVUHPRQSOZTD-LNSITVRQSA-N	1	1	315.377	1.745	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000838144212	707853862	/nfs/dbraw/zinc/85/38/62/707853862.db2.gz	LGJXOXWFPNVIKJ-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
Cc1cccc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897220929	708258705	/nfs/dbraw/zinc/25/87/05/708258705.db2.gz	ZSKMHWBJKIKQDQ-KGLIPLIRSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[C@H](C(=O)N(C)CC[N@@H+](C)CCO)c1cccc([N+](=O)[O-])c1	ZINC000912604635	713044673	/nfs/dbraw/zinc/04/46/73/713044673.db2.gz	LZFASAJDFLGSFM-LBPRGKRZSA-N	1	1	309.366	1.081	20	5		DDBDMO
C[C@@H](CNC(=O)[C@@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402448	709037692	/nfs/dbraw/zinc/03/76/92/709037692.db2.gz	CDMRAWQHEIGACO-FZMZJTMJSA-N	1	1	307.350	1.145	20	5		DDBDMO
C[C@@H](CNC(=O)[C@@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402448	709037695	/nfs/dbraw/zinc/03/76/95/709037695.db2.gz	CDMRAWQHEIGACO-FZMZJTMJSA-N	1	1	307.350	1.145	20	5		DDBDMO
O=[N+]([O-])c1ncccc1Cn1cc(C[NH+]2CCCCC2)nn1	ZINC000887462834	709048713	/nfs/dbraw/zinc/04/87/13/709048713.db2.gz	DEBUEFPIQHNDKR-UHFFFAOYSA-N	1	1	302.338	1.616	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887934156	709170074	/nfs/dbraw/zinc/17/00/74/709170074.db2.gz	ATVUHKBZNLNZDC-WBMJQRKESA-N	1	1	318.377	1.417	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000900288495	709522735	/nfs/dbraw/zinc/52/27/35/709522735.db2.gz	YWTPISDKTGSPJU-OAHLLOKOSA-N	1	1	307.350	1.058	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCC3)C2)c1[N+](=O)[O-]	ZINC000912912655	713122263	/nfs/dbraw/zinc/12/22/63/713122263.db2.gz	CNXAHJUEVUKDBU-JTQLQIEISA-N	1	1	307.354	1.362	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@H+]1CCC(C)(C)C1	ZINC000890078969	709737719	/nfs/dbraw/zinc/73/77/19/709737719.db2.gz	OSZLSZPUSLSIAF-UHFFFAOYSA-N	1	1	323.397	1.338	20	5		DDBDMO
C[C@H](NC(=O)c1c(F)cccc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000900807970	709769389	/nfs/dbraw/zinc/76/93/89/709769389.db2.gz	XMSLQNVDPQEXSA-GXFFZTMASA-N	1	1	324.356	1.098	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639646	710834473	/nfs/dbraw/zinc/83/44/73/710834473.db2.gz	QQBZDNZCGVXUPG-KBPBESRZSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639646	710834477	/nfs/dbraw/zinc/83/44/77/710834477.db2.gz	QQBZDNZCGVXUPG-KBPBESRZSA-N	1	1	317.349	1.920	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2c2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000893941967	710895005	/nfs/dbraw/zinc/89/50/05/710895005.db2.gz	XULUMRVBBJOEQD-WPRPVWTQSA-N	1	1	305.363	1.740	20	5		DDBDMO
CCON(C)C(=O)C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000895167102	711439569	/nfs/dbraw/zinc/43/95/69/711439569.db2.gz	VLWFFWMARFMRIM-UHFFFAOYSA-N	1	1	301.730	1.748	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000895771420	711602040	/nfs/dbraw/zinc/60/20/40/711602040.db2.gz	KNWDNXNHLAZPQU-ZDUSSCGKSA-N	1	1	323.324	1.119	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)NC[C@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000921336893	713738317	/nfs/dbraw/zinc/73/83/17/713738317.db2.gz	ZLTQDTUEILAPKS-WCQYABFASA-N	1	1	306.366	1.968	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H](C3OCCO3)C2)c1	ZINC000932004569	714231222	/nfs/dbraw/zinc/23/12/22/714231222.db2.gz	ZGPRZMRHWXEXNJ-JSGCOSHPSA-N	1	1	308.334	1.323	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)c2ncnn21	ZINC000925383085	714836951	/nfs/dbraw/zinc/83/69/51/714836951.db2.gz	QRJUMAXHKRFFHI-MFKMUULPSA-N	1	1	303.322	1.861	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3nc4ccccc4cc3[N+](=O)[O-])C[C@H]21	ZINC000352355703	719412821	/nfs/dbraw/zinc/41/28/21/719412821.db2.gz	JIQZEOKLQLWFFL-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
COc1nc(C)c(NCC2([NH+]3CCCC3)COC2)cc1[N+](=O)[O-]	ZINC001168451682	745113826	/nfs/dbraw/zinc/11/38/26/745113826.db2.gz	QFROMRFEGIVTLD-UHFFFAOYSA-N	1	1	322.365	1.584	20	5		DDBDMO
Cc1nc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)o1	ZINC000996429331	749587950	/nfs/dbraw/zinc/58/79/50/749587950.db2.gz	PUSKZIHKIGMBPY-TZMCWYRMSA-N	1	1	322.365	1.037	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cn1	ZINC001107321685	749798986	/nfs/dbraw/zinc/79/89/86/749798986.db2.gz	JEZCSSBEIIXLJQ-PLNGDYQASA-N	1	1	321.381	1.416	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001000673088	762077962	/nfs/dbraw/zinc/07/79/62/762077962.db2.gz	DTXZMQFQMRIGHD-ZIAGYGMSSA-N	1	1	309.410	1.836	20	5		DDBDMO
CC(C)(C)CC[N@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001000673088	762077968	/nfs/dbraw/zinc/07/79/68/762077968.db2.gz	DTXZMQFQMRIGHD-ZIAGYGMSSA-N	1	1	309.410	1.836	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001000673088	762077977	/nfs/dbraw/zinc/07/79/77/762077977.db2.gz	DTXZMQFQMRIGHD-ZIAGYGMSSA-N	1	1	309.410	1.836	20	5		DDBDMO
O=C(c1ccco1)N1CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169007153	762174605	/nfs/dbraw/zinc/17/46/05/762174605.db2.gz	LOHCKSDVOTZOBN-CHWSQXEVSA-N	1	1	307.350	1.483	20	5		DDBDMO
CC(=O)N1CCCC[C@]12CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169030354	762186484	/nfs/dbraw/zinc/18/64/84/762186484.db2.gz	YYQFHTZRXZOLFS-OWCLPIDISA-N	1	1	309.410	1.909	20	5		DDBDMO
CC(C)NC(=O)N[C@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169052513	762208137	/nfs/dbraw/zinc/20/81/37/762208137.db2.gz	GSFVCUQYRVUDRY-HZSPNIEDSA-N	1	1	312.414	1.604	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccc2nc[nH]c2c1[N+](=O)[O-]	ZINC001170343648	766276381	/nfs/dbraw/zinc/27/63/81/766276381.db2.gz	WXPYGKSDLYSJKE-UHFFFAOYSA-N	1	1	302.294	1.172	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001094008189	775324071	/nfs/dbraw/zinc/32/40/71/775324071.db2.gz	HGTZQWMXBAKBOZ-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094639966	776161344	/nfs/dbraw/zinc/16/13/44/776161344.db2.gz	KBGNTQQHBASUBZ-UHFFFAOYSA-N	1	1	323.397	1.638	20	5		DDBDMO
COC(=O)[C@@H](CN)C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172901365	776915719	/nfs/dbraw/zinc/91/57/19/776915719.db2.gz	MLFIQNNPCBLZCV-UONOGXRCSA-N	1	1	321.377	1.180	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@@H]2C[C@H](CO)C[C@H]21	ZINC001173222791	777056299	/nfs/dbraw/zinc/05/62/99/777056299.db2.gz	VPBHAYCIMQMLMB-ODVANORSSA-N	1	1	320.389	1.998	20	5		DDBDMO
CS(=O)(=O)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC001177515358	778631429	/nfs/dbraw/zinc/63/14/29/778631429.db2.gz	PAYLZRVLPGXWRA-UHFFFAOYSA-N	1	1	324.358	1.989	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC001178857450	779213307	/nfs/dbraw/zinc/21/33/07/779213307.db2.gz	VLERTWXNAUWGJQ-AWEZNQCLSA-N	1	1	321.377	1.820	20	5		DDBDMO
Nc1cc(N2CCC[N@H+]3CCC[C@@H]3C2)cc(CO)c1[N+](=O)[O-]	ZINC001117284246	780705409	/nfs/dbraw/zinc/70/54/09/780705409.db2.gz	CDOMHAKUKYNOCS-GFCCVEGCSA-N	1	1	306.366	1.344	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC001119948625	781693423	/nfs/dbraw/zinc/69/34/23/781693423.db2.gz	QELVHAFMNDOANR-DGCLKSJQSA-N	1	1	305.382	1.781	20	5		DDBDMO
CN(CCNCc1ccccc1[N+](=O)[O-])C(=O)CC[NH+](C)C	ZINC001266827091	836891995	/nfs/dbraw/zinc/89/19/95/836891995.db2.gz	IOCNUYLEHCSEDV-UHFFFAOYSA-N	1	1	308.382	1.095	20	5		DDBDMO
CCCCC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001270844232	842951193	/nfs/dbraw/zinc/95/11/93/842951193.db2.gz	ALVHGKFXRCDWBF-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
C[C@@H](NC(=O)[C@H]1C[N@H+]2CCN1C[C@@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975900	859506777	/nfs/dbraw/zinc/50/67/77/859506777.db2.gz	GUSQVLAMRAVGBN-YWPYICTPSA-N	1	1	318.377	1.160	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])ccc1Cl)c1nc(N)nc(N)[nH+]1	ZINC001162095605	867246849	/nfs/dbraw/zinc/24/68/49/867246849.db2.gz	VSLHHTWKYGYUAO-UHFFFAOYSA-N	1	1	309.717	1.234	20	5		DDBDMO
Nc1nc(NCC[C@H]2CC[NH2+]CC2(F)F)ccc1[N+](=O)[O-]	ZINC001162811773	867846857	/nfs/dbraw/zinc/84/68/57/867846857.db2.gz	FJBGAYGEVAJDBT-MRVPVSSYSA-N	1	1	301.297	1.619	20	5		DDBDMO
COC(=O)N1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC001335182475	868117270	/nfs/dbraw/zinc/11/72/70/868117270.db2.gz	IMYZLPHGOKPDSV-AWEZNQCLSA-N	1	1	323.349	1.402	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC001335182475	868117278	/nfs/dbraw/zinc/11/72/78/868117278.db2.gz	IMYZLPHGOKPDSV-AWEZNQCLSA-N	1	1	323.349	1.402	20	5		DDBDMO
COC(=O)/C=C/c1ccc(NCC[N@@H+](C)CCO)c([N+](=O)[O-])c1	ZINC001164120551	868952780	/nfs/dbraw/zinc/95/27/80/868952780.db2.gz	WVBPIMCMSALUMB-GQCTYLIASA-N	1	1	323.349	1.117	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc([N+](=O)[O-])c(F)cc2F)C1	ZINC001226181084	882255807	/nfs/dbraw/zinc/25/58/07/882255807.db2.gz	MISZHISXEXFTPU-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1cc(C(F)(F)F)ccc1[N+](=O)[O-]	ZINC001336693782	869097223	/nfs/dbraw/zinc/09/72/23/869097223.db2.gz	RWADVPQNDQVQRP-UHFFFAOYSA-N	1	1	321.299	1.974	20	5		DDBDMO
COc1cccc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC001338084764	869791404	/nfs/dbraw/zinc/79/14/04/869791404.db2.gz	SFRITYOSQOMIAC-DGCLKSJQSA-N	1	1	308.382	1.650	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@H]2C1	ZINC001338464795	869993354	/nfs/dbraw/zinc/99/33/54/869993354.db2.gz	QRRKFOLAYBPVNA-UBHSHLNASA-N	1	1	321.352	1.733	20	5		DDBDMO
CN(CC1(C)COC1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001166711277	870185013	/nfs/dbraw/zinc/18/50/13/870185013.db2.gz	VSVCDPZYAPGTQB-AATRIKPKSA-N	1	1	306.366	1.995	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2cc([N+](=O)[O-])c(C(=O)OC)cc2OC)C1	ZINC001226431667	882426700	/nfs/dbraw/zinc/42/67/00/882426700.db2.gz	QAKZBNILOSUARI-JTQLQIEISA-N	1	1	324.333	1.863	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1Cn1cc([N+](=O)[O-])c(=O)c([N+](=O)[O-])c1	ZINC001307312917	871419723	/nfs/dbraw/zinc/41/97/23/871419723.db2.gz	WTOSOGOLIBDPCF-LLVKDONJSA-N	1	1	324.337	1.928	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1nc2ccc([N+](=O)[O-])cc2s1	ZINC001343190190	872527238	/nfs/dbraw/zinc/52/72/38/872527238.db2.gz	YTIBGUFRTLMXOK-UHFFFAOYSA-N	1	1	310.379	1.565	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC001348223684	874433668	/nfs/dbraw/zinc/43/36/68/874433668.db2.gz	GCOXVLOSLVBQIX-HERUPUMHSA-N	1	1	305.334	1.370	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC001348223684	874433673	/nfs/dbraw/zinc/43/36/73/874433673.db2.gz	GCOXVLOSLVBQIX-HERUPUMHSA-N	1	1	305.334	1.370	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1C[C@@H]2CSC[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC001349907363	875447510	/nfs/dbraw/zinc/44/75/10/875447510.db2.gz	DQDSGWZUOLJCSJ-RWSFTLGLSA-N	1	1	321.402	1.590	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC001350089627	875530226	/nfs/dbraw/zinc/53/02/26/875530226.db2.gz	VSHCNEHRKXSEJC-QEJZJMRPSA-N	1	1	303.362	1.594	20	5		DDBDMO
Cc1nc(N[C@H]2C[C@H]([NH+]3CCOCC3)C2(C)C)ncc1[N+](=O)[O-]	ZINC001353016540	877070502	/nfs/dbraw/zinc/07/05/02/877070502.db2.gz	DQIMMBYPVMVPMI-STQMWFEESA-N	1	1	321.381	1.604	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@H]2C1	ZINC001353381032	877291151	/nfs/dbraw/zinc/29/11/51/877291151.db2.gz	VCZPPKUIGIVHSD-OBJOEFQTSA-N	1	1	321.352	1.733	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CO[C@H](C)C[NH+]1CCOCC1	ZINC001223103607	880831332	/nfs/dbraw/zinc/83/13/32/880831332.db2.gz	CXDWMJKQVAGEPP-GFCCVEGCSA-N	1	1	310.350	1.841	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1CO[C@H]1CCC[N@@H+](C)C1	ZINC001223449783	880967320	/nfs/dbraw/zinc/96/73/20/880967320.db2.gz	GWXQBQGLCCMOPE-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3ccc(Cl)nc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230879313	884999331	/nfs/dbraw/zinc/99/93/31/884999331.db2.gz	NQVRJDWLSDWVFR-NMLBEHRDSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ccc(Cl)nc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230879313	884999349	/nfs/dbraw/zinc/99/93/49/884999349.db2.gz	NQVRJDWLSDWVFR-NMLBEHRDSA-N	1	1	311.725	1.826	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254602838	896528445	/nfs/dbraw/zinc/52/84/45/896528445.db2.gz	JDANSAISMCNIDG-GJZGRUSLSA-N	1	1	303.362	1.615	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCC[C@H](n3ccnn3)C1)C2	ZINC001254610587	896531095	/nfs/dbraw/zinc/53/10/95/896531095.db2.gz	LHJAHDMAQCYOQT-JKSUJKDBSA-N	1	1	313.361	1.991	20	5		DDBDMO
O=[N+]([O-])c1sccc1NC[C@@]1(CO)COC[C@@H]2CCC[N@@H+]21	ZINC001262724838	900336968	/nfs/dbraw/zinc/33/69/68/900336968.db2.gz	GURHZQBEQZXARX-GXFFZTMASA-N	1	1	313.379	1.294	20	5		DDBDMO
O=[N+]([O-])c1sccc1NC[C@@]1(CO)COC[C@@H]2CCC[N@H+]21	ZINC001262724838	900336975	/nfs/dbraw/zinc/33/69/75/900336975.db2.gz	GURHZQBEQZXARX-GXFFZTMASA-N	1	1	313.379	1.294	20	5		DDBDMO
CN(c1ccc(C(N)=O)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000286540217	219044155	/nfs/dbraw/zinc/04/41/55/219044155.db2.gz	ZFVXVWOBPAQQBE-FUNVUKJBSA-N	1	1	318.377	1.755	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000249002296	282125868	/nfs/dbraw/zinc/12/58/68/282125868.db2.gz	YYGXMRRHQPYISJ-DYEKYZERSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000451155093	529381618	/nfs/dbraw/zinc/38/16/18/529381618.db2.gz	ALBPEHQJIQOODX-LLVKDONJSA-N	1	1	323.349	1.596	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CCCO)C1	ZINC000452133112	231316258	/nfs/dbraw/zinc/31/62/58/231316258.db2.gz	RNMQEQXCAAPJPH-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000295806358	529504178	/nfs/dbraw/zinc/50/41/78/529504178.db2.gz	WKWJCSZBFQOOTH-JTQLQIEISA-N	1	1	313.329	1.765	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCOC[C@@H]2C2CC2)c1	ZINC000090009592	185276815	/nfs/dbraw/zinc/27/68/15/185276815.db2.gz	KBSJGODASNMMGR-GDBMZVCRSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCOC[C@@H]2C2CC2)c1	ZINC000090009592	185276816	/nfs/dbraw/zinc/27/68/16/185276816.db2.gz	KBSJGODASNMMGR-GDBMZVCRSA-N	1	1	322.361	1.445	20	5		DDBDMO
CNC(=O)NC(=O)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451554112	529880024	/nfs/dbraw/zinc/88/00/24/529880024.db2.gz	ZHMXVQSFMLUHTA-LBPRGKRZSA-N	1	1	320.349	1.230	20	5		DDBDMO
CNC(=O)NC(=O)C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451554112	529880025	/nfs/dbraw/zinc/88/00/25/529880025.db2.gz	ZHMXVQSFMLUHTA-LBPRGKRZSA-N	1	1	320.349	1.230	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000108339287	185507203	/nfs/dbraw/zinc/50/72/03/185507203.db2.gz	JKWZVHJSGZOIHU-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
COc1cc(C[NH2+]C[C@@H](O)C(F)(F)F)c([N+](=O)[O-])cc1OC	ZINC000616487294	362721490	/nfs/dbraw/zinc/72/14/90/362721490.db2.gz	PZDBZHNQVAQMTR-LLVKDONJSA-N	1	1	324.255	1.625	20	5		DDBDMO
CNC(=O)[C@@H](CCSC)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000342301325	282545371	/nfs/dbraw/zinc/54/53/71/282545371.db2.gz	XWRPMPAFYVYFTC-GFCCVEGCSA-N	1	1	315.370	1.691	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000358406306	299143841	/nfs/dbraw/zinc/14/38/41/299143841.db2.gz	CWWGJYUZEAZYNL-LLVKDONJSA-N	1	1	307.325	1.629	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748436	215111417	/nfs/dbraw/zinc/11/14/17/215111417.db2.gz	LEEKUTLAUHXQLY-FZMZJTMJSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748436	215111420	/nfs/dbraw/zinc/11/14/20/215111420.db2.gz	LEEKUTLAUHXQLY-FZMZJTMJSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000272606282	210004620	/nfs/dbraw/zinc/00/46/20/210004620.db2.gz	JRFRMVBCCCPRSP-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000564644025	304005791	/nfs/dbraw/zinc/00/57/91/304005791.db2.gz	KKLIKORSSRBBFK-CQSZACIVSA-N	1	1	310.329	1.438	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000358466567	299162222	/nfs/dbraw/zinc/16/22/22/299162222.db2.gz	XROBKILXXXNTNF-OAHLLOKOSA-N	1	1	322.365	1.400	20	5		DDBDMO
CNC(=O)OC[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000287101220	219314348	/nfs/dbraw/zinc/31/43/48/219314348.db2.gz	XTVTYGGCSSRBAB-NSHDSACASA-N	1	1	311.342	1.002	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000601228593	358456113	/nfs/dbraw/zinc/45/61/13/358456113.db2.gz	PTENOFXBZLEVRB-UHFFFAOYSA-N	1	1	320.349	1.086	20	5		DDBDMO
C[N@H+]1CCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000601228593	358456116	/nfs/dbraw/zinc/45/61/16/358456116.db2.gz	PTENOFXBZLEVRB-UHFFFAOYSA-N	1	1	320.349	1.086	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@@H](C)O	ZINC000159546821	186126185	/nfs/dbraw/zinc/12/61/85/186126185.db2.gz	DMASRMZUCHSRBC-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
Cc1ccnc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c1[N+](=O)[O-]	ZINC000265146243	186340078	/nfs/dbraw/zinc/34/00/78/186340078.db2.gz	ABOSTBCAKNVYCO-LLVKDONJSA-N	1	1	307.354	1.050	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000287204790	219378773	/nfs/dbraw/zinc/37/87/73/219378773.db2.gz	DRULXQAALMMHOK-GFCCVEGCSA-N	1	1	309.366	1.650	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000601251247	358463905	/nfs/dbraw/zinc/46/39/05/358463905.db2.gz	YGYKJCHRJYDYKP-UONOGXRCSA-N	1	1	305.378	1.984	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)cn1	ZINC000027214974	352215393	/nfs/dbraw/zinc/21/53/93/352215393.db2.gz	JZAPKESIJOEODJ-AWEZNQCLSA-N	1	1	320.349	1.200	20	5		DDBDMO
O=C(NCC1([NH+]2CCSCC2)CCCC1)[C@H]1CC1[N+](=O)[O-]	ZINC000044521419	352387522	/nfs/dbraw/zinc/38/75/22/352387522.db2.gz	FNIXITJXMUASFJ-RYUDHWBXSA-N	1	1	313.423	1.129	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000067360815	353045518	/nfs/dbraw/zinc/04/55/18/353045518.db2.gz	KPTBXFIEPGQNKN-XHSDSOJGSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000067360815	353045519	/nfs/dbraw/zinc/04/55/19/353045519.db2.gz	KPTBXFIEPGQNKN-XHSDSOJGSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000067360815	353045520	/nfs/dbraw/zinc/04/55/20/353045520.db2.gz	KPTBXFIEPGQNKN-XHSDSOJGSA-N	1	1	317.389	1.823	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000068433597	353111461	/nfs/dbraw/zinc/11/14/61/353111461.db2.gz	SVWVAVAVAQDNFU-NSHDSACASA-N	1	1	320.353	1.139	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000174285266	198314373	/nfs/dbraw/zinc/31/43/73/198314373.db2.gz	FRZJXCDJLKYKBR-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)on1	ZINC000075640528	353373413	/nfs/dbraw/zinc/37/34/13/353373413.db2.gz	YZVOIEBLZPHMMN-QWHCGFSZSA-N	1	1	321.337	1.286	20	5		DDBDMO
CN(CC(=O)NC[C@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000080127674	353592575	/nfs/dbraw/zinc/59/25/75/353592575.db2.gz	UNFDVFSHWBCPIZ-CYBMUJFWSA-N	1	1	320.393	1.489	20	5		DDBDMO
Cc1cc(N2CCN(c3ccc(N)[nH+]c3)CC2)ncc1[N+](=O)[O-]	ZINC000080599957	353617363	/nfs/dbraw/zinc/61/73/63/353617363.db2.gz	QHVIKIQRMXZTST-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000093333332	353895955	/nfs/dbraw/zinc/89/59/55/353895955.db2.gz	RBIXKICKSSNGLK-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000093333332	353895956	/nfs/dbraw/zinc/89/59/56/353895956.db2.gz	RBIXKICKSSNGLK-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+](C[C@@H]2CCOC2)CC1	ZINC000093817326	353905866	/nfs/dbraw/zinc/90/58/66/353905866.db2.gz	VNMNNKDNQAUPFY-ZDUSSCGKSA-N	1	1	321.377	1.455	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@H](O)CN2CCOCC2)cc1[N+](=O)[O-]	ZINC000093583316	353902704	/nfs/dbraw/zinc/90/27/04/353902704.db2.gz	DBXZYOZVTUAGHG-HNNXBMFYSA-N	1	1	323.393	1.028	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739776	354201238	/nfs/dbraw/zinc/20/12/38/354201238.db2.gz	DYOOXXGQBNOPRR-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000153739776	354201240	/nfs/dbraw/zinc/20/12/40/354201240.db2.gz	DYOOXXGQBNOPRR-SMDDNHRTSA-N	1	1	322.365	1.744	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H](CCO)C2)c([N+](=O)[O-])c1	ZINC000314064296	354482949	/nfs/dbraw/zinc/48/29/49/354482949.db2.gz	RQMLMKIHLJVJPA-LLVKDONJSA-N	1	1	307.350	1.288	20	5		DDBDMO
CCOc1cc(N2CCO[C@@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000585783577	354842200	/nfs/dbraw/zinc/84/22/00/354842200.db2.gz	BDAHJNKVCRXLMR-LSDHHAIUSA-N	1	1	321.377	1.903	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589501395	354996847	/nfs/dbraw/zinc/99/68/47/354996847.db2.gz	MCZJCTLCURQFCA-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589501395	354996851	/nfs/dbraw/zinc/99/68/51/354996851.db2.gz	MCZJCTLCURQFCA-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1F	ZINC000590631951	355135010	/nfs/dbraw/zinc/13/50/10/355135010.db2.gz	LCDCKRZXBDGCBG-SECBINFHSA-N	1	1	311.313	1.567	20	5		DDBDMO
CCCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C)C1	ZINC000592833239	355708028	/nfs/dbraw/zinc/70/80/28/355708028.db2.gz	XKDAVOJZALXMDM-AWEZNQCLSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593413592	355877868	/nfs/dbraw/zinc/87/78/68/355877868.db2.gz	FFJUYHNPRHVWTG-UHFFFAOYSA-N	1	1	320.324	1.988	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2C[NH+](C[C@@]3(O)CCCOC3)C2)cc1	ZINC000594714281	356294019	/nfs/dbraw/zinc/29/40/19/356294019.db2.gz	LXXXJDYRGOSXQL-HNNXBMFYSA-N	1	1	308.334	1.199	20	5		DDBDMO
Cc1noc(C[N@H+](CCO)CCc2ccccc2)c1[N+](=O)[O-]	ZINC000595317198	356446468	/nfs/dbraw/zinc/44/64/68/356446468.db2.gz	FVTUMHUKNNSIEO-UHFFFAOYSA-N	1	1	305.334	1.928	20	5		DDBDMO
Cc1noc(C[N@@H+](CCO)CCc2ccccc2)c1[N+](=O)[O-]	ZINC000595317198	356446474	/nfs/dbraw/zinc/44/64/74/356446474.db2.gz	FVTUMHUKNNSIEO-UHFFFAOYSA-N	1	1	305.334	1.928	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000081519135	192277904	/nfs/dbraw/zinc/27/79/04/192277904.db2.gz	ZIRMKDXYAXURSF-ZFWWWQNUSA-N	1	1	324.377	1.693	20	5		DDBDMO
CCOC[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000081520576	192278884	/nfs/dbraw/zinc/27/88/84/192278884.db2.gz	ZTFPTVMSBNNCOZ-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000081520576	192278885	/nfs/dbraw/zinc/27/88/85/192278885.db2.gz	ZTFPTVMSBNNCOZ-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000081556683	192290824	/nfs/dbraw/zinc/29/08/24/192290824.db2.gz	XESUDVFLGSKCDT-QWRGUYRKSA-N	1	1	322.365	1.236	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595757043	356638796	/nfs/dbraw/zinc/63/87/96/356638796.db2.gz	LJOBUPVWQCGXJP-ZIBATOQPSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595757043	356638801	/nfs/dbraw/zinc/63/88/01/356638801.db2.gz	LJOBUPVWQCGXJP-ZIBATOQPSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2	ZINC000595760625	356642028	/nfs/dbraw/zinc/64/20/28/356642028.db2.gz	UWYPFBDHFMEFMV-XJKSGUPXSA-N	1	1	320.345	1.930	20	5		DDBDMO
O=C(CC[N@H+]1CCC2(COC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595833518	356670167	/nfs/dbraw/zinc/67/01/67/356670167.db2.gz	LWTVIDGPZAOUDH-UHFFFAOYSA-N	1	1	305.334	1.646	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H]2COC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000595829512	356666657	/nfs/dbraw/zinc/66/66/57/356666657.db2.gz	IGDDJANBBURVBU-OLZOCXBDSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H]2COC[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595828155	356666846	/nfs/dbraw/zinc/66/68/46/356666846.db2.gz	UVRPHTWSXSOHRE-QWHCGFSZSA-N	1	1	319.361	1.892	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595877534	356688635	/nfs/dbraw/zinc/68/86/35/356688635.db2.gz	UYMUJAUPTGUPTE-LRDDRELGSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595877534	356688638	/nfs/dbraw/zinc/68/86/38/356688638.db2.gz	UYMUJAUPTGUPTE-LRDDRELGSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000595864794	356682851	/nfs/dbraw/zinc/68/28/51/356682851.db2.gz	COPPYBRTINYIRR-ZDUSSCGKSA-N	1	1	323.368	1.765	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)C[C@H](C)C(=O)NC)ccc1[N+](=O)[O-]	ZINC000276914505	213173158	/nfs/dbraw/zinc/17/31/58/213173158.db2.gz	NZJXXQAJMTUHCX-NSHDSACASA-N	1	1	309.366	1.807	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC([N@H+]3CCCOCC3)CC2)nc1	ZINC000596268650	356838709	/nfs/dbraw/zinc/83/87/09/356838709.db2.gz	NPJUGDNEVDTDMK-UHFFFAOYSA-N	1	1	307.354	1.076	20	5		DDBDMO
Cc1cc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000596538585	356911246	/nfs/dbraw/zinc/91/12/46/356911246.db2.gz	MKUYIJPVJBPUKU-HNNXBMFYSA-N	1	1	305.378	1.939	20	5		DDBDMO
Nc1c(F)c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000596538492	356911454	/nfs/dbraw/zinc/91/14/54/356911454.db2.gz	LFRPZLWVTAJDFK-LLVKDONJSA-N	1	1	324.356	1.352	20	5		DDBDMO
C[NH2+]C[C@H]1CCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237258409	202208031	/nfs/dbraw/zinc/20/80/31/202208031.db2.gz	YEQZPKHDFGSMRS-SNVBAGLBSA-N	1	1	303.322	1.295	20	5		DDBDMO
C[NH+]1CCN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)CC1	ZINC000597094835	357059155	/nfs/dbraw/zinc/05/91/55/357059155.db2.gz	SRSVQNHAKVQDOE-UHFFFAOYSA-N	1	1	313.745	1.610	20	5		DDBDMO
C[N@H+]1CC[C@]2(C1)CCCN(C(=O)c1cccc([N+](=O)[O-])c1N)C2	ZINC000597716644	357300138	/nfs/dbraw/zinc/30/01/38/357300138.db2.gz	RAJXVZFYIVNQSF-INIZCTEOSA-N	1	1	318.377	1.735	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000597857683	357359895	/nfs/dbraw/zinc/35/98/95/357359895.db2.gz	IWXXRGVXQHZTPO-SNVBAGLBSA-N	1	1	308.338	1.298	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597924824	357384462	/nfs/dbraw/zinc/38/44/62/357384462.db2.gz	LDARTJPONZYGMO-GFCCVEGCSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597926259	357385253	/nfs/dbraw/zinc/38/52/53/357385253.db2.gz	WYGICCFJOROFKG-NSHDSACASA-N	1	1	306.366	1.901	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000598747073	357713815	/nfs/dbraw/zinc/71/38/15/357713815.db2.gz	VLLRTFUFDZCMRX-VIFPVBQESA-N	1	1	308.338	1.298	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000598714064	357700788	/nfs/dbraw/zinc/70/07/88/357700788.db2.gz	FIOWTXGWDFOTGB-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2C[C@@H](CO)[C@H](CO)C2)c(Cl)c1	ZINC000599531116	357964738	/nfs/dbraw/zinc/96/47/38/357964738.db2.gz	IXHCRSNTSNJYPH-QWRGUYRKSA-N	1	1	300.742	1.281	20	5		DDBDMO
C[C@@H]1CC(F)(F)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000599621812	357995118	/nfs/dbraw/zinc/99/51/18/357995118.db2.gz	GMMIYEWWQGWWLA-SNVBAGLBSA-N	1	1	301.293	1.876	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCCC2)c1[N+](=O)[O-]	ZINC000600227489	358162515	/nfs/dbraw/zinc/16/25/15/358162515.db2.gz	DBHRLEXFSZGEKG-LBPRGKRZSA-N	1	1	321.381	1.763	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601137121	358416886	/nfs/dbraw/zinc/41/68/86/358416886.db2.gz	TVBJAUHYINMSQL-YUMQZZPRSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601137121	358416888	/nfs/dbraw/zinc/41/68/88/358416888.db2.gz	TVBJAUHYINMSQL-YUMQZZPRSA-N	1	1	321.303	1.876	20	5		DDBDMO
CN(C)C(=O)NCCN(C)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601136466	358416911	/nfs/dbraw/zinc/41/69/11/358416911.db2.gz	FELYYWGEZIMWFY-UHFFFAOYSA-N	1	1	317.349	1.850	20	5		DDBDMO
C[C@H](O)[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601176306	358434879	/nfs/dbraw/zinc/43/48/79/358434879.db2.gz	USUQYTQOSAPINB-BONVTDFDSA-N	1	1	303.318	1.729	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000181139005	199256627	/nfs/dbraw/zinc/25/66/27/199256627.db2.gz	WVDVXQVBYOHAPU-LBPRGKRZSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)CN1CCN(C)CC1	ZINC000602541898	359035204	/nfs/dbraw/zinc/03/52/04/359035204.db2.gz	SBSBZPXZGAVSIR-HNNXBMFYSA-N	1	1	320.437	1.610	20	5		DDBDMO
C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CN(C)CCO1	ZINC000602575403	359051382	/nfs/dbraw/zinc/05/13/82/359051382.db2.gz	HJBNSAKSFUQUQE-YGRLFVJLSA-N	1	1	320.349	1.545	20	5		DDBDMO
CN(C)C(=O)C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1	ZINC000602592383	359059894	/nfs/dbraw/zinc/05/98/94/359059894.db2.gz	DUMNFSXJYJZDDY-UHFFFAOYSA-N	1	1	322.184	1.597	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1cnn(C)c1)CC(C)C	ZINC000602839424	359228785	/nfs/dbraw/zinc/22/87/85/359228785.db2.gz	FCSRCNHHCRCBDT-UHFFFAOYSA-N	1	1	320.397	1.991	20	5		DDBDMO
CS[C@H]1C[N@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000602797268	359198955	/nfs/dbraw/zinc/19/89/55/359198955.db2.gz	IBPQQAYJLGVXTI-NEPJUHHUSA-N	1	1	313.427	1.077	20	5		DDBDMO
CS[C@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1N(C)C	ZINC000602797268	359198960	/nfs/dbraw/zinc/19/89/60/359198960.db2.gz	IBPQQAYJLGVXTI-NEPJUHHUSA-N	1	1	313.427	1.077	20	5		DDBDMO
COC[C@@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccc(C)o1	ZINC000602808695	359205615	/nfs/dbraw/zinc/20/56/15/359205615.db2.gz	YUJRQOCGRWJSDJ-GFCCVEGCSA-N	1	1	308.338	1.978	20	5		DDBDMO
C[N@H+]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C(C)(C)C	ZINC000602873790	359257118	/nfs/dbraw/zinc/25/71/18/359257118.db2.gz	LICVFUASNVVYBI-CQSZACIVSA-N	1	1	322.409	1.419	20	5		DDBDMO
Cn1cc(CN2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)c([N+](=O)[O-])n1	ZINC000603430799	359635653	/nfs/dbraw/zinc/63/56/53/359635653.db2.gz	VAIXNJCVJXTNOS-BFHYXJOUSA-N	1	1	323.397	1.189	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000187123629	200064820	/nfs/dbraw/zinc/06/48/20/200064820.db2.gz	VWIIABPBVOHXGG-MWLCHTKSSA-N	1	1	308.338	1.250	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(CC)CCC[NH+](C)C)c1[N+](=O)[O-]	ZINC000188956483	200326830	/nfs/dbraw/zinc/32/68/30/200326830.db2.gz	DDYJPWPGYBNOBO-UHFFFAOYSA-N	1	1	311.386	1.684	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1	ZINC000609797419	360350981	/nfs/dbraw/zinc/35/09/81/360350981.db2.gz	ZLKBVHZKVKHWFZ-AWEZNQCLSA-N	1	1	305.382	1.206	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC[C@H]2c2cccc(F)c2)c1	ZINC000610504990	360455364	/nfs/dbraw/zinc/45/53/64/360455364.db2.gz	PSJITOCUXNSNOU-GJZGRUSLSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H]2c2cccc(F)c2)c1	ZINC000610504990	360455369	/nfs/dbraw/zinc/45/53/69/360455369.db2.gz	PSJITOCUXNSNOU-GJZGRUSLSA-N	1	1	320.324	1.738	20	5		DDBDMO
CO[C@@H]1CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611258805	360680566	/nfs/dbraw/zinc/68/05/66/360680566.db2.gz	OOSOTWZSHYFJNR-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611258805	360680568	/nfs/dbraw/zinc/68/05/68/360680568.db2.gz	OOSOTWZSHYFJNR-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611273136	360686944	/nfs/dbraw/zinc/68/69/44/360686944.db2.gz	ZXUJJOKANWSGCQ-HNNXBMFYSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611273136	360686947	/nfs/dbraw/zinc/68/69/47/360686947.db2.gz	ZXUJJOKANWSGCQ-HNNXBMFYSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[N@H+]2CCN1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000611201348	360657623	/nfs/dbraw/zinc/65/76/23/360657623.db2.gz	UAPCPWTVCHOIQV-DOMZBBRYSA-N	1	1	318.377	1.162	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CC[C@@H](O)[C@@H]3C2)c2c(c1)COCO2	ZINC000612134113	360928332	/nfs/dbraw/zinc/92/83/32/360928332.db2.gz	GSJRKLHXOVSRQX-COLVAYQJSA-N	1	1	320.345	1.664	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H](O)C12CCCC2)Nc1ccccc1[N+](=O)[O-]	ZINC000292708133	223210981	/nfs/dbraw/zinc/21/09/81/223210981.db2.gz	LGJROIAMPJQDQT-AWEZNQCLSA-N	1	1	319.361	1.913	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H](O)C12CCCC2)Nc1ccccc1[N+](=O)[O-]	ZINC000292708133	223210984	/nfs/dbraw/zinc/21/09/84/223210984.db2.gz	LGJROIAMPJQDQT-AWEZNQCLSA-N	1	1	319.361	1.913	20	5		DDBDMO
C[C@H]1CCNC(=O)[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000193567027	201076367	/nfs/dbraw/zinc/07/63/67/201076367.db2.gz	CHLSMWBPIZPQFM-ZANVPECISA-N	1	1	321.333	1.076	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000618868831	363780230	/nfs/dbraw/zinc/78/02/30/363780230.db2.gz	KPWCOCQJMMVFRT-CYBMUJFWSA-N	1	1	321.381	1.439	20	5		DDBDMO
CNC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000193649026	201095042	/nfs/dbraw/zinc/09/50/42/201095042.db2.gz	SPZIKOHFMRAPBG-UHFFFAOYSA-N	1	1	322.321	1.461	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516994	364047798	/nfs/dbraw/zinc/04/77/98/364047798.db2.gz	SRJUTHBBAUVZFU-ZWNOBZJWSA-N	1	1	321.333	1.708	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000619516994	364047802	/nfs/dbraw/zinc/04/78/02/364047802.db2.gz	SRJUTHBBAUVZFU-ZWNOBZJWSA-N	1	1	321.333	1.708	20	5		DDBDMO
C[N@H+](CCCCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000349935563	284110645	/nfs/dbraw/zinc/11/06/45/284110645.db2.gz	NXIUKSWZIYYRJI-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
C[N@@H+](CCCCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000349935563	284110647	/nfs/dbraw/zinc/11/06/47/284110647.db2.gz	NXIUKSWZIYYRJI-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
C[C@H](c1cccnc1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000093228079	193219051	/nfs/dbraw/zinc/21/90/51/193219051.db2.gz	DOUOGPNHURWRFK-GFCCVEGCSA-N	1	1	302.334	1.845	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+](C)C1	ZINC000264671174	204066437	/nfs/dbraw/zinc/06/64/37/204066437.db2.gz	YKVUFCCVKGCPLV-NSHDSACASA-N	1	1	306.366	1.342	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000264763363	204138493	/nfs/dbraw/zinc/13/84/93/204138493.db2.gz	MWVPVVXMRUVCBE-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(c2ncc(C)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000271723584	209157244	/nfs/dbraw/zinc/15/72/44/209157244.db2.gz	RYROYRSNKPLISA-GFCCVEGCSA-N	1	1	322.365	1.372	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ncc(C)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000271723584	209157247	/nfs/dbraw/zinc/15/72/47/209157247.db2.gz	RYROYRSNKPLISA-GFCCVEGCSA-N	1	1	322.365	1.372	20	5		DDBDMO
CC(C)Oc1nc(N2CCC[N@@H+](CCO)CC2)ccc1[N+](=O)[O-]	ZINC000566808049	304183074	/nfs/dbraw/zinc/18/30/74/304183074.db2.gz	ZFJXXYJULHHHJX-UHFFFAOYSA-N	1	1	324.381	1.281	20	5		DDBDMO
Cc1cnc(N2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)s1	ZINC000267478080	206096946	/nfs/dbraw/zinc/09/69/46/206096946.db2.gz	ZZNPUDRDFVJMGI-UHFFFAOYSA-N	1	1	322.394	1.378	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000334075898	249206051	/nfs/dbraw/zinc/20/60/51/249206051.db2.gz	CRUROQPVJLBCGG-QWRGUYRKSA-N	1	1	307.350	1.816	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000268245212	206574986	/nfs/dbraw/zinc/57/49/86/206574986.db2.gz	VYBAKZSZCWKZTC-CABZTGNLSA-N	1	1	321.381	1.483	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000104970161	194060206	/nfs/dbraw/zinc/06/02/06/194060206.db2.gz	LBEMAIGDMBVNOY-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)NC[C@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000411476558	223856726	/nfs/dbraw/zinc/85/67/26/223856726.db2.gz	BXFANZRKSKCEJC-VXGBXAGGSA-N	1	1	307.350	1.541	20	5		DDBDMO
O=C(NC[C@H](c1ccco1)[NH+]1CCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC000285077622	218282377	/nfs/dbraw/zinc/28/23/77/218282377.db2.gz	RUCPQXRSHYCBEH-LLVKDONJSA-N	1	1	319.321	1.478	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCO[C@@]3(CCCOC3)C2)c1	ZINC000285354056	218393297	/nfs/dbraw/zinc/39/32/97/218393297.db2.gz	PVNISZSBGHKUIP-INIZCTEOSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCO[C@@]3(CCCOC3)C2)c1	ZINC000285354056	218393299	/nfs/dbraw/zinc/39/32/99/218393299.db2.gz	PVNISZSBGHKUIP-INIZCTEOSA-N	1	1	322.361	1.855	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000057712000	184048544	/nfs/dbraw/zinc/04/85/44/184048544.db2.gz	JNVXCUSLWFWLCT-SECBINFHSA-N	1	1	322.321	1.716	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269104747	207243735	/nfs/dbraw/zinc/24/37/35/207243735.db2.gz	BLXKJRCGHSHNLZ-NEPJUHHUSA-N	1	1	321.381	1.193	20	5		DDBDMO
C[NH+](C)C1(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CCOCC1	ZINC000269169631	207291689	/nfs/dbraw/zinc/29/16/89/207291689.db2.gz	HFCRZVRIPOXBFN-UHFFFAOYSA-N	1	1	323.349	1.141	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(N3CC[N@H+]4CCC[C@H]4C3)n2)cc1	ZINC000486955871	285106945	/nfs/dbraw/zinc/10/69/45/285106945.db2.gz	MDKIUHFPLHVWCB-ZDUSSCGKSA-N	1	1	315.333	1.929	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288614038	220290425	/nfs/dbraw/zinc/29/04/25/220290425.db2.gz	XHIYPXYBKWDFDG-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000272994087	210373188	/nfs/dbraw/zinc/37/31/88/210373188.db2.gz	QJPWEGMZMBLCHK-SNVBAGLBSA-N	1	1	321.381	1.651	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCCO1	ZINC000272969448	210352397	/nfs/dbraw/zinc/35/23/97/210352397.db2.gz	BETPXVWPUCPMJR-UONOGXRCSA-N	1	1	324.377	1.835	20	5		DDBDMO
CN(CC1CC1)C(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352545012	285130171	/nfs/dbraw/zinc/13/01/71/285130171.db2.gz	UTLXKDHLLDSMHA-UHFFFAOYSA-N	1	1	305.378	1.938	20	5		DDBDMO
CN(CC1CC1)C(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352545012	285130173	/nfs/dbraw/zinc/13/01/73/285130173.db2.gz	UTLXKDHLLDSMHA-UHFFFAOYSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[N@H+]([C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)[C@@H]1CCC[C@@H]1O	ZINC000352668259	285211199	/nfs/dbraw/zinc/21/11/99/285211199.db2.gz	QQJFICOFDACSCV-KFWWJZLASA-N	1	1	319.361	1.545	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC1(F)F	ZINC000289783090	221222698	/nfs/dbraw/zinc/22/26/98/221222698.db2.gz	LVOHORSOVGMZFO-ONGXEEELSA-N	1	1	304.297	1.129	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCCC[N@@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000299435448	533665584	/nfs/dbraw/zinc/66/55/84/533665584.db2.gz	GXEJNFBXRKWARZ-LLVKDONJSA-N	1	1	323.397	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+]C[C@H]2C)cc1C	ZINC000054371044	291992275	/nfs/dbraw/zinc/99/22/75/291992275.db2.gz	SZVGLQHGXZIALG-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)[C@@H](C)C1	ZINC000568411612	304292423	/nfs/dbraw/zinc/29/24/23/304292423.db2.gz	WGLXCJUVSLFVJF-PHIMTYICSA-N	1	1	321.381	1.586	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(CO)CC1	ZINC000071955886	406870506	/nfs/dbraw/zinc/87/05/06/406870506.db2.gz	BFUSLIQCKUQGRC-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H]3CO)o2)cc1	ZINC000101727188	407315017	/nfs/dbraw/zinc/31/50/17/407315017.db2.gz	JYWNFYRVJQDSAI-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3CO)o2)cc1	ZINC000101727188	407315018	/nfs/dbraw/zinc/31/50/18/407315018.db2.gz	JYWNFYRVJQDSAI-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@H]1C[C@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123564729	407332694	/nfs/dbraw/zinc/33/26/94/407332694.db2.gz	GJSITHFXAWWXOF-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCCCNC1=O	ZINC000105612116	407354950	/nfs/dbraw/zinc/35/49/50/407354950.db2.gz	NDGJYZRCLCWWTE-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C(N)=O)C(C)(C)C	ZINC000109331386	407397871	/nfs/dbraw/zinc/39/78/71/407397871.db2.gz	YURJKWJLLUUQOS-ZDUSSCGKSA-N	1	1	322.365	1.331	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000271075376	407503441	/nfs/dbraw/zinc/50/34/41/407503441.db2.gz	GQCPYZXXGJRMEK-JTQLQIEISA-N	1	1	324.333	1.607	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000271075376	407503446	/nfs/dbraw/zinc/50/34/46/407503446.db2.gz	GQCPYZXXGJRMEK-JTQLQIEISA-N	1	1	324.333	1.607	20	5		DDBDMO
O=C(C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)N1CCC1	ZINC000266617664	407579714	/nfs/dbraw/zinc/57/97/14/407579714.db2.gz	YLPFBWWBKSVLRS-UHFFFAOYSA-N	1	1	319.361	1.670	20	5		DDBDMO
[NH3+][C@@H]1CCCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000128241517	407513612	/nfs/dbraw/zinc/51/36/12/407513612.db2.gz	DHEOLCPTHUYDRB-ZYHUDNBSSA-N	1	1	303.322	1.471	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000178780323	407599230	/nfs/dbraw/zinc/59/92/30/407599230.db2.gz	FHUVDBOOGVKANM-IUODEOHRSA-N	1	1	319.361	1.668	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000152327503	407611658	/nfs/dbraw/zinc/61/16/58/407611658.db2.gz	ZVVCXZNXDOLNSV-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000152615024	407660668	/nfs/dbraw/zinc/66/06/68/407660668.db2.gz	OLIPCNNFLYFPHV-NSHDSACASA-N	1	1	309.341	1.687	20	5		DDBDMO
C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H](C[NH3+])C1	ZINC000261729546	407592723	/nfs/dbraw/zinc/59/27/23/407592723.db2.gz	HOENHBNUUQHUBQ-GXSJLCMTSA-N	1	1	317.349	1.671	20	5		DDBDMO
CN1CCN(CCn2cc([N+](=O)[O-])ccc2=O)c2ccc[nH+]c21	ZINC000272281752	407846878	/nfs/dbraw/zinc/84/68/78/407846878.db2.gz	QNBYKRYSNZHUAS-UHFFFAOYSA-N	1	1	315.333	1.108	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000268216220	407951449	/nfs/dbraw/zinc/95/14/49/407951449.db2.gz	PNXGBLYEUFLPCL-JOYOIKCWSA-N	1	1	304.350	1.390	20	5		DDBDMO
Cc1c(C[N@@H+](C)CCCN2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000174714733	407982448	/nfs/dbraw/zinc/98/24/48/407982448.db2.gz	VZRGYHJDBASIKZ-UHFFFAOYSA-N	1	1	320.437	1.973	20	5		DDBDMO
Cc1c(C[N@H+](C)CCCN2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000174714733	407982459	/nfs/dbraw/zinc/98/24/59/407982459.db2.gz	VZRGYHJDBASIKZ-UHFFFAOYSA-N	1	1	320.437	1.973	20	5		DDBDMO
CC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@H](O)C(F)(F)F	ZINC000189476119	408029430	/nfs/dbraw/zinc/02/94/30/408029430.db2.gz	BUADHIKBPRBBMN-JTQLQIEISA-N	1	1	323.271	1.002	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@H](O)C(F)(F)F	ZINC000189476119	408029434	/nfs/dbraw/zinc/02/94/34/408029434.db2.gz	BUADHIKBPRBBMN-JTQLQIEISA-N	1	1	323.271	1.002	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCOC2(CCOCC2)C1	ZINC000135613783	408041621	/nfs/dbraw/zinc/04/16/21/408041621.db2.gz	MLAUBACBTUWCLV-UHFFFAOYSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCOC2(CCOCC2)C1	ZINC000135613783	408041629	/nfs/dbraw/zinc/04/16/29/408041629.db2.gz	MLAUBACBTUWCLV-UHFFFAOYSA-N	1	1	322.361	1.855	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591209	407997651	/nfs/dbraw/zinc/99/76/51/407997651.db2.gz	PMDGNDQFXFRXSX-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591209	407997657	/nfs/dbraw/zinc/99/76/57/407997657.db2.gz	PMDGNDQFXFRXSX-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000272672219	408009320	/nfs/dbraw/zinc/00/93/20/408009320.db2.gz	TYOQGPOYXPPVKK-QWRGUYRKSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3CC[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000272672219	408009327	/nfs/dbraw/zinc/00/93/27/408009327.db2.gz	TYOQGPOYXPPVKK-QWRGUYRKSA-N	1	1	321.381	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000272672219	408009333	/nfs/dbraw/zinc/00/93/33/408009333.db2.gz	TYOQGPOYXPPVKK-QWRGUYRKSA-N	1	1	321.381	1.608	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000245750654	408060480	/nfs/dbraw/zinc/06/04/80/408060480.db2.gz	TYMIEASKASKGFI-DGCLKSJQSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNc2ncc([N+](=O)[O-])cn2)C[C@@H](C)O1	ZINC000273138610	408076703	/nfs/dbraw/zinc/07/67/03/408076703.db2.gz	DIUHYVKXVPUMPY-GHMZBOCLSA-N	1	1	309.370	1.685	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000121246408	408171124	/nfs/dbraw/zinc/17/11/24/408171124.db2.gz	JFAWDLMMMDJZQS-WFASDCNBSA-N	1	1	305.378	1.936	20	5		DDBDMO
CN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@@H+](C)C1	ZINC000151105422	408256107	/nfs/dbraw/zinc/25/61/07/408256107.db2.gz	AKIAJQADTDQWAD-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[N@@H+](C)C1	ZINC000151105422	408256120	/nfs/dbraw/zinc/25/61/20/408256120.db2.gz	AKIAJQADTDQWAD-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000263682052	408203791	/nfs/dbraw/zinc/20/37/91/408203791.db2.gz	FOZPCMUDMVCLIR-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000263711206	408216991	/nfs/dbraw/zinc/21/69/91/408216991.db2.gz	NECWVKLFSBMANW-VIFPVBQESA-N	1	1	307.306	1.604	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000263711206	408216995	/nfs/dbraw/zinc/21/69/95/408216995.db2.gz	NECWVKLFSBMANW-VIFPVBQESA-N	1	1	307.306	1.604	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000246371195	408234782	/nfs/dbraw/zinc/23/47/82/408234782.db2.gz	LVUMSQJTJSQXSU-GHMZBOCLSA-N	1	1	323.349	1.663	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)c(OC)c1	ZINC000176193088	408304189	/nfs/dbraw/zinc/30/41/89/408304189.db2.gz	HZWQZNBVONPQKD-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183220987	408358153	/nfs/dbraw/zinc/35/81/53/408358153.db2.gz	RSAYSIBWSYZCBR-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183220987	408358163	/nfs/dbraw/zinc/35/81/63/408358163.db2.gz	RSAYSIBWSYZCBR-WDEREUQCSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000274505625	408432668	/nfs/dbraw/zinc/43/26/68/408432668.db2.gz	PZGDAKWDDVMJFT-GFCCVEGCSA-N	1	1	306.366	1.780	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000264477034	408507728	/nfs/dbraw/zinc/50/77/28/408507728.db2.gz	HFHMAWUWEDMDIC-GFCCVEGCSA-N	1	1	323.349	1.054	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@@H](OCCO)C3)nc2c1	ZINC000177079050	408513111	/nfs/dbraw/zinc/51/31/11/408513111.db2.gz	PTPUEOAHFGCKQX-GFCCVEGCSA-N	1	1	321.333	1.709	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H](OCCO)C3)nc2c1	ZINC000177079050	408513115	/nfs/dbraw/zinc/51/31/15/408513115.db2.gz	PTPUEOAHFGCKQX-GFCCVEGCSA-N	1	1	321.333	1.709	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c1	ZINC000275432670	408587446	/nfs/dbraw/zinc/58/74/46/408587446.db2.gz	FABGEWJWSNHHFD-GFCCVEGCSA-N	1	1	323.393	1.885	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)[C@H]2CSC[NH2+]2)c([N+](=O)[O-])c1	ZINC000161541186	408613165	/nfs/dbraw/zinc/61/31/65/408613165.db2.gz	ZCHKUMGFPPXHED-GFCCVEGCSA-N	1	1	324.406	1.484	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000270882010	408725727	/nfs/dbraw/zinc/72/57/27/408725727.db2.gz	KGILFXLFFMUKSD-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000270882010	408725733	/nfs/dbraw/zinc/72/57/33/408725733.db2.gz	KGILFXLFFMUKSD-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCO1	ZINC000250415618	408778578	/nfs/dbraw/zinc/77/85/78/408778578.db2.gz	AAESGRFUUFXDJT-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1N)c1ccco1	ZINC000178148431	408780342	/nfs/dbraw/zinc/78/03/42/408780342.db2.gz	VPPSDFZYAUNMST-GFCCVEGCSA-N	1	1	318.333	1.803	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C/c3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000192464307	163224445	/nfs/dbraw/zinc/22/44/45/163224445.db2.gz	HIUKNSOIEMBULV-DLPZHFSESA-N	1	1	301.346	1.628	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000281801880	408931706	/nfs/dbraw/zinc/93/17/06/408931706.db2.gz	KOORUCGYNOJQLZ-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)C[N@H+](C)C(C)C)c(N)c([N+](=O)[O-])c1	ZINC000291969498	408954132	/nfs/dbraw/zinc/95/41/32/408954132.db2.gz	SBMOYRIIYHFQSK-LLVKDONJSA-N	1	1	308.382	1.944	20	5		DDBDMO
Cc1cc(N2CC[C@@H]3OCC[N@H+](C)[C@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000292336546	409026063	/nfs/dbraw/zinc/02/60/63/409026063.db2.gz	BCPJIDISWIIAHN-GJZGRUSLSA-N	1	1	309.341	1.952	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000247051122	163539815	/nfs/dbraw/zinc/53/98/15/163539815.db2.gz	SOLKBCFSRANGBQ-WDEREUQCSA-N	1	1	323.349	1.663	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000278396873	409080465	/nfs/dbraw/zinc/08/04/65/409080465.db2.gz	KLLBGAVFSSVIRG-VIFPVBQESA-N	1	1	307.354	1.261	20	5		DDBDMO
CC[C@](C)(O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293314737	409087211	/nfs/dbraw/zinc/08/72/11/409087211.db2.gz	XFRFZVMZYHVTPN-INIZCTEOSA-N	1	1	321.377	1.514	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000287821946	409099181	/nfs/dbraw/zinc/09/91/81/409099181.db2.gz	KGLCXQVXCABPHW-SNVBAGLBSA-N	1	1	308.338	1.448	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)CN1	ZINC000278916326	409112239	/nfs/dbraw/zinc/11/22/39/409112239.db2.gz	QYMXWAANRKGXTH-HNNXBMFYSA-N	1	1	305.334	1.186	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000283456454	409159839	/nfs/dbraw/zinc/15/98/39/409159839.db2.gz	LHYHJXPHZJOFTG-SECBINFHSA-N	1	1	322.340	1.530	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NCCn2cc[nH+]c2C)c1	ZINC000283604137	409183886	/nfs/dbraw/zinc/18/38/86/409183886.db2.gz	YTFVBDATXJNAQM-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)CN1	ZINC000279364386	409199454	/nfs/dbraw/zinc/19/94/54/409199454.db2.gz	HKOHEUFVBHZWMF-LLCTXKFZSA-N	1	1	301.346	1.820	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000284195885	409293834	/nfs/dbraw/zinc/29/38/34/409293834.db2.gz	ZFXGDLQTEGTKKE-ZJUUUORDSA-N	1	1	324.356	1.871	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC[N@H+](C2CC2)C1	ZINC000295288999	409415335	/nfs/dbraw/zinc/41/53/35/409415335.db2.gz	IJICRUBTZSLBKM-SNVBAGLBSA-N	1	1	320.349	1.252	20	5		DDBDMO
Cc1cc(OCC(=O)NCC2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000280714275	409422373	/nfs/dbraw/zinc/42/23/73/409422373.db2.gz	COKLBJNHADGMTP-UHFFFAOYSA-N	1	1	319.361	1.660	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290684384	409485954	/nfs/dbraw/zinc/48/59/54/409485954.db2.gz	SUOMGKJCRMMDKA-WDEREUQCSA-N	1	1	321.381	1.621	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)n1	ZINC000331452801	409527211	/nfs/dbraw/zinc/52/72/11/409527211.db2.gz	XUBURZRITRORJU-LLVKDONJSA-N	1	1	321.381	1.558	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356725578	409552304	/nfs/dbraw/zinc/55/23/04/409552304.db2.gz	DVPQKZWTEPMYTC-GFCCVEGCSA-N	1	1	323.397	1.426	20	5		DDBDMO
CC(C)[N@H+](C)C[C@H](C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000356759109	409578616	/nfs/dbraw/zinc/57/86/16/409578616.db2.gz	GCSVZFBWGKJAMX-JTQLQIEISA-N	1	1	319.365	1.930	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000356759109	409578624	/nfs/dbraw/zinc/57/86/24/409578624.db2.gz	GCSVZFBWGKJAMX-JTQLQIEISA-N	1	1	319.365	1.930	20	5		DDBDMO
CC(C)[N@H+](C)C[C@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000356759109	409578627	/nfs/dbraw/zinc/57/86/27/409578627.db2.gz	GCSVZFBWGKJAMX-JTQLQIEISA-N	1	1	319.365	1.930	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000357005051	409786683	/nfs/dbraw/zinc/78/66/83/409786683.db2.gz	QQQNWFUNWPLTET-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005051	409786695	/nfs/dbraw/zinc/78/66/95/409786695.db2.gz	QQQNWFUNWPLTET-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000357005051	409786707	/nfs/dbraw/zinc/78/67/07/409786707.db2.gz	QQQNWFUNWPLTET-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1C	ZINC000354379682	409810837	/nfs/dbraw/zinc/81/08/37/409810837.db2.gz	CHBINFKHNOOXFL-NEPJUHHUSA-N	1	1	309.370	1.123	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC(Cc2[nH]cc[nH+]2)CC1	ZINC000332095674	409878178	/nfs/dbraw/zinc/87/81/78/409878178.db2.gz	NUSWHNDEWMQEEC-UHFFFAOYSA-N	1	1	318.337	1.146	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000342832073	409934538	/nfs/dbraw/zinc/93/45/38/409934538.db2.gz	RAKJHVBUHNXXMK-LBPRGKRZSA-N	1	1	309.351	1.078	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@H](C)[C@H](O)C1	ZINC000351817065	410260146	/nfs/dbraw/zinc/26/01/46/410260146.db2.gz	UEMHOAMURUYANV-OUJBWJOFSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@H](C)[C@H](O)C1	ZINC000351817065	410260151	/nfs/dbraw/zinc/26/01/51/410260151.db2.gz	UEMHOAMURUYANV-OUJBWJOFSA-N	1	1	323.349	1.243	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@H]1C	ZINC000351940182	410353928	/nfs/dbraw/zinc/35/39/28/410353928.db2.gz	ZUCYTKUUCNAYSQ-NXEZZACHSA-N	1	1	307.354	1.127	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H]1C	ZINC000346997046	410300483	/nfs/dbraw/zinc/30/04/83/410300483.db2.gz	CBNQOEATZXNIOC-CMPLNLGQSA-N	1	1	308.334	1.987	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000347384815	410511725	/nfs/dbraw/zinc/51/17/25/410511725.db2.gz	ZCFKQVTVIDKXDF-ZDUSSCGKSA-N	1	1	320.393	1.737	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H]1CCCOC1	ZINC000352195736	410536619	/nfs/dbraw/zinc/53/66/19/410536619.db2.gz	TWDUIFNLKKUHEL-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@H]1CCCOC1	ZINC000352195736	410536626	/nfs/dbraw/zinc/53/66/26/410536626.db2.gz	TWDUIFNLKKUHEL-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)C[C@H]1C	ZINC000347534897	410602091	/nfs/dbraw/zinc/60/20/91/410602091.db2.gz	ZSUSDZOMYRKDBF-GHMZBOCLSA-N	1	1	309.370	1.273	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C[C@@H](C)O	ZINC000352223252	410559022	/nfs/dbraw/zinc/55/90/22/410559022.db2.gz	UOVPLNZKEQXFJA-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C[C@@H](C)O	ZINC000352223252	410559031	/nfs/dbraw/zinc/55/90/31/410559031.db2.gz	UOVPLNZKEQXFJA-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331074817	410931230	/nfs/dbraw/zinc/93/12/30/410931230.db2.gz	VNEWCCORWXVJQG-GFCCVEGCSA-N	1	1	323.397	1.313	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331074817	410931237	/nfs/dbraw/zinc/93/12/37/410931237.db2.gz	VNEWCCORWXVJQG-GFCCVEGCSA-N	1	1	323.397	1.313	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000331225127	411029139	/nfs/dbraw/zinc/02/91/39/411029139.db2.gz	MLGQZRCFXOUSKQ-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000331225127	411029145	/nfs/dbraw/zinc/02/91/45/411029145.db2.gz	MLGQZRCFXOUSKQ-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC1CC[NH+](Cc2nc(-c3c([N+](=O)[O-])ncn3C)no2)CC1	ZINC000350907513	306759097	/nfs/dbraw/zinc/75/90/97/306759097.db2.gz	RHEZLMHAMZLWFX-UHFFFAOYSA-N	1	1	306.326	1.610	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]12	ZINC000366333442	418459323	/nfs/dbraw/zinc/45/93/23/418459323.db2.gz	QLABRMUEZBXUPI-VHSXEESVSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@H]12	ZINC000366333442	418459324	/nfs/dbraw/zinc/45/93/24/418459324.db2.gz	QLABRMUEZBXUPI-VHSXEESVSA-N	1	1	323.736	1.343	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H]2OCC(=O)N[C@@H]2C1	ZINC000374025703	418485281	/nfs/dbraw/zinc/48/52/81/418485281.db2.gz	YMOXRNOFXYZTSN-GLQYFDAESA-N	1	1	319.361	1.554	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2OCC(=O)N[C@@H]2C1	ZINC000374025703	418485284	/nfs/dbraw/zinc/48/52/84/418485284.db2.gz	YMOXRNOFXYZTSN-GLQYFDAESA-N	1	1	319.361	1.554	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC[C@H]2c2ccccc2F)c1	ZINC000374109414	418490159	/nfs/dbraw/zinc/49/01/59/418490159.db2.gz	VBTOGBUXQVWPTJ-DOMZBBRYSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]2c2ccccc2F)c1	ZINC000374109414	418490162	/nfs/dbraw/zinc/49/01/62/418490162.db2.gz	VBTOGBUXQVWPTJ-DOMZBBRYSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@H]12	ZINC000366571588	418492357	/nfs/dbraw/zinc/49/23/57/418492357.db2.gz	XVCOUZARXKHXIS-ZTGIWPAFSA-N	1	1	315.329	1.203	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3ccco3)C2)c1	ZINC000374139249	418493838	/nfs/dbraw/zinc/49/38/38/418493838.db2.gz	ABKDLWAHKNDYTF-AAEUAGOBSA-N	1	1	306.322	1.235	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c1	ZINC000374387552	418525235	/nfs/dbraw/zinc/52/52/35/418525235.db2.gz	BMJJYZXWCHCHJB-IJEWVQPXSA-N	1	1	306.362	1.987	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1	ZINC000374387555	418525610	/nfs/dbraw/zinc/52/56/10/418525610.db2.gz	BMJJYZXWCHCHJB-SQWLQELKSA-N	1	1	306.362	1.987	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000374836017	418568308	/nfs/dbraw/zinc/56/83/08/418568308.db2.gz	ZICQNKHAXYJCMX-NXEZZACHSA-N	1	1	322.340	1.673	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000189427795	222045451	/nfs/dbraw/zinc/04/54/51/222045451.db2.gz	IOIBSHSAARUINL-UHFFFAOYSA-N	1	1	308.342	1.018	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000375038644	418592687	/nfs/dbraw/zinc/59/26/87/418592687.db2.gz	MAZJASZGVMQJJD-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000367836211	418642452	/nfs/dbraw/zinc/64/24/52/418642452.db2.gz	RTQOLCUZXMFHDJ-OASPWFOLSA-N	1	1	303.318	1.250	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2CCC[C@@H]2[NH+]2CCOCC2)s1	ZINC000375592095	418659461	/nfs/dbraw/zinc/65/94/61/418659461.db2.gz	QOOKXMYQNBRCHT-MNOVXSKESA-N	1	1	312.395	1.964	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](C[C@H]2CCOC2)C1	ZINC000371446960	418791823	/nfs/dbraw/zinc/79/18/23/418791823.db2.gz	IENKFCGEZMSPCE-QWHCGFSZSA-N	1	1	308.382	1.967	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000408067306	418784743	/nfs/dbraw/zinc/78/47/43/418784743.db2.gz	BNZRVIHDUNNBKK-UWVGGRQHSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000408067306	418784745	/nfs/dbraw/zinc/78/47/45/418784745.db2.gz	BNZRVIHDUNNBKK-UWVGGRQHSA-N	1	1	309.370	1.606	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(c2ccnn2C)CC1	ZINC000365859114	418916807	/nfs/dbraw/zinc/91/68/07/418916807.db2.gz	UKJURIBORHBQMN-UHFFFAOYSA-N	1	1	304.354	1.441	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373249537	418933720	/nfs/dbraw/zinc/93/37/20/418933720.db2.gz	JBTCENXBQLKRPJ-UHFFFAOYSA-N	1	1	309.370	1.295	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CC[C@@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC000420990806	419428170	/nfs/dbraw/zinc/42/81/70/419428170.db2.gz	VAGZEDVUDRHUOJ-GFCCVEGCSA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC000420990806	419428177	/nfs/dbraw/zinc/42/81/77/419428177.db2.gz	VAGZEDVUDRHUOJ-GFCCVEGCSA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(CN2C[C@H](C)[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000418106335	419535927	/nfs/dbraw/zinc/53/59/27/419535927.db2.gz	CDQSITYMUYCZLW-QWHCGFSZSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](C(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000411936335	419505860	/nfs/dbraw/zinc/50/58/60/419505860.db2.gz	FPBAVPZGZSPQQA-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)n1	ZINC000411948340	419511957	/nfs/dbraw/zinc/51/19/57/419511957.db2.gz	PQNWEPGZLRNRRD-UONOGXRCSA-N	1	1	302.334	1.599	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)n1	ZINC000427324489	419638259	/nfs/dbraw/zinc/63/82/59/419638259.db2.gz	MWISOVJMMYOAGZ-GHMZBOCLSA-N	1	1	307.354	1.168	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](O)[C@@H](CO)C1	ZINC000412108271	419669937	/nfs/dbraw/zinc/66/99/37/419669937.db2.gz	SAXOHZSAIZXSPY-TZMCWYRMSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](O)[C@@H](CO)C1	ZINC000412108271	419669944	/nfs/dbraw/zinc/66/99/44/419669944.db2.gz	SAXOHZSAIZXSPY-TZMCWYRMSA-N	1	1	310.350	1.169	20	5		DDBDMO
Nc1ccc(N2CCN(c3ncc([N+](=O)[O-])cc3F)CC2)c[nH+]1	ZINC000413100506	419769872	/nfs/dbraw/zinc/76/98/72/419769872.db2.gz	SHGWWRLZNLCYLY-UHFFFAOYSA-N	1	1	318.312	1.433	20	5		DDBDMO
CN(C(=O)CN1CC[NH+](C2CC2)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000299328018	229053672	/nfs/dbraw/zinc/05/36/72/229053672.db2.gz	KJZAAYWSPKLRNS-UHFFFAOYSA-N	1	1	318.377	1.338	20	5		DDBDMO
COCCO[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430193208	420087974	/nfs/dbraw/zinc/08/79/74/420087974.db2.gz	FWOPKRJHZNACKN-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430193208	420087975	/nfs/dbraw/zinc/08/79/75/420087975.db2.gz	FWOPKRJHZNACKN-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000430940275	420215661	/nfs/dbraw/zinc/21/56/61/420215661.db2.gz	OEYZVWSEALHJLF-CYBMUJFWSA-N	1	1	320.393	1.773	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000416296425	420312009	/nfs/dbraw/zinc/31/20/09/420312009.db2.gz	NVKSLGUSTQTOLW-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C(C)(C)C[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000416335468	420334213	/nfs/dbraw/zinc/33/42/13/420334213.db2.gz	VFNJAXXQFWLOIL-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCOC(=O)c1ccnc(N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000420633030	420337273	/nfs/dbraw/zinc/33/72/73/420337273.db2.gz	IQPMOTRQXCHRBV-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000450795428	420533498	/nfs/dbraw/zinc/53/34/98/420533498.db2.gz	OVBXHIUKCCSSAJ-PHIMTYICSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000450795428	420533500	/nfs/dbraw/zinc/53/35/00/420533500.db2.gz	OVBXHIUKCCSSAJ-PHIMTYICSA-N	1	1	311.386	1.011	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n(C)n1	ZINC000417788195	420479246	/nfs/dbraw/zinc/47/92/46/420479246.db2.gz	IGRZCAMFQXNMPB-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)n(C)n1	ZINC000417788195	420479250	/nfs/dbraw/zinc/47/92/50/420479250.db2.gz	IGRZCAMFQXNMPB-LBPRGKRZSA-N	1	1	316.365	1.718	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C/c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000493186307	420781150	/nfs/dbraw/zinc/78/11/50/420781150.db2.gz	GYTLTOQBZAIMRF-XPHWWTOTSA-N	1	1	301.346	1.771	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000454155784	420808346	/nfs/dbraw/zinc/80/83/46/420808346.db2.gz	XCDJSJUUHMQXQM-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000454155784	420808349	/nfs/dbraw/zinc/80/83/49/420808349.db2.gz	XCDJSJUUHMQXQM-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
COc1cc(C[NH2+][C@H]2COC[C@H]2OC)c([N+](=O)[O-])cc1F	ZINC000459823223	420883476	/nfs/dbraw/zinc/88/34/76/420883476.db2.gz	IRESZQBBHYBZLG-GXFFZTMASA-N	1	1	300.286	1.246	20	5		DDBDMO
CO[C@@H]1COC[C@@H]1[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000459836722	420888860	/nfs/dbraw/zinc/88/88/60/420888860.db2.gz	ZNFCFRXEXCGENW-VHRBIJSZSA-N	1	1	323.349	1.234	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000455164927	420977029	/nfs/dbraw/zinc/97/70/29/420977029.db2.gz	KLUMPNLOIIHQJC-GXFFZTMASA-N	1	1	320.349	1.771	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)C[C@H]1C	ZINC000456006771	421088560	/nfs/dbraw/zinc/08/85/60/421088560.db2.gz	CCMFUHDDPZHRBU-MNOVXSKESA-N	1	1	321.381	1.586	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CCC[N@H+]1CCCO	ZINC000450598115	421215292	/nfs/dbraw/zinc/21/52/92/421215292.db2.gz	PVHAEUPDKPHDDR-OAHLLOKOSA-N	1	1	323.393	2.000	20	5		DDBDMO
O=C1CC[C@@H](C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CCN1	ZINC000450481982	421203126	/nfs/dbraw/zinc/20/31/26/421203126.db2.gz	FZLXJNBOWSGJTQ-GFCCVEGCSA-N	1	1	303.362	1.869	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000496973503	421345192	/nfs/dbraw/zinc/34/51/92/421345192.db2.gz	JQVMYKXLTXAPDV-LBPRGKRZSA-N	1	1	323.349	1.876	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](OC(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000496973503	421345195	/nfs/dbraw/zinc/34/51/95/421345195.db2.gz	JQVMYKXLTXAPDV-LBPRGKRZSA-N	1	1	323.349	1.876	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548059749	421394339	/nfs/dbraw/zinc/39/43/39/421394339.db2.gz	XDWMFJIXXWSKNJ-JTQLQIEISA-N	1	1	307.354	1.176	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1c1ccc(C(=O)NC)cc1[N+](=O)[O-]	ZINC000549654219	421503378	/nfs/dbraw/zinc/50/33/78/421503378.db2.gz	NLFPQSMCKVBFLA-GFCCVEGCSA-N	1	1	306.366	1.485	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000563916274	421556325	/nfs/dbraw/zinc/55/63/25/421556325.db2.gz	LVCGNVMIXUJLQS-CYBMUJFWSA-N	1	1	306.366	1.936	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+](C2CCC2)C1	ZINC000553864869	421627022	/nfs/dbraw/zinc/62/70/22/421627022.db2.gz	BBYFHVYMWSUJKU-LBPRGKRZSA-N	1	1	320.393	1.880	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000556321749	421708109	/nfs/dbraw/zinc/70/81/09/421708109.db2.gz	HARCNJZARQDTRO-NHCYSSNCSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@@H](CN1CCN(C)CC1)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000572422982	421787247	/nfs/dbraw/zinc/78/72/47/421787247.db2.gz	NYKVOLPWCDIQIX-BBRMVZONSA-N	1	1	318.421	1.808	20	5		DDBDMO
CCN1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000344409685	272017273	/nfs/dbraw/zinc/01/72/73/272017273.db2.gz	ABZIDKBACRDFQP-CQSZACIVSA-N	1	1	305.382	1.206	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000344412366	272018196	/nfs/dbraw/zinc/01/81/96/272018196.db2.gz	CWGZGYJXMXKTLN-TXEJJXNPSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000157020018	277182616	/nfs/dbraw/zinc/18/26/16/277182616.db2.gz	PBCGEQMXEZFIFI-OCCSQVGLSA-N	1	1	318.377	1.733	20	5		DDBDMO
COC[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000452042392	277265925	/nfs/dbraw/zinc/26/59/25/277265925.db2.gz	TZAMINWOYYCISV-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CN(C(=O)C[N@H+](C)[C@@H]1CCSC1)c1ccc([N+](=O)[O-])cc1	ZINC000119953909	281110475	/nfs/dbraw/zinc/11/04/75/281110475.db2.gz	VZHLSDFOJDIXPY-CYBMUJFWSA-N	1	1	309.391	1.995	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@@H]1CCSC1)c1ccc([N+](=O)[O-])cc1	ZINC000119953909	281110478	/nfs/dbraw/zinc/11/04/78/281110478.db2.gz	VZHLSDFOJDIXPY-CYBMUJFWSA-N	1	1	309.391	1.995	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000362193320	300025962	/nfs/dbraw/zinc/02/59/62/300025962.db2.gz	YOVXSKKYDKNBIL-CHIMOYNISA-N	1	1	310.325	1.945	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)CCOC1	ZINC000362276429	300041736	/nfs/dbraw/zinc/04/17/36/300041736.db2.gz	GXKAURCJJJQYGF-OAHLLOKOSA-N	1	1	324.333	1.415	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCO[C@H](C2CC2)C1	ZINC000362577655	300100800	/nfs/dbraw/zinc/10/08/00/300100800.db2.gz	QKJFGHDHQJHFNO-BBRMVZONSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCO[C@H](C2CC2)C1	ZINC000362577655	300100802	/nfs/dbraw/zinc/10/08/02/300100802.db2.gz	QKJFGHDHQJHFNO-BBRMVZONSA-N	1	1	322.361	1.445	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000363050830	300203850	/nfs/dbraw/zinc/20/38/50/300203850.db2.gz	NMAYFIITZFOZCJ-ARFHVFGLSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363050830	300203852	/nfs/dbraw/zinc/20/38/52/300203852.db2.gz	NMAYFIITZFOZCJ-ARFHVFGLSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363050830	300203853	/nfs/dbraw/zinc/20/38/53/300203853.db2.gz	NMAYFIITZFOZCJ-ARFHVFGLSA-N	1	1	317.389	1.632	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](Oc3ccccc3)C2)c1	ZINC000363170890	300225876	/nfs/dbraw/zinc/22/58/76/300225876.db2.gz	PGSSJMWTZHYTPP-HNNXBMFYSA-N	1	1	302.334	1.945	20	5		DDBDMO
O=[N+]([O-])c1c(N2CCC[N@H+]3CCC[C@H]3C2)nc2sccn21	ZINC000364261162	300364238	/nfs/dbraw/zinc/36/42/38/300364238.db2.gz	SYNGYWOYZZWHLP-JTQLQIEISA-N	1	1	307.379	1.979	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000364433725	300396422	/nfs/dbraw/zinc/39/64/22/300396422.db2.gz	VLOSITAVPPYYMG-CABCVRRESA-N	1	1	319.361	1.266	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000368835962	301094139	/nfs/dbraw/zinc/09/41/39/301094139.db2.gz	VWSTWQHUSVTRLG-AWEZNQCLSA-N	1	1	307.350	1.120	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000368835962	301094140	/nfs/dbraw/zinc/09/41/40/301094140.db2.gz	VWSTWQHUSVTRLG-AWEZNQCLSA-N	1	1	307.350	1.120	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000368950327	301108621	/nfs/dbraw/zinc/10/86/21/301108621.db2.gz	MEDIJGQWJUOIKM-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
Cc1nc(C)n(C[C@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)n1	ZINC000370024583	301260423	/nfs/dbraw/zinc/26/04/23/301260423.db2.gz	ABXQYBUCKAMLMG-CYBMUJFWSA-N	1	1	319.369	1.164	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1	ZINC000370163767	301286270	/nfs/dbraw/zinc/28/62/70/301286270.db2.gz	UDJBWGGKQOSUDU-UHFFFAOYSA-N	1	1	320.393	1.981	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000370560202	301364711	/nfs/dbraw/zinc/36/47/11/301364711.db2.gz	XNWHNZSZXCLTSI-CYBMUJFWSA-N	1	1	321.333	1.500	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000370560202	301364713	/nfs/dbraw/zinc/36/47/13/301364713.db2.gz	XNWHNZSZXCLTSI-CYBMUJFWSA-N	1	1	321.333	1.500	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)[C@H]2C1	ZINC000376729412	302093518	/nfs/dbraw/zinc/09/35/18/302093518.db2.gz	PXEDNAJFFKGDME-GWCFXTLKSA-N	1	1	307.325	1.900	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]12	ZINC000377656187	302205432	/nfs/dbraw/zinc/20/54/32/302205432.db2.gz	RCVKYVSHQWBVNC-PWSUYJOCSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]12	ZINC000377656187	302205434	/nfs/dbraw/zinc/20/54/34/302205434.db2.gz	RCVKYVSHQWBVNC-PWSUYJOCSA-N	1	1	309.753	1.816	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000398742303	302361925	/nfs/dbraw/zinc/36/19/25/302361925.db2.gz	WSYVZWMTDHNUPR-MNOVXSKESA-N	1	1	307.350	1.144	20	5		DDBDMO
Cc1cc(S(=O)(=O)NCC(F)(F)C[NH3+])c(C)cc1[N+](=O)[O-]	ZINC000515311980	302771944	/nfs/dbraw/zinc/77/19/44/302771944.db2.gz	AQCBBLPZMZTJML-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
CC[C@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000531025999	303225943	/nfs/dbraw/zinc/22/59/43/303225943.db2.gz	SHBZZADJFVZNDX-FZMZJTMJSA-N	1	1	317.345	1.959	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000530	307113974	/nfs/dbraw/zinc/11/39/74/307113974.db2.gz	ITNSNNQZROEUJL-NWDGAFQWSA-N	1	1	309.370	1.343	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000530	307113975	/nfs/dbraw/zinc/11/39/75/307113975.db2.gz	ITNSNNQZROEUJL-NWDGAFQWSA-N	1	1	309.370	1.343	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000371555456	307153299	/nfs/dbraw/zinc/15/32/99/307153299.db2.gz	UJOFSJKOXGIUOC-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](CCO[C@H]3CCCCO3)C2)c1	ZINC000373107710	307178956	/nfs/dbraw/zinc/17/89/56/307178956.db2.gz	WBPSBGHYKJVNMN-ZFWWWQNUSA-N	1	1	324.381	1.971	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000374348354	307206033	/nfs/dbraw/zinc/20/60/33/307206033.db2.gz	FWSFARXYUICYCD-NSHDSACASA-N	1	1	315.333	1.421	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000376660570	307252243	/nfs/dbraw/zinc/25/22/43/307252243.db2.gz	OWFXZHNSARVHPS-OAHLLOKOSA-N	1	1	321.377	1.363	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CCC[N@@H+](C)C2	ZINC000583103065	337240921	/nfs/dbraw/zinc/24/09/21/337240921.db2.gz	YOJJSHUXNCAOID-OAHLLOKOSA-N	1	1	306.366	1.491	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CCCO)C1	ZINC000452130256	534338340	/nfs/dbraw/zinc/33/83/40/534338340.db2.gz	NQOUYPBXCGVJHQ-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](S(N)(=O)=O)C1	ZINC000330715831	534347312	/nfs/dbraw/zinc/34/73/12/534347312.db2.gz	SYXIJMYRMRVWQN-PWSUYJOCSA-N	1	1	313.379	1.327	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@H](S(N)(=O)=O)C1	ZINC000330715831	534347319	/nfs/dbraw/zinc/34/73/19/534347319.db2.gz	SYXIJMYRMRVWQN-PWSUYJOCSA-N	1	1	313.379	1.327	20	5		DDBDMO
CC(C)(NC(=O)NCC(F)(F)C[NH3+])c1ccccc1[N+](=O)[O-]	ZINC000418521100	527272803	/nfs/dbraw/zinc/27/28/03/527272803.db2.gz	FVIVLUGZHZCAKZ-UHFFFAOYSA-N	1	1	316.308	1.723	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@@H](CO)C3)o2)cc1	ZINC000157406357	527344869	/nfs/dbraw/zinc/34/48/69/527344869.db2.gz	MCMZYSASHYQJSD-SNVBAGLBSA-N	1	1	304.306	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@H](CO)C3)o2)cc1	ZINC000157406357	527344873	/nfs/dbraw/zinc/34/48/73/527344873.db2.gz	MCMZYSASHYQJSD-SNVBAGLBSA-N	1	1	304.306	1.459	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O	ZINC000412995636	529004757	/nfs/dbraw/zinc/00/47/57/529004757.db2.gz	ZYKFKHWZSKVALH-NSHDSACASA-N	1	1	322.365	1.118	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000457141266	529073903	/nfs/dbraw/zinc/07/39/03/529073903.db2.gz	ZAOWVKSSWITJQI-LBPRGKRZSA-N	1	1	323.397	1.468	20	5		DDBDMO
COCCC[N@@H+](CCOC)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000068963683	696378827	/nfs/dbraw/zinc/37/88/27/696378827.db2.gz	YCXCQCLWPZCVFA-UHFFFAOYSA-N	1	1	322.365	1.887	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000112310700	696650204	/nfs/dbraw/zinc/65/02/04/696650204.db2.gz	AJTLJBKAOARUPC-UHFFFAOYSA-N	1	1	324.337	1.965	20	5		DDBDMO
Cc1nn(CN2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c(C)c1[N+](=O)[O-]	ZINC000164764732	697337117	/nfs/dbraw/zinc/33/71/17/697337117.db2.gz	MZAGRNWYCZOTBP-KGLIPLIRSA-N	1	1	307.398	1.782	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000176105384	697401560	/nfs/dbraw/zinc/40/15/60/697401560.db2.gz	OHTWCNIRCFIQPZ-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2C2OCCO2)c1	ZINC000750055115	700201360	/nfs/dbraw/zinc/20/13/60/700201360.db2.gz	ZBWKEYCIZCSWMO-CABCVRRESA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCC[C@@H]2C2OCCO2)c1	ZINC000750055115	700201362	/nfs/dbraw/zinc/20/13/62/700201362.db2.gz	ZBWKEYCIZCSWMO-CABCVRRESA-N	1	1	322.361	1.856	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000778768167	698366334	/nfs/dbraw/zinc/36/63/34/698366334.db2.gz	GTPPWXOOIHHLNT-UHFFFAOYSA-N	1	1	307.310	1.320	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000779516315	698429651	/nfs/dbraw/zinc/42/96/51/698429651.db2.gz	FHBWOHHDRKTPGG-UHFFFAOYSA-N	1	1	317.349	1.927	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000786949629	699182054	/nfs/dbraw/zinc/18/20/54/699182054.db2.gz	KLYVINAQOFKZSO-GFCCVEGCSA-N	1	1	304.350	1.486	20	5		DDBDMO
Cc1c(C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cnn1C	ZINC000790444190	699460018	/nfs/dbraw/zinc/46/00/18/699460018.db2.gz	AGFYOQKJGWUBGF-OAHLLOKOSA-N	1	1	304.350	1.802	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1CC[N+](=O)[O-])Nc1ccccc1	ZINC000791051417	699608934	/nfs/dbraw/zinc/60/89/34/699608934.db2.gz	CSAIUJINIXBWAP-AWEZNQCLSA-N	1	1	306.366	1.939	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CC[N+](=O)[O-])Nc1ccccc1	ZINC000791051417	699608935	/nfs/dbraw/zinc/60/89/35/699608935.db2.gz	CSAIUJINIXBWAP-AWEZNQCLSA-N	1	1	306.366	1.939	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CCC[C@@H]1C	ZINC000742238652	699868962	/nfs/dbraw/zinc/86/89/62/699868962.db2.gz	GJOIMBORNCWDOA-NSHDSACASA-N	1	1	309.370	1.090	20	5		DDBDMO
C[N@@H+](CCCN1CCOC1=O)CCc1ccccc1[N+](=O)[O-]	ZINC000796111468	699913230	/nfs/dbraw/zinc/91/32/30/699913230.db2.gz	GCIPEGASOSKIMK-UHFFFAOYSA-N	1	1	307.350	1.911	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000796578722	699940028	/nfs/dbraw/zinc/94/00/28/699940028.db2.gz	JXQYSNFJMUYYFS-NILFDRSVSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000761079870	700841508	/nfs/dbraw/zinc/84/15/08/700841508.db2.gz	GPUVVQXMODBGQH-GFCCVEGCSA-N	1	1	318.377	1.120	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCC(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC000803855396	701149702	/nfs/dbraw/zinc/14/97/02/701149702.db2.gz	HWJBECALJMSQMX-GFCCVEGCSA-N	1	1	310.354	1.599	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000804396397	701186108	/nfs/dbraw/zinc/18/61/08/701186108.db2.gz	HFJVLQHZTHVVKU-GHMZBOCLSA-N	1	1	322.321	1.778	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140403	701234008	/nfs/dbraw/zinc/23/40/08/701234008.db2.gz	OJBJWARMTSCCDH-MNOVXSKESA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140403	701234009	/nfs/dbraw/zinc/23/40/09/701234009.db2.gz	OJBJWARMTSCCDH-MNOVXSKESA-N	1	1	306.366	1.650	20	5		DDBDMO
CN(CCOCC1CC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867956752	701852601	/nfs/dbraw/zinc/85/26/01/701852601.db2.gz	SUFZDMUUTXCIFI-MRXNPFEDSA-N	1	1	321.377	1.654	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000840181060	702015686	/nfs/dbraw/zinc/01/56/86/702015686.db2.gz	YXKRUDQWYGQPTG-LLVKDONJSA-N	1	1	317.349	1.312	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000817679667	702449125	/nfs/dbraw/zinc/44/91/25/702449125.db2.gz	VGRZZAXPJSTLFH-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000842046555	702663239	/nfs/dbraw/zinc/66/32/39/702663239.db2.gz	DCKUMLCRSMDHSE-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000842046555	702663240	/nfs/dbraw/zinc/66/32/40/702663240.db2.gz	DCKUMLCRSMDHSE-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
COC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1	ZINC000842802005	702776322	/nfs/dbraw/zinc/77/63/22/702776322.db2.gz	POVRQMXVSPMCGO-AWEZNQCLSA-N	1	1	320.345	1.891	20	5		DDBDMO
COC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)CC1	ZINC000842802005	702776324	/nfs/dbraw/zinc/77/63/24/702776324.db2.gz	POVRQMXVSPMCGO-AWEZNQCLSA-N	1	1	320.345	1.891	20	5		DDBDMO
C[C@@]1(C[NH3+])CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843381310	702870567	/nfs/dbraw/zinc/87/05/67/702870567.db2.gz	COWGVPXZSHIONC-HNNXBMFYSA-N	1	1	324.356	1.733	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000845767444	703198192	/nfs/dbraw/zinc/19/81/92/703198192.db2.gz	JWLAKWJKRGGWEU-UHFFFAOYSA-N	1	1	323.393	1.688	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000879580628	706727103	/nfs/dbraw/zinc/72/71/03/706727103.db2.gz	IPUKDFVUHYLSFV-KBMXLJTQSA-N	1	1	305.378	1.654	20	5		DDBDMO
C[C@H](C(=O)OCc1cn(C)nc1[N+](=O)[O-])[NH+]1CCCCCC1	ZINC000847783914	703466061	/nfs/dbraw/zinc/46/60/61/703466061.db2.gz	IRVSLOAVKMYQJI-LLVKDONJSA-N	1	1	310.354	1.636	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000869784094	703852235	/nfs/dbraw/zinc/85/22/35/703852235.db2.gz	HEAQCNMTUXIJMB-NSHDSACASA-N	1	1	307.350	1.170	20	5		DDBDMO
CC1(C)OC[C@H](C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851843157	703868632	/nfs/dbraw/zinc/86/86/32/703868632.db2.gz	ATWWYMWDOLCOQL-YPMHNXCESA-N	1	1	322.365	1.628	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1	ZINC000818959297	704035089	/nfs/dbraw/zinc/03/50/89/704035089.db2.gz	HQCBESFHOLHNNH-OWCLPIDISA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCN3CCCC[C@@H]23)c1	ZINC000818959297	704035096	/nfs/dbraw/zinc/03/50/96/704035096.db2.gz	HQCBESFHOLHNNH-OWCLPIDISA-N	1	1	305.378	1.845	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000852571567	704078128	/nfs/dbraw/zinc/07/81/28/704078128.db2.gz	VTVNDCZJMUSNBG-UHFFFAOYSA-N	1	1	311.338	1.604	20	5		DDBDMO
CC(C)(C)n1ncnc1C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819290196	704101539	/nfs/dbraw/zinc/10/15/39/704101539.db2.gz	WFGGTCQURHSWQT-CYBMUJFWSA-N	1	1	319.365	1.765	20	5		DDBDMO
CN(C[C@H]1CCCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870922637	704170179	/nfs/dbraw/zinc/17/01/79/704170179.db2.gz	KQJWVWKAPSWVJP-WBMJQRKESA-N	1	1	321.377	1.654	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000821091297	704370907	/nfs/dbraw/zinc/37/09/07/704370907.db2.gz	AQQQGTGLIQSUEJ-OCCSQVGLSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000821091297	704370909	/nfs/dbraw/zinc/37/09/09/704370909.db2.gz	AQQQGTGLIQSUEJ-OCCSQVGLSA-N	1	1	321.377	1.661	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000874834925	705192349	/nfs/dbraw/zinc/19/23/49/705192349.db2.gz	VSDQGCGDVDSDSB-RYUDHWBXSA-N	1	1	304.350	1.486	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)C1	ZINC000826796585	705873673	/nfs/dbraw/zinc/87/36/73/705873673.db2.gz	LJFDZXIWHZCJEQ-SNVBAGLBSA-N	1	1	311.313	1.184	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827366712	705986725	/nfs/dbraw/zinc/98/67/25/705986725.db2.gz	OHOYIEYVMKANON-OCCSQVGLSA-N	1	1	318.377	1.803	20	5		DDBDMO
C[C@H](NCC(=O)N1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029212	707282347	/nfs/dbraw/zinc/28/23/47/707282347.db2.gz	PBKITWNCUBXMOJ-NSHDSACASA-N	1	1	324.356	1.159	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000877652127	706170619	/nfs/dbraw/zinc/17/06/19/706170619.db2.gz	BFVNYHDZINXWDY-INIZCTEOSA-N	1	1	322.361	1.976	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](CCn3cnnn3)C2)cc1	ZINC000878679164	706466740	/nfs/dbraw/zinc/46/67/40/706466740.db2.gz	ULIHYFPWEAMHIC-ZDUSSCGKSA-N	1	1	302.338	1.461	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000865997290	706588819	/nfs/dbraw/zinc/58/88/19/706588819.db2.gz	XTFNRWSEMAPVTL-NSHDSACASA-N	1	1	311.386	1.377	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832908243	706997631	/nfs/dbraw/zinc/99/76/31/706997631.db2.gz	HJAFSZMXKGDSKJ-RISCZKNCSA-N	1	1	309.366	1.473	20	5		DDBDMO
[NH3+]C[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@@H]1C(F)(F)F	ZINC000872149839	707303722	/nfs/dbraw/zinc/30/37/22/707303722.db2.gz	RDVSDIJLSMKBSJ-ONGXEEELSA-N	1	1	319.283	1.869	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000885855207	708640277	/nfs/dbraw/zinc/64/02/77/708640277.db2.gz	LCURRHHWJRFSGG-HNNXBMFYSA-N	1	1	319.361	1.578	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886338510	708745342	/nfs/dbraw/zinc/74/53/42/708745342.db2.gz	LZBWPCGAXPWQJE-GARJFASQSA-N	1	1	305.334	1.882	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886338510	708745343	/nfs/dbraw/zinc/74/53/43/708745343.db2.gz	LZBWPCGAXPWQJE-GARJFASQSA-N	1	1	305.334	1.882	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000900098996	709288812	/nfs/dbraw/zinc/28/88/12/709288812.db2.gz	LMOVQGIJKTXQKY-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000910286365	709867200	/nfs/dbraw/zinc/86/72/00/709867200.db2.gz	GPTVXIKTWPKVDJ-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000910286365	709867206	/nfs/dbraw/zinc/86/72/06/709867206.db2.gz	GPTVXIKTWPKVDJ-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000910286365	709867210	/nfs/dbraw/zinc/86/72/10/709867210.db2.gz	GPTVXIKTWPKVDJ-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@@H](C)C1	ZINC000910289183	709869124	/nfs/dbraw/zinc/86/91/24/709869124.db2.gz	QFHRXHJMZUCYSU-NSHDSACASA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331561	710012137	/nfs/dbraw/zinc/01/21/37/710012137.db2.gz	XTCOLYBPDLLWJQ-PGUXBMHVSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@H](NC(=O)[C@]1(C)C[C@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331561	710012143	/nfs/dbraw/zinc/01/21/43/710012143.db2.gz	XTCOLYBPDLLWJQ-PGUXBMHVSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000928434469	713194530	/nfs/dbraw/zinc/19/45/30/713194530.db2.gz	DZEZKJQHPJYNKJ-PSASIEDQSA-N	1	1	307.306	1.146	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)C[C@@]2(C)C1	ZINC000894800343	711275622	/nfs/dbraw/zinc/27/56/22/711275622.db2.gz	CSBKZJGDPCOQEP-IYBDPMFKSA-N	1	1	318.377	1.472	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC2(C1)C[NH+](Cc1ccccc1)C2	ZINC000894865949	711301967	/nfs/dbraw/zinc/30/19/67/711301967.db2.gz	QVKDLNATVSWXBA-UHFFFAOYSA-N	1	1	313.361	1.651	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000895191091	711449050	/nfs/dbraw/zinc/44/90/50/711449050.db2.gz	GZTQBMYBIRRXJR-CMPLNLGQSA-N	1	1	304.350	1.367	20	5		DDBDMO
CC(=O)c1ccc(N[C@H](C)[C@@H]2C[N@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246143	711463896	/nfs/dbraw/zinc/46/38/96/711463896.db2.gz	LVWVGFMQPQAHIM-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1ccc(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])c1	ZINC000895246143	711463897	/nfs/dbraw/zinc/46/38/97/711463897.db2.gz	LVWVGFMQPQAHIM-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000895444164	711513946	/nfs/dbraw/zinc/51/39/46/711513946.db2.gz	RFGFWHZJYRQKMC-NEPJUHHUSA-N	1	1	308.334	1.777	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000895738494	711591360	/nfs/dbraw/zinc/59/13/60/711591360.db2.gz	WTPHQFJXUIMQHK-CMPLNLGQSA-N	1	1	307.350	1.815	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000895771419	711601922	/nfs/dbraw/zinc/60/19/22/711601922.db2.gz	KNWDNXNHLAZPQU-CYBMUJFWSA-N	1	1	323.324	1.119	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@@H]3[C@H](O)CC[C@@H]3C1)OCCO2	ZINC000895784843	711605561	/nfs/dbraw/zinc/60/55/61/711605561.db2.gz	PDZHRUVCXKQPGG-SCDSUCTJSA-N	1	1	320.345	1.569	20	5		DDBDMO
Cc1ccc(CNC(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000896219940	711693538	/nfs/dbraw/zinc/69/35/38/711693538.db2.gz	JMEWOKOFZXWPCK-HIFRSBDPSA-N	1	1	318.377	1.749	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc(Cl)c(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000908350610	712749336	/nfs/dbraw/zinc/74/93/36/712749336.db2.gz	ZUTSADOXPZLUGX-QPUJVOFHSA-N	1	1	324.768	1.607	20	5		DDBDMO
C[C@H](NC(=O)C[C@]1(O)CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000908512396	712793402	/nfs/dbraw/zinc/79/34/02/712793402.db2.gz	LCRNYMGACGYMND-BLLLJJGKSA-N	1	1	321.377	1.619	20	5		DDBDMO
COc1ccc(CNC(=O)NC[C@@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000914300117	713373015	/nfs/dbraw/zinc/37/30/15/713373015.db2.gz	KDRVQOSGVGNCPU-NSHDSACASA-N	1	1	308.338	1.107	20	5		DDBDMO
C[N@@H+]1CCN(Cn2cc([N+](=O)[O-])cn2)[C@@H](c2ccccc2)C1	ZINC000917462760	713499245	/nfs/dbraw/zinc/49/92/45/713499245.db2.gz	IVLDSOXRTIPJIR-OAHLLOKOSA-N	1	1	301.350	1.738	20	5		DDBDMO
C[N@H+]1CCN(Cn2cc([N+](=O)[O-])cn2)[C@@H](c2ccccc2)C1	ZINC000917462760	713499247	/nfs/dbraw/zinc/49/92/47/713499247.db2.gz	IVLDSOXRTIPJIR-OAHLLOKOSA-N	1	1	301.350	1.738	20	5		DDBDMO
CCOC(=O)/C=C\C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985538	713729016	/nfs/dbraw/zinc/72/90/16/713729016.db2.gz	BUQSPQPDYJHYCX-MVZIDQBPSA-N	1	1	320.349	1.595	20	5		DDBDMO
CCOC(=O)/C=C\C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985538	713729017	/nfs/dbraw/zinc/72/90/17/713729017.db2.gz	BUQSPQPDYJHYCX-MVZIDQBPSA-N	1	1	320.349	1.595	20	5		DDBDMO
COc1cc(N[C@H]2CCC[N@H+](CC[N+](=O)[O-])C2)cc(OC)c1	ZINC000930044353	713742587	/nfs/dbraw/zinc/74/25/87/713742587.db2.gz	YTYSVBBAFHMVHF-LBPRGKRZSA-N	1	1	309.366	1.857	20	5		DDBDMO
COc1cc(N[C@H]2CCC[N@@H+](CC[N+](=O)[O-])C2)cc(OC)c1	ZINC000930044353	713742589	/nfs/dbraw/zinc/74/25/89/713742589.db2.gz	YTYSVBBAFHMVHF-LBPRGKRZSA-N	1	1	309.366	1.857	20	5		DDBDMO
CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[NH2+]CC1	ZINC000923336025	714319631	/nfs/dbraw/zinc/31/96/31/714319631.db2.gz	UAYDNAZLCAQQLT-DZGCQCFKSA-N	1	1	323.393	1.408	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000932514186	714352095	/nfs/dbraw/zinc/35/20/95/714352095.db2.gz	OGBLDYKTRUTZGI-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
CCC1(CC)CNC(=O)[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1OC	ZINC000933287674	714554785	/nfs/dbraw/zinc/55/47/85/714554785.db2.gz	YMUSHDGWHWAXPX-AWEZNQCLSA-N	1	1	321.377	1.998	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2C[C@@H]2CCCO2)c1	ZINC000933677966	714646122	/nfs/dbraw/zinc/64/61/22/714646122.db2.gz	SERZTNXEOSAVJB-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2C[C@@H]2CCCO2)c1	ZINC000933677966	714646124	/nfs/dbraw/zinc/64/61/24/714646124.db2.gz	SERZTNXEOSAVJB-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H]3[C@H]2CCCN3CCO)cc1	ZINC000934259197	714778223	/nfs/dbraw/zinc/77/82/23/714778223.db2.gz	HHRNWSJIZRUSNC-SJORKVTESA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@H]3[C@H]2CCC[N@H+]3CCO)cc1	ZINC000934259197	714778225	/nfs/dbraw/zinc/77/82/25/714778225.db2.gz	HHRNWSJIZRUSNC-SJORKVTESA-N	1	1	319.405	1.668	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)cc1	ZINC000934259197	714778227	/nfs/dbraw/zinc/77/82/27/714778227.db2.gz	HHRNWSJIZRUSNC-SJORKVTESA-N	1	1	319.405	1.668	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CC[N@H+]1C	ZINC000925333467	714815268	/nfs/dbraw/zinc/81/52/68/714815268.db2.gz	FCMYAZQJCBSDHA-BXUZGUMPSA-N	1	1	318.377	1.755	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)c1	ZINC000934832312	714912871	/nfs/dbraw/zinc/91/28/71/714912871.db2.gz	AXMPUKYQDCYDRH-KGLIPLIRSA-N	1	1	308.382	1.930	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21	ZINC000934951505	714937015	/nfs/dbraw/zinc/93/70/15/714937015.db2.gz	OUSWEQNSECMHQU-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)nc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022061853	734367699	/nfs/dbraw/zinc/36/76/99/734367699.db2.gz	YAHMUJIAOVBVOF-WRWGMCAJSA-N	1	1	324.768	1.137	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)[n+]([O-])cc1NCC[NH+]1CCSCC1	ZINC001167833076	738957226	/nfs/dbraw/zinc/95/72/26/738957226.db2.gz	YEPHMTSEIRKBFJ-UHFFFAOYSA-N	1	1	318.786	1.342	20	5		DDBDMO
O=C(NCC[NH2+]Cc1cc2ccccc2s1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936573	742841402	/nfs/dbraw/zinc/84/14/02/742841402.db2.gz	MAEKSHBMZRXVIF-CHWSQXEVSA-N	1	1	319.386	1.772	20	5		DDBDMO
Cn1nccc1C[C@@H]1CCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC001198821324	747623948	/nfs/dbraw/zinc/62/39/48/747623948.db2.gz	QWKHLBRBSVCGSN-AWEZNQCLSA-N	1	1	301.350	1.930	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3ncccc3[N+](=O)[O-])CC2)CC1	ZINC000866212521	749159240	/nfs/dbraw/zinc/15/92/40/749159240.db2.gz	LCGAOVFXYWVBOV-UHFFFAOYSA-N	1	1	305.382	1.206	20	5		DDBDMO
CCOC(=O)C1([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CCOCC1	ZINC001168960766	762154692	/nfs/dbraw/zinc/15/46/92/762154692.db2.gz	GYLJWYWSVPWPLJ-VXGBXAGGSA-N	1	1	300.355	1.134	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cnn(C)c21	ZINC001169018948	762199425	/nfs/dbraw/zinc/19/94/25/762199425.db2.gz	FROZHUPOLHAYDY-AEGPPILISA-N	1	1	322.409	1.801	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC001170329048	766254080	/nfs/dbraw/zinc/25/40/80/766254080.db2.gz	NPTGKPDHZGDQSQ-AAEUAGOBSA-N	1	1	321.377	1.732	20	5		DDBDMO
CC(C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C2	ZINC001048525270	769492826	/nfs/dbraw/zinc/49/28/26/769492826.db2.gz	RFPYXFQHKHFXSA-XLWJZTARSA-N	1	1	309.410	1.667	20	5		DDBDMO
CC(C)C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001048525270	769492830	/nfs/dbraw/zinc/49/28/30/769492830.db2.gz	RFPYXFQHKHFXSA-XLWJZTARSA-N	1	1	309.410	1.667	20	5		DDBDMO
CC(C)C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001048525270	769492836	/nfs/dbraw/zinc/49/28/36/769492836.db2.gz	RFPYXFQHKHFXSA-XLWJZTARSA-N	1	1	309.410	1.667	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1cnc(Oc2ccc([N+](=O)[O-])cc2)nc1	ZINC001170900549	771899119	/nfs/dbraw/zinc/89/91/19/771899119.db2.gz	VWLAULQULYPFBP-CYBMUJFWSA-N	1	1	318.337	1.613	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)c1	ZINC001093787438	775078020	/nfs/dbraw/zinc/07/80/20/775078020.db2.gz	CSZLRPIEYZRESJ-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCNC(=O)C[N@H+](C)C1CCC1	ZINC001094221361	775541751	/nfs/dbraw/zinc/54/17/51/775541751.db2.gz	BDKYZKKEXGTALG-UHFFFAOYSA-N	1	1	321.381	1.311	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001100203693	775815277	/nfs/dbraw/zinc/81/52/77/775815277.db2.gz	BAHWKUAQRBWSAB-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[N@@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC001178708145	779153516	/nfs/dbraw/zinc/15/35/16/779153516.db2.gz	COMOHDHKCLMJRF-JTQLQIEISA-N	1	1	309.370	1.340	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)c1cc([N+](=O)[O-])cc(C)n1	ZINC001139628264	860441806	/nfs/dbraw/zinc/44/18/06/860441806.db2.gz	UTDPECWAYYJNFH-LBPRGKRZSA-N	1	1	306.366	1.855	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@@H]([N@@H+](C)C(C)C)C2)c1[N+](=O)[O-]	ZINC001157018895	863520659	/nfs/dbraw/zinc/52/06/59/863520659.db2.gz	APYDWWUYXFVQCO-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
O=C(NCCC[NH2+]CCc1ccccc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767843	864118356	/nfs/dbraw/zinc/11/83/56/864118356.db2.gz	XKQUAIQGXKBJMF-TZMCWYRMSA-N	1	1	309.341	1.129	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+](C(C)C)[C@@H](C)C2)n1	ZINC001158501308	864692636	/nfs/dbraw/zinc/69/26/36/864692636.db2.gz	QZWFQTZACODGBH-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
COCCOC1CN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001158974178	865010759	/nfs/dbraw/zinc/01/07/59/865010759.db2.gz	JBCUSGIWTQZNMD-SNAWJCMRSA-N	1	1	322.365	1.374	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1cc(OC)c([N+](=O)[O-])cn1	ZINC001159453733	865308825	/nfs/dbraw/zinc/30/88/25/865308825.db2.gz	ZSRDOCXJMNPJNF-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@@H](C(C)C)[NH+]1CCOCC1	ZINC001320575396	866847595	/nfs/dbraw/zinc/84/75/95/866847595.db2.gz	BIQFAEQOFUBONU-ZDUSSCGKSA-N	1	1	308.382	1.489	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[NH+](C[C@H]2CCCO2)CC1	ZINC001322404724	868154786	/nfs/dbraw/zinc/15/47/86/868154786.db2.gz	BRJGBTJJKKOTEA-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC001335442053	868300569	/nfs/dbraw/zinc/30/05/69/868300569.db2.gz	VWJSTCPDWTWLGM-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@H]2CCN(CC3CC3)C2)c1[N+](=O)[O-]	ZINC001335442053	868300580	/nfs/dbraw/zinc/30/05/80/868300580.db2.gz	VWJSTCPDWTWLGM-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
O=C(NCCC1(C[NH2+]CCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494771	869233989	/nfs/dbraw/zinc/23/39/89/869233989.db2.gz	REPBTULMUANAJQ-NXEZZACHSA-N	1	1	323.315	1.480	20	5		DDBDMO
COCCC[NH+]1CCN(c2nccc(Cl)c2[N+](=O)[O-])CC1	ZINC001165093224	869368889	/nfs/dbraw/zinc/36/88/89/869368889.db2.gz	BZYVIMLFYVFAPT-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
C[NH+](C)/C=C\c1cc(N2CCN(CCF)CC2)ncc1[N+](=O)[O-]	ZINC001165102817	869376040	/nfs/dbraw/zinc/37/60/40/869376040.db2.gz	MRSCFGMVWNTRNX-HYXAFXHYSA-N	1	1	323.372	1.614	20	5		DDBDMO
C[N@@H+](C1CN(c2ccc3[nH]cc([N+](=O)[O-])c3n2)C1)[C@@H]1CCOC1	ZINC001165205583	869430413	/nfs/dbraw/zinc/43/04/13/869430413.db2.gz	NBWQIINVNBNXDG-SNVBAGLBSA-N	1	1	317.349	1.380	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])c(C(=O)NCC[NH+]2CC=CC2)c1	ZINC001339493363	870523428	/nfs/dbraw/zinc/52/34/28/870523428.db2.gz	PNBYFYKOIUIFNG-UHFFFAOYSA-N	1	1	307.375	1.918	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC001305031355	871256766	/nfs/dbraw/zinc/25/67/66/871256766.db2.gz	CRYCTVREXFOPQN-UHFFFAOYSA-N	1	1	306.366	1.639	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C	ZINC001340877184	871404381	/nfs/dbraw/zinc/40/43/81/871404381.db2.gz	CRXZWLLICMCJAS-WOPDTQHZSA-N	1	1	310.402	1.555	20	5		DDBDMO
Cc1[nH]c(=O)nc(O[C@@H](C)C[N+](C)(C)C)c1Br	ZINC001226787636	882653902	/nfs/dbraw/zinc/65/39/02/882653902.db2.gz	JURVNNNIIJOBKO-ZETCQYMHSA-O	1	1	305.196	1.727	20	5		DDBDMO
O=[N+]([O-])c1ccc(C(F)(F)F)cc1N1CC[NH+](CCO)CC1	ZINC001346048302	873600718	/nfs/dbraw/zinc/60/07/18/873600718.db2.gz	MCEAEOFJSWRRCK-UHFFFAOYSA-N	1	1	319.283	1.728	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC001347503991	874164460	/nfs/dbraw/zinc/16/44/60/874164460.db2.gz	PPNMNHXEMRCNDF-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[N@@H+]1CCO[C@H](COc2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC001227222198	882917293	/nfs/dbraw/zinc/91/72/93/882917293.db2.gz	XRIRPHHZLDNJIV-NSHDSACASA-N	1	1	319.317	1.558	20	5		DDBDMO
C[N@H+]1CCO[C@H](COc2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC001227222198	882917311	/nfs/dbraw/zinc/91/73/11/882917311.db2.gz	XRIRPHHZLDNJIV-NSHDSACASA-N	1	1	319.317	1.558	20	5		DDBDMO
COC(=O)c1sc([N+](=O)[O-])cc1O[C@@H]1CCC[N@H+](C)C1	ZINC001227541869	883072040	/nfs/dbraw/zinc/07/20/40/883072040.db2.gz	PYMGEDGSCJHVEW-MRVPVSSYSA-N	1	1	300.336	1.916	20	5		DDBDMO
COC(=O)c1sc([N+](=O)[O-])cc1O[C@@H]1CCC[N@@H+](C)C1	ZINC001227541869	883072057	/nfs/dbraw/zinc/07/20/57/883072057.db2.gz	PYMGEDGSCJHVEW-MRVPVSSYSA-N	1	1	300.336	1.916	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC001353102720	877120384	/nfs/dbraw/zinc/12/03/84/877120384.db2.gz	PRVPKVIHLYNYLO-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
C[C@@H](C[NH+]1CCOCC1)Oc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC001227744697	883155466	/nfs/dbraw/zinc/15/54/66/883155466.db2.gz	HWPUGRNQLAFQDM-JTQLQIEISA-N	1	1	306.322	1.571	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(F)cc(F)c2[N+](=O)[O-])C1	ZINC001228614074	883574197	/nfs/dbraw/zinc/57/41/97/883574197.db2.gz	SOLVRCPAIPKAAQ-SNVBAGLBSA-N	1	1	302.277	1.973	20	5		DDBDMO
COC(=O)c1cc(OCC[N@@H+]2CC[C@@H](OC)C2)cc([N+](=O)[O-])c1	ZINC001228772540	883663272	/nfs/dbraw/zinc/66/32/72/883663272.db2.gz	XVOCSFKLVFRUCM-CYBMUJFWSA-N	1	1	324.333	1.481	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3ccc(Cl)nc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230879309	884999841	/nfs/dbraw/zinc/99/98/41/884999841.db2.gz	NQVRJDWLSDWVFR-JVUFJMBOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3ccc(Cl)nc3[N+](=O)[O-])[C@H]1CC(=O)C2	ZINC001230879309	884999851	/nfs/dbraw/zinc/99/98/51/884999851.db2.gz	NQVRJDWLSDWVFR-JVUFJMBOSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@@H]2C[C@@H](CO)C[C@H]21	ZINC001254553473	896498907	/nfs/dbraw/zinc/49/89/07/896498907.db2.gz	VQMKCQCKIIQZBL-DLTLXFJOSA-N	1	1	320.389	1.998	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@H]2C[C@@H](CO)C[C@H]21	ZINC001254553473	896498912	/nfs/dbraw/zinc/49/89/12/896498912.db2.gz	VQMKCQCKIIQZBL-DLTLXFJOSA-N	1	1	320.389	1.998	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565889	896504642	/nfs/dbraw/zinc/50/46/42/896504642.db2.gz	QUFBCPSGGQNBAJ-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565889	896504648	/nfs/dbraw/zinc/50/46/48/896504648.db2.gz	QUFBCPSGGQNBAJ-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
CC[N@@H+](CCN1CCOCC1)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254604292	896526827	/nfs/dbraw/zinc/52/68/27/896526827.db2.gz	UTASZJAONNSAEZ-QGZVFWFLSA-N	1	1	319.405	1.716	20	5		DDBDMO
O=C1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@H]2CCCN12	ZINC001254605309	896527606	/nfs/dbraw/zinc/52/76/06/896527606.db2.gz	BDLKYZGGFSAPOD-HZPDHXFCSA-N	1	1	315.373	1.759	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612450	896533496	/nfs/dbraw/zinc/53/34/96/896533496.db2.gz	WGZXYXXBOCDWBK-DZGCQCFKSA-N	1	1	318.377	1.455	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@H]1CO	ZINC000248964908	282121801	/nfs/dbraw/zinc/12/18/01/282121801.db2.gz	ROEFFTLLCMCLJV-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000079384897	185167824	/nfs/dbraw/zinc/16/78/24/185167824.db2.gz	LKVAKDZKINTXGM-UHFFFAOYSA-N	1	1	309.366	1.380	20	5		DDBDMO
CO[C@@]1(C)C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090551326	185302618	/nfs/dbraw/zinc/30/26/18/185302618.db2.gz	FCFXUGVRJZIKLR-CJNGLKHVSA-N	1	1	323.393	1.892	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000181418543	199293744	/nfs/dbraw/zinc/29/37/44/199293744.db2.gz	ANODRUJPMIVBEZ-SNVBAGLBSA-N	1	1	323.349	1.784	20	5		DDBDMO
CS(=O)(=O)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000279791441	215148690	/nfs/dbraw/zinc/14/86/90/215148690.db2.gz	MJHYZXFHLVQDKJ-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CC[NH+](CCc2cnccn2)CC1	ZINC000601253082	358464775	/nfs/dbraw/zinc/46/47/75/358464775.db2.gz	DGEQPUCGJRFSCG-UHFFFAOYSA-N	1	1	314.349	1.145	20	5		DDBDMO
Cc1cccc(C[NH+]2CCN(c3c([N+](=O)[O-])ncn3C)CC2)c1	ZINC000008337305	352134125	/nfs/dbraw/zinc/13/41/25/352134125.db2.gz	BTACEOLMBNCDDW-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
Nc1ccc(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000047287023	352489487	/nfs/dbraw/zinc/48/94/87/352489487.db2.gz	WHOKHPUMAZIVRA-QWHCGFSZSA-N	1	1	304.350	1.534	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC[C@H](C)O	ZINC000072713605	191218749	/nfs/dbraw/zinc/21/87/49/191218749.db2.gz	RXQQDWXUAIZBSG-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
NC(=O)C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1CCCC1	ZINC000052844406	352627733	/nfs/dbraw/zinc/62/77/33/352627733.db2.gz	NMPWARFETHJLLU-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C1CC1	ZINC000058857822	352854774	/nfs/dbraw/zinc/85/47/74/352854774.db2.gz	NNXXBGVEJWKUPY-UHFFFAOYSA-N	1	1	302.334	1.900	20	5		DDBDMO
Nc1c(C(=O)N2CC[NH+](CC3CC3)CC2)cc(F)cc1[N+](=O)[O-]	ZINC000064299485	352933156	/nfs/dbraw/zinc/93/31/56/352933156.db2.gz	OSNMQMIZWUIMKB-UHFFFAOYSA-N	1	1	322.340	1.484	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2CC[C@@H]([NH+]3CC=CC3)C2)cc1	ZINC000173524160	198224022	/nfs/dbraw/zinc/22/40/22/198224022.db2.gz	BULXVFVRKWFWRH-CYBMUJFWSA-N	1	1	323.374	1.230	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1	ZINC000068776757	353129208	/nfs/dbraw/zinc/12/92/08/353129208.db2.gz	WMUWQGVTDVDMLW-UHFFFAOYSA-N	1	1	323.397	1.469	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)CN1CCOCC1	ZINC000073021810	353233136	/nfs/dbraw/zinc/23/31/36/353233136.db2.gz	SNWGRWSVIZJDAK-CJNGLKHVSA-N	1	1	323.393	1.281	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3ccccc3C2)c1	ZINC000174645604	198364837	/nfs/dbraw/zinc/36/48/37/198364837.db2.gz	NWSRAKGOBRQMNQ-HNNXBMFYSA-N	1	1	302.334	1.211	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNCC1(O)CC[NH+](C)CC1	ZINC000077450008	353469470	/nfs/dbraw/zinc/46/94/70/353469470.db2.gz	IISUMLOVNMMTFR-UHFFFAOYSA-N	1	1	323.393	1.540	20	5		DDBDMO
CN(C)c1nc(NCCNc2ccccc2[N+](=O)[O-])cc[nH+]1	ZINC000077486663	353471675	/nfs/dbraw/zinc/47/16/75/353471675.db2.gz	ZQBSASITHZIAPU-UHFFFAOYSA-N	1	1	302.338	1.975	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)CC2	ZINC000078612839	353524185	/nfs/dbraw/zinc/52/41/85/353524185.db2.gz	LNIKOCCULQGPJQ-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@H+](Cc1cccc([N+](=O)[O-])c1)CC2	ZINC000078612839	353524188	/nfs/dbraw/zinc/52/41/88/353524188.db2.gz	LNIKOCCULQGPJQ-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000080554290	353614715	/nfs/dbraw/zinc/61/47/15/353614715.db2.gz	GXISCTFKSXMZCI-UHFFFAOYSA-N	1	1	306.366	1.526	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N3CCC[C@H](c4[nH]cc[nH+]4)C3)nn21	ZINC000091479994	353828310	/nfs/dbraw/zinc/82/83/10/353828310.db2.gz	HFEFEKZNSCABFM-JTQLQIEISA-N	1	1	313.321	1.745	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000141679000	354141536	/nfs/dbraw/zinc/14/15/36/354141536.db2.gz	YBRPSIIKYXPGRQ-CQSZACIVSA-N	1	1	319.361	1.670	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@]2(CCOC2)C1	ZINC000153491997	354200060	/nfs/dbraw/zinc/20/00/60/354200060.db2.gz	KBXKJKSZVNDGLI-MRXNPFEDSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@]2(CCOC2)C1	ZINC000153491997	354200064	/nfs/dbraw/zinc/20/00/64/354200064.db2.gz	KBXKJKSZVNDGLI-MRXNPFEDSA-N	1	1	319.361	1.954	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH3+])CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237488713	354343230	/nfs/dbraw/zinc/34/32/30/354343230.db2.gz	ZSGAGBBGMRRYHH-BDAKNGLRSA-N	1	1	303.322	1.423	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@H]2CCc3c[nH+]cn3C2)nc2sccn21	ZINC000588067746	354898640	/nfs/dbraw/zinc/89/86/40/354898640.db2.gz	MQKSPJHTQQCINO-QMMMGPOBSA-N	1	1	304.335	1.927	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]([N@H+]3CC[C@H](O)C3)C2)cc([N+](=O)[O-])c1	ZINC000588860632	354943791	/nfs/dbraw/zinc/94/37/91/354943791.db2.gz	KIAFLSQLMLJQHT-ZFWWWQNUSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]([C@H](C)O)C2)c1	ZINC000589510897	354997930	/nfs/dbraw/zinc/99/79/30/354997930.db2.gz	UNJXPNISUIDLIX-CMPLNLGQSA-N	1	1	308.334	1.584	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000590561799	355115028	/nfs/dbraw/zinc/11/50/28/355115028.db2.gz	GVVWGHBUWDPENZ-QWRGUYRKSA-N	1	1	309.322	1.123	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1cscn1	ZINC000591728799	355373162	/nfs/dbraw/zinc/37/31/62/355373162.db2.gz	OCVVBKFSDFNMIC-LLVKDONJSA-N	1	1	309.347	1.581	20	5		DDBDMO
CNC(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC000592130991	355508437	/nfs/dbraw/zinc/50/84/37/355508437.db2.gz	OGICFDIYVUMNFN-HDJSIYSDSA-N	1	1	321.377	1.446	20	5		DDBDMO
CNC(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC000592130991	355508439	/nfs/dbraw/zinc/50/84/39/355508439.db2.gz	OGICFDIYVUMNFN-HDJSIYSDSA-N	1	1	321.377	1.446	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC[C@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000593998411	356083263	/nfs/dbraw/zinc/08/32/63/356083263.db2.gz	JZQPONISBHXGJL-MRXNPFEDSA-N	1	1	319.361	1.848	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@]23CCNC3=O)ccc1[N+](=O)[O-]	ZINC000593998411	356083267	/nfs/dbraw/zinc/08/32/67/356083267.db2.gz	JZQPONISBHXGJL-MRXNPFEDSA-N	1	1	319.361	1.848	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594199313	356137934	/nfs/dbraw/zinc/13/79/34/356137934.db2.gz	JTELFQXANUVOET-OLZOCXBDSA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594199315	356137945	/nfs/dbraw/zinc/13/79/45/356137945.db2.gz	JTELFQXANUVOET-STQMWFEESA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1sc(S(=O)(=O)N(C)CC2C[NH+](C)C2)cc1[N+](=O)[O-]	ZINC000594846454	356335111	/nfs/dbraw/zinc/33/51/11/356335111.db2.gz	JDLAUPCALSZDJT-UHFFFAOYSA-N	1	1	319.408	1.147	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1	ZINC000081362763	192257668	/nfs/dbraw/zinc/25/76/68/192257668.db2.gz	UIUOFNCWMXWGAW-ZDUSSCGKSA-N	1	1	323.397	1.290	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000081556686	192292165	/nfs/dbraw/zinc/29/21/65/192292165.db2.gz	XESUDVFLGSKCDT-MNOVXSKESA-N	1	1	322.365	1.236	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CO)Cc1ccccc1	ZINC000595599572	356570408	/nfs/dbraw/zinc/57/04/08/356570408.db2.gz	YRDQPWAHTHCERD-CQSZACIVSA-N	1	1	304.350	1.327	20	5		DDBDMO
C[C@@H](CO)[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595679782	356607903	/nfs/dbraw/zinc/60/79/03/356607903.db2.gz	YCZWQXSMSAQCKQ-SMDDNHRTSA-N	1	1	321.377	1.677	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]3NC(=O)CC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000595728782	356625082	/nfs/dbraw/zinc/62/50/82/356625082.db2.gz	OWHMWUFJAAJYAS-OLZOCXBDSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595759874	356641220	/nfs/dbraw/zinc/64/12/20/356641220.db2.gz	QLCVJRQXWFAFMZ-WBMJQRKESA-N	1	1	319.361	1.892	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000596081872	356766076	/nfs/dbraw/zinc/76/60/76/356766076.db2.gz	AXYKFFQPWVOZEN-VXGBXAGGSA-N	1	1	304.350	1.732	20	5		DDBDMO
COc1cc(NC[C@]2(O)CC[N@@H+](C)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000596198041	356810581	/nfs/dbraw/zinc/81/05/81/356810581.db2.gz	PMDIYUXKIRAFIA-CYBMUJFWSA-N	1	1	315.757	1.735	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)[C@H](C)CO1	ZINC000596431578	356877897	/nfs/dbraw/zinc/87/78/97/356877897.db2.gz	PIFUYEXUJBQXSO-GHMZBOCLSA-N	1	1	319.365	1.414	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN=c2[nH]c3ccc([N+](=O)[O-])cc3[nH]2)[C@H](C)CO1	ZINC000596431578	356877899	/nfs/dbraw/zinc/87/78/99/356877899.db2.gz	PIFUYEXUJBQXSO-GHMZBOCLSA-N	1	1	319.365	1.414	20	5		DDBDMO
Cc1cnc(N2CCC([N@H+]3CCCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000596269434	356839032	/nfs/dbraw/zinc/83/90/32/356839032.db2.gz	UMRPUNFQXXXLPB-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000596305882	356852232	/nfs/dbraw/zinc/85/22/32/356852232.db2.gz	BXWYJXHZABGSRC-VIFPVBQESA-N	1	1	307.354	1.373	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000597574712	357233935	/nfs/dbraw/zinc/23/39/35/357233935.db2.gz	GYMOQASUKBQMRM-VXGBXAGGSA-N	1	1	310.329	1.192	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597853903	357358071	/nfs/dbraw/zinc/35/80/71/357358071.db2.gz	DKUBLZWZMUGVEF-SNVBAGLBSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000597862296	357362978	/nfs/dbraw/zinc/36/29/78/357362978.db2.gz	ZOALUTIAGDDXKF-JTQLQIEISA-N	1	1	322.365	1.546	20	5		DDBDMO
CCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1	ZINC000598044189	357440565	/nfs/dbraw/zinc/44/05/65/357440565.db2.gz	ZPPHRLJVXGRLSA-CQSZACIVSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)n1	ZINC000597920422	357381606	/nfs/dbraw/zinc/38/16/06/357381606.db2.gz	BTGHCHBQOPIFOY-SNVBAGLBSA-N	1	1	309.370	1.414	20	5		DDBDMO
CC[N@H+](Cc1cnn(C)c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178580368	198891580	/nfs/dbraw/zinc/89/15/80/198891580.db2.gz	KQZNJXASPNFUEL-OAHLLOKOSA-N	1	1	304.350	1.884	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000598221528	357497733	/nfs/dbraw/zinc/49/77/33/357497733.db2.gz	XDGICIKCXTYRMR-LLVKDONJSA-N	1	1	321.381	1.763	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC23CCOCC3)c([N+](=O)[O-])c1	ZINC000618318303	363582930	/nfs/dbraw/zinc/58/29/30/363582930.db2.gz	PLZHSRJHYGBEOO-UHFFFAOYSA-N	1	1	305.334	1.449	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CCOC1	ZINC000178775955	198929182	/nfs/dbraw/zinc/92/91/82/198929182.db2.gz	ZJFCKPPYVIDVQI-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC1COC1)c1ccc([N+](=O)[O-])cc1	ZINC000599079328	357808831	/nfs/dbraw/zinc/80/88/31/357808831.db2.gz	DPNXININDUOBQN-AWEZNQCLSA-N	1	1	302.334	1.654	20	5		DDBDMO
Cc1cc(N2CC(CN3CC[NH+](C)CC3)C2)c(F)cc1[N+](=O)[O-]	ZINC000599109926	357818522	/nfs/dbraw/zinc/81/85/22/357818522.db2.gz	XXIMYEAYJUAXJS-UHFFFAOYSA-N	1	1	322.384	1.726	20	5		DDBDMO
CCC(=O)c1ccc(NCC[N@@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000599175636	357840520	/nfs/dbraw/zinc/84/05/20/357840520.db2.gz	FTQBQTUTGZPLRI-GFCCVEGCSA-N	1	1	307.350	1.666	20	5		DDBDMO
CCC(=O)c1ccc(NCC[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000599175636	357840522	/nfs/dbraw/zinc/84/05/22/357840522.db2.gz	FTQBQTUTGZPLRI-GFCCVEGCSA-N	1	1	307.350	1.666	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2NCC[N@@H+]1CC[C@H](O)C1	ZINC000599200154	357847300	/nfs/dbraw/zinc/84/73/00/357847300.db2.gz	YGERDHNGPZXWMQ-NSHDSACASA-N	1	1	302.334	1.622	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H]1C[C@@H](O)C1	ZINC000599669410	358017379	/nfs/dbraw/zinc/01/73/79/358017379.db2.gz	DFVXZAZQBHRICE-BJHJDKERSA-N	1	1	307.350	1.544	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(CC)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000599985283	358096655	/nfs/dbraw/zinc/09/66/55/358096655.db2.gz	BLZMINCWWUEIQL-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](O)COCC3CC3)c2c1	ZINC000601108435	358404921	/nfs/dbraw/zinc/40/49/21/358404921.db2.gz	HLELXOXVMVYZOH-CYBMUJFWSA-N	1	1	317.345	1.764	20	5		DDBDMO
Cc1c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cnn1C	ZINC000601149865	358422560	/nfs/dbraw/zinc/42/25/60/358422560.db2.gz	QXMMEQHGGFJSNU-OAHLLOKOSA-N	1	1	304.350	1.634	20	5		DDBDMO
COCCCN(CCO)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601150842	358423397	/nfs/dbraw/zinc/42/33/97/358423397.db2.gz	FSWJEKBXQNXJPV-UHFFFAOYSA-N	1	1	305.334	1.978	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000601184141	358437521	/nfs/dbraw/zinc/43/75/21/358437521.db2.gz	IBULHIBSTHVVAW-CMPLNLGQSA-N	1	1	320.349	1.164	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000601187314	358439361	/nfs/dbraw/zinc/43/93/61/358439361.db2.gz	RIEYBUVVRNGVNR-UHFFFAOYSA-N	1	1	322.365	1.615	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000601187314	358439362	/nfs/dbraw/zinc/43/93/62/358439362.db2.gz	RIEYBUVVRNGVNR-UHFFFAOYSA-N	1	1	322.365	1.615	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2C[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000601974197	358761256	/nfs/dbraw/zinc/76/12/56/358761256.db2.gz	QQYAACCEJOPCBE-PHIMTYICSA-N	1	1	321.333	1.120	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2C[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000601974197	358761260	/nfs/dbraw/zinc/76/12/60/358761260.db2.gz	QQYAACCEJOPCBE-PHIMTYICSA-N	1	1	321.333	1.120	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000602195460	358876719	/nfs/dbraw/zinc/87/67/19/358876719.db2.gz	LSUJJTKVKJUDQE-BLLLJJGKSA-N	1	1	321.377	1.260	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C(=O)NCC3CC3)C2)c([N+](=O)[O-])n1	ZINC000602438184	358976445	/nfs/dbraw/zinc/97/64/45/358976445.db2.gz	BPYSNDMSKQZYGG-LBPRGKRZSA-N	1	1	321.381	1.067	20	5		DDBDMO
CC(C)C(=O)NC1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602440504	358978363	/nfs/dbraw/zinc/97/83/63/358978363.db2.gz	PWMNCPKWJKGPJE-UHFFFAOYSA-N	1	1	309.370	1.065	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCS[C@@H]2COCC[C@@H]21	ZINC000602784993	359190169	/nfs/dbraw/zinc/19/01/69/359190169.db2.gz	QVMXZSIOTLZBTR-NWDGAFQWSA-N	1	1	312.395	1.306	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1	ZINC000602795300	359197773	/nfs/dbraw/zinc/19/77/73/359197773.db2.gz	HUHOLHMXOWNHJD-GXTWGEPZSA-N	1	1	318.381	1.879	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602915330	359292035	/nfs/dbraw/zinc/29/20/35/359292035.db2.gz	BAGAUWUFJGUZHV-ZDUSSCGKSA-N	1	1	309.370	1.090	20	5		DDBDMO
CCn1nc(C)c(C[N@H+](C)CCn2cc([N+](=O)[O-])cn2)c1C	ZINC000602926895	359298984	/nfs/dbraw/zinc/29/89/84/359298984.db2.gz	SWBYZZMQHVTPAO-UHFFFAOYSA-N	1	1	306.370	1.757	20	5		DDBDMO
CCn1nc(C)c(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)c1C	ZINC000602926895	359298985	/nfs/dbraw/zinc/29/89/85/359298985.db2.gz	SWBYZZMQHVTPAO-UHFFFAOYSA-N	1	1	306.370	1.757	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899261	359280617	/nfs/dbraw/zinc/28/06/17/359280617.db2.gz	OYVPQTBVUBQMBM-DGCLKSJQSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000602899261	359280621	/nfs/dbraw/zinc/28/06/21/359280621.db2.gz	OYVPQTBVUBQMBM-DGCLKSJQSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](CCO)[C@H](C)C1	ZINC000187675219	200143702	/nfs/dbraw/zinc/14/37/02/200143702.db2.gz	IIRBQNMORBKUNW-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
C[C@H]1CN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000187743268	200151994	/nfs/dbraw/zinc/15/19/94/200151994.db2.gz	SZKWSCAAEGVIMB-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C[C@@H]1C	ZINC000359020302	299308851	/nfs/dbraw/zinc/30/88/51/299308851.db2.gz	PUAGKZAOZTWVGH-RYUDHWBXSA-N	1	1	321.381	1.748	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000611147069	360637227	/nfs/dbraw/zinc/63/72/27/360637227.db2.gz	UFJIKTOPYUKBQZ-CYBMUJFWSA-N	1	1	306.366	1.531	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611261059	360681921	/nfs/dbraw/zinc/68/19/21/360681921.db2.gz	IESVIGLCZYKDKA-JTQLQIEISA-N	1	1	324.333	1.607	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611274433	360686810	/nfs/dbraw/zinc/68/68/10/360686810.db2.gz	CVUBSMRFZZTEEI-UHFFFAOYSA-N	1	1	323.349	1.324	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C(C)(C)CO)CC2)c1	ZINC000611515836	360743048	/nfs/dbraw/zinc/74/30/48/360743048.db2.gz	IHXAAVOQUFKQFQ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000281291878	216215970	/nfs/dbraw/zinc/21/59/70/216215970.db2.gz	GXTOBPPXXVPZPQ-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
COCC[N@@H+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000611615838	360776660	/nfs/dbraw/zinc/77/66/60/360776660.db2.gz	CDYWEJSEGAYBTN-ZDUSSCGKSA-N	1	1	308.382	1.764	20	5		DDBDMO
COCC[N@H+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000611615838	360776665	/nfs/dbraw/zinc/77/66/65/360776665.db2.gz	CDYWEJSEGAYBTN-ZDUSSCGKSA-N	1	1	308.382	1.764	20	5		DDBDMO
COCC1([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000612110826	360923312	/nfs/dbraw/zinc/92/33/12/360923312.db2.gz	YIYXVOWGQGXLHK-LBPRGKRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)NCC[NH+]2CCCCC2)c1	ZINC000194158419	201188328	/nfs/dbraw/zinc/18/83/28/201188328.db2.gz	FCWHXPBNTQRETH-UHFFFAOYSA-N	1	1	313.379	1.359	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619253066	363946943	/nfs/dbraw/zinc/94/69/43/363946943.db2.gz	QYEQFLJPDWXFFL-KBPBESRZSA-N	1	1	307.325	1.853	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000619438225	364008960	/nfs/dbraw/zinc/00/89/60/364008960.db2.gz	QQGCTWKSMDFNNA-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCCN1CCC[N@@H+](C)CC1	ZINC000619479149	364029603	/nfs/dbraw/zinc/02/96/03/364029603.db2.gz	XZOQGIDUMBBQGA-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCC[N@@H+]1CCCN(C)CC1	ZINC000619479149	364029607	/nfs/dbraw/zinc/02/96/07/364029607.db2.gz	XZOQGIDUMBBQGA-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCCC[N@H+]1CCCN(C)CC1	ZINC000619479149	364029609	/nfs/dbraw/zinc/02/96/09/364029609.db2.gz	XZOQGIDUMBBQGA-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000619566959	364062986	/nfs/dbraw/zinc/06/29/86/364062986.db2.gz	CUDBQUSFACCPNA-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
NC(=O)N1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000092754012	193188327	/nfs/dbraw/zinc/18/83/27/193188327.db2.gz	JKQQLPCNERKTFS-ZZXKWVIFSA-N	1	1	304.350	1.694	20	5		DDBDMO
NC(=O)N1CCC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000092754012	193188329	/nfs/dbraw/zinc/18/83/29/193188329.db2.gz	JKQQLPCNERKTFS-ZZXKWVIFSA-N	1	1	304.350	1.694	20	5		DDBDMO
CCOc1cc(C[N@H+](CC)[C@H]2CCNC2=O)ccc1[N+](=O)[O-]	ZINC000282528797	217064665	/nfs/dbraw/zinc/06/46/65/217064665.db2.gz	YWEDEJUJUAUFGE-ZDUSSCGKSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCOc1cc(C[N@@H+](CC)[C@H]2CCNC2=O)ccc1[N+](=O)[O-]	ZINC000282528797	217064668	/nfs/dbraw/zinc/06/46/68/217064668.db2.gz	YWEDEJUJUAUFGE-ZDUSSCGKSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000266418136	205330727	/nfs/dbraw/zinc/33/07/27/205330727.db2.gz	PDQDLBBEIAIUMO-CQSZACIVSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCOCC1	ZINC000267558124	206142957	/nfs/dbraw/zinc/14/29/57/206142957.db2.gz	ABJBLEFODYHPGX-BLLLJJGKSA-N	1	1	323.368	1.886	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCOCC1	ZINC000267558124	206142961	/nfs/dbraw/zinc/14/29/61/206142961.db2.gz	ABJBLEFODYHPGX-BLLLJJGKSA-N	1	1	323.368	1.886	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000273927766	211181877	/nfs/dbraw/zinc/18/18/77/211181877.db2.gz	FDVOHMWQQDBROA-CYBMUJFWSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000273927766	211181880	/nfs/dbraw/zinc/18/18/80/211181880.db2.gz	FDVOHMWQQDBROA-CYBMUJFWSA-N	1	1	304.350	1.631	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[NH+](C[C@@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000284823631	218194006	/nfs/dbraw/zinc/19/40/06/218194006.db2.gz	OLYUCIGKHNTJMD-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000567438728	304219042	/nfs/dbraw/zinc/21/90/42/304219042.db2.gz	DPCOCUXGBZUHJR-LBPRGKRZSA-N	1	1	306.366	1.680	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000159407503	197351376	/nfs/dbraw/zinc/35/13/76/197351376.db2.gz	CXWFNGLQGBDAKS-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)[N@@H+](C)C1CC1	ZINC000057706789	184047915	/nfs/dbraw/zinc/04/79/15/184047915.db2.gz	AECBYLULQWFWTM-QMMMGPOBSA-N	1	1	310.329	1.529	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](O)C[C@@H]1C	ZINC000340904193	251267100	/nfs/dbraw/zinc/26/71/00/251267100.db2.gz	JAGOJEHLMOKFGU-CMPLNLGQSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917678	251275659	/nfs/dbraw/zinc/27/56/59/251275659.db2.gz	UWDBFHJLMILHSN-SKDRFNHKSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917678	251275661	/nfs/dbraw/zinc/27/56/61/251275661.db2.gz	UWDBFHJLMILHSN-SKDRFNHKSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000340921185	251278354	/nfs/dbraw/zinc/27/83/54/251278354.db2.gz	XLEBANITEIXGNR-ZYHUDNBSSA-N	1	1	321.333	1.348	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000330897541	532958177	/nfs/dbraw/zinc/95/81/77/532958177.db2.gz	MDMUOFJSWFLSLP-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000330897541	532958179	/nfs/dbraw/zinc/95/81/79/532958179.db2.gz	MDMUOFJSWFLSLP-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000352395829	285021094	/nfs/dbraw/zinc/02/10/94/285021094.db2.gz	RTKNHZDJUNRNMX-UHFFFAOYSA-N	1	1	313.354	1.513	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](CCO)CC1CC1	ZINC000352459517	285064400	/nfs/dbraw/zinc/06/44/00/285064400.db2.gz	ZUCQIVCFBAREPF-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)Cn1cccn1	ZINC000352545621	285130799	/nfs/dbraw/zinc/13/07/99/285130799.db2.gz	YSGPKOGIOJBVIV-AWEZNQCLSA-N	1	1	304.350	1.327	20	5		DDBDMO
C[C@@H](NC(=O)N1CC[NH2+]C[C@](C)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000417140696	533126495	/nfs/dbraw/zinc/12/64/95/533126495.db2.gz	QJVVFHKGURGKJK-ABAIWWIYSA-N	1	1	324.356	1.999	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)[C@H]1CCC[C@H]1O	ZINC000352660393	285204580	/nfs/dbraw/zinc/20/45/80/285204580.db2.gz	NUEHBPXFQUBLAS-WCQYABFASA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc([S@@](C)=O)cc1	ZINC000360211953	299615767	/nfs/dbraw/zinc/61/57/67/299615767.db2.gz	HJUCOAFYFVMDQZ-MLMJSJRWSA-N	1	1	322.390	1.917	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](O)CC1	ZINC000293037213	533328590	/nfs/dbraw/zinc/32/85/90/533328590.db2.gz	GSXKKSCTWHLNOF-SMDDNHRTSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](O)CC1	ZINC000293037213	533328598	/nfs/dbraw/zinc/32/85/98/533328598.db2.gz	GSXKKSCTWHLNOF-SMDDNHRTSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000444366720	533413005	/nfs/dbraw/zinc/41/30/05/533413005.db2.gz	YBHCDAWBFGPAFJ-NSHDSACASA-N	1	1	319.361	1.984	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000451578520	533415483	/nfs/dbraw/zinc/41/54/83/533415483.db2.gz	XKIGOQXZHCKPGW-QMTHXVAHSA-N	1	1	307.350	1.551	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330895785	533604171	/nfs/dbraw/zinc/60/41/71/533604171.db2.gz	GJWAYHMYYYVHRG-NEPJUHHUSA-N	1	1	307.350	1.573	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCS(=O)(=O)C1	ZINC000069144137	406685926	/nfs/dbraw/zinc/68/59/26/406685926.db2.gz	MYWPHWZTMVBVMX-NSHDSACASA-N	1	1	314.363	1.270	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)[NH2+]1	ZINC000070076799	406808352	/nfs/dbraw/zinc/80/83/52/406808352.db2.gz	NAGMLVVUHBZQQK-PHIMTYICSA-N	1	1	313.379	1.107	20	5		DDBDMO
O=C(C[N@@H+](CCO)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000071955959	406870782	/nfs/dbraw/zinc/87/07/82/406870782.db2.gz	DKJUIUKOQYWEIX-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
O=C(C[N@H+](CCO)C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000071955959	406870784	/nfs/dbraw/zinc/87/07/84/406870784.db2.gz	DKJUIUKOQYWEIX-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H]1CCCO1	ZINC000076298339	406962628	/nfs/dbraw/zinc/96/26/28/406962628.db2.gz	VTAZPNRMEIQSHW-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H]1CCCO1	ZINC000076298339	406962629	/nfs/dbraw/zinc/96/26/29/406962629.db2.gz	VTAZPNRMEIQSHW-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CCOC(=O)c1ccnc(NCC[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000077961065	407016297	/nfs/dbraw/zinc/01/62/97/407016297.db2.gz	TXJVFRBPLSWCIB-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)cc1	ZINC000089153783	407125528	/nfs/dbraw/zinc/12/55/28/407125528.db2.gz	LMICUORNKNXPPL-JKSUJKDBSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@@H]([C@@H]3CCCO3)C2)cc1	ZINC000089153783	407125531	/nfs/dbraw/zinc/12/55/31/407125531.db2.gz	LMICUORNKNXPPL-JKSUJKDBSA-N	1	1	322.361	1.853	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000089205057	407126469	/nfs/dbraw/zinc/12/64/69/407126469.db2.gz	YFOOVIBRUHPNEI-LBPRGKRZSA-N	1	1	319.321	1.130	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000089205057	407126472	/nfs/dbraw/zinc/12/64/72/407126472.db2.gz	YFOOVIBRUHPNEI-LBPRGKRZSA-N	1	1	319.321	1.130	20	5		DDBDMO
CCn1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000093534298	407198155	/nfs/dbraw/zinc/19/81/55/407198155.db2.gz	NTJHNDRUDUGJSU-CYBMUJFWSA-N	1	1	316.365	1.893	20	5		DDBDMO
CCn1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000093534298	407198157	/nfs/dbraw/zinc/19/81/57/407198157.db2.gz	NTJHNDRUDUGJSU-CYBMUJFWSA-N	1	1	316.365	1.893	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](C)CC1	ZINC000097617569	407300507	/nfs/dbraw/zinc/30/05/07/407300507.db2.gz	SPELIZLIYXGCQL-UHFFFAOYSA-N	1	1	306.366	1.439	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159768	407407305	/nfs/dbraw/zinc/40/73/05/407407305.db2.gz	DBVNIYMGBRDROW-FBWDIHGXSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159768	407407306	/nfs/dbraw/zinc/40/73/06/407407306.db2.gz	DBVNIYMGBRDROW-FBWDIHGXSA-N	1	1	300.380	1.327	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCc3cccc(F)c3C2)c1	ZINC000270983037	407451237	/nfs/dbraw/zinc/45/12/37/407451237.db2.gz	ADWGACYCJSBJLQ-ZDUSSCGKSA-N	1	1	320.324	1.350	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3cccc(F)c3C2)c1	ZINC000270983037	407451241	/nfs/dbraw/zinc/45/12/41/407451241.db2.gz	ADWGACYCJSBJLQ-ZDUSSCGKSA-N	1	1	320.324	1.350	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000114063715	407539504	/nfs/dbraw/zinc/53/95/04/407539504.db2.gz	JVBSHHDAPHXZRD-LLVKDONJSA-N	1	1	323.349	1.299	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000114063715	407539505	/nfs/dbraw/zinc/53/95/05/407539505.db2.gz	JVBSHHDAPHXZRD-LLVKDONJSA-N	1	1	323.349	1.299	20	5		DDBDMO
CC[N@@H+](CCCO)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000266872381	407656133	/nfs/dbraw/zinc/65/61/33/407656133.db2.gz	QRCFISAXBPLACO-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[NH+]2CCC1CC2	ZINC000116556281	407763107	/nfs/dbraw/zinc/76/31/07/407763107.db2.gz	ZFLOFDWAOUVCPH-UHFFFAOYSA-N	1	1	315.333	1.391	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000187436492	407857602	/nfs/dbraw/zinc/85/76/02/407857602.db2.gz	DZQTUDSYOUPWEN-WFASDCNBSA-N	1	1	321.377	1.950	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1	ZINC000153599419	407857844	/nfs/dbraw/zinc/85/78/44/407857844.db2.gz	XZLWSHYLQXHSPL-HNNXBMFYSA-N	1	1	305.334	1.306	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796336	407871166	/nfs/dbraw/zinc/87/11/66/407871166.db2.gz	ZJVYPMFOOOKJHT-WFASDCNBSA-N	1	1	321.377	1.281	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796336	407871171	/nfs/dbraw/zinc/87/11/71/407871171.db2.gz	ZJVYPMFOOOKJHT-WFASDCNBSA-N	1	1	321.377	1.281	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000268177655	407930346	/nfs/dbraw/zinc/93/03/46/407930346.db2.gz	KWSHIZRJLPPIEF-NHYWBVRUSA-N	1	1	319.361	1.573	20	5		DDBDMO
Cn1ncc2c1CCC[C@H]2[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000135561188	408030897	/nfs/dbraw/zinc/03/08/97/408030897.db2.gz	NVECDCTZMCOIPT-GFCCVEGCSA-N	1	1	304.354	1.534	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@@H]2CCC[C@H]21	ZINC000273084929	408050222	/nfs/dbraw/zinc/05/02/22/408050222.db2.gz	YOOSLURCAYKTKK-UMVBOHGHSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@@H]2CCC[C@H]21	ZINC000273084929	408050227	/nfs/dbraw/zinc/05/02/27/408050227.db2.gz	YOOSLURCAYKTKK-UMVBOHGHSA-N	1	1	322.361	1.588	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000189636336	408069113	/nfs/dbraw/zinc/06/91/13/408069113.db2.gz	HVNWALKQKDPUCI-INIZCTEOSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182242480	408104158	/nfs/dbraw/zinc/10/41/58/408104158.db2.gz	LTJHUTQBLAQSHH-RDBSUJKOSA-N	1	1	324.377	1.570	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])c1	ZINC000190403194	408237460	/nfs/dbraw/zinc/23/74/60/408237460.db2.gz	YBIRJTVNFNXFHY-QMTHXVAHSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@@H](C)[C@H]2CO)c([N+](=O)[O-])c1	ZINC000190403194	408237468	/nfs/dbraw/zinc/23/74/68/408237468.db2.gz	YBIRJTVNFNXFHY-QMTHXVAHSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H]1C[NH3+]	ZINC000156654767	408270693	/nfs/dbraw/zinc/27/06/93/408270693.db2.gz	FIMBZDGVSAXHPG-RNCFNFMXSA-N	1	1	317.349	1.671	20	5		DDBDMO
O=C(NCC1CC1)[C@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176210422	408308519	/nfs/dbraw/zinc/30/85/19/408308519.db2.gz	SIZWUWPDOLROML-ZDUSSCGKSA-N	1	1	321.381	1.030	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1C[C@H](C)O	ZINC000246785071	408337793	/nfs/dbraw/zinc/33/77/93/408337793.db2.gz	JAQKOEHUGGLUBW-WDEREUQCSA-N	1	1	311.338	1.105	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1C[C@H](C)O	ZINC000246785071	408337797	/nfs/dbraw/zinc/33/77/97/408337797.db2.gz	JAQKOEHUGGLUBW-WDEREUQCSA-N	1	1	311.338	1.105	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)n1	ZINC000134893625	162090926	/nfs/dbraw/zinc/09/09/26/162090926.db2.gz	IPUKQCNMPHFQGS-HIFRSBDPSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)n1	ZINC000134893625	162090939	/nfs/dbraw/zinc/09/09/39/162090939.db2.gz	IPUKQCNMPHFQGS-HIFRSBDPSA-N	1	1	319.409	1.740	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H]3[C@H](CCCN3C3CC3)C2)n1	ZINC000134893625	162090941	/nfs/dbraw/zinc/09/09/41/162090941.db2.gz	IPUKQCNMPHFQGS-HIFRSBDPSA-N	1	1	319.409	1.740	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000183225449	408360488	/nfs/dbraw/zinc/36/04/88/408360488.db2.gz	QQHCYTHPSTUFMN-DYEKYZERSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000171268651	162211189	/nfs/dbraw/zinc/21/11/89/162211189.db2.gz	ZVQQJKGEKXIQBQ-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
Nc1cc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccn1	ZINC000191394010	408418322	/nfs/dbraw/zinc/41/83/22/408418322.db2.gz	JKBLPJRMBAVKQI-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1	ZINC000264456513	408497499	/nfs/dbraw/zinc/49/74/99/408497499.db2.gz	DMGOSDSNEXQLDJ-CYBMUJFWSA-N	1	1	307.350	1.354	20	5		DDBDMO
Cc1ccc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000269913048	408466652	/nfs/dbraw/zinc/46/66/52/408466652.db2.gz	IRUXMTHNEDNLKR-CYBMUJFWSA-N	1	1	306.366	1.655	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCc3n[nH]cc3C2)c1	ZINC000270544376	408572050	/nfs/dbraw/zinc/57/20/50/408572050.db2.gz	LRVNQMSLOGHYKL-ZDUSSCGKSA-N	1	1	318.333	1.116	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCc3n[nH]cc3C2)c1	ZINC000270544376	408572054	/nfs/dbraw/zinc/57/20/54/408572054.db2.gz	LRVNQMSLOGHYKL-ZDUSSCGKSA-N	1	1	318.333	1.116	20	5		DDBDMO
CCOC(=O)C[N@H+](CCn1ccc([N+](=O)[O-])n1)C1CCCC1	ZINC000177296157	408572642	/nfs/dbraw/zinc/57/26/42/408572642.db2.gz	JJVTUTMLAIDIPI-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
CCOC(=O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CCCC1	ZINC000177296157	408572645	/nfs/dbraw/zinc/57/26/45/408572645.db2.gz	JJVTUTMLAIDIPI-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184246876	408578058	/nfs/dbraw/zinc/57/80/58/408578058.db2.gz	FQIABSMWUNWUCY-SECBINFHSA-N	1	1	314.313	1.983	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184246876	408578059	/nfs/dbraw/zinc/57/80/59/408578059.db2.gz	FQIABSMWUNWUCY-SECBINFHSA-N	1	1	314.313	1.983	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@H]1C	ZINC000275387152	408588164	/nfs/dbraw/zinc/58/81/64/408588164.db2.gz	PYSWOEPDMHWHBM-NEPJUHHUSA-N	1	1	320.393	1.454	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000265241406	408589111	/nfs/dbraw/zinc/58/91/11/408589111.db2.gz	TZVPLAZGSQHVPX-UHFFFAOYSA-N	1	1	307.394	1.873	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1	ZINC000192530701	408604809	/nfs/dbraw/zinc/60/48/09/408604809.db2.gz	YXKAWHLWYPCZKV-PHIMTYICSA-N	1	1	305.334	1.237	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000265612250	408713925	/nfs/dbraw/zinc/71/39/25/408713925.db2.gz	XFWGKTAISRHZCV-JTQLQIEISA-N	1	1	311.769	1.859	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC000275845690	408694660	/nfs/dbraw/zinc/69/46/60/408694660.db2.gz	KKNYDTCOAQUYMX-IHRRRGAJSA-N	1	1	324.377	1.570	20	5		DDBDMO
CCN(C)C(=O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000185181743	408776077	/nfs/dbraw/zinc/77/60/77/408776077.db2.gz	XRROVCPNALPDIM-UHFFFAOYSA-N	1	1	317.292	1.764	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280876161	408851215	/nfs/dbraw/zinc/85/12/15/408851215.db2.gz	ZUNTWEIMAUDJGS-BMIGLBTASA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014911	408907034	/nfs/dbraw/zinc/90/70/34/408907034.db2.gz	PPOATBOMPSLUMF-YPMHNXCESA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000286014911	408907038	/nfs/dbraw/zinc/90/70/38/408907038.db2.gz	PPOATBOMPSLUMF-YPMHNXCESA-N	1	1	311.407	1.951	20	5		DDBDMO
C[N@H+]1CCN(CCNC(=O)c2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000281825346	408935316	/nfs/dbraw/zinc/93/53/16/408935316.db2.gz	RKSCWGFCPOZIRP-UHFFFAOYSA-N	1	1	320.393	1.351	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000194747260	163295456	/nfs/dbraw/zinc/29/54/56/163295456.db2.gz	DXWIZJDRNLQLCR-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC(F)(F)[C@H](CO)C2)c1	ZINC000291959780	408953290	/nfs/dbraw/zinc/95/32/90/408953290.db2.gz	UYOJFZNODAWIDG-NSHDSACASA-N	1	1	316.304	1.923	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000291992234	408957680	/nfs/dbraw/zinc/95/76/80/408957680.db2.gz	WXKLQIDYYJDNME-ZIAGYGMSSA-N	1	1	324.377	1.834	20	5		DDBDMO
CCC[C@]1(C(=O)OCC)CCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000277617362	408978426	/nfs/dbraw/zinc/97/84/26/408978426.db2.gz	ADNFXSRZVMCBTR-OAHLLOKOSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCC[C@]1(C(=O)OCC)CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000277617362	408978429	/nfs/dbraw/zinc/97/84/29/408978429.db2.gz	ADNFXSRZVMCBTR-OAHLLOKOSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000277690965	408993337	/nfs/dbraw/zinc/99/33/37/408993337.db2.gz	KJIPTQYKDIIJQM-GHMZBOCLSA-N	1	1	307.354	1.237	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]([C@H](O)C(F)(F)F)C2)n1	ZINC000277721546	408999035	/nfs/dbraw/zinc/99/90/35/408999035.db2.gz	JFNYJKUPLUQVRD-ONGXEEELSA-N	1	1	322.287	1.427	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000278396866	409079872	/nfs/dbraw/zinc/07/98/72/409079872.db2.gz	KLLBGAVFSSVIRG-SECBINFHSA-N	1	1	307.354	1.261	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C[C@H]2C1	ZINC000278808857	409093728	/nfs/dbraw/zinc/09/37/28/409093728.db2.gz	RYVWGAANUJAYKW-TXEJJXNPSA-N	1	1	316.361	1.477	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000284201005	409295381	/nfs/dbraw/zinc/29/53/81/409295381.db2.gz	ZOQJEOBCJYYYOO-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000280663287	409398239	/nfs/dbraw/zinc/39/82/39/409398239.db2.gz	XJELVUZLNZKSSV-UHFFFAOYSA-N	1	1	321.377	1.836	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1COC1	ZINC000295524768	409331379	/nfs/dbraw/zinc/33/13/79/409331379.db2.gz	UXHVKJXAAKGJDT-AWEZNQCLSA-N	1	1	310.350	1.444	20	5		DDBDMO
NC(=O)c1ccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000317043684	164025529	/nfs/dbraw/zinc/02/55/29/164025529.db2.gz	VBVFLVVBINSNDH-NWDGAFQWSA-N	1	1	304.350	1.732	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000408128960	164236477	/nfs/dbraw/zinc/23/64/77/164236477.db2.gz	MLEWTVLSYRLYIP-ONGXEEELSA-N	1	1	309.370	1.049	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1(CO)CC1	ZINC000285555271	409486357	/nfs/dbraw/zinc/48/63/57/409486357.db2.gz	RDZDRCUEJWZSDB-UHFFFAOYSA-N	1	1	311.313	1.519	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@]1(O)CC[N@@H+](C)C1	ZINC000353914488	409558386	/nfs/dbraw/zinc/55/83/86/409558386.db2.gz	RSCQQWDXOVVLKO-HNNXBMFYSA-N	1	1	322.365	1.345	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000345043249	409602036	/nfs/dbraw/zinc/60/20/36/409602036.db2.gz	GIYCFNXHGKJRRY-SNVBAGLBSA-N	1	1	314.773	1.536	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331591936	409670010	/nfs/dbraw/zinc/67/00/10/409670010.db2.gz	XZBUEQYHXSLZJN-WDEREUQCSA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1cc(C(=O)N=c2ccn(CC[NH+](C)C)[nH]2)ccc1[N+](=O)[O-]	ZINC000354128889	409679743	/nfs/dbraw/zinc/67/97/43/409679743.db2.gz	MJOVLWRMBJYQMJ-UHFFFAOYSA-N	1	1	317.349	1.914	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000354406687	409831952	/nfs/dbraw/zinc/83/19/52/409831952.db2.gz	VZSMNDUYQDIFAZ-KOLCDFICSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000354406687	409831961	/nfs/dbraw/zinc/83/19/61/409831961.db2.gz	VZSMNDUYQDIFAZ-KOLCDFICSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000354406687	409831970	/nfs/dbraw/zinc/83/19/70/409831970.db2.gz	VZSMNDUYQDIFAZ-KOLCDFICSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H]1C	ZINC000354439066	409855172	/nfs/dbraw/zinc/85/51/72/409855172.db2.gz	UXKSYRABUQQWQD-RYUDHWBXSA-N	1	1	308.382	1.878	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000346144006	409817263	/nfs/dbraw/zinc/81/72/63/409817263.db2.gz	UCIWFUGLJSCOKH-MNOVXSKESA-N	1	1	323.397	1.873	20	5		DDBDMO
C[C@H]1COCCN1CC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338379988	409949490	/nfs/dbraw/zinc/94/94/90/409949490.db2.gz	QUMJPYBBQCMTDQ-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000346689214	410087003	/nfs/dbraw/zinc/08/70/03/410087003.db2.gz	PRGSEHPLZGKLQR-LBPRGKRZSA-N	1	1	311.357	1.622	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](CO)C1	ZINC000298085337	410105529	/nfs/dbraw/zinc/10/55/29/410105529.db2.gz	HDSOPHLPDZHQMR-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
C[N@H+]1CCCN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1	ZINC000298089937	410108137	/nfs/dbraw/zinc/10/81/37/410108137.db2.gz	RJBJEIOWGIQLIK-UHFFFAOYSA-N	1	1	318.377	1.121	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C1	ZINC000332693280	410218918	/nfs/dbraw/zinc/21/89/18/410218918.db2.gz	KTXXPPULRSOSED-LLVKDONJSA-N	1	1	309.370	1.051	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CCC[N@H+]1C	ZINC000343437277	410452031	/nfs/dbraw/zinc/45/20/31/410452031.db2.gz	KYKOCKJMZVDLRB-IINYFYTJSA-N	1	1	309.341	1.875	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343441162	410455055	/nfs/dbraw/zinc/45/50/55/410455055.db2.gz	BXNVMZSQHMQHPT-FZMZJTMJSA-N	1	1	307.350	1.573	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000299082752	410511606	/nfs/dbraw/zinc/51/16/06/410511606.db2.gz	SJGDPFMKMXLCLH-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCc1cccc([N+](=O)[O-])c1C	ZINC000358684547	410522978	/nfs/dbraw/zinc/52/29/78/410522978.db2.gz	FBULVBWFDRQWFI-UHFFFAOYSA-N	1	1	317.349	1.908	20	5		DDBDMO
Cc1c(NC(=O)CCN2C[C@H]3C[NH2+]C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000359305461	410591729	/nfs/dbraw/zinc/59/17/29/410591729.db2.gz	LCIQGKZSBDLDPQ-CHWSQXEVSA-N	1	1	318.377	1.383	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000355500522	410550178	/nfs/dbraw/zinc/55/01/78/410550178.db2.gz	DRVDVUKZJLVDLR-CYBMUJFWSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000301096449	410654514	/nfs/dbraw/zinc/65/45/14/410654514.db2.gz	GSZWSEQOBOPSSZ-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2c([N+](=O)[O-])c(C)nn2C)CC1	ZINC000301296405	410692288	/nfs/dbraw/zinc/69/22/88/410692288.db2.gz	SHNKJUOUYMRSQE-LBPRGKRZSA-N	1	1	324.429	1.322	20	5		DDBDMO
CCc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@H]4[C@H]3C2)c1[N+](=O)[O-]	ZINC000301917196	410829925	/nfs/dbraw/zinc/82/99/25/410829925.db2.gz	ANWRBMXTBASLGS-OBJOEFQTSA-N	1	1	319.409	1.811	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000301915425	410830981	/nfs/dbraw/zinc/83/09/81/410830981.db2.gz	ISDNIPOFSDPNDM-NSHDSACASA-N	1	1	304.354	1.781	20	5		DDBDMO
COc1cc(N2C[C@@H]3OCC[N@@H+](C)[C@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000301943196	410832702	/nfs/dbraw/zinc/83/27/02/410832702.db2.gz	XYMNQXUWVUXUFE-JSGCOSHPSA-N	1	1	311.313	1.262	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000348522943	410998995	/nfs/dbraw/zinc/99/89/95/410998995.db2.gz	AQSBBLMXRRVNSX-RYUDHWBXSA-N	1	1	307.350	1.559	20	5		DDBDMO
CC[N@@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)sc2C1	ZINC000348649270	411049077	/nfs/dbraw/zinc/04/90/77/411049077.db2.gz	AXFHPZXXZOROBY-UHFFFAOYSA-N	1	1	322.350	1.405	20	5		DDBDMO
CC[N@H+]1CCc2nc(NC(=O)c3cc([N+](=O)[O-])n[nH]3)sc2C1	ZINC000348649270	411049080	/nfs/dbraw/zinc/04/90/80/411049080.db2.gz	AXFHPZXXZOROBY-UHFFFAOYSA-N	1	1	322.350	1.405	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(O)CCC1	ZINC000353484550	411021018	/nfs/dbraw/zinc/02/10/18/411021018.db2.gz	QPVRBGQVLLGUAT-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C[C@@H](C)C1	ZINC000488756841	416560638	/nfs/dbraw/zinc/56/06/38/416560638.db2.gz	WXUHWAPJSSCJHP-DCAQKATOSA-N	1	1	306.370	1.134	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](CCCn3ccnc3)C2)c1	ZINC000373581164	418442440	/nfs/dbraw/zinc/44/24/40/418442440.db2.gz	DLFGYDZYNYUHGP-ZDUSSCGKSA-N	1	1	304.354	1.715	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC1CC[NH+](CCN(C)C)CC1	ZINC000360890904	418541250	/nfs/dbraw/zinc/54/12/50/418541250.db2.gz	CTNLHQPBCKDELI-UHFFFAOYSA-N	1	1	324.429	1.558	20	5		DDBDMO
COc1cccc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000194462061	418544103	/nfs/dbraw/zinc/54/41/03/418544103.db2.gz	GTLDMZAERZSTKV-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000360954384	418553078	/nfs/dbraw/zinc/55/30/78/418553078.db2.gz	MMZGEIXVVCUSKK-GHMZBOCLSA-N	1	1	318.377	1.992	20	5		DDBDMO
C[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000188692616	222020649	/nfs/dbraw/zinc/02/06/49/222020649.db2.gz	GYCASGNIAISKSD-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000188692616	222020655	/nfs/dbraw/zinc/02/06/55/222020655.db2.gz	GYCASGNIAISKSD-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000367399649	418596717	/nfs/dbraw/zinc/59/67/17/418596717.db2.gz	AOGMOZPJWIFKJD-HNNXBMFYSA-N	1	1	321.377	1.510	20	5		DDBDMO
CCc1[nH+]ccn1C[C@@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1	ZINC000371866469	418822309	/nfs/dbraw/zinc/82/23/09/418822309.db2.gz	LCMOWYPJBBJYGM-JTQLQIEISA-N	1	1	317.353	1.395	20	5		DDBDMO
NC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411153233	418874430	/nfs/dbraw/zinc/87/44/30/418874430.db2.gz	IESOLRNITRKAHF-ZDUSSCGKSA-N	1	1	320.349	1.263	20	5		DDBDMO
CCN(CC)C(=O)[C@@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280821	418851005	/nfs/dbraw/zinc/85/10/05/418851005.db2.gz	GGUXTZHUNZNGBI-CHWSQXEVSA-N	1	1	323.397	1.685	20	5		DDBDMO
CCN(CC)C(=O)[C@@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372280821	418851008	/nfs/dbraw/zinc/85/10/08/418851008.db2.gz	GGUXTZHUNZNGBI-CHWSQXEVSA-N	1	1	323.397	1.685	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@]1(CO)CCOC1	ZINC000411511612	418910882	/nfs/dbraw/zinc/91/08/82/418910882.db2.gz	ZDSQPOBWDZISAM-HNNXBMFYSA-N	1	1	323.349	1.007	20	5		DDBDMO
COc1cc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000425049088	228355260	/nfs/dbraw/zinc/35/52/60/228355260.db2.gz	DLMOYBAQPGNCMV-GXTWGEPZSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]1CCO	ZINC000426236889	419418858	/nfs/dbraw/zinc/41/88/58/419418858.db2.gz	KHAXXHFZYIQLHJ-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]1CCO	ZINC000426236889	419418870	/nfs/dbraw/zinc/41/88/70/419418870.db2.gz	KHAXXHFZYIQLHJ-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCC[C@H]2CCO)c1	ZINC000426254375	419422635	/nfs/dbraw/zinc/42/26/35/419422635.db2.gz	DZLRASKILOYYJZ-GXTWGEPZSA-N	1	1	310.350	1.181	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](C(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000411951941	419519865	/nfs/dbraw/zinc/51/98/65/419519865.db2.gz	PEZIPJGGACUOIU-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1C[C@@H](C)[N@H+](CCO)C[C@@H]1C	ZINC000418122951	419554551	/nfs/dbraw/zinc/55/45/51/419554551.db2.gz	YGKIXUWHGVKXNG-KGLIPLIRSA-N	1	1	307.394	1.790	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000411940633	419507883	/nfs/dbraw/zinc/50/78/83/419507883.db2.gz	KNPVQLVNMGVLMH-SNVBAGLBSA-N	1	1	318.333	1.646	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000412040782	419581947	/nfs/dbraw/zinc/58/19/47/419581947.db2.gz	KOTBOXWRTBVDEL-XBFCOCLRSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101485	419662401	/nfs/dbraw/zinc/66/24/01/419662401.db2.gz	WZXDFPRIFFUEST-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000412101485	419662405	/nfs/dbraw/zinc/66/24/05/419662405.db2.gz	WZXDFPRIFFUEST-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1[C@H](CO)CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091201	419647596	/nfs/dbraw/zinc/64/75/96/419647596.db2.gz	QOUIBIVHRKSJPV-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1[C@H](CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000412091201	419647601	/nfs/dbraw/zinc/64/76/01/419647601.db2.gz	QOUIBIVHRKSJPV-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC(C)c1ccc(C[NH2+]C[C@@H]2CNCCN2C)cc1[N+](=O)[O-]	ZINC000414961082	419892303	/nfs/dbraw/zinc/89/23/03/419892303.db2.gz	IHJBWWSXLYMDSE-AWEZNQCLSA-N	1	1	306.410	1.711	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH3+])NCCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420360304	420234867	/nfs/dbraw/zinc/23/48/67/420234867.db2.gz	LACLCCRHBGYHNP-CYBMUJFWSA-N	1	1	308.382	1.886	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CN[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228307	420250616	/nfs/dbraw/zinc/25/06/16/420250616.db2.gz	OJZOZNGWYMZMKJ-RDJZCZTQSA-N	1	1	319.405	1.973	20	5		DDBDMO
CN1CC[C@](O)(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228307	420250619	/nfs/dbraw/zinc/25/06/19/420250619.db2.gz	OJZOZNGWYMZMKJ-RDJZCZTQSA-N	1	1	319.405	1.973	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000416288731	420309167	/nfs/dbraw/zinc/30/91/67/420309167.db2.gz	DOQBJUWSBCELLG-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000416288731	420309169	/nfs/dbraw/zinc/30/91/69/420309169.db2.gz	DOQBJUWSBCELLG-NXEZZACHSA-N	1	1	313.379	1.183	20	5		DDBDMO
Cc1ccc(F)c(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000444745340	230129709	/nfs/dbraw/zinc/12/97/09/230129709.db2.gz	QRQUEXMIRRWIMM-AWEZNQCLSA-N	1	1	322.340	1.732	20	5		DDBDMO
CC1(C)CCC[N@@H+]1CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000457065493	420600163	/nfs/dbraw/zinc/60/01/63/420600163.db2.gz	XIXGAXWIGCOLBZ-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000457065493	420600165	/nfs/dbraw/zinc/60/01/65/420600165.db2.gz	XIXGAXWIGCOLBZ-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000450953315	420569317	/nfs/dbraw/zinc/56/93/17/420569317.db2.gz	XWHBCPSEZLDHNX-UHFFFAOYSA-N	1	1	307.354	1.375	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H](C3CC3)[C@H]2C2CC2)c1	ZINC000453046878	420707285	/nfs/dbraw/zinc/70/72/85/420707285.db2.gz	YRHOZWOCLGIWTF-RBSFLKMASA-N	1	1	306.366	1.273	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C\c3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000493867056	420961324	/nfs/dbraw/zinc/96/13/24/420961324.db2.gz	DXDULVNLEWDGIB-JMCXLMSJSA-N	1	1	301.346	1.628	20	5		DDBDMO
CNc1nc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000455613540	421044084	/nfs/dbraw/zinc/04/40/84/421044084.db2.gz	NMCYNRGQIZQYGM-LLVKDONJSA-N	1	1	319.365	1.340	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Nc3cc(F)cc([N+](=O)[O-])c3)C[C@@H]21	ZINC000455329565	420997263	/nfs/dbraw/zinc/99/72/63/420997263.db2.gz	JOEUUJHOAXZLIL-RNCFNFMXSA-N	1	1	308.313	1.902	20	5		DDBDMO
COc1ccc(CNC[C@@H]2CCC[N@@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449390791	421005031	/nfs/dbraw/zinc/00/50/31/421005031.db2.gz	WVPKZKXSNPGFHO-AWEZNQCLSA-N	1	1	323.393	1.540	20	5		DDBDMO
COc1ccc(CNC[C@@H]2CCC[N@H+]2CCCO)cc1[N+](=O)[O-]	ZINC000449390791	421005032	/nfs/dbraw/zinc/00/50/32/421005032.db2.gz	WVPKZKXSNPGFHO-AWEZNQCLSA-N	1	1	323.393	1.540	20	5		DDBDMO
Cc1nc(NC(C)(C)CCN2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000450460177	421200418	/nfs/dbraw/zinc/20/04/18/421200418.db2.gz	NACCUUHTEAGUHH-UHFFFAOYSA-N	1	1	322.413	1.521	20	5		DDBDMO
COc1cc(CNCC[N@H+]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000525800679	421302438	/nfs/dbraw/zinc/30/24/38/421302438.db2.gz	HDHGBZVIEKDJTN-LLVKDONJSA-N	1	1	309.366	1.740	20	5		DDBDMO
COc1cc(C[NH2+]CCN2CC[C@@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000525800679	421302442	/nfs/dbraw/zinc/30/24/42/421302442.db2.gz	HDHGBZVIEKDJTN-LLVKDONJSA-N	1	1	309.366	1.740	20	5		DDBDMO
C[C@H](C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000562302205	421350461	/nfs/dbraw/zinc/35/04/61/421350461.db2.gz	VLQWCSQZLHUGHS-FPMFFAJLSA-N	1	1	303.362	1.718	20	5		DDBDMO
CNc1nccc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000566467334	421606074	/nfs/dbraw/zinc/60/60/74/421606074.db2.gz	VVEUIIFKMWEJEA-LLVKDONJSA-N	1	1	321.381	1.586	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H](OCC(F)(F)F)C2)c1	ZINC000530623255	421610310	/nfs/dbraw/zinc/61/03/10/421610310.db2.gz	JFWGETQCAYPRNR-NSHDSACASA-N	1	1	322.287	1.835	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](OCC(F)(F)F)C2)c1	ZINC000530623255	421610313	/nfs/dbraw/zinc/61/03/13/421610313.db2.gz	JFWGETQCAYPRNR-NSHDSACASA-N	1	1	322.287	1.835	20	5		DDBDMO
CNc1ccc(C(=O)NCC2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000537361681	421727771	/nfs/dbraw/zinc/72/77/71/421727771.db2.gz	CJSQRQPBDGBKLJ-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000557071812	421759134	/nfs/dbraw/zinc/75/91/34/421759134.db2.gz	QIGIMNNMWVROEC-SNVBAGLBSA-N	1	1	307.354	1.264	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNc2cc[nH+]c(N3CCOCC3)n2)c1	ZINC000541836621	421807963	/nfs/dbraw/zinc/80/79/63/421807963.db2.gz	AHZRTUAUPUWNDG-UHFFFAOYSA-N	1	1	315.333	1.834	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000543141265	421833551	/nfs/dbraw/zinc/83/35/51/421833551.db2.gz	USEHCVPIPDLEBB-MELADBBJSA-N	1	1	324.377	1.427	20	5		DDBDMO
NC(=O)c1cccc(NCc2c[nH+]c3n2CCCC3)c1[N+](=O)[O-]	ZINC000557688348	421788092	/nfs/dbraw/zinc/78/80/92/421788092.db2.gz	BBOTWSNJKSNDNO-UHFFFAOYSA-N	1	1	315.333	1.839	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000581056288	421890576	/nfs/dbraw/zinc/89/05/76/421890576.db2.gz	KPJHDKVUXOHWBG-CQSZACIVSA-N	1	1	314.345	1.720	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2[C@H](C)C[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000573697415	422004344	/nfs/dbraw/zinc/00/43/44/422004344.db2.gz	SWTQUTIBHGJOJS-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2[C@H](C)CN(CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000573697415	422004346	/nfs/dbraw/zinc/00/43/46/422004346.db2.gz	SWTQUTIBHGJOJS-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@H](C)C[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000573697415	422004366	/nfs/dbraw/zinc/00/43/66/422004366.db2.gz	SWTQUTIBHGJOJS-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@H](C)C[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000573697415	422004370	/nfs/dbraw/zinc/00/43/70/422004370.db2.gz	SWTQUTIBHGJOJS-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2NCC[N@@H+]2CC[C@@H](O)C2)c1	ZINC000599175676	422404362	/nfs/dbraw/zinc/40/43/62/422404362.db2.gz	HNEOJGJYVNLVJP-CYBMUJFWSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000341717922	271185617	/nfs/dbraw/zinc/18/56/17/271185617.db2.gz	YHYYTXDXFNHWEJ-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000344044939	271938675	/nfs/dbraw/zinc/93/86/75/271938675.db2.gz	XVGBWYJJIGANLG-NILFDRSVSA-N	1	1	319.361	1.626	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000153797646	273724822	/nfs/dbraw/zinc/72/48/22/273724822.db2.gz	CNBWWPNGLSFMKT-LLVKDONJSA-N	1	1	314.773	1.536	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN1CCN(C)CC1	ZINC000449122698	278298816	/nfs/dbraw/zinc/29/88/16/278298816.db2.gz	MKUYDOOLXQNXFS-GJZGRUSLSA-N	1	1	320.437	1.751	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000362077234	300001389	/nfs/dbraw/zinc/00/13/89/300001389.db2.gz	MZTZSQYNALTNMR-RYUDHWBXSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3CC[N@H+](C)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000368587737	301058455	/nfs/dbraw/zinc/05/84/55/301058455.db2.gz	DRYJEIJFSCZHAM-BBRMVZONSA-N	1	1	317.389	1.998	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368998919	301117553	/nfs/dbraw/zinc/11/75/53/301117553.db2.gz	CGPOCFCRLDOILB-NSHDSACASA-N	1	1	309.370	1.343	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368998919	301117554	/nfs/dbraw/zinc/11/75/54/301117554.db2.gz	CGPOCFCRLDOILB-NSHDSACASA-N	1	1	309.370	1.343	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3CC[NH2+][C@H]3C2)c1[N+](=O)[O-]	ZINC000370166708	301286911	/nfs/dbraw/zinc/28/69/11/301286911.db2.gz	ZQLKEXBMJOHHLD-KOLCDFICSA-N	1	1	307.354	1.094	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3CC[NH2+][C@H]3C2)c1[N+](=O)[O-]	ZINC000370166710	301287013	/nfs/dbraw/zinc/28/70/13/301287013.db2.gz	ZQLKEXBMJOHHLD-ONGXEEELSA-N	1	1	307.354	1.094	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H]3OCC[C@H]3C2)c1	ZINC000376034706	302027996	/nfs/dbraw/zinc/02/79/96/302027996.db2.gz	MDQJISUIVLKWBF-DUVNUKRYSA-N	1	1	322.361	1.445	20	5		DDBDMO
Cc1c(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cnn1C	ZINC000535072397	303343858	/nfs/dbraw/zinc/34/38/58/303343858.db2.gz	VPNRDUIUZBFHFR-UHFFFAOYSA-N	1	1	316.365	1.354	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000371659991	307155588	/nfs/dbraw/zinc/15/55/88/307155588.db2.gz	KIQXWXCHRLSYGX-UQOMUDLDSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000371659991	307155589	/nfs/dbraw/zinc/15/55/89/307155589.db2.gz	KIQXWXCHRLSYGX-UQOMUDLDSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000371659991	307155590	/nfs/dbraw/zinc/15/55/90/307155590.db2.gz	KIQXWXCHRLSYGX-UQOMUDLDSA-N	1	1	318.377	1.073	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@H](CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000374040293	307200420	/nfs/dbraw/zinc/20/04/20/307200420.db2.gz	UQNBGZKKTULFLK-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@H](CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000374040293	307200421	/nfs/dbraw/zinc/20/04/21/307200421.db2.gz	UQNBGZKKTULFLK-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCC[C@@H]1Cn1cccn1	ZINC000374055081	307201363	/nfs/dbraw/zinc/20/13/63/307201363.db2.gz	RISDQJSMWXPTBB-GFCCVEGCSA-N	1	1	304.354	1.580	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@@H]1Cn1cccn1	ZINC000374055081	307201364	/nfs/dbraw/zinc/20/13/64/307201364.db2.gz	RISDQJSMWXPTBB-GFCCVEGCSA-N	1	1	304.354	1.580	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000377553375	307272741	/nfs/dbraw/zinc/27/27/41/307272741.db2.gz	HTUALIWQXOAZLE-SECBINFHSA-N	1	1	304.306	1.433	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@@H]1CC[N@H+](C)[C@@H]1c1ccccc1	ZINC000377645099	307275436	/nfs/dbraw/zinc/27/54/36/307275436.db2.gz	BNGGDEYZRINVDP-UKRRQHHQSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@@H]1CC[N@@H+](C)[C@@H]1c1ccccc1	ZINC000377645099	307275437	/nfs/dbraw/zinc/27/54/37/307275437.db2.gz	BNGGDEYZRINVDP-UKRRQHHQSA-N	1	1	315.377	1.863	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]12	ZINC000377683741	307275754	/nfs/dbraw/zinc/27/57/54/307275754.db2.gz	UZVIEAWEUMLMOZ-VXGBXAGGSA-N	1	1	305.334	1.042	20	5		DDBDMO
C[C@H](CCN(C)C)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000572714621	308222698	/nfs/dbraw/zinc/22/26/98/308222698.db2.gz	RQYSJKBVGMQUML-GFCCVEGCSA-N	1	1	308.382	1.853	20	5		DDBDMO
C[C@@H](C(=O)NCC[NH+]1CCSCC1)c1cccc([N+](=O)[O-])c1	ZINC000581106171	308653751	/nfs/dbraw/zinc/65/37/51/308653751.db2.gz	AERICMCXUZLTQW-GFCCVEGCSA-N	1	1	323.418	1.863	20	5		DDBDMO
CC(C)(CN1CCCC1)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000452098821	527080413	/nfs/dbraw/zinc/08/04/13/527080413.db2.gz	UVPGRQYBBLIFOH-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](Nc3ccccc3)C2)c1	ZINC000157918879	527414083	/nfs/dbraw/zinc/41/40/83/527414083.db2.gz	WUFWFEURDZEYAX-AWEZNQCLSA-N	1	1	301.350	1.978	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2cc(C)c([N+](=O)[O-])cc2F)CC1	ZINC000292568918	529125419	/nfs/dbraw/zinc/12/54/19/529125419.db2.gz	KDOXNFVIRBKTDC-UHFFFAOYSA-N	1	1	324.356	1.618	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000736854499	598504034	/nfs/dbraw/zinc/50/40/34/598504034.db2.gz	CYZJMABRABLCLL-JTQLQIEISA-N	1	1	317.353	1.529	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1	ZINC000820127059	606702593	/nfs/dbraw/zinc/70/25/93/606702593.db2.gz	ICWANCVJOOSPGO-VIFPVBQESA-N	1	1	318.341	1.065	20	5		DDBDMO
COC(=O)/C(C)=C\C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816044	700136506	/nfs/dbraw/zinc/13/65/06/700136506.db2.gz	CKOORCXASLVZPM-DKRCXCIFSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C(C)=C\C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816044	700136509	/nfs/dbraw/zinc/13/65/09/700136509.db2.gz	CKOORCXASLVZPM-DKRCXCIFSA-N	1	1	320.349	1.595	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccccc2F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983650528	697286338	/nfs/dbraw/zinc/28/63/38/697286338.db2.gz	VQGZREOXRUNBPN-BPGGGUHBSA-N	1	1	321.352	1.475	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](n3cncn3)C2)cc1	ZINC000776879245	698145207	/nfs/dbraw/zinc/14/52/07/698145207.db2.gz	SKVWYKBZUYXXPZ-UONOGXRCSA-N	1	1	303.322	1.167	20	5		DDBDMO
O=C1Nc2ccccc2[C@]12CC[N@@H+](Cn1cc([N+](=O)[O-])cn1)C2	ZINC000777555475	698201385	/nfs/dbraw/zinc/20/13/85/698201385.db2.gz	BMYLPMCCXQGGIS-OAHLLOKOSA-N	1	1	313.317	1.345	20	5		DDBDMO
O=C1Nc2ccccc2[C@]12CC[N@H+](Cn1cc([N+](=O)[O-])cn1)C2	ZINC000777555475	698201386	/nfs/dbraw/zinc/20/13/86/698201386.db2.gz	BMYLPMCCXQGGIS-OAHLLOKOSA-N	1	1	313.317	1.345	20	5		DDBDMO
COCCO[C@@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000245923257	698340954	/nfs/dbraw/zinc/34/09/54/698340954.db2.gz	SYZLMZACQIPKTC-HZPDHXFCSA-N	1	1	324.377	1.756	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])[C@H](C)C1	ZINC000779708786	698455252	/nfs/dbraw/zinc/45/52/52/698455252.db2.gz	XYWHYOGIKJSHCV-NEPJUHHUSA-N	1	1	319.365	1.134	20	5		DDBDMO
Cc1c(C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cnn1C	ZINC000790444189	699460143	/nfs/dbraw/zinc/46/01/43/699460143.db2.gz	AGFYOQKJGWUBGF-HNNXBMFYSA-N	1	1	304.350	1.802	20	5		DDBDMO
CO[C@@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000751941036	700328389	/nfs/dbraw/zinc/32/83/89/700328389.db2.gz	QQFMDHUPQHOHKL-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000751941036	700328392	/nfs/dbraw/zinc/32/83/92/700328392.db2.gz	QQFMDHUPQHOHKL-CYBMUJFWSA-N	1	1	303.322	1.532	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000758413034	700704513	/nfs/dbraw/zinc/70/45/13/700704513.db2.gz	XMGVOVATUDLEGE-UHFFFAOYSA-N	1	1	307.354	1.962	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1	ZINC000762721635	700904825	/nfs/dbraw/zinc/90/48/25/700904825.db2.gz	BSRKWECKIKRBHI-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
O=C1O[C@H](C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CC2	ZINC000763760045	700948039	/nfs/dbraw/zinc/94/80/39/700948039.db2.gz	LSUJLBFMUFQGFQ-LBPRGKRZSA-N	1	1	303.318	1.444	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)CC12CC2	ZINC000763760045	700948040	/nfs/dbraw/zinc/94/80/40/700948040.db2.gz	LSUJLBFMUFQGFQ-LBPRGKRZSA-N	1	1	303.318	1.444	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000765937657	701030446	/nfs/dbraw/zinc/03/04/46/701030446.db2.gz	UQMWLHGUCHJVET-MNOVXSKESA-N	1	1	306.366	1.732	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@]3(CCOC3)C2)cc1	ZINC000769220549	701237308	/nfs/dbraw/zinc/23/73/08/701237308.db2.gz	MCERGUOIDGXQHK-LSDHHAIUSA-N	1	1	308.334	1.120	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@]3(CCOC3)C2)cc1	ZINC000769220549	701237309	/nfs/dbraw/zinc/23/73/09/701237309.db2.gz	MCERGUOIDGXQHK-LSDHHAIUSA-N	1	1	308.334	1.120	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000879133291	706595972	/nfs/dbraw/zinc/59/59/72/706595972.db2.gz	CVQMMJVAEOFLSY-PJODQICGSA-N	1	1	322.361	1.759	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000839700196	701789700	/nfs/dbraw/zinc/78/97/00/701789700.db2.gz	CUEOTLHVBXFTEC-NMFUWQPSSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000839700196	701789703	/nfs/dbraw/zinc/78/97/03/701789703.db2.gz	CUEOTLHVBXFTEC-NMFUWQPSSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000839700196	701789706	/nfs/dbraw/zinc/78/97/06/701789706.db2.gz	CUEOTLHVBXFTEC-NMFUWQPSSA-N	1	1	303.362	1.431	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000812336879	702160444	/nfs/dbraw/zinc/16/04/44/702160444.db2.gz	AJQJSNPCSLCXKY-QWHCGFSZSA-N	1	1	319.361	1.627	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000816950097	702234485	/nfs/dbraw/zinc/23/44/85/702234485.db2.gz	LVEWAWGJOSJTTG-HZMBPMFUSA-N	1	1	323.324	1.275	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000844450022	703033276	/nfs/dbraw/zinc/03/32/76/703033276.db2.gz	NWFBTRQIDUAKNE-SNVBAGLBSA-N	1	1	313.329	1.765	20	5		DDBDMO
CNc1nccc(C(=O)OCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000848791702	703589931	/nfs/dbraw/zinc/58/99/31/703589931.db2.gz	QJIHGBUJBZBOLJ-UHFFFAOYSA-N	1	1	319.321	1.784	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c1[N+](=O)[O-]	ZINC000851924520	703883923	/nfs/dbraw/zinc/88/39/23/703883923.db2.gz	OPUWKAGYLGMLCF-LLVKDONJSA-N	1	1	311.338	1.866	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC2CC[NH+](C3CC3)CC2)c1	ZINC000818945632	704031531	/nfs/dbraw/zinc/03/15/31/704031531.db2.gz	MRTZXUVISOYHOA-MRXNPFEDSA-N	1	1	305.378	1.845	20	5		DDBDMO
CCn1nc(C)c(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819378918	704116706	/nfs/dbraw/zinc/11/67/06/704116706.db2.gz	ABLFCZIJOUOKML-AWEZNQCLSA-N	1	1	305.338	1.338	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)CO1	ZINC000853799556	704317039	/nfs/dbraw/zinc/31/70/39/704317039.db2.gz	MGYRYBZROIGGRQ-NWDGAFQWSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)CO1	ZINC000853799556	704317040	/nfs/dbraw/zinc/31/70/40/704317040.db2.gz	MGYRYBZROIGGRQ-NWDGAFQWSA-N	1	1	319.365	1.764	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](CCOc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000821331815	704392251	/nfs/dbraw/zinc/39/22/51/704392251.db2.gz	DXBADFPNHPYQJP-OKILXGFUSA-N	1	1	319.361	1.384	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000855362977	704481020	/nfs/dbraw/zinc/48/10/20/704481020.db2.gz	QORNKHPKFMUFNV-LLVKDONJSA-N	1	1	322.321	1.669	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]2COC[C@@H]21	ZINC000832774715	706981253	/nfs/dbraw/zinc/98/12/53/706981253.db2.gz	AFIBRHMTFNNLPY-RRFJBIMHSA-N	1	1	306.362	1.985	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860159368	705118194	/nfs/dbraw/zinc/11/81/94/705118194.db2.gz	GBZUIWPDAQGPPT-TZMCWYRMSA-N	1	1	320.345	1.987	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860159368	705118198	/nfs/dbraw/zinc/11/81/98/705118198.db2.gz	GBZUIWPDAQGPPT-TZMCWYRMSA-N	1	1	320.345	1.987	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000874827730	705186117	/nfs/dbraw/zinc/18/61/17/705186117.db2.gz	SWYYQWWTDQFOBI-RRFJBIMHSA-N	1	1	319.361	1.323	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874833542	705190918	/nfs/dbraw/zinc/19/09/18/705190918.db2.gz	LUCXSJHPRPNANT-STQMWFEESA-N	1	1	318.377	1.945	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000862794748	705800267	/nfs/dbraw/zinc/80/02/67/705800267.db2.gz	HARPOQYTXYZJGK-IUODEOHRSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC[C@H]21	ZINC000827234542	705957499	/nfs/dbraw/zinc/95/74/99/705957499.db2.gz	YIUJSOWODZCCQP-TZMCWYRMSA-N	1	1	321.352	1.829	20	5		DDBDMO
C/C(=C\C(=O)NCC[N@H+]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000863833367	706024567	/nfs/dbraw/zinc/02/45/67/706024567.db2.gz	PIANAICXVPDSEJ-PABFRNLHSA-N	1	1	319.361	1.181	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000827626289	706039842	/nfs/dbraw/zinc/03/98/42/706039842.db2.gz	VHAHOYQPYMMQOU-ZNMIVQPWSA-N	1	1	303.362	1.909	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c(C(F)F)c1	ZINC000865899699	706557335	/nfs/dbraw/zinc/55/73/35/706557335.db2.gz	LHDKPMHPQDJGQY-LLVKDONJSA-N	1	1	313.304	1.788	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4ccccn4c3[N+](=O)[O-])C[C@@H]2C1	ZINC000865904874	706559014	/nfs/dbraw/zinc/55/90/14/706559014.db2.gz	XNCSMWHNDMSXFA-NEPJUHHUSA-N	1	1	301.350	1.630	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)cc1	ZINC000880069299	706869490	/nfs/dbraw/zinc/86/94/90/706869490.db2.gz	CZCHOATVMRCVEH-JKSUJKDBSA-N	1	1	305.378	1.278	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000880144962	706890861	/nfs/dbraw/zinc/89/08/61/706890861.db2.gz	KTKRTJQWOXDMGX-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000880144962	706890863	/nfs/dbraw/zinc/89/08/63/706890863.db2.gz	KTKRTJQWOXDMGX-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1CO	ZINC000880438470	706976184	/nfs/dbraw/zinc/97/61/84/706976184.db2.gz	JGYRVNWPNHUKST-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1[C@H](C)CC[C@@H]1CO	ZINC000880438470	706976186	/nfs/dbraw/zinc/97/61/86/706976186.db2.gz	JGYRVNWPNHUKST-DGCLKSJQSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000833458976	707008540	/nfs/dbraw/zinc/00/85/40/707008540.db2.gz	RIGODNAOMYOISR-GOEBONIOSA-N	1	1	319.361	1.182	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000881762373	707357406	/nfs/dbraw/zinc/35/74/06/707357406.db2.gz	YTERUBDDEYSBHB-NSHDSACASA-N	1	1	310.329	1.430	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000836944585	707552200	/nfs/dbraw/zinc/55/22/00/707552200.db2.gz	BAIFWSWFUAMCEW-ZFWWWQNUSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C1CC1	ZINC000837224218	707600917	/nfs/dbraw/zinc/60/09/17/707600917.db2.gz	CCWNGVWPQOIYFA-UHFFFAOYSA-N	1	1	324.356	1.920	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000882765657	707781833	/nfs/dbraw/zinc/78/18/33/707781833.db2.gz	GRTQNNJWHCGDGJ-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000882765657	707781837	/nfs/dbraw/zinc/78/18/37/707781837.db2.gz	GRTQNNJWHCGDGJ-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000882766824	707784519	/nfs/dbraw/zinc/78/45/19/707784519.db2.gz	RROJMYAHURGION-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000882766824	707784524	/nfs/dbraw/zinc/78/45/24/707784524.db2.gz	RROJMYAHURGION-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000883898036	708078977	/nfs/dbraw/zinc/07/89/77/708078977.db2.gz	RMXGUMWUSYQJSN-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
CN1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000897098745	708229766	/nfs/dbraw/zinc/22/97/66/708229766.db2.gz	UVUYRJLGAVELPI-UHFFFAOYSA-N	1	1	313.789	1.327	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCn3nncc3C2)cc1	ZINC000886463235	708764181	/nfs/dbraw/zinc/76/41/81/708764181.db2.gz	UKDPIHMRHWMSMO-AWEZNQCLSA-N	1	1	303.322	1.126	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCCn3nncc3C2)cc1	ZINC000886463235	708764183	/nfs/dbraw/zinc/76/41/83/708764183.db2.gz	UKDPIHMRHWMSMO-AWEZNQCLSA-N	1	1	303.322	1.126	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C1C[NH+]([C@H]2CCOC2)C1	ZINC000899910616	709234964	/nfs/dbraw/zinc/23/49/64/709234964.db2.gz	KAPCFLKNVFAGJZ-ZDUSSCGKSA-N	1	1	305.334	1.562	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000889778942	709630904	/nfs/dbraw/zinc/63/09/04/709630904.db2.gz	CEBSESVAAWCXKD-CABCVRRESA-N	1	1	319.361	1.266	20	5		DDBDMO
CC(C)(C(=O)NCC[N@H+]1CCC(C)(C)C1)n1cc([N+](=O)[O-])cn1	ZINC000890078355	709737154	/nfs/dbraw/zinc/73/71/54/709737154.db2.gz	BOKFKIGVCSMRMM-UHFFFAOYSA-N	1	1	323.397	1.375	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@@H]1CCCC[N@@H+]1C(C)C	ZINC000910205631	709813955	/nfs/dbraw/zinc/81/39/55/709813955.db2.gz	LXBYNPBMXIKZML-ZDUSSCGKSA-N	1	1	324.381	1.906	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)n1	ZINC000913280520	713190323	/nfs/dbraw/zinc/19/03/23/713190323.db2.gz	DUQRVZDKMGLZIT-GASCZTMLSA-N	1	1	321.381	1.225	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928435418	713194136	/nfs/dbraw/zinc/19/41/36/713194136.db2.gz	GOTSLOXNZUWBCY-BXKDBHETSA-N	1	1	313.304	1.895	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000902635596	710830415	/nfs/dbraw/zinc/83/04/15/710830415.db2.gz	AWYHMDWWNQMIRW-CHWSQXEVSA-N	1	1	305.338	1.715	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@H]12	ZINC000902906045	710953464	/nfs/dbraw/zinc/95/34/64/710953464.db2.gz	RKCDXWKPFIFWPG-DGCLKSJQSA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12	ZINC000902906045	710953467	/nfs/dbraw/zinc/95/34/67/710953467.db2.gz	RKCDXWKPFIFWPG-DGCLKSJQSA-N	1	1	324.406	1.243	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC000894641746	711226790	/nfs/dbraw/zinc/22/67/90/711226790.db2.gz	XIWGEZUGBVUUBY-GFCCVEGCSA-N	1	1	309.366	1.835	20	5		DDBDMO
COc1cc(N[C@@H]2Cc3c[nH+]cn3C2)c([N+](=O)[O-])cc1OC	ZINC000894995785	711356924	/nfs/dbraw/zinc/35/69/24/711356924.db2.gz	GCOLXIWLUNDUML-SECBINFHSA-N	1	1	304.306	1.845	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000896564690	711753221	/nfs/dbraw/zinc/75/32/21/711753221.db2.gz	RMMPEWVQQXOFSJ-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@H+](C)[C@H](CO)C1	ZINC000931408730	714087818	/nfs/dbraw/zinc/08/78/18/714087818.db2.gz	DRZWCMSTMDMYBH-HNNXBMFYSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C)[C@H](CO)C1	ZINC000931408730	714087822	/nfs/dbraw/zinc/08/78/22/714087822.db2.gz	DRZWCMSTMDMYBH-HNNXBMFYSA-N	1	1	323.393	1.490	20	5		DDBDMO
CN(C(=O)CN1CCn2cc[nH+]c21)c1ccc([N+](=O)[O-])cc1	ZINC000931523138	714118651	/nfs/dbraw/zinc/11/86/51/714118651.db2.gz	QNAOUYNNDRAISA-UHFFFAOYSA-N	1	1	301.306	1.274	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000931564210	714128983	/nfs/dbraw/zinc/12/89/83/714128983.db2.gz	VINJQZMPGZQNOI-QWHCGFSZSA-N	1	1	313.398	1.985	20	5		DDBDMO
COc1cc(C[NH2+][C@@H]2C(=O)NCC2(C)C)c([N+](=O)[O-])cc1F	ZINC000931655377	714150768	/nfs/dbraw/zinc/15/07/68/714150768.db2.gz	YLORNHQIZMQYGR-GFCCVEGCSA-N	1	1	311.313	1.357	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H](C3OCCO3)C2)c1	ZINC000932004571	714231292	/nfs/dbraw/zinc/23/12/92/714231292.db2.gz	ZGPRZMRHWXEXNJ-TZMCWYRMSA-N	1	1	308.334	1.323	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2ccn(C)n2)C1	ZINC000932132728	714267750	/nfs/dbraw/zinc/26/77/50/714267750.db2.gz	NODASDDXWGJQEQ-CYBMUJFWSA-N	1	1	318.381	1.713	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000923270520	714291987	/nfs/dbraw/zinc/29/19/87/714291987.db2.gz	BIKIROMFSOFARP-CMPLNLGQSA-N	1	1	305.334	1.609	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C1	ZINC000933779684	714669590	/nfs/dbraw/zinc/66/95/90/714669590.db2.gz	PRHLHTOMOUSNOY-CYBMUJFWSA-N	1	1	323.397	1.290	20	5		DDBDMO
O=[N+]([O-])c1ccnc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c1	ZINC001164966110	722067349	/nfs/dbraw/zinc/06/73/49/722067349.db2.gz	WDUNUYSGOXKLTR-OKILXGFUSA-N	1	1	304.350	1.289	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c([N+](=O)[O-])c1	ZINC001121008534	782293380	/nfs/dbraw/zinc/29/33/80/782293380.db2.gz	FMVLKIVBSXDQOJ-YUSALJHKSA-N	1	1	320.349	1.529	20	5		DDBDMO
CN1C[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)CCC1=O	ZINC001167249319	732864211	/nfs/dbraw/zinc/86/42/11/732864211.db2.gz	DJQVQLVHPPLQAS-LLVKDONJSA-N	1	1	318.377	1.615	20	5		DDBDMO
CN1C[C@H](Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)CCC1=O	ZINC001167249319	732864219	/nfs/dbraw/zinc/86/42/19/732864219.db2.gz	DJQVQLVHPPLQAS-LLVKDONJSA-N	1	1	318.377	1.615	20	5		DDBDMO
O=C(CC1CC1)N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC001025649153	736808781	/nfs/dbraw/zinc/80/87/81/736808781.db2.gz	FCGJLKCYGSPNFZ-QLPKVWCKSA-N	1	1	315.373	1.941	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1	ZINC001029305424	740551666	/nfs/dbraw/zinc/55/16/66/740551666.db2.gz	YJQWMKNHAMWQMZ-QKPAOTATSA-N	1	1	315.373	1.527	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1	ZINC001029305424	740551669	/nfs/dbraw/zinc/55/16/69/740551669.db2.gz	YJQWMKNHAMWQMZ-QKPAOTATSA-N	1	1	315.373	1.527	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1	ZINC001029305424	740551672	/nfs/dbraw/zinc/55/16/72/740551672.db2.gz	YJQWMKNHAMWQMZ-QKPAOTATSA-N	1	1	315.373	1.527	20	5		DDBDMO
Cc1cc(C)cc(OCC[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001126943058	742937425	/nfs/dbraw/zinc/93/74/25/742937425.db2.gz	IWPORUFUVSCPHL-HUUCEWRRSA-N	1	1	321.377	1.053	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@@H](C)[C@H](O)C(F)(F)F)c1[N+](=O)[O-]	ZINC001183270341	743813398	/nfs/dbraw/zinc/81/33/98/743813398.db2.gz	SRTXBZCHEKJWTA-KGFZYKRKSA-N	1	1	324.255	1.710	20	5		DDBDMO
Cc1ccc(C)c(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001031662071	747336697	/nfs/dbraw/zinc/33/66/97/747336697.db2.gz	SWDOGONZDWBLOR-HZPDHXFCSA-N	1	1	317.389	1.517	20	5		DDBDMO
Cc1ncoc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001034645807	750627856	/nfs/dbraw/zinc/62/78/56/750627856.db2.gz	WFJBNYHUASHOGP-FDYHWXHSSA-N	1	1	322.365	1.165	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2c1cnn2C	ZINC001169019491	762199900	/nfs/dbraw/zinc/19/99/00/762199900.db2.gz	ISKAINDYZWOEGU-RDBSUJKOSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCN1CC[C@@]2(C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@@H]2C)C1=O	ZINC001169025835	762203196	/nfs/dbraw/zinc/20/31/96/762203196.db2.gz	ZGHNKMYSVBISMA-AYDFFVQHSA-N	1	1	309.410	1.622	20	5		DDBDMO
Cc1ccncc1C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086082724	760942116	/nfs/dbraw/zinc/94/21/16/760942116.db2.gz	BNZXKZNVSYMNQE-FAAHXZRKSA-N	1	1	318.377	1.040	20	5		DDBDMO
COc1cc(C)c([N+](=O)[O-])cc1-n1[nH]c(=O)c(CC[NH3+])c1C	ZINC001170342938	766275181	/nfs/dbraw/zinc/27/51/81/766275181.db2.gz	MABYKRWVONJLLD-UHFFFAOYSA-N	1	1	306.322	1.613	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1cc([N+](=O)[O-])cc(Br)n1	ZINC001170898515	771898051	/nfs/dbraw/zinc/89/80/51/771898051.db2.gz	CTTRMNZXDOHFKW-MRVPVSSYSA-N	1	1	304.148	1.188	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001137039021	772275684	/nfs/dbraw/zinc/27/56/84/772275684.db2.gz	OKTULSKYHOQQBP-NSHDSACASA-N	1	1	321.381	1.376	20	5		DDBDMO
Cc1ccc(NCCNC(=O)C[N@H+](C)C(C)C)c([N+](=O)[O-])c1	ZINC001093673910	774987970	/nfs/dbraw/zinc/98/79/70/774987970.db2.gz	CIJWPVSJZVYNNU-UHFFFAOYSA-N	1	1	308.382	1.772	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ccccc1[N+](=O)[O-]	ZINC001094574192	776049183	/nfs/dbraw/zinc/04/91/83/776049183.db2.gz	QYNOOHAUYWXRNG-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
C[C@@]1(O)COCC[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1	ZINC001172906393	776916931	/nfs/dbraw/zinc/91/69/31/776916931.db2.gz	XPBWHHXHGSSTGE-WBVHZDCISA-N	1	1	320.389	1.925	20	5		DDBDMO
CC(C)(C(=O)NCC[NH+]1CC=CC1)c1ccc([N+](=O)[O-])cc1F	ZINC001116613695	780531691	/nfs/dbraw/zinc/53/16/91/780531691.db2.gz	CYCVARFRROBXTO-UHFFFAOYSA-N	1	1	321.352	2.000	20	5		DDBDMO
Cc1ccc(C[N@H+](C)CCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1C	ZINC001268238071	839873880	/nfs/dbraw/zinc/87/38/80/839873880.db2.gz	VHWAUSUGTUILPI-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1C	ZINC001268238071	839873891	/nfs/dbraw/zinc/87/38/91/839873891.db2.gz	VHWAUSUGTUILPI-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1ccc(C[N@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1C	ZINC001268238071	839873896	/nfs/dbraw/zinc/87/38/96/839873896.db2.gz	VHWAUSUGTUILPI-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ncnc3cc([N+](=O)[O-])ccc32)C1	ZINC001155195925	861820989	/nfs/dbraw/zinc/82/09/89/861820989.db2.gz	HAFDGUJZAUYBLH-NSHDSACASA-N	1	1	303.322	1.281	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ncnc3cc([N+](=O)[O-])ccc32)C1	ZINC001155195925	861820999	/nfs/dbraw/zinc/82/09/99/861820999.db2.gz	HAFDGUJZAUYBLH-NSHDSACASA-N	1	1	303.322	1.281	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001293855052	849612940	/nfs/dbraw/zinc/61/29/40/849612940.db2.gz	LHQXWTIHCFXOFB-YUMQZZPRSA-N	1	1	315.761	1.384	20	5		DDBDMO
CCOC(=O)C=C(N)Nc1cc(C=C[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001155701840	862393003	/nfs/dbraw/zinc/39/30/03/862393003.db2.gz	ZKQNDJRVVXCTDV-AATRIKPKSA-N	1	1	321.337	1.864	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@@H]1CC[N@H+]1C(C)(C)C	ZINC001123028251	859062761	/nfs/dbraw/zinc/06/27/61/859062761.db2.gz	AOJZUVSNBSDBCF-NSHDSACASA-N	1	1	310.354	1.516	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@H]([N@@H+](C)C(C)C)C2)c1[N+](=O)[O-]	ZINC001157018896	863520323	/nfs/dbraw/zinc/52/03/23/863520323.db2.gz	APYDWWUYXFVQCO-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157766919	864115589	/nfs/dbraw/zinc/11/55/89/864115589.db2.gz	BRFNLJJAVJWXRA-UKRRQHHQSA-N	1	1	316.361	1.429	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1cccc(Cl)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767850	864118936	/nfs/dbraw/zinc/11/89/36/864118936.db2.gz	XUXKIOYBKZWXHU-CHWSQXEVSA-N	1	1	311.769	1.601	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2C[C@H](F)C[C@@H](CO)C2)ncc1[N+](=O)[O-]	ZINC001164050490	868913246	/nfs/dbraw/zinc/91/32/46/868913246.db2.gz	NQMPFZPBEYOJJB-NAGRZINJSA-N	1	1	324.356	1.679	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1ccc([N+](=O)[O-])cc1C(N)=O	ZINC001226173992	882251721	/nfs/dbraw/zinc/25/17/21/882251721.db2.gz	VTTMPCGUKWSSCR-HBYGRHMLSA-N	1	1	319.361	1.803	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@@H](O)[C@H](F)CC2)ncc1[N+](=O)[O-]	ZINC001164237334	869045210	/nfs/dbraw/zinc/04/52/10/869045210.db2.gz	JHXOLOBMZRCXDI-YJJAWEDRSA-N	1	1	324.356	1.821	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@](O)(C3CC3)C2)c1[N+](=O)[O-]	ZINC001336797187	869148757	/nfs/dbraw/zinc/14/87/57/869148757.db2.gz	KBQVQJMIRGZCGM-OAHLLOKOSA-N	1	1	308.334	1.656	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)COc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC001337836248	869651026	/nfs/dbraw/zinc/65/10/26/869651026.db2.gz	OTYUDNUGSJGCBD-TUKIKUTGSA-N	1	1	319.361	1.430	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc([N+](=O)[O-])c4nonc43)[C@H]2C1	ZINC001339997590	870829424	/nfs/dbraw/zinc/82/94/24/870829424.db2.gz	DRMXPZKIRXRUST-GUBZILKMSA-N	1	1	303.322	1.883	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC001340021303	870846750	/nfs/dbraw/zinc/84/67/50/870846750.db2.gz	RTJBFQCCISPCDV-STQMWFEESA-N	1	1	322.413	1.038	20	5		DDBDMO
CCc1ccccc1CC[N@@H+](C)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001317448066	870853562	/nfs/dbraw/zinc/85/35/62/870853562.db2.gz	MVWTVYXLACYSKI-HZPDHXFCSA-N	1	1	319.405	1.505	20	5		DDBDMO
CCc1ccccc1CC[N@H+](C)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317448066	870853579	/nfs/dbraw/zinc/85/35/79/870853579.db2.gz	MVWTVYXLACYSKI-HZPDHXFCSA-N	1	1	319.405	1.505	20	5		DDBDMO
CCc1ccccc1CC[N@@H+](C)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317448066	870853596	/nfs/dbraw/zinc/85/35/96/870853596.db2.gz	MVWTVYXLACYSKI-HZPDHXFCSA-N	1	1	319.405	1.505	20	5		DDBDMO
CO[C@@H]1CC[C@H]1N(C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC001345464657	873412972	/nfs/dbraw/zinc/41/29/72/873412972.db2.gz	AJSKPXZKMPDTEP-NFAWXSAZSA-N	1	1	307.350	1.405	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1C[N@@H+]2CCN1C[C@H]2C	ZINC001345491707	873421701	/nfs/dbraw/zinc/42/17/01/873421701.db2.gz	PILBQZUMSUJYME-BXUZGUMPSA-N	1	1	304.350	1.230	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1OCC[N@@H+]1CC[C@@H](OC)C1	ZINC001227124263	882857306	/nfs/dbraw/zinc/85/73/06/882857306.db2.gz	LPRKDIHCWYTWHN-LLVKDONJSA-N	1	1	324.333	1.481	20	5		DDBDMO
Nc1ncc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC001300131224	876971059	/nfs/dbraw/zinc/97/10/59/876971059.db2.gz	ODWSCNNCXSVDSC-NEPJUHHUSA-N	1	1	319.365	1.319	20	5		DDBDMO
C[N@H+]1CCC[C@@H](C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584219	879114972	/nfs/dbraw/zinc/11/49/72/879114972.db2.gz	NDXCLLYAJIYGRM-KBPBESRZSA-N	1	1	323.393	1.266	20	5		DDBDMO
CN1CCC[C@@H](C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001356584219	879114979	/nfs/dbraw/zinc/11/49/79/879114979.db2.gz	NDXCLLYAJIYGRM-KBPBESRZSA-N	1	1	323.393	1.266	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])c(F)c2F)C1	ZINC001233768028	887304507	/nfs/dbraw/zinc/30/45/07/887304507.db2.gz	BLTIJHJTHFTSKH-SECBINFHSA-N	1	1	302.277	1.973	20	5		DDBDMO
Cc1cc(N(C(N)=[NH2+])[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)[nH]n1	ZINC001254601094	896525610	/nfs/dbraw/zinc/52/56/10/896525610.db2.gz	ZEHYKWMLENUYIY-LBPRGKRZSA-N	1	1	300.322	1.494	20	5		DDBDMO
O=C1C[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC2(CCCC2)N1	ZINC001254606156	896527433	/nfs/dbraw/zinc/52/74/33/896527433.db2.gz	FJOKBJGWPPUQSY-OAHLLOKOSA-N	1	1	315.373	1.807	20	5		DDBDMO
O=C1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC2(CCCC2)N1	ZINC001254606156	896527447	/nfs/dbraw/zinc/52/74/47/896527447.db2.gz	FJOKBJGWPPUQSY-OAHLLOKOSA-N	1	1	315.373	1.807	20	5		DDBDMO
COC(=O)CO[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254609954	896530418	/nfs/dbraw/zinc/53/04/18/896530418.db2.gz	GRMZEZKUBIZNCB-CABCVRRESA-N	1	1	320.345	1.326	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000295639908	529381844	/nfs/dbraw/zinc/38/18/44/529381844.db2.gz	GNYHOBVILAKFDN-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000295639908	529381847	/nfs/dbraw/zinc/38/18/47/529381847.db2.gz	GNYHOBVILAKFDN-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@H]1O	ZINC000305361547	231004153	/nfs/dbraw/zinc/00/41/53/231004153.db2.gz	UEYDNHKERNMGSR-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000614711738	361986573	/nfs/dbraw/zinc/98/65/73/361986573.db2.gz	PMCSATFXFZHRGJ-CHWSQXEVSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000305857354	231076736	/nfs/dbraw/zinc/07/67/36/231076736.db2.gz	KZGIXOGBDIVWGV-YWPYICTPSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1CN(CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC000451650411	231151216	/nfs/dbraw/zinc/15/12/16/231151216.db2.gz	DOCULUYDIVSLIK-OKILXGFUSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC000451650411	231151220	/nfs/dbraw/zinc/15/12/20/231151220.db2.gz	DOCULUYDIVSLIK-OKILXGFUSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC000451650411	231151223	/nfs/dbraw/zinc/15/12/23/231151223.db2.gz	DOCULUYDIVSLIK-OKILXGFUSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC(C)CCO[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090552033	185302992	/nfs/dbraw/zinc/30/29/92/185302992.db2.gz	YHZHVMCFDPVFSO-OAHLLOKOSA-N	1	1	323.393	1.894	20	5		DDBDMO
CN1CC[NH+](CCNc2ccc([N+](=O)[O-])c3cccnc23)CC1	ZINC000298155938	529772344	/nfs/dbraw/zinc/77/23/44/529772344.db2.gz	LJLVCTWBZWYORT-UHFFFAOYSA-N	1	1	315.377	1.802	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C2)C1	ZINC000292406063	529811013	/nfs/dbraw/zinc/81/10/13/529811013.db2.gz	ZENBIKWCNXTRFN-INIZCTEOSA-N	1	1	303.362	1.692	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000272655470	282318118	/nfs/dbraw/zinc/31/81/18/282318118.db2.gz	QOENHQLPGOEZRN-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612914	210014527	/nfs/dbraw/zinc/01/45/27/210014527.db2.gz	ZPOUCBKJMFAFRX-ZYHUDNBSSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612914	210014529	/nfs/dbraw/zinc/01/45/29/210014529.db2.gz	ZPOUCBKJMFAFRX-ZYHUDNBSSA-N	1	1	305.334	1.609	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046996644	352475850	/nfs/dbraw/zinc/47/58/50/352475850.db2.gz	MJJUUVWLZXSUKG-ZIAGYGMSSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000047633011	352505633	/nfs/dbraw/zinc/50/56/33/352505633.db2.gz	NBJFFDBPROBEAA-GFCCVEGCSA-N	1	1	323.349	1.515	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCCn1cc[nH+]c1C	ZINC000052192434	352603623	/nfs/dbraw/zinc/60/36/23/352603623.db2.gz	VRFUESYMCSPGRW-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000052519051	352613158	/nfs/dbraw/zinc/61/31/58/352613158.db2.gz	WMYVTTSXKJSPTE-CYBMUJFWSA-N	1	1	321.381	1.400	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000054264782	352685262	/nfs/dbraw/zinc/68/52/62/352685262.db2.gz	JTVBQZHAZITPJE-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000063852918	352927483	/nfs/dbraw/zinc/92/74/83/352927483.db2.gz	UTAAEWABFIKOIN-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+](C)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000066924574	353025683	/nfs/dbraw/zinc/02/56/83/353025683.db2.gz	CFWLUGLLBHWKCQ-UHFFFAOYSA-N	1	1	323.349	1.436	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)C1CC1	ZINC000066924584	353026100	/nfs/dbraw/zinc/02/61/00/353026100.db2.gz	QVCPADCKOFYGBS-UHFFFAOYSA-N	1	1	308.294	1.327	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000067292729	353043104	/nfs/dbraw/zinc/04/31/04/353043104.db2.gz	RVHYUOHTBHMKPO-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000069530436	353165889	/nfs/dbraw/zinc/16/58/89/353165889.db2.gz	MFNWOOPFSQZOLW-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2	ZINC000072833170	353220565	/nfs/dbraw/zinc/22/05/65/353220565.db2.gz	SFOQKXYOGOBYLU-MRXNPFEDSA-N	1	1	303.362	1.739	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000182085321	199384653	/nfs/dbraw/zinc/38/46/53/199384653.db2.gz	WUNAAGJWRUSRMS-ZDUSSCGKSA-N	1	1	321.377	1.664	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000073900369	353277499	/nfs/dbraw/zinc/27/74/99/353277499.db2.gz	ZKTKQJIKKXSIKF-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000174163396	198300170	/nfs/dbraw/zinc/30/01/70/198300170.db2.gz	WMEDOTMATDNXCL-CYBMUJFWSA-N	1	1	319.361	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](CO)C1	ZINC000174709339	198373463	/nfs/dbraw/zinc/37/34/63/198373463.db2.gz	YWOKRBUYPRRXHM-LLVKDONJSA-N	1	1	323.349	1.246	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@H](C)O)CC2)c(F)cc1[N+](=O)[O-]	ZINC000114014618	353978645	/nfs/dbraw/zinc/97/86/45/353978645.db2.gz	WHLMRUKBDFYSSX-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
[NH3+][C@@H]1CCC[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000124876686	354042133	/nfs/dbraw/zinc/04/21/33/354042133.db2.gz	FFKVGDUWMIBWBY-BDAKNGLRSA-N	1	1	317.342	1.282	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C[C@H](O)C2CC2)c([N+](=O)[O-])c1	ZINC000156638991	354220034	/nfs/dbraw/zinc/22/00/34/354220034.db2.gz	OWJUIELAOGZCLH-AWEZNQCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C[C@H](O)C2CC2)c([N+](=O)[O-])c1	ZINC000156638991	354220037	/nfs/dbraw/zinc/22/00/37/354220037.db2.gz	OWJUIELAOGZCLH-AWEZNQCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
CN1CC[C@@H]([N@@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000265667625	354400958	/nfs/dbraw/zinc/40/09/58/354400958.db2.gz	WBFYLAZXXKBNGD-CQSZACIVSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)C1CC1	ZINC000305729953	354471222	/nfs/dbraw/zinc/47/12/22/354471222.db2.gz	KFAPPIXVFAAEFK-HZMBPMFUSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@@H]2N1	ZINC000320069207	354525012	/nfs/dbraw/zinc/52/50/12/354525012.db2.gz	KAMSHELKFOBSKW-FZMZJTMJSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@@H]2N1	ZINC000320069207	354525013	/nfs/dbraw/zinc/52/50/13/354525013.db2.gz	KAMSHELKFOBSKW-FZMZJTMJSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)c1	ZINC000585800598	354848982	/nfs/dbraw/zinc/84/89/82/354848982.db2.gz	ASSFKBLNZGTBAM-KFWWJZLASA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2[C@H]2CCCC[C@@H]2O)c1	ZINC000585800598	354848986	/nfs/dbraw/zinc/84/89/86/354848986.db2.gz	ASSFKBLNZGTBAM-KFWWJZLASA-N	1	1	324.381	1.043	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000588007205	354892644	/nfs/dbraw/zinc/89/26/44/354892644.db2.gz	AGVPPVJVUPQJRR-SNVBAGLBSA-N	1	1	317.349	1.397	20	5		DDBDMO
Nc1cc(N[C@@H]2CCn3cc[nH+]c3C2)cc(CO)c1[N+](=O)[O-]	ZINC000588022503	354895060	/nfs/dbraw/zinc/89/50/60/354895060.db2.gz	XRMCVYLLJBSYFS-SNVBAGLBSA-N	1	1	303.322	1.293	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)C[N@H+]1C1CC1	ZINC000589584119	355002349	/nfs/dbraw/zinc/00/23/49/355002349.db2.gz	GCANXYHTCVQIKG-JOYOIKCWSA-N	1	1	306.366	1.706	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@@H](C)C(=O)OC)c1	ZINC000589495883	354995882	/nfs/dbraw/zinc/99/58/82/354995882.db2.gz	HOZWFASHPQYTGR-SNVBAGLBSA-N	1	1	324.333	1.622	20	5		DDBDMO
CN(C(=O)CN1CC[C@H]2C[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1	ZINC000590012326	355040507	/nfs/dbraw/zinc/04/05/07/355040507.db2.gz	QWZXLAMFDMQCFV-SWLSCSKDSA-N	1	1	318.377	1.194	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000590046690	355043303	/nfs/dbraw/zinc/04/33/03/355043303.db2.gz	MMNCGAYGBVSGDE-DZGCQCFKSA-N	1	1	303.362	1.608	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000590046697	355043321	/nfs/dbraw/zinc/04/33/21/355043321.db2.gz	MMNCGAYGBVSGDE-ZFWWWQNUSA-N	1	1	303.362	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]([NH+](C)C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000590403650	355085631	/nfs/dbraw/zinc/08/56/31/355085631.db2.gz	LLZRDAJUGYRHRW-UWVGGRQHSA-N	1	1	309.370	1.606	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c1	ZINC000591505239	355322077	/nfs/dbraw/zinc/32/20/77/355322077.db2.gz	TUHUIZSJGQFRAO-NEPJUHHUSA-N	1	1	322.361	1.832	20	5		DDBDMO
[NH3+]C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(F)(F)F	ZINC000594451006	356222043	/nfs/dbraw/zinc/22/20/43/356222043.db2.gz	BADXGXNJNRDOAT-MRVPVSSYSA-N	1	1	317.227	1.091	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)n1	ZINC000594360779	356183057	/nfs/dbraw/zinc/18/30/57/356183057.db2.gz	WHNZBYVKPVZMHC-WDEREUQCSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[N@@H+]1CCO[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000081434198	192264291	/nfs/dbraw/zinc/26/42/91/192264291.db2.gz	SKRFPGQYTMFWQP-HNNXBMFYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@H+]1CCO[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000081434198	192264294	/nfs/dbraw/zinc/26/42/94/192264294.db2.gz	SKRFPGQYTMFWQP-HNNXBMFYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C2)C1	ZINC000294031671	283169639	/nfs/dbraw/zinc/16/96/39/283169639.db2.gz	ZWHBSYHXYCVVBH-HNNXBMFYSA-N	1	1	304.350	1.345	20	5		DDBDMO
Cc1noc(C[NH2+][C@@H](C2CC2)[C@@]2(CO)CCCO2)c1[N+](=O)[O-]	ZINC000595504300	356521785	/nfs/dbraw/zinc/52/17/85/356521785.db2.gz	BJGSSFBCARTKRR-KBPBESRZSA-N	1	1	311.338	1.301	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595771467	356645709	/nfs/dbraw/zinc/64/57/09/356645709.db2.gz	PJEUYFDCULYJAL-CORIIIEPSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000595759905	356640813	/nfs/dbraw/zinc/64/08/13/356640813.db2.gz	QVYOBNCNFLYFCW-MLGOLLRUSA-N	1	1	319.361	1.892	20	5		DDBDMO
O=C(C[N@@H+]1CCC2(COC2)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595833437	356670456	/nfs/dbraw/zinc/67/04/56/356670456.db2.gz	JDMKPJYETDLBGX-UHFFFAOYSA-N	1	1	317.345	1.206	20	5		DDBDMO
O=C(C[N@H+]1CCC2(COC2)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595833437	356670458	/nfs/dbraw/zinc/67/04/58/356670458.db2.gz	JDMKPJYETDLBGX-UHFFFAOYSA-N	1	1	317.345	1.206	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H]2COC[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595826934	356665744	/nfs/dbraw/zinc/66/57/44/356665744.db2.gz	BESAWYNBWBZWAS-OLZOCXBDSA-N	1	1	319.361	1.892	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000595825005	356666269	/nfs/dbraw/zinc/66/62/69/356666269.db2.gz	BVEYSDXKDQTYKE-OAHLLOKOSA-N	1	1	320.393	1.825	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)c1cc[nH]c(=O)c1[N+](=O)[O-]	ZINC000596233227	356826250	/nfs/dbraw/zinc/82/62/50/356826250.db2.gz	AYHJDRDGHBLSMS-UHFFFAOYSA-N	1	1	311.386	1.015	20	5		DDBDMO
CN(CCCN(C)c1cc[nH]c(=O)c1[N+](=O)[O-])CC[NH+](C)C	ZINC000596233227	356826252	/nfs/dbraw/zinc/82/62/52/356826252.db2.gz	AYHJDRDGHBLSMS-UHFFFAOYSA-N	1	1	311.386	1.015	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@]3(O)C[C@H]3C1)OCCO2	ZINC000597211717	357094456	/nfs/dbraw/zinc/09/44/56/357094456.db2.gz	NYEDDBKXCFTCER-XHDPSFHLSA-N	1	1	306.318	1.323	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@]3(O)C[C@H]3C1)OCCO2	ZINC000597211717	357094461	/nfs/dbraw/zinc/09/44/61/357094461.db2.gz	NYEDDBKXCFTCER-XHDPSFHLSA-N	1	1	306.318	1.323	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000598587287	357642085	/nfs/dbraw/zinc/64/20/85/357642085.db2.gz	OECSGIXGODAUMP-SNVBAGLBSA-N	1	1	320.349	1.673	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000598599463	357648752	/nfs/dbraw/zinc/64/87/52/357648752.db2.gz	OIWMFSGPDNZREM-NXEZZACHSA-N	1	1	308.338	1.671	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@]3([NH3+])C2)c1[N+](=O)[O-]	ZINC000598667431	357677374	/nfs/dbraw/zinc/67/73/74/357677374.db2.gz	GPPVAZVBJXFPFM-XPTSAGLGSA-N	1	1	307.354	1.224	20	5		DDBDMO
COC(=O)c1cnc(NC[C@@H]2CCCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000599138081	357826706	/nfs/dbraw/zinc/82/67/06/357826706.db2.gz	FSOLMDQOPIGUNJ-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000347912966	283298091	/nfs/dbraw/zinc/29/80/91/283298091.db2.gz	LTVHKPFURJYCIC-LLVKDONJSA-N	1	1	306.366	1.780	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000599562860	357975027	/nfs/dbraw/zinc/97/50/27/357975027.db2.gz	IUINBVPKTOQQAR-HNNXBMFYSA-N	1	1	308.334	1.401	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000599568557	357978353	/nfs/dbraw/zinc/97/83/53/357978353.db2.gz	UBCNXGDLALPIRQ-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000599568557	357978357	/nfs/dbraw/zinc/97/83/57/357978357.db2.gz	UBCNXGDLALPIRQ-OAHLLOKOSA-N	1	1	324.333	1.367	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])C1CC[NH+](C)CC1	ZINC000599986729	358096600	/nfs/dbraw/zinc/09/66/00/358096600.db2.gz	YPHAQINRQZUIIQ-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
C=Cn1cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC000601149133	358422079	/nfs/dbraw/zinc/42/20/79/358422079.db2.gz	JFZJWUJUXIQJKC-HNNXBMFYSA-N	1	1	302.334	1.889	20	5		DDBDMO
C[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@H](CO)O1	ZINC000601153504	358424156	/nfs/dbraw/zinc/42/41/56/358424156.db2.gz	PKDHRIZRXRFWSB-ZYHUDNBSSA-N	1	1	303.318	1.729	20	5		DDBDMO
COC[C@@]1(CO)CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1	ZINC000601172129	358432164	/nfs/dbraw/zinc/43/21/64/358432164.db2.gz	VLXHNBMZHJZGSE-INIZCTEOSA-N	1	1	317.345	1.978	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@H](CO)[C@H]3CCCOC3)c2c1	ZINC000601176871	358434544	/nfs/dbraw/zinc/43/45/44/358434544.db2.gz	SGVZNHMPAOSTDK-MEDUHNTESA-N	1	1	317.345	1.764	20	5		DDBDMO
CN(C)C(=O)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000602593945	359061303	/nfs/dbraw/zinc/06/13/03/359061303.db2.gz	MDOUPRYYKZADBK-UHFFFAOYSA-N	1	1	305.256	1.791	20	5		DDBDMO
Cn1cc(C[NH+]2CCC([C@H]3NC(=O)C3(C)C)CC2)c([N+](=O)[O-])n1	ZINC000602704766	359136021	/nfs/dbraw/zinc/13/60/21/359136021.db2.gz	IHWRFEIISCWDFL-GFCCVEGCSA-N	1	1	321.381	1.065	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C1CCOCC1	ZINC000602803120	359203488	/nfs/dbraw/zinc/20/34/88/359203488.db2.gz	WKJOXMNGENVLCC-AWEZNQCLSA-N	1	1	308.382	1.991	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@](C)(CO)C1	ZINC000602965033	359329423	/nfs/dbraw/zinc/32/94/23/359329423.db2.gz	YDDXYAJCFPXIQG-CABCVRRESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000603400276	359616416	/nfs/dbraw/zinc/61/64/16/359616416.db2.gz	FLKNNBQXFSXPKC-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@@H]1O	ZINC000186875463	200024978	/nfs/dbraw/zinc/02/49/78/200024978.db2.gz	JOIWIKXANJMOSS-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@@H]1O	ZINC000186875463	200024980	/nfs/dbraw/zinc/02/49/80/200024980.db2.gz	JOIWIKXANJMOSS-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000188829761	200309216	/nfs/dbraw/zinc/30/92/16/200309216.db2.gz	XSFJUPYQGXHRFY-UHFFFAOYSA-N	1	1	310.354	1.339	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000281176141	216132315	/nfs/dbraw/zinc/13/23/15/216132315.db2.gz	NAVZAMYOXSSOHO-LLVKDONJSA-N	1	1	322.365	1.554	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CN1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC000609333881	360295483	/nfs/dbraw/zinc/29/54/83/360295483.db2.gz	BVZDSVWGTMOUIQ-CQSZACIVSA-N	1	1	319.409	1.596	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ccsc3[N+](=O)[O-])CC2)C1	ZINC000609674474	360343130	/nfs/dbraw/zinc/34/31/30/360343130.db2.gz	HBJMZBRFGZRJHO-LBPRGKRZSA-N	1	1	310.423	1.873	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3cccnc3[N+](=O)[O-])CC2)C1	ZINC000609675159	360344312	/nfs/dbraw/zinc/34/43/12/360344312.db2.gz	ZVPIIDLMKINKNR-CYBMUJFWSA-N	1	1	305.382	1.206	20	5		DDBDMO
CN(C(=O)C[N@@H+](CCO)CC(C)(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000609483441	360312654	/nfs/dbraw/zinc/31/26/54/360312654.db2.gz	CMCRTVVGINBBHJ-UHFFFAOYSA-N	1	1	323.393	1.898	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000610489146	360449748	/nfs/dbraw/zinc/44/97/48/360449748.db2.gz	HKTBIYKBDXYICG-ZDUSSCGKSA-N	1	1	306.366	1.681	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000359028215	299311202	/nfs/dbraw/zinc/31/12/02/299311202.db2.gz	PJPJJKMDNPUGDK-NEPJUHHUSA-N	1	1	305.338	1.160	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](O)C12CCCC2)Nc1ccccc1[N+](=O)[O-]	ZINC000292708137	223210621	/nfs/dbraw/zinc/21/06/21/223210621.db2.gz	LGJROIAMPJQDQT-CQSZACIVSA-N	1	1	319.361	1.913	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](O)C12CCCC2)Nc1ccccc1[N+](=O)[O-]	ZINC000292708137	223210622	/nfs/dbraw/zinc/21/06/22/223210622.db2.gz	LGJROIAMPJQDQT-CQSZACIVSA-N	1	1	319.361	1.913	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CCn1ccccc1=O	ZINC000619785403	364149736	/nfs/dbraw/zinc/14/97/36/364149736.db2.gz	CVGADKBDDGXFCO-UHFFFAOYSA-N	1	1	301.346	1.931	20	5		DDBDMO
C[C@@H]1C[C@@H]1N1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1=O	ZINC000350290214	284178969	/nfs/dbraw/zinc/17/89/69/284178969.db2.gz	UKJSNPDWBKUEHM-PUYPPJJSSA-N	1	1	307.325	1.833	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(CC[NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000264909895	204262594	/nfs/dbraw/zinc/26/25/94/204262594.db2.gz	NEAIUZHDFNPSKL-UHFFFAOYSA-N	1	1	309.370	1.430	20	5		DDBDMO
CCOc1cc(C[N@H+](CC)[C@@H]2CCNC2=O)ccc1[N+](=O)[O-]	ZINC000282528792	217064797	/nfs/dbraw/zinc/06/47/97/217064797.db2.gz	YWEDEJUJUAUFGE-CYBMUJFWSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCOc1cc(C[N@@H+](CC)[C@@H]2CCNC2=O)ccc1[N+](=O)[O-]	ZINC000282528792	217064802	/nfs/dbraw/zinc/06/48/02/217064802.db2.gz	YWEDEJUJUAUFGE-CYBMUJFWSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000351486020	284336444	/nfs/dbraw/zinc/33/64/44/284336444.db2.gz	LTSBOBKVIUSAIH-DZGCQCFKSA-N	1	1	314.345	1.751	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H](c2ccccc2)C1	ZINC000351486889	284337330	/nfs/dbraw/zinc/33/73/30/284337330.db2.gz	YJPGXAFELDWRIB-TZMCWYRMSA-N	1	1	314.345	1.751	20	5		DDBDMO
CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH+](C)CC1	ZINC000351500272	284348042	/nfs/dbraw/zinc/34/80/42/284348042.db2.gz	RUIRJCVHVHEHLB-AWEZNQCLSA-N	1	1	305.378	1.938	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H]3CC[C@@H]([NH3+])[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000351501988	284349329	/nfs/dbraw/zinc/34/93/29/284349329.db2.gz	YQKLZXUMUABKEY-IACUBPJLSA-N	1	1	321.377	1.651	20	5		DDBDMO
C[C@@H](CO)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCC1	ZINC000351525013	284361887	/nfs/dbraw/zinc/36/18/87/284361887.db2.gz	QOGNVFXFJSMYJZ-NSHDSACASA-N	1	1	321.377	1.819	20	5		DDBDMO
CC(C)[N@@H+](CCN1C(=O)CNC1=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000064350006	248203133	/nfs/dbraw/zinc/20/31/33/248203133.db2.gz	AYYPLZSXCDDNLY-UHFFFAOYSA-N	1	1	320.349	1.357	20	5		DDBDMO
CCOCC[NH+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000105831467	194139590	/nfs/dbraw/zinc/13/95/90/194139590.db2.gz	VOLPOMHGZZHKLE-UHFFFAOYSA-N	1	1	311.357	1.888	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH+]3CCC(CO)CC3)n2)cc1	ZINC000339144157	250312964	/nfs/dbraw/zinc/31/29/64/250312964.db2.gz	QEBHHEKZKJHOGG-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000352432628	285046777	/nfs/dbraw/zinc/04/67/77/285046777.db2.gz	UNNYFBNGQXKARM-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CO)C1	ZINC000120094246	195096043	/nfs/dbraw/zinc/09/60/43/195096043.db2.gz	QSDZZTZEPBGZMN-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CO)C1	ZINC000120094246	195096045	/nfs/dbraw/zinc/09/60/45/195096045.db2.gz	QSDZZTZEPBGZMN-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2[nH+]ccn21	ZINC000352472828	285076136	/nfs/dbraw/zinc/07/61/36/285076136.db2.gz	KQQZDCJJCYFPPH-ZDUSSCGKSA-N	1	1	300.318	1.985	20	5		DDBDMO
CNc1c(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000425069367	533040756	/nfs/dbraw/zinc/04/07/56/533040756.db2.gz	UVLVPOIMSBMYIC-SMDDNHRTSA-N	1	1	318.377	1.803	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286477887	219010790	/nfs/dbraw/zinc/01/07/90/219010790.db2.gz	LDZFEUSGPDYADK-ZLKJLUDKSA-N	1	1	307.350	1.767	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000424987357	533092867	/nfs/dbraw/zinc/09/28/67/533092867.db2.gz	ZEIAUJRUIVRKEU-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@H]1O	ZINC000352657692	285201998	/nfs/dbraw/zinc/20/19/98/285201998.db2.gz	BYTRMFTTXVUSFK-ZIAGYGMSSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000156550193	197122864	/nfs/dbraw/zinc/12/28/64/197122864.db2.gz	HMLCGQICWRDYDC-GFCCVEGCSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000156550314	197122672	/nfs/dbraw/zinc/12/26/72/197122672.db2.gz	HMLCGQICWRDYDC-LBPRGKRZSA-N	1	1	324.381	1.845	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000352783384	285298337	/nfs/dbraw/zinc/29/83/37/285298337.db2.gz	XYLTUYKSUSAAAS-GHMZBOCLSA-N	1	1	309.341	1.827	20	5		DDBDMO
Cc1[nH+]cc2n1CC[C@@H](C(=O)NCc1ccccc1[N+](=O)[O-])C2	ZINC000289730784	221185148	/nfs/dbraw/zinc/18/51/48/221185148.db2.gz	GEIJVNDAKZHEDZ-GFCCVEGCSA-N	1	1	314.345	1.979	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@@H+](C)[C@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000487136443	292030136	/nfs/dbraw/zinc/03/01/36/292030136.db2.gz	KKKYPRGMXKMULN-ZDUSSCGKSA-N	1	1	322.365	1.553	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2[C@H]2CCCOC2)c1	ZINC000569453293	304355312	/nfs/dbraw/zinc/35/53/12/304355312.db2.gz	UVMIDDYHOWZRER-CFVMTHIKSA-N	1	1	324.381	1.043	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000068085013	406614670	/nfs/dbraw/zinc/61/46/70/406614670.db2.gz	DHUIVWJCBNAETD-ZDUSSCGKSA-N	1	1	323.397	1.420	20	5		DDBDMO
COc1ccc(C[NH+]2CCC(CC(N)=O)CC2)cc1[N+](=O)[O-]	ZINC000048024594	407086213	/nfs/dbraw/zinc/08/62/13/407086213.db2.gz	BHMJHIHRJPREAY-UHFFFAOYSA-N	1	1	307.350	1.691	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000107891499	407381013	/nfs/dbraw/zinc/38/10/13/407381013.db2.gz	ZXMACUPJXSDIOK-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000107893573	407381121	/nfs/dbraw/zinc/38/11/21/407381121.db2.gz	WAQPDQPAJPCAAU-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CCn1cccn1)c1ccc([N+](=O)[O-])cc1	ZINC000111283073	407405925	/nfs/dbraw/zinc/40/59/25/407405925.db2.gz	QKHADSYAABQBFV-UHFFFAOYSA-N	1	1	317.349	1.386	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CCn1cccn1)c1ccc([N+](=O)[O-])cc1	ZINC000111283073	407405926	/nfs/dbraw/zinc/40/59/26/407405926.db2.gz	QKHADSYAABQBFV-UHFFFAOYSA-N	1	1	317.349	1.386	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@H](C[NH+]3CCOCC3)C2)n1	ZINC000127556404	407440109	/nfs/dbraw/zinc/44/01/09/407440109.db2.gz	VCYGLGCKSWBMJE-CYBMUJFWSA-N	1	1	306.366	1.457	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000271024680	407475690	/nfs/dbraw/zinc/47/56/90/407475690.db2.gz	ZHPTXHPKFPLLQM-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000271024680	407475694	/nfs/dbraw/zinc/47/56/94/407475694.db2.gz	ZHPTXHPKFPLLQM-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000271024680	407475699	/nfs/dbraw/zinc/47/56/99/407475699.db2.gz	ZHPTXHPKFPLLQM-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)CC2(C)C)c1[N+](=O)[O-]	ZINC000271024680	407475703	/nfs/dbraw/zinc/47/57/03/407475703.db2.gz	ZHPTXHPKFPLLQM-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
COC[C@H]1CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000265766038	407441903	/nfs/dbraw/zinc/44/19/03/407441903.db2.gz	HXKUGHMHIHDRDJ-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000265766038	407441912	/nfs/dbraw/zinc/44/19/12/407441912.db2.gz	HXKUGHMHIHDRDJ-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(O)CCCC1	ZINC000152179952	407576548	/nfs/dbraw/zinc/57/65/48/407576548.db2.gz	YOVHCXMAXUXUHX-AWEZNQCLSA-N	1	1	324.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cncnc3)C2)nc1	ZINC000128897325	407580545	/nfs/dbraw/zinc/58/05/45/407580545.db2.gz	UPAFWZFKSHMWGZ-LBPRGKRZSA-N	1	1	300.322	1.466	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cncnc3)C2)nc1	ZINC000128897325	407580552	/nfs/dbraw/zinc/58/05/52/407580552.db2.gz	UPAFWZFKSHMWGZ-LBPRGKRZSA-N	1	1	300.322	1.466	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](C3OCCO3)C2)c1	ZINC000178859912	407630438	/nfs/dbraw/zinc/63/04/38/407630438.db2.gz	WGOPHAAYUSPEPK-ZFWWWQNUSA-N	1	1	322.361	1.713	20	5		DDBDMO
CC(C)C[C@@H](C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236656859	407740811	/nfs/dbraw/zinc/74/08/11/407740811.db2.gz	KTEHFXJAYMTEIC-VIFPVBQESA-N	1	1	305.338	1.574	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173462269	407882590	/nfs/dbraw/zinc/88/25/90/407882590.db2.gz	FYIUYGNXLDKTMC-LBPRGKRZSA-N	1	1	321.381	1.344	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173462269	407882592	/nfs/dbraw/zinc/88/25/92/407882592.db2.gz	FYIUYGNXLDKTMC-LBPRGKRZSA-N	1	1	321.381	1.344	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000153728432	407887669	/nfs/dbraw/zinc/88/76/69/407887669.db2.gz	BNSGCCFHOVSBRM-NSHDSACASA-N	1	1	309.370	1.049	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000153728432	407887673	/nfs/dbraw/zinc/88/76/73/407887673.db2.gz	BNSGCCFHOVSBRM-NSHDSACASA-N	1	1	309.370	1.049	20	5		DDBDMO
Cc1nc(NC2CC[NH+](CCN(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000268429981	408040990	/nfs/dbraw/zinc/04/09/90/408040990.db2.gz	BAHFZVQOOBQHFL-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000263650637	408189474	/nfs/dbraw/zinc/18/94/74/408189474.db2.gz	BLHQJCDYPVCCRW-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
CCNC(=O)C[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000263650637	408189482	/nfs/dbraw/zinc/18/94/82/408189482.db2.gz	BLHQJCDYPVCCRW-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
Cc1ccc(N2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)cc1	ZINC000273614877	408264979	/nfs/dbraw/zinc/26/49/79/408264979.db2.gz	UUXCHKINBNQMHE-UHFFFAOYSA-N	1	1	315.377	1.922	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000269328120	408270551	/nfs/dbraw/zinc/27/05/51/408270551.db2.gz	DMSYRUHWKIRJJX-GHMZBOCLSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000269328120	408270557	/nfs/dbraw/zinc/27/05/57/408270557.db2.gz	DMSYRUHWKIRJJX-GHMZBOCLSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000269328120	408270560	/nfs/dbraw/zinc/27/05/60/408270560.db2.gz	DMSYRUHWKIRJJX-GHMZBOCLSA-N	1	1	321.381	1.750	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nnnc2Sc2ccc([N+](=O)[O-])cn2)C1	ZINC000131941709	162026627	/nfs/dbraw/zinc/02/66/27/162026627.db2.gz	OXYUEYIJUHKHFX-SECBINFHSA-N	1	1	321.366	1.079	20	5		DDBDMO
CC[C@](C)([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C(N)=O	ZINC000133101960	162051004	/nfs/dbraw/zinc/05/10/04/162051004.db2.gz	JWZNNTMLEDTFNM-AWEZNQCLSA-N	1	1	308.338	1.085	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000264160243	408385633	/nfs/dbraw/zinc/38/56/33/408385633.db2.gz	NUFLGRCDBSGKMJ-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000183361230	408390485	/nfs/dbraw/zinc/39/04/85/408390485.db2.gz	RKPFHHMQYKUIEB-MRXNPFEDSA-N	1	1	323.393	1.028	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177081911	408514251	/nfs/dbraw/zinc/51/42/51/408514251.db2.gz	XZISOKHRSOTQCL-PSASIEDQSA-N	1	1	322.340	1.671	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000177205443	408551263	/nfs/dbraw/zinc/55/12/63/408551263.db2.gz	YFHHWYWDYAIPOT-WDEREUQCSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@@H](C)C1	ZINC000275372754	408584046	/nfs/dbraw/zinc/58/40/46/408584046.db2.gz	NSTMBWMPTMBHEY-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)[C@@H](C)C1	ZINC000275372754	408584049	/nfs/dbraw/zinc/58/40/49/408584049.db2.gz	NSTMBWMPTMBHEY-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
CC1(C)C[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@H]1O	ZINC000275440845	408591091	/nfs/dbraw/zinc/59/10/91/408591091.db2.gz	KIWNGPHITKOGML-CYBMUJFWSA-N	1	1	307.350	1.287	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@H]1O	ZINC000275440845	408591096	/nfs/dbraw/zinc/59/10/96/408591096.db2.gz	KIWNGPHITKOGML-CYBMUJFWSA-N	1	1	307.350	1.287	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000161369034	408593956	/nfs/dbraw/zinc/59/39/56/408593956.db2.gz	AHUMEXGWCLDOTE-SKDRFNHKSA-N	1	1	324.356	1.775	20	5		DDBDMO
CN(CC1([NH+](C)C)CCC1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000275888301	408709600	/nfs/dbraw/zinc/70/96/00/408709600.db2.gz	PESXXSNKUGZJQQ-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1O	ZINC000249573344	408743463	/nfs/dbraw/zinc/74/34/63/408743463.db2.gz	OWIIRDVAXMTBFR-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1O	ZINC000249573344	408743468	/nfs/dbraw/zinc/74/34/68/408743468.db2.gz	OWIIRDVAXMTBFR-SMDDNHRTSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000162188215	408676366	/nfs/dbraw/zinc/67/63/66/408676366.db2.gz	QGPXBEOJJMUXCH-LBPRGKRZSA-N	1	1	323.397	1.570	20	5		DDBDMO
COc1cccc(NC[C@H]2C[N@@H+](C3CC3)CCO2)c1[N+](=O)[O-]	ZINC000185382154	408802957	/nfs/dbraw/zinc/80/29/57/408802957.db2.gz	CEIUICAYINOPFC-LBPRGKRZSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1cccc(NC[C@H]2C[N@H+](C3CC3)CCO2)c1[N+](=O)[O-]	ZINC000185382154	408802961	/nfs/dbraw/zinc/80/29/61/408802961.db2.gz	CEIUICAYINOPFC-LBPRGKRZSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000249583232	408746710	/nfs/dbraw/zinc/74/67/10/408746710.db2.gz	RYCHDWKQRXKZHQ-SMDDNHRTSA-N	1	1	310.350	1.685	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@H+](C)CC1(C)C	ZINC000270943448	408752038	/nfs/dbraw/zinc/75/20/38/408752038.db2.gz	SYAVUQZEMAFJSH-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](C)C[N@@H+](C)C(C)C	ZINC000290924349	408853104	/nfs/dbraw/zinc/85/31/04/408853104.db2.gz	LBYNHUBEYRCVLI-LLVKDONJSA-N	1	1	311.386	1.335	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000276603373	408891341	/nfs/dbraw/zinc/89/13/41/408891341.db2.gz	RKWAURUKTXANDU-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CN1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000191140681	163174891	/nfs/dbraw/zinc/17/48/91/163174891.db2.gz	DWHMKOPUNNWMLZ-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
CN1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000191140681	163174894	/nfs/dbraw/zinc/17/48/94/163174894.db2.gz	DWHMKOPUNNWMLZ-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000286223735	408945005	/nfs/dbraw/zinc/94/50/05/408945005.db2.gz	YVIGNNKPZVQCDH-BBRMVZONSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1cc(N)ccc1[N+](=O)[O-]	ZINC000286328474	408964391	/nfs/dbraw/zinc/96/43/91/408964391.db2.gz	LHOVSEPJMQOGTQ-AAEUAGOBSA-N	1	1	306.366	1.476	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000286380147	408974523	/nfs/dbraw/zinc/97/45/23/408974523.db2.gz	GQCPNUWKIGOSSU-ZFWWWQNUSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C2)C1	ZINC000292345717	409026277	/nfs/dbraw/zinc/02/62/77/409026277.db2.gz	QJGFJSZJQQEMQF-HNNXBMFYSA-N	1	1	304.350	1.226	20	5		DDBDMO
C[N@@H+]1CCN(CCNCc2csc([N+](=O)[O-])c2)CC1(C)C	ZINC000282369882	409042111	/nfs/dbraw/zinc/04/21/11/409042111.db2.gz	NUHZKJGLCSWRAT-UHFFFAOYSA-N	1	1	312.439	1.772	20	5		DDBDMO
C[N@H+]1CCN(CCNCc2csc([N+](=O)[O-])c2)CC1(C)C	ZINC000282369882	409042112	/nfs/dbraw/zinc/04/21/12/409042112.db2.gz	NUHZKJGLCSWRAT-UHFFFAOYSA-N	1	1	312.439	1.772	20	5		DDBDMO
CCc1nocc1C[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000293507180	409127226	/nfs/dbraw/zinc/12/72/26/409127226.db2.gz	UVHDVNAKAOQBET-UHFFFAOYSA-N	1	1	306.322	1.439	20	5		DDBDMO
CCc1nocc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000293507180	409127228	/nfs/dbraw/zinc/12/72/28/409127228.db2.gz	UVHDVNAKAOQBET-UHFFFAOYSA-N	1	1	306.322	1.439	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[N@H+]1C1CC1	ZINC000279492337	409224038	/nfs/dbraw/zinc/22/40/38/409224038.db2.gz	RSEFPJUUPNLAIC-IUCAKERBSA-N	1	1	322.340	1.671	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)Cc1csc([N+](=O)[O-])c1	ZINC000289385049	409258457	/nfs/dbraw/zinc/25/84/57/409258457.db2.gz	JNHSNIXSKTVLAI-UHFFFAOYSA-N	1	1	314.455	1.972	20	5		DDBDMO
CN(CCCN(C)Cc1csc([N+](=O)[O-])c1)CC[NH+](C)C	ZINC000289385049	409258460	/nfs/dbraw/zinc/25/84/60/409258460.db2.gz	JNHSNIXSKTVLAI-UHFFFAOYSA-N	1	1	314.455	1.972	20	5		DDBDMO
C[C@@H]1Cc2[nH+]cn(C[C@H](O)Cn3cc([N+](=O)[O-])cn3)c2C[C@H]1C	ZINC000295067199	409312327	/nfs/dbraw/zinc/31/23/27/409312327.db2.gz	CGWUPRPRYITLLO-WZRBSPASSA-N	1	1	319.365	1.420	20	5		DDBDMO
CC1(C)C[C@H](O)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000296047295	409411800	/nfs/dbraw/zinc/41/18/00/409411800.db2.gz	NMOJVCZPCHMFCC-CYBMUJFWSA-N	1	1	321.377	1.677	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1csc([N+](=O)[O-])c1	ZINC000295306888	409425549	/nfs/dbraw/zinc/42/55/49/409425549.db2.gz	BNKRSGXQZUQOBM-LLVKDONJSA-N	1	1	313.379	1.233	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)c1[N+](=O)[O-]	ZINC000295304711	409426038	/nfs/dbraw/zinc/42/60/38/409426038.db2.gz	BGBLOPFIFJZDIP-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408069490	164216673	/nfs/dbraw/zinc/21/66/73/164216673.db2.gz	BVJUOJIYYHSDGS-WDEREUQCSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408069490	164216674	/nfs/dbraw/zinc/21/66/74/164216674.db2.gz	BVJUOJIYYHSDGS-WDEREUQCSA-N	1	1	309.370	1.077	20	5		DDBDMO
COC[C@@H]1CC[N@@H+]1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1	ZINC000354057803	409615219	/nfs/dbraw/zinc/61/52/19/409615219.db2.gz	ZZPHDSUWZJNXFC-LBPRGKRZSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC[C@@H]1CC[N@H+]1Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1	ZINC000354057803	409615225	/nfs/dbraw/zinc/61/52/25/409615225.db2.gz	ZZPHDSUWZJNXFC-LBPRGKRZSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000297192638	409845261	/nfs/dbraw/zinc/84/52/61/409845261.db2.gz	QTVQEBQRQBCNKP-GFCCVEGCSA-N	1	1	307.350	1.674	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000357005083	409785080	/nfs/dbraw/zinc/78/50/80/409785080.db2.gz	QVOWUVYVELQHLJ-CHWSQXEVSA-N	1	1	320.393	1.582	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H](C)C1	ZINC000346224435	409862922	/nfs/dbraw/zinc/86/29/22/409862922.db2.gz	NUHFUYOGNIDLPV-DMDPSCGWSA-N	1	1	306.366	1.725	20	5		DDBDMO
CN(C(=O)c1c(N)cccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000354479355	409883796	/nfs/dbraw/zinc/88/37/96/409883796.db2.gz	NQKIWLYTLJJYEW-NSHDSACASA-N	1	1	304.350	1.486	20	5		DDBDMO
COc1cc(Cc2noc([C@H]3CC[N@@H+](C)C3)n2)ccc1[N+](=O)[O-]	ZINC000350154635	409927915	/nfs/dbraw/zinc/92/79/15/409927915.db2.gz	DXFXTFSVPRWMJF-NSHDSACASA-N	1	1	318.333	1.996	20	5		DDBDMO
CC(C)(C)OCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000297564497	409928689	/nfs/dbraw/zinc/92/86/89/409928689.db2.gz	BKAWCYSGRNKCJS-UHFFFAOYSA-N	1	1	308.382	1.927	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@@H+]2CC=C(C)CC2)n1	ZINC000342848640	409946614	/nfs/dbraw/zinc/94/66/14/409946614.db2.gz	IOPVVKKZYMXXKL-UHFFFAOYSA-N	1	1	320.349	1.840	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000354580874	409948394	/nfs/dbraw/zinc/94/83/94/409948394.db2.gz	DCVPVFAROQESSF-NWDGAFQWSA-N	1	1	319.361	1.960	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](CCO)C2CC2)c([N+](=O)[O-])c1	ZINC000297947088	410056242	/nfs/dbraw/zinc/05/62/42/410056242.db2.gz	SMTCVPCZEHHDJH-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000343110955	410155280	/nfs/dbraw/zinc/15/52/80/410155280.db2.gz	YVGJCOIKKMOVCK-ABAIWWIYSA-N	1	1	319.361	1.382	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000358051311	410347253	/nfs/dbraw/zinc/34/72/53/410347253.db2.gz	BXOOBXXHFOGSMI-UHFFFAOYSA-N	1	1	319.361	1.742	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@H]2C(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000351976392	410386515	/nfs/dbraw/zinc/38/65/15/410386515.db2.gz	ATFIGOTVKOQBJI-ZDUSSCGKSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@H]2C(=O)N(C)C)ccc1[N+](=O)[O-]	ZINC000351976392	410386520	/nfs/dbraw/zinc/38/65/20/410386520.db2.gz	ATFIGOTVKOQBJI-ZDUSSCGKSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CCc3nc[nH]c3C2)cccc1[N+](=O)[O-]	ZINC000358400029	410462585	/nfs/dbraw/zinc/46/25/85/410462585.db2.gz	VYQLIMAVNYBWMU-VIFPVBQESA-N	1	1	316.317	1.614	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCSC[C@@H]1CCO	ZINC000347391513	410517634	/nfs/dbraw/zinc/51/76/34/410517634.db2.gz	PLKWOBLLBXTRQN-LBPRGKRZSA-N	1	1	312.391	1.773	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CCC[N@H+]1C	ZINC000343583803	410551618	/nfs/dbraw/zinc/55/16/18/410551618.db2.gz	ZKEAPTRZIIRKNT-MWLCHTKSSA-N	1	1	321.333	1.536	20	5		DDBDMO
Cc1cn2c([nH+]1)CC[C@H](Nc1ncc([N+](=O)[O-])cc1C(N)=O)C2	ZINC000301127173	410662308	/nfs/dbraw/zinc/66/23/08/410662308.db2.gz	OXUWJRZXEGKRMG-VIFPVBQESA-N	1	1	316.321	1.021	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000343690213	410622954	/nfs/dbraw/zinc/62/29/54/410622954.db2.gz	MEPQRNIWZWMDDO-HNNXBMFYSA-N	1	1	308.334	1.483	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000343690213	410622959	/nfs/dbraw/zinc/62/29/59/410622959.db2.gz	MEPQRNIWZWMDDO-HNNXBMFYSA-N	1	1	308.334	1.483	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2nc3ccccc3cc2[N+](=O)[O-])C1	ZINC000352361263	410646420	/nfs/dbraw/zinc/64/64/20/410646420.db2.gz	QQDFKBUHXQKLTA-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000352362212	410647701	/nfs/dbraw/zinc/64/77/01/410647701.db2.gz	VBKYGELFFKIBLC-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccccc3cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000352362212	410647707	/nfs/dbraw/zinc/64/77/07/410647707.db2.gz	VBKYGELFFKIBLC-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2C)CC[N@H+]1CCOC	ZINC000301400405	410714972	/nfs/dbraw/zinc/71/49/72/410714972.db2.gz	IGQXZXPSTWGWOC-ZDUSSCGKSA-N	1	1	308.382	1.845	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)C[C@H]2C)c1	ZINC000330419125	410679189	/nfs/dbraw/zinc/67/91/89/410679189.db2.gz	CFSONBMJNZMYLS-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)C[C@H]2C)c1	ZINC000330419125	410679192	/nfs/dbraw/zinc/67/91/92/410679192.db2.gz	CFSONBMJNZMYLS-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1nn(CCC(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000330605532	410822354	/nfs/dbraw/zinc/82/23/54/410822354.db2.gz	ZDVYNUWHKZJQQQ-QWRGUYRKSA-N	1	1	323.397	1.349	20	5		DDBDMO
COc1cc(CN[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000330679904	410873696	/nfs/dbraw/zinc/87/36/96/410873696.db2.gz	YESWMKLXPYYBOU-PWSUYJOCSA-N	1	1	309.366	1.881	20	5		DDBDMO
CC(=O)NC1CCC([N@@H+](C)CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000344034192	410907641	/nfs/dbraw/zinc/90/76/41/410907641.db2.gz	GUDXJVRDKJDSCQ-UHFFFAOYSA-N	1	1	309.370	1.170	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000341242895	410961268	/nfs/dbraw/zinc/96/12/68/410961268.db2.gz	XMZCJYDKTSSBKO-CYBMUJFWSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H](O)C[C@@H]2CO)o1	ZINC000359974848	410978278	/nfs/dbraw/zinc/97/82/78/410978278.db2.gz	PLDGINFVUMTOQM-NEPJUHHUSA-N	1	1	318.329	1.782	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC1(O)CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000353541170	411054017	/nfs/dbraw/zinc/05/40/17/411054017.db2.gz	HGMBXELDGAIJMV-AWEZNQCLSA-N	1	1	316.361	1.922	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)c1[N+](=O)[O-]	ZINC000331293361	411062333	/nfs/dbraw/zinc/06/23/33/411062333.db2.gz	LVBGSHHWWQYMRX-UHFFFAOYSA-N	1	1	323.397	1.489	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353481952	411020429	/nfs/dbraw/zinc/02/04/29/411020429.db2.gz	LJACMTPSTPSCJC-UHFFFAOYSA-N	1	1	323.349	1.387	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353481952	411020434	/nfs/dbraw/zinc/02/04/34/411020434.db2.gz	LJACMTPSTPSCJC-UHFFFAOYSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cc1cc(N2CCC[N@H+]([C@@H](C)CO)CC2)c(F)cc1[N+](=O)[O-]	ZINC000360054363	411022941	/nfs/dbraw/zinc/02/29/41/411022941.db2.gz	SVEKSMPTHXNQPY-LBPRGKRZSA-N	1	1	311.357	1.935	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000131399387	196164677	/nfs/dbraw/zinc/16/46/77/196164677.db2.gz	JZIYPCPQEGUCOT-HNNXBMFYSA-N	1	1	321.377	1.562	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000131549101	196178766	/nfs/dbraw/zinc/17/87/66/196178766.db2.gz	GDWLWISYATYZGK-CQSZACIVSA-N	1	1	321.377	1.052	20	5		DDBDMO
CNc1c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000361220808	418608432	/nfs/dbraw/zinc/60/84/32/418608432.db2.gz	MNRSOIYXDAIYCS-LBPRGKRZSA-N	1	1	318.377	1.945	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000361408564	418645219	/nfs/dbraw/zinc/64/52/19/418645219.db2.gz	OOKVKJNNYSBSBJ-GFCCVEGCSA-N	1	1	318.333	1.990	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000361408564	418645220	/nfs/dbraw/zinc/64/52/20/418645220.db2.gz	OOKVKJNNYSBSBJ-GFCCVEGCSA-N	1	1	318.333	1.990	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](OC)C1	ZINC000361362590	418635725	/nfs/dbraw/zinc/63/57/25/418635725.db2.gz	UDTLKZJMRWVYEJ-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000364468282	418778213	/nfs/dbraw/zinc/77/82/13/418778213.db2.gz	ZOLKBZIFPFNPDL-UONOGXRCSA-N	1	1	305.334	1.188	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CCC(c2cnc[nH]2)CC1	ZINC000372013666	418831509	/nfs/dbraw/zinc/83/15/09/418831509.db2.gz	PCXUAICIIBOFPZ-UHFFFAOYSA-N	1	1	301.306	1.733	20	5		DDBDMO
CCCC(=O)N1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000365824942	418913571	/nfs/dbraw/zinc/91/35/71/418913571.db2.gz	MFOCXVSIFMYZSO-UHFFFAOYSA-N	1	1	309.370	1.126	20	5		DDBDMO
CCCC(=O)N1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000365824942	418913572	/nfs/dbraw/zinc/91/35/72/418913572.db2.gz	MFOCXVSIFMYZSO-UHFFFAOYSA-N	1	1	309.370	1.126	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@](CO)(c3ccccc3)C2)c1	ZINC000365848496	418916246	/nfs/dbraw/zinc/91/62/46/418916246.db2.gz	QFUIPEZKRCNXNL-INIZCTEOSA-N	1	1	316.361	1.427	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000411567116	419346752	/nfs/dbraw/zinc/34/67/52/419346752.db2.gz	IUQOTEKZTCMPIP-ZDUSSCGKSA-N	1	1	307.350	1.770	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420970689	419392929	/nfs/dbraw/zinc/39/29/29/419392929.db2.gz	GVFIVGLNHMJEFY-VIFPVBQESA-N	1	1	303.322	1.039	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420970689	419392932	/nfs/dbraw/zinc/39/29/32/419392932.db2.gz	GVFIVGLNHMJEFY-VIFPVBQESA-N	1	1	303.322	1.039	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](C(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000420970435	419393536	/nfs/dbraw/zinc/39/35/36/419393536.db2.gz	GGCGKUSMWZXDKZ-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000411948239	419512478	/nfs/dbraw/zinc/51/24/78/419512478.db2.gz	UOMRNIVGVCFORE-GFCCVEGCSA-N	1	1	307.350	1.384	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](CC)C[C@H]2C)n1	ZINC000427393464	419652886	/nfs/dbraw/zinc/65/28/86/419652886.db2.gz	ZZDSLKBDXISRBV-GHMZBOCLSA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@H]2C)n1	ZINC000427393464	419652889	/nfs/dbraw/zinc/65/28/89/419652889.db2.gz	ZZDSLKBDXISRBV-GHMZBOCLSA-N	1	1	309.370	1.366	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000299561418	229211123	/nfs/dbraw/zinc/21/11/23/229211123.db2.gz	UBBVREAHYMURGW-QMMMGPOBSA-N	1	1	306.326	1.197	20	5		DDBDMO
Cn1cc(CN2CC[C@H](C[NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000435393498	229380330	/nfs/dbraw/zinc/38/03/30/229380330.db2.gz	GEMMPRQJSGIZDN-GFCCVEGCSA-N	1	1	315.377	1.776	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCC1([NH3+])CCC1	ZINC000423316022	420011710	/nfs/dbraw/zinc/01/17/10/420011710.db2.gz	BNFMLAVVWBPPQV-LLVKDONJSA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(N)CCC1	ZINC000423316022	420011716	/nfs/dbraw/zinc/01/17/16/420011716.db2.gz	BNFMLAVVWBPPQV-LLVKDONJSA-N	1	1	306.366	1.783	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)CCOC1	ZINC000430198462	420090902	/nfs/dbraw/zinc/09/09/02/420090902.db2.gz	YNWHQGFIFJYYCB-HNNXBMFYSA-N	1	1	324.333	1.415	20	5		DDBDMO
CC(C)[N@@H+](CCN1CC[NH2+]CC1)Cc1ccc([N+](=O)[O-])cc1	ZINC000420317821	420203442	/nfs/dbraw/zinc/20/34/42/420203442.db2.gz	OCGRGVVUGGHNEF-UHFFFAOYSA-N	1	1	306.410	1.710	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000430934693	420213617	/nfs/dbraw/zinc/21/36/17/420213617.db2.gz	QLSGWTAZUQJVGN-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H](C)[C@@H](C[NH3+])C2)c1[N+](=O)[O-]	ZINC000424015914	420306546	/nfs/dbraw/zinc/30/65/46/420306546.db2.gz	NIMYRURNZZBLPF-ZJUUUORDSA-N	1	1	309.370	1.327	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC000452069491	420620777	/nfs/dbraw/zinc/62/07/77/420620777.db2.gz	PZPKGFHNALMULA-VXGBXAGGSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000492718833	420639942	/nfs/dbraw/zinc/63/99/42/420639942.db2.gz	LUKSVFFKQPLLRU-FWWRYZNZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000492718833	420639944	/nfs/dbraw/zinc/63/99/44/420639944.db2.gz	LUKSVFFKQPLLRU-FWWRYZNZSA-N	1	1	319.361	1.133	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000454269363	420827017	/nfs/dbraw/zinc/82/70/17/420827017.db2.gz	FNSCDMOKEDHGAP-AWEZNQCLSA-N	1	1	322.365	1.563	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000448946432	420920049	/nfs/dbraw/zinc/92/00/49/420920049.db2.gz	NQGFJHSGKAWBDT-VIFPVBQESA-N	1	1	311.313	1.519	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000448946432	420920050	/nfs/dbraw/zinc/92/00/50/420920050.db2.gz	NQGFJHSGKAWBDT-VIFPVBQESA-N	1	1	311.313	1.519	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](CCO)C[C@H]1C	ZINC000455200296	420982055	/nfs/dbraw/zinc/98/20/55/420982055.db2.gz	VJMGOEJDVFQUJN-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](CCO)C[C@H]1C	ZINC000455200296	420982058	/nfs/dbraw/zinc/98/20/58/420982058.db2.gz	VJMGOEJDVFQUJN-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)C[C@H]1C	ZINC000456006770	421088114	/nfs/dbraw/zinc/08/81/14/421088114.db2.gz	CCMFUHDDPZHRBU-GHMZBOCLSA-N	1	1	321.381	1.586	20	5		DDBDMO
COCC[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000490047927	421186871	/nfs/dbraw/zinc/18/68/71/421186871.db2.gz	UIAHOWLYCFDBOA-ZDUSSCGKSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](CCO)C[C@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965930	421432077	/nfs/dbraw/zinc/43/20/77/421432077.db2.gz	QFJRQASTGQOUDI-CHWSQXEVSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](CCO)C[C@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965930	421432078	/nfs/dbraw/zinc/43/20/78/421432078.db2.gz	QFJRQASTGQOUDI-CHWSQXEVSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@@H]1c1ccccc1	ZINC000548955263	421488642	/nfs/dbraw/zinc/48/86/42/421488642.db2.gz	ZACBQHAHPAFBLT-STQMWFEESA-N	1	1	315.333	1.493	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000518313422	421646499	/nfs/dbraw/zinc/64/64/99/421646499.db2.gz	AVAQGOUMYAXZHL-CYBMUJFWSA-N	1	1	322.365	1.367	20	5		DDBDMO
CNc1nccc(C(=O)NCC[N@@H+](C)C2CCCC2)c1[N+](=O)[O-]	ZINC000571223179	421697521	/nfs/dbraw/zinc/69/75/21/421697521.db2.gz	SKIQUBIXDXCMOY-UHFFFAOYSA-N	1	1	321.381	1.636	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000570823143	421671310	/nfs/dbraw/zinc/67/13/10/421671310.db2.gz	IIRUFYPNYNHLON-NSHDSACASA-N	1	1	321.381	1.518	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000521988069	421810218	/nfs/dbraw/zinc/81/02/18/421810218.db2.gz	FLBSVNJCRMWWQQ-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000521988069	421810223	/nfs/dbraw/zinc/81/02/23/421810223.db2.gz	FLBSVNJCRMWWQQ-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000521988069	421810227	/nfs/dbraw/zinc/81/02/27/421810227.db2.gz	FLBSVNJCRMWWQQ-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CCOCC1	ZINC000541349086	421791142	/nfs/dbraw/zinc/79/11/42/421791142.db2.gz	QHRWNWNTMHZFTP-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589560	422602331	/nfs/dbraw/zinc/60/23/31/422602331.db2.gz	ZVUCRLSZDBDBCQ-UKRRQHHQSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589560	422602336	/nfs/dbraw/zinc/60/23/36/422602336.db2.gz	ZVUCRLSZDBDBCQ-UKRRQHHQSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589560	422602344	/nfs/dbraw/zinc/60/23/44/422602344.db2.gz	ZVUCRLSZDBDBCQ-UKRRQHHQSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000183918624	263383062	/nfs/dbraw/zinc/38/30/62/263383062.db2.gz	MINOZUBZJMKLNA-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1	ZINC000341782272	271211030	/nfs/dbraw/zinc/21/10/30/271211030.db2.gz	ZJDIWIRLMFCPFS-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1	ZINC000341782272	271211033	/nfs/dbraw/zinc/21/10/33/271211033.db2.gz	ZJDIWIRLMFCPFS-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C	ZINC000344650267	272079619	/nfs/dbraw/zinc/07/96/19/272079619.db2.gz	WSCPQTMEOUJZFR-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000339395812	276220651	/nfs/dbraw/zinc/22/06/51/276220651.db2.gz	LYMRGMPUKVYWSK-HOTGVXAUSA-N	1	1	305.378	1.890	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000193278564	280395643	/nfs/dbraw/zinc/39/56/43/280395643.db2.gz	JTAWLNKVDRGRQN-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCCCO1	ZINC000126038390	281224255	/nfs/dbraw/zinc/22/42/55/281224255.db2.gz	KGURSSPIIOIYIP-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000261893669	304603180	/nfs/dbraw/zinc/60/31/80/304603180.db2.gz	FWFOWWCLUNEZEA-LBPRGKRZSA-N	1	1	318.358	1.838	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@H]2O1	ZINC000368521638	301047895	/nfs/dbraw/zinc/04/78/95/301047895.db2.gz	HJUXUHPKLRDUOJ-BFHYXJOUSA-N	1	1	324.381	1.184	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CC2(CCOCC2)O1	ZINC000369311310	301162245	/nfs/dbraw/zinc/16/22/45/301162245.db2.gz	FVLQDMTUFRHAHJ-LBPRGKRZSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC2(CCOCC2)O1	ZINC000369311310	301162247	/nfs/dbraw/zinc/16/22/47/301162247.db2.gz	FVLQDMTUFRHAHJ-LBPRGKRZSA-N	1	1	310.354	1.061	20	5		DDBDMO
COC(=O)CN1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000370030438	301261880	/nfs/dbraw/zinc/26/18/80/301261880.db2.gz	YMQBZJKWNWKWGP-ZDUSSCGKSA-N	1	1	321.377	1.837	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000532913477	303301866	/nfs/dbraw/zinc/30/18/66/303301866.db2.gz	FHWDBHZJXBSXAP-SNVBAGLBSA-N	1	1	309.370	1.513	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2CC[NH+](Cc3ccsc3)CC2)n1	ZINC000536022462	303353978	/nfs/dbraw/zinc/35/39/78/303353978.db2.gz	WLWGGIDSBVRANN-UHFFFAOYSA-N	1	1	321.406	1.671	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC000365078311	307057993	/nfs/dbraw/zinc/05/79/93/307057993.db2.gz	STZDXCWYRUIEIG-MFKMUULPSA-N	1	1	320.349	1.307	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000366633686	307078117	/nfs/dbraw/zinc/07/81/17/307078117.db2.gz	CKYCFGSEKRTCIW-OCCSQVGLSA-N	1	1	319.409	1.777	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@@H]([NH3+])[C@H]3C2)c1[N+](=O)[O-]	ZINC000368615218	307106415	/nfs/dbraw/zinc/10/64/15/307106415.db2.gz	UBACVBSOXWMGML-GARJFASQSA-N	1	1	321.381	1.470	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034071	307114611	/nfs/dbraw/zinc/11/46/11/307114611.db2.gz	CIDVDKFTDUXVSS-HIFRSBDPSA-N	1	1	321.333	1.203	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034071	307114612	/nfs/dbraw/zinc/11/46/12/307114612.db2.gz	CIDVDKFTDUXVSS-HIFRSBDPSA-N	1	1	321.333	1.203	20	5		DDBDMO
CCOCC[C@@H](O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000373105552	307178750	/nfs/dbraw/zinc/17/87/50/307178750.db2.gz	AMDVVFHJZAYRGF-TZMCWYRMSA-N	1	1	312.370	1.216	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H]2CCC[C@H]2[C@H]1C(N)=O	ZINC000373973974	307198729	/nfs/dbraw/zinc/19/87/29/307198729.db2.gz	CLLMSHQCONJHFL-ZBINZKHDSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@H]2[C@H]1C(N)=O	ZINC000373973974	307198730	/nfs/dbraw/zinc/19/87/30/307198730.db2.gz	CLLMSHQCONJHFL-ZBINZKHDSA-N	1	1	319.361	1.689	20	5		DDBDMO
C[C@@H]1C[C@H]([NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000567345834	308078453	/nfs/dbraw/zinc/07/84/53/308078453.db2.gz	VTVMCALZTVGXPL-NFAWXSAZSA-N	1	1	323.393	1.407	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168849	308264025	/nfs/dbraw/zinc/26/40/25/308264025.db2.gz	KUTFCXRCVTYYPU-SWLSCSKDSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@H](O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168849	308264026	/nfs/dbraw/zinc/26/40/26/308264026.db2.gz	KUTFCXRCVTYYPU-SWLSCSKDSA-N	1	1	311.382	1.185	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000361591239	484521753	/nfs/dbraw/zinc/52/17/53/484521753.db2.gz	YPNRDUHHDYWNKI-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000419000364	533987989	/nfs/dbraw/zinc/98/79/89/533987989.db2.gz	OGAHVCDWMXBZHS-QWRGUYRKSA-N	1	1	319.365	1.362	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])C1	ZINC000821254661	606701231	/nfs/dbraw/zinc/70/12/31/606701231.db2.gz	OFNLYDRCDBIFEL-SECBINFHSA-N	1	1	318.341	1.066	20	5		DDBDMO
CC[N@@H+](CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-])C1CC1	ZINC000821214817	606706188	/nfs/dbraw/zinc/70/61/88/606706188.db2.gz	MCPSLBRJINCUMM-UHFFFAOYSA-N	1	1	318.341	1.066	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000108298493	696633396	/nfs/dbraw/zinc/63/33/96/696633396.db2.gz	NDQRTCFYLXDGDM-GFCCVEGCSA-N	1	1	307.325	1.948	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000108342960	696633605	/nfs/dbraw/zinc/63/36/05/696633605.db2.gz	NOQQHHRJWJYGMF-JTQLQIEISA-N	1	1	322.321	1.575	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000157008883	696972011	/nfs/dbraw/zinc/97/20/11/696972011.db2.gz	RHWHRAMJWQRCDA-UHFFFAOYSA-N	1	1	305.338	1.360	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776582442	698121736	/nfs/dbraw/zinc/12/17/36/698121736.db2.gz	QOYVJOBTSZLIDS-GXTWGEPZSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000778295534	698258084	/nfs/dbraw/zinc/25/80/84/698258084.db2.gz	QRBZYAUOVZVNFY-HONMWMINSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000778295534	698258085	/nfs/dbraw/zinc/25/80/85/698258085.db2.gz	QRBZYAUOVZVNFY-HONMWMINSA-N	1	1	307.350	1.214	20	5		DDBDMO
Cc1nn(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c(C)c1[N+](=O)[O-]	ZINC000247045969	698360086	/nfs/dbraw/zinc/36/00/86/698360086.db2.gz	MZAGRNWYCZOTBP-UONOGXRCSA-N	1	1	307.398	1.782	20	5		DDBDMO
CCN1C(=O)CN(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O	ZINC000800866335	700251069	/nfs/dbraw/zinc/25/10/69/700251069.db2.gz	FMAFZHNMGPADOS-UHFFFAOYSA-N	1	1	320.349	1.311	20	5		DDBDMO
CCN1C(=O)CN(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1=O	ZINC000800866335	700251071	/nfs/dbraw/zinc/25/10/71/700251071.db2.gz	FMAFZHNMGPADOS-UHFFFAOYSA-N	1	1	320.349	1.311	20	5		DDBDMO
COCC[NH+]1CCC(N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000788563809	699324345	/nfs/dbraw/zinc/32/43/45/699324345.db2.gz	NWJPDLPOPIKBCY-GFCCVEGCSA-N	1	1	322.409	1.938	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(=O)NC	ZINC000735868540	699707535	/nfs/dbraw/zinc/70/75/35/699707535.db2.gz	SABMKXXQWBQZGJ-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000744462367	699950151	/nfs/dbraw/zinc/95/01/51/699950151.db2.gz	IFSPUBNESRLUHA-UHFFFAOYSA-N	1	1	305.338	1.683	20	5		DDBDMO
CC(=O)[C@](C)(O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000809570845	701670344	/nfs/dbraw/zinc/67/03/44/701670344.db2.gz	CARMAPRRGRHETE-OAHLLOKOSA-N	1	1	307.350	1.057	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC000763107880	700925875	/nfs/dbraw/zinc/92/58/75/700925875.db2.gz	GFFBFTYXBOLSLQ-UHFFFAOYSA-N	1	1	304.306	1.929	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000804396398	701185987	/nfs/dbraw/zinc/18/59/87/701185987.db2.gz	HFJVLQHZTHVVKU-MNOVXSKESA-N	1	1	322.321	1.778	20	5		DDBDMO
COc1cccc(C(=O)OCCC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000769607413	701250240	/nfs/dbraw/zinc/25/02/40/701250240.db2.gz	WTKBYQYZUPMAOR-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839700087	701789555	/nfs/dbraw/zinc/78/95/55/701789555.db2.gz	JIUGHIHINDJBTI-LCGIIJARSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000839700087	701789558	/nfs/dbraw/zinc/78/95/58/701789558.db2.gz	JIUGHIHINDJBTI-LCGIIJARSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839700087	701789562	/nfs/dbraw/zinc/78/95/62/701789562.db2.gz	JIUGHIHINDJBTI-LCGIIJARSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[NH+](C)CCN(Cc1ccc(F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839708466	701792134	/nfs/dbraw/zinc/79/21/34/701792134.db2.gz	XQDVXCIUBIQITM-ZIAGYGMSSA-N	1	1	309.341	1.381	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)OC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000810614484	701801197	/nfs/dbraw/zinc/80/11/97/701801197.db2.gz	COMQGFMZYIILNK-JTQLQIEISA-N	1	1	307.310	1.318	20	5		DDBDMO
O=C(NCC[NH+]1CCC2(CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839758341	701812724	/nfs/dbraw/zinc/81/27/24/701812724.db2.gz	SDEPVRDQNMVRLO-ZIAGYGMSSA-N	1	1	309.410	1.814	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3cc(F)c([N+](=O)[O-])cc3CO)CC[C@@H]21	ZINC000866209019	706649209	/nfs/dbraw/zinc/64/92/09/706649209.db2.gz	NEVSYRSBRFUYLY-GWCFXTLKSA-N	1	1	309.341	1.757	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])C[C@@H]21	ZINC000868717207	702283633	/nfs/dbraw/zinc/28/36/33/702283633.db2.gz	LYTJISKFSQWZCU-YPMHNXCESA-N	1	1	307.325	1.439	20	5		DDBDMO
[NH3+]CC(F)(F)CNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000841060319	702330194	/nfs/dbraw/zinc/33/01/94/702330194.db2.gz	UUXGHTPOWLHLGQ-UHFFFAOYSA-N	1	1	314.336	1.747	20	5		DDBDMO
Cc1cc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c(N)c([N+](=O)[O-])c1	ZINC000817677554	702447968	/nfs/dbraw/zinc/44/79/68/702447968.db2.gz	XYAUDSJEAVRPAH-LLVKDONJSA-N	1	1	306.366	1.652	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(Cc2noc(C[NH2+]C3CC3)n2)c1	ZINC000843222893	702845195	/nfs/dbraw/zinc/84/51/95/702845195.db2.gz	MMLIMSZWDUGKQW-UHFFFAOYSA-N	1	1	304.306	1.829	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](Cn2cc([N+](=O)[O-])c(C)n2)C[C@H]1C1CC1	ZINC000844765506	703071156	/nfs/dbraw/zinc/07/11/56/703071156.db2.gz	SPBUSGAEHVRQQS-NWDGAFQWSA-N	1	1	308.338	1.188	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cn2cc([N+](=O)[O-])c(C)n2)C[C@H]1C1CC1	ZINC000844765506	703071159	/nfs/dbraw/zinc/07/11/59/703071159.db2.gz	SPBUSGAEHVRQQS-NWDGAFQWSA-N	1	1	308.338	1.188	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000845741123	703195998	/nfs/dbraw/zinc/19/59/98/703195998.db2.gz	RXVFZFAGAJTKQP-LLVKDONJSA-N	1	1	310.354	1.597	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC[C@H]21	ZINC000879583217	706727617	/nfs/dbraw/zinc/72/76/17/706727617.db2.gz	WQDKDLMIMHYUNA-IAQYHMDHSA-N	1	1	315.377	1.997	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000846176800	703246946	/nfs/dbraw/zinc/24/69/46/703246946.db2.gz	IDZLPBZMHKIENL-ZIAGYGMSSA-N	1	1	306.366	1.027	20	5		DDBDMO
CN(CCC[N@H+](C)Cc1ccncc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000846176800	703246948	/nfs/dbraw/zinc/24/69/48/703246948.db2.gz	IDZLPBZMHKIENL-ZIAGYGMSSA-N	1	1	306.366	1.027	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccncc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000846176800	703246950	/nfs/dbraw/zinc/24/69/50/703246950.db2.gz	IDZLPBZMHKIENL-ZIAGYGMSSA-N	1	1	306.366	1.027	20	5		DDBDMO
CC(C)[C@H](C(=O)OCc1cn(C)nc1[N+](=O)[O-])[NH+]1CCCCC1	ZINC000847784446	703466213	/nfs/dbraw/zinc/46/62/13/703466213.db2.gz	SEVXRJPGRNOCEW-CYBMUJFWSA-N	1	1	324.381	1.882	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCOC(F)F)CC2)c1	ZINC000851729242	703838935	/nfs/dbraw/zinc/83/89/35/703838935.db2.gz	IWJFMICWMNWHLH-UHFFFAOYSA-N	1	1	301.293	1.956	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000869801140	703854872	/nfs/dbraw/zinc/85/48/72/703854872.db2.gz	FGDYLNBIFMJXDH-DTZQCDIJSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801140	703854875	/nfs/dbraw/zinc/85/48/75/703854875.db2.gz	FGDYLNBIFMJXDH-DTZQCDIJSA-N	1	1	317.389	1.536	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000869801140	703854878	/nfs/dbraw/zinc/85/48/78/703854878.db2.gz	FGDYLNBIFMJXDH-DTZQCDIJSA-N	1	1	317.389	1.536	20	5		DDBDMO
CCC[N@@H+]1CC[C@@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981754	704041927	/nfs/dbraw/zinc/04/19/27/704041927.db2.gz	YFTGFRGSOQYMPU-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000818981754	704041931	/nfs/dbraw/zinc/04/19/31/704041931.db2.gz	YFTGFRGSOQYMPU-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
COC(=O)N(C)CC[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000852570898	704077821	/nfs/dbraw/zinc/07/78/21/704077821.db2.gz	HEAPRGRNOUAKSU-UHFFFAOYSA-N	1	1	311.338	1.733	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000852570898	704077823	/nfs/dbraw/zinc/07/78/23/704077823.db2.gz	HEAPRGRNOUAKSU-UHFFFAOYSA-N	1	1	311.338	1.733	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1C[C@H]2CC[C@@H](C1)O2)c1cccc([N+](=O)[O-])c1	ZINC000870896147	704160897	/nfs/dbraw/zinc/16/08/97/704160897.db2.gz	QVAFANUXCFBHJU-GUTXKFCHSA-N	1	1	305.334	1.159	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])nc1Br	ZINC000853064145	704191267	/nfs/dbraw/zinc/19/12/67/704191267.db2.gz	FDTCNIAXLLGCNM-QMMMGPOBSA-N	1	1	321.175	1.255	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(NCC34CC(C3)C[NH2+]4)CC2)cc1	ZINC000853246670	704224563	/nfs/dbraw/zinc/22/45/63/704224563.db2.gz	PHZUMFAARPFDOW-UHFFFAOYSA-N	1	1	316.405	1.905	20	5		DDBDMO
COCCC[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853492088	704249061	/nfs/dbraw/zinc/24/90/61/704249061.db2.gz	FZCUFMLENCVOJI-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
COCCC[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853492088	704249065	/nfs/dbraw/zinc/24/90/65/704249065.db2.gz	FZCUFMLENCVOJI-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC(C[NH+]2CCOCC2)C1	ZINC000853640486	704291612	/nfs/dbraw/zinc/29/16/12/704291612.db2.gz	INDUEASTWLIYQE-UHFFFAOYSA-N	1	1	322.321	1.271	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000874005898	704918016	/nfs/dbraw/zinc/91/80/16/704918016.db2.gz	JSOJDXAHWYHGRM-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874833538	705191559	/nfs/dbraw/zinc/19/15/59/705191559.db2.gz	LUCXSJHPRPNANT-OLZOCXBDSA-N	1	1	318.377	1.945	20	5		DDBDMO
Nc1ccc(NC(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000823950699	705344088	/nfs/dbraw/zinc/34/40/88/705344088.db2.gz	JQGMYQKKQCDBBF-UHFFFAOYSA-N	1	1	305.338	1.560	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000861032007	705352985	/nfs/dbraw/zinc/35/29/85/705352985.db2.gz	GSPUXGCNGNBKDG-AWEZNQCLSA-N	1	1	308.334	1.862	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825505809	705683545	/nfs/dbraw/zinc/68/35/45/705683545.db2.gz	WJPDOLFFQPLBBE-DOMZBBRYSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825777197	705729604	/nfs/dbraw/zinc/72/96/04/705729604.db2.gz	RFSZPCQOXBVXDG-FZMZJTMJSA-N	1	1	307.350	1.086	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C[C@@H]12	ZINC000863338823	705906424	/nfs/dbraw/zinc/90/64/24/705906424.db2.gz	WWUKUPNAOUHMCM-ZYHUDNBSSA-N	1	1	302.290	1.007	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](Cn3ncc4ccc([N+](=O)[O-])cc43)C[C@@H]12	ZINC000863338823	705906429	/nfs/dbraw/zinc/90/64/29/705906429.db2.gz	WWUKUPNAOUHMCM-ZYHUDNBSSA-N	1	1	302.290	1.007	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@H]3CCN(C4CC4)C3)C2)c1	ZINC000876930256	705928846	/nfs/dbraw/zinc/92/88/46/705928846.db2.gz	UPOAZEQOUPRXCS-LKSINWNRSA-N	1	1	305.382	1.569	20	5		DDBDMO
CN(CC1=CCSC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000876978131	705946652	/nfs/dbraw/zinc/94/66/52/705946652.db2.gz	HDEZBHCNPCIYDD-OAHLLOKOSA-N	1	1	321.402	1.900	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827300344	705971166	/nfs/dbraw/zinc/97/11/66/705971166.db2.gz	MJACEPXRDOTZIK-ZBFHGGJFSA-N	1	1	317.389	1.998	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC(CO)(CO)C2)cc1Cl	ZINC000827475166	706010014	/nfs/dbraw/zinc/01/00/14/706010014.db2.gz	UJXZFPXEKVTBKA-UHFFFAOYSA-N	1	1	300.742	1.425	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCC(CO)(CO)C2)cc1Cl	ZINC000827475166	706010017	/nfs/dbraw/zinc/01/00/17/706010017.db2.gz	UJXZFPXEKVTBKA-UHFFFAOYSA-N	1	1	300.742	1.425	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C(C)(C)O)C2)c1	ZINC000877836272	706227398	/nfs/dbraw/zinc/22/73/98/706227398.db2.gz	SDDYOFMDYWTCHF-CYBMUJFWSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1	ZINC000881915338	707423332	/nfs/dbraw/zinc/42/33/32/707423332.db2.gz	LMGZINVJFMMSBM-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@]3(CCSC3)C2)cc1	ZINC000829261957	706310756	/nfs/dbraw/zinc/31/07/56/706310756.db2.gz	QRXDTIZWXNGNJY-HUUCEWRRSA-N	1	1	324.402	1.836	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@]3(CCSC3)C2)cc1	ZINC000829261957	706310760	/nfs/dbraw/zinc/31/07/60/706310760.db2.gz	QRXDTIZWXNGNJY-HUUCEWRRSA-N	1	1	324.402	1.836	20	5		DDBDMO
COc1cccc(N[C@H]2CC[N@@H+](CC(C)(C)O)C2)c1[N+](=O)[O-]	ZINC000865998673	706589890	/nfs/dbraw/zinc/58/98/90/706589890.db2.gz	QXXOCEWEMRHZPI-NSHDSACASA-N	1	1	309.366	1.861	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCO[C@@H](C(F)(F)F)CC2)n1	ZINC000880047596	706863227	/nfs/dbraw/zinc/86/32/27/706863227.db2.gz	VFVRUGYUDHFUTL-SECBINFHSA-N	1	1	308.260	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCO[C@@H](C(F)(F)F)CC2)n1	ZINC000880047596	706863229	/nfs/dbraw/zinc/86/32/29/706863229.db2.gz	VFVRUGYUDHFUTL-SECBINFHSA-N	1	1	308.260	1.445	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@H]1C(C)(C)C	ZINC000880614546	707042572	/nfs/dbraw/zinc/04/25/72/707042572.db2.gz	WPXILMHJLPXJFQ-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])ccc1F)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000834518709	707078955	/nfs/dbraw/zinc/07/89/55/707078955.db2.gz	SKNBSXIOGIZVAL-UHFFFAOYSA-N	1	1	319.296	1.419	20	5		DDBDMO
CC[NH+](CC)Cc1cn(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)nn1	ZINC000881399374	707235703	/nfs/dbraw/zinc/23/57/03/707235703.db2.gz	XNCCVRIBAOCALP-OAHLLOKOSA-N	1	1	319.365	1.762	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000882489928	707660749	/nfs/dbraw/zinc/66/07/49/707660749.db2.gz	HKEQPIFGYNFZRC-SNVBAGLBSA-N	1	1	307.306	1.148	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000873384796	707832243	/nfs/dbraw/zinc/83/22/43/707832243.db2.gz	QMBXOKUHDJXVGI-PHIMTYICSA-N	1	1	310.354	1.516	20	5		DDBDMO
COc1cc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221295	708259421	/nfs/dbraw/zinc/25/94/21/708259421.db2.gz	KYGCWZGFLOFPIZ-KBPBESRZSA-N	1	1	321.377	1.639	20	5		DDBDMO
COC(=O)c1ccnc(NCC[N@H+]2CCC(C)(C)C2)c1[N+](=O)[O-]	ZINC000897247832	708268177	/nfs/dbraw/zinc/26/81/77/708268177.db2.gz	GKZGSXLPJYCGTB-UHFFFAOYSA-N	1	1	322.365	1.920	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000897620866	708397134	/nfs/dbraw/zinc/39/71/34/708397134.db2.gz	ZHGHELQFKVWJEM-BLLLJJGKSA-N	1	1	321.377	1.693	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000885953832	708670360	/nfs/dbraw/zinc/67/03/60/708670360.db2.gz	GXGJSLYWTGMXSY-HNNXBMFYSA-N	1	1	320.393	1.677	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000886564354	708777630	/nfs/dbraw/zinc/77/76/30/708777630.db2.gz	UKHQTVIZYDXZNO-TXEJJXNPSA-N	1	1	307.375	1.489	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@@H+](C)C[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739940	713079656	/nfs/dbraw/zinc/07/96/56/713079656.db2.gz	KSLCERPVUGYWPH-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@H+](C)C[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739940	713079658	/nfs/dbraw/zinc/07/96/58/713079658.db2.gz	KSLCERPVUGYWPH-HMVFGEFZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000900403528	709579415	/nfs/dbraw/zinc/57/94/15/709579415.db2.gz	RFHAVMKGCNMNPB-OAHLLOKOSA-N	1	1	307.350	1.058	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])C1	ZINC000900770626	709750107	/nfs/dbraw/zinc/75/01/07/709750107.db2.gz	FFDVAFCRTAEAKF-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C	ZINC000928438659	713195961	/nfs/dbraw/zinc/19/59/61/713195961.db2.gz	GVYAKOOSOLDLNT-MFKMUULPSA-N	1	1	314.345	1.965	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000928431808	713192793	/nfs/dbraw/zinc/19/27/93/713192793.db2.gz	HAPXCSUVRZWZBK-LDYMZIIASA-N	1	1	311.313	1.565	20	5		DDBDMO
Cn1c(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)ccc1[N+](=O)[O-]	ZINC000913293495	713193585	/nfs/dbraw/zinc/19/35/85/713193585.db2.gz	PEGOJRBIOAGYNB-GASCZTMLSA-N	1	1	306.366	1.347	20	5		DDBDMO
COc1c(O)ccc(C[N@H+](C)[C@@H]2CCC(=O)N(C)C2)c1[N+](=O)[O-]	ZINC000895537971	711537078	/nfs/dbraw/zinc/53/70/78/711537078.db2.gz	XCQGAMHEUZYUSO-LLVKDONJSA-N	1	1	323.349	1.362	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+](C)[C@@H]2CCC(=O)N(C)C2)c1[N+](=O)[O-]	ZINC000895537971	711537080	/nfs/dbraw/zinc/53/70/80/711537080.db2.gz	XCQGAMHEUZYUSO-LLVKDONJSA-N	1	1	323.349	1.362	20	5		DDBDMO
Cc1nn(C)c(N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c1[N+](=O)[O-]	ZINC000895571573	711546217	/nfs/dbraw/zinc/54/62/17/711546217.db2.gz	JALQWJJEPPBSMG-QWRGUYRKSA-N	1	1	311.411	1.628	20	5		DDBDMO
Cc1nn(C)c(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c1[N+](=O)[O-]	ZINC000895571573	711546219	/nfs/dbraw/zinc/54/62/19/711546219.db2.gz	JALQWJJEPPBSMG-QWRGUYRKSA-N	1	1	311.411	1.628	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+]1C	ZINC000895735152	711590237	/nfs/dbraw/zinc/59/02/37/711590237.db2.gz	VFKUYKZQOAFIRI-YGRLFVJLSA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c1	ZINC000896558123	711751364	/nfs/dbraw/zinc/75/13/64/711751364.db2.gz	YDZHAUNCFOVBHJ-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[C@H](NC(=O)c1csc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCN1C	ZINC000896572424	711755701	/nfs/dbraw/zinc/75/57/01/711755701.db2.gz	VBLUSBVZIRDZTC-GXSJLCMTSA-N	1	1	312.395	1.020	20	5		DDBDMO
[NH3+]CC[C@@H]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000904404928	711853545	/nfs/dbraw/zinc/85/35/45/711853545.db2.gz	BJJSQXSJNKMFRV-LLVKDONJSA-N	1	1	307.350	1.537	20	5		DDBDMO
CN1CCN(CCC[NH2+]CC[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000905033717	711914353	/nfs/dbraw/zinc/91/43/53/711914353.db2.gz	HFRFKCXLWIYIIY-INIZCTEOSA-N	1	1	306.410	1.232	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](c3ccn(C)n3)C2)c(C)c1[N+](=O)[O-]	ZINC000905717937	712130581	/nfs/dbraw/zinc/13/05/81/712130581.db2.gz	LSALOJJVNNYJDG-ZDUSSCGKSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](c3ccn(C)n3)C2)c(C)c1[N+](=O)[O-]	ZINC000905717937	712130582	/nfs/dbraw/zinc/13/05/82/712130582.db2.gz	LSALOJJVNNYJDG-ZDUSSCGKSA-N	1	1	318.381	1.979	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](CCO[C@@H]2CCOC2)CC1	ZINC000929245957	713575409	/nfs/dbraw/zinc/57/54/09/713575409.db2.gz	BVCHSBRIYLUHKN-CQSZACIVSA-N	1	1	321.377	1.522	20	5		DDBDMO
Cc1nnc(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)o1	ZINC000929247633	713575801	/nfs/dbraw/zinc/57/58/01/713575801.db2.gz	VAVIUAXTHOUXIJ-UHFFFAOYSA-N	1	1	317.349	1.651	20	5		DDBDMO
O=[N+]([O-])CC[NH2+][C@@H](CCO)c1cccc(OC(F)(F)F)c1	ZINC000930816391	713927093	/nfs/dbraw/zinc/92/70/93/713927093.db2.gz	KVVIMHIKIGXUST-NSHDSACASA-N	1	1	308.256	1.875	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC000931233598	714044581	/nfs/dbraw/zinc/04/45/81/714044581.db2.gz	MKAJNHMGHJEIDF-UHFFFAOYSA-N	1	1	320.324	1.988	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(CC[N+](=O)[O-])C2)O1	ZINC000931704878	714165555	/nfs/dbraw/zinc/16/55/55/714165555.db2.gz	RZYPANHCMONAFE-WBVHZDCISA-N	1	1	319.405	1.629	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000932069677	714251598	/nfs/dbraw/zinc/25/15/98/714251598.db2.gz	FLGPCAXAEUGFFU-CFVMTHIKSA-N	1	1	303.362	1.909	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000933225082	714541214	/nfs/dbraw/zinc/54/12/14/714541214.db2.gz	LWYYLPWRMBHKTJ-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000933225082	714541215	/nfs/dbraw/zinc/54/12/15/714541215.db2.gz	LWYYLPWRMBHKTJ-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933229102	714542704	/nfs/dbraw/zinc/54/27/04/714542704.db2.gz	GNXQRYJQEYQTHY-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933229102	714542706	/nfs/dbraw/zinc/54/27/06/714542706.db2.gz	GNXQRYJQEYQTHY-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121652	714747710	/nfs/dbraw/zinc/74/77/10/714747710.db2.gz	NZZFCBHPBKAFSJ-UONOGXRCSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121652	714747711	/nfs/dbraw/zinc/74/77/11/714747711.db2.gz	NZZFCBHPBKAFSJ-UONOGXRCSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122784	714748843	/nfs/dbraw/zinc/74/88/43/714748843.db2.gz	WOIFGXQCGSYYQT-UONOGXRCSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122784	714748846	/nfs/dbraw/zinc/74/88/46/714748846.db2.gz	WOIFGXQCGSYYQT-UONOGXRCSA-N	1	1	307.350	1.951	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934275913	714784124	/nfs/dbraw/zinc/78/41/24/714784124.db2.gz	RXEXAESRAXJRFJ-KGLIPLIRSA-N	1	1	306.366	1.021	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)C[C@H]21	ZINC000611712218	719389447	/nfs/dbraw/zinc/38/94/47/719389447.db2.gz	XZWBNTJGLXWLND-ZIAGYGMSSA-N	1	1	315.333	1.057	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC001121008535	782292947	/nfs/dbraw/zinc/29/29/47/782292947.db2.gz	FMVLKIVBSXDQOJ-ZMLRMANQSA-N	1	1	320.349	1.529	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000197045246	751357310	/nfs/dbraw/zinc/35/73/10/751357310.db2.gz	ZFTLUCAFHTWABO-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCN(C)c1ncccc1[N+](=O)[O-]	ZINC001105442029	741696676	/nfs/dbraw/zinc/69/66/76/741696676.db2.gz	WUPMNPGUKMLJIY-UHFFFAOYSA-N	1	1	323.397	1.226	20	5		DDBDMO
CC1(C)CCC(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001031663089	747338249	/nfs/dbraw/zinc/33/82/49/747338249.db2.gz	SBAJIPUPPQCWEM-HUUCEWRRSA-N	1	1	323.437	1.916	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1cnco1	ZINC001031880930	748108485	/nfs/dbraw/zinc/10/84/85/748108485.db2.gz	YOIOPOGHZAFMRF-UHFFFAOYSA-N	1	1	316.317	1.445	20	5		DDBDMO
Cc1ccncc1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000996429729	749589356	/nfs/dbraw/zinc/58/93/56/749589356.db2.gz	UZTMVLLEPZBCFA-HUUCEWRRSA-N	1	1	318.377	1.136	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NC/C=C/CNc1ncccc1[N+](=O)[O-]	ZINC001107321596	749799390	/nfs/dbraw/zinc/79/93/90/749799390.db2.gz	HERIVARRWGQZNC-SNAWJCMRSA-N	1	1	321.381	1.416	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2cscn2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034645983	750627681	/nfs/dbraw/zinc/62/76/81/750627681.db2.gz	YTCOHNUJPWRPKH-FPQZTECRSA-N	1	1	324.406	1.325	20	5		DDBDMO
CCOC(=O)[C@H](CCSC)[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001168978822	762148460	/nfs/dbraw/zinc/14/84/60/762148460.db2.gz	UMZLJSCRDHAOSL-WOPDTQHZSA-N	1	1	304.412	1.706	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169022241	762201177	/nfs/dbraw/zinc/20/11/77/762201177.db2.gz	RDIJWWVYPTYAHZ-RDBSUJKOSA-N	1	1	308.382	1.407	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169022241	762201183	/nfs/dbraw/zinc/20/11/83/762201183.db2.gz	RDIJWWVYPTYAHZ-RDBSUJKOSA-N	1	1	308.382	1.407	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169024539	762202560	/nfs/dbraw/zinc/20/25/60/762202560.db2.gz	WWLWBWAIEZAOJF-AGIUHOORSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1[C@H](COC)C[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169024539	762202564	/nfs/dbraw/zinc/20/25/64/762202564.db2.gz	WWLWBWAIEZAOJF-AGIUHOORSA-N	1	1	323.397	1.289	20	5		DDBDMO
O=C(NC1(C2CC[NH+](CC3CC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000153258	761545336	/nfs/dbraw/zinc/54/53/36/761545336.db2.gz	JIIMAAVNFPHQFO-ZIAGYGMSSA-N	1	1	307.394	1.422	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CCC1CC1)CC2	ZINC001050517607	763694209	/nfs/dbraw/zinc/69/42/09/763694209.db2.gz	WLDDMBVQPFXGLJ-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCC[C@@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC001170329049	766254070	/nfs/dbraw/zinc/25/40/70/766254070.db2.gz	NPTGKPDHZGDQSQ-DGCLKSJQSA-N	1	1	321.377	1.732	20	5		DDBDMO
CC(C)(C)OC(=O)c1ccc(N[C@@H](N)CCC[NH3+])cc1[N+](=O)[O-]	ZINC001170900951	771899490	/nfs/dbraw/zinc/89/94/90/771899490.db2.gz	RSWMNKZDWKJPJZ-CYBMUJFWSA-N	1	1	324.381	1.986	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001136225124	771917794	/nfs/dbraw/zinc/91/77/94/771917794.db2.gz	TTZJPQDVKCJUFA-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094456733	775896362	/nfs/dbraw/zinc/89/63/62/775896362.db2.gz	PREDZSGGTPZOSO-UHFFFAOYSA-N	1	1	309.370	1.248	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@H](O)[C@H](CO)C1)CC2	ZINC001172905990	776917219	/nfs/dbraw/zinc/91/72/19/776917219.db2.gz	VYWFWNLHZXMGFN-LZWOXQAQSA-N	1	1	306.362	1.127	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCCO1	ZINC001173231937	777063280	/nfs/dbraw/zinc/06/32/80/777063280.db2.gz	PAVWENMSIMTQIQ-SWLSCSKDSA-N	1	1	322.361	1.790	20	5		DDBDMO
Cc1nc(N[C@H]2CCC[N@H+]3CCSC[C@H]23)ncc1[N+](=O)[O-]	ZINC001120059080	781741629	/nfs/dbraw/zinc/74/16/29/781741629.db2.gz	CZZSBHCZNFTIBZ-CMPLNLGQSA-N	1	1	309.395	1.685	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC001150030322	862037319	/nfs/dbraw/zinc/03/73/19/862037319.db2.gz	LHNSTEVKAGJJNX-ZYHUDNBSSA-N	1	1	320.349	1.252	20	5		DDBDMO
COC(=O)c1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc([N+](=O)[O-])c1	ZINC001155892647	862535979	/nfs/dbraw/zinc/53/59/79/862535979.db2.gz	KSKAISRNXXEDDA-RNCFNFMXSA-N	1	1	321.333	1.204	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@](C)(CO)C2)c1	ZINC001328606032	863104258	/nfs/dbraw/zinc/10/42/58/863104258.db2.gz	XYAGOVGKEVHDTN-MRXNPFEDSA-N	1	1	322.361	1.976	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@](C)(CO)C2)c1	ZINC001328606032	863104264	/nfs/dbraw/zinc/10/42/64/863104264.db2.gz	XYAGOVGKEVHDTN-MRXNPFEDSA-N	1	1	322.361	1.976	20	5		DDBDMO
CN1C[C@@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CCC1=O	ZINC001156566202	863153862	/nfs/dbraw/zinc/15/38/62/863153862.db2.gz	CDZYXMQCYXICKT-SYTKJHMZSA-N	1	1	319.365	1.555	20	5		DDBDMO
COc1cc(C)nc(N2C[C@@H]3CCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001157266355	863695256	/nfs/dbraw/zinc/69/52/56/863695256.db2.gz	RBEHOKKRAQEZAW-NWDGAFQWSA-N	1	1	306.366	1.837	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(N2CC[N@H+]3CC[C@@H]3C2)nn1	ZINC001158430067	864649755	/nfs/dbraw/zinc/64/97/55/864649755.db2.gz	AUENFEDYXJOSCL-GFCCVEGCSA-N	1	1	311.345	1.946	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC001331522128	865133927	/nfs/dbraw/zinc/13/39/27/865133927.db2.gz	CNBRTFJWDBMRHY-BXUZGUMPSA-N	1	1	317.349	1.656	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC001331522128	865133931	/nfs/dbraw/zinc/13/39/31/865133931.db2.gz	CNBRTFJWDBMRHY-BXUZGUMPSA-N	1	1	317.349	1.656	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ncc(OC)cc2[N+](=O)[O-])CC[NH2+]C1	ZINC001159453501	865310835	/nfs/dbraw/zinc/31/08/35/865310835.db2.gz	VMLTZDYKEGJQQK-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
COc1ncnc(N[C@@H]2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC001160468500	865864315	/nfs/dbraw/zinc/86/43/15/865864315.db2.gz	BDMMROKXOCAWIS-RTCCRHLQSA-N	1	1	307.354	1.821	20	5		DDBDMO
[NH3+]C[C@]1(Nc2ccc3[nH]cc([N+](=O)[O-])c3n2)CN2CCC1CC2	ZINC001160514841	865900425	/nfs/dbraw/zinc/90/04/25/865900425.db2.gz	YSWMEIBQVGGACO-HNNXBMFYSA-N	1	1	316.365	1.306	20	5		DDBDMO
COc1cnc(-n2cc(CC[NH3+])c3cnccc32)c([N+](=O)[O-])c1	ZINC001160946216	866203831	/nfs/dbraw/zinc/20/38/31/866203831.db2.gz	WBLQFCPJYACYNR-UHFFFAOYSA-N	1	1	313.317	1.839	20	5		DDBDMO
COc1nc(C)c(NCCC[NH+]2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC001161708670	866919960	/nfs/dbraw/zinc/91/99/60/866919960.db2.gz	PYRBUWIZCORCNW-UHFFFAOYSA-N	1	1	323.397	1.356	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2cc3nsnc3c([N+](=O)[O-])c2)o1	ZINC001324178269	867124692	/nfs/dbraw/zinc/12/46/92/867124692.db2.gz	KGEJSUUNTRLABD-UHFFFAOYSA-N	1	1	306.307	1.711	20	5		DDBDMO
Cc1nn(CN2C[C@@H]3CC[C@H]([NH+](C)C)C[C@H]3C2)cc1[N+](=O)[O-]	ZINC001334748329	867810312	/nfs/dbraw/zinc/81/03/12/867810312.db2.gz	OSEVXSJYWMIWHO-IHRRRGAJSA-N	1	1	307.398	1.719	20	5		DDBDMO
CC(C)Oc1cc(C(=O)NCC[NH+]2CC=CC2)ccc1[N+](=O)[O-]	ZINC001325260947	867897568	/nfs/dbraw/zinc/89/75/68/867897568.db2.gz	KHABZZJLPCAMAX-UHFFFAOYSA-N	1	1	319.361	1.984	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCC2(N(C)C)CC[NH+](C)CC2)n1	ZINC001164211736	869018319	/nfs/dbraw/zinc/01/83/19/869018319.db2.gz	RDRHRAFHFMXNDJ-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
[NH3+][C@H]1CN(c2cnc3cc([N+](=O)[O-])ccc3n2)CCC1(F)F	ZINC001164320135	869124326	/nfs/dbraw/zinc/12/43/26/869124326.db2.gz	YPZVJKZXLBUIBN-NSHDSACASA-N	1	1	309.276	1.711	20	5		DDBDMO
COCCC[NH+]1CCN(c2nc(C)cc(OC)c2[N+](=O)[O-])CC1	ZINC001165097635	869373812	/nfs/dbraw/zinc/37/38/12/869373812.db2.gz	MTHOEUFGAKYEIB-UHFFFAOYSA-N	1	1	324.381	1.465	20	5		DDBDMO
CN(C)/C=C\c1cc(N2CC[N@H+]3CC[C@H]3C2)ncc1[N+](=O)[O-]	ZINC001165198351	869422755	/nfs/dbraw/zinc/42/27/55/869422755.db2.gz	JMNFRUIWKJPLIC-DXTPNHAXSA-N	1	1	303.366	1.416	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC001337585069	869552418	/nfs/dbraw/zinc/55/24/18/869552418.db2.gz	FNXJGYKLQHQDIQ-GFCCVEGCSA-N	1	1	304.350	1.480	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC001337585069	869552426	/nfs/dbraw/zinc/55/24/26/869552426.db2.gz	FNXJGYKLQHQDIQ-GFCCVEGCSA-N	1	1	304.350	1.480	20	5		DDBDMO
COc1ccc(C(=O)NC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC001338295400	869909987	/nfs/dbraw/zinc/90/99/87/869909987.db2.gz	RQQJKVGVHCVURI-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)c2cc(OC)ccc2[N+](=O)[O-])C1	ZINC001306055478	871318929	/nfs/dbraw/zinc/31/89/29/871318929.db2.gz	FWCCERMIFNZKCF-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)NCC[N@H+]1CCCC1(C)C	ZINC001310521439	871639053	/nfs/dbraw/zinc/63/90/53/871639053.db2.gz	KDGMQKHTXSGJGB-UHFFFAOYSA-N	1	1	321.381	1.716	20	5		DDBDMO
C[N@@H+](CCCNC(=O)CC(C)(C)O)Cc1ccc([N+](=O)[O-])cc1	ZINC001316821123	872114405	/nfs/dbraw/zinc/11/44/05/872114405.db2.gz	LIDRLQBIBRFDEO-UHFFFAOYSA-N	1	1	323.393	1.694	20	5		DDBDMO
C[NH+]1CCN(CCCO[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001206581155	872448986	/nfs/dbraw/zinc/44/89/86/872448986.db2.gz	BGVPYZZLPJOQLZ-KRWDZBQOSA-N	1	1	319.405	1.716	20	5		DDBDMO
Cc1nc(NCC(C)(C)[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC001319130964	872454982	/nfs/dbraw/zinc/45/49/82/872454982.db2.gz	UQYQUORJVAYEHK-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1O[C@H]1CCc2[nH+]ccn2C1	ZINC001227125098	882854898	/nfs/dbraw/zinc/85/48/98/882854898.db2.gz	YNXKDEIAFKFCCM-JTQLQIEISA-N	1	1	317.301	1.972	20	5		DDBDMO
COC(=O)c1cc(CO[C@@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001223689055	881058339	/nfs/dbraw/zinc/05/83/39/881058339.db2.gz	SYAGNIRAJSMFGO-CQSZACIVSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC(=O)Nc1ccc(C(C)=O)c(O[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001234680141	888179296	/nfs/dbraw/zinc/17/92/96/888179296.db2.gz	BDXHAEVJFFJMIF-NSHDSACASA-N	1	1	321.333	1.839	20	5		DDBDMO
CC(=O)Nc1ccc(C(C)=O)c(O[C@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC001234680141	888179302	/nfs/dbraw/zinc/17/93/02/888179302.db2.gz	BDXHAEVJFFJMIF-NSHDSACASA-N	1	1	321.333	1.839	20	5		DDBDMO
CSCC[C@H]([NH3+])c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247634045	893269098	/nfs/dbraw/zinc/26/90/98/893269098.db2.gz	HRHSELWMJASMKX-ZETCQYMHSA-N	1	1	313.314	1.932	20	5		DDBDMO
C[N@@H+](CC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)[C@H]1CCSC1	ZINC001253838970	896133944	/nfs/dbraw/zinc/13/39/44/896133944.db2.gz	RIVOTMJYKWWPTQ-AWEZNQCLSA-N	1	1	321.402	1.874	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C)CCN1CCOCC1	ZINC001254550954	896499174	/nfs/dbraw/zinc/49/91/74/896499174.db2.gz	TZJBBPFQGGQJEH-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C[C@@H](O)CO)C(C)(C)C	ZINC001254551802	896499701	/nfs/dbraw/zinc/49/97/01/896499701.db2.gz	FWGSCZNGZWYPEW-TZMCWYRMSA-N	1	1	310.394	1.980	20	5		DDBDMO
Cc1nc(CC[N@H+](C)[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)no1	ZINC001254595035	896520443	/nfs/dbraw/zinc/52/04/43/896520443.db2.gz	VDDPKVIDURHZNT-AWEZNQCLSA-N	1	1	302.334	1.928	20	5		DDBDMO
C[NH+](C)CCN1CCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254600822	896523913	/nfs/dbraw/zinc/52/39/13/896523913.db2.gz	VKGFQKRLYPDEFL-KRWDZBQOSA-N	1	1	318.421	1.241	20	5		DDBDMO
CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)cc1	ZINC001265113197	901578554	/nfs/dbraw/zinc/57/85/54/901578554.db2.gz	DEDFNOCDYFNMGL-HZPDHXFCSA-N	1	1	319.405	1.988	20	5		DDBDMO
CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1	ZINC001265113197	901578564	/nfs/dbraw/zinc/57/85/64/901578564.db2.gz	DEDFNOCDYFNMGL-HZPDHXFCSA-N	1	1	319.405	1.988	20	5		DDBDMO
CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1	ZINC001265113197	901578574	/nfs/dbraw/zinc/57/85/74/901578574.db2.gz	DEDFNOCDYFNMGL-HZPDHXFCSA-N	1	1	319.405	1.988	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1CO	ZINC000248865538	282112785	/nfs/dbraw/zinc/11/27/85/282112785.db2.gz	AVQZUULGYJRHQY-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1c[nH+]c(N(C)C)n1C	ZINC000358083762	299071752	/nfs/dbraw/zinc/07/17/52/299071752.db2.gz	YTCLKFZZEGIYQS-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000272863353	210255798	/nfs/dbraw/zinc/25/57/98/210255798.db2.gz	JIMZWWGCRGLIJB-NSHDSACASA-N	1	1	322.365	1.178	20	5		DDBDMO
COC[C@H](C)OC[C@@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000278513719	214203674	/nfs/dbraw/zinc/20/36/74/214203674.db2.gz	FJLDQMLXMSZKAJ-JSGCOSHPSA-N	1	1	312.366	1.439	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2ccc(F)cc2C1	ZINC000090559615	185303362	/nfs/dbraw/zinc/30/33/62/185303362.db2.gz	SIFFLIXZZWTNGG-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2ccc(F)cc2C1	ZINC000090559615	185303363	/nfs/dbraw/zinc/30/33/63/185303363.db2.gz	SIFFLIXZZWTNGG-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000286746684	219142798	/nfs/dbraw/zinc/14/27/98/219142798.db2.gz	FKHDCRIYPOHZAQ-LLVKDONJSA-N	1	1	322.365	1.981	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(F)c1	ZINC000299354231	530063044	/nfs/dbraw/zinc/06/30/44/530063044.db2.gz	AOZNWOHJBHBWPG-JTQLQIEISA-N	1	1	311.313	1.323	20	5		DDBDMO
CC[C@@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)CC[N@H+]1C[C@@H](C)O	ZINC000266849087	186358763	/nfs/dbraw/zinc/35/87/63/186358763.db2.gz	QBOPVBYYCFYYRJ-CHWSQXEVSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[NH+]1CCN(CCCCNC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000041362694	352304842	/nfs/dbraw/zinc/30/48/42/352304842.db2.gz	CIBSNIOZVZVSBT-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000173101617	198184738	/nfs/dbraw/zinc/18/47/38/198184738.db2.gz	GUMGIIAIKXVUAB-CYBMUJFWSA-N	1	1	305.378	1.985	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000063490241	352914351	/nfs/dbraw/zinc/91/43/51/352914351.db2.gz	BPSWVYALJZRHMD-CQSZACIVSA-N	1	1	305.378	1.984	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1	ZINC000061469164	352887611	/nfs/dbraw/zinc/88/76/11/352887611.db2.gz	MPAKDXVURAUBOB-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)no1	ZINC000355699093	290974378	/nfs/dbraw/zinc/97/43/78/290974378.db2.gz	WPHLCYHAGFPEJL-UHFFFAOYSA-N	1	1	316.317	1.847	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000068935886	353137822	/nfs/dbraw/zinc/13/78/22/353137822.db2.gz	BPSWVYALJZRHMD-AWEZNQCLSA-N	1	1	305.378	1.984	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000331928305	234287816	/nfs/dbraw/zinc/28/78/16/234287816.db2.gz	DCCVQIMWZFLELA-QWHCGFSZSA-N	1	1	310.350	1.303	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000174294523	198316473	/nfs/dbraw/zinc/31/64/73/198316473.db2.gz	REURMGBCFKZUCO-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000174294523	198316475	/nfs/dbraw/zinc/31/64/75/198316475.db2.gz	REURMGBCFKZUCO-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000077995713	353501229	/nfs/dbraw/zinc/50/12/29/353501229.db2.gz	XATXZHJUWCBTSZ-LLVKDONJSA-N	1	1	324.337	1.883	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H](O)Cn1cccn1)CC2	ZINC000088606093	353757305	/nfs/dbraw/zinc/75/73/05/353757305.db2.gz	BMIKLALAVOVTCW-OAHLLOKOSA-N	1	1	302.334	1.211	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H](O)Cn1cccn1)CC2	ZINC000088606093	353757310	/nfs/dbraw/zinc/75/73/10/353757310.db2.gz	BMIKLALAVOVTCW-OAHLLOKOSA-N	1	1	302.334	1.211	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[NH+](C2CC2)CC1	ZINC000126019128	354049797	/nfs/dbraw/zinc/04/97/97/354049797.db2.gz	SXJJQEUNENPDCR-UHFFFAOYSA-N	1	1	318.377	1.622	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000139421255	354127951	/nfs/dbraw/zinc/12/79/51/354127951.db2.gz	HNJWQCGMBKLLCG-LBPRGKRZSA-N	1	1	321.381	1.400	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OC[C@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000153631455	354199485	/nfs/dbraw/zinc/19/94/85/354199485.db2.gz	RWDOWLRFFWZHFZ-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OC[C@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000153631455	354199490	/nfs/dbraw/zinc/19/94/90/354199490.db2.gz	RWDOWLRFFWZHFZ-HZSPNIEDSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@H](O)C1CC1	ZINC000156601420	354220487	/nfs/dbraw/zinc/22/04/87/354220487.db2.gz	OTYBGEWCEKZXEG-ZDUSSCGKSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H](O)C1CC1	ZINC000156601420	354220491	/nfs/dbraw/zinc/22/04/91/354220491.db2.gz	OTYBGEWCEKZXEG-ZDUSSCGKSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H]1CSCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246932419	354362728	/nfs/dbraw/zinc/36/27/28/354362728.db2.gz	DRLUAKVRTAVZJX-DGCLKSJQSA-N	1	1	312.391	1.772	20	5		DDBDMO
Nc1cc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc(CO)c1[N+](=O)[O-]	ZINC000587309778	354881781	/nfs/dbraw/zinc/88/17/81/354881781.db2.gz	QUGNMBCJONQTNA-DGCLKSJQSA-N	1	1	306.366	1.708	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](CO)[C@@H](O)C2)cc1	ZINC000588966443	354952968	/nfs/dbraw/zinc/95/29/68/354952968.db2.gz	ZIMUGFGVIKAJEX-WFASDCNBSA-N	1	1	310.350	1.039	20	5		DDBDMO
O=[N+]([O-])c1cc(N2CC[NH+](CCO)CC2)ccc1C(F)(F)F	ZINC000589102648	354959563	/nfs/dbraw/zinc/95/95/63/354959563.db2.gz	CHJRFXBODIBKOQ-UHFFFAOYSA-N	1	1	319.283	1.728	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](CO)C2)c1	ZINC000589494676	354996276	/nfs/dbraw/zinc/99/62/76/354996276.db2.gz	XRYAFVJQUSHKMJ-LLVKDONJSA-N	1	1	308.334	1.586	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](CO)C2)c1	ZINC000589494676	354996278	/nfs/dbraw/zinc/99/62/78/354996278.db2.gz	XRYAFVJQUSHKMJ-LLVKDONJSA-N	1	1	308.334	1.586	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000589515034	354998536	/nfs/dbraw/zinc/99/85/36/354998536.db2.gz	OJGBUPHCMWPEEY-HNNXBMFYSA-N	1	1	308.334	1.728	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000590447652	355099807	/nfs/dbraw/zinc/09/98/07/355099807.db2.gz	ZRENJKZSRAHWEG-GWCFXTLKSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1	ZINC000591083760	355245551	/nfs/dbraw/zinc/24/55/51/355245551.db2.gz	DPLHDZOLGYCNDL-HNKHHVNMSA-N	1	1	315.373	1.861	20	5		DDBDMO
C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc(N)cc1[N+](=O)[O-]	ZINC000286281623	291067701	/nfs/dbraw/zinc/06/77/01/291067701.db2.gz	IBWNSJVEFAXPOF-WCQYABFASA-N	1	1	306.366	1.476	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593175625	355817215	/nfs/dbraw/zinc/81/72/15/355817215.db2.gz	WRBJKOAKQIAFHU-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000593187721	355819834	/nfs/dbraw/zinc/81/98/34/355819834.db2.gz	OIVRHKYZESLSSV-YNEHKIRRSA-N	1	1	321.377	1.913	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000593186971	355820035	/nfs/dbraw/zinc/82/00/35/355820035.db2.gz	BMIJCOFGDXPBLU-YNEHKIRRSA-N	1	1	321.377	1.913	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](C)[C@H](C)[C@@H]2C)n1	ZINC000593188910	355820801	/nfs/dbraw/zinc/82/08/01/355820801.db2.gz	FGIUHUPMZOOEGL-MXWKQRLJSA-N	1	1	309.370	1.364	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]2C)n1	ZINC000593188910	355820803	/nfs/dbraw/zinc/82/08/03/355820803.db2.gz	FGIUHUPMZOOEGL-MXWKQRLJSA-N	1	1	309.370	1.364	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@H]1Cc1ccccc1	ZINC000593503348	355905753	/nfs/dbraw/zinc/90/57/53/355905753.db2.gz	IJLVTUFJJALWPH-CQSZACIVSA-N	1	1	315.377	1.691	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2c(C)cccc2[N+](=O)[O-])CC1	ZINC000593518530	355911734	/nfs/dbraw/zinc/91/17/34/355911734.db2.gz	RAHCWLUJVZYYGZ-UHFFFAOYSA-N	1	1	323.393	1.688	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000594063589	356103902	/nfs/dbraw/zinc/10/39/02/356103902.db2.gz	IWUUKZBUTQZDGQ-LLVKDONJSA-N	1	1	307.350	1.769	20	5		DDBDMO
CCC[C@@H]1CN(c2ccncc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000346663073	283142018	/nfs/dbraw/zinc/14/20/18/283142018.db2.gz	WHJPUWXPYCZPJB-CYBMUJFWSA-N	1	1	308.382	1.927	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCC(=O)N(C)C1=O	ZINC000595043000	356376085	/nfs/dbraw/zinc/37/60/85/356376085.db2.gz	DKPLGODMRPSMAR-SKDRFNHKSA-N	1	1	321.333	1.401	20	5		DDBDMO
Cc1noc(CN2CC[N@H+](CC(C)(C)O)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000595470671	356506687	/nfs/dbraw/zinc/50/66/87/356506687.db2.gz	OOLHOPPVYITOGS-JTQLQIEISA-N	1	1	312.370	1.168	20	5		DDBDMO
Cc1noc(C[NH+]2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1[N+](=O)[O-]	ZINC000595505943	356522890	/nfs/dbraw/zinc/52/28/90/356522890.db2.gz	XXGIVYIQBBLKLS-ZDUSSCGKSA-N	1	1	322.365	1.628	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@@H](N3CCOCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000595493929	356516716	/nfs/dbraw/zinc/51/67/16/356516716.db2.gz	XEORYTOFGUISES-JQWIXIFHSA-N	1	1	310.354	1.186	20	5		DDBDMO
Cc1noc(C[N@@H+]2C[C@@H](N3CCOCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000595493929	356516717	/nfs/dbraw/zinc/51/67/17/356516717.db2.gz	XEORYTOFGUISES-JQWIXIFHSA-N	1	1	310.354	1.186	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000595745621	356633672	/nfs/dbraw/zinc/63/36/72/356633672.db2.gz	YSSWJUZDQKGQDK-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595727834	356624594	/nfs/dbraw/zinc/62/45/94/356624594.db2.gz	DLFQCCWPAUKJJN-GWCFXTLKSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595727834	356624597	/nfs/dbraw/zinc/62/45/97/356624597.db2.gz	DLFQCCWPAUKJJN-GWCFXTLKSA-N	1	1	307.325	1.834	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000595766961	356644299	/nfs/dbraw/zinc/64/42/99/356644299.db2.gz	SRMXFKSCLOKGED-SMDDNHRTSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000595765843	356644313	/nfs/dbraw/zinc/64/43/13/356644313.db2.gz	KGJMEMQSUYSDII-GXFFZTMASA-N	1	1	318.333	1.990	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1	ZINC000595826787	356665896	/nfs/dbraw/zinc/66/58/96/356665896.db2.gz	IOEKLKUNKQGBAJ-TZMCWYRMSA-N	1	1	320.345	1.850	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000596081870	356765645	/nfs/dbraw/zinc/76/56/45/356765645.db2.gz	AXYKFFQPWVOZEN-NWDGAFQWSA-N	1	1	304.350	1.732	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)nc1	ZINC000596268341	356839009	/nfs/dbraw/zinc/83/90/09/356839009.db2.gz	JSQPODOBOZFYGM-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
Cc1[nH+]cc(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1C	ZINC000597117702	357065937	/nfs/dbraw/zinc/06/59/37/357065937.db2.gz	QJNXJEXMDJMEAB-UHFFFAOYSA-N	1	1	300.322	1.803	20	5		DDBDMO
CCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@H]1CC[N@@H+](C)C1	ZINC000597945059	357393961	/nfs/dbraw/zinc/39/39/61/357393961.db2.gz	HHVSOADOLBTNJP-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](CC)C1	ZINC000598038276	357436940	/nfs/dbraw/zinc/43/69/40/357436940.db2.gz	BTUCKGFALKGHHX-LLVKDONJSA-N	1	1	308.338	1.252	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598651089	357671694	/nfs/dbraw/zinc/67/16/94/357671694.db2.gz	QQOSGWPRLOODMD-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598651089	357671699	/nfs/dbraw/zinc/67/16/99/357671699.db2.gz	QQOSGWPRLOODMD-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@@H+]2CC[C@@H](O)C2)ccc2ncccc21	ZINC000599176747	357840568	/nfs/dbraw/zinc/84/05/68/357840568.db2.gz	WGSDGHSEHAUOEJ-LLVKDONJSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@H]1CC(F)(F)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000599623356	357996569	/nfs/dbraw/zinc/99/65/69/357996569.db2.gz	OXUUFODZMDMABX-GXSJLCMTSA-N	1	1	304.297	1.272	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000600470051	358233160	/nfs/dbraw/zinc/23/31/60/358233160.db2.gz	DYRXFMAJAUKHBL-LLVKDONJSA-N	1	1	307.354	1.075	20	5		DDBDMO
CN(C)C(=O)CCCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601105794	358404747	/nfs/dbraw/zinc/40/47/47/358404747.db2.gz	ISRFAHGCTRLWSF-UHFFFAOYSA-N	1	1	302.334	1.845	20	5		DDBDMO
COc1cncc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1	ZINC000601148936	358422122	/nfs/dbraw/zinc/42/21/22/358422122.db2.gz	HRKSBEZMBDESIH-INIZCTEOSA-N	1	1	317.345	1.996	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](CO)[C@@H]3CCOC3)c2c1	ZINC000601159136	358426362	/nfs/dbraw/zinc/42/63/62/358426362.db2.gz	HRMJCTSXDCRKGS-VXGBXAGGSA-N	1	1	317.345	1.622	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@H](N3CCCC3=O)CC2)c([N+](=O)[O-])n1	ZINC000602693558	359129428	/nfs/dbraw/zinc/12/94/28/359129428.db2.gz	NSTRNYKTRWDNCQ-ZDUSSCGKSA-N	1	1	321.381	1.305	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](N3CCCC3=O)CC2)c([N+](=O)[O-])n1	ZINC000602693558	359129430	/nfs/dbraw/zinc/12/94/30/359129430.db2.gz	NSTRNYKTRWDNCQ-ZDUSSCGKSA-N	1	1	321.381	1.305	20	5		DDBDMO
CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602723116	359149861	/nfs/dbraw/zinc/14/98/61/359149861.db2.gz	QLCOYAFATOOQGC-LLVKDONJSA-N	1	1	309.370	1.065	20	5		DDBDMO
CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602723116	359149865	/nfs/dbraw/zinc/14/98/65/359149865.db2.gz	QLCOYAFATOOQGC-LLVKDONJSA-N	1	1	309.370	1.065	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@](C)(CO)C1	ZINC000602965034	359329298	/nfs/dbraw/zinc/32/92/98/359329298.db2.gz	YDDXYAJCFPXIQG-GJZGRUSLSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC1(CO)CC1	ZINC000186775418	200008191	/nfs/dbraw/zinc/00/81/91/200008191.db2.gz	OTSOAQMIAQCCHZ-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@@H](O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000186922108	200031450	/nfs/dbraw/zinc/03/14/50/200031450.db2.gz	ROXWVCJZHQSACB-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](CCO)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000187651899	200140079	/nfs/dbraw/zinc/14/00/79/200140079.db2.gz	GXYGCWKPMUPKFI-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCO[C@H]3CCC[C@H]32)c1	ZINC000281065388	216056045	/nfs/dbraw/zinc/05/60/45/216056045.db2.gz	KKHRHEBXUSDUAU-IMJJTQAJSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCO[C@H]3CCC[C@H]32)c1	ZINC000281065388	216056050	/nfs/dbraw/zinc/05/60/50/216056050.db2.gz	KKHRHEBXUSDUAU-IMJJTQAJSA-N	1	1	322.361	1.588	20	5		DDBDMO
CC(C)N1CC[NH+](CCCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000188203448	200209287	/nfs/dbraw/zinc/20/92/87/200209287.db2.gz	JYXYKBHYMPNFSH-UHFFFAOYSA-N	1	1	308.382	1.173	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000565782964	304092016	/nfs/dbraw/zinc/09/20/16/304092016.db2.gz	JXBOLCRDAPMTQS-CQSZACIVSA-N	1	1	309.366	1.102	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1cccc([N+](=O)[O-])c1	ZINC000189412198	200396488	/nfs/dbraw/zinc/39/64/88/200396488.db2.gz	OQYCCHPAVWFUGG-CYBMUJFWSA-N	1	1	307.394	1.872	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000609309489	360291661	/nfs/dbraw/zinc/29/16/61/360291661.db2.gz	GUSFSWNVQSKPKP-LLVKDONJSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000609594380	360331344	/nfs/dbraw/zinc/33/13/44/360331344.db2.gz	IWPJLKXTMGJXSH-LBPRGKRZSA-N	1	1	308.382	1.928	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)C1CC1	ZINC000610572835	360473212	/nfs/dbraw/zinc/47/32/12/360473212.db2.gz	HJLZKUHEMUYYCI-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](O)C1CC1	ZINC000610572835	360473217	/nfs/dbraw/zinc/47/32/17/360473217.db2.gz	HJLZKUHEMUYYCI-ZDUSSCGKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H](O)C1CC1	ZINC000610572868	360473855	/nfs/dbraw/zinc/47/38/55/360473855.db2.gz	PCWYNLYEAVHLFY-UKRRQHHQSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000611165982	360643149	/nfs/dbraw/zinc/64/31/49/360643149.db2.gz	RYSAKGAVOBGXAF-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CCOC(=O)C[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000611237516	360674486	/nfs/dbraw/zinc/67/44/86/360674486.db2.gz	NACYIRJNBLEFRN-OAHLLOKOSA-N	1	1	322.361	1.873	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000611616472	360776873	/nfs/dbraw/zinc/77/68/73/360776873.db2.gz	RYTCJDAYXGYBGN-CYBMUJFWSA-N	1	1	308.382	1.500	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)C[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000272164032	296093825	/nfs/dbraw/zinc/09/38/25/296093825.db2.gz	ZSCCFCXYDDADKB-QWHCGFSZSA-N	1	1	321.377	1.740	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1	ZINC000264653337	204055160	/nfs/dbraw/zinc/05/51/60/204055160.db2.gz	HEXIWQKRJFSOPJ-SNVBAGLBSA-N	1	1	302.334	1.758	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000264662028	204060112	/nfs/dbraw/zinc/06/01/12/204060112.db2.gz	IUSDWRGZJSJFBV-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000264914893	204265425	/nfs/dbraw/zinc/26/54/25/204265425.db2.gz	OCXKYETXTHMVET-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
Cc1cccc(C(=O)NCc2c[nH+]c(N(C)C)n2C)c1[N+](=O)[O-]	ZINC000265071359	204378451	/nfs/dbraw/zinc/37/84/51/204378451.db2.gz	UDIBIBFURBZOEG-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
Cc1ccccc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266436981	205344576	/nfs/dbraw/zinc/34/45/76/205344576.db2.gz	LVXSNFQHHQQYSF-HNNXBMFYSA-N	1	1	304.350	1.593	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1C(N)=O	ZINC000284471395	218040905	/nfs/dbraw/zinc/04/09/05/218040905.db2.gz	AGPPAKKUFUSUCH-NOZJJQNGSA-N	1	1	321.333	1.015	20	5		DDBDMO
Cc1ccc([C@@H](C)NC[C@@H]2C[N@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847715	207016663	/nfs/dbraw/zinc/01/66/63/207016663.db2.gz	BQBWEFGGCYOTGC-UKRRQHHQSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1ccc([C@@H](C)NC[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000268847715	207016666	/nfs/dbraw/zinc/01/66/66/207016666.db2.gz	BQBWEFGGCYOTGC-UKRRQHHQSA-N	1	1	306.410	1.800	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000352426391	285042209	/nfs/dbraw/zinc/04/22/09/285042209.db2.gz	UCGREUOOKJKWSW-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](CCO)CC2CC2)cccc1[N+](=O)[O-]	ZINC000352468813	285073225	/nfs/dbraw/zinc/07/32/25/285073225.db2.gz	VBJDIYPMSQTOLY-GFCCVEGCSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC(C)(CO)CO	ZINC000270316096	208388487	/nfs/dbraw/zinc/38/84/87/208388487.db2.gz	HEEYIUOXKKKNMV-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])CC(C)(CO)CO	ZINC000270316096	208388493	/nfs/dbraw/zinc/38/84/93/208388493.db2.gz	HEEYIUOXKKKNMV-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
CCOC(=O)N[C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157688656	197207548	/nfs/dbraw/zinc/20/75/48/197207548.db2.gz	UWWIKBYGZFZYJZ-LLVKDONJSA-N	1	1	311.342	1.002	20	5		DDBDMO
CCOC(=O)N[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157688656	197207550	/nfs/dbraw/zinc/20/75/50/197207550.db2.gz	UWWIKBYGZFZYJZ-LLVKDONJSA-N	1	1	311.342	1.002	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271439526	208913234	/nfs/dbraw/zinc/91/32/34/208913234.db2.gz	TVFXGQSSCABBTO-LLVKDONJSA-N	1	1	309.370	1.036	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](c2nc(=O)[nH][nH]2)C1	ZINC000289482048	221006612	/nfs/dbraw/zinc/00/66/12/221006612.db2.gz	RVDLJZZBSPQZCO-CMPLNLGQSA-N	1	1	317.349	1.947	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000294997048	224367090	/nfs/dbraw/zinc/36/70/90/224367090.db2.gz	ICPANZFRHYLRRN-MRXNPFEDSA-N	1	1	322.361	1.915	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CCCCO)c1cccc([N+](=O)[O-])c1	ZINC000353607518	285826013	/nfs/dbraw/zinc/82/60/13/285826013.db2.gz	PPEHELPNSYVQRP-CQSZACIVSA-N	1	1	304.350	1.780	20	5		DDBDMO
CCOC(=O)[C@@H]1NCC[C@H]1[NH2+][C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000423017455	285889496	/nfs/dbraw/zinc/88/94/96/285889496.db2.gz	ORDBLJNXCCSDEL-MPKXVKKWSA-N	1	1	307.350	1.539	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@H](C)[NH2+]1	ZINC000070076800	406808925	/nfs/dbraw/zinc/80/89/25/406808925.db2.gz	NAGMLVVUHBZQQK-QWRGUYRKSA-N	1	1	313.379	1.107	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000074440359	406913165	/nfs/dbraw/zinc/91/31/65/406913165.db2.gz	LRHCAIQHUTYYOF-UHFFFAOYSA-N	1	1	317.349	1.639	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[NH+](CC2CC2)CC1	ZINC000055673982	407206016	/nfs/dbraw/zinc/20/60/16/407206016.db2.gz	OYRZPIPSAHHUDJ-UHFFFAOYSA-N	1	1	307.325	1.902	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123564535	407332890	/nfs/dbraw/zinc/33/28/90/407332890.db2.gz	GJSITHFXAWWXOF-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000122563596	407304734	/nfs/dbraw/zinc/30/47/34/407304734.db2.gz	UWRYLVYRPKVYLO-LLVKDONJSA-N	1	1	307.354	1.312	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](CC2CCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000122563596	407304736	/nfs/dbraw/zinc/30/47/36/407304736.db2.gz	UWRYLVYRPKVYLO-LLVKDONJSA-N	1	1	307.354	1.312	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000122563596	407304737	/nfs/dbraw/zinc/30/47/37/407304737.db2.gz	UWRYLVYRPKVYLO-LLVKDONJSA-N	1	1	307.354	1.312	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123565218	407333134	/nfs/dbraw/zinc/33/31/34/407333134.db2.gz	GJSITHFXAWWXOF-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@@H+](C)C2)c1	ZINC000104188956	407349331	/nfs/dbraw/zinc/34/93/31/407349331.db2.gz	KLEWDCXARQCRPB-SNVBAGLBSA-N	1	1	309.391	1.998	20	5		DDBDMO
O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000124796577	407369882	/nfs/dbraw/zinc/36/98/82/407369882.db2.gz	AZTNNETWMPHYKM-UHFFFAOYSA-N	1	1	318.377	1.703	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000108325958	407383671	/nfs/dbraw/zinc/38/36/71/407383671.db2.gz	FVPLEYCRZYPLLT-SECBINFHSA-N	1	1	310.329	1.388	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000108325961	407384040	/nfs/dbraw/zinc/38/40/40/407384040.db2.gz	FVPLEYCRZYPLLT-VIFPVBQESA-N	1	1	310.329	1.388	20	5		DDBDMO
COC[C@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806944	407465162	/nfs/dbraw/zinc/46/51/62/407465162.db2.gz	OZBGLTRGPAWGJB-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265806944	407465168	/nfs/dbraw/zinc/46/51/68/407465168.db2.gz	OZBGLTRGPAWGJB-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)C(C)(C)c1ccc([N+](=O)[O-])cc1	ZINC000265816670	407467413	/nfs/dbraw/zinc/46/74/13/407467413.db2.gz	QIFYWFMNZHTLNK-UHFFFAOYSA-N	1	1	323.393	1.567	20	5		DDBDMO
C[C@H]([C@H](C)S(C)(=O)=O)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000113257614	407480384	/nfs/dbraw/zinc/48/03/84/407480384.db2.gz	KXEYFDPZQHLKTI-NEPJUHHUSA-N	1	1	314.407	1.891	20	5		DDBDMO
C[C@H]([C@H](C)S(C)(=O)=O)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000113257614	407480391	/nfs/dbraw/zinc/48/03/91/407480391.db2.gz	KXEYFDPZQHLKTI-NEPJUHHUSA-N	1	1	314.407	1.891	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000271055373	407491544	/nfs/dbraw/zinc/49/15/44/407491544.db2.gz	ZLWTWEGREADZOL-CQSZACIVSA-N	1	1	302.334	1.562	20	5		DDBDMO
COc1ccc(OCC[N@H+](C)[C@H]2CCN(C)C2=O)c([N+](=O)[O-])c1	ZINC000266541160	407550503	/nfs/dbraw/zinc/55/05/03/407550503.db2.gz	PTWNSMBUSNPSPT-LBPRGKRZSA-N	1	1	323.349	1.145	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)[C@H]2CCN(C)C2=O)c([N+](=O)[O-])c1	ZINC000266541160	407550515	/nfs/dbraw/zinc/55/05/15/407550515.db2.gz	PTWNSMBUSNPSPT-LBPRGKRZSA-N	1	1	323.349	1.145	20	5		DDBDMO
CC[N@@H+](CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000171167462	407615076	/nfs/dbraw/zinc/61/50/76/407615076.db2.gz	YKJHJCGBTCGFEH-UHFFFAOYSA-N	1	1	320.393	1.921	20	5		DDBDMO
CN1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)Cc2ccccc21	ZINC000267112885	407752650	/nfs/dbraw/zinc/75/26/50/407752650.db2.gz	YBVRQDMJUZEVBZ-UHFFFAOYSA-N	1	1	301.350	1.743	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000267342975	407841754	/nfs/dbraw/zinc/84/17/54/407841754.db2.gz	LTGGPELXAVCKEP-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000267342975	407841763	/nfs/dbraw/zinc/84/17/63/407841763.db2.gz	LTGGPELXAVCKEP-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)CC1	ZINC000267322280	407834360	/nfs/dbraw/zinc/83/43/60/407834360.db2.gz	OVRGZRNBCXCBHA-UHFFFAOYSA-N	1	1	306.366	1.653	20	5		DDBDMO
CC1(C)[C@@H]2C[N@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000172957137	407854748	/nfs/dbraw/zinc/85/47/48/407854748.db2.gz	LZVXWYKLBXHBOK-AEGPPILISA-N	1	1	306.362	1.922	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@]2(CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000153648043	407869474	/nfs/dbraw/zinc/86/94/74/407869474.db2.gz	XOTSCVSROKCCNE-HNNXBMFYSA-N	1	1	305.334	1.646	20	5		DDBDMO
O=C(C[N@H+]1CC[C@]2(CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000153648043	407869482	/nfs/dbraw/zinc/86/94/82/407869482.db2.gz	XOTSCVSROKCCNE-HNNXBMFYSA-N	1	1	305.334	1.646	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796733	407871720	/nfs/dbraw/zinc/87/17/20/407871720.db2.gz	ZJVYPMFOOOKJHT-SWLSCSKDSA-N	1	1	321.377	1.281	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000133796733	407871727	/nfs/dbraw/zinc/87/17/27/407871727.db2.gz	ZJVYPMFOOOKJHT-SWLSCSKDSA-N	1	1	321.377	1.281	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000189721522	408090562	/nfs/dbraw/zinc/09/05/62/408090562.db2.gz	IKEGWUIPIRWDDO-GJZGRUSLSA-N	1	1	310.350	1.366	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000190171681	408182079	/nfs/dbraw/zinc/18/20/79/408182079.db2.gz	OQJVSMPWHHRTAA-JTQLQIEISA-N	1	1	310.354	1.919	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000155872114	408221920	/nfs/dbraw/zinc/22/19/20/408221920.db2.gz	OPVQBRCNMSGQIX-GFCCVEGCSA-N	1	1	313.379	1.027	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000155872114	408221925	/nfs/dbraw/zinc/22/19/25/408221925.db2.gz	OPVQBRCNMSGQIX-GFCCVEGCSA-N	1	1	313.379	1.027	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000155908817	408225005	/nfs/dbraw/zinc/22/50/05/408225005.db2.gz	PZTNOUYAVINSQK-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@H]1C	ZINC000246634274	408306976	/nfs/dbraw/zinc/30/69/76/408306976.db2.gz	FAUWCGNHJAQGEY-ZJUUUORDSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@H]1C	ZINC000246634274	408306979	/nfs/dbraw/zinc/30/69/79/408306979.db2.gz	FAUWCGNHJAQGEY-ZJUUUORDSA-N	1	1	313.379	1.183	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)CC1	ZINC000133428712	162059156	/nfs/dbraw/zinc/05/91/56/162059156.db2.gz	LVINKHSVASJBKT-UHFFFAOYSA-N	1	1	309.370	1.044	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@H](C)O	ZINC000246824879	408348757	/nfs/dbraw/zinc/34/87/57/408348757.db2.gz	LNEYDDZGKZERDH-JSGCOSHPSA-N	1	1	321.377	1.512	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000171100297	162206393	/nfs/dbraw/zinc/20/63/93/162206393.db2.gz	YDSBMTBOJSVGAL-CYBMUJFWSA-N	1	1	323.397	1.399	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000269745459	408412778	/nfs/dbraw/zinc/41/27/78/408412778.db2.gz	XREKLIDGSAFKDW-CQSZACIVSA-N	1	1	321.377	1.283	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+](CCO)Cc1ccccc1	ZINC000269888729	408460266	/nfs/dbraw/zinc/46/02/66/408460266.db2.gz	KXGAPFRZJGIUHT-UHFFFAOYSA-N	1	1	317.345	1.251	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000264432109	408486896	/nfs/dbraw/zinc/48/68/96/408486896.db2.gz	AUCYFVYQMMMMJI-GFCCVEGCSA-N	1	1	323.349	1.054	20	5		DDBDMO
NC(=O)CC1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000177012039	408497450	/nfs/dbraw/zinc/49/74/50/408497450.db2.gz	NAWZAIUWXDESQA-UHFFFAOYSA-N	1	1	318.333	1.823	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000161297781	408583528	/nfs/dbraw/zinc/58/35/28/408583528.db2.gz	DGQAWKPSBNGHOA-PWSUYJOCSA-N	1	1	306.366	1.636	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275333428	408585833	/nfs/dbraw/zinc/58/58/33/408585833.db2.gz	GKGNAUPGRWGQCN-QWRGUYRKSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275333428	408585835	/nfs/dbraw/zinc/58/58/35/408585835.db2.gz	GKGNAUPGRWGQCN-QWRGUYRKSA-N	1	1	324.337	1.394	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1	ZINC000177159479	408539777	/nfs/dbraw/zinc/53/97/77/408539777.db2.gz	QULFGRXFEHRGLQ-WDEREUQCSA-N	1	1	319.361	1.958	20	5		DDBDMO
CCN1CC[NH+](CCCNc2nccc(C)c2[N+](=O)[O-])CC1	ZINC000265283833	408604529	/nfs/dbraw/zinc/60/45/29/408604529.db2.gz	WSTWOEONDNBANH-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(C)(C)O)CCN1c1ncc([N+](=O)[O-])s1	ZINC000192542317	408608864	/nfs/dbraw/zinc/60/88/64/408608864.db2.gz	MIBLFJFPYHFMHP-SECBINFHSA-N	1	1	300.384	1.333	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ncc([N+](=O)[O-])s1	ZINC000192542317	408608869	/nfs/dbraw/zinc/60/88/69/408608869.db2.gz	MIBLFJFPYHFMHP-SECBINFHSA-N	1	1	300.384	1.333	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)C2CCOCC2)cc1[N+](=O)[O-]	ZINC000275647755	408631797	/nfs/dbraw/zinc/63/17/97/408631797.db2.gz	WVRVQEXDOOIDND-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000270825157	408696695	/nfs/dbraw/zinc/69/66/95/408696695.db2.gz	BVTCILMYXHEHCC-OAHLLOKOSA-N	1	1	303.362	1.834	20	5		DDBDMO
CCOCC[NH+]1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1	ZINC000185365519	408801092	/nfs/dbraw/zinc/80/10/92/408801092.db2.gz	PRPZEPNYAVLJGB-UHFFFAOYSA-N	1	1	309.366	1.762	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([NH+]3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000265725753	408760422	/nfs/dbraw/zinc/76/04/22/408760422.db2.gz	OIZWWRDMJIEMKQ-GFCCVEGCSA-N	1	1	321.381	1.717	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2CO1	ZINC000281333024	408883242	/nfs/dbraw/zinc/88/32/42/408883242.db2.gz	LYUMSEBVXYXCPI-RISCZKNCSA-N	1	1	321.333	1.404	20	5		DDBDMO
CC[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000276191317	408824727	/nfs/dbraw/zinc/82/47/27/408824727.db2.gz	HJYCNHVCOUUJST-UHFFFAOYSA-N	1	1	301.368	1.362	20	5		DDBDMO
COC(=O)[C@@H](C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000280837655	408844392	/nfs/dbraw/zinc/84/43/92/408844392.db2.gz	WTBZORUKNOETJW-LLVKDONJSA-N	1	1	323.349	1.725	20	5		DDBDMO
COC(=O)[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000280837655	408844394	/nfs/dbraw/zinc/84/43/94/408844394.db2.gz	WTBZORUKNOETJW-LLVKDONJSA-N	1	1	323.349	1.725	20	5		DDBDMO
C[C@H](CO)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCC1	ZINC000276510783	408872492	/nfs/dbraw/zinc/87/24/92/408872492.db2.gz	ZSLIFKNCXXDXHJ-GFCCVEGCSA-N	1	1	309.366	1.382	20	5		DDBDMO
C[C@@H](CO)[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCC1	ZINC000276510784	408872662	/nfs/dbraw/zinc/87/26/62/408872662.db2.gz	ZSLIFKNCXXDXHJ-LBPRGKRZSA-N	1	1	309.366	1.382	20	5		DDBDMO
CC(C)[N@H+](C)C[C@@H](C)NC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000291746262	408916309	/nfs/dbraw/zinc/91/63/09/408916309.db2.gz	BSHSTNHKQXQRGY-SNVBAGLBSA-N	1	1	323.349	1.782	20	5		DDBDMO
O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCC[N@H+](C2CC2)CC1	ZINC000193493570	163256555	/nfs/dbraw/zinc/25/65/55/163256555.db2.gz	IHSPFLCHVQWORW-UHFFFAOYSA-N	1	1	306.322	1.006	20	5		DDBDMO
CN(C(=O)CN1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000193652057	163263292	/nfs/dbraw/zinc/26/32/92/163263292.db2.gz	KQHUKHZHDMYFHZ-BETUJISGSA-N	1	1	318.377	1.051	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3ccc([N+](=O)[O-])c4nonc43)C2)C1	ZINC000292329185	409025294	/nfs/dbraw/zinc/02/52/94/409025294.db2.gz	PHPBHUSLAXTPQP-AWEZNQCLSA-N	1	1	303.322	1.663	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(c3ccc([N+](=O)[O-])c(C)n3)[C@H]2C1	ZINC000292732721	409041050	/nfs/dbraw/zinc/04/10/50/409041050.db2.gz	IGEMSEVBOSCPPY-UONOGXRCSA-N	1	1	306.366	1.598	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1[C@@H](CO)CC[C@@H]1CO	ZINC000287574173	409057157	/nfs/dbraw/zinc/05/71/57/409057157.db2.gz	XNBMFQLNELDJFL-VXGBXAGGSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CN1	ZINC000278870962	409105469	/nfs/dbraw/zinc/10/54/69/409105469.db2.gz	MARCWFFQVKHPFR-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)CN1	ZINC000278870962	409105470	/nfs/dbraw/zinc/10/54/70/409105470.db2.gz	MARCWFFQVKHPFR-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@H](O)Cc1ccccc1	ZINC000293418626	409109899	/nfs/dbraw/zinc/10/98/99/409109899.db2.gz	SQDZBQGGJYZYMU-OAHLLOKOSA-N	1	1	304.350	1.327	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000283525016	409171349	/nfs/dbraw/zinc/17/13/49/409171349.db2.gz	KOBHIHAYSDKQCX-UHFFFAOYSA-N	1	1	322.365	1.615	20	5		DDBDMO
O=C1NCCN1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000283524666	409171398	/nfs/dbraw/zinc/17/13/98/409171398.db2.gz	LRSKRLJTHBYJOG-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](C2CC2)O1	ZINC000279453514	409217512	/nfs/dbraw/zinc/21/75/12/409217512.db2.gz	ZQIHUAFFVWWTJW-FZMZJTMJSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H](C2CC2)O1	ZINC000279453514	409217515	/nfs/dbraw/zinc/21/75/15/409217515.db2.gz	ZQIHUAFFVWWTJW-FZMZJTMJSA-N	1	1	307.350	1.256	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000295210654	409377202	/nfs/dbraw/zinc/37/72/02/409377202.db2.gz	LMGYJRCGKBGZQI-LFAOLKIESA-N	1	1	307.325	1.768	20	5		DDBDMO
CC1(C)C[C@H](O)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000295984132	409392244	/nfs/dbraw/zinc/39/22/44/409392244.db2.gz	JLBZUDSBJLHPDT-CYBMUJFWSA-N	1	1	309.366	1.239	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc([N+](=O)[O-])c(C)c2)[N@@H+](C)C1	ZINC000284474402	409345400	/nfs/dbraw/zinc/34/54/00/409345400.db2.gz	AZICYEFLRRVUGC-KBPBESRZSA-N	1	1	321.377	1.694	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000317286346	164026838	/nfs/dbraw/zinc/02/68/38/164026838.db2.gz	KMXJZRUAOOBCEG-WDEREUQCSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[C@H]1CCOCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000373280177	164169287	/nfs/dbraw/zinc/16/92/87/164169287.db2.gz	JMGOGFHUOUVIAQ-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1nccc2cc([N+](=O)[O-])ccc21	ZINC000295488797	409503703	/nfs/dbraw/zinc/50/37/03/409503703.db2.gz	JSBIAFXEPWWUFX-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000342437222	409629515	/nfs/dbraw/zinc/62/95/15/409629515.db2.gz	OBCHWSIXNNKURJ-PELKAZGASA-N	1	1	302.327	1.257	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000356883932	409689370	/nfs/dbraw/zinc/68/93/70/409689370.db2.gz	QOZPOKXFFUTXNZ-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000356883932	409689381	/nfs/dbraw/zinc/68/93/81/409689381.db2.gz	QOZPOKXFFUTXNZ-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(OCC(=O)NC2C[NH+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000297018178	409759073	/nfs/dbraw/zinc/75/90/73/409759073.db2.gz	HZLIQXGGHVNWHI-UHFFFAOYSA-N	1	1	323.349	1.191	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000357005086	409784087	/nfs/dbraw/zinc/78/40/87/409784087.db2.gz	QVOWUVYVELQHLJ-STQMWFEESA-N	1	1	320.393	1.582	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000354385300	409814361	/nfs/dbraw/zinc/81/43/61/409814361.db2.gz	CTOWRJJSCWJBOP-YPMHNXCESA-N	1	1	323.397	1.431	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000342857473	409951191	/nfs/dbraw/zinc/95/11/91/409951191.db2.gz	MFSPIUBWGDDFOX-IORUMNFESA-N	1	1	319.405	1.995	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000332238077	410003845	/nfs/dbraw/zinc/00/38/45/410003845.db2.gz	HQWZMQHBXGCXIT-OLZOCXBDSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000332362968	410099084	/nfs/dbraw/zinc/09/90/84/410099084.db2.gz	XAHNMFDKBGPYOB-LBPRGKRZSA-N	1	1	318.377	1.120	20	5		DDBDMO
O=C(CC[N@H+]1CCc2nn[nH]c2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000351607128	410102563	/nfs/dbraw/zinc/10/25/63/410102563.db2.gz	HVBKUYYYSFPSQZ-UHFFFAOYSA-N	1	1	316.321	1.100	20	5		DDBDMO
O=C(CCN1CCc2nn[nH]c2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000351607128	410102571	/nfs/dbraw/zinc/10/25/71/410102571.db2.gz	HVBKUYYYSFPSQZ-UHFFFAOYSA-N	1	1	316.321	1.100	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC[N@H+]([C@@H](C)CO)CC2)c1	ZINC000347152524	410364870	/nfs/dbraw/zinc/36/48/70/410364870.db2.gz	YPUXJGUXIIUGCM-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
Nc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-]	ZINC000298746874	410380196	/nfs/dbraw/zinc/38/01/96/410380196.db2.gz	UXLCKKDRVNBIOG-LBPRGKRZSA-N	1	1	314.349	1.653	20	5		DDBDMO
CC(C)c1ccc(CNC[C@]2(O)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358171264	410393579	/nfs/dbraw/zinc/39/35/79/410393579.db2.gz	SALFKUPAKSHJIU-MRXNPFEDSA-N	1	1	307.394	1.874	20	5		DDBDMO
CC(C)c1ccc(C[NH2+]C[C@]2(O)CCN(C)C2)cc1[N+](=O)[O-]	ZINC000358171264	410393586	/nfs/dbraw/zinc/39/35/86/410393586.db2.gz	SALFKUPAKSHJIU-MRXNPFEDSA-N	1	1	307.394	1.874	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000298822787	410412493	/nfs/dbraw/zinc/41/24/93/410412493.db2.gz	ZYXUDXVBUZTPBP-NSHDSACASA-N	1	1	321.333	1.053	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000298822787	410412499	/nfs/dbraw/zinc/41/24/99/410412499.db2.gz	ZYXUDXVBUZTPBP-NSHDSACASA-N	1	1	321.333	1.053	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])[nH]1)Cc1ccccc1	ZINC000299109307	410527940	/nfs/dbraw/zinc/52/79/40/410527940.db2.gz	QCYCIIGJPGKQSP-UHFFFAOYSA-N	1	1	302.334	1.785	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000355594268	410598100	/nfs/dbraw/zinc/59/81/00/410598100.db2.gz	DNFXYLCOYXZVAL-HNNXBMFYSA-N	1	1	322.365	1.400	20	5		DDBDMO
CS[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@H]1[NH+](C)C	ZINC000330460760	410709638	/nfs/dbraw/zinc/70/96/38/410709638.db2.gz	VZQMDXVCVOLYNS-ZIAGYGMSSA-N	1	1	311.407	1.778	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](COC(F)F)C1	ZINC000353022924	410741653	/nfs/dbraw/zinc/74/16/53/410741653.db2.gz	FIRGITBYLDXRNG-JTQLQIEISA-N	1	1	317.292	1.318	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000337476473	410816000	/nfs/dbraw/zinc/81/60/00/410816000.db2.gz	SJWHAPYXTZMOCF-VXGBXAGGSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NCC[N@@H+](C)C1CCCCC1	ZINC000330589820	410804328	/nfs/dbraw/zinc/80/43/28/410804328.db2.gz	ZSOVKLPGKNYJFH-UHFFFAOYSA-N	1	1	309.370	1.323	20	5		DDBDMO
CC(C)(C)Oc1cc(N2CC[NH+](CCO)CC2)ccc1[N+](=O)[O-]	ZINC000301900222	410823292	/nfs/dbraw/zinc/82/32/92/410823292.db2.gz	YWLJPADEBOYQFV-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
COC(=O)c1cnc(NCCc2c[nH+]cn2C)c([N+](=O)[O-])c1	ZINC000302785952	410862681	/nfs/dbraw/zinc/86/26/81/410862681.db2.gz	VVFXTUFPCXMFPG-UHFFFAOYSA-N	1	1	305.294	1.165	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C[C@H]1C	ZINC000330677817	410868345	/nfs/dbraw/zinc/86/83/45/410868345.db2.gz	VSIMBSWOWKIZSH-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1	ZINC000330607324	410820917	/nfs/dbraw/zinc/82/09/17/410820917.db2.gz	LMRNKWVMHAOSGO-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1	ZINC000330607324	410820926	/nfs/dbraw/zinc/82/09/26/410820926.db2.gz	LMRNKWVMHAOSGO-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000337607802	410893262	/nfs/dbraw/zinc/89/32/62/410893262.db2.gz	WDMOKDFDCMQIPF-UHFFFAOYSA-N	1	1	318.377	1.631	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344055665	410924486	/nfs/dbraw/zinc/92/44/86/410924486.db2.gz	KUSVPNXLTQARLO-PKIAMQTDSA-N	1	1	319.361	1.625	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1C	ZINC000331090877	410943116	/nfs/dbraw/zinc/94/31/16/410943116.db2.gz	HQMPBVHNIDDHKC-SNVBAGLBSA-N	1	1	307.350	1.688	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)C[C@H]2C)cc([N+](=O)[O-])c1C	ZINC000331090877	410943120	/nfs/dbraw/zinc/94/31/20/410943120.db2.gz	HQMPBVHNIDDHKC-SNVBAGLBSA-N	1	1	307.350	1.688	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000348522941	410998100	/nfs/dbraw/zinc/99/81/00/410998100.db2.gz	AQSBBLMXRRVNSX-NEPJUHHUSA-N	1	1	307.350	1.559	20	5		DDBDMO
CC1CC[NH+](CC2CCN(C(=O)[C@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000360108658	411050123	/nfs/dbraw/zinc/05/01/23/411050123.db2.gz	XYHZISKHQJGHOX-GJZGRUSLSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)n1	ZINC000331296120	411064765	/nfs/dbraw/zinc/06/47/65/411064765.db2.gz	NVTRTWFOWVWNLF-UHFFFAOYSA-N	1	1	323.397	1.663	20	5		DDBDMO
Cc1cnn(CC[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000341836418	411066806	/nfs/dbraw/zinc/06/68/06/411066806.db2.gz	XWCNEQHYLHBPTI-UHFFFAOYSA-N	1	1	315.377	1.922	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)CC1(O)CCC1	ZINC000353483469	411021267	/nfs/dbraw/zinc/02/12/67/411021267.db2.gz	HLHDRWNBYFANNX-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CC1(O)CCC1	ZINC000353483469	411021269	/nfs/dbraw/zinc/02/12/69/411021269.db2.gz	HLHDRWNBYFANNX-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)C1CC(O)C1	ZINC000353490439	411027079	/nfs/dbraw/zinc/02/70/79/411027079.db2.gz	QRGVXIXAIJYTLA-OIKLOGQESA-N	1	1	323.349	1.386	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)C1CC(O)C1	ZINC000353490439	411027085	/nfs/dbraw/zinc/02/70/85/411027085.db2.gz	QRGVXIXAIJYTLA-OIKLOGQESA-N	1	1	323.349	1.386	20	5		DDBDMO
O=C(CCN1CC[C@]2(CC[NH2+]C2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000360565414	418465779	/nfs/dbraw/zinc/46/57/79/418465779.db2.gz	UPUUXUSCHQASPG-INIZCTEOSA-N	1	1	318.377	1.609	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373929402	418474179	/nfs/dbraw/zinc/47/41/79/418474179.db2.gz	ORJPRKPDEMNBOV-CHWSQXEVSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373929382	418474328	/nfs/dbraw/zinc/47/43/28/418474328.db2.gz	OJIZHBWNPJVSBB-TZMCWYRMSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@](O)(c2ccc(F)cc2)C1	ZINC000374861116	418570457	/nfs/dbraw/zinc/57/04/57/418570457.db2.gz	XUJGUOFXZMAJQP-OAHLLOKOSA-N	1	1	320.324	1.561	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@](O)(c2ccc(F)cc2)C1	ZINC000374861116	418570459	/nfs/dbraw/zinc/57/04/59/418570459.db2.gz	XUJGUOFXZMAJQP-OAHLLOKOSA-N	1	1	320.324	1.561	20	5		DDBDMO
C[C@H]1c2ccccc2C[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000361044805	418572849	/nfs/dbraw/zinc/57/28/49/418572849.db2.gz	JPOHSSPNVXSZEB-FZMZJTMJSA-N	1	1	302.334	1.729	20	5		DDBDMO
C[C@H]1CN(CC[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)CCO1	ZINC000367049124	418555469	/nfs/dbraw/zinc/55/54/69/418555469.db2.gz	CDRHCSVDMYKJBM-UONOGXRCSA-N	1	1	323.397	1.149	20	5		DDBDMO
C[C@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000291035612	222088800	/nfs/dbraw/zinc/08/88/00/222088800.db2.gz	ZHDAHUICKLLSCK-VIFPVBQESA-N	1	1	305.338	1.151	20	5		DDBDMO
CNc1c(C(=O)NCCC[N@@H+](C)CCOC)cccc1[N+](=O)[O-]	ZINC000361147847	418594179	/nfs/dbraw/zinc/59/41/79/418594179.db2.gz	XGNSKKXFCHXULH-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
CNc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000387573797	418743910	/nfs/dbraw/zinc/74/39/10/418743910.db2.gz	XOWQLLCTPICGLJ-NSHDSACASA-N	1	1	306.366	1.708	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1cc([N+](=O)[O-])c[nH]c1=O)CC2	ZINC000364661697	418797770	/nfs/dbraw/zinc/79/77/70/418797770.db2.gz	WHQXNJMPHMQWEC-UHFFFAOYSA-N	1	1	320.349	1.396	20	5		DDBDMO
C[C@H](CO)[N@@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000364934838	418824586	/nfs/dbraw/zinc/82/45/86/418824586.db2.gz	OTILEFRGRGKQOD-SNVBAGLBSA-N	1	1	313.379	1.185	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000364934838	418824588	/nfs/dbraw/zinc/82/45/88/418824588.db2.gz	OTILEFRGRGKQOD-SNVBAGLBSA-N	1	1	313.379	1.185	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365839911	418915385	/nfs/dbraw/zinc/91/53/85/418915385.db2.gz	UBWWCQCCKPVOTO-BZNIZROVSA-N	1	1	319.361	1.769	20	5		DDBDMO
CN1C[C@@H]2C[N@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373216797	418932715	/nfs/dbraw/zinc/93/27/15/418932715.db2.gz	BUQCUFAJBYETOA-CYBMUJFWSA-N	1	1	320.349	1.025	20	5		DDBDMO
CN1C[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373216797	418932716	/nfs/dbraw/zinc/93/27/16/418932716.db2.gz	BUQCUFAJBYETOA-CYBMUJFWSA-N	1	1	320.349	1.025	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420936458	419371092	/nfs/dbraw/zinc/37/10/92/419371092.db2.gz	INMBHEOIVQFOFP-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420936458	419371097	/nfs/dbraw/zinc/37/10/97/419371097.db2.gz	INMBHEOIVQFOFP-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC000420990807	419430554	/nfs/dbraw/zinc/43/05/54/419430554.db2.gz	VAGZEDVUDRHUOJ-LBPRGKRZSA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC000420990807	419430559	/nfs/dbraw/zinc/43/05/59/419430559.db2.gz	VAGZEDVUDRHUOJ-LBPRGKRZSA-N	1	1	323.349	1.193	20	5		DDBDMO
COc1ccc(CN2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000418106333	419535831	/nfs/dbraw/zinc/53/58/31/419535831.db2.gz	CDQSITYMUYCZLW-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c4ncccc34)C[C@@H]21	ZINC000413469477	419786258	/nfs/dbraw/zinc/78/62/58/419786258.db2.gz	KOOJGGSBPXRSNQ-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
COC(=O)[C@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+](C)C1	ZINC000413511379	419787583	/nfs/dbraw/zinc/78/75/83/419787583.db2.gz	ZLKBUPZLGTZHHB-GFCCVEGCSA-N	1	1	322.365	1.148	20	5		DDBDMO
COC(=O)[C@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000413511379	419787588	/nfs/dbraw/zinc/78/75/88/419787588.db2.gz	ZLKBUPZLGTZHHB-GFCCVEGCSA-N	1	1	322.365	1.148	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2cc(C)ccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000413508302	419789355	/nfs/dbraw/zinc/78/93/55/419789355.db2.gz	XIOQXUORHFIXGK-LBPRGKRZSA-N	1	1	307.350	1.444	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1C	ZINC000299628676	229277683	/nfs/dbraw/zinc/27/76/83/229277683.db2.gz	LGTHRGJYJMXEAS-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000418997853	420041048	/nfs/dbraw/zinc/04/10/48/420041048.db2.gz	LNTZLNZTSGAUNV-MNOVXSKESA-N	1	1	311.386	1.011	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430210939	420089607	/nfs/dbraw/zinc/08/96/07/420089607.db2.gz	GEZGUCOWNZWHLC-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430210939	420089613	/nfs/dbraw/zinc/08/96/13/420089613.db2.gz	GEZGUCOWNZWHLC-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC([C@H](C)[NH3+])CC1	ZINC000430922428	420206462	/nfs/dbraw/zinc/20/64/62/420206462.db2.gz	AGVAOLMMIBAMFG-NWDGAFQWSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000416291930	420311485	/nfs/dbraw/zinc/31/14/85/420311485.db2.gz	IFTBUKDPRHEWEQ-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H](C)[N@H+](CCO)C[C@@H]1C	ZINC000416291930	420311490	/nfs/dbraw/zinc/31/14/90/420311490.db2.gz	IFTBUKDPRHEWEQ-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+](C)C2)c([N+](=O)[O-])c1	ZINC000416495277	420394207	/nfs/dbraw/zinc/39/42/07/420394207.db2.gz	LCUXQAOCDYPOSI-NSHDSACASA-N	1	1	313.379	1.133	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H](c3nnc[nH]3)C2)c1	ZINC000425541168	420413578	/nfs/dbraw/zinc/41/35/78/420413578.db2.gz	FYOXRMFKCNLBJI-NSHDSACASA-N	1	1	303.322	1.581	20	5		DDBDMO
CNC(=O)c1ccc(N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000450795803	420534049	/nfs/dbraw/zinc/53/40/49/420534049.db2.gz	ROHXEQVEUPHYGR-SMDDNHRTSA-N	1	1	304.350	1.095	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457114144	420618317	/nfs/dbraw/zinc/61/83/17/420618317.db2.gz	KGGZXCAPRSYCHI-NSHDSACASA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457114144	420618322	/nfs/dbraw/zinc/61/83/22/420618322.db2.gz	KGGZXCAPRSYCHI-NSHDSACASA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457114144	420618326	/nfs/dbraw/zinc/61/83/26/420618326.db2.gz	KGGZXCAPRSYCHI-NSHDSACASA-N	1	1	323.397	1.825	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCO)CCOCCO	ZINC000459784835	420872362	/nfs/dbraw/zinc/87/23/62/420872362.db2.gz	JFWYJDSFEZOCJE-UHFFFAOYSA-N	1	1	318.757	1.051	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](CCO)CCOCCO	ZINC000459784835	420872366	/nfs/dbraw/zinc/87/23/66/420872366.db2.gz	JFWYJDSFEZOCJE-UHFFFAOYSA-N	1	1	318.757	1.051	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)N1CCN(C)CC1	ZINC000449134361	420956724	/nfs/dbraw/zinc/95/67/24/420956724.db2.gz	IRBNDVKSUJVSBH-HUUCEWRRSA-N	1	1	320.437	1.751	20	5		DDBDMO
CNc1nc(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000456004537	421087177	/nfs/dbraw/zinc/08/71/77/421087177.db2.gz	KFHPDFKRXZZABD-SNVBAGLBSA-N	1	1	319.365	1.412	20	5		DDBDMO
[NH3+]C[C@H]1CC[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449716770	421068156	/nfs/dbraw/zinc/06/81/56/421068156.db2.gz	LYOUCWUVHBVEAY-DTWKUNHWSA-N	1	1	303.322	1.328	20	5		DDBDMO
Cc1nc(N(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450482665	421202543	/nfs/dbraw/zinc/20/25/43/421202543.db2.gz	HLEWEILILPXZEM-PHIMTYICSA-N	1	1	309.370	1.239	20	5		DDBDMO
Cc1nc(N(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450482665	421202545	/nfs/dbraw/zinc/20/25/45/421202545.db2.gz	HLEWEILILPXZEM-PHIMTYICSA-N	1	1	309.370	1.239	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCC[N@H+]1CCCOCC1	ZINC000491970678	421205433	/nfs/dbraw/zinc/20/54/33/421205433.db2.gz	DBEMQWBPMZFMFN-DAXSKMNVSA-N	1	1	319.361	1.447	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777270	421629655	/nfs/dbraw/zinc/62/96/55/421629655.db2.gz	DWYZWLZQBDZSHE-GXTWGEPZSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](CO)[C@H](O)C2)ccc1[N+](=O)[O-]	ZINC000517777270	421629657	/nfs/dbraw/zinc/62/96/57/421629657.db2.gz	DWYZWLZQBDZSHE-GXTWGEPZSA-N	1	1	310.350	1.169	20	5		DDBDMO
CCc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000554877955	421663769	/nfs/dbraw/zinc/66/37/69/421663769.db2.gz	SYTUSGMJDVGQTP-JTQLQIEISA-N	1	1	318.337	1.382	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000573794111	422015051	/nfs/dbraw/zinc/01/50/51/422015051.db2.gz	FSPZDJAEJDTNSX-GXSJLCMTSA-N	1	1	307.354	1.047	20	5		DDBDMO
Cc1nnsc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000583937288	422221645	/nfs/dbraw/zinc/22/16/45/422221645.db2.gz	HWGSOSHCZQHZRC-SNVBAGLBSA-N	1	1	320.378	1.836	20	5		DDBDMO
Cc1nnsc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000583937288	422221650	/nfs/dbraw/zinc/22/16/50/422221650.db2.gz	HWGSOSHCZQHZRC-SNVBAGLBSA-N	1	1	320.378	1.836	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)C[N@H+]1C1CC1	ZINC000584383767	422299386	/nfs/dbraw/zinc/29/93/86/422299386.db2.gz	PEOQRFYKDGKYIK-ZJUUUORDSA-N	1	1	302.338	1.675	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2ccnc(NC)c2[N+](=O)[O-])C[C@H]1C	ZINC000584788291	422300668	/nfs/dbraw/zinc/30/06/68/422300668.db2.gz	KNBGKSYFTYFFLN-MNOVXSKESA-N	1	1	321.381	1.586	20	5		DDBDMO
Nc1ccc(N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)nc1[N+](=O)[O-]	ZINC000596163553	422369106	/nfs/dbraw/zinc/36/91/06/422369106.db2.gz	WSDBATKSDYJRSP-STQMWFEESA-N	1	1	321.381	1.627	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-]	ZINC000344662744	272084257	/nfs/dbraw/zinc/08/42/57/272084257.db2.gz	KMIQUOGEVOWQRU-LLVKDONJSA-N	1	1	323.397	1.487	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000345328974	272221009	/nfs/dbraw/zinc/22/10/09/272221009.db2.gz	VEJKXJXFHXAEQJ-NWDGAFQWSA-N	1	1	306.366	1.606	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000345593537	272287674	/nfs/dbraw/zinc/28/76/74/272287674.db2.gz	CPMUHOXTGILFHT-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
COCC[NH+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1	ZINC000276605415	274031484	/nfs/dbraw/zinc/03/14/84/274031484.db2.gz	KYXCIJORDFMKAI-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(N2CCC[N@@H+](CCO)CC2)c(F)c1	ZINC000121711405	275033701	/nfs/dbraw/zinc/03/37/01/275033701.db2.gz	UAZCEZVGPVZQMB-UHFFFAOYSA-N	1	1	301.293	1.377	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(N2CCC[N@H+](CCO)CC2)c(F)c1	ZINC000121711405	275033702	/nfs/dbraw/zinc/03/37/02/275033702.db2.gz	UAZCEZVGPVZQMB-UHFFFAOYSA-N	1	1	301.293	1.377	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CC2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000269445184	276040100	/nfs/dbraw/zinc/04/01/00/276040100.db2.gz	QFRUBIRTAVSRDB-UHFFFAOYSA-N	1	1	323.397	1.855	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@@H]21	ZINC000284899857	277130119	/nfs/dbraw/zinc/13/01/19/277130119.db2.gz	HOWHDNOUOACTJY-UWVGGRQHSA-N	1	1	323.378	1.213	20	5		DDBDMO
C[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113700	277182706	/nfs/dbraw/zinc/18/27/06/277182706.db2.gz	YQSWSUDAAPESPW-ABAIWWIYSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000275113700	277182707	/nfs/dbraw/zinc/18/27/07/277182707.db2.gz	YQSWSUDAAPESPW-ABAIWWIYSA-N	1	1	319.361	1.857	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1OC[C@H](O)C[N@H+](C)C1CC1	ZINC000290796301	278244538	/nfs/dbraw/zinc/24/45/38/278244538.db2.gz	PBTRBERSGXKIDZ-CYBMUJFWSA-N	1	1	308.334	1.631	20	5		DDBDMO
CC(C)C[C@]1(CO)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000191666467	279239155	/nfs/dbraw/zinc/23/91/55/279239155.db2.gz	OYQCLZHTIPLASC-INIZCTEOSA-N	1	1	323.393	1.630	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1C	ZINC000357540308	279398517	/nfs/dbraw/zinc/39/85/17/279398517.db2.gz	XBOUCIATZSDQAZ-GHMZBOCLSA-N	1	1	321.381	1.398	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000444270535	295285090	/nfs/dbraw/zinc/28/50/90/295285090.db2.gz	RJTVFAQAWGNVMA-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)CC[NH+]1CCOCC1	ZINC000358038407	299054011	/nfs/dbraw/zinc/05/40/11/299054011.db2.gz	FZPAZLTWGJLOMG-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362073129	300000493	/nfs/dbraw/zinc/00/04/93/300000493.db2.gz	UHYUGJWVKWSEHX-QWRGUYRKSA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362073129	300000495	/nfs/dbraw/zinc/00/04/95/300000495.db2.gz	UHYUGJWVKWSEHX-QWRGUYRKSA-N	1	1	323.349	1.102	20	5		DDBDMO
CN(c1ncccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000363063831	300205316	/nfs/dbraw/zinc/20/53/16/300205316.db2.gz	MGCJALGHSIOWME-CQSZACIVSA-N	1	1	319.409	1.595	20	5		DDBDMO
CN(c1ncccc1[N+](=O)[O-])[C@@H]1CCN(C2CC[NH+](C)CC2)C1	ZINC000363063831	300205318	/nfs/dbraw/zinc/20/53/18/300205318.db2.gz	MGCJALGHSIOWME-CQSZACIVSA-N	1	1	319.409	1.595	20	5		DDBDMO
Cc1nc(C2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)n[nH]1	ZINC000364018314	300335696	/nfs/dbraw/zinc/33/56/96/300335696.db2.gz	OTBZEFSPZUAHSJ-UHFFFAOYSA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1nnc(C2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)[nH]1	ZINC000364018314	300335699	/nfs/dbraw/zinc/33/56/99/300335699.db2.gz	OTBZEFSPZUAHSJ-UHFFFAOYSA-N	1	1	305.342	1.097	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@H]3CO)o2)cc1	ZINC000364326036	300376474	/nfs/dbraw/zinc/37/64/74/300376474.db2.gz	STXIZYIYLVVILL-UONOGXRCSA-N	1	1	318.329	1.782	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1CO	ZINC000365264485	300493123	/nfs/dbraw/zinc/49/31/23/300493123.db2.gz	GIRSQDFDRBKWDR-DOMZBBRYSA-N	1	1	316.361	1.714	20	5		DDBDMO
CCn1cc(C2CC[NH+](Cc3c([N+](=O)[O-])ncn3C)CC2)cn1	ZINC000365853301	300594720	/nfs/dbraw/zinc/59/47/20/300594720.db2.gz	KXEVARISAXNGIF-UHFFFAOYSA-N	1	1	318.381	1.924	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497259	301041039	/nfs/dbraw/zinc/04/10/39/301041039.db2.gz	XBSQUIIMJXFIBB-FXUDXRNXSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497259	301041041	/nfs/dbraw/zinc/04/10/41/301041041.db2.gz	XBSQUIIMJXFIBB-FXUDXRNXSA-N	1	1	317.389	1.851	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000368497259	301041043	/nfs/dbraw/zinc/04/10/43/301041043.db2.gz	XBSQUIIMJXFIBB-FXUDXRNXSA-N	1	1	317.389	1.851	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)N1CCCCC1	ZINC000369010253	301118604	/nfs/dbraw/zinc/11/86/04/301118604.db2.gz	POKUSOVGVVGJAM-CYBMUJFWSA-N	1	1	321.381	1.441	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)N1CCCCC1	ZINC000369010253	301118606	/nfs/dbraw/zinc/11/86/06/301118606.db2.gz	POKUSOVGVVGJAM-CYBMUJFWSA-N	1	1	321.381	1.441	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]2OCC[C@H]2C1	ZINC000369664026	301208515	/nfs/dbraw/zinc/20/85/15/301208515.db2.gz	NSGUFUCALMVFLC-SWLSCSKDSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]2OCC[C@H]2C1	ZINC000369664026	301208519	/nfs/dbraw/zinc/20/85/19/301208519.db2.gz	NSGUFUCALMVFLC-SWLSCSKDSA-N	1	1	319.361	1.953	20	5		DDBDMO
O=C1CCCN1C[C@H]1CCCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000370000860	301255778	/nfs/dbraw/zinc/25/57/78/301255778.db2.gz	FLCWSIYVGUSJGJ-CYBMUJFWSA-N	1	1	321.381	1.268	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H]2CCCO2)CC[C@@H]1Nc1ncc([N+](=O)[O-])cn1	ZINC000376928227	302122329	/nfs/dbraw/zinc/12/23/29/302122329.db2.gz	YXJKCTPKUCRFLJ-XBFCOCLRSA-N	1	1	321.381	1.686	20	5		DDBDMO
CN1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C[C@@H]1c1ccccc1Cl	ZINC000377123229	302145883	/nfs/dbraw/zinc/14/58/83/302145883.db2.gz	OPKBEFNHOBRNLD-MRVWCRGKSA-N	1	1	323.780	1.820	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000533226804	303314018	/nfs/dbraw/zinc/31/40/18/303314018.db2.gz	MECGHNAZOORVMU-LLVKDONJSA-N	1	1	321.381	1.752	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000547735172	303550173	/nfs/dbraw/zinc/55/01/73/303550173.db2.gz	VUMUBOKIKVILMI-UHFFFAOYSA-N	1	1	315.333	1.209	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000362254136	307015768	/nfs/dbraw/zinc/01/57/68/307015768.db2.gz	BOCBYPWNTBCYJH-JQWIXIFHSA-N	1	1	321.381	1.437	20	5		DDBDMO
Cn1nccc1[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000363428796	307027818	/nfs/dbraw/zinc/02/78/18/307027818.db2.gz	CRWFOOHRAXBMLC-LBPRGKRZSA-N	1	1	304.354	1.404	20	5		DDBDMO
CC(=O)N(C[C@H]1CCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C)C1CC1	ZINC000370647396	307131583	/nfs/dbraw/zinc/13/15/83/307131583.db2.gz	HABNVASFWVSKEK-CYBMUJFWSA-N	1	1	321.381	1.304	20	5		DDBDMO
CC(=O)N(C[C@H]1CCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C)C1CC1	ZINC000370647396	307131584	/nfs/dbraw/zinc/13/15/84/307131584.db2.gz	HABNVASFWVSKEK-CYBMUJFWSA-N	1	1	321.381	1.304	20	5		DDBDMO
COC(=O)[C@@]12CCC[C@@H]1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000376268381	307242001	/nfs/dbraw/zinc/24/20/01/307242001.db2.gz	VKHIKEGCHHZLGN-BXUZGUMPSA-N	1	1	308.338	1.066	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)Nc2ncc([N+](=O)[O-])c(C)n2)CC1	ZINC000450925757	307306438	/nfs/dbraw/zinc/30/64/38/307306438.db2.gz	ZMWQEKXLRUAFGN-UHFFFAOYSA-N	1	1	322.413	1.521	20	5		DDBDMO
CC1(C)[C@@H](O)C[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000576237735	308300052	/nfs/dbraw/zinc/30/00/52/308300052.db2.gz	HSCBASCSIBYUQR-RYUDHWBXSA-N	1	1	318.333	1.894	20	5		DDBDMO
Cc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010078	533915400	/nfs/dbraw/zinc/91/54/00/533915400.db2.gz	YFVAZCJARKURGQ-VXGBXAGGSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1cc(N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010078	533915402	/nfs/dbraw/zinc/91/54/02/533915402.db2.gz	YFVAZCJARKURGQ-VXGBXAGGSA-N	1	1	311.357	1.934	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccc(O)cc3)CC2)c1	ZINC000157325558	527413685	/nfs/dbraw/zinc/41/36/85/527413685.db2.gz	AJCOZOCEQVKFTO-UHFFFAOYSA-N	1	1	317.349	1.319	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820665053	599590686	/nfs/dbraw/zinc/59/06/86/599590686.db2.gz	DLEOMGJHWNNZIY-BDAKNGLRSA-N	1	1	318.341	1.065	20	5		DDBDMO
C[C@H]1C[C@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000820669006	606711824	/nfs/dbraw/zinc/71/18/24/606711824.db2.gz	YKKPZWLSYHOSIN-DTWKUNHWSA-N	1	1	318.341	1.065	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000824992258	608554795	/nfs/dbraw/zinc/55/47/95/608554795.db2.gz	LDGWTFLUANGXPZ-NXEZZACHSA-N	1	1	317.353	1.304	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000797418618	700008909	/nfs/dbraw/zinc/00/89/09/700008909.db2.gz	ZNJLTDIICDCOIZ-HNNXBMFYSA-N	1	1	317.349	1.360	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C1(C(N)=O)CCCC1	ZINC000746474801	700026192	/nfs/dbraw/zinc/02/61/92/700026192.db2.gz	APDBUJROZSAAGU-UHFFFAOYSA-N	1	1	320.349	1.229	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H]2CCCS2(=O)=O)c1	ZINC000126747774	696765160	/nfs/dbraw/zinc/76/51/60/696765160.db2.gz	OZDDUQJPHPFYGO-NSHDSACASA-N	1	1	318.782	1.915	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC000175317594	697396032	/nfs/dbraw/zinc/39/60/32/697396032.db2.gz	AYVYSOPCWRDMPW-NSHDSACASA-N	1	1	306.366	1.557	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000194739408	697720055	/nfs/dbraw/zinc/72/00/55/697720055.db2.gz	ORHZDCLZAPYEOB-JTQLQIEISA-N	1	1	308.294	1.327	20	5		DDBDMO
Cc1nn(C[N@H+](C)CCn2cccn2)c2ncc([N+](=O)[O-])cc12	ZINC000749954270	700194398	/nfs/dbraw/zinc/19/43/98/700194398.db2.gz	SRFFAJYWCZORJW-UHFFFAOYSA-N	1	1	315.337	1.434	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CCn2cccn2)c2ncc([N+](=O)[O-])cc12	ZINC000749954270	700194400	/nfs/dbraw/zinc/19/44/00/700194400.db2.gz	SRFFAJYWCZORJW-UHFFFAOYSA-N	1	1	315.337	1.434	20	5		DDBDMO
Cc1c[nH+]ccc1NS(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000776793027	698140814	/nfs/dbraw/zinc/14/08/14/698140814.db2.gz	WFJMIMIBWKHFAS-UHFFFAOYSA-N	1	1	321.358	1.705	20	5		DDBDMO
CN1CCC[C@H]([NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1=O	ZINC000778931831	698383301	/nfs/dbraw/zinc/38/33/01/698383301.db2.gz	FMUUALWEBLHSFW-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
CO[C@H]1C[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@H]1C	ZINC000783969075	698896346	/nfs/dbraw/zinc/89/63/46/698896346.db2.gz	RYPGQAHNVPSBMJ-YGRLFVJLSA-N	1	1	319.365	1.962	20	5		DDBDMO
CO[C@H]1C[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@H]1C	ZINC000783969075	698896350	/nfs/dbraw/zinc/89/63/50/698896350.db2.gz	RYPGQAHNVPSBMJ-YGRLFVJLSA-N	1	1	319.365	1.962	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000786190886	699133247	/nfs/dbraw/zinc/13/32/47/699133247.db2.gz	OOXHKPMGVAPKSV-GJZGRUSLSA-N	1	1	310.350	1.366	20	5		DDBDMO
CO[C@@H]1C[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C[C@@H]1OC	ZINC000792714464	699708375	/nfs/dbraw/zinc/70/83/75/699708375.db2.gz	XKVZGORRSTUHMD-OKILXGFUSA-N	1	1	306.322	1.248	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C[C@@H]1OC	ZINC000792714464	699708377	/nfs/dbraw/zinc/70/83/77/699708377.db2.gz	XKVZGORRSTUHMD-OKILXGFUSA-N	1	1	306.322	1.248	20	5		DDBDMO
C[N@@H+](CCc1ccccc1F)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000743849639	699928530	/nfs/dbraw/zinc/92/85/30/699928530.db2.gz	YAPFSZUWGODOAL-AWEZNQCLSA-N	1	1	322.340	1.466	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000758332464	700699153	/nfs/dbraw/zinc/69/91/53/700699153.db2.gz	BJFDNSBOFSVNLQ-ZANVPECISA-N	1	1	307.325	1.946	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2C[N@@H+](C3CC3)C[C@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000758336338	700699588	/nfs/dbraw/zinc/69/95/88/700699588.db2.gz	PVEFHNWFDPSHDM-MFKMUULPSA-N	1	1	318.377	1.698	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000762817731	700908505	/nfs/dbraw/zinc/90/85/05/700908505.db2.gz	KAPANDQTRBKPAG-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[NH+](C[C@@H]3CCCO3)CC2)n1	ZINC000765454029	701013511	/nfs/dbraw/zinc/01/35/11/701013511.db2.gz	XFKZMNSPNLDPCM-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
CC1(C)CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000804631554	701204936	/nfs/dbraw/zinc/20/49/36/701204936.db2.gz	WWPRXYZEMCRPNS-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
CC1(C)CN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000804631554	701204939	/nfs/dbraw/zinc/20/49/39/701204939.db2.gz	WWPRXYZEMCRPNS-UHFFFAOYSA-N	1	1	324.337	1.396	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)OCCn2cc[nH+]c2C)c1	ZINC000771937745	701337593	/nfs/dbraw/zinc/33/75/93/701337593.db2.gz	NSRDCNLJSPLTKD-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
CC1CC[NH+](C[C@H]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC000839612879	701754483	/nfs/dbraw/zinc/75/44/83/701754483.db2.gz	SKMBJLXENRHXNE-RBSFLKMASA-N	1	1	309.410	1.622	20	5		DDBDMO
C[C@H]1CN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)[C@@H]1C	ZINC000840058945	701944227	/nfs/dbraw/zinc/94/42/27/701944227.db2.gz	YINZDZRBVSSARF-NWDGAFQWSA-N	1	1	321.381	1.500	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000812328263	702152459	/nfs/dbraw/zinc/15/24/59/702152459.db2.gz	BTTGNQHOMKZHQJ-PWSUYJOCSA-N	1	1	307.325	1.758	20	5		DDBDMO
Cc1cc(N2CC[NH+](CCCCO)CC2)c(F)cc1[N+](=O)[O-]	ZINC000812460007	702184360	/nfs/dbraw/zinc/18/43/60/702184360.db2.gz	KIVVXJUHKRMPAI-UHFFFAOYSA-N	1	1	311.357	1.937	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000879320870	706648611	/nfs/dbraw/zinc/64/86/11/706648611.db2.gz	JSHBEQYEORECAY-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC000816953656	702237400	/nfs/dbraw/zinc/23/74/00/702237400.db2.gz	LOOSPBQXZXQKGV-NHYWBVRUSA-N	1	1	318.377	1.437	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000842160837	702678371	/nfs/dbraw/zinc/67/83/71/702678371.db2.gz	AJMTWPHLFCHMIR-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[NH2+]C[C@@H]3CCCO3)n2)c1	ZINC000842568125	702734108	/nfs/dbraw/zinc/73/41/08/702734108.db2.gz	HJTIGWHTGYWFFU-LBPRGKRZSA-N	1	1	304.306	1.913	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])ccc1N)[C@@H]1CC[N@@H+](C)C1	ZINC000843990489	702949785	/nfs/dbraw/zinc/94/97/85/702949785.db2.gz	UJIAOJWEFMDGRR-GFCCVEGCSA-N	1	1	306.366	1.733	20	5		DDBDMO
O=C1[C@H]([N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)CCN1c1cccc([N+](=O)[O-])c1	ZINC000844457769	703033984	/nfs/dbraw/zinc/03/39/84/703033984.db2.gz	ZPQBAURUDNIEEH-FRRDWIJNSA-N	1	1	323.299	1.897	20	5		DDBDMO
O=C1[C@H]([N@H+]2C[C@H]3[C@@H](C2)C3(F)F)CCN1c1cccc([N+](=O)[O-])c1	ZINC000844457769	703033986	/nfs/dbraw/zinc/03/39/86/703033986.db2.gz	ZPQBAURUDNIEEH-FRRDWIJNSA-N	1	1	323.299	1.897	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CCOc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000879571283	706722335	/nfs/dbraw/zinc/72/23/35/706722335.db2.gz	OSLBIFPAFTZLEK-KBPBESRZSA-N	1	1	305.378	2.000	20	5		DDBDMO
O=C1CC[C@@H]([N@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000831538568	706728108	/nfs/dbraw/zinc/72/81/08/706728108.db2.gz	FEQNXDSZNFNWOX-GXTWGEPZSA-N	1	1	317.345	1.579	20	5		DDBDMO
Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)c1	ZINC000870908891	704163807	/nfs/dbraw/zinc/16/38/07/704163807.db2.gz	CFRAHKUJSOTBNE-RBSFLKMASA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1cccc(C[N@@H+]2CC[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC000870908891	704163809	/nfs/dbraw/zinc/16/38/09/704163809.db2.gz	CFRAHKUJSOTBNE-RBSFLKMASA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC000870908891	704163811	/nfs/dbraw/zinc/16/38/11/704163811.db2.gz	CFRAHKUJSOTBNE-RBSFLKMASA-N	1	1	303.362	1.351	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)C(=O)N(C)OC	ZINC000858588779	704731547	/nfs/dbraw/zinc/73/15/47/704731547.db2.gz	OWTGEUWCVHQBCD-VHSXEESVSA-N	1	1	311.338	1.662	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1NCC[N@@H+]1CC[C@@H](O)C1	ZINC000858811546	704760355	/nfs/dbraw/zinc/76/03/55/704760355.db2.gz	CTTMCSJVWDMUES-MRVPVSSYSA-N	1	1	303.721	1.866	20	5		DDBDMO
COc1ccc(OCC[N@H+]2[C@@H](C)CC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000880438933	706977018	/nfs/dbraw/zinc/97/70/18/706977018.db2.gz	FGFWJJPFGLPOGG-RYUDHWBXSA-N	1	1	310.350	1.827	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000861033242	705354033	/nfs/dbraw/zinc/35/40/33/705354033.db2.gz	HXFPRAIIOSWQIR-NSHDSACASA-N	1	1	311.338	1.201	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000826757504	705866576	/nfs/dbraw/zinc/86/65/76/705866576.db2.gz	DKJNGCUYPKALHN-CQSZACIVSA-N	1	1	309.366	1.476	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827302700	705972022	/nfs/dbraw/zinc/97/20/22/705972022.db2.gz	XCFPPVGHDJGRLB-QMTHXVAHSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827302700	705972025	/nfs/dbraw/zinc/97/20/25/705972025.db2.gz	XCFPPVGHDJGRLB-QMTHXVAHSA-N	1	1	305.334	1.467	20	5		DDBDMO
Cn1cc(C[N@H+](C)C[C@@](C)(O)c2ccccc2)c([N+](=O)[O-])n1	ZINC000877599248	706154534	/nfs/dbraw/zinc/15/45/34/706154534.db2.gz	SEDSVQLKVZKDOX-OAHLLOKOSA-N	1	1	304.350	1.668	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@@](C)(O)c2ccccc2)c([N+](=O)[O-])n1	ZINC000877599248	706154537	/nfs/dbraw/zinc/15/45/37/706154537.db2.gz	SEDSVQLKVZKDOX-OAHLLOKOSA-N	1	1	304.350	1.668	20	5		DDBDMO
C[C@H](NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000828905413	706253394	/nfs/dbraw/zinc/25/33/94/706253394.db2.gz	WPIPNMOQBOVGAA-NHYWBVRUSA-N	1	1	319.361	1.395	20	5		DDBDMO
Cn1c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cnc1Cl	ZINC000865702902	706500254	/nfs/dbraw/zinc/50/02/54/706500254.db2.gz	HYSZEXJKDYUOOS-CQSZACIVSA-N	1	1	324.768	1.979	20	5		DDBDMO
NC(=O)[C@H](F)C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000879041562	706570357	/nfs/dbraw/zinc/57/03/57/706570357.db2.gz	HGIMBYQIQUNJPM-CYBMUJFWSA-N	1	1	313.304	1.769	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000880608645	707038764	/nfs/dbraw/zinc/03/87/64/707038764.db2.gz	GOXPCEDEVWAEAJ-PHIMTYICSA-N	1	1	309.370	1.041	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000837188360	707594479	/nfs/dbraw/zinc/59/44/79/707594479.db2.gz	DYPQRCQZBDTDOS-SNVBAGLBSA-N	1	1	324.356	1.871	20	5		DDBDMO
Cc1c(C[NH2+][C@@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873045026	707706788	/nfs/dbraw/zinc/70/67/88/707706788.db2.gz	AKANIAUKLHCWSA-ZDUSSCGKSA-N	1	1	306.410	1.629	20	5		DDBDMO
CC1CC[NH+](Cc2cn(CCn3ccc([N+](=O)[O-])n3)nn2)CC1	ZINC000883993735	708095557	/nfs/dbraw/zinc/09/55/57/708095557.db2.gz	UUVNMQXEIZGCEJ-UHFFFAOYSA-N	1	1	319.369	1.315	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1	ZINC000884825463	708388350	/nfs/dbraw/zinc/38/83/50/708388350.db2.gz	YFYJCVVDASXRQD-UHFFFAOYSA-N	1	1	307.272	1.950	20	5		DDBDMO
CCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886019399	708682253	/nfs/dbraw/zinc/68/22/53/708682253.db2.gz	SQJZJIXTLDFVHI-KGLIPLIRSA-N	1	1	321.377	1.742	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000912610349	713048961	/nfs/dbraw/zinc/04/89/61/713048961.db2.gz	KZKSBVIPCRVSMJ-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCn2nncc2C1	ZINC000886465057	708764438	/nfs/dbraw/zinc/76/44/38/708764438.db2.gz	PVGHZXUDWPZQDZ-UHFFFAOYSA-N	1	1	303.322	1.601	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCn2nncc2C1	ZINC000886465057	708764440	/nfs/dbraw/zinc/76/44/40/708764440.db2.gz	PVGHZXUDWPZQDZ-UHFFFAOYSA-N	1	1	303.322	1.601	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3cccnc3[N+](=O)[O-])C2)C1	ZINC000886839777	708858839	/nfs/dbraw/zinc/85/88/39/708858839.db2.gz	LVBXBWGPVGWLNV-YUELXQCFSA-N	1	1	320.393	1.708	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC23CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000889224801	709464284	/nfs/dbraw/zinc/46/42/84/709464284.db2.gz	WORKIKDZNCUXEJ-UHFFFAOYSA-N	1	1	307.354	1.191	20	5		DDBDMO
CC(C)(CC[NH+]1CCOCC1)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000912954607	713134349	/nfs/dbraw/zinc/13/43/49/713134349.db2.gz	FCLZDDAOSLXCDP-UHFFFAOYSA-N	1	1	321.377	1.826	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC000901181162	709958617	/nfs/dbraw/zinc/95/86/17/709958617.db2.gz	KCFIEEHQMLNXIB-UHFFFAOYSA-N	1	1	301.705	1.823	20	5		DDBDMO
C[C@@H](NC(=O)C[C@@]1(O)CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000901328966	710011578	/nfs/dbraw/zinc/01/15/78/710011578.db2.gz	JVNSWJRBOHIIPU-WBMJQRKESA-N	1	1	321.377	1.619	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000928249076	713157386	/nfs/dbraw/zinc/15/73/86/713157386.db2.gz	OWPYOEKBDNRZOK-RISCZKNCSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000928249076	713157387	/nfs/dbraw/zinc/15/73/87/713157387.db2.gz	OWPYOEKBDNRZOK-RISCZKNCSA-N	1	1	307.350	1.493	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NCC1([NH+]2CCOCC2)CCCCC1	ZINC000891487119	710216481	/nfs/dbraw/zinc/21/64/81/710216481.db2.gz	SOJFCLOFWTXJLV-UHFFFAOYSA-N	1	1	323.397	1.775	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C	ZINC000928439693	713196236	/nfs/dbraw/zinc/19/62/36/713196236.db2.gz	JVQKRKDKVNHQOG-ONGXEEELSA-N	1	1	302.334	1.899	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1C	ZINC000928438953	713196502	/nfs/dbraw/zinc/19/65/02/713196502.db2.gz	VFZNLKJHLJPXBT-MNOVXSKESA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452780	713203476	/nfs/dbraw/zinc/20/34/76/713203476.db2.gz	JKDBAAREQHFQDM-GWCFXTLKSA-N	1	1	309.391	1.896	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C[C@@H]1CO	ZINC000894881094	711307048	/nfs/dbraw/zinc/30/70/48/711307048.db2.gz	IRAHLWBGJMNFCI-SNVBAGLBSA-N	1	1	301.293	1.645	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C[C@@H]1CO	ZINC000894881094	711307052	/nfs/dbraw/zinc/30/70/52/711307052.db2.gz	IRAHLWBGJMNFCI-SNVBAGLBSA-N	1	1	301.293	1.645	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](C)[C@@H](CO)C2)c1[N+](=O)[O-]	ZINC000895515984	711531286	/nfs/dbraw/zinc/53/12/86/711531286.db2.gz	YRQDJJSKZNFNFG-ZYHUDNBSSA-N	1	1	310.350	1.759	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC000896526578	711738931	/nfs/dbraw/zinc/73/89/31/711738931.db2.gz	YZMAVFPNUNNRKB-LBPRGKRZSA-N	1	1	322.365	1.664	20	5		DDBDMO
C[C@@H](c1ccc(F)cc1)N1CCC[C@@H]([NH2+]CC[N+](=O)[O-])C1=O	ZINC000905274225	711988886	/nfs/dbraw/zinc/98/88/86/711988886.db2.gz	NXQNLRKYQFBAJN-SMDDNHRTSA-N	1	1	309.341	1.744	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCO[C@H](C)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000905738951	712135631	/nfs/dbraw/zinc/13/56/31/712135631.db2.gz	MSLOHPJHOTWAPG-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@H+]2CCO[C@H](C)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000905738951	712135632	/nfs/dbraw/zinc/13/56/32/712135632.db2.gz	MSLOHPJHOTWAPG-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000905984566	712209611	/nfs/dbraw/zinc/20/96/11/712209611.db2.gz	NCNNTYGLVNKZES-VWYCJHECSA-N	1	1	309.370	1.039	20	5		DDBDMO
COc1cc2c(c(OC)c1OC)CC[N@H+](CC[N+](=O)[O-])CC2	ZINC000929856086	713707729	/nfs/dbraw/zinc/70/77/29/713707729.db2.gz	GOUWEXIJOIDZDA-UHFFFAOYSA-N	1	1	310.350	1.390	20	5		DDBDMO
COc1cc2c(c(OC)c1OC)CC[N@@H+](CC[N+](=O)[O-])CC2	ZINC000929856086	713707732	/nfs/dbraw/zinc/70/77/32/713707732.db2.gz	GOUWEXIJOIDZDA-UHFFFAOYSA-N	1	1	310.350	1.390	20	5		DDBDMO
O=C(Nc1ccc(F)cc1)NC1CC[NH+](CC[N+](=O)[O-])CC1	ZINC000929877722	713711581	/nfs/dbraw/zinc/71/15/81/713711581.db2.gz	JDQLCQHWQSIQBK-UHFFFAOYSA-N	1	1	310.329	1.688	20	5		DDBDMO
Cn1nc2c(c1C[NH2+]Cc1ccccc1[N+](=O)[O-])COCC2	ZINC000921551096	713805560	/nfs/dbraw/zinc/80/55/60/713805560.db2.gz	YMYPVSNZWWIWTQ-UHFFFAOYSA-N	1	1	302.334	1.691	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)[C@H](C)[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000930914215	713957144	/nfs/dbraw/zinc/95/71/44/713957144.db2.gz	GWZRQAHPYKHLRD-AGIUHOORSA-N	1	1	321.377	1.948	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000933372681	714574923	/nfs/dbraw/zinc/57/49/23/714574923.db2.gz	UPNUBXYBWPCHSM-AAEUAGOBSA-N	1	1	323.397	1.431	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOC[C@@H]2C[C@H]2CCCO2)n1	ZINC000933682116	714647402	/nfs/dbraw/zinc/64/74/02/714647402.db2.gz	OMMSDXQRUWEYBV-QWHCGFSZSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC[C@@H]2C[C@H]2CCCO2)n1	ZINC000933682116	714647405	/nfs/dbraw/zinc/64/74/05/714647405.db2.gz	OMMSDXQRUWEYBV-QWHCGFSZSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3CC3)C[C@H]2CC1	ZINC000946589317	718844467	/nfs/dbraw/zinc/84/44/67/718844467.db2.gz	RPLSFRVCMCMDPP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CCC3CC3)C[C@H]2CC1	ZINC000946589317	718844470	/nfs/dbraw/zinc/84/44/70/718844470.db2.gz	RPLSFRVCMCMDPP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CCC3CC3)C[C@H]2CC1	ZINC000946589317	718844480	/nfs/dbraw/zinc/84/44/80/718844480.db2.gz	RPLSFRVCMCMDPP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H](C)[N@@H+](C)C[C@H]1C	ZINC001164643440	719218084	/nfs/dbraw/zinc/21/80/84/719218084.db2.gz	YVJKPLLLUMSRBP-GHMZBOCLSA-N	1	1	322.365	1.695	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc2ccccc2c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126939408	742881608	/nfs/dbraw/zinc/88/16/08/742881608.db2.gz	XDHNBWFQVNIJCU-HZPDHXFCSA-N	1	1	313.357	1.711	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(c2ccc(CC(=O)OC)cc2[N+](=O)[O-])C1	ZINC001187926578	744636450	/nfs/dbraw/zinc/63/64/50/744636450.db2.gz	LUGKYEHIOKDPJK-CYBMUJFWSA-N	1	1	321.377	1.841	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2cnccn2)C1	ZINC001198157595	747393848	/nfs/dbraw/zinc/39/38/48/747393848.db2.gz	RFDOBYVIVPMCQA-LBPRGKRZSA-N	1	1	315.333	1.036	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CC2CCCCC2)CC1	ZINC000996442015	749575819	/nfs/dbraw/zinc/57/58/19/749575819.db2.gz	UKJLAXOBQRWKPH-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2cccc(F)c2)CC1	ZINC000996429654	749589166	/nfs/dbraw/zinc/58/91/66/749589166.db2.gz	ROXFDZQUCDGDKO-HUUCEWRRSA-N	1	1	321.352	1.572	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2nccs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034643582	750625212	/nfs/dbraw/zinc/62/52/12/750625212.db2.gz	PNSQPGCFIGOAPZ-DDHJBXDOSA-N	1	1	324.406	1.325	20	5		DDBDMO
COC[C@]12CCCO[C@@H]1CC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)C2	ZINC001169022094	762201294	/nfs/dbraw/zinc/20/12/94/762201294.db2.gz	MUZSECJYXQWMOG-CAOSSQGBSA-N	1	1	312.410	1.949	20	5		DDBDMO
COc1cccc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169053580	762209059	/nfs/dbraw/zinc/20/90/59/762209059.db2.gz	IZFUONYPSVFUIN-MGPQQGTHSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(C1C[NH+]([C@H]2CCOC2)C1)N1CCc2c1cccc2[N+](=O)[O-]	ZINC000827974859	759433561	/nfs/dbraw/zinc/43/35/61/759433561.db2.gz	HYVULXXIRXPGFU-LBPRGKRZSA-N	1	1	317.345	1.205	20	5		DDBDMO
Cc1cc(C)cc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1	ZINC001020138924	760612560	/nfs/dbraw/zinc/61/25/60/760612560.db2.gz	IHEABKHUGWXSCV-KLHDSHLOSA-N	1	1	317.389	1.705	20	5		DDBDMO
C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC1	ZINC001050245077	763366779	/nfs/dbraw/zinc/36/67/79/763366779.db2.gz	YRDMHKNRVPNDCH-HZPDHXFCSA-N	1	1	317.389	1.810	20	5		DDBDMO
C[N@@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC1	ZINC001050245077	763366789	/nfs/dbraw/zinc/36/67/89/763366789.db2.gz	YRDMHKNRVPNDCH-HZPDHXFCSA-N	1	1	317.389	1.810	20	5		DDBDMO
C[N@H+](Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC1	ZINC001050245077	763366800	/nfs/dbraw/zinc/36/68/00/763366800.db2.gz	YRDMHKNRVPNDCH-HZPDHXFCSA-N	1	1	317.389	1.810	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@@H](O)[C@H](CO)C1)CC2	ZINC001172905993	776916670	/nfs/dbraw/zinc/91/66/70/776916670.db2.gz	VYWFWNLHZXMGFN-SQWLQELKSA-N	1	1	306.362	1.127	20	5		DDBDMO
O=C(c1cc(F)ccc1[N+](=O)[O-])N1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC001176532962	778172513	/nfs/dbraw/zinc/17/25/13/778172513.db2.gz	CLPFGNDZWDQQKP-NWDGAFQWSA-N	1	1	323.324	1.015	20	5		DDBDMO
CC1([NH+]2CCCC2)CCC(NC(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC001178090805	778894571	/nfs/dbraw/zinc/89/45/71/778894571.db2.gz	QWWOGIWDCCJQTH-UHFFFAOYSA-N	1	1	321.381	1.845	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000069392182	779415050	/nfs/dbraw/zinc/41/50/50/779415050.db2.gz	GDQOKGKOVXGRBA-ZDUSSCGKSA-N	1	1	321.377	1.746	20	5		DDBDMO
C[N@H+](CCNC(=O)C1=COCCO1)Cc1cccc([N+](=O)[O-])c1	ZINC001267186164	837494012	/nfs/dbraw/zinc/49/40/12/837494012.db2.gz	YUIRBJFGSDYUJC-UHFFFAOYSA-N	1	1	321.333	1.031	20	5		DDBDMO
C[N@@H+](CCNC(=O)C1=COCCO1)Cc1cccc([N+](=O)[O-])c1	ZINC001267186164	837494017	/nfs/dbraw/zinc/49/40/17/837494017.db2.gz	YUIRBJFGSDYUJC-UHFFFAOYSA-N	1	1	321.333	1.031	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccccc1C	ZINC001266390521	836197391	/nfs/dbraw/zinc/19/73/91/836197391.db2.gz	AWIIFOHGMIJVGQ-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1C	ZINC001266390521	836197393	/nfs/dbraw/zinc/19/73/93/836197393.db2.gz	AWIIFOHGMIJVGQ-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1C	ZINC001266390521	836197399	/nfs/dbraw/zinc/19/73/99/836197399.db2.gz	AWIIFOHGMIJVGQ-HUUCEWRRSA-N	1	1	305.378	1.598	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2c(C)cncc2[N+](=O)[O-])CC1	ZINC001326506156	861413389	/nfs/dbraw/zinc/41/33/89/861413389.db2.gz	OCHSIMABFDIMFJ-UHFFFAOYSA-N	1	1	324.381	1.083	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ncnc3cc([N+](=O)[O-])ccc32)C1	ZINC001155195924	861821101	/nfs/dbraw/zinc/82/11/01/861821101.db2.gz	HAFDGUJZAUYBLH-LLVKDONJSA-N	1	1	303.322	1.281	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ncnc3cc([N+](=O)[O-])ccc32)C1	ZINC001155195924	861821119	/nfs/dbraw/zinc/82/11/19/861821119.db2.gz	HAFDGUJZAUYBLH-LLVKDONJSA-N	1	1	303.322	1.281	20	5		DDBDMO
CCOC(=O)c1ccnc(NCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC001156009148	862629864	/nfs/dbraw/zinc/62/98/64/862629864.db2.gz	JZMUXBODPQCVBV-UHFFFAOYSA-N	1	1	319.321	1.784	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCN1C	ZINC001123318754	859173181	/nfs/dbraw/zinc/17/31/81/859173181.db2.gz	SGLIXIFVRFAHAZ-BXUZGUMPSA-N	1	1	321.381	1.351	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H]2C[N@H+](C)C[C@@H]12	ZINC001124003006	859519458	/nfs/dbraw/zinc/51/94/58/859519458.db2.gz	LTZJFFNLQYMPOH-KCPJHIHWSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[N@@H+]1CCC[C@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@H]21	ZINC001157264854	863693183	/nfs/dbraw/zinc/69/31/83/863693183.db2.gz	GEPSZCIJDYKNPW-GXSJLCMTSA-N	1	1	312.757	1.412	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3c(Cl)[n+]([O-])ccc3[N+](=O)[O-])C[C@H]21	ZINC001157264854	863693191	/nfs/dbraw/zinc/69/31/91/863693191.db2.gz	GEPSZCIJDYKNPW-GXSJLCMTSA-N	1	1	312.757	1.412	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cc(NCC2([NH+]3CCCC3)COC2)n1	ZINC001157655311	864020287	/nfs/dbraw/zinc/02/02/87/864020287.db2.gz	OHHNGQKBKRAYDM-UHFFFAOYSA-N	1	1	312.757	1.920	20	5		DDBDMO
COCc1cccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157761023	864110853	/nfs/dbraw/zinc/11/08/53/864110853.db2.gz	KNKDOIZAJDPMST-HUUCEWRRSA-N	1	1	321.377	1.094	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC001331284352	864986626	/nfs/dbraw/zinc/98/66/26/864986626.db2.gz	ZOPVMUBHPUBLEY-GFCCVEGCSA-N	1	1	320.393	1.875	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CCc2c1ccc([N+](=O)[O-])c2F	ZINC001332469835	865861837	/nfs/dbraw/zinc/86/18/37/865861837.db2.gz	YFTLYMDUWXOANB-UHFFFAOYSA-N	1	1	304.281	1.828	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[C@H]1[NH+]1CCOCC1	ZINC001160720832	866060521	/nfs/dbraw/zinc/06/05/21/866060521.db2.gz	SSONVZDLKGRXTQ-ZIAGYGMSSA-N	1	1	306.366	1.963	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1[C@@H]2CC[C@H]1C[N@@H+](C)CC2	ZINC001332815781	866163496	/nfs/dbraw/zinc/16/34/96/866163496.db2.gz	LRMQPRZYZVIHOM-YPMHNXCESA-N	1	1	318.377	1.945	20	5		DDBDMO
COC(=O)c1ccnc(NCC[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001160965309	866224883	/nfs/dbraw/zinc/22/48/83/866224883.db2.gz	WHSYKUVRTFWEEQ-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
COc1ncnc(NCc2[nH+]cn3ccccc23)c1[N+](=O)[O-]	ZINC001161684171	866885641	/nfs/dbraw/zinc/88/56/41/866885641.db2.gz	HGFFNBRXQDWDBU-UHFFFAOYSA-N	1	1	300.278	1.653	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCCCn2cncn2)ncc1[N+](=O)[O-]	ZINC001161962853	867147273	/nfs/dbraw/zinc/14/72/73/867147273.db2.gz	UGLZESZJMULVLB-QPJJXVBHSA-N	1	1	317.353	1.616	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]C2(CN(C)C)CCC2)c1[N+](=O)[O-]	ZINC001334272580	867442857	/nfs/dbraw/zinc/44/28/57/867442857.db2.gz	WVKYMNMVDIBHFW-UHFFFAOYSA-N	1	1	309.366	1.883	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001335230803	868158041	/nfs/dbraw/zinc/15/80/41/868158041.db2.gz	REBSTVOKKFOCFN-NHYWBVRUSA-N	1	1	318.377	1.755	20	5		DDBDMO
Cc1nn(CCC(=O)NC[C@@H]2CCCC[N@@H+]2C)c(C)c1[N+](=O)[O-]	ZINC001336205364	868787903	/nfs/dbraw/zinc/78/79/03/868787903.db2.gz	XSYYUEMRWMHPDM-ZDUSSCGKSA-N	1	1	323.397	1.399	20	5		DDBDMO
CN(C)C1(CNc2nccc(N)c2[N+](=O)[O-])CC[NH+](C)CC1	ZINC001164210723	869019926	/nfs/dbraw/zinc/01/99/26/869019926.db2.gz	HMJPLNGWZRBPRS-UHFFFAOYSA-N	1	1	308.386	1.010	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CCn3c(C)[nH+]cc3C2)n1	ZINC001165388221	869561050	/nfs/dbraw/zinc/56/10/50/869561050.db2.gz	WGBIOTYVSFMDPU-UHFFFAOYSA-N	1	1	317.305	1.302	20	5		DDBDMO
C[C@@H](c1nnc(N2CCC[N@H+](C3CCCC3)CC2)n1C)[N+](=O)[O-]	ZINC001338210356	869869488	/nfs/dbraw/zinc/86/94/88/869869488.db2.gz	PJHANNWYLZYMKH-LBPRGKRZSA-N	1	1	322.413	1.608	20	5		DDBDMO
CN(C)C(=O)C1CN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001166737523	870210353	/nfs/dbraw/zinc/21/03/53/870210353.db2.gz	KIWWCUYPUADEAT-AATRIKPKSA-N	1	1	319.365	1.047	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC001303469480	871125341	/nfs/dbraw/zinc/12/53/41/871125341.db2.gz	GQXCEVQCIVLFHA-UHFFFAOYSA-N	1	1	321.312	1.505	20	5		DDBDMO
CSc1ccc([N+](=O)[O-])cc1C(=O)NCC[NH+]1CC=CC1	ZINC001342234328	872093750	/nfs/dbraw/zinc/09/37/50/872093750.db2.gz	OFEFTNWGUJZDHA-UHFFFAOYSA-N	1	1	307.375	1.918	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2cc(N)c([N+](=O)[O-])cn2)C[C@@H]1C	ZINC001354227305	877820451	/nfs/dbraw/zinc/82/04/51/877820451.db2.gz	YHSUFOPOPJQIIW-PHIMTYICSA-N	1	1	309.370	1.117	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1COCC[N@@H+]1CC[C@@H](OC)C1	ZINC001223945768	881157846	/nfs/dbraw/zinc/15/78/46/881157846.db2.gz	KWLDADGUFSMMFG-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228610439	883571430	/nfs/dbraw/zinc/57/14/30/883571430.db2.gz	VKCMBFDQWGMTJW-SNVBAGLBSA-N	1	1	324.337	1.067	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc(C3CC3)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001228610439	883571443	/nfs/dbraw/zinc/57/14/43/883571443.db2.gz	VKCMBFDQWGMTJW-SNVBAGLBSA-N	1	1	324.337	1.067	20	5		DDBDMO
COC(=O)c1ccc(O[C@@H]2CCc3[nH+]ccn3C2)cc1[N+](=O)[O-]	ZINC001234058145	887603079	/nfs/dbraw/zinc/60/30/79/887603079.db2.gz	NRLPWXWLBICKJW-LLVKDONJSA-N	1	1	317.301	1.972	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@H]3CC[NH2+]C[C@H]3F)CC2)cc1	ZINC001246085800	892408383	/nfs/dbraw/zinc/40/83/83/892408383.db2.gz	IZMYRNDSEVCMNT-CVEARBPZSA-N	1	1	322.384	1.853	20	5		DDBDMO
CN1C[C@@H]2C[C@H]1C[N@H+]2C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254479937	896455860	/nfs/dbraw/zinc/45/58/60/896455860.db2.gz	QYKYAXQYKWUBHI-IRXDYDNUSA-N	1	1	316.405	1.952	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254597367	896525328	/nfs/dbraw/zinc/52/53/28/896525328.db2.gz	CTQRIKUNHMFCLN-CJNGLKHVSA-N	1	1	317.389	1.862	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612474	896534275	/nfs/dbraw/zinc/53/42/75/896534275.db2.gz	WTGHAYFTYDWFBV-HOCLYGCPSA-N	1	1	304.346	1.947	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)n1C	ZINC000358076386	299070339	/nfs/dbraw/zinc/07/03/39/299070339.db2.gz	LVCMYORRHVGVMI-UHFFFAOYSA-N	1	1	321.312	1.463	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@@H](C)C1	ZINC000286555165	219051225	/nfs/dbraw/zinc/05/12/25/219051225.db2.gz	AAIOGCAUKXOPLB-LBPRGKRZSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@@H](C)C1	ZINC000286555165	219051229	/nfs/dbraw/zinc/05/12/29/219051229.db2.gz	AAIOGCAUKXOPLB-LBPRGKRZSA-N	1	1	320.393	1.827	20	5		DDBDMO
C[N@H+](CCC(N)=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000286554551	219051430	/nfs/dbraw/zinc/05/14/30/219051430.db2.gz	SPMGHUNGGNBNIV-UHFFFAOYSA-N	1	1	304.306	1.557	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000286554551	219051433	/nfs/dbraw/zinc/05/14/33/219051433.db2.gz	SPMGHUNGGNBNIV-UHFFFAOYSA-N	1	1	304.306	1.557	20	5		DDBDMO
C[C@@H](CNc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CC[NH+](C)CC1	ZINC000278597612	214263851	/nfs/dbraw/zinc/26/38/51/214263851.db2.gz	ZHXSCGHKCBHKLD-NSHDSACASA-N	1	1	318.381	1.519	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000295806361	529381760	/nfs/dbraw/zinc/38/17/60/529381760.db2.gz	WKWJCSZBFQOOTH-SNVBAGLBSA-N	1	1	313.329	1.765	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000495218495	529440371	/nfs/dbraw/zinc/44/03/71/529440371.db2.gz	BGIWAKVAUGPEOJ-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000495218495	529440373	/nfs/dbraw/zinc/44/03/73/529440373.db2.gz	BGIWAKVAUGPEOJ-INIZCTEOSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CC[C@@H](CCCO)C1	ZINC000452126063	231313117	/nfs/dbraw/zinc/31/31/17/231313117.db2.gz	TZIQTMRWBLGYAA-KGLIPLIRSA-N	1	1	324.377	1.429	20	5		DDBDMO
CC[C@@](C)(C(=O)OC)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC1CC1	ZINC000425513148	529493050	/nfs/dbraw/zinc/49/30/50/529493050.db2.gz	OJKCMTMFWWXJOJ-HNNXBMFYSA-N	1	1	324.381	1.845	20	5		DDBDMO
Cc1cnc(CC[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)s1	ZINC000090589739	185305602	/nfs/dbraw/zinc/30/56/02/185305602.db2.gz	MOYPGOVRELIXJV-UHFFFAOYSA-N	1	1	322.390	1.696	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+]1C	ZINC000090551641	185302727	/nfs/dbraw/zinc/30/27/27/185302727.db2.gz	NNRGUYRPHWFPJU-OLZOCXBDSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@@H]1C[C@@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551641	185302728	/nfs/dbraw/zinc/30/27/28/185302728.db2.gz	NNRGUYRPHWFPJU-OLZOCXBDSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CCN1C	ZINC000090551641	185302729	/nfs/dbraw/zinc/30/27/29/185302729.db2.gz	NNRGUYRPHWFPJU-OLZOCXBDSA-N	1	1	308.382	1.171	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000181576538	199321221	/nfs/dbraw/zinc/32/12/21/199321221.db2.gz	IPDLHFBVUAHXBB-OLZOCXBDSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000181576538	199321223	/nfs/dbraw/zinc/32/12/23/199321223.db2.gz	IPDLHFBVUAHXBB-OLZOCXBDSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000491745135	529792473	/nfs/dbraw/zinc/79/24/73/529792473.db2.gz	NTIKCVAUNSIPHG-MZBZXASESA-N	1	1	307.325	1.815	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCC[C@H]1O	ZINC000286752758	219147325	/nfs/dbraw/zinc/14/73/25/219147325.db2.gz	YUXSYXPHUOUBRE-ZIAGYGMSSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330923164	232167408	/nfs/dbraw/zinc/16/74/08/232167408.db2.gz	SGBLICMNESKOFL-QWHCGFSZSA-N	1	1	320.393	1.630	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000286770069	219158025	/nfs/dbraw/zinc/15/80/25/219158025.db2.gz	ZUBHWUABKQBPCV-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000279677535	215053591	/nfs/dbraw/zinc/05/35/91/215053591.db2.gz	DZPJWMIDIFDAMA-FZMZJTMJSA-N	1	1	321.377	1.819	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000287204792	219379255	/nfs/dbraw/zinc/37/92/55/219379255.db2.gz	DRULXQAALMMHOK-LBPRGKRZSA-N	1	1	309.366	1.650	20	5		DDBDMO
C[C@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000173035846	198179058	/nfs/dbraw/zinc/17/90/58/198179058.db2.gz	DCMLURFGFIHLTE-GFCCVEGCSA-N	1	1	320.393	1.630	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-]	ZINC000491577357	234207081	/nfs/dbraw/zinc/20/70/81/234207081.db2.gz	VRKSHLLSOWRYBQ-QZPNVGJNSA-N	1	1	307.325	1.910	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000074160859	353296226	/nfs/dbraw/zinc/29/62/26/353296226.db2.gz	AQVFYWMBYALQID-ZDUSSCGKSA-N	1	1	320.393	1.778	20	5		DDBDMO
CCC[N@H+]1CCCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC1	ZINC000074258530	353303494	/nfs/dbraw/zinc/30/34/94/353303494.db2.gz	FYGPZDDCDXTSDL-UHFFFAOYSA-N	1	1	320.393	1.877	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083170726	353706192	/nfs/dbraw/zinc/70/61/92/353706192.db2.gz	FNRXNPQHMWKNTR-UWVGGRQHSA-N	1	1	318.333	1.822	20	5		DDBDMO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000093064735	353884106	/nfs/dbraw/zinc/88/41/06/353884106.db2.gz	SUAKRCKROVPJES-ZIAGYGMSSA-N	1	1	304.350	1.079	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000093343948	353897539	/nfs/dbraw/zinc/89/75/39/353897539.db2.gz	XYLPSRHELDHNNT-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000093343948	353897542	/nfs/dbraw/zinc/89/75/42/353897542.db2.gz	XYLPSRHELDHNNT-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@]2(CCOC2)C1	ZINC000153916583	354201728	/nfs/dbraw/zinc/20/17/28/354201728.db2.gz	HQDVEVTYBSZYHE-INIZCTEOSA-N	1	1	319.361	1.954	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@]2(CCOC2)C1	ZINC000153916583	354201731	/nfs/dbraw/zinc/20/17/31/354201731.db2.gz	HQDVEVTYBSZYHE-INIZCTEOSA-N	1	1	319.361	1.954	20	5		DDBDMO
CCOC(=O)CC[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000162081211	354245487	/nfs/dbraw/zinc/24/54/87/354245487.db2.gz	DNAIMNFYFSZRNM-CYBMUJFWSA-N	1	1	324.381	1.847	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157313026	354224414	/nfs/dbraw/zinc/22/44/14/354224414.db2.gz	OOLNTIGGWVKKCX-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157313026	354224419	/nfs/dbraw/zinc/22/44/19/354224419.db2.gz	OOLNTIGGWVKKCX-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
COc1cccc(N2CC[C@H]3OCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000585781963	354841264	/nfs/dbraw/zinc/84/12/64/354841264.db2.gz	GTKLYKWYLNOSMY-QWHCGFSZSA-N	1	1	307.350	1.513	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H](O)C1CC1	ZINC000589198283	354972476	/nfs/dbraw/zinc/97/24/76/354972476.db2.gz	YPULFFCSHWALHC-CYBMUJFWSA-N	1	1	308.334	1.569	20	5		DDBDMO
Cc1cccc(C(=O)N2CC(C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000590392539	355083900	/nfs/dbraw/zinc/08/39/00/355083900.db2.gz	SEAJARSSIIWYOR-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590442362	355096390	/nfs/dbraw/zinc/09/63/90/355096390.db2.gz	FNKLKDCVNYVVSW-YPMHNXCESA-N	1	1	305.334	1.380	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590443494	355097276	/nfs/dbraw/zinc/09/72/76/355097276.db2.gz	KMXMLCYFLYROCA-ZJUUUORDSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590443494	355097280	/nfs/dbraw/zinc/09/72/80/355097280.db2.gz	KMXMLCYFLYROCA-ZJUUUORDSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590443494	355097283	/nfs/dbraw/zinc/09/72/83/355097283.db2.gz	KMXMLCYFLYROCA-ZJUUUORDSA-N	1	1	307.354	1.217	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]2CCC[C@H]2C1	ZINC000332580476	235139550	/nfs/dbraw/zinc/13/95/50/235139550.db2.gz	HTPDBWDARYWDLN-ZDUSSCGKSA-N	1	1	318.377	1.622	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCCC2)O1	ZINC000592193274	355531783	/nfs/dbraw/zinc/53/17/83/355531783.db2.gz	LDHSYUWCJLTJSM-ZDUSSCGKSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCCC2)O1	ZINC000592193274	355531786	/nfs/dbraw/zinc/53/17/86/355531786.db2.gz	LDHSYUWCJLTJSM-ZDUSSCGKSA-N	1	1	321.377	1.790	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH3+])[C@H](CC)C2)c1[N+](=O)[O-]	ZINC000592332238	355560999	/nfs/dbraw/zinc/56/09/99/355560999.db2.gz	IBHYNZFRMRFOPC-NXEZZACHSA-N	1	1	309.370	1.470	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2C2CCC2)c1	ZINC000592198750	355534363	/nfs/dbraw/zinc/53/43/63/355534363.db2.gz	RUQZTPIGHVQUAO-CABCVRRESA-N	1	1	308.382	1.807	20	5		DDBDMO
CC1(O)CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1	ZINC000177329130	198704750	/nfs/dbraw/zinc/70/47/50/198704750.db2.gz	DYTRVWZBQOPBBW-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](C)S(C)(=O)=O	ZINC000595033059	356375077	/nfs/dbraw/zinc/37/50/77/356375077.db2.gz	AJLZHVHTAXNYFS-NXEZZACHSA-N	1	1	316.379	1.687	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000081527548	192282706	/nfs/dbraw/zinc/28/27/06/192282706.db2.gz	TXNAAEADHMYQQJ-MNOVXSKESA-N	1	1	322.365	1.236	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH+](C3CCC3)CC2)c1[N+](=O)[O-]	ZINC000618214216	363516001	/nfs/dbraw/zinc/51/60/01/363516001.db2.gz	RJJADTOZPJXHQX-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595771468	356645936	/nfs/dbraw/zinc/64/59/36/356645936.db2.gz	PJEUYFDCULYJAL-NJZAAPMLSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596081381	356766064	/nfs/dbraw/zinc/76/60/64/356766064.db2.gz	HJJBZXJHDXABDO-LBPRGKRZSA-N	1	1	323.397	1.381	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596336035	356860352	/nfs/dbraw/zinc/86/03/52/356860352.db2.gz	KZGKBECPQAIGHK-LLVKDONJSA-N	1	1	306.366	1.978	20	5		DDBDMO
C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ncc([N+](=O)[O-])cc1F	ZINC000596363616	356864156	/nfs/dbraw/zinc/86/41/56/356864156.db2.gz	SWBLQAMFNOTGMI-NSHDSACASA-N	1	1	313.377	1.813	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ncc([N+](=O)[O-])cc1F	ZINC000596363616	356864161	/nfs/dbraw/zinc/86/41/61/356864161.db2.gz	SWBLQAMFNOTGMI-NSHDSACASA-N	1	1	313.377	1.813	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000597604824	357250962	/nfs/dbraw/zinc/25/09/62/357250962.db2.gz	KYDYMKLSRWRAFE-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597604824	357250969	/nfs/dbraw/zinc/25/09/69/357250969.db2.gz	KYDYMKLSRWRAFE-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000597858786	357361334	/nfs/dbraw/zinc/36/13/34/357361334.db2.gz	OZTGKSTVTHGQOB-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
CC(C)[C@@](C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(N)=O	ZINC000347698177	283262030	/nfs/dbraw/zinc/26/20/30/283262030.db2.gz	DAZSSPUETINCET-OAHLLOKOSA-N	1	1	323.349	1.451	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000598341824	357544254	/nfs/dbraw/zinc/54/42/54/357544254.db2.gz	GLCYCXTYRZPEGH-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000598342052	357544271	/nfs/dbraw/zinc/54/42/71/357544271.db2.gz	CNGAUUSPDFLLBU-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)[C@@H](CO)C2)c1	ZINC000598649096	357670286	/nfs/dbraw/zinc/67/02/86/357670286.db2.gz	VLVYQGHSLOKOAF-SMDDNHRTSA-N	1	1	322.361	1.832	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598650798	357670457	/nfs/dbraw/zinc/67/04/57/357670457.db2.gz	OXQNQBOIWBPGGZ-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598650798	357670460	/nfs/dbraw/zinc/67/04/60/357670460.db2.gz	OXQNQBOIWBPGGZ-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599681360	358022846	/nfs/dbraw/zinc/02/28/46/358022846.db2.gz	OEWPBJRJHHOHOT-NORZTCDRSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599681360	358022849	/nfs/dbraw/zinc/02/28/49/358022849.db2.gz	OEWPBJRJHHOHOT-NORZTCDRSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000599744236	358046001	/nfs/dbraw/zinc/04/60/01/358046001.db2.gz	QLNISYQNICSVPN-UHFFFAOYSA-N	1	1	301.306	1.080	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000600469599	358232384	/nfs/dbraw/zinc/23/23/84/358232384.db2.gz	CQUWBUNZCMNDQL-ZDUSSCGKSA-N	1	1	321.381	1.315	20	5		DDBDMO
C[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC(=O)N1C	ZINC000601162755	358428778	/nfs/dbraw/zinc/42/87/78/358428778.db2.gz	WMBJDGMKSDZAOJ-SNVBAGLBSA-N	1	1	300.318	1.810	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601777813	358691257	/nfs/dbraw/zinc/69/12/57/358691257.db2.gz	LMZMPZYIYWHGGL-DZGCQCFKSA-N	1	1	307.350	1.013	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC(C)(C)[C@@H]1[C@@H]1CCCO1	ZINC000602835138	359226967	/nfs/dbraw/zinc/22/69/67/359226967.db2.gz	XVKOMGXTCAAMNZ-JSGCOSHPSA-N	1	1	308.382	1.989	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@H](O)Cc1ccccc1	ZINC000602840423	359229655	/nfs/dbraw/zinc/22/96/55/359229655.db2.gz	MWBQJCRIZMZUJH-OAHLLOKOSA-N	1	1	318.377	1.635	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1[C@@H]1CCCOC1	ZINC000602851685	359239079	/nfs/dbraw/zinc/23/90/79/359239079.db2.gz	CAFQMLHOOUUXRD-KGLIPLIRSA-N	1	1	308.382	1.991	20	5		DDBDMO
CC(=O)C[N@@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000602809152	359205953	/nfs/dbraw/zinc/20/59/53/359205953.db2.gz	NMTKMLFGUDLWGY-UHFFFAOYSA-N	1	1	317.349	1.572	20	5		DDBDMO
CC(=O)C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000602809152	359205956	/nfs/dbraw/zinc/20/59/56/359205956.db2.gz	NMTKMLFGUDLWGY-UHFFFAOYSA-N	1	1	317.349	1.572	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@H](OCc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602819088	359213555	/nfs/dbraw/zinc/21/35/55/359213555.db2.gz	APMMWXGHCFVEGH-AWEZNQCLSA-N	1	1	317.349	1.514	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](OCc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602819088	359213561	/nfs/dbraw/zinc/21/35/61/359213561.db2.gz	APMMWXGHCFVEGH-AWEZNQCLSA-N	1	1	317.349	1.514	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1cn[nH]c1	ZINC000602882261	359265844	/nfs/dbraw/zinc/26/58/44/359265844.db2.gz	UEYJOOPZFWDOIO-CYBMUJFWSA-N	1	1	303.322	1.317	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3cccc(F)c3)CC2)c1	ZINC000603018050	359360415	/nfs/dbraw/zinc/36/04/15/359360415.db2.gz	ZTVUYORFFAJYFP-UHFFFAOYSA-N	1	1	319.340	1.753	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](OC)C[C@@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964943	359329179	/nfs/dbraw/zinc/32/91/79/359329179.db2.gz	WNRYUACUJOVMMJ-BBRMVZONSA-N	1	1	324.377	1.965	20	5		DDBDMO
CC[C@@]1(O)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000602982685	359337741	/nfs/dbraw/zinc/33/77/41/359337741.db2.gz	WUAJRYJQQFKXQC-GDBMZVCRSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H]2C[C@]2(O)C1	ZINC000603089710	359395999	/nfs/dbraw/zinc/39/59/99/359395999.db2.gz	SRIRMYCVPHLTPX-NHYWBVRUSA-N	1	1	305.334	1.298	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604278143	359732101	/nfs/dbraw/zinc/73/21/01/359732101.db2.gz	KGUGSKGNCCMWEQ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604278143	359732105	/nfs/dbraw/zinc/73/21/05/359732105.db2.gz	KGUGSKGNCCMWEQ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC(C)N1CC[NH+](CCCn2cccc([N+](=O)[O-])c2=O)CC1	ZINC000188307005	200225473	/nfs/dbraw/zinc/22/54/73/200225473.db2.gz	OREHBWYYDZOTDK-UHFFFAOYSA-N	1	1	308.382	1.173	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000609269444	360286062	/nfs/dbraw/zinc/28/60/62/360286062.db2.gz	QPVCPWUCNSVRDW-ZDUSSCGKSA-N	1	1	307.350	1.435	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C3CCC3)CC2)c1	ZINC000609594538	360331259	/nfs/dbraw/zinc/33/12/59/360331259.db2.gz	GZGJOFGIICAGKP-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000609448292	360307761	/nfs/dbraw/zinc/30/77/61/360307761.db2.gz	HZTXZRVNUVZTTQ-CYBMUJFWSA-N	1	1	307.325	1.948	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)CO	ZINC000609926687	360365818	/nfs/dbraw/zinc/36/58/18/360365818.db2.gz	SQBDDFPJYQZOIP-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)CO	ZINC000609926687	360365824	/nfs/dbraw/zinc/36/58/24/360365824.db2.gz	SQBDDFPJYQZOIP-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H](CO)C1)OCCO2	ZINC000610930136	360573432	/nfs/dbraw/zinc/57/34/32/360573432.db2.gz	BJFYZAQISOXJRM-LLVKDONJSA-N	1	1	308.334	1.570	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@H](CO)C1)OCCO2	ZINC000610930136	360573438	/nfs/dbraw/zinc/57/34/38/360573438.db2.gz	BJFYZAQISOXJRM-LLVKDONJSA-N	1	1	308.334	1.570	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@]3(CCOC3)C1)OCCO2	ZINC000611275641	360687304	/nfs/dbraw/zinc/68/73/04/360687304.db2.gz	PMGWRLMSVRSWEQ-MRXNPFEDSA-N	1	1	320.345	1.978	20	5		DDBDMO
COc1cc(C(=O)NCC2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000271896131	209304983	/nfs/dbraw/zinc/30/49/83/209304983.db2.gz	FWGDCZYIWPXJCU-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
C[C@@H]1CC[NH2+]C[C@@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000193407603	201047762	/nfs/dbraw/zinc/04/77/62/201047762.db2.gz	WSQAGDWVZYWXJI-SCZZXKLOSA-N	1	1	317.342	1.010	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000193824217	201129311	/nfs/dbraw/zinc/12/93/11/201129311.db2.gz	QLPHLALNMNUIKD-UHFFFAOYSA-N	1	1	306.366	1.484	20	5		DDBDMO
Nc1c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cccc1[N+](=O)[O-]	ZINC000619252029	363945944	/nfs/dbraw/zinc/94/59/44/363945944.db2.gz	FEUDVSHJUGYHKW-NEPJUHHUSA-N	1	1	322.340	1.435	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000359215274	299359181	/nfs/dbraw/zinc/35/91/81/299359181.db2.gz	AZKDMOSIKGGUHY-ZDUSSCGKSA-N	1	1	318.377	1.973	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000275318036	212267838	/nfs/dbraw/zinc/26/78/38/212267838.db2.gz	DBEZBKQSBIIHDR-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@H+](C[C@H](C)O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000275318036	212267840	/nfs/dbraw/zinc/26/78/40/212267840.db2.gz	DBEZBKQSBIIHDR-RYUDHWBXSA-N	1	1	321.377	1.689	20	5		DDBDMO
C[C@@H]1C[C@H]1N1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1=O	ZINC000350290212	284178928	/nfs/dbraw/zinc/17/89/28/284178928.db2.gz	UKJSNPDWBKUEHM-OLUVUFQESA-N	1	1	307.325	1.833	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1C[N@@H+](C2CC2)C[C@H]1C	ZINC000268278942	206604578	/nfs/dbraw/zinc/60/45/78/206604578.db2.gz	WUSBWOKCUIEELZ-MFKMUULPSA-N	1	1	321.381	1.089	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)c2c3c(ccc2[N+](=O)[O-])NCC3)[N@@H+](C)C1	ZINC000284527695	218064812	/nfs/dbraw/zinc/06/48/12/218064812.db2.gz	KRONLJAVAXMJJF-RYUDHWBXSA-N	1	1	320.393	1.718	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H]3OCCN(C)[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000284699808	218138963	/nfs/dbraw/zinc/13/89/63/218138963.db2.gz	IJXQQJVAFCZVEJ-HZPDHXFCSA-N	1	1	305.378	1.808	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[NH+](C[C@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000284825275	218193864	/nfs/dbraw/zinc/19/38/64/218193864.db2.gz	OLYUCIGKHNTJMD-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
COc1cc(N2CC[C@H]3OCC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000285209737	218334890	/nfs/dbraw/zinc/33/48/90/218334890.db2.gz	WYZSXQOYXVBSFE-ZIAGYGMSSA-N	1	1	307.350	1.513	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000109992417	194303249	/nfs/dbraw/zinc/30/32/49/194303249.db2.gz	HDSYLTDERZKPPQ-SECBINFHSA-N	1	1	303.322	1.153	20	5		DDBDMO
C[N@@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000109992417	194303252	/nfs/dbraw/zinc/30/32/52/194303252.db2.gz	HDSYLTDERZKPPQ-SECBINFHSA-N	1	1	303.322	1.153	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000109992417	194303254	/nfs/dbraw/zinc/30/32/54/194303254.db2.gz	HDSYLTDERZKPPQ-SECBINFHSA-N	1	1	303.322	1.153	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000110609634	194342655	/nfs/dbraw/zinc/34/26/55/194342655.db2.gz	KWJLLDGALFWUMG-GFCCVEGCSA-N	1	1	306.366	1.607	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269104757	207243600	/nfs/dbraw/zinc/24/36/00/207243600.db2.gz	BLXKJRCGHSHNLZ-VXGBXAGGSA-N	1	1	321.381	1.193	20	5		DDBDMO
C[C@@H](C[NH+]1CCCCC1)NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269163147	207285569	/nfs/dbraw/zinc/28/55/69/207285569.db2.gz	ZBYGOGXTKQAKOH-NSHDSACASA-N	1	1	307.350	1.905	20	5		DDBDMO
COc1cc(C[N@H+]2CCCC[C@H]2CC(N)=O)ccc1[N+](=O)[O-]	ZINC000352407569	285030142	/nfs/dbraw/zinc/03/01/42/285030142.db2.gz	VLFYHSXPEXHJNC-LBPRGKRZSA-N	1	1	307.350	1.833	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CO)C1	ZINC000120094124	195096323	/nfs/dbraw/zinc/09/63/23/195096323.db2.gz	QSDZZTZEPBGZMN-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CO)C1	ZINC000120094124	195096326	/nfs/dbraw/zinc/09/63/26/195096326.db2.gz	QSDZZTZEPBGZMN-LBPRGKRZSA-N	1	1	307.350	1.546	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000155468373	197057616	/nfs/dbraw/zinc/05/76/16/197057616.db2.gz	ITJSXGXXTVQNPJ-BETUJISGSA-N	1	1	321.377	1.915	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CC[N@H+](C)C[C@@H]1C	ZINC000121056626	195288975	/nfs/dbraw/zinc/28/89/75/195288975.db2.gz	CYWCVXRBMAGIBZ-WCQYABFASA-N	1	1	323.397	1.288	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000451576902	533411619	/nfs/dbraw/zinc/41/16/19/533411619.db2.gz	VCDXAVXYBVYCHT-BXUZGUMPSA-N	1	1	307.350	1.890	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000451576902	533411623	/nfs/dbraw/zinc/41/16/23/533411623.db2.gz	VCDXAVXYBVYCHT-BXUZGUMPSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC(=O)CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C	ZINC000074321308	406908001	/nfs/dbraw/zinc/90/80/01/406908001.db2.gz	SSARNBSGBFNPJD-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
COC(=O)CC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C	ZINC000074321308	406908005	/nfs/dbraw/zinc/90/80/05/406908005.db2.gz	SSARNBSGBFNPJD-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
CC(C)[C@H](CNc1ncccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000045851954	407049863	/nfs/dbraw/zinc/04/98/63/407049863.db2.gz	CMFBKZHZJSNQHI-AWEZNQCLSA-N	1	1	307.398	1.674	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000052556126	407152682	/nfs/dbraw/zinc/15/26/82/407152682.db2.gz	HOLXGRGRZUYEFY-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
CCN(CC)C(=O)C[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000065208998	407240728	/nfs/dbraw/zinc/24/07/28/407240728.db2.gz	QRZGYIIWDDZSQT-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
CCN(CC)C(=O)C[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000065208998	407240730	/nfs/dbraw/zinc/24/07/30/407240730.db2.gz	QRZGYIIWDDZSQT-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000106919702	407366912	/nfs/dbraw/zinc/36/69/12/407366912.db2.gz	NZRYZTRRNRLLFA-SNVBAGLBSA-N	1	1	320.349	1.442	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C[C@@H](C)O)C(C)C	ZINC000107043094	407368426	/nfs/dbraw/zinc/36/84/26/407368426.db2.gz	OUKSESGIEFHOKF-GFCCVEGCSA-N	1	1	309.366	1.933	20	5		DDBDMO
CCC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC[N@H+]1CCOC	ZINC000271006143	407465059	/nfs/dbraw/zinc/46/50/59/407465059.db2.gz	YACOKLAJNPOHPH-LBPRGKRZSA-N	1	1	324.381	1.496	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@@H](C[NH+]3CCOCC3)C2)n1	ZINC000127556650	407440510	/nfs/dbraw/zinc/44/05/10/407440510.db2.gz	VCYGLGCKSWBMJE-ZDUSSCGKSA-N	1	1	306.366	1.457	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000127574294	407442936	/nfs/dbraw/zinc/44/29/36/407442936.db2.gz	HOTGFEGXIAZZMS-MWLCHTKSSA-N	1	1	324.356	1.871	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000170791763	407508743	/nfs/dbraw/zinc/50/87/43/407508743.db2.gz	JXGVUAVCMHKBDG-UHFFFAOYSA-N	1	1	319.321	1.213	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000170791763	407508748	/nfs/dbraw/zinc/50/87/48/407508748.db2.gz	JXGVUAVCMHKBDG-UHFFFAOYSA-N	1	1	319.321	1.213	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3ccccc3)C2)c1	ZINC000266528361	407546488	/nfs/dbraw/zinc/54/64/88/407546488.db2.gz	LCKZXHWNLNPITC-GDBMZVCRSA-N	1	1	316.361	1.642	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000171200834	407628294	/nfs/dbraw/zinc/62/82/94/407628294.db2.gz	SOQNTCRHCLMWFC-UHFFFAOYSA-N	1	1	324.381	1.015	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000152429367	407632730	/nfs/dbraw/zinc/63/27/30/407632730.db2.gz	WKSFXKXJSOPYFA-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCc1cnccn1	ZINC000271334515	407640799	/nfs/dbraw/zinc/64/07/99/407640799.db2.gz	MGQPCKJPHHNWGU-UHFFFAOYSA-N	1	1	302.334	1.938	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000132784690	407805123	/nfs/dbraw/zinc/80/51/23/407805123.db2.gz	YOWZCMSTPLVMMY-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000118114593	407894971	/nfs/dbraw/zinc/89/49/71/407894971.db2.gz	KENBRXLOWNFJCZ-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](CC(C)C)C2)c1[N+](=O)[O-]	ZINC000268280899	407982775	/nfs/dbraw/zinc/98/27/75/407982775.db2.gz	YCHCOGQEUNRQAL-LLVKDONJSA-N	1	1	309.370	1.334	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)NCC[N@H+]1CCCOCC1	ZINC000189475602	408028148	/nfs/dbraw/zinc/02/81/48/408028148.db2.gz	NJZPVJZVOMHDMW-UHFFFAOYSA-N	1	1	321.377	1.366	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000182116276	408073470	/nfs/dbraw/zinc/07/34/70/408073470.db2.gz	BMDZQYWIMBULOX-CYBMUJFWSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190112752	408168259	/nfs/dbraw/zinc/16/82/59/408168259.db2.gz	IIKUBCRXERDDMB-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190112752	408168266	/nfs/dbraw/zinc/16/82/66/408168266.db2.gz	IIKUBCRXERDDMB-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000190425360	408242628	/nfs/dbraw/zinc/24/26/28/408242628.db2.gz	YYGXMRRHQPYISJ-MBNYWOFBSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)[C@H](c2ccccc2)C1	ZINC000183082216	408322751	/nfs/dbraw/zinc/32/27/51/408322751.db2.gz	JFRZUXAAKHHOBU-INIZCTEOSA-N	1	1	315.377	1.780	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000246483871	408270286	/nfs/dbraw/zinc/27/02/86/408270286.db2.gz	QBSBOWGDUCLFAG-DOMZBBRYSA-N	1	1	321.377	1.801	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000246483871	408270292	/nfs/dbraw/zinc/27/02/92/408270292.db2.gz	QBSBOWGDUCLFAG-DOMZBBRYSA-N	1	1	321.377	1.801	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H](C[NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000269330261	408271104	/nfs/dbraw/zinc/27/11/04/408271104.db2.gz	FDVMAKAWNRDTRE-SNVBAGLBSA-N	1	1	309.370	1.465	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@H]1O	ZINC000246760628	408333103	/nfs/dbraw/zinc/33/31/03/408333103.db2.gz	OVGNKEVTBYGJGD-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCC[C@H]1O	ZINC000246760628	408333109	/nfs/dbraw/zinc/33/31/09/408333109.db2.gz	OVGNKEVTBYGJGD-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000183196567	408349579	/nfs/dbraw/zinc/34/95/79/408349579.db2.gz	QYLOCRBARMMPDC-QJPTWQEYSA-N	1	1	307.350	1.625	20	5		DDBDMO
NC(=O)c1ccc(CN2CCC[N@H+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000172346349	162271164	/nfs/dbraw/zinc/27/11/64/162271164.db2.gz	WCLFMTSGCFFIJU-UHFFFAOYSA-N	1	1	318.377	1.364	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662240	408383247	/nfs/dbraw/zinc/38/32/47/408383247.db2.gz	QVMSHLBTGJHWHW-HUUCEWRRSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662240	408383249	/nfs/dbraw/zinc/38/32/49/408383249.db2.gz	QVMSHLBTGJHWHW-HUUCEWRRSA-N	1	1	319.361	1.371	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@H](C)O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000247080513	408403825	/nfs/dbraw/zinc/40/38/25/408403825.db2.gz	HAKDHCBKAAFMLC-OLZOCXBDSA-N	1	1	307.394	1.790	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000274540231	408443734	/nfs/dbraw/zinc/44/37/34/408443734.db2.gz	VXCFHNKNKYESMX-LLVKDONJSA-N	1	1	323.397	1.873	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000270360964	408503172	/nfs/dbraw/zinc/50/31/72/408503172.db2.gz	RMPJKVSNIHWCBE-UHFFFAOYSA-N	1	1	317.349	1.642	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000270387245	408513770	/nfs/dbraw/zinc/51/37/70/408513770.db2.gz	RJHLFQJIERXJRQ-CQSZACIVSA-N	1	1	308.382	1.830	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000177093987	408517327	/nfs/dbraw/zinc/51/73/27/408517327.db2.gz	IWCMWSZXSGEZSB-PWSUYJOCSA-N	1	1	319.361	1.958	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000192660956	408627815	/nfs/dbraw/zinc/62/78/15/408627815.db2.gz	VDCMCLVLVQQJEK-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)CC2(C)C)c1	ZINC000270909556	408736326	/nfs/dbraw/zinc/73/63/26/408736326.db2.gz	LJRHOJRAIHEISG-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)CC2(C)C)c1	ZINC000270909556	408736329	/nfs/dbraw/zinc/73/63/29/408736329.db2.gz	LJRHOJRAIHEISG-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@H]1O	ZINC000249555505	408741596	/nfs/dbraw/zinc/74/15/96/408741596.db2.gz	JOIWIKXANJMOSS-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@H]1O	ZINC000249555505	408741601	/nfs/dbraw/zinc/74/16/01/408741601.db2.gz	JOIWIKXANJMOSS-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000249582261	408745316	/nfs/dbraw/zinc/74/53/16/408745316.db2.gz	ROXWVCJZHQSACB-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000276553288	408881959	/nfs/dbraw/zinc/88/19/59/408881959.db2.gz	KODXESWOJLJMHU-LLVKDONJSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280795054	408835916	/nfs/dbraw/zinc/83/59/16/408835916.db2.gz	RLWJNBRSEQYRJB-ZUZCIYMTSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[N@@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@@H]2C1	ZINC000285826300	408871397	/nfs/dbraw/zinc/87/13/97/408871397.db2.gz	PDGPJDBCRMDJGP-NXEZZACHSA-N	1	1	311.363	1.201	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@@H]2C1	ZINC000285826300	408871400	/nfs/dbraw/zinc/87/14/00/408871400.db2.gz	PDGPJDBCRMDJGP-NXEZZACHSA-N	1	1	311.363	1.201	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ncnc2sc([N+](=O)[O-])cc21	ZINC000287304869	409016721	/nfs/dbraw/zinc/01/67/21/409016721.db2.gz	LOEOOZAHOHWQPG-VIFPVBQESA-N	1	1	322.394	1.257	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCO1	ZINC000293108281	409051975	/nfs/dbraw/zinc/05/19/75/409051975.db2.gz	LMXOEIYLTPMOSU-HNNXBMFYSA-N	1	1	321.377	1.941	20	5		DDBDMO
Cc1nc(N(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000278867078	409103774	/nfs/dbraw/zinc/10/37/74/409103774.db2.gz	NIMOPJVDCDQVPH-TXEJJXNPSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1nc(N(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000278867078	409103777	/nfs/dbraw/zinc/10/37/77/409103777.db2.gz	NIMOPJVDCDQVPH-TXEJJXNPSA-N	1	1	308.382	1.844	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293865950	409196831	/nfs/dbraw/zinc/19/68/31/409196831.db2.gz	KWXPAOAENCECMZ-CQSZACIVSA-N	1	1	307.354	1.048	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293865950	409196833	/nfs/dbraw/zinc/19/68/33/409196833.db2.gz	KWXPAOAENCECMZ-CQSZACIVSA-N	1	1	307.354	1.048	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293865950	409196835	/nfs/dbraw/zinc/19/68/35/409196835.db2.gz	KWXPAOAENCECMZ-CQSZACIVSA-N	1	1	307.354	1.048	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283428222	409154737	/nfs/dbraw/zinc/15/47/37/409154737.db2.gz	IZXYEVKKLOPBLH-SECBINFHSA-N	1	1	310.329	1.530	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](C)N1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293872857	409198325	/nfs/dbraw/zinc/19/83/25/409198325.db2.gz	VACFQQYKYWAMPZ-QWHCGFSZSA-N	1	1	321.425	1.464	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](C)N1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293872851	409198385	/nfs/dbraw/zinc/19/83/85/409198385.db2.gz	VACFQQYKYWAMPZ-CHWSQXEVSA-N	1	1	321.425	1.464	20	5		DDBDMO
O=c1nc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)[nH][nH]1	ZINC000289452636	409275358	/nfs/dbraw/zinc/27/53/58/409275358.db2.gz	PFGXZJDBPWYVIA-LLVKDONJSA-N	1	1	303.322	1.386	20	5		DDBDMO
O=C(CCNc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000280364229	409299415	/nfs/dbraw/zinc/29/94/15/409299415.db2.gz	YIZRKDNTIKWQHQ-UHFFFAOYSA-N	1	1	318.377	1.775	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000294908300	409306514	/nfs/dbraw/zinc/30/65/14/409306514.db2.gz	SCBNOVICCTYEFS-SNVBAGLBSA-N	1	1	324.356	1.624	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000280537990	409346842	/nfs/dbraw/zinc/34/68/42/409346842.db2.gz	PLMLNRRPYFNXOW-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000280537990	409346851	/nfs/dbraw/zinc/34/68/51/409346851.db2.gz	PLMLNRRPYFNXOW-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](CC(N)=O)c1ccccc1	ZINC000280552671	409355901	/nfs/dbraw/zinc/35/59/01/409355901.db2.gz	QOLNLTLCHXZCDS-ZDUSSCGKSA-N	1	1	317.349	1.340	20	5		DDBDMO
COC(=O)[C@@H](C)[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000280715561	409422684	/nfs/dbraw/zinc/42/26/84/409422684.db2.gz	JQKDNYUKNWTTLV-LLVKDONJSA-N	1	1	323.349	1.725	20	5		DDBDMO
COC(=O)[C@@H](C)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000280715561	409422688	/nfs/dbraw/zinc/42/26/88/409422688.db2.gz	JQKDNYUKNWTTLV-LLVKDONJSA-N	1	1	323.349	1.725	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[NH2+]C[C@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000295355970	409448924	/nfs/dbraw/zinc/44/89/24/409448924.db2.gz	ZCUKGGOLGHCGTJ-HNNXBMFYSA-N	1	1	309.341	1.931	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000317075302	164025165	/nfs/dbraw/zinc/02/51/65/164025165.db2.gz	ZCOPUBFPRKJFTO-WDEREUQCSA-N	1	1	304.350	1.534	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198836	164026164	/nfs/dbraw/zinc/02/61/64/164026164.db2.gz	NMIWHHPMHQMUFW-COPLHBTASA-N	1	1	305.334	1.236	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198836	164026165	/nfs/dbraw/zinc/02/61/65/164026165.db2.gz	NMIWHHPMHQMUFW-COPLHBTASA-N	1	1	305.334	1.236	20	5		DDBDMO
CNc1c(C(=O)N(C)C[C@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC000317213091	164026198	/nfs/dbraw/zinc/02/61/98/164026198.db2.gz	AXIQEYMEIDAKBQ-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2NC)C1	ZINC000317244584	164027302	/nfs/dbraw/zinc/02/73/02/164027302.db2.gz	FJFXXBWDSSVXCA-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H]2CCC[N@@H+](CCCO)C2)cc1[N+](=O)[O-]	ZINC000295405318	409469339	/nfs/dbraw/zinc/46/93/39/409469339.db2.gz	IXZOTRPIHRPHHK-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)CN(C)C	ZINC000344855574	409533557	/nfs/dbraw/zinc/53/35/57/409533557.db2.gz	GJJFEKCRZUZRGL-OIQJVACTSA-N	1	1	307.394	1.900	20	5		DDBDMO
Cc1nnc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH]1	ZINC000349372597	409813981	/nfs/dbraw/zinc/81/39/81/409813981.db2.gz	MWBFIJVSYGSFIE-LLVKDONJSA-N	1	1	305.342	1.097	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000349372597	409813987	/nfs/dbraw/zinc/81/39/87/409813987.db2.gz	MWBFIJVSYGSFIE-LLVKDONJSA-N	1	1	305.342	1.097	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000342938708	410013149	/nfs/dbraw/zinc/01/31/49/410013149.db2.gz	YLCKWYJLAPFHJZ-WDEREUQCSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000342938708	410013155	/nfs/dbraw/zinc/01/31/55/410013155.db2.gz	YLCKWYJLAPFHJZ-WDEREUQCSA-N	1	1	322.365	1.614	20	5		DDBDMO
C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C(C)(C)C1	ZINC000332288879	410044016	/nfs/dbraw/zinc/04/40/16/410044016.db2.gz	ZCPZTXCUTJCSKE-UHFFFAOYSA-N	1	1	303.366	1.997	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000298716974	410364521	/nfs/dbraw/zinc/36/45/21/410364521.db2.gz	JMNZZTCZMJYHQK-JTQLQIEISA-N	1	1	322.317	1.456	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000298716974	410364526	/nfs/dbraw/zinc/36/45/26/410364526.db2.gz	JMNZZTCZMJYHQK-JTQLQIEISA-N	1	1	322.317	1.456	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000343415856	410432408	/nfs/dbraw/zinc/43/24/08/410432408.db2.gz	LPVLZNPDNXGZJM-NFAWXSAZSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1c(CNC(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000358605124	410494675	/nfs/dbraw/zinc/49/46/75/410494675.db2.gz	HULYAEWPPNNNLH-CYBMUJFWSA-N	1	1	318.377	1.939	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1	ZINC000301084451	410652107	/nfs/dbraw/zinc/65/21/07/410652107.db2.gz	DFEHSNJDGBXLLG-SNVBAGLBSA-N	1	1	317.349	1.997	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000330464732	410711856	/nfs/dbraw/zinc/71/18/56/410711856.db2.gz	FGJVMEXIJZIKML-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000330464732	410711861	/nfs/dbraw/zinc/71/18/61/410711861.db2.gz	FGJVMEXIJZIKML-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H]1CCNC1=O	ZINC000340217358	410764190	/nfs/dbraw/zinc/76/41/90/410764190.db2.gz	BGJAXGRVDNRRMK-CYBMUJFWSA-N	1	1	320.349	1.052	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000330579885	410794571	/nfs/dbraw/zinc/79/45/71/410794571.db2.gz	IIXFFANDUBLSPZ-VXGBXAGGSA-N	1	1	307.350	1.525	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2[C@@H](O)C(F)(F)F)n1	ZINC000340205517	410749818	/nfs/dbraw/zinc/74/98/18/410749818.db2.gz	YLPRUAYYCKUGKA-GXSJLCMTSA-N	1	1	322.287	1.569	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@@H](O)C1	ZINC000330652073	410849193	/nfs/dbraw/zinc/84/91/93/410849193.db2.gz	KLMZZELQQXHDAC-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000353236592	410869822	/nfs/dbraw/zinc/86/98/22/410869822.db2.gz	SWFCGUJCGKVMOR-SMDDNHRTSA-N	1	1	307.350	1.667	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344045602	410917532	/nfs/dbraw/zinc/91/75/32/410917532.db2.gz	JYIHZNKDDBGRSQ-WHOFXGATSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000344045602	410917538	/nfs/dbraw/zinc/91/75/38/410917538.db2.gz	JYIHZNKDDBGRSQ-WHOFXGATSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344045600	410918497	/nfs/dbraw/zinc/91/84/97/410918497.db2.gz	JYIHZNKDDBGRSQ-LNSITVRQSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344045600	410918503	/nfs/dbraw/zinc/91/85/03/410918503.db2.gz	JYIHZNKDDBGRSQ-LNSITVRQSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cn1nccc1C[N@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000348372757	410938545	/nfs/dbraw/zinc/93/85/45/410938545.db2.gz	OPJHJOMOQTXUEX-CQSZACIVSA-N	1	1	320.349	1.200	20	5		DDBDMO
Cn1nccc1C[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000348372757	410938549	/nfs/dbraw/zinc/93/85/49/410938549.db2.gz	OPJHJOMOQTXUEX-CQSZACIVSA-N	1	1	320.349	1.200	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@H](O)C[C@@H]2CO)o1	ZINC000359974850	410976880	/nfs/dbraw/zinc/97/68/80/410976880.db2.gz	PLDGINFVUMTOQM-VXGBXAGGSA-N	1	1	318.329	1.782	20	5		DDBDMO
C[C@@H](O)CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353528657	411049365	/nfs/dbraw/zinc/04/93/65/411049365.db2.gz	OLRUYFITWCWUOA-RISCZKNCSA-N	1	1	304.350	1.778	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)n1	ZINC000191463007	222102321	/nfs/dbraw/zinc/10/23/21/222102321.db2.gz	PMDUFURWKMGPSQ-JTQLQIEISA-N	1	1	321.337	1.437	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+](CC(C)C)C2)n1	ZINC000191842508	222109371	/nfs/dbraw/zinc/10/93/71/222109371.db2.gz	LAXKJRAHLXQQOY-LBPRGKRZSA-N	1	1	323.397	1.519	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C2)C1	ZINC000293617670	418580480	/nfs/dbraw/zinc/58/04/80/418580480.db2.gz	DGTYAOBFRUIMHQ-HNNXBMFYSA-N	1	1	322.340	1.484	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000193200129	222146757	/nfs/dbraw/zinc/14/67/57/222146757.db2.gz	KPIQLLVZWKTPMG-GFCCVEGCSA-N	1	1	318.377	1.878	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3CC[N@H+](C)[C@@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000375037017	418593306	/nfs/dbraw/zinc/59/33/06/418593306.db2.gz	HXURXPBZETUEKB-BXUZGUMPSA-N	1	1	318.377	1.652	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000342087345	418627138	/nfs/dbraw/zinc/62/71/38/418627138.db2.gz	BKNPAXYHAPIARE-UHFFFAOYSA-N	1	1	305.338	1.996	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392285	418633738	/nfs/dbraw/zinc/63/37/38/418633738.db2.gz	NNEFQRNJVKMRKE-RYUDHWBXSA-N	1	1	323.397	1.731	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392285	418633740	/nfs/dbraw/zinc/63/37/40/418633740.db2.gz	NNEFQRNJVKMRKE-RYUDHWBXSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC(C)N1CC[C@@H]([N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403846	418635270	/nfs/dbraw/zinc/63/52/70/418635270.db2.gz	MOIIZZYJZIWZNZ-GXTWGEPZSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC(C)N1CC[C@@H]([N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)C1=O	ZINC000375403846	418635272	/nfs/dbraw/zinc/63/52/72/418635272.db2.gz	MOIIZZYJZIWZNZ-GXTWGEPZSA-N	1	1	321.381	1.438	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CC[N@H+]1CCCOCC1)CCO2	ZINC000361380913	418640016	/nfs/dbraw/zinc/64/00/16/418640016.db2.gz	ZCLREBZSNREPMD-UHFFFAOYSA-N	1	1	321.377	1.512	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000367927431	418658999	/nfs/dbraw/zinc/65/89/99/418658999.db2.gz	OHCFVTAFYIXWAF-GFCCVEGCSA-N	1	1	321.377	1.690	20	5		DDBDMO
COc1cc(C[NH2+][C@@H]2CCc3[nH]cnc3C2)c([N+](=O)[O-])cc1O	ZINC000368087338	418688373	/nfs/dbraw/zinc/68/83/73/418688373.db2.gz	ARNXLSWGIZQWHH-SNVBAGLBSA-N	1	1	318.333	1.679	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000408092757	418787405	/nfs/dbraw/zinc/78/74/05/418787405.db2.gz	ZRAIIPQQDYTWGJ-ZJUUUORDSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000408092757	418787407	/nfs/dbraw/zinc/78/74/07/418787407.db2.gz	ZRAIIPQQDYTWGJ-ZJUUUORDSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000408092757	418787408	/nfs/dbraw/zinc/78/74/08/418787408.db2.gz	ZRAIIPQQDYTWGJ-ZJUUUORDSA-N	1	1	309.370	1.606	20	5		DDBDMO
COc1ccc(CN[C@@H]2CCOC[C@H]2[C@@H](C)[NH3+])cc1[N+](=O)[O-]	ZINC000422945644	227273944	/nfs/dbraw/zinc/27/39/44/227273944.db2.gz	NOEDKENZSZCAOH-KGYLQXTDSA-N	1	1	309.366	1.445	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000365572346	418877408	/nfs/dbraw/zinc/87/74/08/418877408.db2.gz	LEFMFKBVTJFPDQ-BYNQJWBRSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000365572346	418877410	/nfs/dbraw/zinc/87/74/10/418877410.db2.gz	LEFMFKBVTJFPDQ-BYNQJWBRSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000365572346	418877413	/nfs/dbraw/zinc/87/74/13/418877413.db2.gz	LEFMFKBVTJFPDQ-BYNQJWBRSA-N	1	1	323.418	1.912	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H](CO)C1	ZINC000420930531	419361475	/nfs/dbraw/zinc/36/14/75/419361475.db2.gz	CKRPACNPDIIOSE-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)C[C@H](CO)C1	ZINC000420930531	419361479	/nfs/dbraw/zinc/36/14/79/419361479.db2.gz	CKRPACNPDIIOSE-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)N(C)C)C1	ZINC000411961881	419523675	/nfs/dbraw/zinc/52/36/75/419523675.db2.gz	YLYPPLNVIYSGTJ-GFCCVEGCSA-N	1	1	321.377	1.904	20	5		DDBDMO
Cc1nn(Cc2cccc(C[NH+]3CCOCC3)c2)cc1[N+](=O)[O-]	ZINC000421221354	419529355	/nfs/dbraw/zinc/52/93/55/419529355.db2.gz	YQVALMZNOISAPH-UHFFFAOYSA-N	1	1	316.361	1.980	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000422018758	419808973	/nfs/dbraw/zinc/80/89/73/419808973.db2.gz	JMNGYKSFCSONKP-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCSC[C@@H]1CCO	ZINC000430220982	420092598	/nfs/dbraw/zinc/09/25/98/420092598.db2.gz	RFRZANMWEFCQRU-ZDUSSCGKSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCSC[C@@H]1CCO	ZINC000430220982	420092600	/nfs/dbraw/zinc/09/26/00/420092600.db2.gz	RFRZANMWEFCQRU-ZDUSSCGKSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](c3nnc[nH]3)C2)c([N+](=O)[O-])cc1F	ZINC000425551741	420415095	/nfs/dbraw/zinc/41/50/95/420415095.db2.gz	QUIDNAVPNSTFFG-SECBINFHSA-N	1	1	321.312	1.850	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](c3nnc[nH]3)C2)c([N+](=O)[O-])cc1F	ZINC000425551741	420415098	/nfs/dbraw/zinc/41/50/98/420415098.db2.gz	QUIDNAVPNSTFFG-SECBINFHSA-N	1	1	321.312	1.850	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)nc2sccn21	ZINC000450787350	420530944	/nfs/dbraw/zinc/53/09/44/420530944.db2.gz	FOWZDNAOVWYBSI-AOOOYVTPSA-N	1	1	323.378	1.579	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000450792630	420532440	/nfs/dbraw/zinc/53/24/40/420532440.db2.gz	OJEONDCPHFOVPL-TXEJJXNPSA-N	1	1	309.370	1.395	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)C1	ZINC000493046675	420743160	/nfs/dbraw/zinc/74/31/60/420743160.db2.gz	KJVNOAOTUOMQJW-YVACAVLKSA-N	1	1	307.325	1.768	20	5		DDBDMO
C[C@H](NC(=O)NC[C@]1(O)CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000458894432	420756135	/nfs/dbraw/zinc/75/61/35/420756135.db2.gz	YJCZUGXBDWYSHD-XHDPSFHLSA-N	1	1	322.365	1.022	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000445132750	420761529	/nfs/dbraw/zinc/76/15/29/420761529.db2.gz	GYHZMFCAICFXRB-ZJUUUORDSA-N	1	1	308.338	1.250	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)ccc1[N+](=O)[O-]	ZINC000454747712	420919053	/nfs/dbraw/zinc/91/90/53/420919053.db2.gz	CAXAUMQMJWENAA-ZYHUDNBSSA-N	1	1	319.365	1.388	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000470182975	420932478	/nfs/dbraw/zinc/93/24/78/420932478.db2.gz	LHFYVTZGTRSOBY-CWJQNXGWSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)O[C@H](C(N)=O)C1	ZINC000470182975	420932481	/nfs/dbraw/zinc/93/24/81/420932481.db2.gz	LHFYVTZGTRSOBY-CWJQNXGWSA-N	1	1	319.361	1.573	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)CCOc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000456169006	421111825	/nfs/dbraw/zinc/11/18/25/421111825.db2.gz	PBBMGHRGVFMSJL-OCCSQVGLSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000449787387	421084733	/nfs/dbraw/zinc/08/47/33/421084733.db2.gz	VEEJEDSCXCOQMY-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000489924023	421181117	/nfs/dbraw/zinc/18/11/17/421181117.db2.gz	KWFVDIMHRCYMPL-LLVKDONJSA-N	1	1	315.333	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NC[C@H]3CCC[N@@H+]3CCCO)[nH]c2c1	ZINC000450598816	421215156	/nfs/dbraw/zinc/21/51/56/421215156.db2.gz	RLULARZWAJTRGR-GFCCVEGCSA-N	1	1	319.365	1.152	20	5		DDBDMO
C[C@]1(CO)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000546102805	421284115	/nfs/dbraw/zinc/28/41/15/421284115.db2.gz	MTNGUYTVUCFGDC-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000546102805	421284117	/nfs/dbraw/zinc/28/41/17/421284117.db2.gz	MTNGUYTVUCFGDC-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CN1C[C@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC1=O	ZINC000518790859	421667291	/nfs/dbraw/zinc/66/72/91/421667291.db2.gz	PJZJBOZVDANUIY-LLVKDONJSA-N	1	1	317.349	1.524	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC1=O	ZINC000518790859	421667293	/nfs/dbraw/zinc/66/72/93/421667293.db2.gz	PJZJBOZVDANUIY-LLVKDONJSA-N	1	1	317.349	1.524	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)CCOc2ccccc2[N+](=O)[O-])CCC1=O	ZINC000518674175	421662601	/nfs/dbraw/zinc/66/26/01/421662601.db2.gz	BPDYIODSOXWSLV-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000557556169	421777134	/nfs/dbraw/zinc/77/71/34/421777134.db2.gz	VJOSZJDOWVELRN-CYBMUJFWSA-N	1	1	314.345	1.979	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000582011583	422088680	/nfs/dbraw/zinc/08/86/80/422088680.db2.gz	HQHMHGHEEYDFLT-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000582011584	422088833	/nfs/dbraw/zinc/08/88/33/422088833.db2.gz	HQHMHGHEEYDFLT-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
[NH3+]CCC1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000578079089	422491081	/nfs/dbraw/zinc/49/10/81/422491081.db2.gz	VSIGFRJBAWIOFZ-UHFFFAOYSA-N	1	1	317.349	1.672	20	5		DDBDMO
C[C@@H]1CN(C(=O)NCc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC000578958056	422676464	/nfs/dbraw/zinc/67/64/64/422676464.db2.gz	NUIHUOHBAKOXLQ-TXEJJXNPSA-N	1	1	306.366	1.829	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C	ZINC000341577689	271125970	/nfs/dbraw/zinc/12/59/70/271125970.db2.gz	RYVFUWJXDHBKGM-ZIAGYGMSSA-N	1	1	322.409	1.561	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000342362546	271389777	/nfs/dbraw/zinc/38/97/77/271389777.db2.gz	MDBOABJUIFRCJJ-NSHDSACASA-N	1	1	308.338	1.107	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000342362546	271389778	/nfs/dbraw/zinc/38/97/78/271389778.db2.gz	MDBOABJUIFRCJJ-NSHDSACASA-N	1	1	308.338	1.107	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000345933141	272369623	/nfs/dbraw/zinc/36/96/23/272369623.db2.gz	AJOUXZLKUHILBL-NEPJUHHUSA-N	1	1	309.370	1.123	20	5		DDBDMO
CC(=O)[C@@](C)(O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000330830394	273495383	/nfs/dbraw/zinc/49/53/83/273495383.db2.gz	JNYINTUVRINJDD-HNNXBMFYSA-N	1	1	307.350	1.057	20	5		DDBDMO
COCC[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1C	ZINC000153719229	274032067	/nfs/dbraw/zinc/03/20/67/274032067.db2.gz	DQYXNGHDYALSGQ-SNVBAGLBSA-N	1	1	314.773	1.800	20	5		DDBDMO
COCC[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])C[C@H]1C	ZINC000153719229	274032069	/nfs/dbraw/zinc/03/20/69/274032069.db2.gz	DQYXNGHDYALSGQ-SNVBAGLBSA-N	1	1	314.773	1.800	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCCNC1	ZINC000414866945	274206615	/nfs/dbraw/zinc/20/66/15/274206615.db2.gz	NMYSGJYNAAXFHI-AAEUAGOBSA-N	1	1	306.366	1.654	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000330559657	278190606	/nfs/dbraw/zinc/19/06/06/278190606.db2.gz	HJIUFEVWOKUZIO-NWDGAFQWSA-N	1	1	308.382	1.784	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+](C2CC2)[C@H]2CCS(=O)(=O)C2)cc1	ZINC000264580157	280362994	/nfs/dbraw/zinc/36/29/94/280362994.db2.gz	CBESRBKEPVCGJY-HNNXBMFYSA-N	1	1	324.402	1.789	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+](C2CC2)[C@H]2CCS(=O)(=O)C2)cc1	ZINC000264580157	280362996	/nfs/dbraw/zinc/36/29/96/280362996.db2.gz	CBESRBKEPVCGJY-HNNXBMFYSA-N	1	1	324.402	1.789	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000358059671	299060258	/nfs/dbraw/zinc/06/02/58/299060258.db2.gz	SEDRCFHVRMCBAM-MRXNPFEDSA-N	1	1	321.377	1.055	20	5		DDBDMO
COc1ccc(CNC(=O)[C@H]2C[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000362588269	300102677	/nfs/dbraw/zinc/10/26/77/300102677.db2.gz	KHXCRGXFWCFQNU-PWSUYJOCSA-N	1	1	307.350	1.417	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000363035998	300201443	/nfs/dbraw/zinc/20/14/43/300201443.db2.gz	ZKLLEKZKCSPLCZ-UHFFFAOYSA-N	1	1	321.381	1.187	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CC[N@@H+]1C1CCN(C)CC1	ZINC000364383748	300387390	/nfs/dbraw/zinc/38/73/90/300387390.db2.gz	MPXBDTZNEXJFFM-CYBMUJFWSA-N	1	1	319.409	1.595	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CC[N@H+]1C1CCN(C)CC1	ZINC000364383748	300387391	/nfs/dbraw/zinc/38/73/91/300387391.db2.gz	MPXBDTZNEXJFFM-CYBMUJFWSA-N	1	1	319.409	1.595	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](O)C2(CC2)C1	ZINC000364435563	300397016	/nfs/dbraw/zinc/39/70/16/300397016.db2.gz	SPKBFIKBSMPKSJ-ZWNOBZJWSA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](O)C2(CC2)C1	ZINC000364435563	300397018	/nfs/dbraw/zinc/39/70/18/300397018.db2.gz	SPKBFIKBSMPKSJ-ZWNOBZJWSA-N	1	1	305.334	1.379	20	5		DDBDMO
Cc1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973690	301114673	/nfs/dbraw/zinc/11/46/73/301114673.db2.gz	KZIZBVIZJKFZQW-GUTXKFCHSA-N	1	1	303.362	1.989	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973690	301114675	/nfs/dbraw/zinc/11/46/75/301114675.db2.gz	KZIZBVIZJKFZQW-GUTXKFCHSA-N	1	1	303.362	1.989	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@@H]3CO)o2)c1	ZINC000370385925	301328240	/nfs/dbraw/zinc/32/82/40/301328240.db2.gz	HLDKAWJFYPQMRQ-ZIAGYGMSSA-N	1	1	318.329	1.782	20	5		DDBDMO
CN1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C[C@H]1c1ccccc1Cl	ZINC000377123230	302145782	/nfs/dbraw/zinc/14/57/82/302145782.db2.gz	OPKBEFNHOBRNLD-XBFCOCLRSA-N	1	1	323.780	1.820	20	5		DDBDMO
COc1c(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356544305	306855162	/nfs/dbraw/zinc/85/51/62/306855162.db2.gz	QTUVKWIBOCUSFL-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000519632142	302845868	/nfs/dbraw/zinc/84/58/68/302845868.db2.gz	QCIUVXPRQHJZIN-LBPRGKRZSA-N	1	1	321.377	1.849	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000531054928	303227494	/nfs/dbraw/zinc/22/74/94/303227494.db2.gz	LXFFABSSLDKSPZ-BETUJISGSA-N	1	1	321.377	1.963	20	5		DDBDMO
CN(C(=O)C[NH+]1CCC(CCO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000532552817	303290137	/nfs/dbraw/zinc/29/01/37/303290137.db2.gz	LWPHLGSAIIAESY-UHFFFAOYSA-N	1	1	321.377	1.652	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-]	ZINC000535282493	303345341	/nfs/dbraw/zinc/34/53/41/303345341.db2.gz	ZANVWTRUTSBCJV-ZDUSSCGKSA-N	1	1	314.345	1.850	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-]	ZINC000535282493	303345342	/nfs/dbraw/zinc/34/53/42/303345342.db2.gz	ZANVWTRUTSBCJV-ZDUSSCGKSA-N	1	1	314.345	1.850	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000559390349	303791028	/nfs/dbraw/zinc/79/10/28/303791028.db2.gz	SLCXCTWOLYOSIY-STQMWFEESA-N	1	1	321.377	1.223	20	5		DDBDMO
CN(C(=O)[C@H]1CC1[N+](=O)[O-])C1CCN(c2cc[nH+]cc2)CC1	ZINC000368929739	307112976	/nfs/dbraw/zinc/11/29/76/307112976.db2.gz	IUUBTYVEHXKFDL-UONOGXRCSA-N	1	1	304.350	1.174	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC23CCCCC3)c1	ZINC000371164668	307143877	/nfs/dbraw/zinc/14/38/77/307143877.db2.gz	JPUHGQYMJSMEKA-CQSZACIVSA-N	1	1	308.382	1.951	20	5		DDBDMO
COC[C@@H]1CCCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000372087787	307162995	/nfs/dbraw/zinc/16/29/95/307162995.db2.gz	GSTZMEXQAHWQNY-GFCCVEGCSA-N	1	1	321.377	1.942	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373938063	307198144	/nfs/dbraw/zinc/19/81/44/307198144.db2.gz	MJVAOBUTAYURIQ-NEPJUHHUSA-N	1	1	304.350	1.655	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(Cc1ccccn1)[C@@H]1CCC[NH2+]CC1	ZINC000375270748	307220005	/nfs/dbraw/zinc/22/00/05/307220005.db2.gz	VSNQKELPBSFYLM-KFWWJZLASA-N	1	1	318.377	1.218	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)NCc1c[nH+]c2n1CCCC2	ZINC000375545386	307227496	/nfs/dbraw/zinc/22/74/96/307227496.db2.gz	ZBAXTJZOVBKWIF-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000376302054	307242602	/nfs/dbraw/zinc/24/26/02/307242602.db2.gz	IRXPMUXPNTYBDN-ZDUSSCGKSA-N	1	1	313.379	1.027	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000376302054	307242603	/nfs/dbraw/zinc/24/26/03/307242603.db2.gz	IRXPMUXPNTYBDN-ZDUSSCGKSA-N	1	1	313.379	1.027	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@H]1CC[N@H+](C)[C@@H]1c1ccccc1	ZINC000377645086	307275379	/nfs/dbraw/zinc/27/53/79/307275379.db2.gz	BNGGDEYZRINVDP-DZGCQCFKSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1	ZINC000377645086	307275380	/nfs/dbraw/zinc/27/53/80/307275380.db2.gz	BNGGDEYZRINVDP-DZGCQCFKSA-N	1	1	315.377	1.863	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488374	307289337	/nfs/dbraw/zinc/28/93/37/307289337.db2.gz	AUPCEZWOSJWTOI-HNKHHVNMSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000378488374	307289338	/nfs/dbraw/zinc/28/93/38/307289338.db2.gz	AUPCEZWOSJWTOI-HNKHHVNMSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488374	307289339	/nfs/dbraw/zinc/28/93/39/307289339.db2.gz	AUPCEZWOSJWTOI-HNKHHVNMSA-N	1	1	317.389	1.678	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000571263528	308192926	/nfs/dbraw/zinc/19/29/26/308192926.db2.gz	FLZDGTPQOAMEIC-ZWNOBZJWSA-N	1	1	319.365	1.407	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000571870729	308205074	/nfs/dbraw/zinc/20/50/74/308205074.db2.gz	QATPCYWYRRBUBY-SNVBAGLBSA-N	1	1	304.350	1.590	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)S(C)(=O)=O	ZINC000575981224	308284201	/nfs/dbraw/zinc/28/42/01/308284201.db2.gz	BWHYDSUZAGKNHD-SECBINFHSA-N	1	1	302.352	1.126	20	5		DDBDMO
CC1(C)[C@H](O)C[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000576237736	308300045	/nfs/dbraw/zinc/30/00/45/308300045.db2.gz	HSCBASCSIBYUQR-VXGBXAGGSA-N	1	1	318.333	1.894	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)n1	ZINC000576686346	308331851	/nfs/dbraw/zinc/33/18/51/308331851.db2.gz	KZOPGTSBJZXLKC-GXSJLCMTSA-N	1	1	307.354	1.024	20	5		DDBDMO
Cc1ocnc1C[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000576749821	308336744	/nfs/dbraw/zinc/33/67/44/308336744.db2.gz	XXEMJBUCBYVMCJ-LLVKDONJSA-N	1	1	307.306	1.421	20	5		DDBDMO
C[C@H]1COCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000331928302	534023593	/nfs/dbraw/zinc/02/35/93/534023593.db2.gz	DCCVQIMWZFLELA-CHWSQXEVSA-N	1	1	310.350	1.303	20	5		DDBDMO
COc1ccc(NC(=O)C[NH2+]C(C)(C)CN(C)C)c([N+](=O)[O-])c1	ZINC000459551858	534081493	/nfs/dbraw/zinc/08/14/93/534081493.db2.gz	TWWXYSUCHGWDRR-UHFFFAOYSA-N	1	1	324.381	1.472	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000305816455	534338884	/nfs/dbraw/zinc/33/88/84/534338884.db2.gz	AFEQTHIZEVAROK-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000305816455	534338890	/nfs/dbraw/zinc/33/88/90/534338890.db2.gz	AFEQTHIZEVAROK-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(=O)[C@](C)(O)C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000330869346	527154870	/nfs/dbraw/zinc/15/48/70/527154870.db2.gz	SWYAKCFGBSYPRY-OAHLLOKOSA-N	1	1	307.350	1.057	20	5		DDBDMO
[NH3+]C[C@@H]1CCCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000158397320	527209047	/nfs/dbraw/zinc/20/90/47/527209047.db2.gz	AHWGPOIKBLMUSP-CABZTGNLSA-N	1	1	317.349	1.718	20	5		DDBDMO
CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557083	528094418	/nfs/dbraw/zinc/09/44/18/528094418.db2.gz	KZOZTBGXWAXMJB-CZUORRHYSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557083	528094420	/nfs/dbraw/zinc/09/44/20/528094420.db2.gz	KZOZTBGXWAXMJB-CZUORRHYSA-N	1	1	308.378	1.893	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(-c3nn[nH]n3)o2)cc1	ZINC000823635020	599429649	/nfs/dbraw/zinc/42/96/49/599429649.db2.gz	PTZJMUIJHXDLMC-UHFFFAOYSA-N	1	1	314.305	1.700	20	5		DDBDMO
CCC[N@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000069062431	696379978	/nfs/dbraw/zinc/37/99/78/696379978.db2.gz	RMMZKAFAFWPNNB-HNNXBMFYSA-N	1	1	320.349	1.661	20	5		DDBDMO
CCC[N@@H+](C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000069062431	696379981	/nfs/dbraw/zinc/37/99/81/696379981.db2.gz	RMMZKAFAFWPNNB-HNNXBMFYSA-N	1	1	320.349	1.661	20	5		DDBDMO
CO[C@@H]1CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000076266130	696427877	/nfs/dbraw/zinc/42/78/77/696427877.db2.gz	SVPXZHLDSJJUMN-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000076266130	696427878	/nfs/dbraw/zinc/42/78/78/696427878.db2.gz	SVPXZHLDSJJUMN-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1nn(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c(C)c1[N+](=O)[O-]	ZINC000129289633	696787591	/nfs/dbraw/zinc/78/75/91/696787591.db2.gz	UDZUMXOGBZWUGH-KGLIPLIRSA-N	1	1	307.398	1.782	20	5		DDBDMO
CCC(=O)N1CCC([N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000985189298	697464813	/nfs/dbraw/zinc/46/48/13/697464813.db2.gz	KRMZRNBUOKWGME-UHFFFAOYSA-N	1	1	309.370	1.161	20	5		DDBDMO
CCC(=O)N1CCC([N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000985189298	697464814	/nfs/dbraw/zinc/46/48/14/697464814.db2.gz	KRMZRNBUOKWGME-UHFFFAOYSA-N	1	1	309.370	1.161	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776588829	698123144	/nfs/dbraw/zinc/12/31/44/698123144.db2.gz	CFHPUYIXBYEGLS-XJKSGUPXSA-N	1	1	307.394	1.902	20	5		DDBDMO
O=C1NCC2(CC[NH+](Cc3cc(F)ccc3[N+](=O)[O-])CC2)O1	ZINC000782004649	698672786	/nfs/dbraw/zinc/67/27/86/698672786.db2.gz	PGMITWJILQODEY-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000712532596	699263775	/nfs/dbraw/zinc/26/37/75/699263775.db2.gz	XKRJDHJUGJUNJY-QMMMGPOBSA-N	1	1	301.144	1.868	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000712532596	699263776	/nfs/dbraw/zinc/26/37/76/699263776.db2.gz	XKRJDHJUGJUNJY-QMMMGPOBSA-N	1	1	301.144	1.868	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000729919534	699491755	/nfs/dbraw/zinc/49/17/55/699491755.db2.gz	QEZYITLJKZKBFX-NSHDSACASA-N	1	1	306.366	1.485	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000742241716	699869601	/nfs/dbraw/zinc/86/96/01/699869601.db2.gz	RIGUFKQWKAXFBW-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
O=C(CC[NH+]1CCOCC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000751314724	700279633	/nfs/dbraw/zinc/27/96/33/700279633.db2.gz	FFJUCAWMRWKUCN-UHFFFAOYSA-N	1	1	305.334	1.206	20	5		DDBDMO
C[C@H]1CN(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000761076784	700840068	/nfs/dbraw/zinc/84/00/68/700840068.db2.gz	JQYYWKMFXYAWME-LBPRGKRZSA-N	1	1	318.377	1.120	20	5		DDBDMO
CC(=O)c1cc(N2CC[NH+](CCCCO)CC2)ccc1[N+](=O)[O-]	ZINC000804501861	701196497	/nfs/dbraw/zinc/19/64/97/701196497.db2.gz	FXDYVEFZCGAKHU-UHFFFAOYSA-N	1	1	321.377	1.692	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000769145158	701234252	/nfs/dbraw/zinc/23/42/52/701234252.db2.gz	MHXOFCYHURQUEJ-NWDGAFQWSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000769145158	701234254	/nfs/dbraw/zinc/23/42/54/701234254.db2.gz	MHXOFCYHURQUEJ-NWDGAFQWSA-N	1	1	320.393	1.825	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCC(=O)N1	ZINC000839671029	701775749	/nfs/dbraw/zinc/77/57/49/701775749.db2.gz	XXRQWNAXSOWXOL-ZFWWWQNUSA-N	1	1	321.377	1.617	20	5		DDBDMO
CN(C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000867970197	701862488	/nfs/dbraw/zinc/86/24/88/701862488.db2.gz	XLXMFFWTIXRHSW-GXTWGEPZSA-N	1	1	309.391	1.733	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@H]2COC[C@]2(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867985418	701874156	/nfs/dbraw/zinc/87/41/56/701874156.db2.gz	CPQVMESUOFVANX-VBNZEHGJSA-N	1	1	319.361	1.264	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000868160300	701970453	/nfs/dbraw/zinc/97/04/53/701970453.db2.gz	DUDFEYCUOQJVJH-UKRRQHHQSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000866206838	706648585	/nfs/dbraw/zinc/64/85/85/706648585.db2.gz	GDWRGYANPJTHCS-JQWIXIFHSA-N	1	1	304.350	1.224	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000842625489	702745105	/nfs/dbraw/zinc/74/51/05/702745105.db2.gz	LVAHJVOWFJKYNH-HNNXBMFYSA-N	1	1	304.350	1.897	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000842625489	702745106	/nfs/dbraw/zinc/74/51/06/702745106.db2.gz	LVAHJVOWFJKYNH-HNNXBMFYSA-N	1	1	304.350	1.897	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000879577504	706724803	/nfs/dbraw/zinc/72/48/03/706724803.db2.gz	JRKSOZRIZFNERO-FVQBIDKESA-N	1	1	305.378	1.654	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC1	ZINC000845483000	703162839	/nfs/dbraw/zinc/16/28/39/703162839.db2.gz	LUFDYIOJIROUFJ-SECBINFHSA-N	1	1	317.748	1.890	20	5		DDBDMO
C[C@H]1CN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000845517484	703167132	/nfs/dbraw/zinc/16/71/32/703167132.db2.gz	ARJOMKOHTKFFTA-VIFPVBQESA-N	1	1	317.748	1.890	20	5		DDBDMO
C[C@H]1CN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000845517484	703167134	/nfs/dbraw/zinc/16/71/34/703167134.db2.gz	ARJOMKOHTKFFTA-VIFPVBQESA-N	1	1	317.748	1.890	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000846291127	703262629	/nfs/dbraw/zinc/26/26/29/703262629.db2.gz	IWJYXGJLJTXSFP-UHFFFAOYSA-N	1	1	308.382	1.885	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc1[N+](=O)[O-]	ZINC000848350710	703541714	/nfs/dbraw/zinc/54/17/14/703541714.db2.gz	SJYDPIRJNICHTI-ZIAGYGMSSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@@H]1C[C@H]1C(N)=[NH+]O[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000848518518	703560238	/nfs/dbraw/zinc/56/02/38/703560238.db2.gz	KRVCARVVVUYWBQ-OASPWFOLSA-N	1	1	318.333	1.855	20	5		DDBDMO
O=C1NCCO[C@@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000879717943	706768493	/nfs/dbraw/zinc/76/84/93/706768493.db2.gz	IPMYMPSAVXJLSN-HUUCEWRRSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C1NCCO[C@@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000879717943	706768496	/nfs/dbraw/zinc/76/84/96/706768496.db2.gz	IPMYMPSAVXJLSN-HUUCEWRRSA-N	1	1	319.361	1.117	20	5		DDBDMO
Cc1cc(C[C@@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819177549	704082117	/nfs/dbraw/zinc/08/21/17/704082117.db2.gz	OFNDMLVRVBEVSI-MEBBXXQBSA-N	1	1	304.350	1.881	20	5		DDBDMO
CC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@H]1CCOC1	ZINC000853515398	704256455	/nfs/dbraw/zinc/25/64/55/704256455.db2.gz	NQBLZVRCTNZFPY-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@H]1CCOC1	ZINC000853515398	704256457	/nfs/dbraw/zinc/25/64/57/704256457.db2.gz	NQBLZVRCTNZFPY-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[NH+](C[C@@H](C)O)CC1	ZINC000874400441	705040039	/nfs/dbraw/zinc/04/00/39/705040039.db2.gz	PCGZAOIIEFMTQZ-GFCCVEGCSA-N	1	1	321.377	1.350	20	5		DDBDMO
COc1ccc(COC(=O)Cn2c[nH+]cc2C)cc1[N+](=O)[O-]	ZINC000859949304	705051514	/nfs/dbraw/zinc/05/15/14/705051514.db2.gz	KUPOMPYJRMMFGJ-UHFFFAOYSA-N	1	1	305.290	1.852	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCCOc1cccc([N+](=O)[O-])c1	ZINC000859950016	705051972	/nfs/dbraw/zinc/05/19/72/705051972.db2.gz	ZBOGRJCCNRZTJD-UHFFFAOYSA-N	1	1	305.290	1.722	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000860176334	705123320	/nfs/dbraw/zinc/12/33/20/705123320.db2.gz	CWPPCGXTUCIRBD-HOTGVXAUSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000874823247	705182301	/nfs/dbraw/zinc/18/23/01/705182301.db2.gz	GVSKQFHBATWMDZ-ZIAGYGMSSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000874834923	705191983	/nfs/dbraw/zinc/19/19/83/705191983.db2.gz	VSDQGCGDVDSDSB-NEPJUHHUSA-N	1	1	304.350	1.486	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000874839117	705194955	/nfs/dbraw/zinc/19/49/55/705194955.db2.gz	TUIMWCDHTLGSAI-OLZOCXBDSA-N	1	1	318.377	1.794	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c1	ZINC000874846000	705200616	/nfs/dbraw/zinc/20/06/16/705200616.db2.gz	XBZSUSUIASOXQE-HUUCEWRRSA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848712	705202516	/nfs/dbraw/zinc/20/25/16/705202516.db2.gz	GMDIGNFSLFCPRD-STQMWFEESA-N	1	1	319.361	1.912	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823961262	705345129	/nfs/dbraw/zinc/34/51/29/705345129.db2.gz	APTQBVMDRIHROY-UHFFFAOYSA-N	1	1	307.354	1.735	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000824003223	705353280	/nfs/dbraw/zinc/35/32/80/705353280.db2.gz	SYPNBSUMTQFFHB-STQMWFEESA-N	1	1	319.365	1.925	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(C(=O)OCC[NH+]2CCC2)cc1OC	ZINC000861386114	705453430	/nfs/dbraw/zinc/45/34/30/705453430.db2.gz	LJOMETOXTBCPOU-UHFFFAOYSA-N	1	1	324.333	1.865	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000827137220	705937940	/nfs/dbraw/zinc/93/79/40/705937940.db2.gz	VHAHOYQPYMMQOU-KFWWJZLASA-N	1	1	303.362	1.909	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827265999	705963741	/nfs/dbraw/zinc/96/37/41/705963741.db2.gz	JKJMPYWRRUFQBX-WCQYABFASA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC[C@H]21	ZINC000827269312	705964772	/nfs/dbraw/zinc/96/47/72/705964772.db2.gz	WQWOONNHLACERH-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827302701	705972263	/nfs/dbraw/zinc/97/22/63/705972263.db2.gz	XCFPPVGHDJGRLB-YGRLFVJLSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827302701	705972264	/nfs/dbraw/zinc/97/22/64/705972264.db2.gz	XCFPPVGHDJGRLB-YGRLFVJLSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827374739	705988774	/nfs/dbraw/zinc/98/87/74/705988774.db2.gz	PPCLBPGGUZHLBR-KGLIPLIRSA-N	1	1	303.362	1.690	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000863829997	706023073	/nfs/dbraw/zinc/02/30/73/706023073.db2.gz	OQKKQSKOXUMNAX-JTQLQIEISA-N	1	1	313.741	1.045	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000863942499	706042380	/nfs/dbraw/zinc/04/23/80/706042380.db2.gz	YLDRXHHQYYYJMG-SNVBAGLBSA-N	1	1	313.741	1.045	20	5		DDBDMO
O=[N+]([O-])c1c(N[C@@H]2CCC[N@H+](CCCO)C2)nc2ccccn21	ZINC000828461379	706184478	/nfs/dbraw/zinc/18/44/78/706184478.db2.gz	VHIYYYYQFSFHEG-GFCCVEGCSA-N	1	1	319.365	1.501	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000828505311	706191255	/nfs/dbraw/zinc/19/12/55/706191255.db2.gz	MYOHPUFJPWLQFS-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000830292908	706491405	/nfs/dbraw/zinc/49/14/05/706491405.db2.gz	UENYDHHNEJPHFK-PMPSAXMXSA-N	1	1	321.377	1.033	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]2C1	ZINC000865905039	706559174	/nfs/dbraw/zinc/55/91/74/706559174.db2.gz	ZWQQWAVYHNKPSP-MNOVXSKESA-N	1	1	306.322	1.891	20	5		DDBDMO
CONC(=O)C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000879926182	706821761	/nfs/dbraw/zinc/82/17/61/706821761.db2.gz	NONXRMJMODXMOT-UHFFFAOYSA-N	1	1	311.313	1.624	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000880138961	706888270	/nfs/dbraw/zinc/88/82/70/706888270.db2.gz	JGQOKTFDKRDWDK-JSGCOSHPSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)O)C1	ZINC000880146274	706891890	/nfs/dbraw/zinc/89/18/90/706891890.db2.gz	STNSINISOXCPOA-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C(C)(C)O)C1	ZINC000880146274	706891892	/nfs/dbraw/zinc/89/18/92/706891892.db2.gz	STNSINISOXCPOA-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000880425591	706970421	/nfs/dbraw/zinc/97/04/21/706970421.db2.gz	GHGPZRGPWFLYBM-WFASDCNBSA-N	1	1	310.350	1.709	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@H]1C(C)(C)C	ZINC000880613187	707041573	/nfs/dbraw/zinc/04/15/73/707041573.db2.gz	NTXCVIFWUWIVKB-AWEZNQCLSA-N	1	1	320.393	1.979	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271633	707358944	/nfs/dbraw/zinc/35/89/44/707358944.db2.gz	TUFFVRFWRTWCJL-STQMWFEESA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271633	707358948	/nfs/dbraw/zinc/35/89/48/707358948.db2.gz	TUFFVRFWRTWCJL-STQMWFEESA-N	1	1	316.304	1.984	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000882958644	707872172	/nfs/dbraw/zinc/87/21/72/707872172.db2.gz	GSTDBKOBVRMNFN-ZETCQYMHSA-N	1	1	307.276	1.853	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000883898035	708078847	/nfs/dbraw/zinc/07/88/47/708078847.db2.gz	RMXGUMWUSYQJSN-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3C[C@@]34CCOC4)C2)nc1	ZINC000886067098	708691376	/nfs/dbraw/zinc/69/13/76/708691376.db2.gz	HFLYJRLAWYNQBR-WOSRLPQWSA-N	1	1	318.377	1.903	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)Cc1cccnc1[N+](=O)[O-]	ZINC000886177252	708710807	/nfs/dbraw/zinc/71/08/07/708710807.db2.gz	YDGJZSYKSSTXKM-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)Cc1cccnc1[N+](=O)[O-]	ZINC000886177252	708710808	/nfs/dbraw/zinc/71/08/08/708710808.db2.gz	YDGJZSYKSSTXKM-UHFFFAOYSA-N	1	1	308.382	1.532	20	5		DDBDMO
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+](C)CCO	ZINC000899737207	709183636	/nfs/dbraw/zinc/18/36/36/709183636.db2.gz	DDWPZFBTVZJZLT-CQSZACIVSA-N	1	1	323.393	1.204	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCCC[C@@H]2[C@H](C)C[NH+](C)C)c1[N+](=O)[O-]	ZINC000912811836	713098419	/nfs/dbraw/zinc/09/84/19/713098419.db2.gz	ORXQGARZATYAPZ-ZYHUDNBSSA-N	1	1	323.397	1.819	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000890068706	709729826	/nfs/dbraw/zinc/72/98/26/709729826.db2.gz	CFSLWEQWNDBPJL-CQSZACIVSA-N	1	1	321.377	1.476	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-]	ZINC000928093322	713127355	/nfs/dbraw/zinc/12/73/55/713127355.db2.gz	BWEZXWBDDKIEJL-CMPLNLGQSA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-]	ZINC000928093322	713127358	/nfs/dbraw/zinc/12/73/58/713127358.db2.gz	BWEZXWBDDKIEJL-CMPLNLGQSA-N	1	1	324.406	1.243	20	5		DDBDMO
C[C@@H](NC(=O)c1c(F)cccc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000900807974	709769431	/nfs/dbraw/zinc/76/94/31/709769431.db2.gz	XMSLQNVDPQEXSA-ZWNOBZJWSA-N	1	1	324.356	1.098	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000892418108	710434040	/nfs/dbraw/zinc/43/40/40/710434040.db2.gz	MZQJGZPLMNSOFH-LBPRGKRZSA-N	1	1	306.366	1.878	20	5		DDBDMO
COC(=O)c1sccc1C[NH2+]CCn1cc([N+](=O)[O-])cn1	ZINC000893134298	710559944	/nfs/dbraw/zinc/55/99/44/710559944.db2.gz	HZJSPVPSWIIWLM-UHFFFAOYSA-N	1	1	310.335	1.429	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452783	713203800	/nfs/dbraw/zinc/20/38/00/713203800.db2.gz	JKDBAAREQHFQDM-MFKMUULPSA-N	1	1	309.391	1.896	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@@H]1C	ZINC000912024944	711128753	/nfs/dbraw/zinc/12/87/53/711128753.db2.gz	XRCVWIFMDCSPAJ-AOOOYVTPSA-N	1	1	324.356	1.871	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N[C@@H]2Cc3c[nH+]cn3C2)s1	ZINC000894996775	711356519	/nfs/dbraw/zinc/35/65/19/711356519.db2.gz	QBDGEERUUOCUEB-SSDOTTSWSA-N	1	1	302.319	1.833	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000895102738	711413082	/nfs/dbraw/zinc/41/30/82/711413082.db2.gz	ZEZMIBSIAGKTSM-CYBMUJFWSA-N	1	1	311.769	1.499	20	5		DDBDMO
Cc1nn(C)c(N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)c1[N+](=O)[O-]	ZINC000895571571	711546119	/nfs/dbraw/zinc/54/61/19/711546119.db2.gz	JALQWJJEPPBSMG-GHMZBOCLSA-N	1	1	311.411	1.628	20	5		DDBDMO
Cc1nn(C)c(N[C@@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-]	ZINC000895571571	711546121	/nfs/dbraw/zinc/54/61/21/711546121.db2.gz	JALQWJJEPPBSMG-GHMZBOCLSA-N	1	1	311.411	1.628	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CS(=O)(=O)C1(C)C	ZINC000895986655	711661037	/nfs/dbraw/zinc/66/10/37/711661037.db2.gz	WEHAZGURWVOUIV-ZDUSSCGKSA-N	1	1	312.391	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]C/C=C/Cl)cc1	ZINC000905704587	712125490	/nfs/dbraw/zinc/12/54/90/712125490.db2.gz	ANYVVJCXQOPBAX-LZCJLJQNSA-N	1	1	304.755	1.711	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc(Cl)c(N)c([N+](=O)[O-])c3)C[C@H]2C1	ZINC000907805540	712629063	/nfs/dbraw/zinc/62/90/63/712629063.db2.gz	UHBPLLKSAAWFKG-AOOOYVTPSA-N	1	1	324.768	1.464	20	5		DDBDMO
CC[NH+]1CCN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000915280112	713415402	/nfs/dbraw/zinc/41/54/02/713415402.db2.gz	GNNKYOBJHZVBNA-UHFFFAOYSA-N	1	1	317.349	1.109	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1	ZINC000930544327	713862845	/nfs/dbraw/zinc/86/28/45/713862845.db2.gz	FZPHLQURULSURK-RYUDHWBXSA-N	1	1	323.397	1.336	20	5		DDBDMO
O=[N+]([O-])CC[NH+]1CCC([C@H](O)c2cc(F)ccc2F)CC1	ZINC000930696877	713898504	/nfs/dbraw/zinc/89/85/04/713898504.db2.gz	UYLFKGJWTDKPBS-AWEZNQCLSA-N	1	1	300.305	1.987	20	5		DDBDMO
COc1ccc(CN2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000931433151	714096524	/nfs/dbraw/zinc/09/65/24/714096524.db2.gz	QJSNWSSRKBQFRQ-UONOGXRCSA-N	1	1	305.378	1.987	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000931641421	714147490	/nfs/dbraw/zinc/14/74/90/714147490.db2.gz	FALIPGCRDOTEOH-RISCZKNCSA-N	1	1	310.350	1.712	20	5		DDBDMO
Cn1ccc([C@H]2CCC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000932133075	714267756	/nfs/dbraw/zinc/26/77/56/714267756.db2.gz	RBRGSYGKZWGVKZ-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
Cn1ccc([C@H]2CCC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000932133075	714267757	/nfs/dbraw/zinc/26/77/57/714267757.db2.gz	RBRGSYGKZWGVKZ-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000933721526	714655231	/nfs/dbraw/zinc/65/52/31/714655231.db2.gz	FWFUXRIFYVFPGX-RWMBFGLXSA-N	1	1	324.402	1.941	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000933721526	714655233	/nfs/dbraw/zinc/65/52/33/714655233.db2.gz	FWFUXRIFYVFPGX-RWMBFGLXSA-N	1	1	324.402	1.941	20	5		DDBDMO
Cc1conc1C[NH2+]C1(C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000940108756	716627630	/nfs/dbraw/zinc/62/76/30/716627630.db2.gz	JEROQUNFCBEVDO-DGCLKSJQSA-N	1	1	322.365	1.119	20	5		DDBDMO
O=[N+]([O-])c1cc[n+]([O-])c(N2CC3(C2)CC[N@@H+](CC2CC2)C3)c1	ZINC001164768146	721279535	/nfs/dbraw/zinc/27/95/35/721279535.db2.gz	KNEJGCSGQCHCDA-UHFFFAOYSA-N	1	1	304.350	1.150	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1	ZINC001121199295	782405984	/nfs/dbraw/zinc/40/59/84/782405984.db2.gz	NWIVISKYVGODAB-HERUPUMHSA-N	1	1	307.325	1.804	20	5		DDBDMO
Cc1cc(CC(=O)NCC[NH2+]Cc2cccc([N+](=O)[O-])c2)[nH]n1	ZINC001125542547	734451566	/nfs/dbraw/zinc/45/15/66/734451566.db2.gz	PRKOIJNMQXDIME-UHFFFAOYSA-N	1	1	317.349	1.075	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001105415514	741206035	/nfs/dbraw/zinc/20/60/35/741206035.db2.gz	WEGNXOQJCQDSSI-UHFFFAOYSA-N	1	1	322.409	1.830	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc2cc[nH]c2c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936942	742843803	/nfs/dbraw/zinc/84/38/03/742843803.db2.gz	XXWHZBMEJGNMEC-TZMCWYRMSA-N	1	1	302.334	1.039	20	5		DDBDMO
CCc1ccc(CC[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001126938901	742887068	/nfs/dbraw/zinc/88/70/68/742887068.db2.gz	MFEYEPPWXCJXSE-HUUCEWRRSA-N	1	1	305.378	1.163	20	5		DDBDMO
CN(C)c1ccc(NCC2([NH+]3CCCC3)COC2)c([N+](=O)[O-])c1	ZINC001168450994	745113487	/nfs/dbraw/zinc/11/34/87/745113487.db2.gz	DGLVCPYRZYIHHX-UHFFFAOYSA-N	1	1	320.393	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](CO)[C@H](CCO)C2)c(Cl)c1	ZINC001198752040	747598786	/nfs/dbraw/zinc/59/87/86/747598786.db2.gz	HZEKDJBMNMFTRD-PWSUYJOCSA-N	1	1	314.769	1.671	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001095605356	750072297	/nfs/dbraw/zinc/07/22/97/750072297.db2.gz	HYJKPLSKRAHBGK-UHFFFAOYSA-N	1	1	322.409	1.879	20	5		DDBDMO
CC[C@H](C)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)C(N)=O	ZINC001169156867	762266377	/nfs/dbraw/zinc/26/63/77/762266377.db2.gz	HGNNHVPSOBQYNP-BONVTDFDSA-N	1	1	320.393	1.895	20	5		DDBDMO
CC[C@H](C)[C@H](Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)C(N)=O	ZINC001169156867	762266382	/nfs/dbraw/zinc/26/63/82/762266382.db2.gz	HGNNHVPSOBQYNP-BONVTDFDSA-N	1	1	320.393	1.895	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCC1CC1)CC2	ZINC001040699405	762653074	/nfs/dbraw/zinc/65/30/74/762653074.db2.gz	CKSDOJRFARQKCQ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
C[C@H]1[C@@H](O)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC001170324855	766252116	/nfs/dbraw/zinc/25/21/16/766252116.db2.gz	SPKJLPROBRZLST-ZANVPECISA-N	1	1	311.313	1.518	20	5		DDBDMO
O=C(C1CC1)N1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC001048635904	769603418	/nfs/dbraw/zinc/60/34/18/769603418.db2.gz	LPDNEKDNNDCQOW-GASCZTMLSA-N	1	1	315.373	1.895	20	5		DDBDMO
Cc1cc(N[C@H](N)CCC[NH3+])nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC001159788949	771928935	/nfs/dbraw/zinc/92/89/35/771928935.db2.gz	NTHAHZVOWMKITB-ZDUSSCGKSA-N	1	1	316.365	1.218	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ncc([N+](=O)[O-])cc1C	ZINC001094008446	775325351	/nfs/dbraw/zinc/32/53/51/775325351.db2.gz	NRNIOXNDBRQVCE-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
O=C(NCc1c[nH+]c2n1CCC2)c1ccc([N+](=O)[O-])cc1F	ZINC001177740630	778718219	/nfs/dbraw/zinc/71/82/19/778718219.db2.gz	WERBLJFFPYUPOD-UHFFFAOYSA-N	1	1	304.281	1.807	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001117797907	780902323	/nfs/dbraw/zinc/90/23/23/780902323.db2.gz	MZAQQTIFSNKMQN-OSMZGAPFSA-N	1	1	307.350	1.227	20	5		DDBDMO
CN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@@H+](C)C1	ZINC001119938551	781688376	/nfs/dbraw/zinc/68/83/76/781688376.db2.gz	IWDQMPZJCPLLAZ-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cocn1)Cc1ccccc1[N+](=O)[O-]	ZINC001267187960	837497871	/nfs/dbraw/zinc/49/78/71/837497871.db2.gz	BGEBFIBXNCTLFG-UHFFFAOYSA-N	1	1	304.306	1.445	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cocn1)Cc1ccccc1[N+](=O)[O-]	ZINC001267187960	837497876	/nfs/dbraw/zinc/49/78/76/837497876.db2.gz	BGEBFIBXNCTLFG-UHFFFAOYSA-N	1	1	304.306	1.445	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]CCCCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001269986131	842201711	/nfs/dbraw/zinc/20/17/11/842201711.db2.gz	UTAMNWAKDVFIBO-AAVRWANBSA-N	1	1	315.389	1.808	20	5		DDBDMO
C[C@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCO1	ZINC001122253111	858726149	/nfs/dbraw/zinc/72/61/49/858726149.db2.gz	JPEWXZSXYKDPDM-NHYWBVRUSA-N	1	1	307.350	1.406	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC001124003007	859518523	/nfs/dbraw/zinc/51/85/23/859518523.db2.gz	LTZJFFNLQYMPOH-NILFDRSVSA-N	1	1	303.362	1.973	20	5		DDBDMO
CN1CC[NH+](CCO[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001224551121	881444838	/nfs/dbraw/zinc/44/48/38/881444838.db2.gz	CUFDBGZWXBCCOM-INIZCTEOSA-N	1	1	305.378	1.326	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C=C1CCCCC1	ZINC001124383956	859699716	/nfs/dbraw/zinc/69/97/16/859699716.db2.gz	KCNBSRSJEVCFAX-UHFFFAOYSA-N	1	1	321.381	1.425	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCC2(O)CCOCC2)ncc1[N+](=O)[O-]	ZINC001156712515	863284786	/nfs/dbraw/zinc/28/47/86/863284786.db2.gz	GSECHWXCPIZZPO-ZZXKWVIFSA-N	1	1	322.365	1.476	20	5		DDBDMO
CC(C)[N@@H+](C)[C@H]1CCN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C1	ZINC001157018972	863520472	/nfs/dbraw/zinc/52/04/72/863520472.db2.gz	CAACTYFFDNCINM-JTQLQIEISA-N	1	1	314.773	1.801	20	5		DDBDMO
O=C(NCCC[NH2+]CC1CCC(F)(F)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767034	864117966	/nfs/dbraw/zinc/11/79/66/864117966.db2.gz	DOALTVOGNHJLPA-VXGBXAGGSA-N	1	1	319.352	1.573	20	5		DDBDMO
[NH3+]Cc1ncn(C(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)n1	ZINC001157928321	864272909	/nfs/dbraw/zinc/27/29/09/864272909.db2.gz	HSPTWWBSZKWAOU-UHFFFAOYSA-N	1	1	304.644	1.291	20	5		DDBDMO
[NH3+]Cc1ncn(-c2cc3ncnc(Cl)c3cc2[N+](=O)[O-])n1	ZINC001157928610	864274125	/nfs/dbraw/zinc/27/41/25/864274125.db2.gz	LVJTWPNYFNCENH-UHFFFAOYSA-N	1	1	305.685	1.231	20	5		DDBDMO
[NH3+]CCc1cn(-c2ncc([N+](=O)[O-])cc2F)c2ccncc12	ZINC001160945760	866202861	/nfs/dbraw/zinc/20/28/61/866202861.db2.gz	KRSIYGOCAVSBBQ-UHFFFAOYSA-N	1	1	301.281	1.969	20	5		DDBDMO
O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC001324437772	867279308	/nfs/dbraw/zinc/27/93/08/867279308.db2.gz	BXZIUFYWYHXUNM-LSDHHAIUSA-N	1	1	319.361	1.325	20	5		DDBDMO
CC(=O)Nc1ccc(NC[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162689650	867738321	/nfs/dbraw/zinc/73/83/21/867738321.db2.gz	LUIQTPSXXDXGTG-GFCCVEGCSA-N	1	1	308.338	1.296	20	5		DDBDMO
CC(=O)Nc1ccc(NC[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162689650	867738337	/nfs/dbraw/zinc/73/83/37/867738337.db2.gz	LUIQTPSXXDXGTG-GFCCVEGCSA-N	1	1	308.338	1.296	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)CC[N@H+]1C	ZINC001335230804	868160015	/nfs/dbraw/zinc/16/00/15/868160015.db2.gz	REBSTVOKKFOCFN-XHDPSFHLSA-N	1	1	318.377	1.755	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C	ZINC001322508679	868212009	/nfs/dbraw/zinc/21/20/09/868212009.db2.gz	DSCBPRSDGRWPMN-BMIGLBTASA-N	1	1	318.377	1.849	20	5		DDBDMO
CC(C)[N@H+](C)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC001335365109	868250343	/nfs/dbraw/zinc/25/03/43/868250343.db2.gz	AGSIURQAOFYGPW-AWEZNQCLSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC001335365109	868250357	/nfs/dbraw/zinc/25/03/57/868250357.db2.gz	AGSIURQAOFYGPW-AWEZNQCLSA-N	1	1	311.382	1.264	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC001335565330	868387738	/nfs/dbraw/zinc/38/77/38/868387738.db2.gz	HYCRISVRUHFJHN-KGLIPLIRSA-N	1	1	306.366	1.334	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001336745182	869120677	/nfs/dbraw/zinc/12/06/77/869120677.db2.gz	GNMRDFSFHOMKDA-LLVKDONJSA-N	1	1	322.365	1.981	20	5		DDBDMO
CN1CCN(c2cc[nH+]cc2Nc2ccc([N+](=O)[O-])nc2)CC1	ZINC001203569385	870645986	/nfs/dbraw/zinc/64/59/86/870645986.db2.gz	BPORGJURRQPEME-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001304002276	871176921	/nfs/dbraw/zinc/17/69/21/871176921.db2.gz	OTCHIDZTELYPJE-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001304002276	871176931	/nfs/dbraw/zinc/17/69/31/871176931.db2.gz	OTCHIDZTELYPJE-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cnc2N)C(C)(C)C1	ZINC001304042932	871180691	/nfs/dbraw/zinc/18/06/91/871180691.db2.gz	PDXVASBSPYWUHN-LLVKDONJSA-N	1	1	307.354	1.032	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3[O-])[C@H]2C1	ZINC001347597693	874205675	/nfs/dbraw/zinc/20/56/75/874205675.db2.gz	RYERSXZWKPHXGH-XDTLVQLUSA-N	1	1	305.334	1.370	20	5		DDBDMO
CC(=O)N1CCC([N@H+]2CCc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001351065404	876041447	/nfs/dbraw/zinc/04/14/47/876041447.db2.gz	JXCFZBZHDZWAFB-UHFFFAOYSA-N	1	1	303.362	1.964	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)cccc1[N+](=O)[O-]	ZINC001353285487	877229449	/nfs/dbraw/zinc/22/94/49/877229449.db2.gz	NQVUXIRYFZSNKY-RAIGVLPGSA-N	1	1	319.361	1.673	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CC[N@@H+](C)CCO	ZINC001219044232	877886583	/nfs/dbraw/zinc/88/65/83/877886583.db2.gz	XVABQDJSQRKVPU-UHFFFAOYSA-N	1	1	324.381	1.545	20	5		DDBDMO
CC[N@H+]1CC[C@@H](O[C@@H](C(=O)OC)c2ccccc2[N+](=O)[O-])C1	ZINC001223641641	881038708	/nfs/dbraw/zinc/03/87/08/881038708.db2.gz	BWAWFJWQFFSOLE-BXUZGUMPSA-N	1	1	308.334	1.920	20	5		DDBDMO
C[C@H](C[N+](C)(C)C)Oc1[nH]c(=O)nc2cc([N+](=O)[O-])ccc21	ZINC001228243434	883403483	/nfs/dbraw/zinc/40/34/83/883403483.db2.gz	YDJLFCUJLQVJSC-SECBINFHSA-O	1	1	307.330	1.717	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2n[nH]c(=O)c3cccc([N+](=O)[O-])c32)C1	ZINC001229368140	883948137	/nfs/dbraw/zinc/94/81/37/883948137.db2.gz	WYYFWUAQYIARTN-VIFPVBQESA-N	1	1	304.306	1.717	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3C[C@@H](F)C[C@H]3CO)CC2)cc1	ZINC001254476642	896457073	/nfs/dbraw/zinc/45/70/73/896457073.db2.gz	VBRIJEVUWVHYRR-LRDDRELGSA-N	1	1	323.368	1.968	20	5		DDBDMO
COC(=O)CO[C@H]1CC[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])C1	ZINC001254571273	896509290	/nfs/dbraw/zinc/50/92/90/896509290.db2.gz	RMMZAFRBWLVADD-JSGCOSHPSA-N	1	1	322.361	1.790	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CC(N3CCOCC3)C1)C2	ZINC001254598599	896524039	/nfs/dbraw/zinc/52/40/39/896524039.db2.gz	IEEJYBZFSFTYDE-HNNXBMFYSA-N	1	1	303.362	1.078	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1	ZINC001265581124	902156719	/nfs/dbraw/zinc/15/67/19/902156719.db2.gz	QPVKZRBTWBKZJE-ZDUSSCGKSA-N	1	1	320.393	1.928	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](C(N)=O)C1	ZINC000249590322	282179457	/nfs/dbraw/zinc/17/94/57/282179457.db2.gz	VDXXBHKNNKMMFG-DGCLKSJQSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@H](C(N)=O)C1	ZINC000249590322	282179458	/nfs/dbraw/zinc/17/94/58/282179458.db2.gz	VDXXBHKNNKMMFG-DGCLKSJQSA-N	1	1	307.350	1.559	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000278917651	214494816	/nfs/dbraw/zinc/49/48/16/214494816.db2.gz	RDDCCILCFQEFNH-OAHLLOKOSA-N	1	1	305.334	1.186	20	5		DDBDMO
CC1(C)CN(Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1CCO	ZINC000614920193	362076276	/nfs/dbraw/zinc/07/62/76/362076276.db2.gz	GSJLAKZVTZSJRO-UHFFFAOYSA-N	1	1	311.357	1.622	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCOCC1	ZINC000616141637	362558606	/nfs/dbraw/zinc/55/86/06/362558606.db2.gz	DFBCVBSTJXBKRI-UHFFFAOYSA-N	1	1	313.741	1.372	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000181719139	199343469	/nfs/dbraw/zinc/34/34/69/199343469.db2.gz	RTUDZMVWTDWDJC-SNVBAGLBSA-N	1	1	313.329	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2CCS(=O)(=O)C2)C2CC2)cc1	ZINC000279747939	215111950	/nfs/dbraw/zinc/11/19/50/215111950.db2.gz	PWFRPSRMRXDUEQ-ZDUSSCGKSA-N	1	1	324.402	1.994	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H]2CCS(=O)(=O)C2)C2CC2)cc1	ZINC000279747939	215111951	/nfs/dbraw/zinc/11/19/51/215111951.db2.gz	PWFRPSRMRXDUEQ-ZDUSSCGKSA-N	1	1	324.402	1.994	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@@H+]1CC=CCC1	ZINC000279788244	215146641	/nfs/dbraw/zinc/14/66/41/215146641.db2.gz	CYMYFYUIUKIXEA-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)NCC[N@@H+]1CC=CCC1	ZINC000279920349	215237723	/nfs/dbraw/zinc/23/77/23/215237723.db2.gz	GCVMHUXXZOUKAI-UHFFFAOYSA-N	1	1	305.334	1.352	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]3CCCC[C@@H]32)c1	ZINC000331774300	234107495	/nfs/dbraw/zinc/10/74/95/234107495.db2.gz	KWJAWZSCYDCDRB-YUELXQCFSA-N	1	1	308.382	1.807	20	5		DDBDMO
CCOCCNC(=O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000292073938	222822560	/nfs/dbraw/zinc/82/25/60/222822560.db2.gz	DWUNXHIGDDIHMT-UHFFFAOYSA-N	1	1	309.366	1.572	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000054375840	352690707	/nfs/dbraw/zinc/69/07/07/352690707.db2.gz	PMVQBQCCURMVQR-GFCCVEGCSA-N	1	1	310.354	1.010	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000067159197	353036578	/nfs/dbraw/zinc/03/65/78/353036578.db2.gz	UZPIWHCKRAIHBA-UHFFFAOYSA-N	1	1	323.349	1.436	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCC[N@H+](C)C1CC1	ZINC000066870925	353020636	/nfs/dbraw/zinc/02/06/36/353020636.db2.gz	YMOJPVTULSDHNR-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000068800124	353131149	/nfs/dbraw/zinc/13/11/49/353131149.db2.gz	RRCXSWZIQAARNL-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[C@@H](c1ccccc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174663738	198367470	/nfs/dbraw/zinc/36/74/70/198367470.db2.gz	AWSBLIBGLYVMAC-WFASDCNBSA-N	1	1	304.350	1.845	20	5		DDBDMO
CCCC(=O)NC[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000174841125	198392016	/nfs/dbraw/zinc/39/20/16/198392016.db2.gz	FOOUMIHTMAYTJY-CYBMUJFWSA-N	1	1	323.397	1.420	20	5		DDBDMO
Cc1cc(N(C)CCCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000092652826	353865707	/nfs/dbraw/zinc/86/57/07/353865707.db2.gz	LSLQDRBFDPTIFP-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000142296230	354144275	/nfs/dbraw/zinc/14/42/75/354144275.db2.gz	VLAJBSFQLIVREI-CQSZACIVSA-N	1	1	303.362	1.834	20	5		DDBDMO
Nc1ccc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000142257006	354144300	/nfs/dbraw/zinc/14/43/00/354144300.db2.gz	KYJHIUBYIVXTPU-LBPRGKRZSA-N	1	1	304.350	1.487	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H](CCO)C2)c([N+](=O)[O-])c1	ZINC000314064299	354483068	/nfs/dbraw/zinc/48/30/68/354483068.db2.gz	RQMLMKIHLJVJPA-NSHDSACASA-N	1	1	307.350	1.288	20	5		DDBDMO
O=c1[nH]cnc2cc(N[C@@H]3CC[N@H+](C4CC4)C3)c([N+](=O)[O-])cc21	ZINC000320983898	354530412	/nfs/dbraw/zinc/53/04/12/354530412.db2.gz	BNZSXYRURXVRHY-SECBINFHSA-N	1	1	315.333	1.892	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](CCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000314680528	354488120	/nfs/dbraw/zinc/48/81/20/354488120.db2.gz	COASLPFWWNXLSO-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](CCO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000314680528	354488123	/nfs/dbraw/zinc/48/81/23/354488123.db2.gz	COASLPFWWNXLSO-LBPRGKRZSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000587862312	354886195	/nfs/dbraw/zinc/88/61/95/354886195.db2.gz	ZYLVHXOSICBFEU-TZMCWYRMSA-N	1	1	309.341	1.769	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000588004322	354892145	/nfs/dbraw/zinc/89/21/45/354892145.db2.gz	NKLQQYUIXBHYNO-UHFFFAOYSA-N	1	1	319.365	1.701	20	5		DDBDMO
Cc1c(C(=O)N2CC[C@H]([N@H+]3CC[C@@H](O)C3)C2)cccc1[N+](=O)[O-]	ZINC000588860603	354943281	/nfs/dbraw/zinc/94/32/81/354943281.db2.gz	JYQOATUSLJYVOG-QWHCGFSZSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC000590011324	355040390	/nfs/dbraw/zinc/04/03/90/355040390.db2.gz	HYVXHWXAYNKYOL-SWLSCSKDSA-N	1	1	318.377	1.478	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000590578387	355119491	/nfs/dbraw/zinc/11/94/91/355119491.db2.gz	QGXVUBXBHPFXAY-LLVKDONJSA-N	1	1	322.365	1.554	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000591579972	355330728	/nfs/dbraw/zinc/33/07/28/355330728.db2.gz	CANMMXMXMLDAPC-MDZLAQPJSA-N	1	1	324.356	1.602	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000346477471	283110116	/nfs/dbraw/zinc/11/01/16/283110116.db2.gz	GBLSVDRQZHQUCT-CQSZACIVSA-N	1	1	319.361	1.670	20	5		DDBDMO
CCCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](C)C1	ZINC000592828332	355704992	/nfs/dbraw/zinc/70/49/92/355704992.db2.gz	GQWZRFJKNHFBHP-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
CCCN(C(=O)c1cccc([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](C)C1	ZINC000592828331	355705378	/nfs/dbraw/zinc/70/53/78/355705378.db2.gz	GQWZRFJKNHFBHP-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](CO)[C@@H]2C)c1	ZINC000593036803	355776318	/nfs/dbraw/zinc/77/63/18/355776318.db2.gz	UMKDYIOVSVHPBY-AAEUAGOBSA-N	1	1	322.361	1.974	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000593415036	355878249	/nfs/dbraw/zinc/87/82/49/355878249.db2.gz	JZSPNLPBBMDRCD-NSHDSACASA-N	1	1	321.352	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000593727841	355977318	/nfs/dbraw/zinc/97/73/18/355977318.db2.gz	TXYVXJRPHXWMGH-MRXNPFEDSA-N	1	1	314.345	1.842	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000593697768	355970958	/nfs/dbraw/zinc/97/09/58/355970958.db2.gz	FBROVNKPKXYXAB-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000594731033	356300000	/nfs/dbraw/zinc/30/00/00/356300000.db2.gz	DLUUJTIZOUOAJE-LLVKDONJSA-N	1	1	305.338	1.166	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCN(C)C1=O	ZINC000595011337	356371929	/nfs/dbraw/zinc/37/19/29/356371929.db2.gz	HDPFPLKKBLKDMO-GXFFZTMASA-N	1	1	307.350	1.875	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000601339431	358506109	/nfs/dbraw/zinc/50/61/09/358506109.db2.gz	XSFGBFTYKZTQKL-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000595769523	356644990	/nfs/dbraw/zinc/64/49/90/356644990.db2.gz	JJRAVAQVHYVWTM-QMTHXVAHSA-N	1	1	308.334	1.807	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000595826500	356665971	/nfs/dbraw/zinc/66/59/71/356665971.db2.gz	ABFDGELDKBEDBR-QWHCGFSZSA-N	1	1	322.361	1.951	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596272241	356840373	/nfs/dbraw/zinc/84/03/73/356840373.db2.gz	VHSIFWUFXKRTRJ-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000597677979	357281624	/nfs/dbraw/zinc/28/16/24/357281624.db2.gz	KIARSQNZOHAKBK-NSHDSACASA-N	1	1	322.365	1.248	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)c1	ZINC000597623879	357260214	/nfs/dbraw/zinc/26/02/14/357260214.db2.gz	CXXGIUJKUFBBPN-ZDUSSCGKSA-N	1	1	318.377	1.023	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000597924831	357384521	/nfs/dbraw/zinc/38/45/21/357384521.db2.gz	LERFMYCKFFWOJZ-SNVBAGLBSA-N	1	1	324.356	1.919	20	5		DDBDMO
CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)[C@@H]1CC[N@@H+](C)C1	ZINC000597947398	357395390	/nfs/dbraw/zinc/39/53/90/357395390.db2.gz	XQZPROCXQQEQKG-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000598342280	357545521	/nfs/dbraw/zinc/54/55/21/357545521.db2.gz	LMTQFWSEDHHXSP-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000598745584	357713455	/nfs/dbraw/zinc/71/34/55/357713455.db2.gz	KQYVDRHULMIESV-JTQLQIEISA-N	1	1	322.365	1.546	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[N@@H+]1CC[C@H](O)C1	ZINC000599093320	357813280	/nfs/dbraw/zinc/81/32/80/357813280.db2.gz	ORZYPVSBWGZMAV-AAEUAGOBSA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[N@H+]1CC[C@H](O)C1	ZINC000599093320	357813283	/nfs/dbraw/zinc/81/32/83/357813283.db2.gz	ORZYPVSBWGZMAV-AAEUAGOBSA-N	1	1	309.366	1.321	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)c1	ZINC000599631898	357999183	/nfs/dbraw/zinc/99/91/83/357999183.db2.gz	DWLWQOPWDGJMHT-GTQRCTGISA-N	1	1	324.402	1.959	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000599809794	358063902	/nfs/dbraw/zinc/06/39/02/358063902.db2.gz	WFGKJNUTJIOPAJ-UHFFFAOYSA-N	1	1	316.317	1.390	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600474540	358234514	/nfs/dbraw/zinc/23/45/14/358234514.db2.gz	XZYSGZMTLAOBHS-NSHDSACASA-N	1	1	321.381	1.627	20	5		DDBDMO
Cc1ncc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)n1C	ZINC000601148456	358421983	/nfs/dbraw/zinc/42/19/83/358421983.db2.gz	BZNIFKOGDOYAJP-OAHLLOKOSA-N	1	1	304.350	1.634	20	5		DDBDMO
Cc1[nH+]cc(CN[C@](C)(CO)c2cccc([N+](=O)[O-])c2)n1C	ZINC000601148456	358421988	/nfs/dbraw/zinc/42/19/88/358421988.db2.gz	BZNIFKOGDOYAJP-OAHLLOKOSA-N	1	1	304.350	1.634	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](O)C(F)(F)F)c2c1	ZINC000601151982	358423128	/nfs/dbraw/zinc/42/31/28/358423128.db2.gz	JXGIJEBOOQDAFG-LLVKDONJSA-N	1	1	301.224	1.900	20	5		DDBDMO
C[C@H]1CN(c2ncc(F)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000601151287	358423131	/nfs/dbraw/zinc/42/31/31/358423131.db2.gz	VJMKLFZJPNBAKO-JTQLQIEISA-N	1	1	312.345	1.410	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000601583517	358611603	/nfs/dbraw/zinc/61/16/03/358611603.db2.gz	BULNLEZDMKSBNN-WDEREUQCSA-N	1	1	323.324	1.015	20	5		DDBDMO
CC(C)(O)CN1CCC([NH2+]CCc2ccccc2[N+](=O)[O-])CC1	ZINC000602556985	359043504	/nfs/dbraw/zinc/04/35/04/359043504.db2.gz	HYNNXPHIJGTBER-UHFFFAOYSA-N	1	1	321.421	1.962	20	5		DDBDMO
C[C@@H]1OCC[C@H]1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602792799	359195137	/nfs/dbraw/zinc/19/51/37/359195137.db2.gz	COOYBKKAGPOJKV-AVGNSLFASA-N	1	1	306.366	1.901	20	5		DDBDMO
CO[C@@H]1C[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C12CCC2	ZINC000602839811	359229283	/nfs/dbraw/zinc/22/92/83/359229283.db2.gz	LWLCLUUFYHDRQI-QWHCGFSZSA-N	1	1	308.382	1.989	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Nc2c(C)cncc2[N+](=O)[O-])C[C@H]1C	ZINC000602952567	359318704	/nfs/dbraw/zinc/31/87/04/359318704.db2.gz	NPJYSFWTXFODPX-VXGBXAGGSA-N	1	1	321.381	1.667	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H](OC)C[C@@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964607	359327790	/nfs/dbraw/zinc/32/77/90/359327790.db2.gz	RWDUEEYRCIIWSC-WFASDCNBSA-N	1	1	310.350	1.575	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000603140837	359428998	/nfs/dbraw/zinc/42/89/98/359428998.db2.gz	ALZXVHSAGLWYOB-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@H](C(C)(C)C)C1	ZINC000603140837	359429006	/nfs/dbraw/zinc/42/90/06/359429006.db2.gz	ALZXVHSAGLWYOB-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCn2cc(C[NH+]3CCCCC3)nn2)c1	ZINC000603226448	359497477	/nfs/dbraw/zinc/49/74/77/359497477.db2.gz	YMSZMFPATJARMC-UHFFFAOYSA-N	1	1	305.342	1.069	20	5		DDBDMO
CC1(C)[C@H]([NH+]2CCOCC2)C[C@@H]1Nc1ccc([N+](=O)[O-])cn1	ZINC000603397053	359614661	/nfs/dbraw/zinc/61/46/61/359614661.db2.gz	JLXYIIWSUFYJGA-QWHCGFSZSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1ccc(NC(=O)NCC[N@H+]2CCCOCC2)cc1[N+](=O)[O-]	ZINC000187406433	200108128	/nfs/dbraw/zinc/10/81/28/200108128.db2.gz	RQHUZNFNEWBTJL-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000565782963	304092125	/nfs/dbraw/zinc/09/21/25/304092125.db2.gz	JXBOLCRDAPMTQS-AWEZNQCLSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000609309494	360291726	/nfs/dbraw/zinc/29/17/26/360291726.db2.gz	GUSFSWNVQSKPKP-NSHDSACASA-N	1	1	306.366	1.680	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000610712468	360512180	/nfs/dbraw/zinc/51/21/80/360512180.db2.gz	BWNUIPZHLWDQTB-GWCFXTLKSA-N	1	1	321.381	1.125	20	5		DDBDMO
C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000610899189	360565999	/nfs/dbraw/zinc/56/59/99/360565999.db2.gz	DTBTYTVAZKCQIQ-GXFFZTMASA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000610899189	360566002	/nfs/dbraw/zinc/56/60/02/360566002.db2.gz	DTBTYTVAZKCQIQ-GXFFZTMASA-N	1	1	308.338	1.435	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c1	ZINC000610912570	360570212	/nfs/dbraw/zinc/57/02/12/360570212.db2.gz	YMUVKGTWURJEJS-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c1	ZINC000610912570	360570216	/nfs/dbraw/zinc/57/02/16/360570216.db2.gz	YMUVKGTWURJEJS-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000611088487	360619474	/nfs/dbraw/zinc/61/94/74/360619474.db2.gz	ZGASKBKNMKNKQJ-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000193946116	201151995	/nfs/dbraw/zinc/15/19/95/201151995.db2.gz	IJMXKFNWBQQLEV-NSHDSACASA-N	1	1	322.321	1.461	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000193946116	201151998	/nfs/dbraw/zinc/15/19/98/201151998.db2.gz	IJMXKFNWBQQLEV-NSHDSACASA-N	1	1	322.321	1.461	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000271720217	296115601	/nfs/dbraw/zinc/11/56/01/296115601.db2.gz	KUGFSCXXOAFTID-FRRDWIJNSA-N	1	1	321.377	1.881	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000266204803	205180606	/nfs/dbraw/zinc/18/06/06/205180606.db2.gz	WTDJVJQJKRHEOX-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)[C@@H](C)C1	ZINC000288380850	220120604	/nfs/dbraw/zinc/12/06/04/220120604.db2.gz	KGSLTQCMLSUTCD-LBPRGKRZSA-N	1	1	305.378	1.998	20	5		DDBDMO
C[C@@H](CCCC[NH3+])NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000336848698	249255215	/nfs/dbraw/zinc/25/52/15/249255215.db2.gz	MEZLOGVADGQADU-VIFPVBQESA-N	1	1	319.358	1.530	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H]3[C@@H](C2)NC(=O)N3C)cc1[N+](=O)[O-]	ZINC000284802987	218183668	/nfs/dbraw/zinc/18/36/68/218183668.db2.gz	MOSZLKWFBDJEKU-OLZOCXBDSA-N	1	1	304.350	1.501	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H]3[C@@H](C2)NC(=O)N3C)cc1[N+](=O)[O-]	ZINC000284802987	218183670	/nfs/dbraw/zinc/18/36/70/218183670.db2.gz	MOSZLKWFBDJEKU-OLZOCXBDSA-N	1	1	304.350	1.501	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CCn1ccc([N+](=O)[O-])n1	ZINC000285265540	218358985	/nfs/dbraw/zinc/35/89/85/218358985.db2.gz	IFRQWORKZBXTSG-UHFFFAOYSA-N	1	1	319.321	1.874	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)[C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000302486846	532955436	/nfs/dbraw/zinc/95/54/36/532955436.db2.gz	YRHNWBBLGCTQNO-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)[C@@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000302486846	532955440	/nfs/dbraw/zinc/95/54/40/532955440.db2.gz	YRHNWBBLGCTQNO-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccccc3F)CC2)c1	ZINC000157326689	197180166	/nfs/dbraw/zinc/18/01/66/197180166.db2.gz	NGGBMPFJDIXNMZ-UHFFFAOYSA-N	1	1	319.340	1.753	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCC[C@@H]1O	ZINC000352657401	285201916	/nfs/dbraw/zinc/20/19/16/285201916.db2.gz	AEEYUQQXBRDGAU-STQMWFEESA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCC[C@@H]1O	ZINC000352657401	285201919	/nfs/dbraw/zinc/20/19/19/285201919.db2.gz	AEEYUQQXBRDGAU-STQMWFEESA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCC[C@@H]1O	ZINC000352660154	285204942	/nfs/dbraw/zinc/20/49/42/285204942.db2.gz	MUFZGFYNYZMIQM-CABCVRRESA-N	1	1	319.361	1.329	20	5		DDBDMO
Cc1ccc(CN2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000120601275	195200040	/nfs/dbraw/zinc/20/00/40/195200040.db2.gz	HGWBWQIDUHATOL-ZIAGYGMSSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H](C)[NH2+]1	ZINC000070076801	406808322	/nfs/dbraw/zinc/80/83/22/406808322.db2.gz	NAGMLVVUHBZQQK-GHMZBOCLSA-N	1	1	313.379	1.107	20	5		DDBDMO
Cc1c(C[N@H+]2CCc3nn(C)c(=O)cc3C2)cccc1[N+](=O)[O-]	ZINC000078622845	407036777	/nfs/dbraw/zinc/03/67/77/407036777.db2.gz	GWAJOHGPLWRBDH-UHFFFAOYSA-N	1	1	314.345	1.555	20	5		DDBDMO
Cc1c(C[N@@H+]2CCc3nn(C)c(=O)cc3C2)cccc1[N+](=O)[O-]	ZINC000078622845	407036779	/nfs/dbraw/zinc/03/67/79/407036779.db2.gz	GWAJOHGPLWRBDH-UHFFFAOYSA-N	1	1	314.345	1.555	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000066620645	407255354	/nfs/dbraw/zinc/25/53/54/407255354.db2.gz	YKNINSQZFUPKNX-NSHDSACASA-N	1	1	318.377	1.700	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000124907189	407372931	/nfs/dbraw/zinc/37/29/31/407372931.db2.gz	HMHLHDYZCGKSCZ-LLVKDONJSA-N	1	1	322.365	1.690	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000114062861	407535631	/nfs/dbraw/zinc/53/56/31/407535631.db2.gz	FRXWNAIAJNWQQY-MNOVXSKESA-N	1	1	323.349	1.663	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@H]1CCOC1	ZINC000178782009	407602591	/nfs/dbraw/zinc/60/25/91/407602591.db2.gz	ZHZVPFKRNLABBK-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[C@@H](CNC(=O)NCc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000171609699	407720354	/nfs/dbraw/zinc/72/03/54/407720354.db2.gz	SSYWRAXWKYAZGE-NSHDSACASA-N	1	1	306.366	1.877	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000267248823	407806629	/nfs/dbraw/zinc/80/66/29/407806629.db2.gz	GFBSVEKXBJOHPB-RYUDHWBXSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C(N)=O)C1	ZINC000187420955	407855633	/nfs/dbraw/zinc/85/56/33/407855633.db2.gz	SSHADDZWKUMIAL-RISCZKNCSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C(N)=O)C1	ZINC000187420955	407855641	/nfs/dbraw/zinc/85/56/41/407855641.db2.gz	SSHADDZWKUMIAL-RISCZKNCSA-N	1	1	307.350	1.559	20	5		DDBDMO
CCC[N@@H+](CC(=O)N(C)C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153758523	407895371	/nfs/dbraw/zinc/89/53/71/407895371.db2.gz	KHCKSYMLTNYFKM-CQSZACIVSA-N	1	1	309.366	1.428	20	5		DDBDMO
CCC[N@H+](CC(=O)N(C)C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153758523	407895381	/nfs/dbraw/zinc/89/53/81/407895381.db2.gz	KHCKSYMLTNYFKM-CQSZACIVSA-N	1	1	309.366	1.428	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCSC1	ZINC000154036224	407958720	/nfs/dbraw/zinc/95/87/20/407958720.db2.gz	NRWLGPBNAVNRBQ-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCSC1	ZINC000154036224	407958727	/nfs/dbraw/zinc/95/87/27/407958727.db2.gz	NRWLGPBNAVNRBQ-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000268242971	407963913	/nfs/dbraw/zinc/96/39/13/407963913.db2.gz	VGABIQLVQBMZAW-ZWNOBZJWSA-N	1	1	319.361	1.816	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000189660502	408073768	/nfs/dbraw/zinc/07/37/68/408073768.db2.gz	BLJGYCRDLPDMAZ-BBRMVZONSA-N	1	1	324.377	1.571	20	5		DDBDMO
COCCOCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000175683196	408184502	/nfs/dbraw/zinc/18/45/02/408184502.db2.gz	NKZZTASGMZORGP-GFCCVEGCSA-N	1	1	310.354	1.139	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1CO	ZINC000190897913	408338547	/nfs/dbraw/zinc/33/85/47/408338547.db2.gz	RHVBBMQRZZTPEB-PWSUYJOCSA-N	1	1	318.333	1.705	20	5		DDBDMO
C[C@@H](CO)[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000131949646	162026349	/nfs/dbraw/zinc/02/63/49/162026349.db2.gz	CCLDMWGZBGACCH-JTQLQIEISA-N	1	1	309.322	1.205	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nnnc2Sc2ncccc2[N+](=O)[O-])C1	ZINC000131944389	162026976	/nfs/dbraw/zinc/02/69/76/162026976.db2.gz	ICLRYJNBQHHAFA-SECBINFHSA-N	1	1	321.366	1.079	20	5		DDBDMO
CCc1[nH+]ccn1[C@@H]1CCCN(c2c([N+](=O)[O-])ncn2C)C1	ZINC000264324794	408445944	/nfs/dbraw/zinc/44/59/44/408445944.db2.gz	LBRQOZUHYLVCCK-LLVKDONJSA-N	1	1	304.354	1.929	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177128916	408529034	/nfs/dbraw/zinc/52/90/34/408529034.db2.gz	KQFOATOKPVTRCR-AAEUAGOBSA-N	1	1	303.362	1.879	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)CC(N)=O	ZINC000191701314	408471722	/nfs/dbraw/zinc/47/17/22/408471722.db2.gz	HVBYASNUZFEZNY-UHFFFAOYSA-N	1	1	308.338	1.039	20	5		DDBDMO
CC[C@@H](O)[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000269937118	408475484	/nfs/dbraw/zinc/47/54/84/408475484.db2.gz	YQQDXZNBRGGCQF-ZIAGYGMSSA-N	1	1	309.366	1.382	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCOC[C@H]1C1CC1	ZINC000248440586	408565745	/nfs/dbraw/zinc/56/57/45/408565745.db2.gz	DCFFUNWRYHJCRQ-ZFWWWQNUSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCOC[C@H]1C1CC1	ZINC000248440586	408565752	/nfs/dbraw/zinc/56/57/52/408565752.db2.gz	DCFFUNWRYHJCRQ-ZFWWWQNUSA-N	1	1	322.361	1.445	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248456632	408572211	/nfs/dbraw/zinc/57/22/11/408572211.db2.gz	LTJHUTQBLAQSHH-MELADBBJSA-N	1	1	324.377	1.570	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CC[C@H]([NH3+])[C@H]3C2)c1[N+](=O)[O-]	ZINC000248636974	408606230	/nfs/dbraw/zinc/60/62/30/408606230.db2.gz	QNRDFNIVVJHSNI-GUBZILKMSA-N	1	1	307.354	1.080	20	5		DDBDMO
COC[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccc(C)o1	ZINC000184771795	408684823	/nfs/dbraw/zinc/68/48/23/408684823.db2.gz	ISDCANOWHPUIML-ZDUSSCGKSA-N	1	1	321.333	1.635	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@H]1O	ZINC000249569045	408742934	/nfs/dbraw/zinc/74/29/34/408742934.db2.gz	NTUAGCVDPLSWLR-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[C@H]1O	ZINC000249569045	408742938	/nfs/dbraw/zinc/74/29/38/408742938.db2.gz	NTUAGCVDPLSWLR-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+](C[C@H](O)Cn2cccn2)C2CC2)c1	ZINC000177999952	408755178	/nfs/dbraw/zinc/75/51/78/408755178.db2.gz	UGDSCMTVAAIFTD-INIZCTEOSA-N	1	1	316.361	1.817	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](C(F)(F)F)[C@@H](CO)C2)c1	ZINC000285631178	408831709	/nfs/dbraw/zinc/83/17/09/408831709.db2.gz	AFKVZRCVMLADTK-MWLCHTKSSA-N	1	1	322.287	1.284	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](C(F)(F)F)[C@@H](CO)C2)c1	ZINC000285631164	408831768	/nfs/dbraw/zinc/83/17/68/408831768.db2.gz	AFKVZRCVMLADTK-KOLCDFICSA-N	1	1	322.287	1.284	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000192810054	163238221	/nfs/dbraw/zinc/23/82/21/163238221.db2.gz	CKGDZJKLTTZWRK-UHFFFAOYSA-N	1	1	310.354	1.074	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]([C@@H](O)C(F)(F)F)C2)c1	ZINC000277678343	408990979	/nfs/dbraw/zinc/99/09/79/408990979.db2.gz	GDMNTLCUGLZLNR-GXSJLCMTSA-N	1	1	322.287	1.427	20	5		DDBDMO
COCCO[C@H]1C[C@H](CO)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000278398498	409080111	/nfs/dbraw/zinc/08/01/11/409080111.db2.gz	WCFCSRITTLIYLB-HOCLYGCPSA-N	1	1	324.377	1.441	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H](O)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000293297324	409084790	/nfs/dbraw/zinc/08/47/90/409084790.db2.gz	WICKTNGMKKNZPC-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000278917643	409112539	/nfs/dbraw/zinc/11/25/39/409112539.db2.gz	RDDCCILCFQEFNH-HNNXBMFYSA-N	1	1	305.334	1.186	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283428229	409154811	/nfs/dbraw/zinc/15/48/11/409154811.db2.gz	IZXYEVKKLOPBLH-VIFPVBQESA-N	1	1	310.329	1.530	20	5		DDBDMO
CCC[C@@]1(CO)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000288808738	409181984	/nfs/dbraw/zinc/18/19/84/409181984.db2.gz	MHWCNUUTXCJWNH-MRXNPFEDSA-N	1	1	321.377	1.678	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283600807	409183549	/nfs/dbraw/zinc/18/35/49/409183549.db2.gz	YHHNMUGIVCZFHF-UHFFFAOYSA-N	1	1	321.312	1.641	20	5		DDBDMO
C[N@@H+]1CC[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000293945824	409211324	/nfs/dbraw/zinc/21/13/24/409211324.db2.gz	RRSRQQMENMSJFB-HNNXBMFYSA-N	1	1	305.334	1.468	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000293945824	409211328	/nfs/dbraw/zinc/21/13/28/409211328.db2.gz	RRSRQQMENMSJFB-HNNXBMFYSA-N	1	1	305.334	1.468	20	5		DDBDMO
COCC[NH+]1CCN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC000284012232	409257902	/nfs/dbraw/zinc/25/79/02/409257902.db2.gz	KHXDUKMNKURYMW-UHFFFAOYSA-N	1	1	315.320	1.637	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000283732339	409205740	/nfs/dbraw/zinc/20/57/40/409205740.db2.gz	IAMRPGFBICMZSX-NSHDSACASA-N	1	1	322.365	1.979	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+]2CC=CCC2)c1[N+](=O)[O-]	ZINC000280264799	409280102	/nfs/dbraw/zinc/28/01/02/409280102.db2.gz	OUKHJYUWOUHHRM-UHFFFAOYSA-N	1	1	307.354	1.262	20	5		DDBDMO
CCOc1cccc(N2CC[C@@H]3OCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000284995662	409391186	/nfs/dbraw/zinc/39/11/86/409391186.db2.gz	LREHYTSGIHXJDQ-KGLIPLIRSA-N	1	1	321.377	1.903	20	5		DDBDMO
C[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1	ZINC000280536477	409346282	/nfs/dbraw/zinc/34/62/82/409346282.db2.gz	PINDOXLJMZUDAN-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1	ZINC000280536477	409346285	/nfs/dbraw/zinc/34/62/85/409346285.db2.gz	PINDOXLJMZUDAN-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000285400709	409429411	/nfs/dbraw/zinc/42/94/11/409429411.db2.gz	ORGBHTCMHRWAQX-BETUJISGSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000285400709	409429416	/nfs/dbraw/zinc/42/94/16/409429416.db2.gz	ORGBHTCMHRWAQX-BETUJISGSA-N	1	1	307.350	1.951	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N(C)C[C@@H]2CCC[N@H+]2C)c1	ZINC000316971050	164025249	/nfs/dbraw/zinc/02/52/49/164025249.db2.gz	ZUTZPVUIULXIKP-LBPRGKRZSA-N	1	1	307.350	1.912	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[N@H+](CC(C)C)CC1	ZINC000363442177	164160276	/nfs/dbraw/zinc/16/02/76/164160276.db2.gz	PYEUXRMXLHKIEZ-UHFFFAOYSA-N	1	1	323.397	1.290	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2C2CCCC2)c1	ZINC000304380555	409616888	/nfs/dbraw/zinc/61/68/88/409616888.db2.gz	YGJBCMSHOCRDPS-HUUCEWRRSA-N	1	1	308.382	1.807	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])[N@H+](C)C1	ZINC000331556654	409633446	/nfs/dbraw/zinc/63/34/46/409633446.db2.gz	IYMNLOBCGDBXJE-HZMBPMFUSA-N	1	1	305.334	1.203	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])[N@@H+](C)C1	ZINC000331556654	409633449	/nfs/dbraw/zinc/63/34/49/409633449.db2.gz	IYMNLOBCGDBXJE-HZMBPMFUSA-N	1	1	305.334	1.203	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000356891006	409694497	/nfs/dbraw/zinc/69/44/97/409694497.db2.gz	WCVYAGCNCZKOSW-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])nc2C)C1	ZINC000338073915	409697855	/nfs/dbraw/zinc/69/78/55/409697855.db2.gz	RELNXQSOCGSKHP-CYBMUJFWSA-N	1	1	323.397	1.338	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000318799315	409881368	/nfs/dbraw/zinc/88/13/68/409881368.db2.gz	ATAHWFLTWDIJBO-JTQLQIEISA-N	1	1	307.354	1.032	20	5		DDBDMO
COc1cc(Cc2noc([C@@H]3CC[N@@H+](C)C3)n2)ccc1[N+](=O)[O-]	ZINC000350154633	409926868	/nfs/dbraw/zinc/92/68/68/409926868.db2.gz	DXFXTFSVPRWMJF-LLVKDONJSA-N	1	1	318.333	1.996	20	5		DDBDMO
C[C@@H]1[C@H]([N@@H+](C)CCO)CCN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000332726615	410238465	/nfs/dbraw/zinc/23/84/65/410238465.db2.gz	SNUXIAWBLAEOAH-MWLCHTKSSA-N	1	1	313.379	1.183	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCCC[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000298752426	410383397	/nfs/dbraw/zinc/38/33/97/410383397.db2.gz	NMKKFEMVHRAVHZ-AWEZNQCLSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCC[C@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000298752426	410383402	/nfs/dbraw/zinc/38/34/02/410383402.db2.gz	NMKKFEMVHRAVHZ-AWEZNQCLSA-N	1	1	307.350	1.404	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2[C@@H](CO)CC[C@H]2CO)c(Cl)c1	ZINC000347325043	410471257	/nfs/dbraw/zinc/47/12/57/410471257.db2.gz	YUXDSXLPQOMNNS-TXEJJXNPSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2[C@@H](CO)CC[C@H]2CO)c(Cl)c1	ZINC000347325043	410471269	/nfs/dbraw/zinc/47/12/69/410471269.db2.gz	YUXDSXLPQOMNNS-TXEJJXNPSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1[C@@H](CO)CC[C@@H]1CO	ZINC000347329320	410473518	/nfs/dbraw/zinc/47/35/18/410473518.db2.gz	IFNAJRGXBPLJCE-VXGBXAGGSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1ccc(CNC(=O)NC[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000299251539	410582554	/nfs/dbraw/zinc/58/25/54/410582554.db2.gz	PJETXVMGTSHDGU-GFCCVEGCSA-N	1	1	322.365	1.497	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1ccc(C(=O)NC)cc1[N+](=O)[O-]	ZINC000301061841	410647044	/nfs/dbraw/zinc/64/70/44/410647044.db2.gz	CIIUEEGVYWLMNF-GFCCVEGCSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343802147	410712765	/nfs/dbraw/zinc/71/27/65/410712765.db2.gz	SORXJRVKRHHPSW-DOMZBBRYSA-N	1	1	320.393	1.919	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1	ZINC000343829905	410731748	/nfs/dbraw/zinc/73/17/48/410731748.db2.gz	NHUCSGXQWPTVRC-QMTHXVAHSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCOC(=O)c1cc(N2CCC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000301612163	410755618	/nfs/dbraw/zinc/75/56/18/410755618.db2.gz	FPFBQTHWQXEXMJ-UHFFFAOYSA-N	1	1	307.350	1.913	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000359623904	410778197	/nfs/dbraw/zinc/77/81/97/410778197.db2.gz	LBQBWGVCYQGHAH-UHFFFAOYSA-N	1	1	307.350	1.656	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000337437487	410783343	/nfs/dbraw/zinc/78/33/43/410783343.db2.gz	XWHIESPGWUSQBO-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000330585670	410801249	/nfs/dbraw/zinc/80/12/49/410801249.db2.gz	LMJAWGNPQMDSOE-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CN1C	ZINC000330585670	410801254	/nfs/dbraw/zinc/80/12/54/410801254.db2.gz	LMJAWGNPQMDSOE-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CN1C	ZINC000330585670	410801258	/nfs/dbraw/zinc/80/12/58/410801258.db2.gz	LMJAWGNPQMDSOE-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+](C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000330524333	410749934	/nfs/dbraw/zinc/74/99/34/410749934.db2.gz	NUCMTUCXYJTFDR-UHFFFAOYSA-N	1	1	323.397	1.631	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000301896940	410823057	/nfs/dbraw/zinc/82/30/57/410823057.db2.gz	ZVNBBMWHBMQBRE-LBPRGKRZSA-N	1	1	318.381	1.806	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935490	410832806	/nfs/dbraw/zinc/83/28/06/410832806.db2.gz	RLDRMVVBQWTPIS-XPTSAGLGSA-N	1	1	313.329	1.874	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c(F)cc1[N+](=O)[O-]	ZINC000301935490	410832813	/nfs/dbraw/zinc/83/28/13/410832813.db2.gz	RLDRMVVBQWTPIS-XPTSAGLGSA-N	1	1	313.329	1.874	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCNc2cc[nH+]c(N3CCCCC3)n2)c1	ZINC000353270755	410893195	/nfs/dbraw/zinc/89/31/95/410893195.db2.gz	WUNPWSQYHAECJL-UHFFFAOYSA-N	1	1	317.353	1.684	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CC=C(C)CC1	ZINC000348356573	410931408	/nfs/dbraw/zinc/93/14/08/410931408.db2.gz	ZJJLNWHLFLVPDD-UHFFFAOYSA-N	1	1	321.381	1.258	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCOC1	ZINC000361732387	307004769	/nfs/dbraw/zinc/00/47/69/307004769.db2.gz	CEGXAXBNRYVPEV-CQSZACIVSA-N	1	1	312.297	1.546	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H](C)[C@@H]1CO	ZINC000132908678	196295769	/nfs/dbraw/zinc/29/57/69/196295769.db2.gz	OGHXAYDOJRRBKF-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CO	ZINC000132908678	196295771	/nfs/dbraw/zinc/29/57/71/196295771.db2.gz	OGHXAYDOJRRBKF-WFASDCNBSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1	ZINC000133231978	196323302	/nfs/dbraw/zinc/32/33/02/196323302.db2.gz	LEFAVOIEZXPTID-UHFFFAOYSA-N	1	1	307.325	1.902	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H](C)C[NH+]1CCOCC1	ZINC000134059897	196357419	/nfs/dbraw/zinc/35/74/19/196357419.db2.gz	RQVYLYCOJLWOJW-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000134117830	196362876	/nfs/dbraw/zinc/36/28/76/196362876.db2.gz	PYYZBSGCPCZVKS-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCc3[nH+]ccn3C2)n1	ZINC000350892674	306758857	/nfs/dbraw/zinc/75/88/57/306758857.db2.gz	SYIQOZSEFWCPNU-MRVPVSSYSA-N	1	1	315.293	1.305	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000296665987	226103670	/nfs/dbraw/zinc/10/36/70/226103670.db2.gz	KJOKVXOJRGIMRP-GOEBONIOSA-N	1	1	324.377	1.693	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC000373285250	418418625	/nfs/dbraw/zinc/41/86/25/418418625.db2.gz	AESSLYKARVTVCH-NSHDSACASA-N	1	1	305.338	1.114	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H]2OCC(=O)N[C@H]2C1	ZINC000374025705	418485449	/nfs/dbraw/zinc/48/54/49/418485449.db2.gz	YMOXRNOFXYZTSN-TUKIKUTGSA-N	1	1	319.361	1.554	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2OCC(=O)N[C@H]2C1	ZINC000374025705	418485452	/nfs/dbraw/zinc/48/54/52/418485452.db2.gz	YMOXRNOFXYZTSN-TUKIKUTGSA-N	1	1	319.361	1.554	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ncc([N+](=O)[O-])s2)CC1	ZINC000374425573	418529757	/nfs/dbraw/zinc/52/97/57/418529757.db2.gz	XOFCTXGFAMBJBF-UHFFFAOYSA-N	1	1	308.367	1.866	20	5		DDBDMO
CC(C)C[C@H]1C(=O)NCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000189819107	222058545	/nfs/dbraw/zinc/05/85/45/222058545.db2.gz	KCWBDOMDKQIIEP-HNNXBMFYSA-N	1	1	305.378	1.984	20	5		DDBDMO
CC(C)C[C@H]1C(=O)NCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000189819107	222058547	/nfs/dbraw/zinc/05/85/47/222058547.db2.gz	KCWBDOMDKQIIEP-HNNXBMFYSA-N	1	1	305.378	1.984	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CCOc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000375036891	418593109	/nfs/dbraw/zinc/59/31/09/418593109.db2.gz	IJGGVTLPBJRZJV-CZUORRHYSA-N	1	1	305.378	2.000	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@H]3C[N@H+](C)C[C@@H]3C)n2)n1C	ZINC000361248774	418612615	/nfs/dbraw/zinc/61/26/15/418612615.db2.gz	CXVDLPKPCNYPOU-CBAPKCEASA-N	1	1	306.326	1.352	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@@H+](CCO)CCOc1cccc([N+](=O)[O-])c1	ZINC000361587114	418688107	/nfs/dbraw/zinc/68/81/07/418688107.db2.gz	UWNFTDBMEYHTSN-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420950417	419382274	/nfs/dbraw/zinc/38/22/74/419382274.db2.gz	WLNMYJIRUJFWIO-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000421701625	419689827	/nfs/dbraw/zinc/68/98/27/419689827.db2.gz	HZVJSHWLYFUTMT-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1cc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000421703782	419690089	/nfs/dbraw/zinc/69/00/89/419690089.db2.gz	NAJBVFHIGVKWHZ-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@@H+](CCCCNc1ccc2ncc([N+](=O)[O-])n2n1)C1CC1	ZINC000413351536	419778644	/nfs/dbraw/zinc/77/86/44/419778644.db2.gz	ZYYKCLGNTLHWNW-UHFFFAOYSA-N	1	1	304.354	1.924	20	5		DDBDMO
CCNC(=O)NC(=O)[C@@H](C)[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000429254486	419994032	/nfs/dbraw/zinc/99/40/32/419994032.db2.gz	FRVSMAHHPJVMSF-SNVBAGLBSA-N	1	1	322.365	1.654	20	5		DDBDMO
C[C@H](c1ccccc1)[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)C(N)=O	ZINC000428855624	419942863	/nfs/dbraw/zinc/94/28/63/419942863.db2.gz	HICHYZIFRZTDMR-ZWNOBZJWSA-N	1	1	317.349	1.076	20	5		DDBDMO
Cc1ccc(C)c(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000429299016	419998716	/nfs/dbraw/zinc/99/87/16/419998716.db2.gz	FLPJYTHNUMXETE-MRXNPFEDSA-N	1	1	318.377	1.901	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000418997846	420041193	/nfs/dbraw/zinc/04/11/93/420041193.db2.gz	LNTZLNZTSGAUNV-GHMZBOCLSA-N	1	1	311.386	1.011	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@H](CN)C(C)(C)C)c([N+](=O)[O-])c1	ZINC000420356301	420232844	/nfs/dbraw/zinc/23/28/44/420232844.db2.gz	GAGPKJQBAVOEBT-CQSZACIVSA-N	1	1	311.382	1.945	20	5		DDBDMO
Nc1nc(NC[C@H]2CCC[N@H+]2C2CCCCC2)ncc1[N+](=O)[O-]	ZINC000435596849	420266902	/nfs/dbraw/zinc/26/69/02/420266902.db2.gz	ZZBUZFMFGFBXKH-GFCCVEGCSA-N	1	1	320.397	1.598	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)c1	ZINC000425061079	420325378	/nfs/dbraw/zinc/32/53/78/420325378.db2.gz	XWXUTQWREBVULP-XHDPSFHLSA-N	1	1	319.361	1.770	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420593919	420325622	/nfs/dbraw/zinc/32/56/22/420325622.db2.gz	CLZYENCOXISVQT-LBPRGKRZSA-N	1	1	320.393	1.862	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000420606977	420329590	/nfs/dbraw/zinc/32/95/90/420329590.db2.gz	ZBXYWDQTLAGUIX-AAEUAGOBSA-N	1	1	318.377	1.614	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CCCC[N@@H+]2CC(C)C)c1[N+](=O)[O-]	ZINC000439696150	420532433	/nfs/dbraw/zinc/53/24/33/420532433.db2.gz	MVLMLJCUSXGIHU-GFCCVEGCSA-N	1	1	323.397	1.867	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000457084329	420604386	/nfs/dbraw/zinc/60/43/86/420604386.db2.gz	GPBFFBBJDWYZRO-LLVKDONJSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000457094618	420610073	/nfs/dbraw/zinc/61/00/73/420610073.db2.gz	OUNWPHHDRXKANG-SNVBAGLBSA-N	1	1	307.354	1.127	20	5		DDBDMO
CC[N@@H+](C)CCNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000447804848	420802839	/nfs/dbraw/zinc/80/28/39/420802839.db2.gz	GXMFMSOJPWKDNX-UHFFFAOYSA-N	1	1	322.409	1.791	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1CCO	ZINC000456221183	421125863	/nfs/dbraw/zinc/12/58/63/421125863.db2.gz	GFVSBROSBDHHQJ-TXEJJXNPSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1CCO	ZINC000456221183	421125866	/nfs/dbraw/zinc/12/58/66/421125866.db2.gz	GFVSBROSBDHHQJ-TXEJJXNPSA-N	1	1	307.350	1.122	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000449764503	421077669	/nfs/dbraw/zinc/07/76/69/421077669.db2.gz	BQXCRFBHWDGTSZ-ZYHUDNBSSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](C)C[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000449764503	421077672	/nfs/dbraw/zinc/07/76/72/421077672.db2.gz	BQXCRFBHWDGTSZ-ZYHUDNBSSA-N	1	1	310.350	1.815	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000489348694	421148764	/nfs/dbraw/zinc/14/87/64/421148764.db2.gz	NBESLTTUICQNNZ-HNNXBMFYSA-N	1	1	305.378	1.936	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000545396210	421256756	/nfs/dbraw/zinc/25/67/56/421256756.db2.gz	BSJYGZDLRXBXRY-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000562933257	421428478	/nfs/dbraw/zinc/42/84/78/421428478.db2.gz	CLVYUJFESHVXPJ-ZDUSSCGKSA-N	1	1	306.366	1.220	20	5		DDBDMO
C[N@@H+](CCC(=O)NCCn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000548392952	421432689	/nfs/dbraw/zinc/43/26/89/421432689.db2.gz	JKCXYRRWVKMNNJ-UHFFFAOYSA-N	1	1	323.397	1.562	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2cc([N+](=O)[O-])cn2C)C[C@H](C)O1	ZINC000516387135	421544425	/nfs/dbraw/zinc/54/44/25/421544425.db2.gz	DEWCGZADPYNNRY-TXEJJXNPSA-N	1	1	324.381	1.162	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CCOCC1	ZINC000530627221	421610675	/nfs/dbraw/zinc/61/06/75/421610675.db2.gz	KLDXABZPQVIDGA-AWEZNQCLSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000572395924	421783478	/nfs/dbraw/zinc/78/34/78/421783478.db2.gz	OXPXGHVEKIQFEQ-AWEZNQCLSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000572395924	421783485	/nfs/dbraw/zinc/78/34/85/421783485.db2.gz	OXPXGHVEKIQFEQ-AWEZNQCLSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000574782458	422180310	/nfs/dbraw/zinc/18/03/10/422180310.db2.gz	ZNYIQFLKWVORDN-LLVKDONJSA-N	1	1	309.370	1.275	20	5		DDBDMO
COC(=O)c1ccnc(NCC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000598629752	422398314	/nfs/dbraw/zinc/39/83/14/422398314.db2.gz	PGKAKMFMFBLYJS-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000577767803	422424498	/nfs/dbraw/zinc/42/44/98/422424498.db2.gz	MDQHSDKUVKRHKG-NSHDSACASA-N	1	1	323.397	1.882	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@@H](C)O)CC2)c([N+](=O)[O-])cc1F	ZINC000275815548	274096601	/nfs/dbraw/zinc/09/66/01/274096601.db2.gz	MCEDUHDTZSYKOC-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2C[C@@H]3[C@H](C2)OCC[N@H+]3C)c([N+](=O)[O-])cc1F	ZINC000301646496	274096953	/nfs/dbraw/zinc/09/69/53/274096953.db2.gz	ICIFIEAJOIQGEX-OCCSQVGLSA-N	1	1	311.313	1.262	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+](CCO)CC2)c2cccnc21	ZINC000320971237	275036091	/nfs/dbraw/zinc/03/60/91/275036091.db2.gz	XEWOFIKTTHSRNF-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)NCc1cccs1	ZINC000357923212	299021417	/nfs/dbraw/zinc/02/14/17/299021417.db2.gz	CXEQXLZMADPJID-UHFFFAOYSA-N	1	1	323.378	1.101	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)NCc1cccs1	ZINC000357923212	299021420	/nfs/dbraw/zinc/02/14/20/299021420.db2.gz	CXEQXLZMADPJID-UHFFFAOYSA-N	1	1	323.378	1.101	20	5		DDBDMO
C[N@@H+](CCCC(=O)OC(C)(C)C)CCn1ccc([N+](=O)[O-])n1	ZINC000357932318	299024049	/nfs/dbraw/zinc/02/40/49/299024049.db2.gz	RWBUEDBLHJUMLZ-UHFFFAOYSA-N	1	1	312.370	1.845	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C[C@@H]21	ZINC000362279594	300042663	/nfs/dbraw/zinc/04/26/63/300042663.db2.gz	HQQQUWXEYODFOY-ZANVPECISA-N	1	1	322.340	1.482	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC[C@H]21	ZINC000369981748	301251237	/nfs/dbraw/zinc/25/12/37/301251237.db2.gz	CYMBKKKSLFGHQJ-GXFFZTMASA-N	1	1	319.365	1.128	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000370217831	301296359	/nfs/dbraw/zinc/29/63/59/301296359.db2.gz	BQENGVXURUUPII-HRCADAONSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000370217831	301296361	/nfs/dbraw/zinc/29/63/61/301296361.db2.gz	BQENGVXURUUPII-HRCADAONSA-N	1	1	317.389	1.475	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1CCc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000370217831	301296363	/nfs/dbraw/zinc/29/63/63/301296363.db2.gz	BQENGVXURUUPII-HRCADAONSA-N	1	1	317.389	1.475	20	5		DDBDMO
Cn1nccc1[C@@H](CO)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000514873868	302751911	/nfs/dbraw/zinc/75/19/11/302751911.db2.gz	YYGNUXSJHKYICJ-CHWSQXEVSA-N	1	1	302.334	1.639	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2C[C@H](CO)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000362086969	307013582	/nfs/dbraw/zinc/01/35/82/307013582.db2.gz	LFXAKBUVMMJIAF-VXGBXAGGSA-N	1	1	310.350	1.542	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000363939931	307038220	/nfs/dbraw/zinc/03/82/20/307038220.db2.gz	VKHWGRNMCGBCGF-STQMWFEESA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369017396	307114513	/nfs/dbraw/zinc/11/45/13/307114513.db2.gz	OIDFLILIDQXYMR-ZIAGYGMSSA-N	1	1	307.398	1.913	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000371834244	307158661	/nfs/dbraw/zinc/15/86/61/307158661.db2.gz	IFIRIDZIFBDQML-HIFRSBDPSA-N	1	1	305.378	1.981	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000371834244	307158662	/nfs/dbraw/zinc/15/86/62/307158662.db2.gz	IFIRIDZIFBDQML-HIFRSBDPSA-N	1	1	305.378	1.981	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000377583436	307273618	/nfs/dbraw/zinc/27/36/18/307273618.db2.gz	HWCIOCXYQZQPCB-BTDICHCPSA-N	1	1	311.288	1.674	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000377601544	307274560	/nfs/dbraw/zinc/27/45/60/307274560.db2.gz	CGIUAJSHCMCEIW-SECBINFHSA-N	1	1	308.294	1.200	20	5		DDBDMO
C[C@H](CCN(C)C)[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116848	308043826	/nfs/dbraw/zinc/04/38/26/308043826.db2.gz	LDTHDKSUWVFLCU-CHWSQXEVSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@H](CC[NH+](C)C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000566116848	308043827	/nfs/dbraw/zinc/04/38/27/308043827.db2.gz	LDTHDKSUWVFLCU-CHWSQXEVSA-N	1	1	311.382	1.264	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](CO)[C@H]1C	ZINC000488807094	484220263	/nfs/dbraw/zinc/22/02/63/484220263.db2.gz	OFNZCSBCJPLCLI-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](CO)[C@H]1C	ZINC000488807094	484220272	/nfs/dbraw/zinc/22/02/72/484220272.db2.gz	OFNZCSBCJPLCLI-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)OC[C@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000493796300	484238848	/nfs/dbraw/zinc/23/88/48/484238848.db2.gz	OTSKTBCHCUMZAA-TZMCWYRMSA-N	1	1	324.381	1.262	20	5		DDBDMO
CN(CC[NH+](C)C)c1sc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000271451347	500612765	/nfs/dbraw/zinc/61/27/65/500612765.db2.gz	XDKOXNFWOCXDIB-UHFFFAOYSA-N	1	1	307.397	1.058	20	5		DDBDMO
C[C@H]1CN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC[N@H+]1CCO	ZINC000302443700	533977327	/nfs/dbraw/zinc/97/73/27/533977327.db2.gz	QWVBYNWSHUKIGD-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CS[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000451308209	533980607	/nfs/dbraw/zinc/98/06/07/533980607.db2.gz	AFGFPSSGHFQTRT-TZMCWYRMSA-N	1	1	312.391	1.772	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@](O)(CO)C1	ZINC000459638447	528210565	/nfs/dbraw/zinc/21/05/65/528210565.db2.gz	BYRFKFNZKBXMFD-INIZCTEOSA-N	1	1	324.377	1.701	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@](O)(CO)C1	ZINC000459638447	528210568	/nfs/dbraw/zinc/21/05/68/528210568.db2.gz	BYRFKFNZKBXMFD-INIZCTEOSA-N	1	1	324.377	1.701	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000821095175	606138911	/nfs/dbraw/zinc/13/89/11/606138911.db2.gz	ZULYVCRSUPFUJJ-UHFFFAOYSA-N	1	1	319.369	1.919	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H]1CCCS1(=O)=O	ZINC000127001522	696767156	/nfs/dbraw/zinc/76/71/56/696767156.db2.gz	VSPMIRXRCBAVBF-NSHDSACASA-N	1	1	318.782	1.915	20	5		DDBDMO
C[N@H+](C[C@@H]1CCCO1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000151736008	696889973	/nfs/dbraw/zinc/88/99/73/696889973.db2.gz	STUNQGUKOKPENT-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCCO1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000151736008	696889975	/nfs/dbraw/zinc/88/99/75/696889975.db2.gz	STUNQGUKOKPENT-AWEZNQCLSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](Cn3ccnn3)C2)c(C)c1[N+](=O)[O-]	ZINC000154904681	696939002	/nfs/dbraw/zinc/93/90/02/696939002.db2.gz	YQWCEPUHQQHXRJ-ZDUSSCGKSA-N	1	1	319.369	1.369	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)c(C)c1[N+](=O)[O-]	ZINC000154904681	696939003	/nfs/dbraw/zinc/93/90/03/696939003.db2.gz	YQWCEPUHQQHXRJ-ZDUSSCGKSA-N	1	1	319.369	1.369	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](C3OCCO3)C2)c(C)c1[N+](=O)[O-]	ZINC000172491538	697368119	/nfs/dbraw/zinc/36/81/19/697368119.db2.gz	ZBCSKVLWABWFBE-LBPRGKRZSA-N	1	1	310.354	1.451	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](C3OCCO3)C2)c(C)c1[N+](=O)[O-]	ZINC000172491538	697368120	/nfs/dbraw/zinc/36/81/20/697368120.db2.gz	ZBCSKVLWABWFBE-LBPRGKRZSA-N	1	1	310.354	1.451	20	5		DDBDMO
COCCOC[C@@H]1CC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000173393509	697377409	/nfs/dbraw/zinc/37/74/09/697377409.db2.gz	CXOQMUFLYACECO-CYBMUJFWSA-N	1	1	312.370	1.351	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000173393509	697377411	/nfs/dbraw/zinc/37/74/11/697377411.db2.gz	CXOQMUFLYACECO-CYBMUJFWSA-N	1	1	312.370	1.351	20	5		DDBDMO
Cc1nn(CN2CCC[C@@H]2C[NH+]2CCOCC2)c(C)c1[N+](=O)[O-]	ZINC000173372368	697377740	/nfs/dbraw/zinc/37/77/40/697377740.db2.gz	VNPBCKKISNYAHE-CQSZACIVSA-N	1	1	323.397	1.162	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CC(O)(C(C)C)C1	ZINC000773891461	697819539	/nfs/dbraw/zinc/81/95/39/697819539.db2.gz	YNDDQLWADRKFSK-UHFFFAOYSA-N	1	1	321.377	1.935	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]1C	ZINC000775100184	697962763	/nfs/dbraw/zinc/96/27/63/697962763.db2.gz	BMGVMDGDFXPSAY-BXKDBHETSA-N	1	1	323.305	1.886	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@@H]1C	ZINC000775100184	697962766	/nfs/dbraw/zinc/96/27/66/697962766.db2.gz	BMGVMDGDFXPSAY-BXKDBHETSA-N	1	1	323.305	1.886	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776583087	698121444	/nfs/dbraw/zinc/12/14/44/698121444.db2.gz	ZLXFRRANJPGGTM-MPKXVKKWSA-N	1	1	307.350	1.214	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776586975	698122489	/nfs/dbraw/zinc/12/24/89/698122489.db2.gz	RTDPGTMBFZCJDY-UKRRQHHQSA-N	1	1	308.334	1.513	20	5		DDBDMO
C[C@H]1CN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC[N@H+]1CCO	ZINC000783680863	698867519	/nfs/dbraw/zinc/86/75/19/698867519.db2.gz	WLDUEAYRDZQGQX-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000353079928	699028993	/nfs/dbraw/zinc/02/89/93/699028993.db2.gz	LBQXSFUYACBUMU-RYUDHWBXSA-N	1	1	321.377	1.950	20	5		DDBDMO
C[C@H]([C@H](C)Nc1nc2ccccn2c1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000729469401	699479524	/nfs/dbraw/zinc/47/95/24/699479524.db2.gz	GINYIKKKAWDNCV-NWDGAFQWSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588969	699642031	/nfs/dbraw/zinc/64/20/31/699642031.db2.gz	GZRZZILHJDSDEE-RCBQFDQVSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588969	699642033	/nfs/dbraw/zinc/64/20/33/699642033.db2.gz	GZRZZILHJDSDEE-RCBQFDQVSA-N	1	1	322.361	1.508	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000794969688	699838997	/nfs/dbraw/zinc/83/89/97/699838997.db2.gz	BFUWFCFDKCCTKJ-FICVDOATSA-N	1	1	320.345	1.715	20	5		DDBDMO
CCc1[nH]nc(C(=O)OCC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000795612230	699878767	/nfs/dbraw/zinc/87/87/67/699878767.db2.gz	OVDZVBLOXMOURT-JTQLQIEISA-N	1	1	310.354	1.912	20	5		DDBDMO
Cc1c(C(=O)NCC[NH+]2CCC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-]	ZINC000752299877	700354553	/nfs/dbraw/zinc/35/45/53/700354553.db2.gz	VBORSLVXJFQFLO-UHFFFAOYSA-N	1	1	322.321	1.555	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)[C@@H](C)C1	ZINC000761067599	700838216	/nfs/dbraw/zinc/83/82/16/700838216.db2.gz	FYWYKDJWQKISFF-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCC(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC000803855397	701149657	/nfs/dbraw/zinc/14/96/57/701149657.db2.gz	HWJBECALJMSQMX-LBPRGKRZSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771404456	701318489	/nfs/dbraw/zinc/31/84/89/701318489.db2.gz	JCWZYHCBJGRYQF-NXEZZACHSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771404456	701318491	/nfs/dbraw/zinc/31/84/91/701318491.db2.gz	JCWZYHCBJGRYQF-NXEZZACHSA-N	1	1	322.321	1.668	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000771946237	701337919	/nfs/dbraw/zinc/33/79/19/701337919.db2.gz	AQBOXKSFWWSGBW-UHFFFAOYSA-N	1	1	307.310	1.275	20	5		DDBDMO
O=C(CC[N@H+]1CCOC[C@@H]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000839533627	701728243	/nfs/dbraw/zinc/72/82/43/701728243.db2.gz	WEYQBRBVLJGJKV-AWEZNQCLSA-N	1	1	323.349	1.007	20	5		DDBDMO
O=C(CC[N@@H+]1CCOC[C@@H]1CCO)Nc1ccc([N+](=O)[O-])cc1	ZINC000839533627	701728251	/nfs/dbraw/zinc/72/82/51/701728251.db2.gz	WEYQBRBVLJGJKV-AWEZNQCLSA-N	1	1	323.349	1.007	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000839636629	701761622	/nfs/dbraw/zinc/76/16/22/701761622.db2.gz	SPONLTJVRYZFJT-TZMCWYRMSA-N	1	1	307.350	1.038	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000879231056	706622828	/nfs/dbraw/zinc/62/28/28/706622828.db2.gz	RRCQDPKLJLBXIK-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000868160298	701970206	/nfs/dbraw/zinc/97/02/06/701970206.db2.gz	DUDFEYCUOQJVJH-DZGCQCFKSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3c(=O)oc4cccc([N+](=O)[O-])c43)C[C@@H]21	ZINC000840134417	701989592	/nfs/dbraw/zinc/98/95/92/701989592.db2.gz	WKRXSYHLQVNAQG-PWSUYJOCSA-N	1	1	318.333	1.096	20	5		DDBDMO
CNC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000879334833	706653768	/nfs/dbraw/zinc/65/37/68/706653768.db2.gz	NQCVVOARICHBPF-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000817374830	702361306	/nfs/dbraw/zinc/36/13/06/702361306.db2.gz	MOSOYRLAAJPWRH-LLVKDONJSA-N	1	1	320.349	1.486	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@H+]1C	ZINC000817492516	702390805	/nfs/dbraw/zinc/39/08/05/702390805.db2.gz	XTECNXXHWMGKQT-CYBMUJFWSA-N	1	1	320.393	1.827	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000842160838	702678169	/nfs/dbraw/zinc/67/81/69/702678169.db2.gz	AJMTWPHLFCHMIR-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCC2	ZINC000818969310	704037656	/nfs/dbraw/zinc/03/76/56/704037656.db2.gz	CPQYEHDJLBDYND-GXFFZTMASA-N	1	1	317.349	1.517	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c(N)cccc2[N+](=O)[O-])CCC1(C)C	ZINC000871156296	704232983	/nfs/dbraw/zinc/23/29/83/704232983.db2.gz	VQHQJZKGCGWMSR-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
CC(C)(CCC(=O)N1CCC[C@H]([NH+]2CCOCC2)C1)[N+](=O)[O-]	ZINC000854726007	704444566	/nfs/dbraw/zinc/44/45/66/704444566.db2.gz	FNXVLIZCPAYKFL-ZDUSSCGKSA-N	1	1	313.398	1.145	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000822506395	704963136	/nfs/dbraw/zinc/96/31/36/704963136.db2.gz	KSRFSEAVDZSFLN-BETUJISGSA-N	1	1	303.362	1.845	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(CCC(C)(C)[N+](=O)[O-])no1	ZINC000823234627	705178735	/nfs/dbraw/zinc/17/87/35/705178735.db2.gz	KLMKZSRVRAFIMC-MRVPVSSYSA-N	1	1	300.315	1.011	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836660	705194001	/nfs/dbraw/zinc/19/40/01/705194001.db2.gz	HOCSLVMOBSCQKT-UONOGXRCSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000874836660	705194006	/nfs/dbraw/zinc/19/40/06/705194006.db2.gz	HOCSLVMOBSCQKT-UONOGXRCSA-N	1	1	305.334	1.609	20	5		DDBDMO
CN1C(=O)NCC12CC[NH+](Cc1ccc([N+](=O)[O-])c(F)c1)CC2	ZINC000823650064	705287451	/nfs/dbraw/zinc/28/74/51/705287451.db2.gz	OUWRWOMFBBEDEF-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCCC[N@H+](C)CC(C)C	ZINC000823817787	705324179	/nfs/dbraw/zinc/32/41/79/705324179.db2.gz	OSRGRCDILRKVGQ-UHFFFAOYSA-N	1	1	311.386	1.194	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823968186	705346826	/nfs/dbraw/zinc/34/68/26/705346826.db2.gz	MNTNISDNQSXLPM-UWVGGRQHSA-N	1	1	307.354	1.733	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000861340622	705433213	/nfs/dbraw/zinc/43/32/13/705433213.db2.gz	KGMBBXXQNQFZRZ-HIFRSBDPSA-N	1	1	308.334	1.861	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000861386772	705453050	/nfs/dbraw/zinc/45/30/50/705453050.db2.gz	OBYHKSYHKOCRNX-UHFFFAOYSA-N	1	1	316.317	1.643	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000861386308	705453450	/nfs/dbraw/zinc/45/34/50/705453450.db2.gz	TXZBMZZOFRSDOS-UHFFFAOYSA-N	1	1	308.290	1.229	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825380313	705658744	/nfs/dbraw/zinc/65/87/44/705658744.db2.gz	YCWNKQBVMNGOGD-CQSZACIVSA-N	1	1	318.333	1.340	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000825676176	705712681	/nfs/dbraw/zinc/71/26/81/705712681.db2.gz	SVXIGNOGWGMSKD-OAHLLOKOSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000862793670	705799510	/nfs/dbraw/zinc/79/95/10/705799510.db2.gz	SKXUIDPQOBDMQZ-JTQLQIEISA-N	1	1	307.354	1.034	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](N2CCOC2=O)C1	ZINC000827000804	705910483	/nfs/dbraw/zinc/91/04/83/705910483.db2.gz	OXOIFLVBRBOJBG-AWEZNQCLSA-N	1	1	305.334	1.930	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827300342	705971181	/nfs/dbraw/zinc/97/11/81/705971181.db2.gz	MJACEPXRDOTZIK-GOEBONIOSA-N	1	1	317.389	1.998	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1	ZINC000827330867	705977545	/nfs/dbraw/zinc/97/75/45/705977545.db2.gz	SKINIXDAJLKNPX-RISCZKNCSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[N@H+](C)C(C)(C)CC1	ZINC000828299730	706156453	/nfs/dbraw/zinc/15/64/53/706156453.db2.gz	JBDORVVLZHKLAH-UHFFFAOYSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000877764917	706202379	/nfs/dbraw/zinc/20/23/79/706202379.db2.gz	SBUOMMVLNJSHLZ-BETUJISGSA-N	1	1	310.350	1.026	20	5		DDBDMO
C[C@@H]1c2sccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000880377833	706956899	/nfs/dbraw/zinc/95/68/99/706956899.db2.gz	GMMNFRWPBVZAQK-MFKMUULPSA-N	1	1	322.390	1.833	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000880571122	707022141	/nfs/dbraw/zinc/02/21/41/707022141.db2.gz	LWJSLLVCJNEOAG-UHFFFAOYSA-N	1	1	320.349	1.294	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](O)c1ccnn1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000927127090	712945185	/nfs/dbraw/zinc/94/51/85/712945185.db2.gz	QWQSNJOQHJYYDB-RNCFNFMXSA-N	1	1	308.313	1.852	20	5		DDBDMO
COc1cc([N+](=O)[O-])cn(Cc2[nH+]ccn2CC(F)F)c1=O	ZINC000882271094	707566393	/nfs/dbraw/zinc/56/63/93/707566393.db2.gz	KVVFPSDCVIVJMK-UHFFFAOYSA-N	1	1	314.248	1.275	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CNC2CC[NH+](C3CC3)CC2)cc1	ZINC000838986836	708010718	/nfs/dbraw/zinc/01/07/18/708010718.db2.gz	OKDBGXNQESYXNZ-INIZCTEOSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+](CCO)CCOCCO	ZINC000839195082	708035253	/nfs/dbraw/zinc/03/52/53/708035253.db2.gz	ZLEHXLUVCMEUBG-UHFFFAOYSA-N	1	1	318.757	1.051	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[N@H+](CCO)CCOCCO	ZINC000839195082	708035255	/nfs/dbraw/zinc/03/52/55/708035255.db2.gz	ZLEHXLUVCMEUBG-UHFFFAOYSA-N	1	1	318.757	1.051	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc43)C[C@]2(C)C1	ZINC000896914383	708181199	/nfs/dbraw/zinc/18/11/99/708181199.db2.gz	CUIMOMJGLIZSOX-OTYXRUKQSA-N	1	1	303.322	1.519	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000897219640	708257404	/nfs/dbraw/zinc/25/74/04/708257404.db2.gz	MFOKNTLWPWLAEH-QWRGUYRKSA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897220526	708258869	/nfs/dbraw/zinc/25/88/69/708258869.db2.gz	XCDXIFYUDIIXLQ-CABCVRRESA-N	1	1	309.341	1.769	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@H](CO)C[C@@H]3CCCO3)c2c1	ZINC000884614246	708339215	/nfs/dbraw/zinc/33/92/15/708339215.db2.gz	IITSMZHKAPYOBM-AAEUAGOBSA-N	1	1	317.345	1.907	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c1	ZINC000886553843	708776812	/nfs/dbraw/zinc/77/68/12/708776812.db2.gz	WQCPYQCMYSXJAN-MBNYWOFBSA-N	1	1	324.402	1.629	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000886848406	708862228	/nfs/dbraw/zinc/86/22/28/708862228.db2.gz	BKGIWGZUDLOBPL-LBPRGKRZSA-N	1	1	323.349	1.794	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000910269080	709853379	/nfs/dbraw/zinc/85/33/79/709853379.db2.gz	DSOGJLVYQBLFKU-SWLSCSKDSA-N	1	1	321.377	1.571	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000893884548	710873769	/nfs/dbraw/zinc/87/37/69/710873769.db2.gz	FANNZIQELAMUIS-GFCCVEGCSA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000893884548	710873771	/nfs/dbraw/zinc/87/37/71/710873771.db2.gz	FANNZIQELAMUIS-GFCCVEGCSA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1cc([C@@H](C)NC[C@]2(O)CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000903154146	711049895	/nfs/dbraw/zinc/04/98/95/711049895.db2.gz	TVNDCMKFHJZYMU-IAQYHMDHSA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+]C[C@]2(O)CCN(C)C2)cc([N+](=O)[O-])c1	ZINC000903154146	711049901	/nfs/dbraw/zinc/04/99/01/711049901.db2.gz	TVNDCMKFHJZYMU-IAQYHMDHSA-N	1	1	309.366	1.321	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])cc1C(F)F	ZINC000894590401	711198479	/nfs/dbraw/zinc/19/84/79/711198479.db2.gz	GTFKMBSTZVFQNG-UHFFFAOYSA-N	1	1	303.309	1.893	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000895101150	711412300	/nfs/dbraw/zinc/41/23/00/711412300.db2.gz	ZVBCHVDECQPBPL-TXEJJXNPSA-N	1	1	320.393	1.873	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@@H+](C)[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545978	713253136	/nfs/dbraw/zinc/25/31/36/713253136.db2.gz	DZAWFIZLIYTBBQ-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/C(=O)N1CC[N@H+](C)[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000913545978	713253139	/nfs/dbraw/zinc/25/31/39/713253139.db2.gz	DZAWFIZLIYTBBQ-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H](Nc1c(Cl)cncc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895248268	711465190	/nfs/dbraw/zinc/46/51/90/711465190.db2.gz	ZPOXDGLMTYDWIL-JOYOIKCWSA-N	1	1	313.789	1.111	20	5		DDBDMO
O=C1C[C@@H](CCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CN1	ZINC000896134125	711680397	/nfs/dbraw/zinc/68/03/97/711680397.db2.gz	IRGNTPQUMUOMSZ-SNVBAGLBSA-N	1	1	300.318	1.503	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000920599392	713682044	/nfs/dbraw/zinc/68/20/44/713682044.db2.gz	TUYFZWKSOOISLL-DGCLKSJQSA-N	1	1	306.366	1.529	20	5		DDBDMO
COCC(COC)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929988947	713730062	/nfs/dbraw/zinc/73/00/62/713730062.db2.gz	PAMZKIPXVYTZKU-LLVKDONJSA-N	1	1	310.354	1.137	20	5		DDBDMO
O=[N+]([O-])CC[N@@H+]1CC[C@@H](Oc2cncc(Br)c2)C1	ZINC000930901431	713953475	/nfs/dbraw/zinc/95/34/75/713953475.db2.gz	MKXYHJSWWFUEQY-SNVBAGLBSA-N	1	1	316.155	1.574	20	5		DDBDMO
O=[N+]([O-])CC[N@H+]1CC[C@@H](Oc2cncc(Br)c2)C1	ZINC000930901431	713953477	/nfs/dbraw/zinc/95/34/77/713953477.db2.gz	MKXYHJSWWFUEQY-SNVBAGLBSA-N	1	1	316.155	1.574	20	5		DDBDMO
Cc1noc(CN2CCC([N@H+]3CCCOCC3)CC2)c1[N+](=O)[O-]	ZINC000931284942	714057754	/nfs/dbraw/zinc/05/77/54/714057754.db2.gz	FDNIRADLYJMKSA-UHFFFAOYSA-N	1	1	324.381	1.578	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)Cc2c[nH]nc21	ZINC000931459973	714102635	/nfs/dbraw/zinc/10/26/35/714102635.db2.gz	CPFNJDDRWVUTRU-QMTHXVAHSA-N	1	1	302.334	1.971	20	5		DDBDMO
CNc1c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cccc1[N+](=O)[O-]	ZINC000923271085	714292174	/nfs/dbraw/zinc/29/21/74/714292174.db2.gz	KKQMVPCKZWXTJV-NEPJUHHUSA-N	1	1	318.377	1.945	20	5		DDBDMO
CNc1ccc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cc1[N+](=O)[O-]	ZINC000923313157	714308126	/nfs/dbraw/zinc/30/81/26/714308126.db2.gz	WIHVKXMCWFEQGX-OLZOCXBDSA-N	1	1	318.377	1.945	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@@H]1[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923370498	714331116	/nfs/dbraw/zinc/33/11/16/714331116.db2.gz	PHLSTBNHCOKJCQ-ZNEHSRBWSA-N	1	1	323.393	1.311	20	5		DDBDMO
Cc1c(C[N@H+]2C[C@@H]3CCC[C@]3(C(N)=O)C2)cccc1[N+](=O)[O-]	ZINC000933758991	714665540	/nfs/dbraw/zinc/66/55/40/714665540.db2.gz	HLPYRWMHIMPNER-BBRMVZONSA-N	1	1	303.362	1.991	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1C1OCCO1	ZINC000933908715	714699525	/nfs/dbraw/zinc/69/95/25/714699525.db2.gz	KVXGTDVRNWGCCG-CYBMUJFWSA-N	1	1	308.334	1.811	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1C1OCCO1	ZINC000933908715	714699526	/nfs/dbraw/zinc/69/95/26/714699526.db2.gz	KVXGTDVRNWGCCG-CYBMUJFWSA-N	1	1	308.334	1.811	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])n1	ZINC000934832075	714912775	/nfs/dbraw/zinc/91/27/75/714912775.db2.gz	NIFDRDMJQCTBSO-OLZOCXBDSA-N	1	1	308.382	1.967	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC001181840547	743361205	/nfs/dbraw/zinc/36/12/05/743361205.db2.gz	TYWKWVDNYWLXLJ-CYBMUJFWSA-N	1	1	321.377	1.699	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc(CF)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031661728	747336738	/nfs/dbraw/zinc/33/67/38/747336738.db2.gz	FZDJCIWWANGZPJ-HUUCEWRRSA-N	1	1	321.352	1.369	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCOC[C@@](O)(C(F)(F)F)C2)C1	ZINC001169014418	762178917	/nfs/dbraw/zinc/17/89/17/762178917.db2.gz	ZLZOUOGVAZSCLT-GMTAPVOTSA-N	1	1	312.288	1.057	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cnn(C)c21	ZINC001169018950	762199437	/nfs/dbraw/zinc/19/94/37/762199437.db2.gz	FROZHUPOLHAYDY-SNPRPXQTSA-N	1	1	322.409	1.801	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169057457	762210898	/nfs/dbraw/zinc/21/08/98/762210898.db2.gz	VKUNMPJXBZNVAU-YNEHKIRRSA-N	1	1	322.365	1.384	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC001097203290	756971817	/nfs/dbraw/zinc/97/18/17/756971817.db2.gz	BJVVSZGWKOOAHD-TXEJJXNPSA-N	1	1	321.381	1.391	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](C/C=C/Cl)CC2	ZINC001050520309	763700048	/nfs/dbraw/zinc/70/00/48/763700048.db2.gz	OQUVMQFTRBEJCU-IYODYBDTSA-N	1	1	313.785	1.329	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC001170334410	766256798	/nfs/dbraw/zinc/25/67/98/766256798.db2.gz	DGUXSSZQEXHVRR-NORZTCDRSA-N	1	1	324.377	1.210	20	5		DDBDMO
Cc1nc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)s1	ZINC001157767016	766565582	/nfs/dbraw/zinc/56/55/82/766565582.db2.gz	DICHZFLLYRKRRL-ZYHUDNBSSA-N	1	1	312.395	1.021	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3N)CC[C@@H]21	ZINC001171815426	776482488	/nfs/dbraw/zinc/48/24/88/776482488.db2.gz	VUEBVRQGQAEVSM-HZMBPMFUSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1ncc(C[NH3+])c(=N)n1[C@@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173218531	777050914	/nfs/dbraw/zinc/05/09/14/777050914.db2.gz	PTYVSOVPLYHCNU-JTQLQIEISA-N	1	1	301.350	1.842	20	5		DDBDMO
O=C(NCCCCCC[NH2+]Cc1cccnc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001178458713	779059269	/nfs/dbraw/zinc/05/92/69/779059269.db2.gz	UINBVUUTPAXSFW-HUUCEWRRSA-N	1	1	320.393	1.513	20	5		DDBDMO
CCOCCC[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178463239	779060879	/nfs/dbraw/zinc/06/08/79/779060879.db2.gz	BMXMOYQHECARQQ-ZIAGYGMSSA-N	1	1	315.414	1.344	20	5		DDBDMO
C[N@@H+](CCNC(=O)COC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1	ZINC001267192138	837508496	/nfs/dbraw/zinc/50/84/96/837508496.db2.gz	IJMBKLPUESDSEV-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC2(CCC2)C1	ZINC001267241391	837589000	/nfs/dbraw/zinc/58/90/00/837589000.db2.gz	WFEXPHYDZMRNIR-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1	ZINC001267241391	837589006	/nfs/dbraw/zinc/58/90/06/837589006.db2.gz	WFEXPHYDZMRNIR-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1	ZINC001267241391	837589014	/nfs/dbraw/zinc/58/90/14/837589014.db2.gz	WFEXPHYDZMRNIR-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN2CCN(c3[nH]cc[nH+]3)CC2)cc1	ZINC001326757416	861594597	/nfs/dbraw/zinc/59/45/97/861594597.db2.gz	ORBBTRDNVVILSJ-AWEZNQCLSA-N	1	1	317.349	1.174	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001293855050	849612956	/nfs/dbraw/zinc/61/29/56/849612956.db2.gz	LHQXWTIHCFXOFB-SFYZADRCSA-N	1	1	315.761	1.384	20	5		DDBDMO
NC(=O)COC1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC001327511127	862229793	/nfs/dbraw/zinc/22/97/93/862229793.db2.gz	BYNPIFPIBHJTCE-UHFFFAOYSA-N	1	1	311.313	1.200	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(NCC[C@@H]2CCC[N@@H+](C)C2)n1	ZINC001156379244	862989252	/nfs/dbraw/zinc/98/92/52/862989252.db2.gz	RJLOIPHKNPNBSP-NSHDSACASA-N	1	1	309.370	1.846	20	5		DDBDMO
Cc1ccsc1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001122710004	858943869	/nfs/dbraw/zinc/94/38/69/858943869.db2.gz	HCJQOQXIRVJOMJ-UHFFFAOYSA-N	1	1	323.378	1.218	20	5		DDBDMO
COC(=O)c1cnc(NCc2ccc(N)[nH+]c2C)c([N+](=O)[O-])c1	ZINC001156974236	863489780	/nfs/dbraw/zinc/48/97/80/863489780.db2.gz	CQDRJMQXEFWXNG-UHFFFAOYSA-N	1	1	317.305	1.674	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3ncc([N+](=O)[O-])c(OC)n3)C[C@H]2C1	ZINC001157689355	864047953	/nfs/dbraw/zinc/04/79/53/864047953.db2.gz	MRQKFFOHOYPRJR-PHIMTYICSA-N	1	1	307.354	1.171	20	5		DDBDMO
CN(C)/C=C/c1cc(N2CC[N@H+]3CC[C@H]3C2)ncc1[N+](=O)[O-]	ZINC001158432319	864652813	/nfs/dbraw/zinc/65/28/13/864652813.db2.gz	JMNFRUIWKJPLIC-LQPUYASZSA-N	1	1	303.366	1.416	20	5		DDBDMO
COC(C)(CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)OC	ZINC001159382917	865266155	/nfs/dbraw/zinc/26/61/55/865266155.db2.gz	SXZLDHVOPJXZPQ-VOTSOKGWSA-N	1	1	310.354	1.943	20	5		DDBDMO
COc1ccnc(NCCC[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC001161700904	866907180	/nfs/dbraw/zinc/90/71/80/866907180.db2.gz	VVRCIDWRSJFAEN-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC001333721528	866963139	/nfs/dbraw/zinc/96/31/39/866963139.db2.gz	IKMANHXZMYLWKT-XHDPSFHLSA-N	1	1	317.349	1.574	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ncnc3cc(F)c([N+](=O)[O-])cc32)C1	ZINC001162683169	867727274	/nfs/dbraw/zinc/72/72/74/867727274.db2.gz	QOQXAKYRTFBMJP-SECBINFHSA-N	1	1	321.312	1.420	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ncnc3cc(F)c([N+](=O)[O-])cc32)C1	ZINC001162683169	867727279	/nfs/dbraw/zinc/72/72/79/867727279.db2.gz	QOQXAKYRTFBMJP-SECBINFHSA-N	1	1	321.312	1.420	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1	ZINC001322752709	868363479	/nfs/dbraw/zinc/36/34/79/868363479.db2.gz	MPAZNEDSTWUGOB-GFCCVEGCSA-N	1	1	308.382	1.580	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC001335565328	868387485	/nfs/dbraw/zinc/38/74/85/868387485.db2.gz	HYCRISVRUHFJHN-KBPBESRZSA-N	1	1	306.366	1.334	20	5		DDBDMO
[NH3+][C@H]1CN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])CCC1(F)F	ZINC001164323902	869127852	/nfs/dbraw/zinc/12/78/52/869127852.db2.gz	ONDOFWXRJNPDAC-ZETCQYMHSA-N	1	1	308.672	1.054	20	5		DDBDMO
CN(C)/C=C/c1cc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ncc1[N+](=O)[O-]	ZINC001165147388	869407835	/nfs/dbraw/zinc/40/78/35/869407835.db2.gz	FKAQKHXNOFFWIL-TWRSITDPSA-N	1	1	317.393	1.520	20	5		DDBDMO
CC[C@H](C)[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(N)=O	ZINC001308074958	871467346	/nfs/dbraw/zinc/46/73/46/871467346.db2.gz	WDKMHOQSMPBTNU-SDBXPKJASA-N	1	1	305.338	1.461	20	5		DDBDMO
C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCN1C	ZINC001345719709	873487655	/nfs/dbraw/zinc/48/76/55/873487655.db2.gz	PHZLXQIRIZAJEB-RISCZKNCSA-N	1	1	321.381	1.351	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1	ZINC001357161632	879826191	/nfs/dbraw/zinc/82/61/91/879826191.db2.gz	WGMSNWKQXLMUER-CJNGLKHVSA-N	1	1	318.377	1.688	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1COC1C[NH+](C(C)C)C1	ZINC001222773933	880692312	/nfs/dbraw/zinc/69/23/12/880692312.db2.gz	MYNHGAKHPAQIQW-UHFFFAOYSA-N	1	1	308.334	1.991	20	5		DDBDMO
COC(=O)c1cc(COC[C@@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001223690409	881059049	/nfs/dbraw/zinc/05/90/49/881059049.db2.gz	JOOKUEGBQDETKL-AWEZNQCLSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cc(COC[C@@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001223690409	881059065	/nfs/dbraw/zinc/05/90/65/881059065.db2.gz	JOOKUEGBQDETKL-AWEZNQCLSA-N	1	1	324.333	1.229	20	5		DDBDMO
CCOC(=O)c1ccc(CO[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001223963838	881165214	/nfs/dbraw/zinc/16/52/14/881165214.db2.gz	RFBXIBAZEWJWCG-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COc1c(C(=O)N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-]	ZINC001289376641	913190355	/nfs/dbraw/zinc/19/03/55/913190355.db2.gz	HDBPGZONABZLEY-BZNIZROVSA-N	1	1	319.361	1.627	20	5		DDBDMO
CC(=O)NC1C[NH+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC001254478507	896456051	/nfs/dbraw/zinc/45/60/51/896456051.db2.gz	FNYLGOQUVGHMRP-UHFFFAOYSA-N	1	1	318.377	1.384	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(CO)[C@@H](O)C1	ZINC001254553295	896497996	/nfs/dbraw/zinc/49/79/96/896497996.db2.gz	UQIKMOKMRJMVPR-KCXAZCMYSA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+](C[C@@H](O)CO)C(C)(C)C	ZINC001254551801	896499563	/nfs/dbraw/zinc/49/95/63/896499563.db2.gz	FWGSCZNGZWYPEW-GXTWGEPZSA-N	1	1	310.394	1.980	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254602291	896527236	/nfs/dbraw/zinc/52/72/36/896527236.db2.gz	CRDDCHAPHCZJPJ-ZIAGYGMSSA-N	1	1	303.318	1.198	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)CCN12	ZINC001254602291	896527248	/nfs/dbraw/zinc/52/72/48/896527248.db2.gz	CRDDCHAPHCZJPJ-ZIAGYGMSSA-N	1	1	303.318	1.198	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC001261810920	899774826	/nfs/dbraw/zinc/77/48/26/899774826.db2.gz	RHXRBNMXPDLTPQ-UHFFFAOYSA-N	1	1	300.318	1.685	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccc2c(c1[N+](=O)[O-])OCCCO2	ZINC001263583208	900641860	/nfs/dbraw/zinc/64/18/60/900641860.db2.gz	AVSRFMASFPZROS-UHFFFAOYSA-N	1	1	322.317	1.619	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(NCC3([NH+]4CCOCC4)CC3)nc2c1	ZINC000278480544	214182226	/nfs/dbraw/zinc/18/22/26/214182226.db2.gz	OQCUWXLSHUDZMW-UHFFFAOYSA-N	1	1	317.349	1.748	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O	ZINC000451334529	231070780	/nfs/dbraw/zinc/07/07/80/231070780.db2.gz	BVFUGYKBVKEADN-BZPMIXESSA-N	1	1	308.382	1.844	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278237667	214039950	/nfs/dbraw/zinc/03/99/50/214039950.db2.gz	VWOGVDKSTFRYDM-UHFFFAOYSA-N	1	1	305.338	1.428	20	5		DDBDMO
NC(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000083127308	185213686	/nfs/dbraw/zinc/21/36/86/185213686.db2.gz	YQYZGGKPWKHQKC-UHFFFAOYSA-N	1	1	304.306	1.433	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000452093838	231298530	/nfs/dbraw/zinc/29/85/30/231298530.db2.gz	JHBLFBMSSKEWGM-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000452093838	231298534	/nfs/dbraw/zinc/29/85/34/231298534.db2.gz	JHBLFBMSSKEWGM-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@H]2CCCC[N@H+]2CCO)cc1[N+](=O)[O-]	ZINC000452363985	231362815	/nfs/dbraw/zinc/36/28/15/231362815.db2.gz	ADAOOBYUIQBQFM-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
CCCN(CC[NH+]1CCCC1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000286611649	219081186	/nfs/dbraw/zinc/08/11/86/219081186.db2.gz	BWGOVEAATQIPNG-UHFFFAOYSA-N	1	1	309.370	1.574	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC1	ZINC000255677041	282273946	/nfs/dbraw/zinc/27/39/46/282273946.db2.gz	RJPIGXFLARZIPN-SREVYHEPSA-N	1	1	319.361	1.399	20	5		DDBDMO
CC1(C)[C@H](O)C[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000563821270	303976328	/nfs/dbraw/zinc/97/63/28/303976328.db2.gz	QBJIKQSUAFPMTP-NWDGAFQWSA-N	1	1	318.333	1.894	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000425047992	529822154	/nfs/dbraw/zinc/82/21/54/529822154.db2.gz	NKNZJADSEGZKQM-GXTWGEPZSA-N	1	1	319.361	1.526	20	5		DDBDMO
CNC(=O)NC(=O)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451554111	529879897	/nfs/dbraw/zinc/87/98/97/529879897.db2.gz	ZHMXVQSFMLUHTA-GFCCVEGCSA-N	1	1	320.349	1.230	20	5		DDBDMO
CNC(=O)NC(=O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451554111	529879898	/nfs/dbraw/zinc/87/98/98/529879898.db2.gz	ZHMXVQSFMLUHTA-GFCCVEGCSA-N	1	1	320.349	1.230	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)CNc1ccccc1[N+](=O)[O-])C1CC1	ZINC000457195122	529882991	/nfs/dbraw/zinc/88/29/91/529882991.db2.gz	GDFANGDLVOAGDB-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[N@@H+](Cc1cnccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181963633	199368208	/nfs/dbraw/zinc/36/82/08/199368208.db2.gz	OLXVJFRTXVVZKQ-ZDUSSCGKSA-N	1	1	318.333	1.257	20	5		DDBDMO
C[N@H+](Cc1cnccn1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181963633	199368210	/nfs/dbraw/zinc/36/82/10/199368210.db2.gz	OLXVJFRTXVVZKQ-ZDUSSCGKSA-N	1	1	318.333	1.257	20	5		DDBDMO
C[C@H](NC(=O)COc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272648483	210052648	/nfs/dbraw/zinc/05/26/48/210052648.db2.gz	DPXPOFBMXMMLRL-LBPRGKRZSA-N	1	1	319.361	1.740	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000287096638	219311151	/nfs/dbraw/zinc/31/11/51/219311151.db2.gz	YZSKYRPDTZJVRU-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000287096638	219311153	/nfs/dbraw/zinc/31/11/53/219311153.db2.gz	YZSKYRPDTZJVRU-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
COc1cc(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000155790589	186113057	/nfs/dbraw/zinc/11/30/57/186113057.db2.gz	YPHSYEARDHOPMK-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000155790589	186113059	/nfs/dbraw/zinc/11/30/59/186113059.db2.gz	YPHSYEARDHOPMK-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@H]([NH3+])[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000237445939	186290269	/nfs/dbraw/zinc/29/02/69/186290269.db2.gz	ZGLPHFSHTJEFLM-UWVGGRQHSA-N	1	1	317.349	1.671	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000277251299	213396570	/nfs/dbraw/zinc/39/65/70/213396570.db2.gz	KIOKQSIAMQYTHK-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000277251297	213395986	/nfs/dbraw/zinc/39/59/86/213395986.db2.gz	KIOKQSIAMQYTHK-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000617285158	363037478	/nfs/dbraw/zinc/03/74/78/363037478.db2.gz	CTDNZDZQJPMGQV-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000617285158	363037484	/nfs/dbraw/zinc/03/74/84/363037484.db2.gz	CTDNZDZQJPMGQV-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](OCCO)C1	ZINC000172296193	198073371	/nfs/dbraw/zinc/07/33/71/198073371.db2.gz	XRYSFXZFDUGACY-AWEZNQCLSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](OCCO)C1	ZINC000172296193	198073373	/nfs/dbraw/zinc/07/33/73/198073373.db2.gz	XRYSFXZFDUGACY-AWEZNQCLSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCCCn1cc[nH+]c1C	ZINC000047676432	352508079	/nfs/dbraw/zinc/50/80/79/352508079.db2.gz	NUHMPWKZBICVKP-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000067703543	353063176	/nfs/dbraw/zinc/06/31/76/353063176.db2.gz	LFLATDWQKVCQAT-WXJAXGNASA-N	1	1	301.346	1.961	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C1CC1	ZINC000067282055	353042138	/nfs/dbraw/zinc/04/21/38/353042138.db2.gz	LKRWXFHBVSYAGK-UHFFFAOYSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000331928307	234287764	/nfs/dbraw/zinc/28/77/64/234287764.db2.gz	DCCVQIMWZFLELA-STQMWFEESA-N	1	1	310.350	1.303	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2CN2CCOCC2)cs1	ZINC000174024695	198282480	/nfs/dbraw/zinc/28/24/80/198282480.db2.gz	BZHBIAVGJVULMY-CYBMUJFWSA-N	1	1	311.407	1.953	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]2CN2CCOCC2)cs1	ZINC000174024695	198282481	/nfs/dbraw/zinc/28/24/81/198282481.db2.gz	BZHBIAVGJVULMY-CYBMUJFWSA-N	1	1	311.407	1.953	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000174536419	198349343	/nfs/dbraw/zinc/34/93/43/198349343.db2.gz	UOVLNXXCOWEEKH-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
CC(C)[N@H+]1CCCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000075938902	353386059	/nfs/dbraw/zinc/38/60/59/353386059.db2.gz	CINCOGGCYDUAJJ-UHFFFAOYSA-N	1	1	320.393	1.610	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000078562781	353521842	/nfs/dbraw/zinc/52/18/42/353521842.db2.gz	OABDMTCCLHWNBH-GFCCVEGCSA-N	1	1	320.393	1.862	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000108301059	353949541	/nfs/dbraw/zinc/94/95/41/353949541.db2.gz	LPPIONYTSIAXAD-GFCCVEGCSA-N	1	1	319.361	1.818	20	5		DDBDMO
CCc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157276644	354224189	/nfs/dbraw/zinc/22/41/89/354224189.db2.gz	QJMLRCIQRMYOIY-NHYWBVRUSA-N	1	1	321.377	1.606	20	5		DDBDMO
CCc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157276644	354224191	/nfs/dbraw/zinc/22/41/91/354224191.db2.gz	QJMLRCIQRMYOIY-NHYWBVRUSA-N	1	1	321.377	1.606	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@H]21	ZINC000284899861	283031997	/nfs/dbraw/zinc/03/19/97/283031997.db2.gz	HOWHDNOUOACTJY-ZJUUUORDSA-N	1	1	323.378	1.213	20	5		DDBDMO
CC[N@@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000588006098	354892796	/nfs/dbraw/zinc/89/27/96/354892796.db2.gz	VRXUYAGWZHHGCX-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000588006098	354892797	/nfs/dbraw/zinc/89/27/97/354892797.db2.gz	VRXUYAGWZHHGCX-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[C@H]([N@H+]3CC[C@@H](O)C3)C2)c1[N+](=O)[O-]	ZINC000588863637	354944225	/nfs/dbraw/zinc/94/42/25/354944225.db2.gz	SGMITZDFPYJMLW-QWHCGFSZSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000590561800	355114686	/nfs/dbraw/zinc/11/46/86/355114686.db2.gz	GVVWGHBUWDPENZ-WDEREUQCSA-N	1	1	309.322	1.123	20	5		DDBDMO
Nc1ccc(N2CC[NH+](Cc3ccncc3)CC2)nc1[N+](=O)[O-]	ZINC000590570652	355116637	/nfs/dbraw/zinc/11/66/37/355116637.db2.gz	RIACFDYKXJWPAX-UHFFFAOYSA-N	1	1	314.349	1.289	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000590758470	355168509	/nfs/dbraw/zinc/16/85/09/355168509.db2.gz	OOFVXVACRAQQMU-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
CN1CC[C@@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000590758470	355168512	/nfs/dbraw/zinc/16/85/12/355168512.db2.gz	OOFVXVACRAQQMU-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
CN1CC[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000590758470	355168513	/nfs/dbraw/zinc/16/85/13/355168513.db2.gz	OOFVXVACRAQQMU-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
CCOc1cc(C[N@@H+](CCO)CCCOC)ccc1[N+](=O)[O-]	ZINC000276967351	213207163	/nfs/dbraw/zinc/20/71/63/213207163.db2.gz	WGRSYZKZWCXXLS-UHFFFAOYSA-N	1	1	312.366	1.824	20	5		DDBDMO
COC(=O)[C@H]1C[C@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000592530717	355615974	/nfs/dbraw/zinc/61/59/74/355615974.db2.gz	GILQIQUMOGUKBD-JSGCOSHPSA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1	ZINC000593028919	355774226	/nfs/dbraw/zinc/77/42/26/355774226.db2.gz	FFXPAVAPRACXDH-DOMZBBRYSA-N	1	1	319.361	1.517	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000593067606	355785617	/nfs/dbraw/zinc/78/56/17/355785617.db2.gz	XEJKIAGDNCXTEC-ZIAGYGMSSA-N	1	1	324.333	1.043	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000593067606	355785620	/nfs/dbraw/zinc/78/56/20/355785620.db2.gz	XEJKIAGDNCXTEC-ZIAGYGMSSA-N	1	1	324.333	1.043	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000593108849	355801018	/nfs/dbraw/zinc/80/10/18/355801018.db2.gz	DRABRPAREPFKRF-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000593108849	355801021	/nfs/dbraw/zinc/80/10/21/355801021.db2.gz	DRABRPAREPFKRF-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@]3(CC3(F)F)C2)c([N+](=O)[O-])c1	ZINC000593117433	355804638	/nfs/dbraw/zinc/80/46/38/355804638.db2.gz	NEKHSHXTSGFEIB-ZDUSSCGKSA-N	1	1	311.288	1.925	20	5		DDBDMO
CCOc1cc(N2CC([N@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000593505232	355906516	/nfs/dbraw/zinc/90/65/16/355906516.db2.gz	UYPHAPIADWTYFO-CYBMUJFWSA-N	1	1	307.350	1.249	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594081522	356107810	/nfs/dbraw/zinc/10/78/10/356107810.db2.gz	OFPMLORGBRPJLP-YPMHNXCESA-N	1	1	319.365	1.550	20	5		DDBDMO
COC(=O)[C@@H]1CC12CC[NH+](Cc1onc(C)c1[N+](=O)[O-])CC2	ZINC000595319687	356448298	/nfs/dbraw/zinc/44/82/98/356448298.db2.gz	CHBHXIUKTJISGB-JTQLQIEISA-N	1	1	309.322	1.666	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000081361390	192257468	/nfs/dbraw/zinc/25/74/68/192257468.db2.gz	NVOMMZBNOCVJRI-GFCCVEGCSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+]C(C)(C)C2)c([N+](=O)[O-])s1	ZINC000601343036	358507620	/nfs/dbraw/zinc/50/76/20/358507620.db2.gz	JJBJVJPGVSMFFZ-UHFFFAOYSA-N	1	1	319.408	1.337	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595836633	356672737	/nfs/dbraw/zinc/67/27/37/356672737.db2.gz	XOVZGFKYJLBIMI-FRRDWIJNSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@]1(C)CO	ZINC000595856995	356679235	/nfs/dbraw/zinc/67/92/35/356679235.db2.gz	HERBBDFSXKPMRO-XNRPHZJLSA-N	1	1	324.377	1.285	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1	ZINC000595826892	356666084	/nfs/dbraw/zinc/66/60/84/356666084.db2.gz	AWPAMPVMNJOSFM-VNHYZAJKSA-N	1	1	322.361	1.303	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000595825777	356666193	/nfs/dbraw/zinc/66/61/93/356666193.db2.gz	GQZUHXAHXUPUOK-CQSZACIVSA-N	1	1	306.366	1.783	20	5		DDBDMO
CN(C)C(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000595825777	356666197	/nfs/dbraw/zinc/66/61/97/356666197.db2.gz	GQZUHXAHXUPUOK-CQSZACIVSA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595880766	356689386	/nfs/dbraw/zinc/68/93/86/356689386.db2.gz	ZBVMGICFWAKHGC-HSMVNMDESA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000595868948	356685126	/nfs/dbraw/zinc/68/51/26/356685126.db2.gz	CNXFAHGXXPBUCR-LRDDRELGSA-N	1	1	321.377	1.874	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNc1c(Cl)cncc1[N+](=O)[O-]	ZINC000596234554	356827148	/nfs/dbraw/zinc/82/71/48/356827148.db2.gz	MRONUIGNHXBXQR-UHFFFAOYSA-N	1	1	315.805	1.361	20	5		DDBDMO
CN(CCCNc1c(Cl)cncc1[N+](=O)[O-])CC[NH+](C)C	ZINC000596234554	356827151	/nfs/dbraw/zinc/82/71/51/356827151.db2.gz	MRONUIGNHXBXQR-UHFFFAOYSA-N	1	1	315.805	1.361	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC[C@H]([NH+]2CCOCC2)C1	ZINC000596246847	356831253	/nfs/dbraw/zinc/83/12/53/356831253.db2.gz	ILCPEOZZJREQFE-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](Nc2c(Cl)cncc2[N+](=O)[O-])C1	ZINC000596122837	356781293	/nfs/dbraw/zinc/78/12/93/356781293.db2.gz	PAMNQKYNZWLCAH-VIFPVBQESA-N	1	1	300.746	1.198	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2c(Cl)cncc2[N+](=O)[O-])C1	ZINC000596122837	356781295	/nfs/dbraw/zinc/78/12/95/356781295.db2.gz	PAMNQKYNZWLCAH-VIFPVBQESA-N	1	1	300.746	1.198	20	5		DDBDMO
C[N@@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	ZINC000597712904	357298132	/nfs/dbraw/zinc/29/81/32/357298132.db2.gz	AECWSVYPPWZXAF-MRXNPFEDSA-N	1	1	319.361	1.858	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2	ZINC000597712904	357298135	/nfs/dbraw/zinc/29/81/35/357298135.db2.gz	AECWSVYPPWZXAF-MRXNPFEDSA-N	1	1	319.361	1.858	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000597925375	357384807	/nfs/dbraw/zinc/38/48/07/357384807.db2.gz	NXYYDEWXWOKXEJ-GFCCVEGCSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000597946285	357394844	/nfs/dbraw/zinc/39/48/44/357394844.db2.gz	NGJDQWGXGHFURV-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CC[N@@H+](C)C1	ZINC000597947460	357395858	/nfs/dbraw/zinc/39/58/58/357395858.db2.gz	YTZKHVSLENYDBE-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CC[N@H+](C)C1	ZINC000597947460	357395860	/nfs/dbraw/zinc/39/58/60/357395860.db2.gz	YTZKHVSLENYDBE-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H]1CC[N@@H+](C)C1	ZINC000597947460	357395864	/nfs/dbraw/zinc/39/58/64/357395864.db2.gz	YTZKHVSLENYDBE-NSHDSACASA-N	1	1	317.349	1.637	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC1CC([NH+]2CCOCC2)C1	ZINC000599094285	357814433	/nfs/dbraw/zinc/81/44/33/357814433.db2.gz	FXXXPFNANPOUOM-UHFFFAOYSA-N	1	1	309.370	1.395	20	5		DDBDMO
COC(=O)c1cnc(NC[C@H]2CCCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000599138080	357826890	/nfs/dbraw/zinc/82/68/90/357826890.db2.gz	FSOLMDQOPIGUNJ-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1c[nH+]cn1Cc1nc(-c2c([N+](=O)[O-])nc(C)n2C)no1	ZINC000599154233	357831023	/nfs/dbraw/zinc/83/10/23/357831023.db2.gz	QTMOSOFLAYRPJE-UHFFFAOYSA-N	1	1	303.282	1.240	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@@H](O)C2)cc1OC(F)F	ZINC000599176020	357840612	/nfs/dbraw/zinc/84/06/12/357840612.db2.gz	OKHXORDZWDOXKY-SNVBAGLBSA-N	1	1	317.292	1.675	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@H]2CCC[C@@H]21	ZINC000599661223	358013587	/nfs/dbraw/zinc/01/35/87/358013587.db2.gz	TVCUSCRLCKCBBO-UPJWGTAASA-N	1	1	322.365	1.455	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000600312985	358193235	/nfs/dbraw/zinc/19/32/35/358193235.db2.gz	WLZOLQLNSKIGLF-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000600472130	358234070	/nfs/dbraw/zinc/23/40/70/358234070.db2.gz	MXUHJTDEHMEEEZ-CYBMUJFWSA-N	1	1	321.381	1.233	20	5		DDBDMO
COC[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601118244	358409827	/nfs/dbraw/zinc/40/98/27/358409827.db2.gz	AXRNDMRJLXDSHX-LBPRGKRZSA-N	1	1	303.318	1.995	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601153043	358424198	/nfs/dbraw/zinc/42/41/98/358424198.db2.gz	UESYIPWYWJRION-UHFFFAOYSA-N	1	1	320.328	1.943	20	5		DDBDMO
Cn1cnc(CCCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)n1	ZINC000601182604	358436968	/nfs/dbraw/zinc/43/69/68/358436968.db2.gz	VWFHMCNLKWLABW-UHFFFAOYSA-N	1	1	312.333	1.738	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CC(C[NH+]2CCOCC2)C1	ZINC000601593702	358616579	/nfs/dbraw/zinc/61/65/79/358616579.db2.gz	FPQLNZBHKHKJGB-UHFFFAOYSA-N	1	1	323.324	1.138	20	5		DDBDMO
CCN1CCN([C@@H](C)C[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000602513319	359021351	/nfs/dbraw/zinc/02/13/51/359021351.db2.gz	BZTSRZHBKNWOTA-HNNXBMFYSA-N	1	1	320.437	1.753	20	5		DDBDMO
CCN(CC)C(=O)C1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602450085	358984845	/nfs/dbraw/zinc/98/48/45/358984845.db2.gz	HJNJNQBHFHIBCX-UHFFFAOYSA-N	1	1	323.397	1.409	20	5		DDBDMO
CN1CCN(C(C)(C)C[NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000602508503	359018905	/nfs/dbraw/zinc/01/89/05/359018905.db2.gz	CMAWQRFMJGJSOI-UHFFFAOYSA-N	1	1	320.437	1.753	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)c([N+](=O)[O-])n1	ZINC000602603217	359066933	/nfs/dbraw/zinc/06/69/33/359066933.db2.gz	WMLAQWUMRGRESY-CYBMUJFWSA-N	1	1	301.350	1.788	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C12CCC2	ZINC000602839810	359228816	/nfs/dbraw/zinc/22/88/16/359228816.db2.gz	LWLCLUUFYHDRQI-OLZOCXBDSA-N	1	1	308.382	1.989	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@H+](C)C[C@@H]1CO	ZINC000602902405	359282924	/nfs/dbraw/zinc/28/29/24/359282924.db2.gz	BWFLOFRWRMVPRU-OAHLLOKOSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C)C[C@@H]1CO	ZINC000602902405	359282929	/nfs/dbraw/zinc/28/29/29/359282929.db2.gz	BWFLOFRWRMVPRU-OAHLLOKOSA-N	1	1	323.393	1.490	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000604546962	359763875	/nfs/dbraw/zinc/76/38/75/359763875.db2.gz	NQVAYVQBWIFMED-SNVBAGLBSA-N	1	1	302.334	1.900	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCOCC(F)F)CC2)cc1	ZINC000188604698	200274491	/nfs/dbraw/zinc/27/44/91/200274491.db2.gz	APSWSGHKSJVRNM-UHFFFAOYSA-N	1	1	315.320	1.999	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1CC(C)(C)O	ZINC000188643916	200280513	/nfs/dbraw/zinc/28/05/13/200280513.db2.gz	BZUYFVWLEAHQEU-SNVBAGLBSA-N	1	1	311.338	1.105	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1CC(C)(C)O	ZINC000188643916	200280515	/nfs/dbraw/zinc/28/05/15/200280515.db2.gz	BZUYFVWLEAHQEU-SNVBAGLBSA-N	1	1	311.338	1.105	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2C)C1	ZINC000609269839	360285826	/nfs/dbraw/zinc/28/58/26/360285826.db2.gz	YDDLJIYVPZJVJP-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H](O)C2CC2)cccc1[N+](=O)[O-]	ZINC000611207335	360660242	/nfs/dbraw/zinc/66/02/42/360660242.db2.gz	ZWJLJSLNDFXJLZ-IAQYHMDHSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@H]1CN(c2nc(C)cc(C)c2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000611615842	360776674	/nfs/dbraw/zinc/77/66/74/360776674.db2.gz	CZVMGNLRQDKSFN-KBPBESRZSA-N	1	1	322.409	1.888	20	5		DDBDMO
COCC[N@H+]1CCCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000611615908	360777481	/nfs/dbraw/zinc/77/74/81/360777481.db2.gz	LMKBVRREKPCNDF-UHFFFAOYSA-N	1	1	308.382	1.765	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CCOCC3(CC3)C2)c([N+](=O)[O-])c1	ZINC000611813101	360832372	/nfs/dbraw/zinc/83/23/72/360832372.db2.gz	DVYPIZLWZZAUHZ-UHFFFAOYSA-N	1	1	305.334	1.306	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCOCC3(CC3)C2)c([N+](=O)[O-])c1	ZINC000611813101	360832374	/nfs/dbraw/zinc/83/23/74/360832374.db2.gz	DVYPIZLWZZAUHZ-UHFFFAOYSA-N	1	1	305.334	1.306	20	5		DDBDMO
Cc1cc(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000292713159	223212941	/nfs/dbraw/zinc/21/29/41/223212941.db2.gz	SVHQUAJLFACGAS-NWDGAFQWSA-N	1	1	311.357	1.934	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000193651094	201096236	/nfs/dbraw/zinc/09/62/36/201096236.db2.gz	IWAZEAFHFGTYAG-NSHDSACASA-N	1	1	322.365	1.499	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000194908235	201310592	/nfs/dbraw/zinc/31/05/92/201310592.db2.gz	BPQHJBKYXMEZLJ-GFCCVEGCSA-N	1	1	309.370	1.028	20	5		DDBDMO
Nc1c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)cccc1[N+](=O)[O-]	ZINC000619252030	363945891	/nfs/dbraw/zinc/94/58/91/363945891.db2.gz	FEUDVSHJUGYHKW-NWDGAFQWSA-N	1	1	322.340	1.435	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2cc(C)c([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000271753305	209183831	/nfs/dbraw/zinc/18/38/31/209183831.db2.gz	ZBKRSPBZEVKMSJ-GFCCVEGCSA-N	1	1	322.365	1.372	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000275067544	212102507	/nfs/dbraw/zinc/10/25/07/212102507.db2.gz	AHXMBWQYVPLIHR-KOLCDFICSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000275067544	212102508	/nfs/dbraw/zinc/10/25/08/212102508.db2.gz	AHXMBWQYVPLIHR-KOLCDFICSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000275067544	212102510	/nfs/dbraw/zinc/10/25/10/212102510.db2.gz	AHXMBWQYVPLIHR-KOLCDFICSA-N	1	1	309.370	1.293	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)C1	ZINC000264611080	204027573	/nfs/dbraw/zinc/02/75/73/204027573.db2.gz	IAAVRFQHFXUONI-LLVKDONJSA-N	1	1	309.391	1.755	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282509848	217050144	/nfs/dbraw/zinc/05/01/44/217050144.db2.gz	RTWNBKWZTNGVGN-HNNXBMFYSA-N	1	1	310.350	1.383	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000288397152	220132021	/nfs/dbraw/zinc/13/20/21/220132021.db2.gz	LANCHZNUJLCTMQ-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@H+](Cc1ccccc1C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266444642	205350065	/nfs/dbraw/zinc/35/00/65/205350065.db2.gz	NLRRXMNCEAWPAB-MRXNPFEDSA-N	1	1	318.377	1.983	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000288501382	220183868	/nfs/dbraw/zinc/18/38/68/220183868.db2.gz	SDMAJRLCCWPNHW-UHFFFAOYSA-N	1	1	315.333	1.274	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCOCC1	ZINC000267558128	206143397	/nfs/dbraw/zinc/14/33/97/206143397.db2.gz	ABJBLEFODYHPGX-MLGOLLRUSA-N	1	1	323.368	1.886	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1N1CCOCC1	ZINC000267558128	206143403	/nfs/dbraw/zinc/14/34/03/206143403.db2.gz	ABJBLEFODYHPGX-MLGOLLRUSA-N	1	1	323.368	1.886	20	5		DDBDMO
Cc1[nH+]c(N2CCOCC2)ccc1Nc1ncc([N+](=O)[O-])cn1	ZINC000273936499	211189632	/nfs/dbraw/zinc/18/96/32/211189632.db2.gz	LBTPPATVWRZHBR-UHFFFAOYSA-N	1	1	316.321	1.668	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CC2)CC1	ZINC000105177186	194082192	/nfs/dbraw/zinc/08/21/92/194082192.db2.gz	YEVQTESVZIEXTH-UHFFFAOYSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1	ZINC000109992068	194303084	/nfs/dbraw/zinc/30/30/84/194303084.db2.gz	DDDVPKPLNAIQRB-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
COCC[N@H+](C)CCNCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000061378383	184169634	/nfs/dbraw/zinc/16/96/34/184169634.db2.gz	CAXCRUWGNLUDBP-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
COCC[N@@H+](C)CCNCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000061378383	184169637	/nfs/dbraw/zinc/16/96/37/184169637.db2.gz	CAXCRUWGNLUDBP-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000424974366	533093325	/nfs/dbraw/zinc/09/33/25/533093325.db2.gz	GDFDYKHLBXACGR-UHFFFAOYSA-N	1	1	311.338	1.371	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[NH+](CCO)CC1	ZINC000156043219	197082422	/nfs/dbraw/zinc/08/24/22/197082422.db2.gz	ZRZIPSRBEPBGQE-UHFFFAOYSA-N	1	1	308.338	1.045	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(NC[C@H]3C[NH+]4CCN3CC4)c2c1	ZINC000413193528	224151863	/nfs/dbraw/zinc/15/18/63/224151863.db2.gz	AFHWXVVYNAWFFX-AWEZNQCLSA-N	1	1	313.361	1.555	20	5		DDBDMO
Cc1cnn(C)c1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000289613568	221103982	/nfs/dbraw/zinc/10/39/82/221103982.db2.gz	JNYLDAIFKHGLDM-UHFFFAOYSA-N	1	1	300.322	1.803	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)C[C@H](C)O	ZINC000289772953	221216288	/nfs/dbraw/zinc/21/62/88/221216288.db2.gz	LKEMCJFDVSCCDO-LBPRGKRZSA-N	1	1	312.366	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)C[C@H](C)O	ZINC000289772953	221216290	/nfs/dbraw/zinc/21/62/90/221216290.db2.gz	LKEMCJFDVSCCDO-LBPRGKRZSA-N	1	1	312.366	1.557	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCNC1	ZINC000423193936	533446413	/nfs/dbraw/zinc/44/64/13/533446413.db2.gz	RCQRFWBUISWOOY-WCQYABFASA-N	1	1	306.366	1.654	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](C)[N@H+]1CCC[C@H](C)C1	ZINC000068203038	406623465	/nfs/dbraw/zinc/62/34/65/406623465.db2.gz	UJBDVVJBXVMRNI-NWDGAFQWSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[NH+]1CCOCC1	ZINC000071899148	406863705	/nfs/dbraw/zinc/86/37/05/406863705.db2.gz	ASHWNSQRMRKDKB-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000013693510	406865798	/nfs/dbraw/zinc/86/57/98/406865798.db2.gz	YARVDZYYGDSMRB-UHFFFAOYSA-N	1	1	315.333	1.291	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC(=O)NC1CC1	ZINC000055899617	407208043	/nfs/dbraw/zinc/20/80/43/407208043.db2.gz	FKQDJMHURCQWBS-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-]	ZINC000123361592	407327000	/nfs/dbraw/zinc/32/70/00/407327000.db2.gz	NLBNAQXTZWUNSH-SNVBAGLBSA-N	1	1	321.337	1.262	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NC[C@H]1CCC[NH2+]C1	ZINC000123383989	407327132	/nfs/dbraw/zinc/32/71/32/407327132.db2.gz	DRDXDQFNYBQQNK-VIFPVBQESA-N	1	1	317.342	1.012	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000124708143	407367154	/nfs/dbraw/zinc/36/71/54/407367154.db2.gz	IJIFRITWZGZUGH-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)CS(C)(=O)=O	ZINC000112618966	407433490	/nfs/dbraw/zinc/43/34/90/407433490.db2.gz	HRDJQEOBEVXVAZ-LBPRGKRZSA-N	1	1	314.407	1.892	20	5		DDBDMO
CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)CS(C)(=O)=O	ZINC000112618966	407433492	/nfs/dbraw/zinc/43/34/92/407433492.db2.gz	HRDJQEOBEVXVAZ-LBPRGKRZSA-N	1	1	314.407	1.892	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000113196892	407474255	/nfs/dbraw/zinc/47/42/55/407474255.db2.gz	XEXCATKZZGNSFQ-GFCCVEGCSA-N	1	1	323.397	1.631	20	5		DDBDMO
NC(=O)CC[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000170731159	407483058	/nfs/dbraw/zinc/48/30/58/407483058.db2.gz	JLQIOGVKYFKFOT-ZDUSSCGKSA-N	1	1	321.377	1.951	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000152157879	407574997	/nfs/dbraw/zinc/57/49/97/407574997.db2.gz	KJYYPVXACNEDEP-UHFFFAOYSA-N	1	1	306.771	1.773	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178859380	407630749	/nfs/dbraw/zinc/63/07/49/407630749.db2.gz	MTPDTPFZIALKRA-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000178859380	407630753	/nfs/dbraw/zinc/63/07/53/407630753.db2.gz	MTPDTPFZIALKRA-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
CN(C)S(=O)(=O)CC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000230987544	407691637	/nfs/dbraw/zinc/69/16/37/407691637.db2.gz	BCANSLFIPHPDDV-UHFFFAOYSA-N	1	1	321.786	1.229	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000171676479	407739499	/nfs/dbraw/zinc/73/94/99/407739499.db2.gz	PCIWHOPMDKMVMR-UHFFFAOYSA-N	1	1	307.354	1.048	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000171676479	407739507	/nfs/dbraw/zinc/73/95/07/407739507.db2.gz	PCIWHOPMDKMVMR-UHFFFAOYSA-N	1	1	307.354	1.048	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117285306	407821342	/nfs/dbraw/zinc/82/13/42/407821342.db2.gz	FGDIXTBUUWOYKO-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117285306	407821348	/nfs/dbraw/zinc/82/13/48/407821348.db2.gz	FGDIXTBUUWOYKO-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866038	407957995	/nfs/dbraw/zinc/95/79/95/407957995.db2.gz	KPSHJFXDYIEGPH-RYUDHWBXSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866038	407958000	/nfs/dbraw/zinc/95/80/00/407958000.db2.gz	KPSHJFXDYIEGPH-RYUDHWBXSA-N	1	1	321.381	1.391	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000181215048	407967567	/nfs/dbraw/zinc/96/75/67/407967567.db2.gz	TYMIEASKASKGFI-AAEUAGOBSA-N	1	1	318.377	1.733	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546642	407976391	/nfs/dbraw/zinc/97/63/91/407976391.db2.gz	KEYPDMKEBPEMJK-NEPJUHHUSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546642	407976393	/nfs/dbraw/zinc/97/63/93/407976393.db2.gz	KEYPDMKEBPEMJK-NEPJUHHUSA-N	1	1	307.350	1.260	20	5		DDBDMO
CN(CCCN1CC[NH+](C)CC1)Cc1c(F)cccc1[N+](=O)[O-]	ZINC000174729880	407982653	/nfs/dbraw/zinc/98/26/53/407982653.db2.gz	WSVLPAGDAFIWMJ-UHFFFAOYSA-N	1	1	324.400	1.803	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1c(C)cc([N+](=O)[O-])cc1C	ZINC000175092037	408049285	/nfs/dbraw/zinc/04/92/85/408049285.db2.gz	UFGDEIRBOLVBEN-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
CC1CC[NH+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000136162145	408084140	/nfs/dbraw/zinc/08/41/40/408084140.db2.gz	MIJHMEKOLATQLI-UHFFFAOYSA-N	1	1	309.370	1.560	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000155943523	408227919	/nfs/dbraw/zinc/22/79/19/408227919.db2.gz	HUBJICSKXCWNDC-GWCFXTLKSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000155943523	408227925	/nfs/dbraw/zinc/22/79/25/408227925.db2.gz	HUBJICSKXCWNDC-GWCFXTLKSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000246673396	408315327	/nfs/dbraw/zinc/31/53/27/408315327.db2.gz	IBVQYERAMSWKOL-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000246673396	408315332	/nfs/dbraw/zinc/31/53/32/408315332.db2.gz	IBVQYERAMSWKOL-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000151263371	408285535	/nfs/dbraw/zinc/28/55/35/408285535.db2.gz	YKOPIYRYUANKRR-OAHLLOKOSA-N	1	1	320.393	1.805	20	5		DDBDMO
Cc1ccc(NC(=O)C[N@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176190644	408303054	/nfs/dbraw/zinc/30/30/54/408303054.db2.gz	VUFROPXLDAFQFJ-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
Cc1ccc(NC(=O)C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176190644	408303062	/nfs/dbraw/zinc/30/30/62/408303062.db2.gz	VUFROPXLDAFQFJ-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)CO	ZINC000190874318	408336242	/nfs/dbraw/zinc/33/62/42/408336242.db2.gz	WGOCPRNAGCYJAW-VHSXEESVSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)CO	ZINC000190874318	408336247	/nfs/dbraw/zinc/33/62/47/408336247.db2.gz	WGOCPRNAGCYJAW-VHSXEESVSA-N	1	1	302.758	1.812	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000134141522	162071853	/nfs/dbraw/zinc/07/18/53/162071853.db2.gz	ZNCDXYRYLWYEOQ-NSHDSACASA-N	1	1	321.352	1.877	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000183186181	408348396	/nfs/dbraw/zinc/34/83/96/408348396.db2.gz	SNKOIZSTJNTCCX-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000183186181	408348397	/nfs/dbraw/zinc/34/83/97/408348397.db2.gz	SNKOIZSTJNTCCX-VXGBXAGGSA-N	1	1	307.350	1.544	20	5		DDBDMO
COc1cc(C[N@@H+](C)CC2CC(O)C2)c([N+](=O)[O-])cc1OC	ZINC000191168115	408381446	/nfs/dbraw/zinc/38/14/46/408381446.db2.gz	BQAXRCAAJSNJIG-UHFFFAOYSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000247377978	408459337	/nfs/dbraw/zinc/45/93/37/408459337.db2.gz	VOFRVNBOCMZUAN-KGLIPLIRSA-N	1	1	307.394	1.524	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176612728	408404224	/nfs/dbraw/zinc/40/42/24/408404224.db2.gz	AKEUCSWDNHJMHS-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000270421240	408528125	/nfs/dbraw/zinc/52/81/25/408528125.db2.gz	GDVVUGMASBDFLJ-MFKMUULPSA-N	1	1	307.350	1.429	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2nccc(C)c2[N+](=O)[O-])CC1	ZINC000265188575	408573291	/nfs/dbraw/zinc/57/32/91/408573291.db2.gz	KFGYOVYWWKQZHJ-ZDUSSCGKSA-N	1	1	321.425	1.984	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000264609583	408540470	/nfs/dbraw/zinc/54/04/70/408540470.db2.gz	ZDAMVITUNCKZRT-CYBMUJFWSA-N	1	1	307.350	1.354	20	5		DDBDMO
CC(C)OC(=O)C[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000184498486	408630191	/nfs/dbraw/zinc/63/01/91/408630191.db2.gz	OCSHAEYGQLDDFB-ZDUSSCGKSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC[N@@H+](CCO)CCNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000184544036	408640774	/nfs/dbraw/zinc/64/07/74/408640774.db2.gz	PPCUTFMEGSDKDW-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
CCN(CCO)CC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000184544036	408640779	/nfs/dbraw/zinc/64/07/79/408640779.db2.gz	PPCUTFMEGSDKDW-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000192820570	408656569	/nfs/dbraw/zinc/65/65/69/408656569.db2.gz	HFDYUOJMAWLYAP-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[N@H+](CCCCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000276460260	408862961	/nfs/dbraw/zinc/86/29/61/408862961.db2.gz	XIOAHXPWMNAPEE-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
C[N@@H+](CCCCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000276460260	408862963	/nfs/dbraw/zinc/86/29/63/408862963.db2.gz	XIOAHXPWMNAPEE-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC000286072320	408918182	/nfs/dbraw/zinc/91/81/82/408918182.db2.gz	VHIPUAMACQNBNY-LBPRGKRZSA-N	1	1	321.381	1.845	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000192496903	163225599	/nfs/dbraw/zinc/22/55/99/163225599.db2.gz	QWUQCDVWTPLAAR-PHIMTYICSA-N	1	1	309.753	1.882	20	5		DDBDMO
C[N@@H+]1CCCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000192850358	163240025	/nfs/dbraw/zinc/24/00/25/163240025.db2.gz	KVVIHGPJPLQFQT-UHFFFAOYSA-N	1	1	313.379	1.062	20	5		DDBDMO
C[N@H+]1CCCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000192850358	163240026	/nfs/dbraw/zinc/24/00/26/163240026.db2.gz	KVVIHGPJPLQFQT-UHFFFAOYSA-N	1	1	313.379	1.062	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CNC(C)(C)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000292080319	408976067	/nfs/dbraw/zinc/97/60/67/408976067.db2.gz	FOFQSUXVXIFLNR-ZDUSSCGKSA-N	1	1	307.394	1.875	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])c(Cl)c3)C[C@H]2C1	ZINC000279194208	409168138	/nfs/dbraw/zinc/16/81/38/409168138.db2.gz	KKQRJSWXPFZLMK-PHIMTYICSA-N	1	1	309.753	1.882	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@H](O)CC2)c([N+](=O)[O-])cc1OC	ZINC000294125099	409244726	/nfs/dbraw/zinc/24/47/26/409244726.db2.gz	UCBDVWGCYSNRNK-LBPRGKRZSA-N	1	1	310.350	1.959	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@H](O)CC2)c([N+](=O)[O-])cc1OC	ZINC000294125099	409244729	/nfs/dbraw/zinc/24/47/29/409244729.db2.gz	UCBDVWGCYSNRNK-LBPRGKRZSA-N	1	1	310.350	1.959	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)n1	ZINC000296079293	409421149	/nfs/dbraw/zinc/42/11/49/409421149.db2.gz	SJECWKPHFWJAIH-FGWVZKOKSA-N	1	1	320.349	1.814	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000295307461	409424050	/nfs/dbraw/zinc/42/40/50/409424050.db2.gz	FSZXYKGUUZMDTI-CVEARBPZSA-N	1	1	321.377	1.379	20	5		DDBDMO
C[C@@H]1CN(C(=O)NCc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000296140937	409444091	/nfs/dbraw/zinc/44/40/91/409444091.db2.gz	CRAQVAKKRUMBKY-TXEJJXNPSA-N	1	1	306.366	1.829	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000317712456	164029111	/nfs/dbraw/zinc/02/91/11/164029111.db2.gz	MAJFDPZOWRFMIF-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1	ZINC000317712456	164029114	/nfs/dbraw/zinc/02/91/14/164029114.db2.gz	MAJFDPZOWRFMIF-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
CNc1c(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000318614215	164032826	/nfs/dbraw/zinc/03/28/26/164032826.db2.gz	JBPICLVSDFZJQV-SNVBAGLBSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1	ZINC000324174992	164050193	/nfs/dbraw/zinc/05/01/93/164050193.db2.gz	WFYGKBDOCUKSOM-AWEZNQCLSA-N	1	1	317.349	1.308	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000408114604	164232885	/nfs/dbraw/zinc/23/28/85/164232885.db2.gz	YGBGQZVWPBUQLB-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000408114604	164232887	/nfs/dbraw/zinc/23/28/87/164232887.db2.gz	YGBGQZVWPBUQLB-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
Cc1nccn1CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000342604859	409760454	/nfs/dbraw/zinc/76/04/54/409760454.db2.gz	FXKTZMKAVIHLED-ZDUSSCGKSA-N	1	1	316.365	1.681	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2COC[C@H](C1)O2)Nc1ccccc1[N+](=O)[O-]	ZINC000338380946	409950228	/nfs/dbraw/zinc/95/02/28/409950228.db2.gz	XSIHJHFOKZCYOQ-TXEJJXNPSA-N	1	1	321.333	1.023	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC[C@H](C1)O2)Nc1ccccc1[N+](=O)[O-]	ZINC000338380946	409950233	/nfs/dbraw/zinc/95/02/33/409950233.db2.gz	XSIHJHFOKZCYOQ-TXEJJXNPSA-N	1	1	321.333	1.023	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)Nc3ccncc3[N+](=O)[O-])C2)C1	ZINC000297883129	410037575	/nfs/dbraw/zinc/03/75/75/410037575.db2.gz	VYUGSGFDBIFBLQ-HNNXBMFYSA-N	1	1	319.365	1.939	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000332309873	410057837	/nfs/dbraw/zinc/05/78/37/410057837.db2.gz	XCILZTUMELFCTK-QWHCGFSZSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[N@@H+](C)CC1	ZINC000298628173	410321852	/nfs/dbraw/zinc/32/18/52/410321852.db2.gz	GUCYLDYTFBQEOG-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000343432244	410448576	/nfs/dbraw/zinc/44/85/76/410448576.db2.gz	KLEQWZGKIDVONH-MFKMUULPSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000343415857	410432280	/nfs/dbraw/zinc/43/22/80/410432280.db2.gz	LPVLZNPDNXGZJM-UMVBOHGHSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC1	ZINC000299098840	410522219	/nfs/dbraw/zinc/52/22/19/410522219.db2.gz	PZKORPBSGAPPDF-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000347480434	410576228	/nfs/dbraw/zinc/57/62/28/410576228.db2.gz	RCPNUUPTIDFHAB-OLZOCXBDSA-N	1	1	312.366	1.427	20	5		DDBDMO
Cc1c(NC(=O)CCN2C[C@@H]3C[NH2+]C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000359305465	410592861	/nfs/dbraw/zinc/59/28/61/410592861.db2.gz	LCIQGKZSBDLDPQ-STQMWFEESA-N	1	1	318.377	1.383	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000343583283	410551764	/nfs/dbraw/zinc/55/17/64/410551764.db2.gz	YGRYMVDBIFJLKQ-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343719438	410643284	/nfs/dbraw/zinc/64/32/84/410643284.db2.gz	CZLLPQJUQRXBKB-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343719438	410643291	/nfs/dbraw/zinc/64/32/91/410643291.db2.gz	CZLLPQJUQRXBKB-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343719438	410643297	/nfs/dbraw/zinc/64/32/97/410643297.db2.gz	CZLLPQJUQRXBKB-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301947445	410837131	/nfs/dbraw/zinc/83/71/31/410837131.db2.gz	YALMSGCNRAFHPW-NSHDSACASA-N	1	1	304.354	1.924	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000343952820	410844582	/nfs/dbraw/zinc/84/45/82/410844582.db2.gz	BQQWCTUQONNCHW-JTQLQIEISA-N	1	1	307.354	1.375	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000330667351	410863925	/nfs/dbraw/zinc/86/39/25/410863925.db2.gz	IUQOJZKRNTXDDC-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1CN(C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000330667351	410863929	/nfs/dbraw/zinc/86/39/29/410863929.db2.gz	IUQOJZKRNTXDDC-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1CN(C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000330667351	410863932	/nfs/dbraw/zinc/86/39/32/410863932.db2.gz	IUQOJZKRNTXDDC-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1	ZINC000344055657	410922982	/nfs/dbraw/zinc/92/29/82/410922982.db2.gz	KUSVPNXLTQARLO-BAESOJJISA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344127847	410973982	/nfs/dbraw/zinc/97/39/82/410973982.db2.gz	KDROLZXLTLMFNA-CHWSQXEVSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000344127847	410973984	/nfs/dbraw/zinc/97/39/84/410973984.db2.gz	KDROLZXLTLMFNA-CHWSQXEVSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC[N@@H+](C)CCN[C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353494857	411031127	/nfs/dbraw/zinc/03/11/27/411031127.db2.gz	GHELZFQKHSRGEV-HNNXBMFYSA-N	1	1	317.393	1.959	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000360256297	411114240	/nfs/dbraw/zinc/11/42/40/411114240.db2.gz	FKMBFQJJFSNNOS-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000360256297	411114243	/nfs/dbraw/zinc/11/42/43/411114243.db2.gz	FKMBFQJJFSNNOS-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@@H](CO)C(C)(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000134398703	196386276	/nfs/dbraw/zinc/38/62/76/196386276.db2.gz	JXSVOWXRCXRIDS-AWEZNQCLSA-N	1	1	323.393	1.896	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000520780149	416976290	/nfs/dbraw/zinc/97/62/90/416976290.db2.gz	FSJVPJRHOPMGMV-JTQLQIEISA-N	1	1	309.370	1.492	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1CCOc1ccccc1[N+](=O)[O-]	ZINC000419335000	226121975	/nfs/dbraw/zinc/12/19/75/226121975.db2.gz	VYAZMLAXPPUEJS-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)C[C@H](CO)C1	ZINC000420940657	226597421	/nfs/dbraw/zinc/59/74/21/226597421.db2.gz	NAVSSGOONGCSGG-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)C[C@H](CO)C1	ZINC000420940657	226597424	/nfs/dbraw/zinc/59/74/24/226597424.db2.gz	NAVSSGOONGCSGG-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCCOC2)O1	ZINC000373809448	418462445	/nfs/dbraw/zinc/46/24/45/418462445.db2.gz	JENQDCOINKARCE-OAHLLOKOSA-N	1	1	324.381	1.451	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000189558593	222047433	/nfs/dbraw/zinc/04/74/33/222047433.db2.gz	AKILFUQAIZUYFN-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000375025228	418590480	/nfs/dbraw/zinc/59/04/80/418590480.db2.gz	YNFVPYGAQJSDTH-UKRRQHHQSA-N	1	1	318.377	1.830	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@@H](n3cncn3)C2)cc1[N+](=O)[O-]	ZINC000375331649	418630198	/nfs/dbraw/zinc/63/01/98/418630198.db2.gz	IUSWRMIFSWAVQI-GFCCVEGCSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](n3cncn3)C2)cc1[N+](=O)[O-]	ZINC000375331649	418630202	/nfs/dbraw/zinc/63/02/02/418630202.db2.gz	IUSWRMIFSWAVQI-GFCCVEGCSA-N	1	1	303.322	1.642	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000368068001	418683927	/nfs/dbraw/zinc/68/39/27/418683927.db2.gz	DNJFVCBVITVRAC-MRXNPFEDSA-N	1	1	321.377	1.534	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](Cc3ccncc3)C2)c1	ZINC000368138689	418695433	/nfs/dbraw/zinc/69/54/33/418695433.db2.gz	KJLVTPWBKGNQCR-AWEZNQCLSA-N	1	1	301.350	1.751	20	5		DDBDMO
CC(=O)N[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000420961016	419388404	/nfs/dbraw/zinc/38/84/04/419388404.db2.gz	SCKCXUKQBYWHBT-GFCCVEGCSA-N	1	1	320.349	1.134	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915446	419369369	/nfs/dbraw/zinc/36/93/69/419369369.db2.gz	HHQVQVAKCIJVMZ-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915446	419369375	/nfs/dbraw/zinc/36/93/75/419369375.db2.gz	HHQVQVAKCIJVMZ-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](C3CCCC3)C2)c1	ZINC000420966308	419387389	/nfs/dbraw/zinc/38/73/89/419387389.db2.gz	VBLOFDOAZGSXIY-UKRRQHHQSA-N	1	1	308.382	1.664	20	5		DDBDMO
Cc1ccc(CN2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000418112745	419541234	/nfs/dbraw/zinc/54/12/34/419541234.db2.gz	LNOXLYBBJPMREP-KGLIPLIRSA-N	1	1	307.394	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CO)[C@@H]1C	ZINC000412063464	419607849	/nfs/dbraw/zinc/60/78/49/419607849.db2.gz	BBSACGKTVXDMOM-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CO)[C@@H]1C	ZINC000412063464	419607861	/nfs/dbraw/zinc/60/78/61/419607861.db2.gz	BBSACGKTVXDMOM-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](CC)[C@H](C)C2)n1	ZINC000427844434	419750534	/nfs/dbraw/zinc/75/05/34/419750534.db2.gz	CUKBEFAKMNOQFE-VXGBXAGGSA-N	1	1	323.397	1.756	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000299419023	229106430	/nfs/dbraw/zinc/10/64/30/229106430.db2.gz	UBFLCHFHUYCGEW-UHFFFAOYSA-N	1	1	303.322	1.502	20	5		DDBDMO
CC(=O)c1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000418991938	420040000	/nfs/dbraw/zinc/04/00/00/420040000.db2.gz	FFMVPCCEODGBFM-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000418991938	420040003	/nfs/dbraw/zinc/04/00/03/420040003.db2.gz	FFMVPCCEODGBFM-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
COc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000418996549	420041374	/nfs/dbraw/zinc/04/13/74/420041374.db2.gz	FJSNLTQUGGGNER-NEPJUHHUSA-N	1	1	309.366	1.495	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000423444705	420052435	/nfs/dbraw/zinc/05/24/35/420052435.db2.gz	XCPRIMBVHOWPPH-GCVYGYKWSA-N	1	1	304.350	1.119	20	5		DDBDMO
Cc1c(CC(=O)N2CC[NH2+]C[C@@](C)(F)C2)cccc1[N+](=O)[O-]	ZINC000423679522	420124274	/nfs/dbraw/zinc/12/42/74/420124274.db2.gz	KNNQVBDOTFKPGD-OAHLLOKOSA-N	1	1	309.341	1.606	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1(CCO)CCOCC1	ZINC000430226462	420091998	/nfs/dbraw/zinc/09/19/98/420091998.db2.gz	MWJQDAJJQUMGRK-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000416298472	420316098	/nfs/dbraw/zinc/31/60/98/420316098.db2.gz	QXAOPILEGCUHOQ-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000416298472	420316101	/nfs/dbraw/zinc/31/61/01/420316101.db2.gz	QXAOPILEGCUHOQ-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000420590588	420325537	/nfs/dbraw/zinc/32/55/37/420325537.db2.gz	VUFNGXOBNLBSIO-QWRGUYRKSA-N	1	1	304.350	1.732	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000420636991	420337303	/nfs/dbraw/zinc/33/73/03/420337303.db2.gz	OCPSXSXTIOJVFG-NSHDSACASA-N	1	1	317.349	1.774	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000420824937	420404722	/nfs/dbraw/zinc/40/47/22/420404722.db2.gz	YDDUSOHYZVWGMI-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@H+]1CCCC1(C)C	ZINC000457082229	420604490	/nfs/dbraw/zinc/60/44/90/420604490.db2.gz	WIONOLDNWIXIPR-UHFFFAOYSA-N	1	1	323.397	1.480	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450947098	420566498	/nfs/dbraw/zinc/56/64/98/420566498.db2.gz	BALUAASOQXGORI-CYBMUJFWSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](CO)[C@H](O)C1	ZINC000459682952	420844761	/nfs/dbraw/zinc/84/47/61/420844761.db2.gz	FJPRSIVYNTUKFQ-TZMCWYRMSA-N	1	1	310.350	1.167	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](CO)[C@H](O)C1	ZINC000459682952	420844764	/nfs/dbraw/zinc/84/47/64/420844764.db2.gz	FJPRSIVYNTUKFQ-TZMCWYRMSA-N	1	1	310.350	1.167	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000454143551	420805436	/nfs/dbraw/zinc/80/54/36/420805436.db2.gz	ZQWKUWDICWHXSL-GXFFZTMASA-N	1	1	320.349	1.771	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000493298962	420812459	/nfs/dbraw/zinc/81/24/59/420812459.db2.gz	ZTFULIUITSYUIV-CFHLNLSMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000493298962	420812461	/nfs/dbraw/zinc/81/24/61/420812461.db2.gz	ZTFULIUITSYUIV-CFHLNLSMSA-N	1	1	319.361	1.133	20	5		DDBDMO
CC1(C)[NH2+]CC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000449749698	421074918	/nfs/dbraw/zinc/07/49/18/421074918.db2.gz	GSJFRTDPOGCROD-LLVKDONJSA-N	1	1	303.322	1.341	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000456317272	421141272	/nfs/dbraw/zinc/14/12/72/421141272.db2.gz	HUKPOVQHGPSXMS-YOGCLGLASA-N	1	1	304.350	1.653	20	5		DDBDMO
CC[N@@H+](C)CCNc1c2ccc(OC)cc2ncc1[N+](=O)[O-]	ZINC000450277213	421176589	/nfs/dbraw/zinc/17/65/89/421176589.db2.gz	LAKDGWCKXONNDE-UHFFFAOYSA-N	1	1	304.350	1.937	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000522901424	421226691	/nfs/dbraw/zinc/22/66/91/421226691.db2.gz	YPTZQMBOIQYONW-LLVKDONJSA-N	1	1	309.370	1.097	20	5		DDBDMO
C[C@@]1(CO)CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000546102804	421284824	/nfs/dbraw/zinc/28/48/24/421284824.db2.gz	MTNGUYTVUCFGDC-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000546102804	421284826	/nfs/dbraw/zinc/28/48/26/421284826.db2.gz	MTNGUYTVUCFGDC-HNNXBMFYSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)NCc1cccc([N+](=O)[O-])c1	ZINC000527523033	421393763	/nfs/dbraw/zinc/39/37/63/421393763.db2.gz	KPCSTCKZXXWJOF-UHFFFAOYSA-N	1	1	304.350	1.656	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000548955262	421488085	/nfs/dbraw/zinc/48/80/85/421488085.db2.gz	ZACBQHAHPAFBLT-QWHCGFSZSA-N	1	1	315.333	1.493	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000516379332	421542974	/nfs/dbraw/zinc/54/29/74/421542974.db2.gz	IAYHNTOFSBYVOH-SNVBAGLBSA-N	1	1	321.333	1.538	20	5		DDBDMO
CCN1C[C@@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000517173111	421599013	/nfs/dbraw/zinc/59/90/13/421599013.db2.gz	QGODVACJGFNOSE-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
CCN1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000517173111	421599016	/nfs/dbraw/zinc/59/90/16/421599016.db2.gz	QGODVACJGFNOSE-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000517173111	421599017	/nfs/dbraw/zinc/59/90/17/421599017.db2.gz	QGODVACJGFNOSE-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000517173111	421599019	/nfs/dbraw/zinc/59/90/19/421599019.db2.gz	QGODVACJGFNOSE-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1cc(C)[nH+]cc1C	ZINC000535748468	421710775	/nfs/dbraw/zinc/71/07/75/421710775.db2.gz	IAORQLCWZWZLRR-UHFFFAOYSA-N	1	1	303.322	1.562	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000582218202	422129924	/nfs/dbraw/zinc/12/99/24/422129924.db2.gz	HRTDYUAZAPNKJI-ZDUSSCGKSA-N	1	1	321.377	1.740	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000574940145	422220889	/nfs/dbraw/zinc/22/08/89/422220889.db2.gz	WPKWGEVLDLEISV-LBPRGKRZSA-N	1	1	312.366	1.691	20	5		DDBDMO
CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000114726424	263337895	/nfs/dbraw/zinc/33/78/95/263337895.db2.gz	CLRAUQLTURPLIU-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCO1	ZINC000114726424	263337898	/nfs/dbraw/zinc/33/78/98/263337898.db2.gz	CLRAUQLTURPLIU-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F	ZINC000293462508	274267092	/nfs/dbraw/zinc/26/70/92/274267092.db2.gz	DHMVMWFIHRANJD-SECBINFHSA-N	1	1	322.283	1.789	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3nccc(C(N)=O)c3[N+](=O)[O-])C2)C1	ZINC000292707590	277073006	/nfs/dbraw/zinc/07/30/06/277073006.db2.gz	GNGHZQNMWICZQI-OAHLLOKOSA-N	1	1	319.365	1.011	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000247318444	277181492	/nfs/dbraw/zinc/18/14/92/277181492.db2.gz	SCUBNYFGNCYQMZ-JSGCOSHPSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[C@H]1C[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC[NH2+]1	ZINC000261783993	279969856	/nfs/dbraw/zinc/96/98/56/279969856.db2.gz	XCTOCCKWCFBMTC-IUCAKERBSA-N	1	1	317.342	1.153	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)Cn2cccn2)C2CC2)cc1	ZINC000179520980	280363542	/nfs/dbraw/zinc/36/35/42/280363542.db2.gz	XRDTZRGJCRKCEC-MRXNPFEDSA-N	1	1	316.361	1.817	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000125399945	281190679	/nfs/dbraw/zinc/19/06/79/281190679.db2.gz	DHDIXYGCFMVVKX-WDEREUQCSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCCO1	ZINC000126074278	281225638	/nfs/dbraw/zinc/22/56/38/281225638.db2.gz	SMHWWKJPEYKESD-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCCO1	ZINC000126074278	281225639	/nfs/dbraw/zinc/22/56/39/281225639.db2.gz	SMHWWKJPEYKESD-ZDUSSCGKSA-N	1	1	307.350	1.695	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNc2ccncc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000357035899	298947375	/nfs/dbraw/zinc/94/73/75/298947375.db2.gz	JHWWBMXGEAYWCK-VXGBXAGGSA-N	1	1	308.382	1.711	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2C[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000362072584	300000500	/nfs/dbraw/zinc/00/05/00/300000500.db2.gz	OVIGEHNKKJIUOL-WDEREUQCSA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2C[C@H](C)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000362072584	300000502	/nfs/dbraw/zinc/00/05/02/300000502.db2.gz	OVIGEHNKKJIUOL-WDEREUQCSA-N	1	1	323.349	1.102	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000363026612	300200504	/nfs/dbraw/zinc/20/05/04/300200504.db2.gz	JVZMEJZCHFFVGX-ZFWWWQNUSA-N	1	1	303.362	1.880	20	5		DDBDMO
Cn1cc(C[C@@H]2CC[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C2)cn1	ZINC000363129519	300216730	/nfs/dbraw/zinc/21/67/30/300216730.db2.gz	IBEJEERRPAGKSD-NSHDSACASA-N	1	1	304.354	1.126	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000370148574	301283792	/nfs/dbraw/zinc/28/37/92/301283792.db2.gz	BFQHNSYPOOGNPN-DAXOMENPSA-N	1	1	305.378	1.654	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)n1	ZINC000370654372	301376384	/nfs/dbraw/zinc/37/63/84/301376384.db2.gz	RYHNIAWPKBXTFQ-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000377609305	302198001	/nfs/dbraw/zinc/19/80/01/302198001.db2.gz	YAMCTOPAPXSLHG-LLVKDONJSA-N	1	1	307.350	1.691	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641910	302360049	/nfs/dbraw/zinc/36/00/49/302360049.db2.gz	XMMALNVQKMATHG-VXGBXAGGSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641910	302360050	/nfs/dbraw/zinc/36/00/50/302360050.db2.gz	XMMALNVQKMATHG-VXGBXAGGSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000362091389	307014156	/nfs/dbraw/zinc/01/41/56/307014156.db2.gz	UQBLICXTDQIMAN-AAEUAGOBSA-N	1	1	321.377	1.792	20	5		DDBDMO
CC1CCC([NH+]2CCC(NC(=O)[C@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000363673370	307032934	/nfs/dbraw/zinc/03/29/34/307032934.db2.gz	CBDKHKHILKBMRE-RIXNLZLZSA-N	1	1	309.410	1.811	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000365194452	307061713	/nfs/dbraw/zinc/06/17/13/307061713.db2.gz	DEBNVBQEPMUKSX-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@@H]2C(=O)NC(=O)[C@H]2C1	ZINC000366304605	307070470	/nfs/dbraw/zinc/07/04/70/307070470.db2.gz	ANBYSSWQTDZQJO-JKOKRWQUSA-N	1	1	317.345	1.559	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000371834245	307158508	/nfs/dbraw/zinc/15/85/08/307158508.db2.gz	IFIRIDZIFBDQML-UKRRQHHQSA-N	1	1	305.378	1.981	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCN2CCOC[C@H]2C1	ZINC000371834245	307158509	/nfs/dbraw/zinc/15/85/09/307158509.db2.gz	IFIRIDZIFBDQML-UKRRQHHQSA-N	1	1	305.378	1.981	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](CCO[C@H]3CCCCO3)C2)c1	ZINC000373107708	307178952	/nfs/dbraw/zinc/17/89/52/307178952.db2.gz	WBPSBGHYKJVNMN-HIFRSBDPSA-N	1	1	324.381	1.971	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@H]2CCC[N@@H+](CCO[C@@H]3CCCCO3)C2)c1	ZINC000373107707	307178967	/nfs/dbraw/zinc/17/89/67/307178967.db2.gz	WBPSBGHYKJVNMN-DZGCQCFKSA-N	1	1	324.381	1.971	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)CC2	ZINC000373195360	307181299	/nfs/dbraw/zinc/18/12/99/307181299.db2.gz	IATWOROKAYXEES-UHFFFAOYSA-N	1	1	320.349	1.396	20	5		DDBDMO
O=C1NCC[C@H]1CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000575192653	308273367	/nfs/dbraw/zinc/27/33/67/308273367.db2.gz	JMIKJCRHCFVURF-NWDGAFQWSA-N	1	1	319.365	1.002	20	5		DDBDMO
Cc1nn(C)c(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000488736626	484216664	/nfs/dbraw/zinc/21/66/64/484216664.db2.gz	VIZKZPOXXSEUNP-GMXVVIOVSA-N	1	1	307.398	1.803	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@H]1C	ZINC000357540309	484508924	/nfs/dbraw/zinc/50/89/24/484508924.db2.gz	XBOUCIATZSDQAZ-MNOVXSKESA-N	1	1	321.381	1.398	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000305816303	533844477	/nfs/dbraw/zinc/84/44/77/533844477.db2.gz	ADQQDBQSJZQXCX-NEPJUHHUSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[C@@H]2CCC[N@@H+](C)C2)n1	ZINC000413448068	534245612	/nfs/dbraw/zinc/24/56/12/534245612.db2.gz	WIPSJWPFJVCANC-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1[nH+]ccn1-c1ccc(CNc2ncc([N+](=O)[O-])cn2)cn1	ZINC000302151380	534767662	/nfs/dbraw/zinc/76/76/62/534767662.db2.gz	KRDGWGZVFMMLKK-UHFFFAOYSA-N	1	1	311.305	1.886	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000491412904	534773099	/nfs/dbraw/zinc/77/30/99/534773099.db2.gz	AYMMXEUKAWMSJO-AATRIKPKSA-N	1	1	300.318	1.929	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000457715347	528983236	/nfs/dbraw/zinc/98/32/36/528983236.db2.gz	FECNFFXDBMRDHE-UHFFFAOYSA-N	1	1	306.366	1.240	20	5		DDBDMO
C[C@@H]1CN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000824994185	608555023	/nfs/dbraw/zinc/55/50/23/608555023.db2.gz	UBYRWGVADQRACN-ZJUUUORDSA-N	1	1	317.353	1.304	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000050900128	696235135	/nfs/dbraw/zinc/23/51/35/696235135.db2.gz	BBEBSEJGPCXGMI-ZDUSSCGKSA-N	1	1	323.397	1.604	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000050900128	696235137	/nfs/dbraw/zinc/23/51/37/696235137.db2.gz	BBEBSEJGPCXGMI-ZDUSSCGKSA-N	1	1	323.397	1.604	20	5		DDBDMO
C[C@H]1C[NH2+]CCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000054371033	696275570	/nfs/dbraw/zinc/27/55/70/696275570.db2.gz	KINBDDOBPHTGDM-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
CCOC(=O)CCC1CC[NH+](Cn2nccc2[N+](=O)[O-])CC1	ZINC000747817292	700087853	/nfs/dbraw/zinc/08/78/53/700087853.db2.gz	YASFHEMLYRIEON-UHFFFAOYSA-N	1	1	310.354	1.804	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N)C(C)C	ZINC000104884066	696621602	/nfs/dbraw/zinc/62/16/02/696621602.db2.gz	ZXVVTZDHUURUFG-UHFFFAOYSA-N	1	1	308.382	1.946	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678493	700176302	/nfs/dbraw/zinc/17/63/02/700176302.db2.gz	SRUWIYVQWAKQAH-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000749678493	700176304	/nfs/dbraw/zinc/17/63/04/700176304.db2.gz	SRUWIYVQWAKQAH-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776588824	698123093	/nfs/dbraw/zinc/12/30/93/698123093.db2.gz	CFHPUYIXBYEGLS-BBRMVZONSA-N	1	1	307.394	1.902	20	5		DDBDMO
O=C1NCC2(CC[NH+](Cc3ccc([N+](=O)[O-])cc3F)CC2)O1	ZINC000781996050	698670702	/nfs/dbraw/zinc/67/07/02/698670702.db2.gz	XYDBTCMSQUIZOH-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
NC(=[NH+]OCCOc1cccc([N+](=O)[O-])c1)C1CCOCC1	ZINC000782332727	698710027	/nfs/dbraw/zinc/71/00/27/698710027.db2.gz	PVYRKJHZEWVZLI-UHFFFAOYSA-N	1	1	309.322	1.899	20	5		DDBDMO
CC[C@@H]1CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000782860963	698774080	/nfs/dbraw/zinc/77/40/80/698774080.db2.gz	TWSGEGHAGLQZPT-GFCCVEGCSA-N	1	1	321.381	1.644	20	5		DDBDMO
COCC[N@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@@H]1CCOC1	ZINC000782961991	698789724	/nfs/dbraw/zinc/78/97/24/698789724.db2.gz	LOEQTNSNJHIQNF-CQSZACIVSA-N	1	1	320.349	1.639	20	5		DDBDMO
COCC[N@@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)[C@@H]1CCOC1	ZINC000782961991	698789727	/nfs/dbraw/zinc/78/97/27/698789727.db2.gz	LOEQTNSNJHIQNF-CQSZACIVSA-N	1	1	320.349	1.639	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000787328290	699206287	/nfs/dbraw/zinc/20/62/87/699206287.db2.gz	QKQBRDZKFRECBF-GDLCADMTSA-N	1	1	308.334	1.512	20	5		DDBDMO
O=C1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CCN1	ZINC000728899502	699459507	/nfs/dbraw/zinc/45/95/07/699459507.db2.gz	ICNOTPDOKSQNLU-UHFFFAOYSA-N	1	1	315.333	1.238	20	5		DDBDMO
O=C1CC[N@@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CCN1	ZINC000728899502	699459513	/nfs/dbraw/zinc/45/95/13/699459513.db2.gz	ICNOTPDOKSQNLU-UHFFFAOYSA-N	1	1	315.333	1.238	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000792865492	699719596	/nfs/dbraw/zinc/71/95/96/699719596.db2.gz	CALJQEVQJMMQGM-ONGXEEELSA-N	1	1	322.321	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@]3(CCCOC3)C2)cc1	ZINC000796081344	699910992	/nfs/dbraw/zinc/91/09/92/699910992.db2.gz	TUNPYINNYUAFOV-HZPDHXFCSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@]3(CCCOC3)C2)cc1	ZINC000796081344	699910994	/nfs/dbraw/zinc/91/09/94/699910994.db2.gz	TUNPYINNYUAFOV-HZPDHXFCSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)n1	ZINC000754208650	700489725	/nfs/dbraw/zinc/48/97/25/700489725.db2.gz	GUOMWUBCRIWAJZ-UHFFFAOYSA-N	1	1	318.293	1.153	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)OCC[C@H]2CCCC[N@H+]2C)n1	ZINC000755575160	700571636	/nfs/dbraw/zinc/57/16/36/700571636.db2.gz	VDNMCJQVRVFQQY-LLVKDONJSA-N	1	1	310.354	1.842	20	5		DDBDMO
COC[C@](C)(CC(=O)OC)[NH2+]Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000755980972	700597247	/nfs/dbraw/zinc/59/72/47/700597247.db2.gz	YEGUUMFXYPHVIX-AWEZNQCLSA-N	1	1	314.313	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@@H+](C)[C@@H](C)C1	ZINC000761072090	700838982	/nfs/dbraw/zinc/83/89/82/700838982.db2.gz	DPSALZQHGCTENT-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)[C@@H](C)C1	ZINC000761072090	700838983	/nfs/dbraw/zinc/83/89/83/700838983.db2.gz	DPSALZQHGCTENT-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C)[C@@H](C)C1	ZINC000761072090	700838986	/nfs/dbraw/zinc/83/89/86/700838986.db2.gz	DPSALZQHGCTENT-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])n1C	ZINC000804451325	701191031	/nfs/dbraw/zinc/19/10/31/701191031.db2.gz	GHIRMJQABNXWNQ-UHFFFAOYSA-N	1	1	320.309	1.915	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCC[C@H]2C)n1	ZINC000804520670	701197254	/nfs/dbraw/zinc/19/72/54/701197254.db2.gz	HMIGSVRXFSOQEZ-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000771931023	701337457	/nfs/dbraw/zinc/33/74/57/701337457.db2.gz	NTJXFOCBRCXODU-UHFFFAOYSA-N	1	1	304.306	1.755	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000879231055	706622914	/nfs/dbraw/zinc/62/29/14/706622914.db2.gz	RRCQDPKLJLBXIK-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
C[C@@H]1CCC[N@@H+]1CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014215	701912438	/nfs/dbraw/zinc/91/24/38/701912438.db2.gz	IQELVJPGDKOIAB-IAQYHMDHSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014215	701912440	/nfs/dbraw/zinc/91/24/40/701912440.db2.gz	IQELVJPGDKOIAB-IAQYHMDHSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@@H]21	ZINC000866205262	706648094	/nfs/dbraw/zinc/64/80/94/706648094.db2.gz	KSZXBAMMVLAMDL-QWRGUYRKSA-N	1	1	302.338	1.168	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1	ZINC000866210126	706649584	/nfs/dbraw/zinc/64/95/84/706649584.db2.gz	YFGYRTVUFHDXIL-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@](O)(C(F)F)C2)c1	ZINC000831175134	706649904	/nfs/dbraw/zinc/64/99/04/706649904.db2.gz	FVKYSZQPRMFPJK-WCQYABFASA-N	1	1	302.277	1.330	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)c(N)c([N+](=O)[O-])c1	ZINC000816949337	702233000	/nfs/dbraw/zinc/23/30/00/702233000.db2.gz	TUIPTCMYZSUVIR-ZWNOBZJWSA-N	1	1	304.350	1.262	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000842045982	702663274	/nfs/dbraw/zinc/66/32/74/702663274.db2.gz	NYILUWRCWLCHHY-QWRGUYRKSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000842045982	702663275	/nfs/dbraw/zinc/66/32/75/702663275.db2.gz	NYILUWRCWLCHHY-QWRGUYRKSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC[C@@H]21	ZINC000879583218	706727621	/nfs/dbraw/zinc/72/76/21/706727621.db2.gz	WQDKDLMIMHYUNA-NHYWBVRUSA-N	1	1	315.377	1.997	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](CCOCCO)C2CCC2)cc1	ZINC000852289831	703997732	/nfs/dbraw/zinc/99/77/32/703997732.db2.gz	DHKVJGGSPAUNAN-INIZCTEOSA-N	1	1	324.377	1.492	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852410509	704036714	/nfs/dbraw/zinc/03/67/14/704036714.db2.gz	CDPYSWPJECBZCH-HUUCEWRRSA-N	1	1	310.350	1.102	20	5		DDBDMO
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C[NH+]1CCCC1	ZINC000818966589	704036740	/nfs/dbraw/zinc/03/67/40/704036740.db2.gz	LMSBEZJZEFIANQ-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
COc1cc(N2CC[NH+](C[C@@H](C)O)CC2)c([N+](=O)[O-])cc1C	ZINC000853265484	704226853	/nfs/dbraw/zinc/22/68/53/704226853.db2.gz	VPJZYDYZHGOMLM-GFCCVEGCSA-N	1	1	309.366	1.415	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000821955461	704847813	/nfs/dbraw/zinc/84/78/13/704847813.db2.gz	RFDCLAXUZKKRFA-HNNXBMFYSA-N	1	1	307.350	1.008	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCCCC[N@H+](C)C1CC1	ZINC000822272159	704903454	/nfs/dbraw/zinc/90/34/54/704903454.db2.gz	JUOQZGMQWRGUJV-UHFFFAOYSA-N	1	1	309.370	1.090	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179374	705163299	/nfs/dbraw/zinc/16/32/99/705163299.db2.gz	MMGGOYZBLMYHMD-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179374	705163300	/nfs/dbraw/zinc/16/33/00/705163300.db2.gz	MMGGOYZBLMYHMD-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
CC(C)[C@H]1CN(C)CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000823179374	705163302	/nfs/dbraw/zinc/16/33/02/705163302.db2.gz	MMGGOYZBLMYHMD-HZPDHXFCSA-N	1	1	307.394	1.900	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000874827728	705186110	/nfs/dbraw/zinc/18/61/10/705186110.db2.gz	SWYYQWWTDQFOBI-KFWWJZLASA-N	1	1	319.361	1.323	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000893877406	710870699	/nfs/dbraw/zinc/87/06/99/710870699.db2.gz	WRCHCWUTQHRLMY-HIFRSBDPSA-N	1	1	318.377	1.483	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000825791307	705731371	/nfs/dbraw/zinc/73/13/71/705731371.db2.gz	GDNNAJGYBRMXJC-AWEZNQCLSA-N	1	1	307.350	1.182	20	5		DDBDMO
CN(C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000825844531	705736232	/nfs/dbraw/zinc/73/62/32/705736232.db2.gz	MCYCXIWNSHGNLL-LSDHHAIUSA-N	1	1	319.361	1.323	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826722481	705857772	/nfs/dbraw/zinc/85/77/72/705857772.db2.gz	QVTVHFREGAESHG-SMDDNHRTSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@H]21	ZINC000827278210	705967350	/nfs/dbraw/zinc/96/73/50/705967350.db2.gz	VDUYPHRLGNACGD-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@@H+]1CC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827302698	705972239	/nfs/dbraw/zinc/97/22/39/705972239.db2.gz	XCFPPVGHDJGRLB-HZMBPMFUSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827302698	705972241	/nfs/dbraw/zinc/97/22/41/705972241.db2.gz	XCFPPVGHDJGRLB-HZMBPMFUSA-N	1	1	305.334	1.467	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000827329457	705976783	/nfs/dbraw/zinc/97/67/83/705976783.db2.gz	GPTJISULARIDQJ-QWHCGFSZSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)N1CC[NH2+]CC1=O	ZINC000863658566	705978394	/nfs/dbraw/zinc/97/83/94/705978394.db2.gz	QLMYIDPXKAIQGD-SECBINFHSA-N	1	1	317.305	1.138	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000828338626	706163101	/nfs/dbraw/zinc/16/31/01/706163101.db2.gz	PQGFHSAWHXGOOQ-UHIISALHSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000828338626	706163102	/nfs/dbraw/zinc/16/31/02/706163102.db2.gz	PQGFHSAWHXGOOQ-UHIISALHSA-N	1	1	307.350	1.179	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@H]2CCC[N@@H+]2CCCO)nc2ccccn21	ZINC000828422922	706176630	/nfs/dbraw/zinc/17/66/30/706176630.db2.gz	SPDBRJKOEHKDDE-GFCCVEGCSA-N	1	1	319.365	1.501	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@H]2C1=O	ZINC000877720370	706188810	/nfs/dbraw/zinc/18/88/10/706188810.db2.gz	OUHRDRNAMPEWTN-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C[C@H]2C1=O	ZINC000877720370	706188815	/nfs/dbraw/zinc/18/88/15/706188815.db2.gz	OUHRDRNAMPEWTN-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H]3CS(=O)(=O)C[C@H]3C2)cc1	ZINC000877789314	706213931	/nfs/dbraw/zinc/21/39/31/706213931.db2.gz	IENXCGBOHLGGCA-UONOGXRCSA-N	1	1	324.402	1.504	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]3CS(=O)(=O)C[C@H]3C2)cc1	ZINC000877789314	706213935	/nfs/dbraw/zinc/21/39/35/706213935.db2.gz	IENXCGBOHLGGCA-UONOGXRCSA-N	1	1	324.402	1.504	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000829020119	706275089	/nfs/dbraw/zinc/27/50/89/706275089.db2.gz	WSQXQVALEDDTMM-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000829020119	706275092	/nfs/dbraw/zinc/27/50/92/706275092.db2.gz	WSQXQVALEDDTMM-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1c(F)cccc1[N+](=O)[O-]	ZINC000865057859	706338015	/nfs/dbraw/zinc/33/80/15/706338015.db2.gz	FXDTVXVYTQFIDS-MNOVXSKESA-N	1	1	323.324	1.327	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCN2CCO[C@H]1C2	ZINC000830292905	706491465	/nfs/dbraw/zinc/49/14/65/706491465.db2.gz	UENYDHHNEJPHFK-OAGGEKHMSA-N	1	1	321.377	1.033	20	5		DDBDMO
CCON(CC)C(=O)CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865965541	706578873	/nfs/dbraw/zinc/57/88/73/706578873.db2.gz	OEFPGXDZIAZBNT-UHFFFAOYSA-N	1	1	318.333	1.777	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000880134030	706886300	/nfs/dbraw/zinc/88/63/00/706886300.db2.gz	LIXPZBIFJYGJHD-UONOGXRCSA-N	1	1	318.377	1.362	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432286	706974123	/nfs/dbraw/zinc/97/41/23/706974123.db2.gz	NAQPICPLXRZSMY-KGLIPLIRSA-N	1	1	320.349	1.707	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432286	706974124	/nfs/dbraw/zinc/97/41/24/706974124.db2.gz	NAQPICPLXRZSMY-KGLIPLIRSA-N	1	1	320.349	1.707	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000832870304	706996953	/nfs/dbraw/zinc/99/69/53/706996953.db2.gz	HJAFSZMXKGDSKJ-SMDDNHRTSA-N	1	1	309.366	1.473	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000880564955	707019959	/nfs/dbraw/zinc/01/99/59/707019959.db2.gz	ALSKIPFRDOPQGH-XHDPSFHLSA-N	1	1	308.334	1.574	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000880609574	707039194	/nfs/dbraw/zinc/03/91/94/707039194.db2.gz	ORUDHCXTIRONEH-PHIMTYICSA-N	1	1	306.366	1.732	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000872266961	707356500	/nfs/dbraw/zinc/35/65/00/707356500.db2.gz	IUNSXZFYRPVYQN-HUUCEWRRSA-N	1	1	321.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCO[C@H](C(F)F)CC2)c1	ZINC000872271346	707358273	/nfs/dbraw/zinc/35/82/73/707358273.db2.gz	NSPFZMJJCOXLJG-OLZOCXBDSA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCO[C@H](C(F)F)CC2)c1	ZINC000872271346	707358279	/nfs/dbraw/zinc/35/82/79/707358279.db2.gz	NSPFZMJJCOXLJG-OLZOCXBDSA-N	1	1	316.304	1.984	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000837175598	707592334	/nfs/dbraw/zinc/59/23/34/707592334.db2.gz	UPPYIFJPUDHEBD-AWEZNQCLSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1)C1CC1	ZINC000837226244	707601591	/nfs/dbraw/zinc/60/15/91/707601591.db2.gz	REYNZYDHJXRFBB-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000882423141	707631464	/nfs/dbraw/zinc/63/14/64/707631464.db2.gz	JGGXWVLDQFCLSR-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000882423141	707631467	/nfs/dbraw/zinc/63/14/67/707631467.db2.gz	JGGXWVLDQFCLSR-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000882476847	707648099	/nfs/dbraw/zinc/64/80/99/707648099.db2.gz	DVQQFFQCFSEFRR-SNVBAGLBSA-N	1	1	323.349	1.436	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000882485671	707656076	/nfs/dbraw/zinc/65/60/76/707656076.db2.gz	JVZNITCCGGHANI-LBPRGKRZSA-N	1	1	307.350	1.356	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000838147246	707854335	/nfs/dbraw/zinc/85/43/35/707854335.db2.gz	BSRMIMDNLFRXCQ-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
O=C1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CN1CC1CC1	ZINC000883403049	707991332	/nfs/dbraw/zinc/99/13/32/707991332.db2.gz	IVRRSDLSZMZCPC-LBPRGKRZSA-N	1	1	307.325	1.834	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CCCN(C=O)CC2)c([N+](=O)[O-])c1	ZINC000839019351	708016394	/nfs/dbraw/zinc/01/63/94/708016394.db2.gz	PYSOHNRVCPXSMA-UHFFFAOYSA-N	1	1	323.349	1.146	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCCN(C=O)CC2)c([N+](=O)[O-])c1	ZINC000839019351	708016395	/nfs/dbraw/zinc/01/63/95/708016395.db2.gz	PYSOHNRVCPXSMA-UHFFFAOYSA-N	1	1	323.349	1.146	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@](O)(CO)C2)cc1Cl	ZINC000839160690	708031484	/nfs/dbraw/zinc/03/14/84/708031484.db2.gz	SMWUVKUJBBMUBT-ZDUSSCGKSA-N	1	1	300.742	1.567	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@](O)(CO)C2)cc1Cl	ZINC000839160690	708031485	/nfs/dbraw/zinc/03/14/85/708031485.db2.gz	SMWUVKUJBBMUBT-ZDUSSCGKSA-N	1	1	300.742	1.567	20	5		DDBDMO
Cc1cnc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897221611	708259365	/nfs/dbraw/zinc/25/93/65/708259365.db2.gz	NSDXAKLRZJVJLE-STQMWFEESA-N	1	1	306.366	1.334	20	5		DDBDMO
COc1cccc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222343	708259851	/nfs/dbraw/zinc/25/98/51/708259851.db2.gz	UQGGXSVURIMMGA-QWHCGFSZSA-N	1	1	321.377	1.639	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN1CCN(C)CC[N@H+](C)CC1	ZINC000897859396	708472800	/nfs/dbraw/zinc/47/28/00/708472800.db2.gz	CFWRFWRWKHOKCY-UHFFFAOYSA-N	1	1	320.437	1.891	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N(C)CC[N@@H+](C)CCO	ZINC000912607160	713046542	/nfs/dbraw/zinc/04/65/42/713046542.db2.gz	CTXBBYRMYPNHIO-UHFFFAOYSA-N	1	1	323.393	1.516	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886344648	708746219	/nfs/dbraw/zinc/74/62/19/708746219.db2.gz	IYJVROLULZUXCO-PHIMTYICSA-N	1	1	303.318	1.845	20	5		DDBDMO
[NH3+][C@@H]1CCO[C@H]([C@H]2CCCN(Cc3cccnc3[N+](=O)[O-])C2)C1	ZINC000886839775	708858614	/nfs/dbraw/zinc/85/86/14/708858614.db2.gz	LVBXBWGPVGWLNV-CFVMTHIKSA-N	1	1	320.393	1.708	20	5		DDBDMO
Cc1cc(C(=O)N2CCN(C)CC[N@@H+](C)CC2)cc([N+](=O)[O-])c1	ZINC000888993694	709426195	/nfs/dbraw/zinc/42/61/95/709426195.db2.gz	CCJYCXWTYPLPBJ-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1cc(C(=O)N2CCN(C)CC[N@H+](C)CC2)cc([N+](=O)[O-])c1	ZINC000888993694	709426196	/nfs/dbraw/zinc/42/61/96/709426196.db2.gz	CCJYCXWTYPLPBJ-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
CN(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC000892419061	710434166	/nfs/dbraw/zinc/43/41/66/710434166.db2.gz	YNBSXOWWPRHVPY-CQSZACIVSA-N	1	1	306.366	1.830	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000893274460	710584149	/nfs/dbraw/zinc/58/41/49/710584149.db2.gz	LXDYSAGDAKCKGW-UHFFFAOYSA-N	1	1	322.317	1.619	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928456454	713204998	/nfs/dbraw/zinc/20/49/98/713204998.db2.gz	RPLYOWIDVQDINW-GXFFZTMASA-N	1	1	318.377	1.992	20	5		DDBDMO
COc1c(O)ccc(CN2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000893669908	710770367	/nfs/dbraw/zinc/77/03/67/710770367.db2.gz	XCLBNAQVRRRBRM-QWRGUYRKSA-N	1	1	309.366	1.833	20	5		DDBDMO
CCO[C@H]1CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000902529677	710783976	/nfs/dbraw/zinc/78/39/76/710783976.db2.gz	XWMJATYIZPEAQY-LBPRGKRZSA-N	1	1	305.338	1.716	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000902529677	710783981	/nfs/dbraw/zinc/78/39/81/710783981.db2.gz	XWMJATYIZPEAQY-LBPRGKRZSA-N	1	1	305.338	1.716	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637830	710832747	/nfs/dbraw/zinc/83/27/47/710832747.db2.gz	JTIILFKOGSSESI-UONOGXRCSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000902637830	710832750	/nfs/dbraw/zinc/83/27/50/710832750.db2.gz	JTIILFKOGSSESI-UONOGXRCSA-N	1	1	317.349	1.920	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@@H+]1CC	ZINC000893874482	710869398	/nfs/dbraw/zinc/86/93/98/710869398.db2.gz	XDUPOSSEAFGTHT-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1CC	ZINC000893874482	710869400	/nfs/dbraw/zinc/86/94/00/710869400.db2.gz	XDUPOSSEAFGTHT-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC000893941489	710894217	/nfs/dbraw/zinc/89/42/17/710894217.db2.gz	SDWBHYGDQJPRLP-FZMZJTMJSA-N	1	1	304.350	1.095	20	5		DDBDMO
COc1c(O)ccc(C[NH+]2CC([C@@H]3CCOC3)C2)c1[N+](=O)[O-]	ZINC000894149762	710986549	/nfs/dbraw/zinc/98/65/49/710986549.db2.gz	VHWDAGYRFWGOJJ-LLVKDONJSA-N	1	1	308.334	1.777	20	5		DDBDMO
COC(=O)N1CC([NH2+][C@H](C)c2cc(OC)cc([N+](=O)[O-])c2)C1	ZINC000903124289	711040300	/nfs/dbraw/zinc/04/03/00/711040300.db2.gz	FAMNRGUGPORQAU-SECBINFHSA-N	1	1	309.322	1.705	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CC[NH+](CCc2ccncc2)CC1	ZINC000894840008	711292329	/nfs/dbraw/zinc/29/23/29/711292329.db2.gz	NNKXRTARDHHHPA-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)[C@H](CO)C1	ZINC000913546380	713253122	/nfs/dbraw/zinc/25/31/22/713253122.db2.gz	OMRCSBCYJJPTKK-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)[C@H](CO)C1	ZINC000913546380	713253124	/nfs/dbraw/zinc/25/31/24/713253124.db2.gz	OMRCSBCYJJPTKK-LMRWQKIVSA-N	1	1	319.361	1.133	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-]	ZINC000895161662	711437709	/nfs/dbraw/zinc/43/77/09/711437709.db2.gz	SSVCJEZNNHARQC-LLVKDONJSA-N	1	1	316.361	1.953	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-]	ZINC000895161662	711437711	/nfs/dbraw/zinc/43/77/11/711437711.db2.gz	SSVCJEZNNHARQC-LLVKDONJSA-N	1	1	316.361	1.953	20	5		DDBDMO
Cc1cc(NCC[N@@H+]2CCC3(C2)OCCO3)ncc1[N+](=O)[O-]	ZINC000895253401	711467521	/nfs/dbraw/zinc/46/75/21/711467521.db2.gz	GWJNONVVLRXEQW-UHFFFAOYSA-N	1	1	308.338	1.159	20	5		DDBDMO
Cc1cc(NCC[N@H+]2CCC3(C2)OCCO3)ncc1[N+](=O)[O-]	ZINC000895253401	711467522	/nfs/dbraw/zinc/46/75/22/711467522.db2.gz	GWJNONVVLRXEQW-UHFFFAOYSA-N	1	1	308.338	1.159	20	5		DDBDMO
COc1cc(CN2CC[C@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OC	ZINC000904406424	711853656	/nfs/dbraw/zinc/85/36/56/711853656.db2.gz	SRZZLCMKEVIXHI-NSHDSACASA-N	1	1	309.366	1.783	20	5		DDBDMO
O=C1C[C@@H]([NH2+]CC[N+](=O)[O-])CN1c1cccc(C(F)(F)F)c1	ZINC000905155670	711954509	/nfs/dbraw/zinc/95/45/09/711954509.db2.gz	QHHYKGDZYYZPGF-SNVBAGLBSA-N	1	1	317.267	1.677	20	5		DDBDMO
CN(C)c1cc[nH+]c(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000905526211	712065391	/nfs/dbraw/zinc/06/53/91/712065391.db2.gz	UQWYWQSHSRCKLT-INIZCTEOSA-N	1	1	316.361	1.879	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000920599394	713682104	/nfs/dbraw/zinc/68/21/04/713682104.db2.gz	TUYFZWKSOOISLL-YPMHNXCESA-N	1	1	306.366	1.529	20	5		DDBDMO
CCOC(=O)/C=C/C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985535	713728980	/nfs/dbraw/zinc/72/89/80/713728980.db2.gz	BUQSPQPDYJHYCX-AAOUONPWSA-N	1	1	320.349	1.595	20	5		DDBDMO
CCOC(=O)/C=C/C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985535	713728982	/nfs/dbraw/zinc/72/89/82/713728982.db2.gz	BUQSPQPDYJHYCX-AAOUONPWSA-N	1	1	320.349	1.595	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)C1(O)CCCC1)C2	ZINC000930100334	713756267	/nfs/dbraw/zinc/75/62/67/713756267.db2.gz	SKNMWCJOYFOZAU-HNNXBMFYSA-N	1	1	306.362	1.619	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000931207519	714036633	/nfs/dbraw/zinc/03/66/33/714036633.db2.gz	XNQPZJVTMGIDTA-ZDUSSCGKSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC1(C)CC(=O)NCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000931207519	714036634	/nfs/dbraw/zinc/03/66/34/714036634.db2.gz	XNQPZJVTMGIDTA-ZDUSSCGKSA-N	1	1	307.350	1.229	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H](C3OCCO3)C2)cc1	ZINC000932003463	714230741	/nfs/dbraw/zinc/23/07/41/714230741.db2.gz	PWASTLKWPCSLRX-GXTWGEPZSA-N	1	1	308.334	1.323	20	5		DDBDMO
Cn1ccc([C@@H]2CCC[N@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000932133074	714267753	/nfs/dbraw/zinc/26/77/53/714267753.db2.gz	RBRGSYGKZWGVKZ-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
Cn1ccc([C@@H]2CCC[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C2)n1	ZINC000932133074	714267754	/nfs/dbraw/zinc/26/77/54/714267754.db2.gz	RBRGSYGKZWGVKZ-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000933438649	714589071	/nfs/dbraw/zinc/58/90/71/714589071.db2.gz	BGSBDSMFPFMONP-PWSUYJOCSA-N	1	1	309.370	1.041	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114481	714745212	/nfs/dbraw/zinc/74/52/12/714745212.db2.gz	JCDOJVLCJOUKJX-QLFBSQMISA-N	1	1	319.361	1.809	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114481	714745214	/nfs/dbraw/zinc/74/52/14/714745214.db2.gz	JCDOJVLCJOUKJX-QLFBSQMISA-N	1	1	319.361	1.809	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120447	714747303	/nfs/dbraw/zinc/74/73/03/714747303.db2.gz	HFAHTNJCMULCOG-WCQYABFASA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120447	714747305	/nfs/dbraw/zinc/74/73/05/714747305.db2.gz	HFAHTNJCMULCOG-WCQYABFASA-N	1	1	307.350	1.951	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934260296	714778511	/nfs/dbraw/zinc/77/85/11/714778511.db2.gz	WDBIAULKMYMJLT-HOTGVXAUSA-N	1	1	323.368	1.765	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CC[N@H+]1C	ZINC000925423559	714852118	/nfs/dbraw/zinc/85/21/18/714852118.db2.gz	QWTPSTMBCSDNHI-ZDUSSCGKSA-N	1	1	306.366	1.483	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ncnc4cc([N+](=O)[O-])ccc43)C[C@H]21	ZINC001164667329	719389162	/nfs/dbraw/zinc/38/91/62/719389162.db2.gz	NVBGKOPMJYIDNC-KGLIPLIRSA-N	1	1	315.333	1.057	20	5		DDBDMO
C[C@H](Nc1c2c(ccc1[N+](=O)[O-])NCC2)[C@H]1C[N@@H+](C)CCN1C	ZINC001120960725	782258611	/nfs/dbraw/zinc/25/86/11/782258611.db2.gz	WTKRFGWXGPFIAZ-XHDPSFHLSA-N	1	1	319.409	1.609	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCc3[nH+]ccn3CC2)c([N+](=O)[O-])c1	ZINC001167177904	732805557	/nfs/dbraw/zinc/80/55/57/732805557.db2.gz	AIJLCMSKEKCVAO-UHFFFAOYSA-N	1	1	304.266	1.157	20	5		DDBDMO
CCOc1nc(N2CCc3[nH+]ccn3CC2)ccc1[N+](=O)[O-]	ZINC001167179997	732808068	/nfs/dbraw/zinc/80/80/68/732808068.db2.gz	CNQAFADQIGMCBJ-UHFFFAOYSA-N	1	1	303.322	1.648	20	5		DDBDMO
CC(C)[C@@](C)(Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)C(N)=O	ZINC001167419218	733433973	/nfs/dbraw/zinc/43/39/73/733433973.db2.gz	SWEZQIPITIXQMJ-MRXNPFEDSA-N	1	1	320.393	1.895	20	5		DDBDMO
CC(C)[C@@](C)(Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)C(N)=O	ZINC001167419218	733433974	/nfs/dbraw/zinc/43/39/74/733433974.db2.gz	SWEZQIPITIXQMJ-MRXNPFEDSA-N	1	1	320.393	1.895	20	5		DDBDMO
C[C@@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000928246694	740129902	/nfs/dbraw/zinc/12/99/02/740129902.db2.gz	LBZJLXMFZLQIGH-RIEGTJTDSA-N	1	1	307.350	1.227	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2CC=C(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1	ZINC001000675149	762078504	/nfs/dbraw/zinc/07/85/04/762078504.db2.gz	RZDAHYJIFBTUGS-HUUCEWRRSA-N	1	1	321.421	1.836	20	5		DDBDMO
CC1(C)CC(C[N@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC001000675149	762078510	/nfs/dbraw/zinc/07/85/10/762078510.db2.gz	RZDAHYJIFBTUGS-HUUCEWRRSA-N	1	1	321.421	1.836	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2CC=C(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC001000675149	762078515	/nfs/dbraw/zinc/07/85/15/762078515.db2.gz	RZDAHYJIFBTUGS-HUUCEWRRSA-N	1	1	321.421	1.836	20	5		DDBDMO
Cc1cncnc1O[C@@H]1CC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169053209	762207682	/nfs/dbraw/zinc/20/76/82/762207682.db2.gz	IEJSUKLVBVTMAX-MGPQQGTHSA-N	1	1	306.366	1.684	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1)C1CCC1	ZINC001169057438	762211308	/nfs/dbraw/zinc/21/13/08/762211308.db2.gz	VIOXNHDUPCBKPX-BPLDGKMQSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CC2CCC3(CC3)CC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139478	760614100	/nfs/dbraw/zinc/61/41/00/760614100.db2.gz	ALERMNFYCMSRFS-KBUPBQIOSA-N	1	1	321.421	1.859	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCCNc1ncccc1[N+](=O)[O-]	ZINC001109520992	763780443	/nfs/dbraw/zinc/78/04/43/763780443.db2.gz	VGPUNZZLTALPTP-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCOC[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334100	766256476	/nfs/dbraw/zinc/25/64/76/766256476.db2.gz	BLDCXUKLPVYLEM-YPMHNXCESA-N	1	1	310.350	1.228	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1cc([N+](=O)[O-])cnc1OC	ZINC001170516690	767741561	/nfs/dbraw/zinc/74/15/61/767741561.db2.gz	UKEIZEFQJBQIPK-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
C[C@H]1CC[C@H](C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001148488725	773499011	/nfs/dbraw/zinc/49/90/11/773499011.db2.gz	KJFTUEYWRCHIGC-HAQNSBGRSA-N	1	1	323.397	1.360	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1ccc([N+](=O)[O-])cn1	ZINC001093952609	775259720	/nfs/dbraw/zinc/25/97/20/775259720.db2.gz	HWFGRJJUVRHWLV-UHFFFAOYSA-N	1	1	309.370	1.248	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCNc1ccc([N+](=O)[O-])cc1	ZINC001094456570	775894513	/nfs/dbraw/zinc/89/45/13/775894513.db2.gz	JQXOIVGALMOYIZ-UHFFFAOYSA-N	1	1	308.382	1.853	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001094517466	775976047	/nfs/dbraw/zinc/97/60/47/775976047.db2.gz	STVPGLKNFVWYBJ-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCC2	ZINC001177740280	778718110	/nfs/dbraw/zinc/71/81/10/778718110.db2.gz	GRUYXUXFIWRWGI-UHFFFAOYSA-N	1	1	316.317	1.433	20	5		DDBDMO
C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCNS(C)(=O)=O	ZINC001116444010	780509730	/nfs/dbraw/zinc/50/97/30/780509730.db2.gz	NORZJLQSEDJNBQ-ALCCZGGFSA-N	1	1	313.379	1.089	20	5		DDBDMO
C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCNS(C)(=O)=O	ZINC001116444010	780509735	/nfs/dbraw/zinc/50/97/35/780509735.db2.gz	NORZJLQSEDJNBQ-ALCCZGGFSA-N	1	1	313.379	1.089	20	5		DDBDMO
Nc1cc(N2CCC[N@H+]3CCC[C@H]3C2)cc(CO)c1[N+](=O)[O-]	ZINC001117284247	780704998	/nfs/dbraw/zinc/70/49/98/780704998.db2.gz	CDOMHAKUKYNOCS-LBPRGKRZSA-N	1	1	306.366	1.344	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC001119948626	781693566	/nfs/dbraw/zinc/69/35/66/781693566.db2.gz	QELVHAFMNDOANR-WCQYABFASA-N	1	1	305.382	1.781	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(CNC(=O)C2(C)CCC2)CC1	ZINC001269469893	841668931	/nfs/dbraw/zinc/66/89/31/841668931.db2.gz	ZWWQLUSMKYDWAK-UHFFFAOYSA-N	1	1	321.381	1.257	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC001150030317	862038156	/nfs/dbraw/zinc/03/81/56/862038156.db2.gz	LHNSTEVKAGJJNX-JQWIXIFHSA-N	1	1	320.349	1.252	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC[NH+]2CC=CC2)c1[N+](=O)[O-]	ZINC001328565625	863071109	/nfs/dbraw/zinc/07/11/09/863071109.db2.gz	UAGGIMLJBOVKKC-UHFFFAOYSA-N	1	1	306.322	1.369	20	5		DDBDMO
CCC[N@@H+]1C[C@H]2CN(c3ccc([N+](=O)[O-])c(OC)n3)C[C@H]2C1	ZINC001157688026	864046547	/nfs/dbraw/zinc/04/65/47/864046547.db2.gz	ALSCOCVADGVFHO-TXEJJXNPSA-N	1	1	306.366	1.776	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001161042340	866310756	/nfs/dbraw/zinc/31/07/56/866310756.db2.gz	MHTHJFACDMPZMD-RVAOTSRCSA-N	1	1	320.349	1.743	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC001320547820	866816724	/nfs/dbraw/zinc/81/67/24/866816724.db2.gz	LHTGXXIPCBPPHO-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@H]1C	ZINC001320547820	866816738	/nfs/dbraw/zinc/81/67/38/866816738.db2.gz	LHTGXXIPCBPPHO-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CN(Cc1ncccn1)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001163926933	868798707	/nfs/dbraw/zinc/79/87/07/868798707.db2.gz	OGRNBPKWVMVKMG-VMPITWQZSA-N	1	1	314.349	1.949	20	5		DDBDMO
COc1cccc(C(=O)NC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001336223741	868801036	/nfs/dbraw/zinc/80/10/36/868801036.db2.gz	MIIXPVVUKIFVJN-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762922	869128888	/nfs/dbraw/zinc/12/88/88/869128888.db2.gz	JQZIEUZWERRKAH-BBRMVZONSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762922	869128897	/nfs/dbraw/zinc/12/88/97/869128897.db2.gz	JQZIEUZWERRKAH-BBRMVZONSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762922	869128905	/nfs/dbraw/zinc/12/89/05/869128905.db2.gz	JQZIEUZWERRKAH-BBRMVZONSA-N	1	1	307.394	1.948	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCCC[N@H+]1C	ZINC001339153804	870375580	/nfs/dbraw/zinc/37/55/80/870375580.db2.gz	YQPGEOSSTIAXNR-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+](CCNC(=O)Cc1cc[nH]n1)Cc1ccccc1[N+](=O)[O-]	ZINC001317441118	870839748	/nfs/dbraw/zinc/83/97/48/870839748.db2.gz	ATXBBBNDISOKBU-UHFFFAOYSA-N	1	1	317.349	1.109	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cc1cc[nH]n1)Cc1ccccc1[N+](=O)[O-]	ZINC001317441118	870839760	/nfs/dbraw/zinc/83/97/60/870839760.db2.gz	ATXBBBNDISOKBU-UHFFFAOYSA-N	1	1	317.349	1.109	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCn1cnnc1	ZINC001308050427	871465649	/nfs/dbraw/zinc/46/56/49/871465649.db2.gz	GWNDYKUDUZCARJ-UHFFFAOYSA-N	1	1	305.338	1.587	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH+]3CCC(CO)(CO)CC3)nc2c1	ZINC001308061137	871466856	/nfs/dbraw/zinc/46/68/56/871466856.db2.gz	DGFXQWZWSUMNIT-UHFFFAOYSA-N	1	1	321.333	1.303	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@H](CCO)[C@H](CO)C1	ZINC001308982659	871543335	/nfs/dbraw/zinc/54/33/35/871543335.db2.gz	FVLIVSWWJKWIIW-KBPBESRZSA-N	1	1	308.378	1.634	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc2ncc([N+](=O)[O-])n2n1	ZINC001348031228	874339574	/nfs/dbraw/zinc/33/95/74/874339574.db2.gz	IQROKTLJSHSKOU-KOLCDFICSA-N	1	1	302.338	1.532	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001348223683	874434316	/nfs/dbraw/zinc/43/43/16/874434316.db2.gz	GCOXVLOSLVBQIX-FZZIBODNSA-N	1	1	305.334	1.370	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001348223683	874434322	/nfs/dbraw/zinc/43/43/22/874434322.db2.gz	GCOXVLOSLVBQIX-FZZIBODNSA-N	1	1	305.334	1.370	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc3ccc([N+](=O)[O-])cc3o2)C1	ZINC001227232545	882921353	/nfs/dbraw/zinc/92/13/53/882921353.db2.gz	UIOHWCOTLVCMKW-LLVKDONJSA-N	1	1	307.306	1.836	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCc2cc(C(=O)OC)cc([N+](=O)[O-])c2)C1	ZINC001223688266	881058382	/nfs/dbraw/zinc/05/83/82/881058382.db2.gz	HEDWMPUGYOOTKV-CQSZACIVSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc2c(c1)nc(=O)[nH]c2O[C@@H](C)C[N+](C)(C)C	ZINC001230206031	884374599	/nfs/dbraw/zinc/37/45/99/884374599.db2.gz	YZZJRHIWPSFGTD-JTQLQIEISA-O	1	1	320.369	1.596	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])c(C(C)=O)c2)C1	ZINC001233498233	887041379	/nfs/dbraw/zinc/04/13/79/887041379.db2.gz	JYDHUIURQJRUEK-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])c(C(C)=O)c2)C1	ZINC001233498233	887041394	/nfs/dbraw/zinc/04/13/94/887041394.db2.gz	JYDHUIURQJRUEK-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2nncn2CC1	ZINC001254553497	896498679	/nfs/dbraw/zinc/49/86/79/896498679.db2.gz	WDLGOACBEBESKM-LBPRGKRZSA-N	1	1	301.350	1.676	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NCCc1cn2c([nH+]1)CCCC2	ZINC001258022870	898023681	/nfs/dbraw/zinc/02/36/81/898023681.db2.gz	DXABFGASUZTKDM-UHFFFAOYSA-N	1	1	301.350	1.908	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2C)C[C@H]1C	ZINC001262864550	900401669	/nfs/dbraw/zinc/40/16/69/900401669.db2.gz	JVURDXUIZSQWNV-SNVBAGLBSA-N	1	1	320.353	1.514	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc(C[N+](=O)[O-])n2CC(C)C)C[C@@H]1C	ZINC001263414580	900604742	/nfs/dbraw/zinc/60/47/42/900604742.db2.gz	FKEBXLRZUIAVFS-LBPRGKRZSA-N	1	1	310.402	1.241	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000295792672	529382057	/nfs/dbraw/zinc/38/20/57/529382057.db2.gz	VHFBNRIOHDXCLK-SNVBAGLBSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000295792672	529382060	/nfs/dbraw/zinc/38/20/60/529382060.db2.gz	VHFBNRIOHDXCLK-SNVBAGLBSA-N	1	1	315.757	1.889	20	5		DDBDMO
O=C1NCCN1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451550133	231123202	/nfs/dbraw/zinc/12/32/02/231123202.db2.gz	REZBRCHPDDQYSC-CQSZACIVSA-N	1	1	318.377	1.799	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072391	231291088	/nfs/dbraw/zinc/29/10/88/231291088.db2.gz	WPPMAFWQJZSQIP-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452072391	231291091	/nfs/dbraw/zinc/29/10/91/231291091.db2.gz	WPPMAFWQJZSQIP-UHIISALHSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000495218716	529573467	/nfs/dbraw/zinc/57/34/67/529573467.db2.gz	GHSJYZBGIVUXMP-OAHLLOKOSA-N	1	1	310.350	1.829	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286645614	219101295	/nfs/dbraw/zinc/10/12/95/219101295.db2.gz	UALZPJGHNAVZEL-ZIAGYGMSSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000412411335	530060961	/nfs/dbraw/zinc/06/09/61/530060961.db2.gz	AVJCAKDQBNOHEC-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CN1	ZINC000369483126	307121293	/nfs/dbraw/zinc/12/12/93/307121293.db2.gz	GLICAXYPFYNNRM-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CN1	ZINC000369483126	307121294	/nfs/dbraw/zinc/12/12/94/307121294.db2.gz	GLICAXYPFYNNRM-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCS(=O)(=O)C1	ZINC000060379795	352870030	/nfs/dbraw/zinc/87/00/30/352870030.db2.gz	GGPJQHLKMYIGBW-AWEZNQCLSA-N	1	1	312.391	1.646	20	5		DDBDMO
CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCS(=O)(=O)C1	ZINC000060379795	352870031	/nfs/dbraw/zinc/87/00/31/352870031.db2.gz	GGPJQHLKMYIGBW-AWEZNQCLSA-N	1	1	312.391	1.646	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]2C[NH+]2CCCCC2)c1[N+](=O)[O-]	ZINC000069489947	353162870	/nfs/dbraw/zinc/16/28/70/353162870.db2.gz	CNUARBSWHTZKBC-LBPRGKRZSA-N	1	1	321.381	1.717	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000074105514	353292570	/nfs/dbraw/zinc/29/25/70/353292570.db2.gz	CMTWVNJZTJUVII-CYBMUJFWSA-N	1	1	321.377	1.364	20	5		DDBDMO
Cc1nn(C)c(N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074772865	353330052	/nfs/dbraw/zinc/33/00/52/353330052.db2.gz	DNZXIRVVONSORZ-ZDUSSCGKSA-N	1	1	307.398	1.805	20	5		DDBDMO
COC(=O)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000076118101	353400437	/nfs/dbraw/zinc/40/04/37/353400437.db2.gz	DEPGIZIYVDNRKE-UHFFFAOYSA-N	1	1	322.361	1.791	20	5		DDBDMO
COC(=O)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000076118101	353400440	/nfs/dbraw/zinc/40/04/40/353400440.db2.gz	DEPGIZIYVDNRKE-UHFFFAOYSA-N	1	1	322.361	1.791	20	5		DDBDMO
C[N@H+]1CCCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC1	ZINC000078359792	353512946	/nfs/dbraw/zinc/51/29/46/353512946.db2.gz	XZHHMSRVEHJQAG-UHFFFAOYSA-N	1	1	318.377	1.629	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[N@H+](C2CCOCC2)CC1	ZINC000077990040	353500477	/nfs/dbraw/zinc/50/04/77/353500477.db2.gz	CUMBHGYSOCUUNR-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
CCOC(=O)CC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000355797602	291010967	/nfs/dbraw/zinc/01/09/67/291010967.db2.gz	VKGJBROPRCMMRM-UHFFFAOYSA-N	1	1	310.354	1.494	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2cccs2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000145704781	354157572	/nfs/dbraw/zinc/15/75/72/354157572.db2.gz	RAUQUTIQQYZGMZ-UONOGXRCSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2cccs2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000145704412	354157735	/nfs/dbraw/zinc/15/77/35/354157735.db2.gz	RAUQUTIQQYZGMZ-KBPBESRZSA-N	1	1	323.418	1.742	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CCc3c[nH+]cn3C2)c([N+](=O)[O-])c1	ZINC000588067834	354899288	/nfs/dbraw/zinc/89/92/88/354899288.db2.gz	UAZIYASEKBKKHS-NSHDSACASA-N	1	1	315.333	1.578	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@H](C)O)C(C)C)c1	ZINC000589499611	354997112	/nfs/dbraw/zinc/99/71/12/354997112.db2.gz	XOWVQSIBVRXKSP-NSHDSACASA-N	1	1	310.350	1.973	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000589836345	355024240	/nfs/dbraw/zinc/02/42/40/355024240.db2.gz	AMRCYFFKKBVLJS-VIFPVBQESA-N	1	1	313.304	1.626	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1	ZINC000590444725	355098406	/nfs/dbraw/zinc/09/84/06/355098406.db2.gz	KEKZHHWPPQVFME-ZUZCIYMTSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000591028150	355235814	/nfs/dbraw/zinc/23/58/14/355235814.db2.gz	LJORTYWOXWTGBX-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H](NCC(=O)N1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000591577147	355329963	/nfs/dbraw/zinc/32/99/63/355329963.db2.gz	OWJFMMLSAVSBER-CQSZACIVSA-N	1	1	306.366	1.067	20	5		DDBDMO
CCCN(C(=O)COc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592831910	355707271	/nfs/dbraw/zinc/70/72/71/355707271.db2.gz	QGQURPPYGOWQDV-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1	ZINC000593018892	355771442	/nfs/dbraw/zinc/77/14/42/355771442.db2.gz	BRLLJQBFZKGJGX-RYUDHWBXSA-N	1	1	321.377	1.906	20	5		DDBDMO
COCC[N@@H+]1CCN(Cc2cc(O)ccc2[N+](=O)[O-])C(C)(C)C1	ZINC000593099757	355796927	/nfs/dbraw/zinc/79/69/27/355796927.db2.gz	CZCXTWSXYKKGCP-UHFFFAOYSA-N	1	1	323.393	1.843	20	5		DDBDMO
COCC[N@H+]1CCN(Cc2cc(O)ccc2[N+](=O)[O-])C(C)(C)C1	ZINC000593099757	355796929	/nfs/dbraw/zinc/79/69/29/355796929.db2.gz	CZCXTWSXYKKGCP-UHFFFAOYSA-N	1	1	323.393	1.843	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCCCC[C@H]2CO)c1	ZINC000594014451	356087147	/nfs/dbraw/zinc/08/71/47/356087147.db2.gz	DSXLYSZZRUDDDH-GJZGRUSLSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1	ZINC000594065073	356103800	/nfs/dbraw/zinc/10/38/00/356103800.db2.gz	OABGGTCGZFOGPL-JTQLQIEISA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1	ZINC000594065073	356103804	/nfs/dbraw/zinc/10/38/04/356103804.db2.gz	OABGGTCGZFOGPL-JTQLQIEISA-N	1	1	318.333	1.990	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594200387	356138160	/nfs/dbraw/zinc/13/81/60/356138160.db2.gz	LRQWSSHZPJDCFR-QWHCGFSZSA-N	1	1	306.366	1.680	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)c([N+](=O)[O-])s1	ZINC000601338521	358505512	/nfs/dbraw/zinc/50/55/12/358505512.db2.gz	XWMTZKYDPKKUIO-OCAPTIKFSA-N	1	1	319.408	1.336	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000595475286	356508677	/nfs/dbraw/zinc/50/86/77/356508677.db2.gz	HHSHZWSQZCIQPV-UHFFFAOYSA-N	1	1	300.330	1.953	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000595536004	356537559	/nfs/dbraw/zinc/53/75/59/356537559.db2.gz	LTFACGYHCDUPFL-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC(C[NH2+]C)CC2)c1[N+](=O)[O-]	ZINC000236883784	202052148	/nfs/dbraw/zinc/05/21/48/202052148.db2.gz	DIDWXNVYFJVJIW-UHFFFAOYSA-N	1	1	309.370	1.342	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595742440	356631210	/nfs/dbraw/zinc/63/12/10/356631210.db2.gz	GMDNDLJIJKUQOS-ZAZJYDDPSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595742440	356631211	/nfs/dbraw/zinc/63/12/11/356631211.db2.gz	GMDNDLJIJKUQOS-ZAZJYDDPSA-N	1	1	321.377	1.871	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595752121	356635969	/nfs/dbraw/zinc/63/59/69/356635969.db2.gz	SLLQNSCWVHMDGP-INIZCTEOSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595752121	356635974	/nfs/dbraw/zinc/63/59/74/356635974.db2.gz	SLLQNSCWVHMDGP-INIZCTEOSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1COCCO1	ZINC000595738481	356629369	/nfs/dbraw/zinc/62/93/69/356629369.db2.gz	JDHDEEUXBNLMOU-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595755406	356637489	/nfs/dbraw/zinc/63/74/89/356637489.db2.gz	ADXYPANMRDXJOW-WQGACYEGSA-N	1	1	319.361	1.890	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c([N+](=O)[O-])c1	ZINC000595762097	356641905	/nfs/dbraw/zinc/64/19/05/356641905.db2.gz	ZXPOWZPUZRFGGD-MLGOLLRUSA-N	1	1	322.361	1.951	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595836635	356672515	/nfs/dbraw/zinc/67/25/15/356672515.db2.gz	XOVZGFKYJLBIMI-UPJWGTAASA-N	1	1	319.361	1.890	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3ccc4ncc([N+](=O)[O-])n4n3)[C@@H]2C1	ZINC000425283742	283206041	/nfs/dbraw/zinc/20/60/41/283206041.db2.gz	MQHRCLKVLHUMIK-WDEREUQCSA-N	1	1	302.338	1.168	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNc1c(Cl)cncc1[N+](=O)[O-]	ZINC000596110548	356775190	/nfs/dbraw/zinc/77/51/90/356775190.db2.gz	OXHSCCJOCOIMOL-JTQLQIEISA-N	1	1	314.773	1.588	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@H](C(C)C)N2CC[NH+](C)CC2)n1	ZINC000177999722	198802111	/nfs/dbraw/zinc/80/21/11/198802111.db2.gz	RDIUNDSWDTWQKS-OAHLLOKOSA-N	1	1	321.425	1.982	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000597925758	357384444	/nfs/dbraw/zinc/38/44/44/357384444.db2.gz	QYUIJRXBWYBCQS-GFCCVEGCSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597944664	357393944	/nfs/dbraw/zinc/39/39/44/357393944.db2.gz	DNJNTWHSVJCOPE-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C3CCCCC3)C2)n1	ZINC000598218892	357497166	/nfs/dbraw/zinc/49/71/66/357497166.db2.gz	IYJBJOXCZKLKIS-LLVKDONJSA-N	1	1	321.381	1.465	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000598648862	357670502	/nfs/dbraw/zinc/67/05/02/357670502.db2.gz	IAHAZUMIZJXQCD-CHWSQXEVSA-N	1	1	321.377	1.874	20	5		DDBDMO
C/C=C\C[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000599689900	358026735	/nfs/dbraw/zinc/02/67/35/358026735.db2.gz	LLRZMWMUWOUTCZ-CLGDDFHISA-N	1	1	308.382	1.830	20	5		DDBDMO
C/C=C\C[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000599689903	358026921	/nfs/dbraw/zinc/02/69/21/358026921.db2.gz	LLRZMWMUWOUTCZ-KXAWDHGWSA-N	1	1	308.382	1.830	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@H]2COCC[NH2+]2)o1	ZINC000600677938	358280469	/nfs/dbraw/zinc/28/04/69/358280469.db2.gz	LQOPDIGPWLDLKA-LBPRGKRZSA-N	1	1	317.345	1.933	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ncc(F)cc3[N+](=O)[O-])CC2)C1	ZINC000601115798	358408733	/nfs/dbraw/zinc/40/87/33/358408733.db2.gz	CGYCLGUSIHKEKC-CYBMUJFWSA-N	1	1	323.372	1.345	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@H](CO)[C@@H](O)C3)c2c1	ZINC000601153055	358424082	/nfs/dbraw/zinc/42/40/82/358424082.db2.gz	UXTHWLQQXGPNJB-BMIGLBTASA-N	1	1	303.318	1.323	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601171152	358431190	/nfs/dbraw/zinc/43/11/90/358431190.db2.gz	GNWJFSKDTKNWPM-HUUCEWRRSA-N	1	1	303.318	1.781	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](CO)C1	ZINC000601979306	358763842	/nfs/dbraw/zinc/76/38/42/358763842.db2.gz	DMACHBCQHYGIDU-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](CO)C1	ZINC000601979306	358763846	/nfs/dbraw/zinc/76/38/46/358763846.db2.gz	DMACHBCQHYGIDU-SNVBAGLBSA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000602141055	358841004	/nfs/dbraw/zinc/84/10/04/358841004.db2.gz	KPWCOCQJMMVFRT-ZDUSSCGKSA-N	1	1	321.381	1.439	20	5		DDBDMO
COCCCOC1CC[NH+](Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602478036	359004894	/nfs/dbraw/zinc/00/48/94/359004894.db2.gz	NSBQCWYQAYDLRB-UHFFFAOYSA-N	1	1	312.370	1.346	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCS[C@@H]2COCC[C@H]21	ZINC000602784995	359190804	/nfs/dbraw/zinc/19/08/04/359190804.db2.gz	QVMXZSIOTLZBTR-VXGBXAGGSA-N	1	1	312.395	1.306	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602687450	359125808	/nfs/dbraw/zinc/12/58/08/359125808.db2.gz	WMROOACAHWDTER-LLVKDONJSA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602687450	359125810	/nfs/dbraw/zinc/12/58/10/359125810.db2.gz	WMROOACAHWDTER-LLVKDONJSA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@H]1CN(Cc2cn(C)nc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000602843064	359231418	/nfs/dbraw/zinc/23/14/18/359231418.db2.gz	YRDOOUHBFMXWQU-LBPRGKRZSA-N	1	1	307.398	1.635	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCCC[C@@H]1[C@H]1CNC(=O)C1	ZINC000602795883	359197746	/nfs/dbraw/zinc/19/77/46/359197746.db2.gz	BYAGAKDJUMSECD-CHWSQXEVSA-N	1	1	321.381	1.090	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1C1CCOCC1	ZINC000602803121	359202755	/nfs/dbraw/zinc/20/27/55/359202755.db2.gz	WKJOXMNGENVLCC-CQSZACIVSA-N	1	1	308.382	1.991	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000602899325	359281115	/nfs/dbraw/zinc/28/11/15/359281115.db2.gz	PNCNHHNHGNOMIP-ZFWWWQNUSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]1C1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000603400291	359616393	/nfs/dbraw/zinc/61/63/93/359616393.db2.gz	FLZPXJUIRMSHJF-SNVBAGLBSA-N	1	1	312.395	1.741	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000603400291	359616395	/nfs/dbraw/zinc/61/63/95/359616395.db2.gz	FLZPXJUIRMSHJF-SNVBAGLBSA-N	1	1	312.395	1.741	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000188324999	200228324	/nfs/dbraw/zinc/22/83/24/200228324.db2.gz	CJZIBOSUASZQNZ-LBPRGKRZSA-N	1	1	320.393	1.885	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000189329925	200383063	/nfs/dbraw/zinc/38/30/63/200383063.db2.gz	BIDIYOISNYOWCL-LLVKDONJSA-N	1	1	322.365	1.554	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1	ZINC000609269116	360285272	/nfs/dbraw/zinc/28/52/72/360285272.db2.gz	LFKIQEROWAIKGK-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
CNc1ccc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000609413056	360305520	/nfs/dbraw/zinc/30/55/20/360305520.db2.gz	ZNHRUGUACHGFFR-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000609279556	360287454	/nfs/dbraw/zinc/28/74/54/360287454.db2.gz	JRIQMJQZOOLONE-CYBMUJFWSA-N	1	1	322.365	1.827	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000609673806	360342744	/nfs/dbraw/zinc/34/27/44/360342744.db2.gz	LDXQRHUEXBHVTR-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000609673806	360342750	/nfs/dbraw/zinc/34/27/50/360342750.db2.gz	LDXQRHUEXBHVTR-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C[C@H](O)C2CC2)c([N+](=O)[O-])c1	ZINC000610571771	360472708	/nfs/dbraw/zinc/47/27/08/360472708.db2.gz	NQZUPMMCYGSXOF-AWEZNQCLSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H]1COCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610990903	360591748	/nfs/dbraw/zinc/59/17/48/360591748.db2.gz	UFQGIZKERFOUGH-OCCSQVGLSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1cc(C[N@H+](CC(N)=O)C2CCCC2)ccc1[N+](=O)[O-]	ZINC000611515845	360742693	/nfs/dbraw/zinc/74/26/93/360742693.db2.gz	OBMDHLXHCVKXNQ-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1cc(C[N@@H+](CC(N)=O)C2CCCC2)ccc1[N+](=O)[O-]	ZINC000611515845	360742694	/nfs/dbraw/zinc/74/26/94/360742694.db2.gz	OBMDHLXHCVKXNQ-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000612030670	360895303	/nfs/dbraw/zinc/89/53/03/360895303.db2.gz	WIWJMUGNOLWRJS-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c1[N+](=O)[O-]	ZINC000193279833	201018565	/nfs/dbraw/zinc/01/85/65/201018565.db2.gz	YEOGVLFOGPXMRQ-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@H]1[NH2+]CCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000193558628	201074600	/nfs/dbraw/zinc/07/46/00/201074600.db2.gz	WKGPLULPBKGMAC-KCJUWKMLSA-N	1	1	303.322	1.341	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000193574230	201078619	/nfs/dbraw/zinc/07/86/19/201078619.db2.gz	QMGNXXBZDBUEON-NSHDSACASA-N	1	1	308.338	1.300	20	5		DDBDMO
C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H](C[NH3+])C1	ZINC000261729547	203102796	/nfs/dbraw/zinc/10/27/96/203102796.db2.gz	HOENHBNUUQHUBQ-KOLCDFICSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCCO1	ZINC000271731146	209164721	/nfs/dbraw/zinc/16/47/21/209164721.db2.gz	MZSCYGMMOWYSQD-RWMBFGLXSA-N	1	1	321.377	1.929	20	5		DDBDMO
C[C@H]1C[C@H]([NH+]2CCCC2)CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000288343456	220095772	/nfs/dbraw/zinc/09/57/72/220095772.db2.gz	JXMCWJSRBAIJOQ-FZMZJTMJSA-N	1	1	319.361	1.999	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000288490011	220175567	/nfs/dbraw/zinc/17/55/67/220175567.db2.gz	ROIRPQDEJWBKOD-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]Cc2ccoc2)cc1	ZINC000567201536	304202716	/nfs/dbraw/zinc/20/27/16/304202716.db2.gz	AIKXFBBKCAXLGP-UHFFFAOYSA-N	1	1	310.331	1.751	20	5		DDBDMO
COCC[N@@H+](C)CCNc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000336858843	249266946	/nfs/dbraw/zinc/26/69/46/249266946.db2.gz	BYZKNEQODDQETJ-UHFFFAOYSA-N	1	1	311.338	1.372	20	5		DDBDMO
Cc1ccc(CN2CC[N@H+](C[C@H](C)O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000284432071	218024561	/nfs/dbraw/zinc/02/45/61/218024561.db2.gz	SBADETLVKFJRMB-KGLIPLIRSA-N	1	1	307.394	1.790	20	5		DDBDMO
CC[C@]1(C)COCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871816	251254009	/nfs/dbraw/zinc/25/40/09/251254009.db2.gz	CXSDYYZHWCYEMM-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)COCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871816	251254013	/nfs/dbraw/zinc/25/40/13/251254013.db2.gz	CXSDYYZHWCYEMM-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC(=O)N1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000065209191	184314471	/nfs/dbraw/zinc/31/44/71/184314471.db2.gz	DCAUTUUYXIKDQX-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@@H]1[NH3+]	ZINC000269175284	207295931	/nfs/dbraw/zinc/29/59/31/207295931.db2.gz	BMJWXEPDFSPFTO-KWQFWETISA-N	1	1	303.322	1.280	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[NH2+]Cc2ccccc21	ZINC000269193313	207312272	/nfs/dbraw/zinc/31/22/72/207312272.db2.gz	YKXCAWIBSPNYGA-UHFFFAOYSA-N	1	1	315.333	1.236	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](CO)[C@H]2CCCO2)c(F)c1	ZINC000352403964	285028016	/nfs/dbraw/zinc/02/80/16/285028016.db2.gz	ZVWOFLRGOOESDQ-QWHCGFSZSA-N	1	1	302.277	1.503	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CC[NH+](CCO)CC1	ZINC000119882117	195054945	/nfs/dbraw/zinc/05/49/45/195054945.db2.gz	MUWKZROFDMLIPG-UHFFFAOYSA-N	1	1	322.365	1.353	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000156258596	197099550	/nfs/dbraw/zinc/09/95/50/197099550.db2.gz	VTKPJYOJPIIESW-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)C[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000156258596	197099551	/nfs/dbraw/zinc/09/95/51/197099551.db2.gz	VTKPJYOJPIIESW-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)C1	ZINC000352689903	285230370	/nfs/dbraw/zinc/23/03/70/285230370.db2.gz	DKHYIGCHSAULNM-NSHDSACASA-N	1	1	303.366	1.997	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000154980170	197010160	/nfs/dbraw/zinc/01/01/60/197010160.db2.gz	IVAFMDQOBUXUAP-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
CCS(=O)(=O)C[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC	ZINC000121050340	195287859	/nfs/dbraw/zinc/28/78/59/195287859.db2.gz	XZNJMDSYPGPRAK-SNVBAGLBSA-N	1	1	316.379	1.516	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452064486	533671331	/nfs/dbraw/zinc/67/13/31/533671331.db2.gz	FLPOSEODXIRBNI-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452064486	533671338	/nfs/dbraw/zinc/67/13/38/533671338.db2.gz	FLPOSEODXIRBNI-BXUZGUMPSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000020479092	406887304	/nfs/dbraw/zinc/88/73/04/406887304.db2.gz	GOBUGROEFZSCME-UHFFFAOYSA-N	1	1	308.294	1.281	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000112309932	407426031	/nfs/dbraw/zinc/42/60/31/407426031.db2.gz	IYGVMCRIMLENGM-UHFFFAOYSA-N	1	1	312.345	1.778	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000185725684	407487443	/nfs/dbraw/zinc/48/74/43/407487443.db2.gz	AZZNSTXUYBMNIT-PWSUYJOCSA-N	1	1	322.365	1.498	20	5		DDBDMO
C[NH+](C)C[C@@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000114199430	407551072	/nfs/dbraw/zinc/55/10/72/407551072.db2.gz	ZAYUULVCSNUWAN-ZDUSSCGKSA-N	1	1	320.393	1.807	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000178627223	407517889	/nfs/dbraw/zinc/51/78/89/407517889.db2.gz	KBGUGJKJJZPNRT-IUODEOHRSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@H](CCN1CCN(C)CC1)[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC000185863107	407522314	/nfs/dbraw/zinc/52/23/14/407522314.db2.gz	QIKNQBFEYKAGSD-CQSZACIVSA-N	1	1	306.410	1.710	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@](C)(C[NH3+])C1	ZINC000261724691	407592757	/nfs/dbraw/zinc/59/27/57/407592757.db2.gz	JMNDAIHRUPSUIH-INIZCTEOSA-N	1	1	320.393	1.903	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000178954166	407670551	/nfs/dbraw/zinc/67/05/51/407670551.db2.gz	LNYSVLJPBBTDGC-PHIMTYICSA-N	1	1	313.379	1.274	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000180854406	407923722	/nfs/dbraw/zinc/92/37/22/407923722.db2.gz	XSNCBTBHPRGMNV-NXEZZACHSA-N	1	1	304.350	1.532	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000174330749	407934627	/nfs/dbraw/zinc/93/46/27/407934627.db2.gz	SWXZEWPEEFRXMD-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000174330749	407934632	/nfs/dbraw/zinc/93/46/32/407934632.db2.gz	SWXZEWPEEFRXMD-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[NH+]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000268185041	407937213	/nfs/dbraw/zinc/93/72/13/407937213.db2.gz	VTQIPJRFLNJCCZ-UHFFFAOYSA-N	1	1	312.757	1.705	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1CC[NH+](CCOC)CC1	ZINC000175075588	408045338	/nfs/dbraw/zinc/04/53/38/408045338.db2.gz	PCCTWGZHRBUTBV-UHFFFAOYSA-N	1	1	323.393	1.758	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC1	ZINC000272576616	407991970	/nfs/dbraw/zinc/99/19/70/407991970.db2.gz	VVFSFCBSISUOKZ-UHFFFAOYSA-N	1	1	319.317	1.315	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1[N+](=O)[O-]	ZINC000119451642	408073198	/nfs/dbraw/zinc/07/31/98/408073198.db2.gz	TWBXPUUECQKETM-GFCCVEGCSA-N	1	1	323.397	1.487	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000190201367	408187059	/nfs/dbraw/zinc/18/70/59/408187059.db2.gz	GKUMNAZMSCZYPM-SNVBAGLBSA-N	1	1	304.350	1.391	20	5		DDBDMO
CCOCCC[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000273572939	408251702	/nfs/dbraw/zinc/25/17/02/408251702.db2.gz	DMZVKHCBNHDWEH-TZMCWYRMSA-N	1	1	323.397	1.934	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000156444397	408253988	/nfs/dbraw/zinc/25/39/88/408253988.db2.gz	TXDRQJJIRSCENJ-AWEZNQCLSA-N	1	1	321.377	1.774	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000175994814	408258636	/nfs/dbraw/zinc/25/86/36/408258636.db2.gz	MDXVWLHZKUAQGE-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
Cc1c(C(=O)NCC(F)(F)C[NH3+])cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000190284371	408210431	/nfs/dbraw/zinc/21/04/31/408210431.db2.gz	TYNVLVAKVMHIRN-UHFFFAOYSA-N	1	1	318.236	1.135	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3C(N)=O)CC[C@H]21	ZINC000268841227	408214998	/nfs/dbraw/zinc/21/49/98/408214998.db2.gz	ORDNHJNRPJQWCJ-ZWNOBZJWSA-N	1	1	319.365	1.009	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]1CO	ZINC000190345675	408226829	/nfs/dbraw/zinc/22/68/29/408226829.db2.gz	QPTVSRPXTLNHJM-HZMBPMFUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]1CO	ZINC000190345675	408226836	/nfs/dbraw/zinc/22/68/36/408226836.db2.gz	QPTVSRPXTLNHJM-HZMBPMFUSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)C(=O)NC[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176225452	408314649	/nfs/dbraw/zinc/31/46/49/408314649.db2.gz	XWQBMPHZOWHVEN-CYBMUJFWSA-N	1	1	323.397	1.276	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000246721838	408324340	/nfs/dbraw/zinc/32/43/40/408324340.db2.gz	LLXHPKQFPPDTPU-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000246721838	408324344	/nfs/dbraw/zinc/32/43/44/408324344.db2.gz	LLXHPKQFPPDTPU-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@H]1C[N@@H+](C)CCN1C	ZINC000269547741	408350280	/nfs/dbraw/zinc/35/02/80/408350280.db2.gz	CWUYKHNKAMTHCB-AWEZNQCLSA-N	1	1	308.382	1.399	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CN(C)CCN1C	ZINC000269547741	408350285	/nfs/dbraw/zinc/35/02/85/408350285.db2.gz	CWUYKHNKAMTHCB-AWEZNQCLSA-N	1	1	308.382	1.399	20	5		DDBDMO
C[N@H+]1CC[C@H](CNc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1	ZINC000137964210	162129466	/nfs/dbraw/zinc/12/94/66/162129466.db2.gz	LAZAYMYRCBHKNE-SNVBAGLBSA-N	1	1	313.379	1.362	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]2C[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000264194755	408396245	/nfs/dbraw/zinc/39/62/45/408396245.db2.gz	OIXDPCHYZZQBJT-NSHDSACASA-N	1	1	307.354	1.327	20	5		DDBDMO
C[C@@H]1CC(O)C[C@H](C)[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000191282773	408399219	/nfs/dbraw/zinc/39/92/19/408399219.db2.gz	AIDGIAZWFVAULW-HWYHXSKPSA-N	1	1	307.350	1.427	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000247161614	408418980	/nfs/dbraw/zinc/41/89/80/408418980.db2.gz	MIWSTJFFHIUTGG-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000247523659	408487759	/nfs/dbraw/zinc/48/77/59/408487759.db2.gz	WPZVXRQXTAEJLT-SWLSCSKDSA-N	1	1	321.377	1.772	20	5		DDBDMO
CCOc1cc(N2CC[NH+]([C@@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000269927946	408473641	/nfs/dbraw/zinc/47/36/41/408473641.db2.gz	CCUNQGALRVCQPZ-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCOC1	ZINC000248470924	408576594	/nfs/dbraw/zinc/57/65/94/408576594.db2.gz	VLNAJDIMKOYKAO-QWHCGFSZSA-N	1	1	310.350	1.303	20	5		DDBDMO
CN(CC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccccc1[N+](=O)[O-]	ZINC000192484675	408596849	/nfs/dbraw/zinc/59/68/49/408596849.db2.gz	JPPZJMODSGTSAL-BETUJISGSA-N	1	1	318.377	1.051	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCC([C@H](O)C(F)(F)F)CC2)c1	ZINC000161386230	408597843	/nfs/dbraw/zinc/59/78/43/408597843.db2.gz	ZWUPXOAPACAQTL-NSHDSACASA-N	1	1	322.287	1.427	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C[N@H+]1C1CC1	ZINC000184486896	408627910	/nfs/dbraw/zinc/62/79/10/408627910.db2.gz	NHFFPKODVWPKTA-NXEZZACHSA-N	1	1	304.350	1.532	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000265628051	408719931	/nfs/dbraw/zinc/71/99/31/408719931.db2.gz	RGJQUCLTACMPLL-ZDUSSCGKSA-N	1	1	322.365	1.115	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCC(F)(F)C[NH3+])c1C	ZINC000162652136	408724160	/nfs/dbraw/zinc/72/41/60/408724160.db2.gz	RHAVTVWCIWAYJP-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000164177946	408795694	/nfs/dbraw/zinc/79/56/94/408795694.db2.gz	GDDDNOYPMJEKNM-LLVKDONJSA-N	1	1	309.370	1.558	20	5		DDBDMO
CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000164177946	408795698	/nfs/dbraw/zinc/79/56/98/408795698.db2.gz	GDDDNOYPMJEKNM-LLVKDONJSA-N	1	1	309.370	1.558	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000164177946	408795701	/nfs/dbraw/zinc/79/57/01/408795701.db2.gz	GDDDNOYPMJEKNM-LLVKDONJSA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@@H](C(=O)NC[C@@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000185183449	408775618	/nfs/dbraw/zinc/77/56/18/408775618.db2.gz	NWUZMFDDRQWAGM-MNOVXSKESA-N	1	1	309.341	1.905	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000250817944	408779783	/nfs/dbraw/zinc/77/97/83/408779783.db2.gz	WIODLFDGQKXGAM-WDEREUQCSA-N	1	1	312.757	1.918	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)cc([N+](=O)[O-])c1	ZINC000285872566	408880854	/nfs/dbraw/zinc/88/08/54/408880854.db2.gz	RLCNJFFXPORUHD-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[N@H+](CCCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000276219701	408826035	/nfs/dbraw/zinc/82/60/35/408826035.db2.gz	BATGBRIPNNPOKY-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[N@@H+](CCCCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000276219701	408826036	/nfs/dbraw/zinc/82/60/36/408826036.db2.gz	BATGBRIPNNPOKY-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000290863220	408846430	/nfs/dbraw/zinc/84/64/30/408846430.db2.gz	YVJJQCLEYDRNKA-ZJUUUORDSA-N	1	1	307.354	1.008	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000188746257	163066027	/nfs/dbraw/zinc/06/60/27/163066027.db2.gz	AWPFKBIOLMVUJH-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000188746257	163066029	/nfs/dbraw/zinc/06/60/29/163066029.db2.gz	AWPFKBIOLMVUJH-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000286253774	408949816	/nfs/dbraw/zinc/94/98/16/408949816.db2.gz	VKCPGJRDUIEVIT-UHFFFAOYSA-N	1	1	310.329	1.356	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000277609199	408976713	/nfs/dbraw/zinc/97/67/13/408976713.db2.gz	PNOPMVSYYFROCT-KBPBESRZSA-N	1	1	319.361	1.960	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C	ZINC000277638646	408982801	/nfs/dbraw/zinc/98/28/01/408982801.db2.gz	TUHZCGDKHVQUOJ-IINYFYTJSA-N	1	1	319.361	1.816	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H](C)CO	ZINC000292302916	409020861	/nfs/dbraw/zinc/02/08/61/409020861.db2.gz	UXNWLWCJTLNPDS-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCCO1	ZINC000293237219	409074282	/nfs/dbraw/zinc/07/42/82/409074282.db2.gz	SOXGYDWWQSZGNJ-CQSZACIVSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000283166136	409102897	/nfs/dbraw/zinc/10/28/97/409102897.db2.gz	PEGKEUIDFWGQTA-SNVBAGLBSA-N	1	1	324.356	1.919	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCOCCO)C(C)C	ZINC000283628253	409187495	/nfs/dbraw/zinc/18/74/95/409187495.db2.gz	BFPLURKNFYBOBD-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C2)C1	ZINC000293658817	409156034	/nfs/dbraw/zinc/15/60/34/409156034.db2.gz	HQKKBJHMAXEYDE-HNNXBMFYSA-N	1	1	304.350	1.345	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]([N@@H+](C)CCO)[C@H]1C	ZINC000293697263	409162619	/nfs/dbraw/zinc/16/26/19/409162619.db2.gz	OSMHQSVCZCLAHW-IUODEOHRSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000284012544	409257822	/nfs/dbraw/zinc/25/78/22/409257822.db2.gz	OEMLNHWEDWJTPU-JTQLQIEISA-N	1	1	324.356	1.920	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CCC[N@@H+](CCCO)C2)cc([N+](=O)[O-])c1	ZINC000295513624	409325938	/nfs/dbraw/zinc/32/59/38/409325938.db2.gz	QBCJWILVTCOWCH-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285377178	409416337	/nfs/dbraw/zinc/41/63/37/409416337.db2.gz	MWOBPQRVCHTYBD-SNVBAGLBSA-N	1	1	318.337	1.554	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1	ZINC000285390761	409422795	/nfs/dbraw/zinc/42/27/95/409422795.db2.gz	NXXJLDZYXQMSML-OCCSQVGLSA-N	1	1	320.353	1.103	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@H]2c2cc[nH]n2)c1	ZINC000285390761	409422800	/nfs/dbraw/zinc/42/28/00/409422800.db2.gz	NXXJLDZYXQMSML-OCCSQVGLSA-N	1	1	320.353	1.103	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CC[N@@H+](C)C1	ZINC000296105836	409431508	/nfs/dbraw/zinc/43/15/08/409431508.db2.gz	GYIPOHRGZYPOGJ-SNVBAGLBSA-N	1	1	308.338	1.677	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198837	164026537	/nfs/dbraw/zinc/02/65/37/164026537.db2.gz	NMIWHHPMHQMUFW-MISXGVKJSA-N	1	1	305.334	1.236	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198837	164026538	/nfs/dbraw/zinc/02/65/38/164026538.db2.gz	NMIWHHPMHQMUFW-MISXGVKJSA-N	1	1	305.334	1.236	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3csc([N+](=O)[O-])c3)[C@H]2C1	ZINC000285592927	409501130	/nfs/dbraw/zinc/50/11/30/409501130.db2.gz	CALDFNMWFSPXNF-QWRGUYRKSA-N	1	1	311.363	1.201	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H](CO)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000303040565	409525717	/nfs/dbraw/zinc/52/57/17/409525717.db2.gz	NLZMPNDHFPSUKG-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2C2CCCC2)c1	ZINC000304380552	409616049	/nfs/dbraw/zinc/61/60/49/409616049.db2.gz	YGJBCMSHOCRDPS-CABCVRRESA-N	1	1	308.382	1.807	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)N(C)c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000296869522	409679763	/nfs/dbraw/zinc/67/97/63/409679763.db2.gz	VZEFLIVYGVZKDG-LLVKDONJSA-N	1	1	319.365	1.628	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000356883929	409687864	/nfs/dbraw/zinc/68/78/64/409687864.db2.gz	QOZPOKXFFUTXNZ-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000356883929	409687872	/nfs/dbraw/zinc/68/78/72/409687872.db2.gz	QOZPOKXFFUTXNZ-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000354139155	409690010	/nfs/dbraw/zinc/69/00/10/409690010.db2.gz	PKAFJUXRTVJWJH-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1	ZINC000357050517	409820948	/nfs/dbraw/zinc/82/09/48/409820948.db2.gz	IEFWAQRTZYFGEO-GFCCVEGCSA-N	1	1	321.381	1.132	20	5		DDBDMO
C[C@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1	ZINC000357308536	409967630	/nfs/dbraw/zinc/96/76/30/409967630.db2.gz	WNYSRUZWRVXNEZ-GHMZBOCLSA-N	1	1	321.381	1.621	20	5		DDBDMO
Cn1cncc1CC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298044014	410087794	/nfs/dbraw/zinc/08/77/94/410087794.db2.gz	HRUMGXJZQLFYRJ-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
Cn1c[nH+]cc1CCN1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298044014	410087800	/nfs/dbraw/zinc/08/78/00/410087800.db2.gz	HRUMGXJZQLFYRJ-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670375	410067021	/nfs/dbraw/zinc/06/70/21/410067021.db2.gz	UOUSVWTYWOMCSV-ZOWXZIJZSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670375	410067028	/nfs/dbraw/zinc/06/70/28/410067028.db2.gz	UOUSVWTYWOMCSV-ZOWXZIJZSA-N	1	1	319.361	1.689	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@H]1C	ZINC000346695004	410091211	/nfs/dbraw/zinc/09/12/11/410091211.db2.gz	XRTIGVQTGIDDNE-GWCFXTLKSA-N	1	1	308.334	1.987	20	5		DDBDMO
CCNC(=O)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C	ZINC000339321225	410092046	/nfs/dbraw/zinc/09/20/46/410092046.db2.gz	QBOPUTONQMHXEX-AWEZNQCLSA-N	1	1	319.365	1.721	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](C)O)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343511141	410499895	/nfs/dbraw/zinc/49/98/95/410499895.db2.gz	NCZAJAZJKPNJRE-OLZOCXBDSA-N	1	1	312.366	1.426	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000343620176	410572896	/nfs/dbraw/zinc/57/28/96/410572896.db2.gz	GGXGOGBGTXFAGK-CYBMUJFWSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCNC1=O	ZINC000340222398	410769900	/nfs/dbraw/zinc/76/99/00/410769900.db2.gz	MHFIGONZHKTCSP-ZDUSSCGKSA-N	1	1	320.349	1.052	20	5		DDBDMO
CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347900115	410781110	/nfs/dbraw/zinc/78/11/10/410781110.db2.gz	SQKHEAKVRGXFHN-CYBMUJFWSA-N	1	1	318.377	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c1	ZINC000343995410	410876240	/nfs/dbraw/zinc/87/62/40/410876240.db2.gz	QISFDSGASFYJDQ-ZCDTZLGTSA-N	1	1	322.361	1.037	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000337810197	411013241	/nfs/dbraw/zinc/01/32/41/411013241.db2.gz	MAXMOMAMKZSWIE-UHFFFAOYSA-N	1	1	301.310	1.645	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]1CO	ZINC000331294348	411061944	/nfs/dbraw/zinc/06/19/44/411061944.db2.gz	XZKWBZGIPPBQTD-GWCFXTLKSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]1CO	ZINC000331294348	411061947	/nfs/dbraw/zinc/06/19/47/411061947.db2.gz	XZKWBZGIPPBQTD-GWCFXTLKSA-N	1	1	307.350	1.544	20	5		DDBDMO
COc1c(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356544307	411082191	/nfs/dbraw/zinc/08/21/91/411082191.db2.gz	QTUVKWIBOCUSFL-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356544307	411082195	/nfs/dbraw/zinc/08/21/95/411082195.db2.gz	QTUVKWIBOCUSFL-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[N@@H+](CC1(O)CCC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000353487222	411023638	/nfs/dbraw/zinc/02/36/38/411023638.db2.gz	DERCZLFKKIWACE-CQSZACIVSA-N	1	1	319.361	1.547	20	5		DDBDMO
Cc1ccc(C[N@H+](C)C[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	ZINC000353766008	411126273	/nfs/dbraw/zinc/12/62/73/411126273.db2.gz	FXHQZEUANCKDFC-CYBMUJFWSA-N	1	1	312.391	1.770	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	ZINC000353766008	411126275	/nfs/dbraw/zinc/12/62/75/411126275.db2.gz	FXHQZEUANCKDFC-CYBMUJFWSA-N	1	1	312.391	1.770	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000305452872	533680562	/nfs/dbraw/zinc/68/05/62/533680562.db2.gz	RZSRBBZBFMRICC-IUODEOHRSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000305452872	533680565	/nfs/dbraw/zinc/68/05/65/533680565.db2.gz	RZSRBBZBFMRICC-IUODEOHRSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000366177688	418437973	/nfs/dbraw/zinc/43/79/73/418437973.db2.gz	DWVDFYONYSEMGK-HNNXBMFYSA-N	1	1	319.361	1.593	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000366177688	418437974	/nfs/dbraw/zinc/43/79/74/418437974.db2.gz	DWVDFYONYSEMGK-HNNXBMFYSA-N	1	1	319.361	1.593	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]12	ZINC000366333441	418459075	/nfs/dbraw/zinc/45/90/75/418459075.db2.gz	QLABRMUEZBXUPI-UWVGGRQHSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@H]12	ZINC000366333441	418459079	/nfs/dbraw/zinc/45/90/79/418459079.db2.gz	QLABRMUEZBXUPI-UWVGGRQHSA-N	1	1	323.736	1.343	20	5		DDBDMO
COc1cc(OCC(=O)NC[C@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000195186999	418554792	/nfs/dbraw/zinc/55/47/92/418554792.db2.gz	VEQLIKBXTPNMSS-LLVKDONJSA-N	1	1	323.349	1.193	20	5		DDBDMO
O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[N@H+]2CCC[C@H]2C1	ZINC000195190714	222193672	/nfs/dbraw/zinc/19/36/72/222193672.db2.gz	XAOYPCVFGWFEDS-LBPRGKRZSA-N	1	1	314.345	1.996	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361267858	418615228	/nfs/dbraw/zinc/61/52/28/418615228.db2.gz	SKIXRKJMERQGHW-VIFPVBQESA-N	1	1	306.322	1.712	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361267858	418615231	/nfs/dbraw/zinc/61/52/31/418615231.db2.gz	SKIXRKJMERQGHW-VIFPVBQESA-N	1	1	306.322	1.712	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)CN(CC[N@H+]1CCCOCC1)CC2	ZINC000361349330	418631804	/nfs/dbraw/zinc/63/18/04/418631804.db2.gz	UGVZCAOYWMKTIB-UHFFFAOYSA-N	1	1	306.366	1.070	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367779268	418633191	/nfs/dbraw/zinc/63/31/91/418633191.db2.gz	NCMCXOAJNQJUAV-ITGUQSILSA-N	1	1	305.334	1.012	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367779268	418633192	/nfs/dbraw/zinc/63/31/92/418633192.db2.gz	NCMCXOAJNQJUAV-ITGUQSILSA-N	1	1	305.334	1.012	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]12	ZINC000368238173	418708460	/nfs/dbraw/zinc/70/84/60/418708460.db2.gz	BLLGAWVFIYEJSD-JQWIXIFHSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]12	ZINC000368238173	418708462	/nfs/dbraw/zinc/70/84/62/418708462.db2.gz	BLLGAWVFIYEJSD-JQWIXIFHSA-N	1	1	309.753	1.816	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CCC[C@@](O)(C(N)=O)C2)cc1[N+](=O)[O-]	ZINC000375532145	418655484	/nfs/dbraw/zinc/65/54/84/418655484.db2.gz	IKKVKCXOSSGCDU-INIZCTEOSA-N	1	1	321.377	1.530	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000368063939	418682815	/nfs/dbraw/zinc/68/28/15/418682815.db2.gz	OSKDVYXRDQEYCF-ZYHUDNBSSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000368063939	418682818	/nfs/dbraw/zinc/68/28/18/418682818.db2.gz	OSKDVYXRDQEYCF-ZYHUDNBSSA-N	1	1	309.753	1.816	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1	ZINC000389251103	418749009	/nfs/dbraw/zinc/74/90/09/418749009.db2.gz	BMWJIOODOBVWJS-SNVBAGLBSA-N	1	1	313.379	1.504	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])C1	ZINC000389251103	418749011	/nfs/dbraw/zinc/74/90/11/418749011.db2.gz	BMWJIOODOBVWJS-SNVBAGLBSA-N	1	1	313.379	1.504	20	5		DDBDMO
CNC(=O)C[N@@H+]1CCCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000370988439	418755089	/nfs/dbraw/zinc/75/50/89/418755089.db2.gz	PLIZAOWZVPRGMV-UHFFFAOYSA-N	1	1	306.366	1.161	20	5		DDBDMO
CNC(=O)C[N@H+]1CCCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000370988439	418755090	/nfs/dbraw/zinc/75/50/90/418755090.db2.gz	PLIZAOWZVPRGMV-UHFFFAOYSA-N	1	1	306.366	1.161	20	5		DDBDMO
Cn1ccnc1[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000365651417	418888653	/nfs/dbraw/zinc/88/86/53/418888653.db2.gz	VYDNMSQSNIDZPW-LBPRGKRZSA-N	1	1	304.354	1.404	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H]1CCO)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000426241817	419417791	/nfs/dbraw/zinc/41/77/91/419417791.db2.gz	XEKWEDDOLCNWAV-ZDUSSCGKSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420936456	419371195	/nfs/dbraw/zinc/37/11/95/419371195.db2.gz	INMBHEOIVQFOFP-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420936456	419371200	/nfs/dbraw/zinc/37/12/00/419371200.db2.gz	INMBHEOIVQFOFP-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954656	419382875	/nfs/dbraw/zinc/38/28/75/419382875.db2.gz	ZPLPEHVUYXORML-WDEREUQCSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420954656	419382881	/nfs/dbraw/zinc/38/28/81/419382881.db2.gz	ZPLPEHVUYXORML-WDEREUQCSA-N	1	1	304.350	1.921	20	5		DDBDMO
CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[N@H+]1C	ZINC000420993826	419427368	/nfs/dbraw/zinc/42/73/68/419427368.db2.gz	BIGIXAQKSWVWIJ-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@H]1C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420993826	419427372	/nfs/dbraw/zinc/42/73/72/419427372.db2.gz	BIGIXAQKSWVWIJ-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CCC[C@H]1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000420993826	419427376	/nfs/dbraw/zinc/42/73/76/419427376.db2.gz	BIGIXAQKSWVWIJ-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000418109211	419537458	/nfs/dbraw/zinc/53/74/58/419537458.db2.gz	HXOVKGSHVRNCKP-ZWXLGZMVSA-N	1	1	319.405	1.995	20	5		DDBDMO
CNC(=O)NC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000412056380	419598430	/nfs/dbraw/zinc/59/84/30/419598430.db2.gz	OGJXQJGGZWGUNK-UHFFFAOYSA-N	1	1	322.365	1.497	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000421710517	419699024	/nfs/dbraw/zinc/69/90/24/419699024.db2.gz	KZMHHZAJUCLMOH-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+]1C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000421710517	419699033	/nfs/dbraw/zinc/69/90/33/419699033.db2.gz	KZMHHZAJUCLMOH-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000421710517	419699042	/nfs/dbraw/zinc/69/90/42/419699042.db2.gz	KZMHHZAJUCLMOH-LLVKDONJSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])c2ncccc12	ZINC000413312700	419778367	/nfs/dbraw/zinc/77/83/67/419778367.db2.gz	GHUZBLBILRPHMV-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)n1	ZINC000434443312	229296751	/nfs/dbraw/zinc/29/67/51/229296751.db2.gz	XGGZHUUAPBJYJS-GFCCVEGCSA-N	1	1	321.381	1.558	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000429115373	419970582	/nfs/dbraw/zinc/97/05/82/419970582.db2.gz	ODOFYSSOUUSZLX-AVGNSLFASA-N	1	1	310.350	1.180	20	5		DDBDMO
CSC[C@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000429295842	419999168	/nfs/dbraw/zinc/99/91/68/419999168.db2.gz	BGXDXQPPLUGMSP-WCQYABFASA-N	1	1	314.411	1.227	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000416494277	420393430	/nfs/dbraw/zinc/39/34/30/420393430.db2.gz	IFBPDHFAUPNDBA-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCO)CC2)c(OC(F)F)c1	ZINC000302033957	230052472	/nfs/dbraw/zinc/05/24/72/230052472.db2.gz	DMJFENBLLIPFRL-UHFFFAOYSA-N	1	1	317.292	1.311	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H](c3nnc[nH]3)C2)cc1	ZINC000425549783	420415418	/nfs/dbraw/zinc/41/54/18/420415418.db2.gz	ODALTHWXPCWRDP-NSHDSACASA-N	1	1	303.322	1.581	20	5		DDBDMO
CC(C)c1ncc(C[N@H+](C)CCn2ccc([N+](=O)[O-])n2)cn1	ZINC000440480163	420578649	/nfs/dbraw/zinc/57/86/49/420578649.db2.gz	UWTHFMMUJAXVLU-UHFFFAOYSA-N	1	1	304.354	1.837	20	5		DDBDMO
CC(C)c1ncc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cn1	ZINC000440480163	420578652	/nfs/dbraw/zinc/57/86/52/420578652.db2.gz	UWTHFMMUJAXVLU-UHFFFAOYSA-N	1	1	304.354	1.837	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000457024169	420589576	/nfs/dbraw/zinc/58/95/76/420589576.db2.gz	OEMUMFXBRNVOFY-GFCCVEGCSA-N	1	1	301.306	1.105	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000442132924	420671440	/nfs/dbraw/zinc/67/14/40/420671440.db2.gz	QKSDANHFBDIYED-ZYHUDNBSSA-N	1	1	320.349	1.132	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@@H+](C)[C@@H](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000487136442	421006113	/nfs/dbraw/zinc/00/61/13/421006113.db2.gz	KKKYPRGMXKMULN-CYBMUJFWSA-N	1	1	322.365	1.553	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H](C)C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC000456048701	421093952	/nfs/dbraw/zinc/09/39/52/421093952.db2.gz	NAOZFZGZIOOYMD-JTQLQIEISA-N	1	1	309.370	1.490	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)ncc1[N+](=O)[O-]	ZINC000450264341	421173792	/nfs/dbraw/zinc/17/37/92/421173792.db2.gz	ZIUDDAKWGQZTIQ-NSHDSACASA-N	1	1	321.381	1.383	20	5		DDBDMO
COCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCOC1	ZINC000490069519	421188437	/nfs/dbraw/zinc/18/84/37/421188437.db2.gz	VBXFTKZJVPIDLB-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000524776429	421271616	/nfs/dbraw/zinc/27/16/16/421271616.db2.gz	DZSBPPOVUJPDPN-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000548435785	421438039	/nfs/dbraw/zinc/43/80/39/421438039.db2.gz	WMBZDAVBBJJTBK-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000531482991	421635442	/nfs/dbraw/zinc/63/54/42/421635442.db2.gz	JXPUARZCZCYKNO-ZYHUDNBSSA-N	1	1	318.377	1.992	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000540932518	421777352	/nfs/dbraw/zinc/77/73/52/421777352.db2.gz	CPYOISRWWXLIBB-LLVKDONJSA-N	1	1	307.350	1.761	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC[C@H](C)C1	ZINC000572425040	421787257	/nfs/dbraw/zinc/78/72/57/421787257.db2.gz	GLWAAVQQFGRMAY-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
O=C1C[C@@H]([N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960199	421874975	/nfs/dbraw/zinc/87/49/75/421874975.db2.gz	HCNHCLOGAZDERY-DGCLKSJQSA-N	1	1	303.318	1.189	20	5		DDBDMO
O=C1C[C@@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000580960199	421874980	/nfs/dbraw/zinc/87/49/80/421874980.db2.gz	HCNHCLOGAZDERY-DGCLKSJQSA-N	1	1	303.318	1.189	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000582218201	422130289	/nfs/dbraw/zinc/13/02/89/422130289.db2.gz	HRTDYUAZAPNKJI-CYBMUJFWSA-N	1	1	321.377	1.740	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccnc(NC)c2[N+](=O)[O-])C[C@H]1C	ZINC000584788290	422301462	/nfs/dbraw/zinc/30/14/62/422301462.db2.gz	KNBGKSYFTYFFLN-GHMZBOCLSA-N	1	1	321.381	1.586	20	5		DDBDMO
O=c1[nH]c(N[C@H]2CC[N@H+](C3CC3)C2)nc2ccc([N+](=O)[O-])cc21	ZINC000596092997	422364911	/nfs/dbraw/zinc/36/49/11/422364911.db2.gz	YXRZSGMNQMAJQN-VIFPVBQESA-N	1	1	315.333	1.892	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000578204241	422522063	/nfs/dbraw/zinc/52/20/63/422522063.db2.gz	LZHGUAFGCBSJOE-UHFFFAOYSA-N	1	1	318.377	1.606	20	5		DDBDMO
CNC(=O)[C@H](CCSC)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000342320394	271375369	/nfs/dbraw/zinc/37/53/69/271375369.db2.gz	VJIGHCJYKHIXEW-VIFPVBQESA-N	1	1	303.409	1.614	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1[N@@H+](C)CCCC1(C)C	ZINC000344645715	272079101	/nfs/dbraw/zinc/07/91/01/272079101.db2.gz	PUIDMORIXLKRFZ-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1	ZINC000302857884	274004633	/nfs/dbraw/zinc/00/46/33/274004633.db2.gz	MVGUDDQEOAMMLN-TXEJJXNPSA-N	1	1	305.334	1.379	20	5		DDBDMO
COCC[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000302697173	274030131	/nfs/dbraw/zinc/03/01/31/274030131.db2.gz	TUHUIIXPMLZGAK-UHFFFAOYSA-N	1	1	306.366	1.331	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000275860419	274271345	/nfs/dbraw/zinc/27/13/45/274271345.db2.gz	TXXBRCWWMXWDHW-SNVBAGLBSA-N	1	1	310.310	1.006	20	5		DDBDMO
C[C@@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H](C[NH3+])C1	ZINC000261729548	274299957	/nfs/dbraw/zinc/29/99/57/274299957.db2.gz	HOENHBNUUQHUBQ-MWLCHTKSSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[C@H](CNc1ccc2ncc([N+](=O)[O-])n2n1)C[NH+]1CCOCC1	ZINC000301952532	274492457	/nfs/dbraw/zinc/49/24/57/274492457.db2.gz	CFOVRBJUMAQSNZ-LLVKDONJSA-N	1	1	320.353	1.018	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3nccc(C(N)=O)c3[N+](=O)[O-])C2)C1	ZINC000292707584	277087618	/nfs/dbraw/zinc/08/76/18/277087618.db2.gz	GNGHZQNMWICZQI-HNNXBMFYSA-N	1	1	319.365	1.011	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[NH2+]1	ZINC000187155693	288238820	/nfs/dbraw/zinc/23/88/20/288238820.db2.gz	KBKFIZPHEUMGRY-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[C@@H](c1cccs1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246705819	282008159	/nfs/dbraw/zinc/00/81/59/282008159.db2.gz	JXKPKNZWVOZHHW-CMPLNLGQSA-N	1	1	310.379	1.907	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@H]21	ZINC000408026839	290114729	/nfs/dbraw/zinc/11/47/29/290114729.db2.gz	JJAOSVJPLOKGTO-CABCVRRESA-N	1	1	318.377	1.472	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1C[N@@H+](C(C)C)C[C@H]1C	ZINC000246850784	293395695	/nfs/dbraw/zinc/39/56/95/293395695.db2.gz	FHQKHSPZYMQJET-YPMHNXCESA-N	1	1	323.397	1.335	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1cc(N)ccc1[N+](=O)[O-]	ZINC000286328479	297266662	/nfs/dbraw/zinc/26/66/62/297266662.db2.gz	LHOVSEPJMQOGTQ-DGCLKSJQSA-N	1	1	306.366	1.476	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1	ZINC000354241687	298379066	/nfs/dbraw/zinc/37/90/66/298379066.db2.gz	XQQNJUGCVINPGO-LBPRGKRZSA-N	1	1	316.361	1.617	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCCN2CC[NH+]([C@@H]3CCOC3)CC2)c1	ZINC000362222652	300031462	/nfs/dbraw/zinc/03/14/62/300031462.db2.gz	ZWISPTSJRFWBMY-OAHLLOKOSA-N	1	1	321.377	1.380	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)C[C@H]21	ZINC000362290458	300045093	/nfs/dbraw/zinc/04/50/93/300045093.db2.gz	RVCCBSIBDURWLK-GXFFZTMASA-N	1	1	304.350	1.343	20	5		DDBDMO
CN(C)c1nc(N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc[nH+]1	ZINC000362682581	300115191	/nfs/dbraw/zinc/11/51/91/300115191.db2.gz	DULAPHLOUJICCW-UHFFFAOYSA-N	1	1	317.353	1.489	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000363265559	300242022	/nfs/dbraw/zinc/24/20/22/300242022.db2.gz	FYFAKBOAEKPFSW-HUUCEWRRSA-N	1	1	319.361	1.117	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)c1	ZINC000368590608	301060120	/nfs/dbraw/zinc/06/01/20/301060120.db2.gz	KZNRBRWFFIZYPJ-NHYWBVRUSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000370215044	301295829	/nfs/dbraw/zinc/29/58/29/301295829.db2.gz	JIUGHIHINDJBTI-DMRZNYOFSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000370215044	301295832	/nfs/dbraw/zinc/29/58/32/301295832.db2.gz	JIUGHIHINDJBTI-DMRZNYOFSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000370215044	301295835	/nfs/dbraw/zinc/29/58/35/301295835.db2.gz	JIUGHIHINDJBTI-DMRZNYOFSA-N	1	1	317.389	1.821	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000377481813	302183951	/nfs/dbraw/zinc/18/39/51/302183951.db2.gz	OPIPQXOXQITNGV-GJZGRUSLSA-N	1	1	319.361	1.117	20	5		DDBDMO
Cn1ccnc1[C@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000261764049	303008974	/nfs/dbraw/zinc/00/89/74/303008974.db2.gz	QRBCCZMLRRMYND-CYBMUJFWSA-N	1	1	315.333	1.115	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000366655087	307078722	/nfs/dbraw/zinc/07/87/22/307078722.db2.gz	PPHGCWNJCJYTCS-UONOGXRCSA-N	1	1	322.361	1.759	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[NH+]([C@@H]3CCOC3)CC2)nc2sccn21	ZINC000372932188	307177091	/nfs/dbraw/zinc/17/70/91/307177091.db2.gz	WLVBIMJZOOGMDV-SNVBAGLBSA-N	1	1	323.378	1.215	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000373813343	307195793	/nfs/dbraw/zinc/19/57/93/307195793.db2.gz	SXVINOZPVPJYNI-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000373813343	307195794	/nfs/dbraw/zinc/19/57/94/307195794.db2.gz	SXVINOZPVPJYNI-OCCSQVGLSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279335	307204947	/nfs/dbraw/zinc/20/49/47/307204947.db2.gz	VGJHKYJTWGZXBS-BFYDXBDKSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000374279335	307204948	/nfs/dbraw/zinc/20/49/48/307204948.db2.gz	VGJHKYJTWGZXBS-BFYDXBDKSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279335	307204949	/nfs/dbraw/zinc/20/49/49/307204949.db2.gz	VGJHKYJTWGZXBS-BFYDXBDKSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000535958038	307662301	/nfs/dbraw/zinc/66/23/01/307662301.db2.gz	ASLFZNNVNBLOEY-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
Cc1c(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)cccc1[N+](=O)[O-]	ZINC000548718309	307789105	/nfs/dbraw/zinc/78/91/05/307789105.db2.gz	RKVZQZFTZVOGMZ-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2nc3c(cc2[N+](=O)[O-])CCCC3)C1	ZINC000567607891	308086771	/nfs/dbraw/zinc/08/67/71/308086771.db2.gz	IHXIBKHIUSHURJ-HNNXBMFYSA-N	1	1	306.366	1.347	20	5		DDBDMO
O=C1NCC[C@@H]1CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000575192655	308273349	/nfs/dbraw/zinc/27/33/49/308273349.db2.gz	JMIKJCRHCFVURF-VXGBXAGGSA-N	1	1	319.365	1.002	20	5		DDBDMO
C[C@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000443349073	534107276	/nfs/dbraw/zinc/10/72/76/534107276.db2.gz	SYPVCIUBNNRCJE-DYEKYZERSA-N	1	1	309.366	1.238	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)c1	ZINC000332336397	534316656	/nfs/dbraw/zinc/31/66/56/534316656.db2.gz	VYAMZIJWPVXMIO-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](CCCCCO)CC1	ZINC000293312456	534751583	/nfs/dbraw/zinc/75/15/83/534751583.db2.gz	XDFMKNJOXNKOSC-UHFFFAOYSA-N	1	1	321.377	1.515	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456073876	527988896	/nfs/dbraw/zinc/98/88/96/527988896.db2.gz	WROIMGZXRBGFMR-LLVKDONJSA-N	1	1	323.397	1.882	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC(=O)OC	ZINC000411222974	528400888	/nfs/dbraw/zinc/40/08/88/528400888.db2.gz	OMFSVJKRAKAZBB-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000820717102	606713329	/nfs/dbraw/zinc/71/33/29/606713329.db2.gz	NWDGKZDQGZWYJG-SECBINFHSA-N	1	1	318.341	1.066	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845773	701140472	/nfs/dbraw/zinc/14/04/72/701140472.db2.gz	YKKIIYRLIWBMAT-LITPITGPSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@H](C[S@@](C)=O)[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845773	701140474	/nfs/dbraw/zinc/14/04/74/701140474.db2.gz	YKKIIYRLIWBMAT-LITPITGPSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[N@@H+](CC1CCCC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985424726	697508550	/nfs/dbraw/zinc/50/85/50/697508550.db2.gz	AATNGWSJBUOAKN-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[N@H+](CC1CCCC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985424726	697508552	/nfs/dbraw/zinc/50/85/52/697508552.db2.gz	AATNGWSJBUOAKN-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[N@@H+](CC1CCCC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985424726	697508554	/nfs/dbraw/zinc/50/85/54/697508554.db2.gz	AATNGWSJBUOAKN-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
[NH3+]C1CCC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000237811047	697813115	/nfs/dbraw/zinc/81/31/15/697813115.db2.gz	XQICUVUYDGAJFA-UHFFFAOYSA-N	1	1	303.322	1.471	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278233	698091650	/nfs/dbraw/zinc/09/16/50/698091650.db2.gz	SMJWRJHCEFZQDU-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278233	698091655	/nfs/dbraw/zinc/09/16/55/698091655.db2.gz	SMJWRJHCEFZQDU-XJKSGUPXSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1	ZINC000778264324	698254723	/nfs/dbraw/zinc/25/47/23/698254723.db2.gz	XHGUDTMRFGLGFF-NSHDSACASA-N	1	1	313.304	1.897	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1	ZINC000778264324	698254724	/nfs/dbraw/zinc/25/47/24/698254724.db2.gz	XHGUDTMRFGLGFF-NSHDSACASA-N	1	1	313.304	1.897	20	5		DDBDMO
Cc1nn(CN2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c(C)c1[N+](=O)[O-]	ZINC000247049859	698360270	/nfs/dbraw/zinc/36/02/70/698360270.db2.gz	UDZUMXOGBZWUGH-ZIAGYGMSSA-N	1	1	307.398	1.782	20	5		DDBDMO
CC(C)[N@H+](CCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000778965344	698387669	/nfs/dbraw/zinc/38/76/69/698387669.db2.gz	BSWBNEGGRJMPKQ-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000778965344	698387673	/nfs/dbraw/zinc/38/76/73/698387673.db2.gz	BSWBNEGGRJMPKQ-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000262534282	698473380	/nfs/dbraw/zinc/47/33/80/698473380.db2.gz	QAUGDRVPDOWLRX-UONOGXRCSA-N	1	1	304.394	1.635	20	5		DDBDMO
CNc1c(C(=O)NCC[N@H+]2CCC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000783913973	698891627	/nfs/dbraw/zinc/89/16/27/698891627.db2.gz	FHEWKSDZIQPGPM-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
Nc1c(F)c(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000785801482	699102641	/nfs/dbraw/zinc/10/26/41/699102641.db2.gz	RENPUGLXZAKPHK-NXEZZACHSA-N	1	1	310.329	1.591	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)O[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000788114516	699280047	/nfs/dbraw/zinc/28/00/47/699280047.db2.gz	FCOOEUVZPJXXTJ-AAEUAGOBSA-N	1	1	308.338	1.351	20	5		DDBDMO
COCC[NH+]1CCC(N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000788563811	699324306	/nfs/dbraw/zinc/32/43/06/699324306.db2.gz	NWJPDLPOPIKBCY-LBPRGKRZSA-N	1	1	322.409	1.938	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000795754077	699889981	/nfs/dbraw/zinc/88/99/81/699889981.db2.gz	YLVAMFAPWSIATR-LBPRGKRZSA-N	1	1	322.365	1.761	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000795754077	699889982	/nfs/dbraw/zinc/88/99/82/699889982.db2.gz	YLVAMFAPWSIATR-LBPRGKRZSA-N	1	1	322.365	1.761	20	5		DDBDMO
C[C@H]1CN(C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])CCO1	ZINC000796115269	699913332	/nfs/dbraw/zinc/91/33/32/699913332.db2.gz	WKVJCCAKWCELIJ-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@H]1CN(C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CCO1	ZINC000796115269	699913335	/nfs/dbraw/zinc/91/33/35/699913335.db2.gz	WKVJCCAKWCELIJ-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@H](NC(=O)CC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000751348957	700281706	/nfs/dbraw/zinc/28/17/06/700281706.db2.gz	CNVLATHEVWCLCI-LBPRGKRZSA-N	1	1	307.350	1.494	20	5		DDBDMO
C[N@@H+](CCCN1CCOC1=O)CCc1cccc([N+](=O)[O-])c1	ZINC000801600314	700326524	/nfs/dbraw/zinc/32/65/24/700326524.db2.gz	OAVAIUCYGGNCBP-UHFFFAOYSA-N	1	1	307.350	1.911	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000801950082	700359839	/nfs/dbraw/zinc/35/98/39/700359839.db2.gz	SMRNFFRMXUMSBU-UHFFFAOYSA-N	1	1	322.340	1.698	20	5		DDBDMO
C[C@@H]1COCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000753985375	700473925	/nfs/dbraw/zinc/47/39/25/700473925.db2.gz	HBVVJLHOCDDFKI-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000753985375	700473927	/nfs/dbraw/zinc/47/39/27/700473927.db2.gz	HBVVJLHOCDDFKI-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000754222772	700490354	/nfs/dbraw/zinc/49/03/54/700490354.db2.gz	DBFAIKMZGNGWIH-NSHDSACASA-N	1	1	306.366	1.652	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000754222772	700490356	/nfs/dbraw/zinc/49/03/56/700490356.db2.gz	DBFAIKMZGNGWIH-NSHDSACASA-N	1	1	306.366	1.652	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@]3(CCOC3)C2)c2ncc([N+](=O)[O-])cc12	ZINC000756861339	700646176	/nfs/dbraw/zinc/64/61/76/700646176.db2.gz	CDYMXTXKMQGXLA-HNNXBMFYSA-N	1	1	317.349	1.718	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)N2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761076320	700840456	/nfs/dbraw/zinc/84/04/56/700840456.db2.gz	NRRLOSOLCXRHFT-WCQYABFASA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@H]1CN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1C	ZINC000761080659	700841264	/nfs/dbraw/zinc/84/12/64/700841264.db2.gz	VBJCBSXPSPIZPJ-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000767618721	701123601	/nfs/dbraw/zinc/12/36/01/701123601.db2.gz	YRKSUCLRSXKIMK-UHFFFAOYSA-N	1	1	307.310	1.320	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839682855	701782421	/nfs/dbraw/zinc/78/24/21/701782421.db2.gz	ANUWQWHOPWDAFT-GBJTYRQASA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839682855	701782424	/nfs/dbraw/zinc/78/24/24/701782424.db2.gz	ANUWQWHOPWDAFT-GBJTYRQASA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1C[C@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839682855	701782427	/nfs/dbraw/zinc/78/24/27/701782427.db2.gz	ANUWQWHOPWDAFT-GBJTYRQASA-N	1	1	309.410	1.765	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])C1CC1	ZINC000839728002	701799865	/nfs/dbraw/zinc/79/98/65/701799865.db2.gz	GPRRFFZZKPYYDM-BZUAXINKSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1	ZINC000839728002	701799869	/nfs/dbraw/zinc/79/98/69/701799869.db2.gz	GPRRFFZZKPYYDM-BZUAXINKSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])C1CC1	ZINC000839728002	701799873	/nfs/dbraw/zinc/79/98/73/701799873.db2.gz	GPRRFFZZKPYYDM-BZUAXINKSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@@H]21	ZINC000866205261	706648002	/nfs/dbraw/zinc/64/80/02/706648002.db2.gz	KSZXBAMMVLAMDL-MNOVXSKESA-N	1	1	302.338	1.168	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000879320872	706648724	/nfs/dbraw/zinc/64/87/24/706648724.db2.gz	JSHBEQYEORECAY-MELADBBJSA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2C[N@H+](C)C[C@H]21	ZINC000843893517	702939094	/nfs/dbraw/zinc/93/90/94/702939094.db2.gz	OGNNCZXIKKXBTD-ZWNOBZJWSA-N	1	1	307.325	1.818	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000844447172	703032661	/nfs/dbraw/zinc/03/26/61/703032661.db2.gz	MXLKAAFWJTVTBZ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000844447172	703032664	/nfs/dbraw/zinc/03/26/64/703032664.db2.gz	MXLKAAFWJTVTBZ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H]1[C@H](COC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000845819060	703206255	/nfs/dbraw/zinc/20/62/55/703206255.db2.gz	JRONVZORUOHRRO-ZJUUUORDSA-N	1	1	322.317	1.821	20	5		DDBDMO
Cn1ccnc1[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000846835475	703339348	/nfs/dbraw/zinc/33/93/48/703339348.db2.gz	BNPNHWSHEGRTGA-HIFRSBDPSA-N	1	1	316.361	1.851	20	5		DDBDMO
COC(=O)[C@]12C[N@H+](Cn3cc([N+](=O)[O-])cn3)C[C@H]1CCCC2	ZINC000848491271	703556940	/nfs/dbraw/zinc/55/69/40/703556940.db2.gz	RIICYIUZIHFJSH-BXUZGUMPSA-N	1	1	308.338	1.414	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cn3cc([N+](=O)[O-])cn3)C[C@H]1CCCC2	ZINC000848491271	703556942	/nfs/dbraw/zinc/55/69/42/703556942.db2.gz	RIICYIUZIHFJSH-BXUZGUMPSA-N	1	1	308.338	1.414	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[N@H+]3CCCC[C@H]23)c1	ZINC000818959295	704035525	/nfs/dbraw/zinc/03/55/25/704035525.db2.gz	HQCBESFHOLHNNH-BZUAXINKSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCN3CCCC[C@H]23)c1	ZINC000818959295	704035526	/nfs/dbraw/zinc/03/55/26/704035526.db2.gz	HQCBESFHOLHNNH-BZUAXINKSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000818963295	704035875	/nfs/dbraw/zinc/03/58/75/704035875.db2.gz	NTSXJOWQFLYJAS-OFQRWUPVSA-N	1	1	305.378	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972943	704038819	/nfs/dbraw/zinc/03/88/19/704038819.db2.gz	PHWLLUZTRRYJAF-WBMJQRKESA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[N@@H+](C3CC3)C2)c1	ZINC000818972943	704038822	/nfs/dbraw/zinc/03/88/22/704038822.db2.gz	PHWLLUZTRRYJAF-WBMJQRKESA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972943	704038829	/nfs/dbraw/zinc/03/88/29/704038829.db2.gz	PHWLLUZTRRYJAF-WBMJQRKESA-N	1	1	305.378	1.702	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)n1	ZINC000853964783	704341447	/nfs/dbraw/zinc/34/14/47/704341447.db2.gz	AMQFURYJWQCGDX-ZDUSSCGKSA-N	1	1	306.366	1.334	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)c1	ZINC000859888399	705030903	/nfs/dbraw/zinc/03/09/03/705030903.db2.gz	CTVTWRWJGBRGTR-YSOBRWQISA-N	1	1	324.402	1.614	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874830376	705189156	/nfs/dbraw/zinc/18/91/56/705189156.db2.gz	RGOXYZHZWPMWFB-QWHCGFSZSA-N	1	1	319.361	1.912	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2cccc([N+](=O)[O-])c2C)no1	ZINC000823269999	705189543	/nfs/dbraw/zinc/18/95/43/705189543.db2.gz	MRSUJFRLPPVQHO-SNVBAGLBSA-N	1	1	320.305	1.906	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000874840450	705196128	/nfs/dbraw/zinc/19/61/28/705196128.db2.gz	OBJVCMICRZAPKI-STQMWFEESA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1ccc(CNC(=O)N2CCC[N@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000876170339	705647622	/nfs/dbraw/zinc/64/76/22/705647622.db2.gz	ABQAPRRHHBFEBW-UHFFFAOYSA-N	1	1	306.366	1.750	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825970060	705752820	/nfs/dbraw/zinc/75/28/20/705752820.db2.gz	USNJYLOMLVRRAR-WFASDCNBSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827346624	705982457	/nfs/dbraw/zinc/98/24/57/705982457.db2.gz	PSBOFNCFIKVFKU-IUODEOHRSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NCc2ccc([N+](=O)[O-])cc2F)C1	ZINC000865659273	706490157	/nfs/dbraw/zinc/49/01/57/706490157.db2.gz	KNBYNLJEBYKTDJ-LBPRGKRZSA-N	1	1	311.357	1.669	20	5		DDBDMO
CC(C)(O)CN1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000865659273	706490159	/nfs/dbraw/zinc/49/01/59/706490159.db2.gz	KNBYNLJEBYKTDJ-LBPRGKRZSA-N	1	1	311.357	1.669	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3c([N+](=O)[O-])cccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000865905427	706559164	/nfs/dbraw/zinc/55/91/64/706559164.db2.gz	JTUUEFWVNBRWNA-MNOVXSKESA-N	1	1	306.322	1.891	20	5		DDBDMO
C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCCO1	ZINC000880094874	706877083	/nfs/dbraw/zinc/87/70/83/706877083.db2.gz	MZSCYGMMOWYSQD-UPJWGTAASA-N	1	1	321.377	1.929	20	5		DDBDMO
C[C@H](NC(=O)CC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000833029855	706999710	/nfs/dbraw/zinc/99/97/10/706999710.db2.gz	PKSRVOUCOLFRDM-LBPRGKRZSA-N	1	1	307.350	1.494	20	5		DDBDMO
C[C@]12C[NH2+]C[C@H]1CN(CCC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000872152002	707305083	/nfs/dbraw/zinc/30/50/83/707305083.db2.gz	JILVYCIPKZGAEC-BLLLJJGKSA-N	1	1	318.377	1.465	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC000836847729	707529359	/nfs/dbraw/zinc/52/93/59/707529359.db2.gz	CPKNRGABUXZECK-MFKMUULPSA-N	1	1	307.325	1.818	20	5		DDBDMO
C[N@H+]1CCN(CCNc2ccnc(F)c2[N+](=O)[O-])CC1(C)C	ZINC000882314388	707580046	/nfs/dbraw/zinc/58/00/46/707580046.db2.gz	SREIZWKHHZEJMQ-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000837613342	707695814	/nfs/dbraw/zinc/69/58/14/707695814.db2.gz	UFMKNMFONYSEES-NSHDSACASA-N	1	1	322.365	1.992	20	5		DDBDMO
C[N@@H+](CCNc1ccc(F)cc1[N+](=O)[O-])CCOCCO	ZINC000882951955	707868743	/nfs/dbraw/zinc/86/87/43/707868743.db2.gz	CRZFMIPKYQZROW-UHFFFAOYSA-N	1	1	301.318	1.087	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000883079649	707920273	/nfs/dbraw/zinc/92/02/73/707920273.db2.gz	ZBKVSNPIIUJTNU-LBPRGKRZSA-N	1	1	321.381	1.400	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1	ZINC000883170359	707946201	/nfs/dbraw/zinc/94/62/01/707946201.db2.gz	RSHCSJCGJJDBDX-GFCCVEGCSA-N	1	1	322.365	1.497	20	5		DDBDMO
COc1cccc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222342	708259999	/nfs/dbraw/zinc/25/99/99/708259999.db2.gz	UQGGXSVURIMMGA-OLZOCXBDSA-N	1	1	321.377	1.639	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000912599001	713042301	/nfs/dbraw/zinc/04/23/01/713042301.db2.gz	NASPHADSEJRKQW-LSDHHAIUSA-N	1	1	321.377	1.081	20	5		DDBDMO
O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])CN1	ZINC000886098677	708697946	/nfs/dbraw/zinc/69/79/46/708697946.db2.gz	PKHFKEMSRIYGQE-OLZOCXBDSA-N	1	1	304.350	1.480	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3C[C@@H]4[C@H](O)CC[C@@H]4C3)nc2c1	ZINC000886579299	708780769	/nfs/dbraw/zinc/78/07/69/708780769.db2.gz	IEIFVKSIBZPONF-SUZMYJTESA-N	1	1	303.318	1.939	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000886597441	708787972	/nfs/dbraw/zinc/78/79/72/708787972.db2.gz	DUCHYKXUMZBTDQ-GFCCVEGCSA-N	1	1	322.365	1.498	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCC[N@@H+](C)CCO	ZINC000899741445	709185792	/nfs/dbraw/zinc/18/57/92/709185792.db2.gz	XXCGPYKPASDRRP-VAWYXSNFSA-N	1	1	307.350	1.038	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@]1(O)CCC[N@H+](C)C1	ZINC000899911697	709235206	/nfs/dbraw/zinc/23/52/06/709235206.db2.gz	VQEDLCSRTNIKNQ-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000889783128	709633965	/nfs/dbraw/zinc/63/39/65/709633965.db2.gz	VLWISJJKFTVIRV-HUUCEWRRSA-N	1	1	319.361	1.266	20	5		DDBDMO
C[C@H](NC(=O)c1c(F)cccc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000900807968	709769899	/nfs/dbraw/zinc/76/98/99/709769899.db2.gz	XMSLQNVDPQEXSA-GWCFXTLKSA-N	1	1	324.356	1.098	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000910281812	709863709	/nfs/dbraw/zinc/86/37/09/709863709.db2.gz	DWXGYGHNGRZSEO-NSHDSACASA-N	1	1	306.366	1.733	20	5		DDBDMO
CC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])(C(F)(F)F)CC1	ZINC000891211365	710125389	/nfs/dbraw/zinc/12/53/89/710125389.db2.gz	GIYKHOINHFMPNT-RKDXNWHRSA-N	1	1	309.288	1.185	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1	ZINC000913295345	713194063	/nfs/dbraw/zinc/19/40/63/713194063.db2.gz	SLKIBWDMHJBSCS-CALCHBBNSA-N	1	1	317.389	1.938	20	5		DDBDMO
CCOc1ccc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000928452604	713203463	/nfs/dbraw/zinc/20/34/63/713203463.db2.gz	NFAFISGKRFEFLQ-JQWIXIFHSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F)C1CCC1	ZINC000911475084	710813430	/nfs/dbraw/zinc/81/34/30/710813430.db2.gz	QHMKKDRNGNSNMH-UHFFFAOYSA-N	1	1	313.304	1.974	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639649	710834240	/nfs/dbraw/zinc/83/42/40/710834240.db2.gz	QQBZDNZCGVXUPG-ZIAGYGMSSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000902639649	710834242	/nfs/dbraw/zinc/83/42/42/710834242.db2.gz	QQBZDNZCGVXUPG-ZIAGYGMSSA-N	1	1	317.349	1.920	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-]	ZINC000928553723	713223582	/nfs/dbraw/zinc/22/35/82/713223582.db2.gz	DIXFWTYMYMAMMU-SECBINFHSA-N	1	1	315.732	1.750	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@H]3CCCC[NH2+]C3)C2)nc1	ZINC000903739895	711262794	/nfs/dbraw/zinc/26/27/94/711262794.db2.gz	AXMSJKFAXPKWHH-UONOGXRCSA-N	1	1	319.409	1.866	20	5		DDBDMO
Cc1cc(N(C)CC(=O)N2CC[NH+](C)CC2)c(F)cc1[N+](=O)[O-]	ZINC000894957751	711338825	/nfs/dbraw/zinc/33/88/25/711338825.db2.gz	IZDFHIRTYNPXRQ-UHFFFAOYSA-N	1	1	324.356	1.253	20	5		DDBDMO
C[C@H]1[C@@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000895738217	711591210	/nfs/dbraw/zinc/59/12/10/711591210.db2.gz	IATWKYPQOBCONY-ONGXEEELSA-N	1	1	313.379	1.503	20	5		DDBDMO
C[C@H]1[C@@H](Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895738217	711591212	/nfs/dbraw/zinc/59/12/12/711591212.db2.gz	IATWKYPQOBCONY-ONGXEEELSA-N	1	1	313.379	1.503	20	5		DDBDMO
COC(=O)/C=C\c1ccc(NC[C@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895777742	711604209	/nfs/dbraw/zinc/60/42/09/711604209.db2.gz	WVGVSDPGOHAWBY-TXNVCOODSA-N	1	1	305.334	1.897	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000896564692	711753530	/nfs/dbraw/zinc/75/35/30/711753530.db2.gz	RMMPEWVQQXOFSJ-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[C@@H](CNC[C@@H](O)C[NH+]1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643917	712104953	/nfs/dbraw/zinc/10/49/53/712104953.db2.gz	OLJQCUOLNWWVKV-UONOGXRCSA-N	1	1	307.394	1.745	20	5		DDBDMO
C[C@@H](C[NH2+]C[C@@H](O)CN1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643917	712104954	/nfs/dbraw/zinc/10/49/54/712104954.db2.gz	OLJQCUOLNWWVKV-UONOGXRCSA-N	1	1	307.394	1.745	20	5		DDBDMO
COc1ccc(NC(=O)C2CN(C)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000907301131	712537413	/nfs/dbraw/zinc/53/74/13/712537413.db2.gz	UNJCJNJSCLYZCM-UHFFFAOYSA-N	1	1	322.365	1.035	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c1C	ZINC000907803965	712628891	/nfs/dbraw/zinc/62/88/91/712628891.db2.gz	OXADUAQGFRZCST-BETUJISGSA-N	1	1	303.362	1.845	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000918395369	713541375	/nfs/dbraw/zinc/54/13/75/713541375.db2.gz	PFGDKGPWFWTKKD-JTQLQIEISA-N	1	1	308.294	1.327	20	5		DDBDMO
COC/C(C)=C/C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000930681230	713894217	/nfs/dbraw/zinc/89/42/17/713894217.db2.gz	UKJUGHWQAUTBOS-WLRTZDKTSA-N	1	1	306.366	1.705	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000930914218	713956907	/nfs/dbraw/zinc/95/69/07/713956907.db2.gz	GWZRQAHPYKHLRD-JHJVBQTASA-N	1	1	321.377	1.948	20	5		DDBDMO
C[NH+](C)CC1(O)CC[NH+](Cc2cc([O-])ccc2[N+](=O)[O-])CC1	ZINC000931480643	714107683	/nfs/dbraw/zinc/10/76/83/714107683.db2.gz	HNBNXDPRDMCAQM-UHFFFAOYSA-N	1	1	309.366	1.189	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000931639129	714146272	/nfs/dbraw/zinc/14/62/72/714146272.db2.gz	HRXSNKGRYHOMBD-RISCZKNCSA-N	1	1	310.350	1.712	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@H]2CC[N@@H+]2C2CCOCC2)cc1	ZINC000922951105	714195912	/nfs/dbraw/zinc/19/59/12/714195912.db2.gz	JMZRZJLKSXTHNR-MRXNPFEDSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@H]2CC[N@H+]2C2CCOCC2)cc1	ZINC000922951105	714195915	/nfs/dbraw/zinc/19/59/15/714195915.db2.gz	JMZRZJLKSXTHNR-MRXNPFEDSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@]1(C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)COC(=O)N1	ZINC000932102057	714259166	/nfs/dbraw/zinc/25/91/66/714259166.db2.gz	MQLVJYHZSOSVKS-OAHLLOKOSA-N	1	1	320.349	1.700	20	5		DDBDMO
CCO[C@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000932973828	714447239	/nfs/dbraw/zinc/44/72/39/714447239.db2.gz	LQKSXHUSAMGPCD-LSDHHAIUSA-N	1	1	319.361	1.811	20	5		DDBDMO
CCO[C@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000932973828	714447240	/nfs/dbraw/zinc/44/72/40/714447240.db2.gz	LQKSXHUSAMGPCD-LSDHHAIUSA-N	1	1	319.361	1.811	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000933721527	714655193	/nfs/dbraw/zinc/65/51/93/714655193.db2.gz	FWFUXRIFYVFPGX-UPJWGTAASA-N	1	1	324.402	1.941	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H]2CS(=O)(=O)C[C@@H]2C1	ZINC000933721527	714655196	/nfs/dbraw/zinc/65/51/96/714655196.db2.gz	FWFUXRIFYVFPGX-UPJWGTAASA-N	1	1	324.402	1.941	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H]2C2OCCO2)cc1	ZINC000933902373	714697327	/nfs/dbraw/zinc/69/73/27/714697327.db2.gz	ZNTPYTDCSFMBHB-KBPBESRZSA-N	1	1	308.334	1.466	20	5		DDBDMO
C[N@@H+](CCO)CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1	ZINC000924996903	714721009	/nfs/dbraw/zinc/72/10/09/714721009.db2.gz	CBPYZXJGCVYSBH-UHFFFAOYSA-N	1	1	319.720	1.041	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925317532	714806901	/nfs/dbraw/zinc/80/69/01/714806901.db2.gz	MCKAOCIKYMURRK-YPMHNXCESA-N	1	1	306.366	1.829	20	5		DDBDMO
C[C@@](CO)([NH2+]CC[N+](=O)[O-])c1cccc(Br)c1	ZINC000934492282	714832914	/nfs/dbraw/zinc/83/29/14/714832914.db2.gz	AVXSQEBUWWLVAX-NSHDSACASA-N	1	1	303.156	1.523	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000935663223	715112725	/nfs/dbraw/zinc/11/27/25/715112725.db2.gz	PTQBLFVXBLGYAW-CYBMUJFWSA-N	1	1	321.381	1.233	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)OC[C@@H]2CCC[N@H+]2CC2CC2)n1	ZINC001123375835	746378328	/nfs/dbraw/zinc/37/83/28/746378328.db2.gz	OIONZZFATFNVOD-NSHDSACASA-N	1	1	308.338	1.360	20	5		DDBDMO
CCCCOCC[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001200472927	748265137	/nfs/dbraw/zinc/26/51/37/748265137.db2.gz	VCVXVPYCZUBEOO-ZIAGYGMSSA-N	1	1	313.398	1.049	20	5		DDBDMO
Cc1ccnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169052442	762206997	/nfs/dbraw/zinc/20/69/97/762206997.db2.gz	FXQUKIUJJHCXMG-HZSPNIEDSA-N	1	1	306.366	1.684	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CC[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329370	766254709	/nfs/dbraw/zinc/25/47/09/766254709.db2.gz	PMPRZXWUOCNROL-NHYWBVRUSA-N	1	1	312.341	1.941	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329370	766254719	/nfs/dbraw/zinc/25/47/19/766254719.db2.gz	PMPRZXWUOCNROL-NHYWBVRUSA-N	1	1	312.341	1.941	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC001096242956	768738537	/nfs/dbraw/zinc/73/85/37/768738537.db2.gz	JXNMUXNJNSFVHU-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
C[NH+](C)CCCC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001133040116	769424686	/nfs/dbraw/zinc/42/46/86/769424686.db2.gz	BSVKNIMQWBENPT-UHFFFAOYSA-N	1	1	308.382	1.142	20	5		DDBDMO
CCCC(=O)N1C[C@@H]2C[N@@H+](Cc3c([N+](=O)[O-])ncn3C)C[C@@H]2C1	ZINC001048646465	769629555	/nfs/dbraw/zinc/62/95/55/769629555.db2.gz	WJPRGFVEZULOAO-TXEJJXNPSA-N	1	1	321.381	1.019	20	5		DDBDMO
CCCC(=O)N1C[C@@H]2C[N@H+](Cc3c([N+](=O)[O-])ncn3C)C[C@@H]2C1	ZINC001048646465	769629558	/nfs/dbraw/zinc/62/95/58/769629558.db2.gz	WJPRGFVEZULOAO-TXEJJXNPSA-N	1	1	321.381	1.019	20	5		DDBDMO
CC(C)(C)OC(=O)c1ccc(N[C@H](N)CCC[NH3+])cc1[N+](=O)[O-]	ZINC001170900952	771899809	/nfs/dbraw/zinc/89/98/09/771899809.db2.gz	RSWMNKZDWKJPJZ-ZDUSSCGKSA-N	1	1	324.381	1.986	20	5		DDBDMO
CC(=O)N1CC(Nc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)C1	ZINC001171081839	772267979	/nfs/dbraw/zinc/26/79/79/772267979.db2.gz	LSYFOCSRRCLMJJ-UHFFFAOYSA-N	1	1	304.350	1.225	20	5		DDBDMO
CC(=O)N1CC(Nc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)C1	ZINC001171081839	772267984	/nfs/dbraw/zinc/26/79/84/772267984.db2.gz	LSYFOCSRRCLMJJ-UHFFFAOYSA-N	1	1	304.350	1.225	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCC1(Nc2ccccc2[N+](=O)[O-])CC1	ZINC001110158550	775939224	/nfs/dbraw/zinc/93/92/24/775939224.db2.gz	KOZZPINYNSAJBE-UHFFFAOYSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=C1C[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCCN1	ZINC001172906395	776916817	/nfs/dbraw/zinc/91/68/17/776916817.db2.gz	XQBSTTHIZSYPLK-AWEZNQCLSA-N	1	1	303.362	1.664	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCO[C@@H]2C[C@@H](CO)C[C@@H]21	ZINC001173222790	777056249	/nfs/dbraw/zinc/05/62/49/777056249.db2.gz	VPBHAYCIMQMLMB-NQZOLGFYSA-N	1	1	320.389	1.998	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@H]2CCOC2)CC1	ZINC001173224855	777058938	/nfs/dbraw/zinc/05/89/38/777058938.db2.gz	HLLUUNVAUXLRFI-PBHICJAKSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001173235016	777064342	/nfs/dbraw/zinc/06/43/42/777064342.db2.gz	VRLCJZFGPUTVIN-WFASDCNBSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001173235016	777064346	/nfs/dbraw/zinc/06/43/46/777064346.db2.gz	VRLCJZFGPUTVIN-WFASDCNBSA-N	1	1	319.361	1.069	20	5		DDBDMO
CNc1ccc(C(=O)NCc2[nH]c(C)[nH+]c2C)cc1[N+](=O)[O-]	ZINC001178441578	779030495	/nfs/dbraw/zinc/03/04/95/779030495.db2.gz	LGYVTINIHQUBMP-UHFFFAOYSA-N	1	1	303.322	1.906	20	5		DDBDMO
O=C(NCC[NH+]1CC=CC1)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC001116201551	780484563	/nfs/dbraw/zinc/48/45/63/780484563.db2.gz	VZYLOLPUARHIKA-UHFFFAOYSA-N	1	1	301.302	1.943	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC(C)(C)C1	ZINC001267313946	837810320	/nfs/dbraw/zinc/81/03/20/837810320.db2.gz	CCKJUBDDQWVWJJ-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC(C)(C)C1	ZINC001267313946	837810330	/nfs/dbraw/zinc/81/03/30/837810330.db2.gz	CCKJUBDDQWVWJJ-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC(C)(C)C1	ZINC001267313946	837810341	/nfs/dbraw/zinc/81/03/41/837810341.db2.gz	CCKJUBDDQWVWJJ-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
COCC1(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC001266297530	836073502	/nfs/dbraw/zinc/07/35/02/836073502.db2.gz	NQFVZFYUWAZSHX-UHFFFAOYSA-N	1	1	321.377	1.569	20	5		DDBDMO
COCC1(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC001266297530	836073513	/nfs/dbraw/zinc/07/35/13/836073513.db2.gz	NQFVZFYUWAZSHX-UHFFFAOYSA-N	1	1	321.377	1.569	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC001327616167	862320809	/nfs/dbraw/zinc/32/08/09/862320809.db2.gz	KNTJAEAFWZBBBN-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)c2ccnc(NC)c2[N+](=O)[O-])C(C)(C)C1	ZINC001156837419	863383205	/nfs/dbraw/zinc/38/32/05/863383205.db2.gz	UGBDMTKTINKLLG-LLVKDONJSA-N	1	1	321.381	1.492	20	5		DDBDMO
COc1cc(C)nc(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001157266357	863695490	/nfs/dbraw/zinc/69/54/90/863695490.db2.gz	RBEHOKKRAQEZAW-VXGBXAGGSA-N	1	1	306.366	1.837	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@@H](O)C(F)(F)F)ncc1[N+](=O)[O-]	ZINC001158542399	864715952	/nfs/dbraw/zinc/71/59/52/864715952.db2.gz	FTRNROLFUOUFEC-HMDXOVGESA-N	1	1	320.271	1.857	20	5		DDBDMO
CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3ccc([N+](=O)[O-])cn3)C[C@H]1[N@H+]2C	ZINC001225634007	881951067	/nfs/dbraw/zinc/95/10/67/881951067.db2.gz	COYOZRZQNGJDMB-IGQOVBAYSA-N	1	1	321.333	1.535	20	5		DDBDMO
CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C(F)F	ZINC001319966301	866406191	/nfs/dbraw/zinc/40/61/91/866406191.db2.gz	IJJSVJOPHLHFMP-UHFFFAOYSA-N	1	1	301.293	1.750	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C(F)F	ZINC001319966301	866406197	/nfs/dbraw/zinc/40/61/97/866406197.db2.gz	IJJSVJOPHLHFMP-UHFFFAOYSA-N	1	1	301.293	1.750	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H]1CCC3(COC3)O1)CC2	ZINC001333118172	866436107	/nfs/dbraw/zinc/43/61/07/866436107.db2.gz	ICSYTRSUVIOPTN-HNNXBMFYSA-N	1	1	304.346	1.901	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1CCC3(COC3)O1)CC2	ZINC001333118172	866436110	/nfs/dbraw/zinc/43/61/10/866436110.db2.gz	ICSYTRSUVIOPTN-HNNXBMFYSA-N	1	1	304.346	1.901	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC001320963607	867155889	/nfs/dbraw/zinc/15/58/89/867155889.db2.gz	VJHIBKUKEDXRQO-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
C[N@H+]1CCC[C@](C)(Nc2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C1	ZINC001162336432	867467036	/nfs/dbraw/zinc/46/70/36/867467036.db2.gz	BILCWSLBRWGOKN-LBPRGKRZSA-N	1	1	300.746	1.778	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@@H]3CCNC(=O)C3)ccc([N+](=O)[O-])c2C1	ZINC001162337982	867469576	/nfs/dbraw/zinc/46/95/76/867469576.db2.gz	DIHXPQOZYBYPOC-LLVKDONJSA-N	1	1	318.377	1.521	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@@H]3CCNC(=O)C3)ccc([N+](=O)[O-])c2C1	ZINC001162337982	867469587	/nfs/dbraw/zinc/46/95/87/867469587.db2.gz	DIHXPQOZYBYPOC-LLVKDONJSA-N	1	1	318.377	1.521	20	5		DDBDMO
CN(CCC[NH2+]Cc1ccc(F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001322506069	868211719	/nfs/dbraw/zinc/21/17/19/868211719.db2.gz	VECOAHHRIBPSAZ-ZIAGYGMSSA-N	1	1	309.341	1.429	20	5		DDBDMO
C[C@H]1CC[C@@H](CO)N1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001164309341	869113005	/nfs/dbraw/zinc/11/30/05/869113005.db2.gz	FIBUUPZUFKSFAP-XTYWZOAOSA-N	1	1	306.366	1.872	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNc2ncnc3[nH]cc([N+](=O)[O-])c32)C1	ZINC001165262515	869476892	/nfs/dbraw/zinc/47/68/92/869476892.db2.gz	VTDVYXVCAOTRJM-JTQLQIEISA-N	1	1	304.354	1.962	20	5		DDBDMO
CN(CCNCc1csc([N+](=O)[O-])c1)C(=O)CC[NH+](C)C	ZINC001317623309	871230306	/nfs/dbraw/zinc/23/03/06/871230306.db2.gz	KADYVSSVFPPMMH-UHFFFAOYSA-N	1	1	314.411	1.156	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)C1N=NC(=O)N1C	ZINC001308846944	871530778	/nfs/dbraw/zinc/53/07/78/871530778.db2.gz	XPBPMPUNZUUDLM-JTQLQIEISA-N	1	1	305.338	1.897	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC001205555934	871628240	/nfs/dbraw/zinc/62/82/40/871628240.db2.gz	YKLVIOFQBPOHLL-OAHLLOKOSA-N	1	1	323.349	1.267	20	5		DDBDMO
Nc1ncc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC001300131226	876970570	/nfs/dbraw/zinc/97/05/70/876970570.db2.gz	ODWSCNNCXSVDSC-RYUDHWBXSA-N	1	1	319.365	1.319	20	5		DDBDMO
CC[N@H+]1CC[C@H](O[C@H](C(=O)OC)c2ccccc2[N+](=O)[O-])C1	ZINC001223641643	881037514	/nfs/dbraw/zinc/03/75/14/881037514.db2.gz	BWAWFJWQFFSOLE-FZMZJTMJSA-N	1	1	308.334	1.920	20	5		DDBDMO
COc1cccc(CO[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c1[N+](=O)[O-]	ZINC001223812892	881106954	/nfs/dbraw/zinc/10/69/54/881106954.db2.gz	RLUISUQMTHJRFZ-LNSITVRQSA-N	1	1	320.345	1.924	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](OCCc3ccc([N+](=O)[O-])cc3)[C@H]1CC(=O)C2	ZINC001224331279	881332282	/nfs/dbraw/zinc/33/22/82/881332282.db2.gz	ONZDRETXIYNMIX-IMJJTQAJSA-N	1	1	304.346	1.958	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2[nH]c(=O)nc3cc([N+](=O)[O-])ccc32)C1	ZINC001228242786	883403311	/nfs/dbraw/zinc/40/33/11/883403311.db2.gz	RQCCDTDCWGZGRN-JTQLQIEISA-N	1	1	304.306	1.717	20	5		DDBDMO
C[N@H+]1CCC[C@H](Oc2[nH]c(=O)nc3cc([N+](=O)[O-])ccc32)C1	ZINC001228242706	883404012	/nfs/dbraw/zinc/40/40/12/883404012.db2.gz	RDCYPXLCQHTGFP-JTQLQIEISA-N	1	1	304.306	1.717	20	5		DDBDMO
C[C@@H](CNC(=O)c1cnc(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1	ZINC001290900462	913537353	/nfs/dbraw/zinc/53/73/53/913537353.db2.gz	UYGRNIOCIRWHMR-QWRGUYRKSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCNC(=O)C(F)(F)F	ZINC001254534729	896491637	/nfs/dbraw/zinc/49/16/37/896491637.db2.gz	CBXBIZJJAJOOCO-SECBINFHSA-N	1	1	319.283	1.794	20	5		DDBDMO
CN1CCO[C@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]21	ZINC001254593921	896521057	/nfs/dbraw/zinc/52/10/57/896521057.db2.gz	BULMUPHZKPLLIM-OAGGEKHMSA-N	1	1	303.362	1.077	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C2)O1	ZINC001254603452	896526602	/nfs/dbraw/zinc/52/66/02/896526602.db2.gz	NGPTYYNHPHAOIR-HOCLYGCPSA-N	1	1	317.345	1.636	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1O	ZINC000614661517	361967732	/nfs/dbraw/zinc/96/77/32/361967732.db2.gz	KLGVOJKKCKPLNO-MFKMUULPSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@@H]1O	ZINC000614661517	361967737	/nfs/dbraw/zinc/96/77/37/361967737.db2.gz	KLGVOJKKCKPLNO-MFKMUULPSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000249566763	282174134	/nfs/dbraw/zinc/17/41/34/282174134.db2.gz	NFEFQCMPAUSPEK-BXUZGUMPSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000249566763	282174139	/nfs/dbraw/zinc/17/41/39/282174139.db2.gz	NFEFQCMPAUSPEK-BXUZGUMPSA-N	1	1	307.350	1.559	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000295792670	529503807	/nfs/dbraw/zinc/50/38/07/529503807.db2.gz	VHFBNRIOHDXCLK-JTQLQIEISA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000295792670	529503808	/nfs/dbraw/zinc/50/38/08/529503808.db2.gz	VHFBNRIOHDXCLK-JTQLQIEISA-N	1	1	315.757	1.889	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CCO)c1cccc([N+](=O)[O-])c1	ZINC000452395976	231376803	/nfs/dbraw/zinc/37/68/03/231376803.db2.gz	XNXQBQWXHKBLMA-CQSZACIVSA-N	1	1	307.350	1.171	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCCC[N@H+]1CCO	ZINC000452395052	231376973	/nfs/dbraw/zinc/37/69/73/231376973.db2.gz	VZJZPJYSFNBUNV-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
COc1cc(NC[C@H](C)[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000266422727	282302471	/nfs/dbraw/zinc/30/24/71/282302471.db2.gz	SHCFYVYDMORFAT-LBPRGKRZSA-N	1	1	308.382	1.651	20	5		DDBDMO
C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000305759266	529926080	/nfs/dbraw/zinc/92/60/80/529926080.db2.gz	CQEHQXCNQIVBGF-NSHDSACASA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000305759266	529926082	/nfs/dbraw/zinc/92/60/82/529926082.db2.gz	CQEHQXCNQIVBGF-NSHDSACASA-N	1	1	308.256	1.829	20	5		DDBDMO
COC(=O)c1cc(N2CC[N@@H+](C)C[C@@H]2C)cc(C)c1[N+](=O)[O-]	ZINC000615494270	362307181	/nfs/dbraw/zinc/30/71/81/362307181.db2.gz	LSTBMBXALMFBRN-NSHDSACASA-N	1	1	307.350	1.830	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](O)CC1	ZINC000293025980	282361285	/nfs/dbraw/zinc/36/12/85/282361285.db2.gz	FVSVUIIQRSXRBT-QWHCGFSZSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000330918570	232161445	/nfs/dbraw/zinc/16/14/45/232161445.db2.gz	XMDBFEPJPFLFJU-VXGBXAGGSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1(CO)CCOCC1	ZINC000616828677	362836735	/nfs/dbraw/zinc/83/67/35/362836735.db2.gz	CXEVTXHMGZPWED-UHFFFAOYSA-N	1	1	321.333	1.709	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000279884199	215204541	/nfs/dbraw/zinc/20/45/41/215204541.db2.gz	UMNYLOAPPWUQNT-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000279884199	215204545	/nfs/dbraw/zinc/20/45/45/215204545.db2.gz	UMNYLOAPPWUQNT-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
NC(=O)c1ccc(C[NH+]2CCC3(CC2)OCCO3)c([N+](=O)[O-])c1	ZINC000028078941	352228013	/nfs/dbraw/zinc/22/80/13/352228013.db2.gz	XCRWNPQMSMEKLD-UHFFFAOYSA-N	1	1	321.333	1.033	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000041929301	352318702	/nfs/dbraw/zinc/31/87/02/352318702.db2.gz	OOHMKXCXPMQEAF-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
Cc1cccc(C[NH+]2CCC(NC(=O)[C@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000053506615	352659520	/nfs/dbraw/zinc/65/95/20/352659520.db2.gz	DXIBHCWGSSQEQO-HOTGVXAUSA-N	1	1	317.389	1.741	20	5		DDBDMO
CS(=O)(=O)NC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000054146203	352680411	/nfs/dbraw/zinc/68/04/11/352680411.db2.gz	BLRBCCJGRDIREO-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000491559440	234202745	/nfs/dbraw/zinc/20/27/45/234202745.db2.gz	ALRYNXZWEOXSGJ-AFNCTOJWSA-N	1	1	319.361	1.445	20	5		DDBDMO
CCOC[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000072977168	191261276	/nfs/dbraw/zinc/26/12/76/191261276.db2.gz	VBUIJGMBZHQSDZ-GFCCVEGCSA-N	1	1	321.377	1.942	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000174195810	198304858	/nfs/dbraw/zinc/30/48/58/198304858.db2.gz	YCXZCRLNPFVJJO-CYBMUJFWSA-N	1	1	319.361	1.389	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H](C[NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000174321518	198319471	/nfs/dbraw/zinc/31/94/71/198319471.db2.gz	VBIKHVAJGDKCAG-NSHDSACASA-N	1	1	321.381	1.438	20	5		DDBDMO
Cc1cc(NC2CC[NH+](CC(=O)N(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000074750078	353328510	/nfs/dbraw/zinc/32/85/10/353328510.db2.gz	QNDKLDVDFSFDSI-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000174534638	198348775	/nfs/dbraw/zinc/34/87/75/198348775.db2.gz	MUWRMJKOXFZQHR-CQSZACIVSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCO[C@@H]1CCC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000076403968	353418712	/nfs/dbraw/zinc/41/87/12/353418712.db2.gz	ZIRIQXHFRWVYKK-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CCO[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000076403968	353418716	/nfs/dbraw/zinc/41/87/16/353418716.db2.gz	ZIRIQXHFRWVYKK-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC[C@@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000174703881	198373093	/nfs/dbraw/zinc/37/30/93/198373093.db2.gz	FBDHPAMSJHYYHN-GFCCVEGCSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1cnc(N(C)CCC[NH+]2CCN(C)CC2)c([N+](=O)[O-])c1	ZINC000078662072	353527376	/nfs/dbraw/zinc/52/73/76/353527376.db2.gz	GJWWZIYLPMZBGC-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)[nH+]c1	ZINC000079403851	353560619	/nfs/dbraw/zinc/56/06/19/353560619.db2.gz	HWQVUXSRDLJOMV-UHFFFAOYSA-N	1	1	303.322	1.858	20	5		DDBDMO
Cc1c(C[N@@H+](C)C[C@@H](O)CN2CCOCC2)cccc1[N+](=O)[O-]	ZINC000083244979	353709154	/nfs/dbraw/zinc/70/91/54/353709154.db2.gz	ZEZWHDJFHOANEX-OAHLLOKOSA-N	1	1	323.393	1.028	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000093332118	353895464	/nfs/dbraw/zinc/89/54/64/353895464.db2.gz	DZSQEQUULCUGQU-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000093332118	353895467	/nfs/dbraw/zinc/89/54/67/353895467.db2.gz	DZSQEQUULCUGQU-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H](O)[C@@H](O)C3)s2)cc1	ZINC000093483525	353901686	/nfs/dbraw/zinc/90/16/86/353901686.db2.gz	UQKGWDYLRUQTNG-OKILXGFUSA-N	1	1	320.370	1.861	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154686079	354207491	/nfs/dbraw/zinc/20/74/91/354207491.db2.gz	HTJOYPOEBNDORL-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154686079	354207493	/nfs/dbraw/zinc/20/74/93/354207493.db2.gz	HTJOYPOEBNDORL-BXUZGUMPSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@H]1C	ZINC000164712226	354247621	/nfs/dbraw/zinc/24/76/21/354247621.db2.gz	FENDGUFXEHEHSD-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOC[C@H]1C	ZINC000164712226	354247624	/nfs/dbraw/zinc/24/76/24/354247624.db2.gz	FENDGUFXEHEHSD-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1cc(N)c([N+](=O)[O-])c(CO)c1)CC2	ZINC000588011474	354893261	/nfs/dbraw/zinc/89/32/61/354893261.db2.gz	UEKPRZHXPBNXKA-UHFFFAOYSA-N	1	1	320.393	1.734	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588863024	354944544	/nfs/dbraw/zinc/94/45/44/354944544.db2.gz	NYGMJSNDNLUBLN-UONOGXRCSA-N	1	1	319.361	1.184	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](CO)[C@@H](O)C2)cc1	ZINC000588966438	354952555	/nfs/dbraw/zinc/95/25/55/354952555.db2.gz	ZIMUGFGVIKAJEX-DOMZBBRYSA-N	1	1	310.350	1.039	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@@H]2CCCO2)c1	ZINC000589494152	354996184	/nfs/dbraw/zinc/99/61/84/354996184.db2.gz	GCHYUJLICWYEEL-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H]2CCCO2)c1	ZINC000589494152	354996187	/nfs/dbraw/zinc/99/61/87/354996187.db2.gz	GCHYUJLICWYEEL-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000590045784	355043459	/nfs/dbraw/zinc/04/34/59/355043459.db2.gz	WDLCLIMWJLGGEL-WFASDCNBSA-N	1	1	319.361	1.445	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)[C@@H]2C1	ZINC000590441781	355095508	/nfs/dbraw/zinc/09/55/08/355095508.db2.gz	FCGFGKYRIZNOIE-BXKDBHETSA-N	1	1	319.317	1.100	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000590443362	355097901	/nfs/dbraw/zinc/09/79/01/355097901.db2.gz	IMZHFRHEEDPNJG-BXUZGUMPSA-N	1	1	305.334	1.136	20	5		DDBDMO
C[C@H]1CN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC[N@H+](C2CCC2)C1	ZINC000590452373	355100471	/nfs/dbraw/zinc/10/04/71/355100471.db2.gz	BNIRHWZXANYHLC-SNVBAGLBSA-N	1	1	307.354	1.264	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C	ZINC000592750873	355675020	/nfs/dbraw/zinc/67/50/20/355675020.db2.gz	CENRJBHFCJJARB-ZWNOBZJWSA-N	1	1	307.350	1.560	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000593070265	355786449	/nfs/dbraw/zinc/78/64/49/355786449.db2.gz	VYTWCBRCFGPTNF-GJZGRUSLSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](O)C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000594063570	356103941	/nfs/dbraw/zinc/10/39/41/356103941.db2.gz	IGXQALUFLNGGLL-WCQYABFASA-N	1	1	310.350	1.180	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000594419173	356204555	/nfs/dbraw/zinc/20/45/55/356204555.db2.gz	OJMRLSQAHZWMIK-STQMWFEESA-N	1	1	318.377	1.924	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cn2cc(C[N@H+]3CCC[C@H]3CO)nn2)cc1	ZINC000594651936	356275731	/nfs/dbraw/zinc/27/57/31/356275731.db2.gz	PMVGDBONKBGAAF-HNNXBMFYSA-N	1	1	317.349	1.191	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cn2cc(C[N@@H+]3CCC[C@H]3CO)nn2)cc1	ZINC000594651936	356275735	/nfs/dbraw/zinc/27/57/35/356275735.db2.gz	PMVGDBONKBGAAF-HNNXBMFYSA-N	1	1	317.349	1.191	20	5		DDBDMO
COC[C@H](C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)OC	ZINC000595370248	356468283	/nfs/dbraw/zinc/46/82/83/356468283.db2.gz	FYIHJIZBXWPYNJ-AAEUAGOBSA-N	1	1	310.354	1.137	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595744674	356632105	/nfs/dbraw/zinc/63/21/05/356632105.db2.gz	LRQHOAVMZPMEKQ-ATCWAGBWSA-N	1	1	321.377	1.790	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595744674	356632108	/nfs/dbraw/zinc/63/21/08/356632108.db2.gz	LRQHOAVMZPMEKQ-ATCWAGBWSA-N	1	1	321.377	1.790	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2COC[C@]2(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000595756463	356638684	/nfs/dbraw/zinc/63/86/84/356638684.db2.gz	GGPQELHCEMFEBK-WBMJQRKESA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C2	ZINC000595758441	356639451	/nfs/dbraw/zinc/63/94/51/356639451.db2.gz	MYBJAFYYLDLOPZ-ZENOOKHLSA-N	1	1	322.361	1.303	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000595761679	356641851	/nfs/dbraw/zinc/64/18/51/356641851.db2.gz	ZBHXHELHKJDLTN-WFASDCNBSA-N	1	1	305.334	1.162	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595876237	356688310	/nfs/dbraw/zinc/68/83/10/356688310.db2.gz	RCSWIXFKNAAHQK-MLGOLLRUSA-N	1	1	321.377	1.874	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CCc3[nH+]c[nH]c3C2)ccc1[N+](=O)[O-]	ZINC000596239199	356828818	/nfs/dbraw/zinc/82/88/18/356828818.db2.gz	ZFOVDTBEGOXWNG-VIFPVBQESA-N	1	1	301.306	1.386	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CCc3[nH]c[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000596239199	356828821	/nfs/dbraw/zinc/82/88/21/356828821.db2.gz	ZFOVDTBEGOXWNG-VIFPVBQESA-N	1	1	301.306	1.386	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1	ZINC000596539344	356911234	/nfs/dbraw/zinc/91/12/34/356911234.db2.gz	OWZYBHRZVFBSHM-CQSZACIVSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[NH2+]C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000237249693	202204817	/nfs/dbraw/zinc/20/48/17/202204817.db2.gz	HFWJJXCGKUJCLZ-JTQLQIEISA-N	1	1	317.349	1.543	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000598343861	357546422	/nfs/dbraw/zinc/54/64/22/357546422.db2.gz	WYEAXESMVXJHCR-SNVBAGLBSA-N	1	1	309.370	1.655	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000598628153	357660681	/nfs/dbraw/zinc/66/06/81/357660681.db2.gz	OMZHWJADSRMIKA-AOOOYVTPSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000598628153	357660683	/nfs/dbraw/zinc/66/06/83/357660683.db2.gz	OMZHWJADSRMIKA-AOOOYVTPSA-N	1	1	308.338	1.305	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1CO	ZINC000598643498	357666300	/nfs/dbraw/zinc/66/63/00/357666300.db2.gz	LMUYIPKAVOKOKM-NFAWXSAZSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1CO	ZINC000598645107	357667311	/nfs/dbraw/zinc/66/73/11/357667311.db2.gz	DOKXKCKRNLTKSL-SMDDNHRTSA-N	1	1	322.361	1.912	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCC[N@@H+](CC2CC2)C1	ZINC000598561310	357632996	/nfs/dbraw/zinc/63/29/96/357632996.db2.gz	PQCAJDRDFZKVKD-ZDUSSCGKSA-N	1	1	321.381	1.030	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000598740668	357711095	/nfs/dbraw/zinc/71/10/95/357711095.db2.gz	VGXCKGJETJDVCH-UHFFFAOYSA-N	1	1	308.338	1.300	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)Nc1ccccc1[N+](=O)[O-]	ZINC000599680555	358022835	/nfs/dbraw/zinc/02/28/35/358022835.db2.gz	GJAVMWSPAOGPFP-SGIREYDYSA-N	1	1	319.361	1.769	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000599704194	358033330	/nfs/dbraw/zinc/03/33/30/358033330.db2.gz	QKGOGXSPNJXWMT-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@H]1CCC[N@H+]1C	ZINC000601109810	358405238	/nfs/dbraw/zinc/40/52/38/358405238.db2.gz	ZPXLFDRYGWENPJ-SSDOTTSWSA-N	1	1	307.276	1.853	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(c2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601116517	358409285	/nfs/dbraw/zinc/40/92/85/358409285.db2.gz	MJSYSBCOUOXPEB-UHFFFAOYSA-N	1	1	312.345	1.412	20	5		DDBDMO
C[NH+]1CCN(CCCCNc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601103526	358403581	/nfs/dbraw/zinc/40/35/81/358403581.db2.gz	CHPGKQSDWKUZNV-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
COC[C@](C)(O)CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601171022	358431320	/nfs/dbraw/zinc/43/13/20/358431320.db2.gz	ZDTJIOAORJFRMZ-OAHLLOKOSA-N	1	1	305.334	1.764	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1=O	ZINC000601970794	358759212	/nfs/dbraw/zinc/75/92/12/358759212.db2.gz	QAJUUATZNRONTQ-OAHLLOKOSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cn1cc(CN2CCC(CCC[NH+](C)C)CC2)c([N+](=O)[O-])n1	ZINC000602476484	359004292	/nfs/dbraw/zinc/00/42/92/359004292.db2.gz	OTKQBHZVSXEOMK-UHFFFAOYSA-N	1	1	309.414	1.882	20	5		DDBDMO
C[S@](=O)C1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000602655355	359104568	/nfs/dbraw/zinc/10/45/68/359104568.db2.gz	JXEVKFLBIPAGTK-NRFANRHFSA-N	1	1	309.347	1.737	20	5		DDBDMO
Cn1cc(C[N@H+](C)C[C@H](O)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602672281	359116496	/nfs/dbraw/zinc/11/64/96/359116496.db2.gz	YFCDZFMKQWRNSF-CQSZACIVSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@H](O)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602672281	359116501	/nfs/dbraw/zinc/11/65/01/359116501.db2.gz	YFCDZFMKQWRNSF-CQSZACIVSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1	ZINC000602837806	359227371	/nfs/dbraw/zinc/22/73/71/359227371.db2.gz	AAEUEOCDPILXJZ-GXSJLCMTSA-N	1	1	322.287	1.345	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@]2(C)C(=O)NC(=O)[C@]2(C)C1	ZINC000602938986	359307302	/nfs/dbraw/zinc/30/73/02/359307302.db2.gz	ZSBZFHCTLPYWRT-GTTSAUCSSA-N	1	1	317.345	1.640	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCC[N@H+](C)C2CC2)c1	ZINC000281165624	216124246	/nfs/dbraw/zinc/12/42/46/216124246.db2.gz	IMMLQCCNDJZICP-UHFFFAOYSA-N	1	1	321.377	1.883	20	5		DDBDMO
CS(=O)(=O)C[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000292404017	223055177	/nfs/dbraw/zinc/05/51/77/223055177.db2.gz	ZBHMCSJUJBPHDD-ZDUSSCGKSA-N	1	1	312.391	1.504	20	5		DDBDMO
CS(=O)(=O)C[C@H]1CC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000292404017	223055179	/nfs/dbraw/zinc/05/51/79/223055179.db2.gz	ZBHMCSJUJBPHDD-ZDUSSCGKSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000359018713	299307774	/nfs/dbraw/zinc/30/77/74/299307774.db2.gz	MVIHXQXZNOQYSK-TXEJJXNPSA-N	1	1	321.381	1.796	20	5		DDBDMO
C[N@H+]1CCCN(CCCNC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000609619897	360336345	/nfs/dbraw/zinc/33/63/45/360336345.db2.gz	WXEPAWOUDNVBTH-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CN1CCC[N@H+](CCCNC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000609619897	360336348	/nfs/dbraw/zinc/33/63/48/360336348.db2.gz	WXEPAWOUDNVBTH-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CN1CCC[N@@H+](CCCNC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000609619897	360336352	/nfs/dbraw/zinc/33/63/52/360336352.db2.gz	WXEPAWOUDNVBTH-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
C[C@H]1C[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000610271197	360404782	/nfs/dbraw/zinc/40/47/82/360404782.db2.gz	JWMXABVBMAZRSW-WCQYABFASA-N	1	1	321.377	1.938	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](C)CCO1	ZINC000610899535	360567465	/nfs/dbraw/zinc/56/74/65/360567465.db2.gz	YYGOFWFMAJOMNP-SMDDNHRTSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCO1	ZINC000610899535	360567471	/nfs/dbraw/zinc/56/74/71/360567471.db2.gz	YYGOFWFMAJOMNP-SMDDNHRTSA-N	1	1	322.365	1.113	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000611084680	360617592	/nfs/dbraw/zinc/61/75/92/360617592.db2.gz	JKUMCPRCJLCWIP-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](CC)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000611084680	360617595	/nfs/dbraw/zinc/61/75/95/360617595.db2.gz	JKUMCPRCJLCWIP-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
C[C@@H](NC(=O)[C@H]1C[N@H+]2CCN1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000611201349	360657383	/nfs/dbraw/zinc/65/73/83/360657383.db2.gz	UAPCPWTVCHOIQV-IUODEOHRSA-N	1	1	318.377	1.162	20	5		DDBDMO
COc1cc(CN2CC[NH+]([C@H]3CCOC3)CC2)ccc1[N+](=O)[O-]	ZINC000611516705	360744479	/nfs/dbraw/zinc/74/44/79/360744479.db2.gz	DCOFHZXKSVRTIL-AWEZNQCLSA-N	1	1	321.377	1.510	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@@H](OC(F)F)C1	ZINC000611577241	360765524	/nfs/dbraw/zinc/76/55/24/360765524.db2.gz	HADDUTQAAYYCLU-LLVKDONJSA-N	1	1	317.292	1.460	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](OC(F)F)C1	ZINC000611577241	360765525	/nfs/dbraw/zinc/76/55/25/360765525.db2.gz	HADDUTQAAYYCLU-LLVKDONJSA-N	1	1	317.292	1.460	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000281287259	216212364	/nfs/dbraw/zinc/21/23/64/216212364.db2.gz	GTLNBITZTVPLCQ-GJZGRUSLSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1ccc(NC(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000611826381	360835760	/nfs/dbraw/zinc/83/57/60/360835760.db2.gz	HLKOQLWWOSHWHQ-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000619435625	364007769	/nfs/dbraw/zinc/00/77/69/364007769.db2.gz	MCYGHVBJDRQVDH-GFCCVEGCSA-N	1	1	319.361	1.818	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000275353036	212285727	/nfs/dbraw/zinc/28/57/27/212285727.db2.gz	KDNZTUBVVMWABI-UWVGGRQHSA-N	1	1	315.320	1.764	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2c(F)cc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000275353036	212285730	/nfs/dbraw/zinc/28/57/30/212285730.db2.gz	KDNZTUBVVMWABI-UWVGGRQHSA-N	1	1	315.320	1.764	20	5		DDBDMO
C[N@@H+](CCCCO)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000349917897	284105622	/nfs/dbraw/zinc/10/56/22/284105622.db2.gz	BXCZAZSWPBNAOL-AWEZNQCLSA-N	1	1	307.350	1.404	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@H]1CCS(=O)(=O)C1	ZINC000349961142	284120298	/nfs/dbraw/zinc/12/02/98/284120298.db2.gz	BEGWOPRPDXNZOC-LBPRGKRZSA-N	1	1	312.391	1.770	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1CCS(=O)(=O)C1	ZINC000349961142	284120300	/nfs/dbraw/zinc/12/03/00/284120300.db2.gz	BEGWOPRPDXNZOC-LBPRGKRZSA-N	1	1	312.391	1.770	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C1CCN(CCO)CC1	ZINC000350016995	284133048	/nfs/dbraw/zinc/13/30/48/284133048.db2.gz	SWFYXVNTHQZPBR-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN(C)C1CC[NH+](CCO)CC1	ZINC000350016995	284133050	/nfs/dbraw/zinc/13/30/50/284133050.db2.gz	SWFYXVNTHQZPBR-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000264707382	204092375	/nfs/dbraw/zinc/09/23/75/204092375.db2.gz	YAQOMICMJMDOBW-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000264707382	204092378	/nfs/dbraw/zinc/09/23/78/204092378.db2.gz	YAQOMICMJMDOBW-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000264707382	204092382	/nfs/dbraw/zinc/09/23/82/204092382.db2.gz	YAQOMICMJMDOBW-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CC[N@H+]1C[C@H](C)O	ZINC000266392095	205314338	/nfs/dbraw/zinc/31/43/38/205314338.db2.gz	OEAXAAZFFRTDEK-STQMWFEESA-N	1	1	323.393	1.885	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1[C@@H]1CCCOC1	ZINC000566970900	304190724	/nfs/dbraw/zinc/19/07/24/304190724.db2.gz	FTBPAXBKLFNIOO-HIFRSBDPSA-N	1	1	321.377	1.648	20	5		DDBDMO
CNc1c(C(=O)N2CC[NH+](C(C)C)CC2)cccc1[N+](=O)[O-]	ZINC000336859297	249267356	/nfs/dbraw/zinc/26/73/56/249267356.db2.gz	GNQSBJSTQBWLFV-UHFFFAOYSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000104389053	194004102	/nfs/dbraw/zinc/00/41/02/194004102.db2.gz	SCFLAAQEPHPOSU-GFCCVEGCSA-N	1	1	308.382	1.853	20	5		DDBDMO
Cc1c(CN2CCO[C@H]3CC[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000284471383	218040113	/nfs/dbraw/zinc/04/01/13/218040113.db2.gz	AGLHBCNXDNPPAF-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
NC(=O)c1ccc(C[NH2+][C@@H](CO)c2ccsc2)c([N+](=O)[O-])c1	ZINC000352031911	284725935	/nfs/dbraw/zinc/72/59/35/284725935.db2.gz	ICWRVNDSCOBYCM-LBPRGKRZSA-N	1	1	321.358	1.578	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000106393584	194206123	/nfs/dbraw/zinc/20/61/23/194206123.db2.gz	QFSNFDDBEALDDJ-AWEZNQCLSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000285393361	218412933	/nfs/dbraw/zinc/41/29/33/218412933.db2.gz	XGDODKWQKXMXBR-ZIAGYGMSSA-N	1	1	319.361	1.448	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341009067	251334143	/nfs/dbraw/zinc/33/41/43/251334143.db2.gz	AHJGRHFAVIKMMT-DGCLKSJQSA-N	1	1	306.366	1.877	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000341092530	251377306	/nfs/dbraw/zinc/37/73/06/251377306.db2.gz	PTRXHEHILUJWQJ-UHFFFAOYSA-N	1	1	324.381	1.015	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N1CCOCC1)Cc1ccc([N+](=O)[O-])cc1	ZINC000064350583	184295122	/nfs/dbraw/zinc/29/51/22/184295122.db2.gz	DUXQDDPQGAYOOD-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
CC(C)[N@@H+](CC(=O)N1CCOCC1)Cc1ccc([N+](=O)[O-])cc1	ZINC000064350583	184295123	/nfs/dbraw/zinc/29/51/23/184295123.db2.gz	DUXQDDPQGAYOOD-UHFFFAOYSA-N	1	1	321.377	1.664	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[NH2+]C1	ZINC000269159266	207283362	/nfs/dbraw/zinc/28/33/62/207283362.db2.gz	APJHZENUJBSFQX-NXEZZACHSA-N	1	1	317.349	1.589	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000330897542	532958792	/nfs/dbraw/zinc/95/87/92/532958792.db2.gz	MDMUOFJSWFLSLP-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000330897542	532958794	/nfs/dbraw/zinc/95/87/94/532958794.db2.gz	MDMUOFJSWFLSLP-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000157671555	197206513	/nfs/dbraw/zinc/20/65/13/197206513.db2.gz	HAGFAAGAXQUKDO-UHFFFAOYSA-N	1	1	309.366	1.678	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@H]2CCC=CO2)CC1	ZINC000296032885	285166534	/nfs/dbraw/zinc/16/65/34/285166534.db2.gz	OHSYDVYVSNWBPT-CYBMUJFWSA-N	1	1	304.350	1.805	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@]3(CNC(=O)C3)C2)ccc1[N+](=O)[O-]	ZINC000352772213	285290153	/nfs/dbraw/zinc/29/01/53/285290153.db2.gz	QEVFHXTYHQHGJV-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000568646884	304303994	/nfs/dbraw/zinc/30/39/94/304303994.db2.gz	KZWVLHYPJSESNW-GFCCVEGCSA-N	1	1	305.338	1.166	20	5		DDBDMO
CC[N@@H+](CCc1cccs1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266565693	407563486	/nfs/dbraw/zinc/56/34/86/407563486.db2.gz	ZMTXVDMWURRXEI-ZDUSSCGKSA-N	1	1	324.406	1.778	20	5		DDBDMO
C[C@@H](C1CC1)[N@@H+](C)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000073800328	406894995	/nfs/dbraw/zinc/89/49/95/406894995.db2.gz	JKGWGUPBQATVPH-VIFPVBQESA-N	1	1	321.333	1.992	20	5		DDBDMO
CC(C)NC(=O)c1ccc(N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000028707073	406918208	/nfs/dbraw/zinc/91/82/08/406918208.db2.gz	WZAFNTXDEUDYKY-UHFFFAOYSA-N	1	1	306.366	1.485	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000078681595	407041571	/nfs/dbraw/zinc/04/15/71/407041571.db2.gz	JLKGDPUFPAVKKV-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000055209808	407198374	/nfs/dbraw/zinc/19/83/74/407198374.db2.gz	ATSBKNSUSSREGL-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C(C)C	ZINC000102480258	407323575	/nfs/dbraw/zinc/32/35/75/407323575.db2.gz	LAXMNJCQVDLMEJ-UHFFFAOYSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[N@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(C)C	ZINC000102480258	407323576	/nfs/dbraw/zinc/32/35/76/407323576.db2.gz	LAXMNJCQVDLMEJ-UHFFFAOYSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(C)C	ZINC000102480258	407323578	/nfs/dbraw/zinc/32/35/78/407323578.db2.gz	LAXMNJCQVDLMEJ-UHFFFAOYSA-N	1	1	319.365	1.931	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000067706303	407280833	/nfs/dbraw/zinc/28/08/33/407280833.db2.gz	RWKHBHNAMKGTMN-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCOC2)cccc1[N+](=O)[O-]	ZINC000106882098	407365094	/nfs/dbraw/zinc/36/50/94/407365094.db2.gz	IJFCKPXCOALEPL-GFCCVEGCSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCn1cccn1	ZINC000111282448	407406164	/nfs/dbraw/zinc/40/61/64/407406164.db2.gz	QVFIXMKMROGWEP-UHFFFAOYSA-N	1	1	317.349	1.752	20	5		DDBDMO
CC(C)(C)C[N@@H+](CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000112600296	407433090	/nfs/dbraw/zinc/43/30/90/407433090.db2.gz	ICASQUJWJYBPNP-UHFFFAOYSA-N	1	1	309.366	1.534	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000112924239	407447413	/nfs/dbraw/zinc/44/74/13/407447413.db2.gz	SJUBYGVDMPESJT-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C(C)(C)C1	ZINC000270999550	407461685	/nfs/dbraw/zinc/46/16/85/407461685.db2.gz	VTQXHJLJXVVJBA-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000128942471	407584330	/nfs/dbraw/zinc/58/43/30/407584330.db2.gz	CVXOKHYUZUHOFG-HNNXBMFYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C)CC1	ZINC000171261783	407641995	/nfs/dbraw/zinc/64/19/95/407641995.db2.gz	HEPBRGGFCJMTPT-QWHCGFSZSA-N	1	1	320.393	1.408	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)C[C@H]1C	ZINC000267000403	407712261	/nfs/dbraw/zinc/71/22/61/407712261.db2.gz	CTIGMPOTJVZJGK-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
COCC[N@H+](CCc1ccccc1)CCn1ccc([N+](=O)[O-])n1	ZINC000267059756	407733281	/nfs/dbraw/zinc/73/32/81/407733281.db2.gz	IGKUWFXALXYBCH-UHFFFAOYSA-N	1	1	318.377	1.982	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000153576206	407854122	/nfs/dbraw/zinc/85/41/22/407854122.db2.gz	FVEIWOSAOFNYIL-UHFFFAOYSA-N	1	1	303.362	1.964	20	5		DDBDMO
CC[C@@H](C)NC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173473349	407882336	/nfs/dbraw/zinc/88/23/36/407882336.db2.gz	BROSCZJIYGSURI-NEPJUHHUSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[C@@H](C)NC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173473349	407882340	/nfs/dbraw/zinc/88/23/40/407882340.db2.gz	BROSCZJIYGSURI-NEPJUHHUSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2[O-])C1	ZINC000134097449	407885896	/nfs/dbraw/zinc/88/58/96/407885896.db2.gz	JARBIUWBVWXROJ-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000174534919	407959845	/nfs/dbraw/zinc/95/98/45/407959845.db2.gz	IEHDCIOWMCGJID-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCS[C@H]3COCC[C@@H]32)c1	ZINC000154472445	408042661	/nfs/dbraw/zinc/04/26/61/408042661.db2.gz	NVVMKYAMGGBPLV-ZNMIVQPWSA-N	1	1	324.402	1.835	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC000272596231	408001853	/nfs/dbraw/zinc/00/18/53/408001853.db2.gz	IMISXLNLOUTTKI-HZMBPMFUSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cc1nc(NC2CC[NH+](CC(=O)N(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000268487564	408067689	/nfs/dbraw/zinc/06/76/89/408067689.db2.gz	MYGIKDJDTAUBMN-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000182492252	408177832	/nfs/dbraw/zinc/17/78/32/408177832.db2.gz	LZPBWQMQNGGYDP-AVGNSLFASA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269323557	408268275	/nfs/dbraw/zinc/26/82/75/408268275.db2.gz	CEZZPQZTVODQFM-UHFFFAOYSA-N	1	1	306.326	1.376	20	5		DDBDMO
CS[C@@H]1CCCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000246849147	408353369	/nfs/dbraw/zinc/35/33/69/408353369.db2.gz	OZUOWPPISNWEDN-CHWSQXEVSA-N	1	1	314.411	1.370	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H](O)CN1CCOCC1	ZINC000183361200	408391507	/nfs/dbraw/zinc/39/15/07/408391507.db2.gz	RKPFHHMQYKUIEB-INIZCTEOSA-N	1	1	323.393	1.028	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CN(C)C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000177001288	408494899	/nfs/dbraw/zinc/49/48/99/408494899.db2.gz	VOLLBBZBLOSHEZ-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000248450323	408569030	/nfs/dbraw/zinc/56/90/30/408569030.db2.gz	IPDLHFBVUAHXBB-CHWSQXEVSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000248450323	408569035	/nfs/dbraw/zinc/56/90/35/408569035.db2.gz	IPDLHFBVUAHXBB-CHWSQXEVSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@]2(CCOC2)C1	ZINC000248466318	408574227	/nfs/dbraw/zinc/57/42/27/408574227.db2.gz	SEJHFPFMMJRKGZ-XJKSGUPXSA-N	1	1	322.361	1.447	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](C)C[NH+]1CCOCC1	ZINC000192613575	408620031	/nfs/dbraw/zinc/62/00/31/408620031.db2.gz	YWULWQPDIBHADU-LLVKDONJSA-N	1	1	311.386	1.500	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000248858445	408648414	/nfs/dbraw/zinc/64/84/14/408648414.db2.gz	ROBLWIBQQIZFCS-UHTWSYAYSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000248858445	408648416	/nfs/dbraw/zinc/64/84/16/408648416.db2.gz	ROBLWIBQQIZFCS-UHTWSYAYSA-N	1	1	308.338	1.065	20	5		DDBDMO
C[N@H+]1CCCN(c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC1	ZINC000193540405	408725307	/nfs/dbraw/zinc/72/53/07/408725307.db2.gz	PQQULTCLBSJAPP-UHFFFAOYSA-N	1	1	304.350	1.621	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000249512745	408735132	/nfs/dbraw/zinc/73/51/32/408735132.db2.gz	OQOOYPUHRYIPNQ-KGLIPLIRSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]2C1	ZINC000194534627	408786392	/nfs/dbraw/zinc/78/63/92/408786392.db2.gz	FDYSXRWTCDHZCD-TXEJJXNPSA-N	1	1	306.322	1.496	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)cc([N+](=O)[O-])c1	ZINC000285872571	408881169	/nfs/dbraw/zinc/88/11/69/408881169.db2.gz	RLCNJFFXPORUHD-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000276191478	408824829	/nfs/dbraw/zinc/82/48/29/408824829.db2.gz	IHQNGUUENJMOSD-LLVKDONJSA-N	1	1	306.366	1.780	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000286380136	408973863	/nfs/dbraw/zinc/97/38/63/408973863.db2.gz	GQCPNUWKIGOSSU-HIFRSBDPSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C1	ZINC000286392612	408977041	/nfs/dbraw/zinc/97/70/41/408977041.db2.gz	HAZWBTDMWYBFJD-LBPRGKRZSA-N	1	1	321.377	1.987	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCSCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000286443194	408986821	/nfs/dbraw/zinc/98/68/21/408986821.db2.gz	ICGUHKBZQNURLI-UHFFFAOYSA-N	1	1	323.418	1.992	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@]3(CC[N@H+](C)C3)C2)c(N)c([N+](=O)[O-])c1	ZINC000293592319	409144660	/nfs/dbraw/zinc/14/46/60/409144660.db2.gz	BETPJGDQDAICFN-MRXNPFEDSA-N	1	1	318.377	1.653	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CC2)c1	ZINC000283464373	409160812	/nfs/dbraw/zinc/16/08/12/409160812.db2.gz	LWOJRLCICIHLBX-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([N@@H+](C)CCO)[C@H]1C	ZINC000293767552	409176231	/nfs/dbraw/zinc/17/62/31/409176231.db2.gz	VMGBOLQZHBHJHR-IUODEOHRSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cnc(C[NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000295306663	409424673	/nfs/dbraw/zinc/42/46/73/409424673.db2.gz	YDSZIYRQKUTAFV-TZMCWYRMSA-N	1	1	323.374	1.544	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@](C)(C(N)=O)C2)c([N+](=O)[O-])cc1F	ZINC000280742454	409434063	/nfs/dbraw/zinc/43/40/63/409434063.db2.gz	MNIBEGQIPAMNMA-CQSZACIVSA-N	1	1	311.313	1.440	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1	ZINC000295336943	409441029	/nfs/dbraw/zinc/44/10/29/409441029.db2.gz	MJQDJEDTFBHFBF-SNVBAGLBSA-N	1	1	320.349	1.252	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000317768839	164029090	/nfs/dbraw/zinc/02/90/90/164029090.db2.gz	QKAMYUGUZPNYOR-QWHCGFSZSA-N	1	1	307.350	1.879	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(Cc3cc([O-])ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000407999002	164193693	/nfs/dbraw/zinc/19/36/93/164193693.db2.gz	SORWLXFFJBWCFM-HUUCEWRRSA-N	1	1	307.350	1.205	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC000407999002	164193696	/nfs/dbraw/zinc/19/36/96/164193696.db2.gz	SORWLXFFJBWCFM-HUUCEWRRSA-N	1	1	307.350	1.205	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(Cc3cc([O-])ccc3[N+](=O)[O-])[C@H]2C1	ZINC000407999000	164193778	/nfs/dbraw/zinc/19/37/78/164193778.db2.gz	SORWLXFFJBWCFM-GJZGRUSLSA-N	1	1	307.350	1.205	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(Cc3cc(O)ccc3[N+](=O)[O-])[C@H]2C1	ZINC000407999000	164193782	/nfs/dbraw/zinc/19/37/82/164193782.db2.gz	SORWLXFFJBWCFM-GJZGRUSLSA-N	1	1	307.350	1.205	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000408068538	164215568	/nfs/dbraw/zinc/21/55/68/164215568.db2.gz	IONRIVIXBLOTBE-TUAOUCFPSA-N	1	1	321.381	1.795	20	5		DDBDMO
C[C@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000342426599	409619629	/nfs/dbraw/zinc/61/96/29/409619629.db2.gz	DTFOVKLGRMLNDB-UFBFGSQYSA-N	1	1	318.782	1.771	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000331560302	409637858	/nfs/dbraw/zinc/63/78/58/409637858.db2.gz	SXGOMCPNRJYPJA-JTQLQIEISA-N	1	1	305.334	1.570	20	5		DDBDMO
COCCOC[C@H](O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000296851643	409665412	/nfs/dbraw/zinc/66/54/12/409665412.db2.gz	UJZQQMCCVXTDPZ-MRXNPFEDSA-N	1	1	324.377	1.583	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CC[N@@H+](C3CC3)C2)cc1	ZINC000354284112	409748387	/nfs/dbraw/zinc/74/83/87/409748387.db2.gz	WANIICLWZLXUGV-JTQLQIEISA-N	1	1	311.363	1.110	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1	ZINC000354284112	409748393	/nfs/dbraw/zinc/74/83/93/409748393.db2.gz	WANIICLWZLXUGV-JTQLQIEISA-N	1	1	311.363	1.110	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccon1	ZINC000349242780	409760461	/nfs/dbraw/zinc/76/04/61/409760461.db2.gz	PBJQHWWUCIXUMH-QWRGUYRKSA-N	1	1	307.306	1.673	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357052082	409820899	/nfs/dbraw/zinc/82/08/99/409820899.db2.gz	QXMANWCXANSZMM-WDEREUQCSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCC1CCC1	ZINC000338360627	409939843	/nfs/dbraw/zinc/93/98/43/409939843.db2.gz	OPEFUTDWMAOZBS-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NCC1CCC1	ZINC000338360627	409939850	/nfs/dbraw/zinc/93/98/50/409939850.db2.gz	OPEFUTDWMAOZBS-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000332309866	410056644	/nfs/dbraw/zinc/05/66/44/410056644.db2.gz	XCILZTUMELFCTK-CHWSQXEVSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@H]1C[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000357534206	410089133	/nfs/dbraw/zinc/08/91/33/410089133.db2.gz	QSAFVXGTPYHUAP-UWVGGRQHSA-N	1	1	304.350	1.731	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([NH+]3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000354894010	410157014	/nfs/dbraw/zinc/15/70/14/410157014.db2.gz	ZFQNYZGQUPGNJT-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000351923239	410338147	/nfs/dbraw/zinc/33/81/47/410338147.db2.gz	RQVACFLJPPAQGE-ZDUSSCGKSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000351923239	410338159	/nfs/dbraw/zinc/33/81/59/410338159.db2.gz	RQVACFLJPPAQGE-ZDUSSCGKSA-N	1	1	310.350	1.577	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000298688444	410349333	/nfs/dbraw/zinc/34/93/33/410349333.db2.gz	AOOIBJJFZCCCIH-SNVBAGLBSA-N	1	1	324.333	1.702	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N1CC[NH+](C)CC1	ZINC000298945050	410461520	/nfs/dbraw/zinc/46/15/20/410461520.db2.gz	RECCEJZQQQWLBO-UHFFFAOYSA-N	1	1	308.338	1.060	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCC[N@@H+](C)[C@H]1C	ZINC000343457049	410467962	/nfs/dbraw/zinc/46/79/62/410467962.db2.gz	KOYBYCNWNJOCKQ-GWCFXTLKSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000299079986	410512777	/nfs/dbraw/zinc/51/27/77/410512777.db2.gz	HAPSXFFRIPEXDP-WDEREUQCSA-N	1	1	321.381	1.621	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000347387461	410515960	/nfs/dbraw/zinc/51/59/60/410515960.db2.gz	ZWBCDWJGGLZYMM-LTBFUDJGSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN(CCO)[C@@H](C)C1	ZINC000347387461	410515972	/nfs/dbraw/zinc/51/59/72/410515972.db2.gz	ZWBCDWJGGLZYMM-LTBFUDJGSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCN(CCO)[C@@H](C)C1	ZINC000347387461	410515980	/nfs/dbraw/zinc/51/59/80/410515980.db2.gz	ZWBCDWJGGLZYMM-LTBFUDJGSA-N	1	1	319.405	1.997	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291220	410602161	/nfs/dbraw/zinc/60/21/61/410602161.db2.gz	XIRJIPVROBSPNP-IUODEOHRSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291220	410602165	/nfs/dbraw/zinc/60/21/65/410602165.db2.gz	XIRJIPVROBSPNP-IUODEOHRSA-N	1	1	321.377	1.881	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000352228519	410562547	/nfs/dbraw/zinc/56/25/47/410562547.db2.gz	ZYXFCXVOVABRBI-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
Cc1nn(C)c(N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c1[N+](=O)[O-]	ZINC000301306380	410696437	/nfs/dbraw/zinc/69/64/37/410696437.db2.gz	YLVZKVVEICRMFB-LLVKDONJSA-N	1	1	323.397	1.326	20	5		DDBDMO
CS[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@H]1[NH+](C)C	ZINC000330460758	410710040	/nfs/dbraw/zinc/71/00/40/410710040.db2.gz	VZQMDXVCVOLYNS-KGLIPLIRSA-N	1	1	311.407	1.778	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2C(=O)NC)CC1	ZINC000301498907	410731845	/nfs/dbraw/zinc/73/18/45/410731845.db2.gz	CRKDTOULSPPEAT-UHFFFAOYSA-N	1	1	306.366	1.486	20	5		DDBDMO
Cc1ccnc(NC2CC[NH+](CC(=O)N(C)C)CC2)c1[N+](=O)[O-]	ZINC000301269212	410686606	/nfs/dbraw/zinc/68/66/06/410686606.db2.gz	HHDCBAOAADOXGQ-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000330585672	410800323	/nfs/dbraw/zinc/80/03/23/410800323.db2.gz	LMJAWGNPQMDSOE-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CN1C	ZINC000330585672	410800332	/nfs/dbraw/zinc/80/03/32/410800332.db2.gz	LMJAWGNPQMDSOE-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](C)CN1C	ZINC000330585672	410800341	/nfs/dbraw/zinc/80/03/41/410800341.db2.gz	LMJAWGNPQMDSOE-UMVBOHGHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@H]1C[C@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000344121280	410970781	/nfs/dbraw/zinc/97/07/81/410970781.db2.gz	DWVZTYJUKVMUTE-WDEREUQCSA-N	1	1	307.350	1.287	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399672	411009477	/nfs/dbraw/zinc/00/94/77/411009477.db2.gz	YMXCIWFECXCOBX-NEPJUHHUSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356399672	411009483	/nfs/dbraw/zinc/00/94/83/411009483.db2.gz	YMXCIWFECXCOBX-NEPJUHHUSA-N	1	1	305.334	1.657	20	5		DDBDMO
CC1CC[NH+](CC2CCN(C(=O)[C@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000360108660	411049765	/nfs/dbraw/zinc/04/97/65/411049765.db2.gz	XYHZISKHQJGHOX-LSDHHAIUSA-N	1	1	309.410	1.622	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](CN3CCOCC3)C2)cc1	ZINC000129540037	196056153	/nfs/dbraw/zinc/05/61/53/196056153.db2.gz	WDNFHIONDOKXGO-MRXNPFEDSA-N	1	1	319.405	1.791	20	5		DDBDMO
Cc1cc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])no1	ZINC000580251531	422907421	/nfs/dbraw/zinc/90/74/21/422907421.db2.gz	JIMNEPNIYZGRLD-GFCCVEGCSA-N	1	1	307.306	1.421	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000580366537	422923611	/nfs/dbraw/zinc/92/36/11/422923611.db2.gz	HCBOKUKCUWHJBL-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000580366537	422923613	/nfs/dbraw/zinc/92/36/13/422923613.db2.gz	HCBOKUKCUWHJBL-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000516314130	416721170	/nfs/dbraw/zinc/72/11/70/416721170.db2.gz	XHVVEDRPFPUWRR-UWVGGRQHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000516314130	416721173	/nfs/dbraw/zinc/72/11/73/416721173.db2.gz	XHVVEDRPFPUWRR-UWVGGRQHSA-N	1	1	307.354	1.196	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000366333443	418459170	/nfs/dbraw/zinc/45/91/70/418459170.db2.gz	QLABRMUEZBXUPI-ZJUUUORDSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC[C@@H]12	ZINC000366333443	418459174	/nfs/dbraw/zinc/45/91/74/418459174.db2.gz	QLABRMUEZBXUPI-ZJUUUORDSA-N	1	1	323.736	1.343	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000360741656	418505025	/nfs/dbraw/zinc/50/50/25/418505025.db2.gz	XTQYZHSRISIQJK-ZDUSSCGKSA-N	1	1	309.322	1.263	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000360741656	418505028	/nfs/dbraw/zinc/50/50/28/418505028.db2.gz	XTQYZHSRISIQJK-ZDUSSCGKSA-N	1	1	309.322	1.263	20	5		DDBDMO
Cc1[nH+]c(N2CCOCC2)ccc1Nc1ccncc1[N+](=O)[O-]	ZINC000361042218	418572892	/nfs/dbraw/zinc/57/28/92/418572892.db2.gz	JFJILBZJZGLHEN-UHFFFAOYSA-N	1	1	315.333	1.695	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367286108	418578914	/nfs/dbraw/zinc/57/89/14/418578914.db2.gz	IJFREWFZAJCPOX-SNVBAGLBSA-N	1	1	315.276	1.039	20	5		DDBDMO
[NH3+][C@H]1C[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000375250849	418621718	/nfs/dbraw/zinc/62/17/18/418621718.db2.gz	PWBOEISNZFXOGI-ILWJIGKKSA-N	1	1	315.333	1.565	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CCC[N@H+](CCN(C)C)CC1	ZINC000361831913	418715861	/nfs/dbraw/zinc/71/58/61/418715861.db2.gz	XQNMYCRHOCVJFH-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@]3(CC[N@@H+](C)C3)C2)c([N+](=O)[O-])c1	ZINC000368305463	418717369	/nfs/dbraw/zinc/71/73/69/418717369.db2.gz	VZCQDLSTRJNEEB-HNNXBMFYSA-N	1	1	320.349	1.308	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@@H+](CCO)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000361588128	418686926	/nfs/dbraw/zinc/68/69/26/418686926.db2.gz	XQZHCFNGGAAHAH-CZUORRHYSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000361592164	418689127	/nfs/dbraw/zinc/68/91/27/418689127.db2.gz	AGJGJECJMZDLKJ-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000361592164	418689130	/nfs/dbraw/zinc/68/91/30/418689130.db2.gz	AGJGJECJMZDLKJ-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)COc1c(C)cc(C)cc1[N+](=O)[O-]	ZINC000390641835	418754783	/nfs/dbraw/zinc/75/47/83/418754783.db2.gz	SMWIWRSGFXCWGI-CYBMUJFWSA-N	1	1	312.366	1.530	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000364621812	418794824	/nfs/dbraw/zinc/79/48/24/418794824.db2.gz	FBMXTYVBVSNCEX-DCQANWLSSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000364621812	418794826	/nfs/dbraw/zinc/79/48/26/418794826.db2.gz	FBMXTYVBVSNCEX-DCQANWLSSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000364621812	418794828	/nfs/dbraw/zinc/79/48/28/418794828.db2.gz	FBMXTYVBVSNCEX-DCQANWLSSA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000365572348	418877894	/nfs/dbraw/zinc/87/78/94/418877894.db2.gz	LEFMFKBVTJFPDQ-NMKXLXIOSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000365572348	418877895	/nfs/dbraw/zinc/87/78/95/418877895.db2.gz	LEFMFKBVTJFPDQ-NMKXLXIOSA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@H]1c1cccs1	ZINC000365572348	418877898	/nfs/dbraw/zinc/87/78/98/418877898.db2.gz	LEFMFKBVTJFPDQ-NMKXLXIOSA-N	1	1	323.418	1.912	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000425974226	419375766	/nfs/dbraw/zinc/37/57/66/419375766.db2.gz	LGIUCRBQQWZHIJ-MNOVXSKESA-N	1	1	310.350	1.815	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@H](NC(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000420956240	419385221	/nfs/dbraw/zinc/38/52/21/419385221.db2.gz	MVCCUFBUUAUBEJ-ZDUSSCGKSA-N	1	1	307.350	1.704	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](NC(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000420956240	419385223	/nfs/dbraw/zinc/38/52/23/419385223.db2.gz	MVCCUFBUUAUBEJ-ZDUSSCGKSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000426884617	419563028	/nfs/dbraw/zinc/56/30/28/419563028.db2.gz	YWVACVDUXKFUDI-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCC[N@@H+](C)[C@H]1C	ZINC000427058708	419589944	/nfs/dbraw/zinc/58/99/44/419589944.db2.gz	FIPLTUINBOLBGI-GWCFXTLKSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@H]1[C@H](CO)CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079260	419628089	/nfs/dbraw/zinc/62/80/89/419628089.db2.gz	LCOYBTLIODQPGN-STQMWFEESA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1[C@H](CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079260	419628094	/nfs/dbraw/zinc/62/80/94/419628094.db2.gz	LCOYBTLIODQPGN-STQMWFEESA-N	1	1	321.377	1.650	20	5		DDBDMO
CC(C)([NH2+]CC(=O)Nc1ccncc1)c1ccccc1[N+](=O)[O-]	ZINC000429246571	419992601	/nfs/dbraw/zinc/99/26/01/419992601.db2.gz	OKKXCFBEAVHNFB-UHFFFAOYSA-N	1	1	314.345	1.875	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)[C@@H]1C	ZINC000430231957	420091868	/nfs/dbraw/zinc/09/18/68/420091868.db2.gz	DNRHJSRXBUYVDY-MFKMUULPSA-N	1	1	308.334	1.987	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](CN)C1CC1	ZINC000420312957	420200644	/nfs/dbraw/zinc/20/06/44/420200644.db2.gz	JHWRWCLHTCGQOY-AWEZNQCLSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](CN)C1CC1	ZINC000420312957	420200646	/nfs/dbraw/zinc/20/06/46/420200646.db2.gz	JHWRWCLHTCGQOY-AWEZNQCLSA-N	1	1	306.366	1.593	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000420590590	420325459	/nfs/dbraw/zinc/32/54/59/420325459.db2.gz	VUFNGXOBNLBSIO-WDEREUQCSA-N	1	1	304.350	1.732	20	5		DDBDMO
CN1C(=O)NCC12CC[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC2	ZINC000425374472	420366989	/nfs/dbraw/zinc/36/69/89/420366989.db2.gz	RVTWFTSHJWVJDA-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](c2nnc[nH]2)C1	ZINC000425550237	420415967	/nfs/dbraw/zinc/41/59/67/420415967.db2.gz	OTZBVBMXRYQWNI-JTQLQIEISA-N	1	1	303.322	1.711	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)[C@H](C)O1	ZINC000446082135	230232132	/nfs/dbraw/zinc/23/21/32/230232132.db2.gz	OPSKCYWUFPYRPF-OSFYFWSMSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)[C@H](C)O1	ZINC000446082135	230232138	/nfs/dbraw/zinc/23/21/38/230232138.db2.gz	OPSKCYWUFPYRPF-OSFYFWSMSA-N	1	1	324.377	1.832	20	5		DDBDMO
Cc1ccsc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000438781968	420465410	/nfs/dbraw/zinc/46/54/10/420465410.db2.gz	AAUIHMJDCILHFT-LBPRGKRZSA-N	1	1	310.379	1.654	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000457084526	420605724	/nfs/dbraw/zinc/60/57/24/420605724.db2.gz	LOJAIMPTDCJHML-CQSZACIVSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000450952766	420569228	/nfs/dbraw/zinc/56/92/28/420569228.db2.gz	IZHGPEZCRNHPNK-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450958718	420571459	/nfs/dbraw/zinc/57/14/59/420571459.db2.gz	WPLQARPVOZHQEF-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000455879218	421072154	/nfs/dbraw/zinc/07/21/54/421072154.db2.gz	CBBPRZDXJQOUEJ-UWVGGRQHSA-N	1	1	319.365	1.387	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](CC)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000456335168	421144387	/nfs/dbraw/zinc/14/43/87/421144387.db2.gz	AFXTYCWTOUAARU-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](CC)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000456335168	421144392	/nfs/dbraw/zinc/14/43/92/421144392.db2.gz	AFXTYCWTOUAARU-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](CC)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000456335168	421144393	/nfs/dbraw/zinc/14/43/93/421144393.db2.gz	AFXTYCWTOUAARU-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](CC)C[C@H]2CC)c1[N+](=O)[O-]	ZINC000456335168	421144396	/nfs/dbraw/zinc/14/43/96/421144396.db2.gz	AFXTYCWTOUAARU-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2NCCC[NH+]1CCOCC1	ZINC000450208522	421162617	/nfs/dbraw/zinc/16/26/17/421162617.db2.gz	NQGMWAZHPJRMCY-UHFFFAOYSA-N	1	1	316.361	2.277	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000525291757	421284852	/nfs/dbraw/zinc/28/48/52/421284852.db2.gz	PWAZROBVYGLOJA-LBPRGKRZSA-N	1	1	321.377	1.604	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000516490536	421547770	/nfs/dbraw/zinc/54/77/70/421547770.db2.gz	TYMIBVISCYULJZ-LLVKDONJSA-N	1	1	321.381	1.422	20	5		DDBDMO
CC(C)Oc1nc(N[C@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000566867377	421609198	/nfs/dbraw/zinc/60/91/98/421609198.db2.gz	YTQLEYVDLVDROC-NSHDSACASA-N	1	1	317.349	2.400	20	5		DDBDMO
Cc1c(CC(=O)NCC[N@@H+]2CC[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000533497593	421675852	/nfs/dbraw/zinc/67/58/52/421675852.db2.gz	ZJUCRESSNMQLHR-GFCCVEGCSA-N	1	1	305.378	1.904	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000537814632	421736480	/nfs/dbraw/zinc/73/64/80/421736480.db2.gz	FXYBWTMIMGMJGL-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000537814632	421736486	/nfs/dbraw/zinc/73/64/86/421736486.db2.gz	FXYBWTMIMGMJGL-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H](C)C[NH+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000573697417	422003441	/nfs/dbraw/zinc/00/34/41/422003441.db2.gz	SWTQUTIBHGJOJS-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000574500041	422119839	/nfs/dbraw/zinc/11/98/39/422119839.db2.gz	NYICHXTWTHTGKZ-UHFFFAOYSA-N	1	1	312.345	1.412	20	5		DDBDMO
Nc1nccc(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594418493	422347559	/nfs/dbraw/zinc/34/75/59/422347559.db2.gz	JMOKFPHYETVWSR-RYUDHWBXSA-N	1	1	319.365	1.319	20	5		DDBDMO
CCN(C(=O)c1ccnc(NC)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000598038606	422393445	/nfs/dbraw/zinc/39/34/45/422393445.db2.gz	FCMPLJQRGHXUOY-LLVKDONJSA-N	1	1	321.381	1.588	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])ccc2=O)on1	ZINC000341609220	271138886	/nfs/dbraw/zinc/13/88/86/271138886.db2.gz	SBVDFSCDBOMGRX-ZDUSSCGKSA-N	1	1	318.333	1.890	20	5		DDBDMO
Cc1cc([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)on1	ZINC000341609220	271138890	/nfs/dbraw/zinc/13/88/90/271138890.db2.gz	SBVDFSCDBOMGRX-ZDUSSCGKSA-N	1	1	318.333	1.890	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000344621519	272072278	/nfs/dbraw/zinc/07/22/78/272072278.db2.gz	SWJUAFZLFKQCJF-GFCCVEGCSA-N	1	1	321.381	1.422	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000345282723	272208379	/nfs/dbraw/zinc/20/83/79/272208379.db2.gz	GQZPHLHXPBGOES-ZJUUUORDSA-N	1	1	309.370	1.483	20	5		DDBDMO
COC(=O)c1cc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc(C)c1[N+](=O)[O-]	ZINC000278820225	274000556	/nfs/dbraw/zinc/00/05/56/274000556.db2.gz	TWFHHXAKGHEMSW-TXEJJXNPSA-N	1	1	319.361	1.688	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ccc([N+](=O)[O-])c(C)n2)C[C@@H]1C	ZINC000131934528	274034756	/nfs/dbraw/zinc/03/47/56/274034756.db2.gz	YJLDOBKMMRLHAQ-TXEJJXNPSA-N	1	1	308.382	1.844	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[NH2+]1	ZINC000262955597	274391987	/nfs/dbraw/zinc/39/19/87/274391987.db2.gz	VXTYATDEVFZRAL-BDAKNGLRSA-N	1	1	303.322	1.341	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000455035448	276011278	/nfs/dbraw/zinc/01/12/78/276011278.db2.gz	HGCYSIHLMZFIRV-NSHDSACASA-N	1	1	307.354	1.408	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(=O)NC)C1	ZINC000175221364	276376600	/nfs/dbraw/zinc/37/66/00/276376600.db2.gz	CZJCLYVWZDLIJD-GFCCVEGCSA-N	1	1	321.377	1.952	20	5		DDBDMO
CN1CCNC[C@@H]1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423517860	277116189	/nfs/dbraw/zinc/11/61/89/277116189.db2.gz	OJFZKFMBVPZIDI-ZBFHGGJFSA-N	1	1	304.394	1.465	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N(C)Cc1ccccc1[N+](=O)[O-]	ZINC000171210517	277212256	/nfs/dbraw/zinc/21/22/56/277212256.db2.gz	QDXNXHSOBUHOOO-UHFFFAOYSA-N	1	1	324.381	1.314	20	5		DDBDMO
C[C@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000247560919	289354058	/nfs/dbraw/zinc/35/40/58/289354058.db2.gz	RUTCSOCQJFSGIP-GRYCIOLGSA-N	1	1	309.370	1.169	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)C1=CC[N@@H+](C)CC1	ZINC000357911253	299018110	/nfs/dbraw/zinc/01/81/10/299018110.db2.gz	ROWSDEGPZZIVCY-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000368578521	301056645	/nfs/dbraw/zinc/05/66/45/301056645.db2.gz	NXAYONWCSCISKM-JTQLQIEISA-N	1	1	321.333	1.159	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N[C@H]1CC[N@@H+](CCN2CCOCC2)C1	ZINC000369349358	301169245	/nfs/dbraw/zinc/16/92/45/301169245.db2.gz	YQKXCEHRKWQMKS-AWEZNQCLSA-N	1	1	320.393	1.413	20	5		DDBDMO
COC(=O)CN1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000363567865	307031642	/nfs/dbraw/zinc/03/16/42/307031642.db2.gz	KQSPWDKHUILKOL-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COC(=O)CN1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC000363567865	307031643	/nfs/dbraw/zinc/03/16/43/307031643.db2.gz	KQSPWDKHUILKOL-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369017392	307114414	/nfs/dbraw/zinc/11/44/14/307114414.db2.gz	OIDFLILIDQXYMR-KGLIPLIRSA-N	1	1	307.398	1.913	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373938681	307198160	/nfs/dbraw/zinc/19/81/60/307198160.db2.gz	OGZYIQHHQBBERN-OLZOCXBDSA-N	1	1	319.361	1.717	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920465	307233078	/nfs/dbraw/zinc/23/30/78/307233078.db2.gz	NRMMBEIURUTKPK-YRGRVCCFSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[C@H]1OCC[C@@]12C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920465	307233079	/nfs/dbraw/zinc/23/30/79/307233079.db2.gz	NRMMBEIURUTKPK-YRGRVCCFSA-N	1	1	310.354	1.060	20	5		DDBDMO
CC[NH2+]CCCN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000571991801	308207417	/nfs/dbraw/zinc/20/74/17/308207417.db2.gz	WIUHMUMYSFGFCB-GFCCVEGCSA-N	1	1	308.382	1.901	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000577101047	308362928	/nfs/dbraw/zinc/36/29/28/308362928.db2.gz	UVGUXUJVGCOSMU-GFCCVEGCSA-N	1	1	316.361	1.687	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c(C)cc1[N+](=O)[O-]	ZINC000582736759	337128015	/nfs/dbraw/zinc/12/80/15/337128015.db2.gz	HSMXCNYHNBIMEF-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000582961068	337218955	/nfs/dbraw/zinc/21/89/55/337218955.db2.gz	NAGWPXJPPUBOJV-NSHDSACASA-N	1	1	303.366	1.997	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1F	ZINC000590767508	483927350	/nfs/dbraw/zinc/92/73/50/483927350.db2.gz	ILGYEBQLIKQDOU-NOZJJQNGSA-N	1	1	323.324	1.519	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000331338432	534446674	/nfs/dbraw/zinc/44/66/74/534446674.db2.gz	JMEIXTJWSHQKBG-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CN(C)[C@@H](C)C[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000331338432	534446684	/nfs/dbraw/zinc/44/66/84/534446684.db2.gz	JMEIXTJWSHQKBG-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CN(C)[C@@H](C)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000331338432	534446687	/nfs/dbraw/zinc/44/66/87/534446687.db2.gz	JMEIXTJWSHQKBG-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC(C)(CO)CO	ZINC000182247049	523274238	/nfs/dbraw/zinc/27/42/38/523274238.db2.gz	ADQJHGDDHOEHLB-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC(C)(CO)CO	ZINC000182247049	523274246	/nfs/dbraw/zinc/27/42/46/523274246.db2.gz	ADQJHGDDHOEHLB-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000491423261	534772879	/nfs/dbraw/zinc/77/28/79/534772879.db2.gz	YZIBXOKVDJNITI-SREVYHEPSA-N	1	1	300.318	1.929	20	5		DDBDMO
[NH3+]C[C@H]1CCCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000158397044	527232210	/nfs/dbraw/zinc/23/22/10/527232210.db2.gz	AHWGPOIKBLMUSP-SKDRFNHKSA-N	1	1	317.349	1.718	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N2CCC[N@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000020479220	696070940	/nfs/dbraw/zinc/07/09/40/696070940.db2.gz	JRHCGTRGJFSPAN-UHFFFAOYSA-N	1	1	322.321	1.589	20	5		DDBDMO
Cc1ccncc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000983650498	697286458	/nfs/dbraw/zinc/28/64/58/697286458.db2.gz	UZGLPFNSLALPAY-NMFUWQPSSA-N	1	1	318.377	1.040	20	5		DDBDMO
Cc1c[nH+]ccc1OC1CCN(Cn2nccc2[N+](=O)[O-])CC1	ZINC000773336973	697747052	/nfs/dbraw/zinc/74/70/52/697747052.db2.gz	CPMCEDLBIZLQMD-UHFFFAOYSA-N	1	1	317.349	1.996	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H]1C	ZINC000787247957	699199907	/nfs/dbraw/zinc/19/99/07/699199907.db2.gz	VTIRFWYJRVRZCZ-MFKMUULPSA-N	1	1	318.333	1.785	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H]1C	ZINC000787247957	699199910	/nfs/dbraw/zinc/19/99/10/699199910.db2.gz	VTIRFWYJRVRZCZ-MFKMUULPSA-N	1	1	318.333	1.785	20	5		DDBDMO
C[N@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1	ZINC000726584971	699369238	/nfs/dbraw/zinc/36/92/38/699369238.db2.gz	NKDRNWLBKWJLAE-UHFFFAOYSA-N	1	1	304.306	1.415	20	5		DDBDMO
C[N@@H+](CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O)C1CC1	ZINC000726584971	699369241	/nfs/dbraw/zinc/36/92/41/699369241.db2.gz	NKDRNWLBKWJLAE-UHFFFAOYSA-N	1	1	304.306	1.415	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000789334033	699378217	/nfs/dbraw/zinc/37/82/17/699378217.db2.gz	FUTRFFVAIWCMTP-CZUORRHYSA-N	1	1	323.393	1.281	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC000744800166	699961313	/nfs/dbraw/zinc/96/13/13/699961313.db2.gz	UIPAULPENBVXKW-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000801886564	700350737	/nfs/dbraw/zinc/35/07/37/700350737.db2.gz	CGFKTDKECKPRNX-SNVBAGLBSA-N	1	1	322.340	1.530	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N1CC[NH+](C2CCC2)CC1	ZINC000801899176	700351541	/nfs/dbraw/zinc/35/15/41/700351541.db2.gz	MEJVHKMGDNUOHB-UHFFFAOYSA-N	1	1	322.340	1.626	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000762720667	700904660	/nfs/dbraw/zinc/90/46/60/700904660.db2.gz	YPCWMVQWVDHTRT-YHVDPYDOSA-N	1	1	319.361	1.181	20	5		DDBDMO
COc1cc(NC[C@@]2(O)CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000762817209	700908454	/nfs/dbraw/zinc/90/84/54/700908454.db2.gz	ZACHRROYHAFNEF-AWEZNQCLSA-N	1	1	311.338	1.091	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+]Cc2occc2Br)c1	ZINC000769423518	701244389	/nfs/dbraw/zinc/24/43/89/701244389.db2.gz	LUQJHDPZYZWIMZ-UHFFFAOYSA-N	1	1	315.127	1.937	20	5		DDBDMO
C[C@H](CO)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000839596234	701749157	/nfs/dbraw/zinc/74/91/57/701749157.db2.gz	TZLZOHLIRKHOCH-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](CO)[N@@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000839596234	701749163	/nfs/dbraw/zinc/74/91/63/701749163.db2.gz	TZLZOHLIRKHOCH-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839718436	701796136	/nfs/dbraw/zinc/79/61/36/701796136.db2.gz	POWFVVJUBHXFIP-WMHQRMGPSA-N	1	1	317.389	1.773	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2C)C1	ZINC000879214394	706616622	/nfs/dbraw/zinc/61/66/22/706616622.db2.gz	QSVROAPUFFUICX-RYUDHWBXSA-N	1	1	319.365	1.278	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCCO1	ZINC000867949631	701848553	/nfs/dbraw/zinc/84/85/53/701848553.db2.gz	FGTPOUYGZBHEJE-ABAIWWIYSA-N	1	1	307.350	1.406	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CC[C@]2(CCOC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000867956013	701852493	/nfs/dbraw/zinc/85/24/93/701852493.db2.gz	JRGPGFAYQNYDMO-HOTGVXAUSA-N	1	1	319.361	1.408	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCOC(C)(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867960559	701855649	/nfs/dbraw/zinc/85/56/49/701855649.db2.gz	MUJYPLABZPQWTE-HNNXBMFYSA-N	1	1	307.350	1.406	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@](O)(C(F)F)C2)cc1	ZINC000831175545	706650463	/nfs/dbraw/zinc/65/04/63/706650463.db2.gz	LMYQXBGVAGAOLT-YPMHNXCESA-N	1	1	302.277	1.330	20	5		DDBDMO
CNC(=O)NC[C@@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000879333678	706652853	/nfs/dbraw/zinc/65/28/53/706652853.db2.gz	CMRHQRZYCXRUOO-HNNXBMFYSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@@H]3CCC[NH2+]C3)CC2)cc1	ZINC000841041628	702320221	/nfs/dbraw/zinc/32/02/21/702320221.db2.gz	BRYSXVCUNJOPQD-CQSZACIVSA-N	1	1	304.394	1.905	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000842047197	702663325	/nfs/dbraw/zinc/66/33/25/702663325.db2.gz	MISZGXMZKAQFID-NEPJUHHUSA-N	1	1	319.365	1.134	20	5		DDBDMO
CCN(OC)C(=O)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000842769891	702771025	/nfs/dbraw/zinc/77/10/25/702771025.db2.gz	YHBJRROJPXCREX-UHFFFAOYSA-N	1	1	301.730	1.748	20	5		DDBDMO
C[NH2+]C[C@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843349230	702864064	/nfs/dbraw/zinc/86/40/64/702864064.db2.gz	NLQKJMDMLCBADG-LLVKDONJSA-N	1	1	324.356	1.604	20	5		DDBDMO
CCCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@H]1CC[N@@H+](C)C1	ZINC000843990264	702950014	/nfs/dbraw/zinc/95/00/14/702950014.db2.gz	SSRVTIFMSFBWKJ-JTQLQIEISA-N	1	1	307.354	1.128	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000845514096	703166521	/nfs/dbraw/zinc/16/65/21/703166521.db2.gz	DMSFRLPRSOQXKJ-SECBINFHSA-N	1	1	315.732	1.908	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(Cl)cc1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000845514096	703166523	/nfs/dbraw/zinc/16/65/23/703166523.db2.gz	DMSFRLPRSOQXKJ-SECBINFHSA-N	1	1	315.732	1.908	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC([N@H+]3CC[C@@H](O)C3)C2)cc1Cl	ZINC000846067751	703233529	/nfs/dbraw/zinc/23/35/29/703233529.db2.gz	KGRSJEQVBVCPLK-GFCCVEGCSA-N	1	1	311.769	1.499	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000848790412	703589690	/nfs/dbraw/zinc/58/96/90/703589690.db2.gz	MOKNJOJQUUNCBP-LLVKDONJSA-N	1	1	322.365	1.992	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])s2)C1	ZINC000869786222	703853503	/nfs/dbraw/zinc/85/35/03/703853503.db2.gz	XIRMCQQNKNHSRH-VIFPVBQESA-N	1	1	313.379	1.231	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000852498156	704063468	/nfs/dbraw/zinc/06/34/68/704063468.db2.gz	ZSNVSCGAGKAOQS-GXFFZTMASA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000852498156	704063470	/nfs/dbraw/zinc/06/34/70/704063470.db2.gz	ZSNVSCGAGKAOQS-GXFFZTMASA-N	1	1	307.325	1.834	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])cnc1N)[C@@H]1CC[N@@H+](CC)C1	ZINC000855491167	704487506	/nfs/dbraw/zinc/48/75/06/704487506.db2.gz	PFVCDGSTDZZMED-SNVBAGLBSA-N	1	1	307.354	1.128	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000880424638	706970013	/nfs/dbraw/zinc/97/00/13/706970013.db2.gz	JQTHRXHCUKVXBF-LSDHHAIUSA-N	1	1	310.350	1.709	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000861345107	705436690	/nfs/dbraw/zinc/43/66/90/705436690.db2.gz	YWBYYBNHHFWONT-HZMBPMFUSA-N	1	1	311.338	1.199	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825118402	705603890	/nfs/dbraw/zinc/60/38/90/705603890.db2.gz	SMTZNJCTSZGBEJ-QLFBSQMISA-N	1	1	319.361	1.371	20	5		DDBDMO
Cc1ccc(CNC(=O)C[N@H+](C)[C@@H]2CCSC2)cc1[N+](=O)[O-]	ZINC000825648659	705709092	/nfs/dbraw/zinc/70/90/92/705709092.db2.gz	WZRFESVFCFFVAD-CYBMUJFWSA-N	1	1	323.418	1.957	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825776606	705729897	/nfs/dbraw/zinc/72/98/97/705729897.db2.gz	JUIRMXGUFHTWHE-ZFWWWQNUSA-N	1	1	319.361	1.229	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827264775	705963314	/nfs/dbraw/zinc/96/33/14/705963314.db2.gz	DOTUQMFNNVMITF-AAEUAGOBSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)CC[C@@H]21	ZINC000827328216	705976126	/nfs/dbraw/zinc/97/61/26/705976126.db2.gz	DFQWIIHZFAYDNH-AAEUAGOBSA-N	1	1	321.381	1.079	20	5		DDBDMO
C[C@@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C	ZINC000878317611	706356827	/nfs/dbraw/zinc/35/68/27/706356827.db2.gz	RXYOXFPOZPTTOU-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
C[C@@H]1CN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[N@H+]1C	ZINC000878317611	706356829	/nfs/dbraw/zinc/35/68/29/706356829.db2.gz	RXYOXFPOZPTTOU-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](C2(C)OCCO2)C1	ZINC000878406888	706379697	/nfs/dbraw/zinc/37/96/97/706379697.db2.gz	FWJCGXXYZJUEEL-ZDUSSCGKSA-N	1	1	324.381	1.575	20	5		DDBDMO
CO[C@H]1COCC[C@H]1[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000880428826	706972634	/nfs/dbraw/zinc/97/26/34/706972634.db2.gz	SLXGGNNUNXYSAF-CABCVRRESA-N	1	1	310.350	1.709	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000837187655	707593510	/nfs/dbraw/zinc/59/35/10/707593510.db2.gz	AWXNEKKIGZBJAS-HUUCEWRRSA-N	1	1	321.377	1.569	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872772271	707593566	/nfs/dbraw/zinc/59/35/66/707593566.db2.gz	SABRUXSAYONFRD-NSHDSACASA-N	1	1	320.353	1.160	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872772271	707593569	/nfs/dbraw/zinc/59/35/69/707593569.db2.gz	SABRUXSAYONFRD-NSHDSACASA-N	1	1	320.353	1.160	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000882481048	707651475	/nfs/dbraw/zinc/65/14/75/707651475.db2.gz	DGMKUKZYXRHYAG-LBPRGKRZSA-N	1	1	309.391	1.897	20	5		DDBDMO
Cc1ccc(CN[C@@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1[N+](=O)[O-]	ZINC000873251847	707786167	/nfs/dbraw/zinc/78/61/67/707786167.db2.gz	LVJODEQCTFBPRN-HOTGVXAUSA-N	1	1	305.378	1.760	20	5		DDBDMO
Cc1cc(C(=O)NCC[C@@H]2CCC[N@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000838145138	707854395	/nfs/dbraw/zinc/85/43/95/707854395.db2.gz	VHZMXFXUDSXNGC-LBPRGKRZSA-N	1	1	320.393	1.947	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000883182711	707949907	/nfs/dbraw/zinc/94/99/07/707949907.db2.gz	JEFHYEAXZUUXRY-AWEZNQCLSA-N	1	1	306.366	1.531	20	5		DDBDMO
Cc1cc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897222102	708259559	/nfs/dbraw/zinc/25/95/59/708259559.db2.gz	RPKBHMHOVNLVHC-CVEARBPZSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[C@@](O)(C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)C(F)F	ZINC000885949104	708669191	/nfs/dbraw/zinc/66/91/91/708669191.db2.gz	OIIMENURJOJQNY-CQSZACIVSA-N	1	1	315.320	1.733	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000886591279	708784135	/nfs/dbraw/zinc/78/41/35/708784135.db2.gz	QCBPNDGFODZLEX-LBPRGKRZSA-N	1	1	308.382	1.736	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000886591279	708784137	/nfs/dbraw/zinc/78/41/37/708784137.db2.gz	QCBPNDGFODZLEX-LBPRGKRZSA-N	1	1	308.382	1.736	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000900812300	709773559	/nfs/dbraw/zinc/77/35/59/709773559.db2.gz	UVXVWWDWHOUBEI-OCCSQVGLSA-N	1	1	320.393	1.267	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000891674213	710263215	/nfs/dbraw/zinc/26/32/15/710263215.db2.gz	FYWWGKNWMNLPQK-TXEJJXNPSA-N	1	1	324.381	1.910	20	5		DDBDMO
CC(C)[C@H](CNc1c([N+](=O)[O-])cnn1C)N1CC[NH+](C)CC1	ZINC000891681526	710265268	/nfs/dbraw/zinc/26/52/68/710265268.db2.gz	VYXNXLMCRPVRRD-LBPRGKRZSA-N	1	1	310.402	1.012	20	5		DDBDMO
CN(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1CCC[N@@H+](C)C1	ZINC000892419060	710434339	/nfs/dbraw/zinc/43/43/39/710434339.db2.gz	YNBSXOWWPRHVPY-AWEZNQCLSA-N	1	1	306.366	1.830	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000913288606	713192164	/nfs/dbraw/zinc/19/21/64/713192164.db2.gz	FLADYISAEAXMBG-GASCZTMLSA-N	1	1	321.381	1.051	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2c[nH]c3cccc([N+](=O)[O-])c23)CC[N@H+]1C	ZINC000928439692	713196534	/nfs/dbraw/zinc/19/65/34/713196534.db2.gz	JVQKRKDKVNHQOG-MWLCHTKSSA-N	1	1	302.334	1.899	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000928451248	713202431	/nfs/dbraw/zinc/20/24/31/713202431.db2.gz	VIRSIIPMANSJNQ-ZYHUDNBSSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@H]1CC[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317498	711095981	/nfs/dbraw/zinc/09/59/81/711095981.db2.gz	LRRAXEWTSGNXDW-CABCVRRESA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@H]1CC[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317498	711095984	/nfs/dbraw/zinc/09/59/84/711095984.db2.gz	LRRAXEWTSGNXDW-CABCVRRESA-N	1	1	315.377	1.711	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1nc2ccccc2cc1[N+](=O)[O-]	ZINC000894590541	711198376	/nfs/dbraw/zinc/19/83/76/711198376.db2.gz	HLBFGQXRRBVJEW-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NCc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC000895438342	711512410	/nfs/dbraw/zinc/51/24/10/711512410.db2.gz	PFGYUVDKWMOPPQ-GFCCVEGCSA-N	1	1	309.366	1.883	20	5		DDBDMO
CCCN1CC[C@@H]([NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC000895438342	711512412	/nfs/dbraw/zinc/51/24/12/711512412.db2.gz	PFGYUVDKWMOPPQ-GFCCVEGCSA-N	1	1	309.366	1.883	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000895709029	711584961	/nfs/dbraw/zinc/58/49/61/711584961.db2.gz	XWXIMQXMKJXXKP-CSPWOOARSA-N	1	1	306.318	1.218	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000895709029	711584962	/nfs/dbraw/zinc/58/49/62/711584962.db2.gz	XWXIMQXMKJXXKP-CSPWOOARSA-N	1	1	306.318	1.218	20	5		DDBDMO
C[C@H](NC(=O)C1CN(C)CC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000907220867	712515711	/nfs/dbraw/zinc/51/57/11/712515711.db2.gz	LOQINPUUOFGZEF-LBPRGKRZSA-N	1	1	320.393	1.265	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C1C[NH+]([C@@H]2CCOC2)C1	ZINC000908268226	712724928	/nfs/dbraw/zinc/72/49/28/712724928.db2.gz	MKSRLDMSBHRVMF-CYBMUJFWSA-N	1	1	319.361	1.871	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCCC[N@@H+]1CCCC[C@@H]1C	ZINC000929399844	713604023	/nfs/dbraw/zinc/60/40/23/713604023.db2.gz	VVSCVUFZJXBRLW-LBPRGKRZSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1c(CNC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000922167842	713980983	/nfs/dbraw/zinc/98/09/83/713980983.db2.gz	GYRKRBHXFFHQOL-YPMHNXCESA-N	1	1	306.366	1.795	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@H]2[C@H](CCC[N@H+]2CC[N+](=O)[O-])C1	ZINC000931564209	714129062	/nfs/dbraw/zinc/12/90/62/714129062.db2.gz	VINJQZMPGZQNOI-OLZOCXBDSA-N	1	1	313.398	1.985	20	5		DDBDMO
O=C1N[C@H](C2CC[NH+](Cc3csc([N+](=O)[O-])c3)CC2)CO1	ZINC000932779713	714412230	/nfs/dbraw/zinc/41/22/30/714412230.db2.gz	BKRFMGDTFBCPJF-NSHDSACASA-N	1	1	311.363	1.977	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000934252390	714774628	/nfs/dbraw/zinc/77/46/28/714774628.db2.gz	MOODQSACGBAKRJ-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@@H]2[C@@H]1CCCN2CCO	ZINC000934252390	714774631	/nfs/dbraw/zinc/77/46/31/714774631.db2.gz	MOODQSACGBAKRJ-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H]2[C@@H]1CCCN2CCO	ZINC000934252390	714774633	/nfs/dbraw/zinc/77/46/33/714774633.db2.gz	MOODQSACGBAKRJ-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[N@@H+](C)[C@H]1C	ZINC000925309430	714803374	/nfs/dbraw/zinc/80/33/74/714803374.db2.gz	ZYLBKTMLDMCLLC-GXSJLCMTSA-N	1	1	308.338	1.818	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000925345679	714822615	/nfs/dbraw/zinc/82/26/15/714822615.db2.gz	XRTKDYAZUDWVDN-SWLSCSKDSA-N	1	1	320.393	1.871	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H]1CCC[N@H+](C(C)C)C1	ZINC000935431358	715053497	/nfs/dbraw/zinc/05/34/97/715053497.db2.gz	ZTUHQBPIXHXYKB-GFCCVEGCSA-N	1	1	309.370	1.089	20	5		DDBDMO
Cc1cnc(N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922022	721849592	/nfs/dbraw/zinc/84/95/92/721849592.db2.gz	PQLPXMCEHCNYNH-ZIAGYGMSSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1cnc(N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922022	721849594	/nfs/dbraw/zinc/84/95/94/721849594.db2.gz	PQLPXMCEHCNYNH-ZIAGYGMSSA-N	1	1	319.409	1.513	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3CCCCC3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025777631	736849704	/nfs/dbraw/zinc/84/97/04/736849704.db2.gz	NVXQSIIFAQSUGX-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CC3CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025777631	736849706	/nfs/dbraw/zinc/84/97/06/736849706.db2.gz	NVXQSIIFAQSUGX-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CC3CCCCC3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025777631	736849712	/nfs/dbraw/zinc/84/97/12/736849712.db2.gz	NVXQSIIFAQSUGX-QMIVOQANSA-N	1	1	307.394	1.278	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ccccc1[N+](=O)[O-]	ZINC001101757120	741928295	/nfs/dbraw/zinc/92/82/95/741928295.db2.gz	ZZCDQDZXYQJLHR-UHFFFAOYSA-N	1	1	308.382	1.807	20	5		DDBDMO
O=C(NCc1ccc(C[NH2+]CC2CC2)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034816314	750916652	/nfs/dbraw/zinc/91/66/52/750916652.db2.gz	MMDMRVPIGVKTQY-HUUCEWRRSA-N	1	1	303.362	1.468	20	5		DDBDMO
CC(C)C[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2	ZINC001035187210	751287509	/nfs/dbraw/zinc/28/75/09/751287509.db2.gz	QHRCXCLAWWSQCO-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)C[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035187210	751287512	/nfs/dbraw/zinc/28/75/12/751287512.db2.gz	QHRCXCLAWWSQCO-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)C[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035187210	751287513	/nfs/dbraw/zinc/28/75/13/751287513.db2.gz	QHRCXCLAWWSQCO-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169035719	762191701	/nfs/dbraw/zinc/19/17/01/762191701.db2.gz	LGZDZDYTFSIANP-YHQUGGNUSA-N	1	1	312.366	1.084	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169035719	762191703	/nfs/dbraw/zinc/19/17/03/762191703.db2.gz	LGZDZDYTFSIANP-YHQUGGNUSA-N	1	1	312.366	1.084	20	5		DDBDMO
O=C(c1cccs1)N1CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169039586	762193401	/nfs/dbraw/zinc/19/34/01/762193401.db2.gz	RCRAUJOLVYRIKH-STQMWFEESA-N	1	1	323.418	1.951	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169057456	762211356	/nfs/dbraw/zinc/21/13/56/762211356.db2.gz	VKUNMPJXBZNVAU-RWMBFGLXSA-N	1	1	322.365	1.384	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(CNC(=O)C2CC2)CC1	ZINC001001102959	762552194	/nfs/dbraw/zinc/55/21/94/762552194.db2.gz	QZGQGMNDMJRRCZ-UHFFFAOYSA-N	1	1	321.381	1.067	20	5		DDBDMO
O=C(NC1(C2CC[NH+](CC3CCC3)CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000149395	761542655	/nfs/dbraw/zinc/54/26/55/761542655.db2.gz	LJBFFJOIAIYDET-HUUCEWRRSA-N	1	1	321.421	1.813	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001048525211	769493056	/nfs/dbraw/zinc/49/30/56/769493056.db2.gz	OZAXQKPFVKMCJZ-XLWJZTARSA-N	1	1	307.394	1.421	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048525211	769493064	/nfs/dbraw/zinc/49/30/64/769493064.db2.gz	OZAXQKPFVKMCJZ-XLWJZTARSA-N	1	1	307.394	1.421	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048525211	769493067	/nfs/dbraw/zinc/49/30/67/769493067.db2.gz	OZAXQKPFVKMCJZ-XLWJZTARSA-N	1	1	307.394	1.421	20	5		DDBDMO
CSc1nc(Cl)c([N+](=O)[O-])c(N2CC3(C2)C[NH+](C)C3)n1	ZINC001158863545	769843169	/nfs/dbraw/zinc/84/31/69/769843169.db2.gz	DDXMBOAATCAUCY-UHFFFAOYSA-N	1	1	315.786	1.512	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1cc(C)ccc1[N+](=O)[O-]	ZINC001093787365	775078469	/nfs/dbraw/zinc/07/84/69/775078469.db2.gz	AUGKUPLRRQKSIW-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
Cc1ccc(NCCNC(=O)C[N@H+](C)C2CCC2)c([N+](=O)[O-])c1	ZINC001094221570	775544131	/nfs/dbraw/zinc/54/41/31/775544131.db2.gz	HBUPGRSDDUECDG-UHFFFAOYSA-N	1	1	320.393	1.916	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001100240904	775878719	/nfs/dbraw/zinc/87/87/19/775878719.db2.gz	VCYPDHGUINQXJV-UHFFFAOYSA-N	1	1	317.349	1.352	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N(C)CCNc1ccccc1[N+](=O)[O-]	ZINC001101634621	777331311	/nfs/dbraw/zinc/33/13/11/777331311.db2.gz	FXPANQZSIYGNDI-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
CN(CC[NH2+]Cc1cc(F)cc(F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267371780	837934277	/nfs/dbraw/zinc/93/42/77/837934277.db2.gz	UQXQOYKZUXXGDL-CHWSQXEVSA-N	1	1	313.304	1.178	20	5		DDBDMO
Cc1noc([C@]23COC[C@H]2C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C3)n1	ZINC001169019995	850518215	/nfs/dbraw/zinc/51/82/15/850518215.db2.gz	HMMQDZCPHPEFHA-KYEXWDHISA-N	1	1	322.365	1.023	20	5		DDBDMO
COC(=O)c1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)cc([N+](=O)[O-])c1	ZINC001155892646	862535943	/nfs/dbraw/zinc/53/59/43/862535943.db2.gz	KSKAISRNXXEDDA-NOZJJQNGSA-N	1	1	321.333	1.204	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc(-c2ccc([N+](=O)[O-])cc2)nn1	ZINC001156624111	863202327	/nfs/dbraw/zinc/20/23/27/863202327.db2.gz	RKUCSKNEXFJTPZ-UHFFFAOYSA-N	1	1	323.316	1.176	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3cc([N+](=O)[O-])cc(Cl)[n+]3[O-])C[C@@H]21	ZINC001157271048	863700682	/nfs/dbraw/zinc/70/06/82/863700682.db2.gz	HGXSPGPUIWXBTK-ONGXEEELSA-N	1	1	312.757	1.412	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@](O)(C3CC3)C2)c1	ZINC001329584583	863738851	/nfs/dbraw/zinc/73/88/51/863738851.db2.gz	VKKATKDRCDDAAW-MRXNPFEDSA-N	1	1	320.345	1.728	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@H]2COCCO2)ncc1[N+](=O)[O-]	ZINC001157483662	863860102	/nfs/dbraw/zinc/86/01/02/863860102.db2.gz	SNCXYKPNWVVWGZ-PCAWENJQSA-N	1	1	308.338	1.349	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157766939	864115149	/nfs/dbraw/zinc/11/51/49/864115149.db2.gz	CEWARSZLYHEFBX-CHWSQXEVSA-N	1	1	311.769	1.601	20	5		DDBDMO
COc1ccc(C)cc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775571	864131141	/nfs/dbraw/zinc/13/11/41/864131141.db2.gz	QXRXFQQDZRJMRT-ZIAGYGMSSA-N	1	1	321.377	1.265	20	5		DDBDMO
C[NH+]1CCC(CN2CCN(c3cc([N+](=O)[O-])ccn3)CC2)CC1	ZINC001157836654	864183289	/nfs/dbraw/zinc/18/32/89/864183289.db2.gz	MOSZWTVNHGEHNF-UHFFFAOYSA-N	1	1	319.409	1.454	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@H+](Cn1cc([N+](=O)[O-])c(C)n1)C2	ZINC001332152407	865615411	/nfs/dbraw/zinc/61/54/11/865615411.db2.gz	UBLNXALAAGPCPR-FZMZJTMJSA-N	1	1	308.338	1.332	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cn1cc([N+](=O)[O-])c(C)n1)C2	ZINC001332152407	865615415	/nfs/dbraw/zinc/61/54/15/865615415.db2.gz	UBLNXALAAGPCPR-FZMZJTMJSA-N	1	1	308.338	1.332	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](C/C=C\Cl)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001160090789	865675763	/nfs/dbraw/zinc/67/57/63/865675763.db2.gz	PMWAANBWUGSHNT-KXPPAHKPSA-N	1	1	313.785	1.543	20	5		DDBDMO
O=C(CCCC[NH+]1CCOCC1)OCc1cccnc1[N+](=O)[O-]	ZINC001333405065	866715318	/nfs/dbraw/zinc/71/53/18/866715318.db2.gz	QEBMUUHXOFCTFS-UHFFFAOYSA-N	1	1	323.349	1.536	20	5		DDBDMO
O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1C[C@@H]2CSC[C@@H]2C1	ZINC001333845241	867071783	/nfs/dbraw/zinc/07/17/83/867071783.db2.gz	SHNRZZSJMPYELZ-AOOOYVTPSA-N	1	1	321.358	1.755	20	5		DDBDMO
O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+]1C[C@@H]2CSC[C@@H]2C1	ZINC001333845241	867071802	/nfs/dbraw/zinc/07/18/02/867071802.db2.gz	SHNRZZSJMPYELZ-AOOOYVTPSA-N	1	1	321.358	1.755	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@@H]1C[N@@H+](CC(C)C)CCO1	ZINC001321169934	867372162	/nfs/dbraw/zinc/37/21/62/867372162.db2.gz	LRWNAVKLDVUEPG-CYBMUJFWSA-N	1	1	308.382	1.489	20	5		DDBDMO
O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1cnco1	ZINC001321177422	867377861	/nfs/dbraw/zinc/37/78/61/867377861.db2.gz	CUOPRXVIRLKSSR-OWOJBTEDSA-N	1	1	322.346	1.720	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C4CCC3(CO)CC4)nc2c1	ZINC001335128630	868083751	/nfs/dbraw/zinc/08/37/51/868083751.db2.gz	AXYYJYZCRXZYDY-UHFFFAOYSA-N	1	1	302.334	1.960	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C4CCC3(CO)CC4)nc2c1	ZINC001335128630	868083764	/nfs/dbraw/zinc/08/37/64/868083764.db2.gz	AXYYJYZCRXZYDY-UHFFFAOYSA-N	1	1	302.334	1.960	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1CCn2c(C)[nH+]cc2C1	ZINC001165384096	869557440	/nfs/dbraw/zinc/55/74/40/869557440.db2.gz	DEKOGUPZLCDMOB-UHFFFAOYSA-N	1	1	317.305	1.302	20	5		DDBDMO
C[N@@H+]1CC[C@H](Oc2ncc([N+](=O)[O-])cc2Br)C1	ZINC001226340561	882367475	/nfs/dbraw/zinc/36/74/75/882367475.db2.gz	ZSZJKPZHMQHVCL-QMMMGPOBSA-N	1	1	302.128	1.835	20	5		DDBDMO
C[N@H+]1CC[C@H](Oc2ncc([N+](=O)[O-])cc2Br)C1	ZINC001226340561	882367491	/nfs/dbraw/zinc/36/74/91/882367491.db2.gz	ZSZJKPZHMQHVCL-QMMMGPOBSA-N	1	1	302.128	1.835	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCC[C@@H](C(N)=O)C2)ncc1[N+](=O)[O-]	ZINC001166934595	870396306	/nfs/dbraw/zinc/39/63/06/870396306.db2.gz	VIELCAQKPSGVSV-HOSRBBHYSA-N	1	1	319.365	1.224	20	5		DDBDMO
Cc1ccc(NCCNC(=O)c2cnc(N)c([N+](=O)[O-])c2)[nH+]c1	ZINC001303956165	871170436	/nfs/dbraw/zinc/17/04/36/871170436.db2.gz	FQPINMMASDGJIK-UHFFFAOYSA-N	1	1	316.321	1.117	20	5		DDBDMO
O=C(NCC[NH+]1CC=CC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC001318897506	872335097	/nfs/dbraw/zinc/33/50/97/872335097.db2.gz	PFRUSADHOPSAMR-UHFFFAOYSA-N	1	1	306.278	1.105	20	5		DDBDMO
CN(C(=O)c1ccn(-c2cc[nH+]cc2)n1)c1ccc([N+](=O)[O-])nc1	ZINC001342965964	872454397	/nfs/dbraw/zinc/45/43/97/872454397.db2.gz	RIYWFWSAXOCDTA-UHFFFAOYSA-N	1	1	324.300	1.847	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1	ZINC001349696121	875310559	/nfs/dbraw/zinc/31/05/59/875310559.db2.gz	ZFCMKJFTIVKZTG-ZLKJLUDKSA-N	1	1	319.361	1.673	20	5		DDBDMO
C[N@@H+]1CC[C@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001227498052	883044389	/nfs/dbraw/zinc/04/43/89/883044389.db2.gz	KPKOBEHVNDUHIT-QMMMGPOBSA-N	1	1	312.238	1.494	20	5		DDBDMO
C[N@H+]1CC[C@H](Oc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001227498052	883044408	/nfs/dbraw/zinc/04/44/08/883044408.db2.gz	KPKOBEHVNDUHIT-QMMMGPOBSA-N	1	1	312.238	1.494	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2nnc(C[N+](=O)[O-])n2CC(C)C)C[C@H]1C	ZINC001358057077	880309985	/nfs/dbraw/zinc/30/99/85/880309985.db2.gz	HAQALPNFXSKUHY-CHWSQXEVSA-N	1	1	324.429	1.630	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@H]2Oc1ncc([N+](=O)[O-])c2nc[nH]c21	ZINC001227694216	883135911	/nfs/dbraw/zinc/13/59/11/883135911.db2.gz	FGJIUFWFUTYLPH-MSRIBSCDSA-N	1	1	317.349	1.975	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2n[nH]c(=O)c3ccc([N+](=O)[O-])cc32)C1	ZINC001229365921	883947531	/nfs/dbraw/zinc/94/75/31/883947531.db2.gz	YMVNPXQZWFWCEK-JTQLQIEISA-N	1	1	304.306	1.717	20	5		DDBDMO
CSCC(=O)NCCC[N@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001233656653	887195638	/nfs/dbraw/zinc/19/56/38/887195638.db2.gz	ZHBJFDMSSHOELC-UHFFFAOYSA-N	1	1	317.436	1.957	20	5		DDBDMO
CSCC(=O)NCCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1	ZINC001233656653	887195646	/nfs/dbraw/zinc/19/56/46/887195646.db2.gz	ZHBJFDMSSHOELC-UHFFFAOYSA-N	1	1	317.436	1.957	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001254564402	896502860	/nfs/dbraw/zinc/50/28/60/896502860.db2.gz	LNDLKGKDQROGFX-TZMCWYRMSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001254564402	896502868	/nfs/dbraw/zinc/50/28/68/896502868.db2.gz	LNDLKGKDQROGFX-TZMCWYRMSA-N	1	1	319.361	1.069	20	5		DDBDMO
CC(=O)N1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@@H](C)C1	ZINC001254608701	896530676	/nfs/dbraw/zinc/53/06/76/896530676.db2.gz	SJYLCYWGSNSCRG-MEDUHNTESA-N	1	1	303.362	1.615	20	5		DDBDMO
CC(=O)N1CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)[C@@H](C)C1	ZINC001254608701	896530687	/nfs/dbraw/zinc/53/06/87/896530687.db2.gz	SJYLCYWGSNSCRG-MEDUHNTESA-N	1	1	303.362	1.615	20	5		DDBDMO
COC(=O)C[C@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612382	896533467	/nfs/dbraw/zinc/53/34/67/896533467.db2.gz	VUYOGICDLSYQKN-IAQYHMDHSA-N	1	1	304.346	1.947	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC001262652334	900286176	/nfs/dbraw/zinc/28/61/76/900286176.db2.gz	CXAYTRVUFRXTPU-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCN(C)c1nc(C)ccc1[N+](=O)[O-]	ZINC001263679282	900667649	/nfs/dbraw/zinc/66/76/49/900667649.db2.gz	MEXXSAQHXPZWEP-UHFFFAOYSA-N	1	1	323.397	1.192	20	5		DDBDMO
COCCO[C@@H]1C[C@H](CO)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000278261678	214054217	/nfs/dbraw/zinc/05/42/17/214054217.db2.gz	IGZVKZREEOZTEX-DZGCQCFKSA-N	1	1	324.377	1.441	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278365608	214119300	/nfs/dbraw/zinc/11/93/00/214119300.db2.gz	DDQXRAJEXOMLSZ-UHFFFAOYSA-N	1	1	305.338	1.240	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000278571648	214244985	/nfs/dbraw/zinc/24/49/85/214244985.db2.gz	KNSRYTXLAWUNOK-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000278571648	214244986	/nfs/dbraw/zinc/24/49/86/214244986.db2.gz	KNSRYTXLAWUNOK-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000278571648	214244989	/nfs/dbraw/zinc/24/49/89/214244989.db2.gz	KNSRYTXLAWUNOK-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1	ZINC000451306468	231063239	/nfs/dbraw/zinc/06/32/39/231063239.db2.gz	YHKCGJXGGUVPCI-UAGQMJEPSA-N	1	1	320.389	1.999	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323654	529466461	/nfs/dbraw/zinc/46/64/61/529466461.db2.gz	LEVBSTVXRRJKCY-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323654	529466463	/nfs/dbraw/zinc/46/64/63/529466463.db2.gz	LEVBSTVXRRJKCY-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323654	529466468	/nfs/dbraw/zinc/46/64/68/529466468.db2.gz	LEVBSTVXRRJKCY-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323654	529466469	/nfs/dbraw/zinc/46/64/69/529466469.db2.gz	LEVBSTVXRRJKCY-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000295655215	529503053	/nfs/dbraw/zinc/50/30/53/529503053.db2.gz	HSIXEHQZKNFOME-LBPRGKRZSA-N	1	1	307.350	1.187	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250335	529576641	/nfs/dbraw/zinc/57/66/41/529576641.db2.gz	IXQRRSOSLGFNBW-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250335	529576644	/nfs/dbraw/zinc/57/66/44/529576644.db2.gz	IXQRRSOSLGFNBW-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@H+](CCO)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000614894742	362066716	/nfs/dbraw/zinc/06/67/16/362066716.db2.gz	IZBYAFHHRICMBV-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@@H+](CCO)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000614894742	362066721	/nfs/dbraw/zinc/06/67/21/362066721.db2.gz	IZBYAFHHRICMBV-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2sccc2C1	ZINC000090512038	185299660	/nfs/dbraw/zinc/29/96/60/185299660.db2.gz	UQQJCTBBDCLRPD-UHFFFAOYSA-N	1	1	305.359	1.876	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2sccc2C1	ZINC000090512038	185299661	/nfs/dbraw/zinc/29/96/61/185299661.db2.gz	UQQJCTBBDCLRPD-UHFFFAOYSA-N	1	1	305.359	1.876	20	5		DDBDMO
CO[C@]1(C)C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090551324	185302597	/nfs/dbraw/zinc/30/25/97/185302597.db2.gz	FCFXUGVRJZIKLR-CZUORRHYSA-N	1	1	323.393	1.892	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3cccc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC000425048276	529823277	/nfs/dbraw/zinc/82/32/77/529823277.db2.gz	BBRXBHNGXJVJTJ-GXFFZTMASA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@@H+](CC(C)(C)CO)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000451260356	529848240	/nfs/dbraw/zinc/84/82/40/529848240.db2.gz	ZKUVJAYKYVXOHT-AWEZNQCLSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1N)C1=CC[N@@H+](C)CC1	ZINC000272753448	210157629	/nfs/dbraw/zinc/15/76/29/210157629.db2.gz	FDDNCQXIZFDJQL-SNVBAGLBSA-N	1	1	304.350	1.557	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000330918568	232161867	/nfs/dbraw/zinc/16/18/67/232161867.db2.gz	XMDBFEPJPFLFJU-NWDGAFQWSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000272659309	210065128	/nfs/dbraw/zinc/06/51/28/210065128.db2.gz	HCOPAJYLOCJWAQ-ABAIWWIYSA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000272659309	210065132	/nfs/dbraw/zinc/06/51/32/210065132.db2.gz	HCOPAJYLOCJWAQ-ABAIWWIYSA-N	1	1	319.361	1.857	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](O)C(C)(C)C1	ZINC000279892500	215212168	/nfs/dbraw/zinc/21/21/68/215212168.db2.gz	UTQUEMFBGFGHDF-CQSZACIVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000279901202	215220847	/nfs/dbraw/zinc/22/08/47/215220847.db2.gz	VEGGLDNLRKJPGQ-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000279901202	215220848	/nfs/dbraw/zinc/22/08/48/215220848.db2.gz	VEGGLDNLRKJPGQ-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3C(N)=O)CC[C@@H]21	ZINC000133704275	186008647	/nfs/dbraw/zinc/00/86/47/186008647.db2.gz	ORDNHJNRPJQWCJ-MFKMUULPSA-N	1	1	319.365	1.009	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000181878927	186214100	/nfs/dbraw/zinc/21/41/00/186214100.db2.gz	SIPZURBNOKEKJI-KGLIPLIRSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC1(C)[C@@H]2C[N@H+](C[C@H](O)COc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000181914248	186218203	/nfs/dbraw/zinc/21/82/03/186218203.db2.gz	IRFXERZWUUJQAI-RWMBFGLXSA-N	1	1	306.362	1.922	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000277193075	213357467	/nfs/dbraw/zinc/35/74/67/213357467.db2.gz	BORTWMANCMFFBS-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000491290269	234126516	/nfs/dbraw/zinc/12/65/16/234126516.db2.gz	BORHBTLREBYFSH-QPJJXVBHSA-N	1	1	301.346	1.915	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H](C)[N@@H+](C)C1CC1	ZINC000057716562	352825919	/nfs/dbraw/zinc/82/59/19/352825919.db2.gz	AHQZNMYGUSGGNL-JTQLQIEISA-N	1	1	307.350	1.816	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000067711410	353064190	/nfs/dbraw/zinc/06/41/90/353064190.db2.gz	FAHRYWYIOOCWBP-NSHDSACASA-N	1	1	304.350	1.603	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000072714984	353211927	/nfs/dbraw/zinc/21/19/27/353211927.db2.gz	MEMFOFRWFRKOFZ-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000072714984	353211929	/nfs/dbraw/zinc/21/19/29/353211929.db2.gz	MEMFOFRWFRKOFZ-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000072731514	353213340	/nfs/dbraw/zinc/21/33/40/353213340.db2.gz	QQBAUNRFDBXTPA-LBPRGKRZSA-N	1	1	306.366	1.727	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000174288518	198315829	/nfs/dbraw/zinc/31/58/29/198315829.db2.gz	NNIFFYSRNKUJNV-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000174288518	198315831	/nfs/dbraw/zinc/31/58/31/198315831.db2.gz	NNIFFYSRNKUJNV-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@@H](C)O)C1	ZINC000089928376	353783388	/nfs/dbraw/zinc/78/33/88/353783388.db2.gz	JOFILSGTWBLCKC-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]([C@@H](C)O)C1	ZINC000089928376	353783389	/nfs/dbraw/zinc/78/33/89/353783389.db2.gz	JOFILSGTWBLCKC-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N3CCC[C@@H](c4[nH]cc[nH+]4)C3)nn21	ZINC000091479996	353827877	/nfs/dbraw/zinc/82/78/77/353827877.db2.gz	HFEFEKZNSCABFM-SNVBAGLBSA-N	1	1	313.321	1.745	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000157920742	354227842	/nfs/dbraw/zinc/22/78/42/354227842.db2.gz	PZQGPLAJVNMBNZ-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000157920742	354227843	/nfs/dbraw/zinc/22/78/43/354227843.db2.gz	PZQGPLAJVNMBNZ-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc(Br)c([N+](=O)[O-])n1)C1CC1	ZINC000290864245	354445213	/nfs/dbraw/zinc/44/52/13/354445213.db2.gz	YXEQSFCKIZFFQK-MRVPVSSYSA-N	1	1	319.159	1.009	20	5		DDBDMO
Cc1c(C(=O)N2CC[C@H]([N@H+]3CC[C@H](O)C3)C2)cccc1[N+](=O)[O-]	ZINC000588860604	354943767	/nfs/dbraw/zinc/94/37/67/354943767.db2.gz	JYQOATUSLJYVOG-STQMWFEESA-N	1	1	319.361	1.184	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc([N+](=O)[O-])c1C	ZINC000590047191	355044864	/nfs/dbraw/zinc/04/48/64/355044864.db2.gz	XDJJTURWRTUFNN-SMDDNHRTSA-N	1	1	319.361	1.688	20	5		DDBDMO
CCOc1cc(C[NH2+][C@H](CO)c2cnn(C)c2)ccc1[N+](=O)[O-]	ZINC000276972650	213211450	/nfs/dbraw/zinc/21/14/50/213211450.db2.gz	XCIOIAAABVLIRZ-CYBMUJFWSA-N	1	1	320.349	1.550	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000591505192	355322097	/nfs/dbraw/zinc/32/20/97/355322097.db2.gz	DOKXVNXAAOMFOI-NWDGAFQWSA-N	1	1	322.361	1.816	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000593071883	355787177	/nfs/dbraw/zinc/78/71/77/355787177.db2.gz	VMYXVCQUPFIUKS-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000593187544	355820143	/nfs/dbraw/zinc/82/01/43/355820143.db2.gz	LQYORTDHMSBWMH-UPJWGTAASA-N	1	1	321.377	1.913	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593578993	355933141	/nfs/dbraw/zinc/93/31/41/355933141.db2.gz	RQBUIIFUODOSOX-WDEREUQCSA-N	1	1	309.341	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CCC[C@]3(C[NH3+])C2)c1[N+](=O)[O-]	ZINC000593912357	356055922	/nfs/dbraw/zinc/05/59/22/356055922.db2.gz	LYQYQVUVBGKLHC-BONVTDFDSA-N	1	1	321.381	1.471	20	5		DDBDMO
C[C@H](c1ccc([N+](=O)[O-])cc1)[NH+]1CCN(c2nncn2C)CC1	ZINC000594021970	356091713	/nfs/dbraw/zinc/09/17/13/356091713.db2.gz	CGAOEKDXFJBEMN-GFCCVEGCSA-N	1	1	316.365	1.607	20	5		DDBDMO
COc1cc(C[N@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000594613180	356266445	/nfs/dbraw/zinc/26/64/45/356266445.db2.gz	ALMVAGLZVVKKRI-JTQLQIEISA-N	1	1	310.350	1.957	20	5		DDBDMO
COc1cc(C[N@@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000594613180	356266448	/nfs/dbraw/zinc/26/64/48/356266448.db2.gz	ALMVAGLZVVKKRI-JTQLQIEISA-N	1	1	310.350	1.957	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000595353705	356460857	/nfs/dbraw/zinc/46/08/57/356460857.db2.gz	JUMQQPUZCISXOA-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
COc1cc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)on1	ZINC000595460731	356501320	/nfs/dbraw/zinc/50/13/20/356501320.db2.gz	GSWXCVYBUUAHCD-UHFFFAOYSA-N	1	1	307.310	1.625	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595741352	356629991	/nfs/dbraw/zinc/62/99/91/356629991.db2.gz	MXSGOSBVTLBLFC-GXFFZTMASA-N	1	1	307.325	1.834	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H]3NC(=O)CC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000595744271	356631962	/nfs/dbraw/zinc/63/19/62/356631962.db2.gz	VHQBGQPZIFARMN-CHWSQXEVSA-N	1	1	319.361	1.704	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595741352	356629988	/nfs/dbraw/zinc/62/99/88/356629988.db2.gz	MXSGOSBVTLBLFC-GXFFZTMASA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CCC3(COC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595833427	356670224	/nfs/dbraw/zinc/67/02/24/356670224.db2.gz	IRTMRWMDTHNSDF-CQSZACIVSA-N	1	1	317.345	1.422	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC3(COC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000595833427	356670229	/nfs/dbraw/zinc/67/02/29/356670229.db2.gz	IRTMRWMDTHNSDF-CQSZACIVSA-N	1	1	317.345	1.422	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC3(COC3)C2)c1	ZINC000595835395	356671754	/nfs/dbraw/zinc/67/17/54/356671754.db2.gz	PBWNQLQXYMITQG-CYBMUJFWSA-N	1	1	308.334	1.057	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000595849474	356676152	/nfs/dbraw/zinc/67/61/52/356676152.db2.gz	LNTNZMYWOPZHGM-TXEJJXNPSA-N	1	1	321.333	1.077	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000595849474	356676156	/nfs/dbraw/zinc/67/61/56/356676156.db2.gz	LNTNZMYWOPZHGM-TXEJJXNPSA-N	1	1	321.333	1.077	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@H]1C	ZINC000596176407	356802736	/nfs/dbraw/zinc/80/27/36/356802736.db2.gz	FVCYCRMVWFQOGI-MNOVXSKESA-N	1	1	306.366	1.613	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596129861	356784960	/nfs/dbraw/zinc/78/49/60/356784960.db2.gz	RRRMSCGRJLLWHR-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2NCC23CC(C2)C[NH2+]3)n1	ZINC000596655749	356943686	/nfs/dbraw/zinc/94/36/86/356943686.db2.gz	YMPOMNMHHOOICJ-FMPXUHTOSA-N	1	1	305.382	1.617	20	5		DDBDMO
CC1(C)Cc2n[nH]cc2C[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000596596977	356929261	/nfs/dbraw/zinc/92/92/61/356929261.db2.gz	HRIABAYVDVXDSY-UHFFFAOYSA-N	1	1	304.354	1.599	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000596816517	356984770	/nfs/dbraw/zinc/98/47/70/356984770.db2.gz	JDNDLTZQVKXMJB-SNVBAGLBSA-N	1	1	307.354	1.406	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000596817871	356985162	/nfs/dbraw/zinc/98/51/62/356985162.db2.gz	UHDNLGTXKMBCHO-UHFFFAOYSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000597859576	357361535	/nfs/dbraw/zinc/36/15/35/357361535.db2.gz	VFNYJBUBRWPORO-JTQLQIEISA-N	1	1	324.356	1.919	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)n1	ZINC000597860018	357362105	/nfs/dbraw/zinc/36/21/05/357362105.db2.gz	JWJRPTUBTRLQBQ-SNVBAGLBSA-N	1	1	309.370	1.179	20	5		DDBDMO
CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000598041277	357439649	/nfs/dbraw/zinc/43/96/49/357439649.db2.gz	SFCAIXINGURTQK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@H+](CC)C1	ZINC000598041277	357439653	/nfs/dbraw/zinc/43/96/53/357439653.db2.gz	SFCAIXINGURTQK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000598041277	357439657	/nfs/dbraw/zinc/43/96/57/357439657.db2.gz	SFCAIXINGURTQK-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000598343799	357546823	/nfs/dbraw/zinc/54/68/23/357546823.db2.gz	YFVCRRVMHXWLLJ-SNVBAGLBSA-N	1	1	321.333	1.538	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598622120	357658496	/nfs/dbraw/zinc/65/84/96/357658496.db2.gz	ZMUDIPLUJBQFMB-LBPRGKRZSA-N	1	1	322.365	1.553	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000598914021	357756440	/nfs/dbraw/zinc/75/64/40/357756440.db2.gz	VKUXHAPNZAHFIV-ZDUSSCGKSA-N	1	1	314.292	1.899	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000598980344	357781958	/nfs/dbraw/zinc/78/19/58/357781958.db2.gz	UMSSNDDHAXDDJH-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)cc1	ZINC000599632452	357999328	/nfs/dbraw/zinc/99/93/28/357999328.db2.gz	ONPCRWOVEQCUCL-GTQRCTGISA-N	1	1	324.402	1.959	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000601006267	358379261	/nfs/dbraw/zinc/37/92/61/358379261.db2.gz	TUXDCPWPPZAFIE-QWHCGFSZSA-N	1	1	321.377	1.950	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NCC[N@@H+](C)C1CC1	ZINC000601108453	358404816	/nfs/dbraw/zinc/40/48/16/358404816.db2.gz	KFKSKRBOUGLKKW-UHFFFAOYSA-N	1	1	307.276	1.853	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000180931954	199229212	/nfs/dbraw/zinc/22/92/12/199229212.db2.gz	GUSVYIBWFOXCSA-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H]1C(=O)N(C)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601149482	358422128	/nfs/dbraw/zinc/42/21/28/358422128.db2.gz	MKZOXJQRHCRNLY-SNVBAGLBSA-N	1	1	300.318	1.810	20	5		DDBDMO
C[C@H]1C(=O)N(C)CCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601149481	358422192	/nfs/dbraw/zinc/42/21/92/358422192.db2.gz	MKZOXJQRHCRNLY-JTQLQIEISA-N	1	1	300.318	1.810	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601170140	358431206	/nfs/dbraw/zinc/43/12/06/358431206.db2.gz	XFNKJUPXSGQBDI-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601170140	358431210	/nfs/dbraw/zinc/43/12/10/358431210.db2.gz	XFNKJUPXSGQBDI-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@H]2C1	ZINC000602796898	359199497	/nfs/dbraw/zinc/19/94/97/359199497.db2.gz	UFYWZRMHBVPWPM-RDBSUJKOSA-N	1	1	324.381	1.368	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@H]2C1	ZINC000602796898	359199499	/nfs/dbraw/zinc/19/94/99/359199499.db2.gz	UFYWZRMHBVPWPM-RDBSUJKOSA-N	1	1	324.381	1.368	20	5		DDBDMO
Cn1cc(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)c([N+](=O)[O-])n1	ZINC000602805592	359204685	/nfs/dbraw/zinc/20/46/85/359204685.db2.gz	OQISUBBZAMEPRW-UHFFFAOYSA-N	1	1	316.317	1.836	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cn(C)nc1[N+](=O)[O-]	ZINC000602829657	359222657	/nfs/dbraw/zinc/22/26/57/359222657.db2.gz	WZUIXVGCQXCROH-LBPRGKRZSA-N	1	1	309.370	1.209	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000186797579	200012398	/nfs/dbraw/zinc/01/23/98/200012398.db2.gz	IUKZZJDAWRSWNJ-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(CC[N@H+](C)C1CC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000186797579	200012399	/nfs/dbraw/zinc/01/23/99/200012399.db2.gz	IUKZZJDAWRSWNJ-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000186797579	200012400	/nfs/dbraw/zinc/01/24/00/200012400.db2.gz	IUKZZJDAWRSWNJ-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
C[N@@H+](CCn1ccc(N)c([N+](=O)[O-])c1=O)Cc1ccc(F)cc1	ZINC000603420729	359629175	/nfs/dbraw/zinc/62/91/75/359629175.db2.gz	OLAMMLGBOJEDFA-UHFFFAOYSA-N	1	1	320.324	1.610	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000188818166	200307164	/nfs/dbraw/zinc/30/71/64/200307164.db2.gz	YKTDJORZAWKSIY-UHFFFAOYSA-N	1	1	308.338	1.439	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000609673801	360343263	/nfs/dbraw/zinc/34/32/63/360343263.db2.gz	LDXQRHUEXBHVTR-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cc(S(=O)(=O)N[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000609673801	360343268	/nfs/dbraw/zinc/34/32/68/360343268.db2.gz	LDXQRHUEXBHVTR-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)CO	ZINC000609894841	360362406	/nfs/dbraw/zinc/36/24/06/360362406.db2.gz	DNZKGGJNXBQACA-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)CO	ZINC000609894841	360362412	/nfs/dbraw/zinc/36/24/12/360362412.db2.gz	DNZKGGJNXBQACA-UHFFFAOYSA-N	1	1	315.757	1.889	20	5		DDBDMO
CN(CCCC[NH+](C)C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000610112130	360382963	/nfs/dbraw/zinc/38/29/63/360382963.db2.gz	YESBRPSTWMTAQE-UHFFFAOYSA-N	1	1	319.365	1.885	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)C[C@@H]1C	ZINC000610125849	360383944	/nfs/dbraw/zinc/38/39/44/360383944.db2.gz	VDAQHTFAUZCQMM-NWDGAFQWSA-N	1	1	308.382	1.878	20	5		DDBDMO
O=C(NCC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC1	ZINC000610580901	360475210	/nfs/dbraw/zinc/47/52/10/360475210.db2.gz	WRIQEYJVMOOMSP-UHFFFAOYSA-N	1	1	304.306	1.352	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000611087608	360618375	/nfs/dbraw/zinc/61/83/75/360618375.db2.gz	YAMJNRRRANMUFK-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000611087925	360618545	/nfs/dbraw/zinc/61/85/45/360618545.db2.gz	SFWPNYGBYIRLSC-LLVKDONJSA-N	1	1	309.370	1.079	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000611087925	360618551	/nfs/dbraw/zinc/61/85/51/360618551.db2.gz	SFWPNYGBYIRLSC-LLVKDONJSA-N	1	1	309.370	1.079	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@H](O)C3)o2)cc1	ZINC000611276774	360687612	/nfs/dbraw/zinc/68/76/12/360687612.db2.gz	HUILXRGXHIPTLN-OKILXGFUSA-N	1	1	318.329	1.782	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CC[C@@H](O)[C@H]3C2)c2c(c1)COCO2	ZINC000612134115	360929198	/nfs/dbraw/zinc/92/91/98/360929198.db2.gz	GSJRKLHXOVSRQX-NZVBXONLSA-N	1	1	320.345	1.664	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000264592885	204015150	/nfs/dbraw/zinc/01/51/50/204015150.db2.gz	ANYJFTCOCQQRFU-LBPRGKRZSA-N	1	1	319.361	1.574	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1	ZINC000264891089	204243106	/nfs/dbraw/zinc/24/31/06/204243106.db2.gz	JTOKDMFWGCSYPG-UHFFFAOYSA-N	1	1	317.349	1.462	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H](C)C1	ZINC000288202894	220015935	/nfs/dbraw/zinc/01/59/35/220015935.db2.gz	BZOZGFCADRTYBJ-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H](C)C1	ZINC000288202894	220015938	/nfs/dbraw/zinc/01/59/38/220015938.db2.gz	BZOZGFCADRTYBJ-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@@H+](CCCC(=O)NC(N)=O)CCc1cccc([N+](=O)[O-])c1	ZINC000282500316	217042381	/nfs/dbraw/zinc/04/23/81/217042381.db2.gz	QUKUFLZIDCSMMK-UHFFFAOYSA-N	1	1	308.338	1.044	20	5		DDBDMO
C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C(=O)NCCF	ZINC000282545536	217078577	/nfs/dbraw/zinc/07/85/77/217078577.db2.gz	CLJKGSDBLKZABP-QMMMGPOBSA-N	1	1	303.721	1.812	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000268188011	206528908	/nfs/dbraw/zinc/52/89/08/206528908.db2.gz	DQSHJAHXMZOSKC-NSHDSACASA-N	1	1	321.381	1.479	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000105824078	194137857	/nfs/dbraw/zinc/13/78/57/194137857.db2.gz	MIWSTJFFHIUTGG-CHWSQXEVSA-N	1	1	323.393	1.490	20	5		DDBDMO
COc1cc(N2CC[C@H]3OCC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000285209732	218334651	/nfs/dbraw/zinc/33/46/51/218334651.db2.gz	WYZSXQOYXVBSFE-UONOGXRCSA-N	1	1	307.350	1.513	20	5		DDBDMO
CCOC(=O)[C@](C)(O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285275868	218362561	/nfs/dbraw/zinc/36/25/61/218362561.db2.gz	IZERAXCPRRCZLS-OAHLLOKOSA-N	1	1	310.350	1.383	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@]3(CCCOC3)C2)cc1	ZINC000285335513	218387447	/nfs/dbraw/zinc/38/74/47/218387447.db2.gz	OGAUQFCFERWNBS-MRXNPFEDSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@]3(CCCOC3)C2)cc1	ZINC000285335513	218387449	/nfs/dbraw/zinc/38/74/49/218387449.db2.gz	OGAUQFCFERWNBS-MRXNPFEDSA-N	1	1	322.361	1.855	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000110993433	194379289	/nfs/dbraw/zinc/37/92/89/194379289.db2.gz	KWNCOHGVIKBLFU-NSHDSACASA-N	1	1	309.370	1.241	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)NCCc2ccccc2[N+](=O)[O-])CC1	ZINC000269110788	207249854	/nfs/dbraw/zinc/24/98/54/207249854.db2.gz	OYXWEMUEMYSZIL-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)[C@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000302486847	532955234	/nfs/dbraw/zinc/95/52/34/532955234.db2.gz	YRHNWBBLGCTQNO-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)[C@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000302486847	532955240	/nfs/dbraw/zinc/95/52/40/532955240.db2.gz	YRHNWBBLGCTQNO-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269265698	207407751	/nfs/dbraw/zinc/40/77/51/207407751.db2.gz	DCZLUYDOOUPNBW-SNVBAGLBSA-N	1	1	305.334	1.515	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269265698	207407758	/nfs/dbraw/zinc/40/77/58/207407758.db2.gz	DCZLUYDOOUPNBW-SNVBAGLBSA-N	1	1	305.334	1.515	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000158701142	197295055	/nfs/dbraw/zinc/29/50/55/197295055.db2.gz	MVIZKTMFILADPE-AWEZNQCLSA-N	1	1	307.354	1.096	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])[C@H]1CCN(C2CC2)C1=O	ZINC000352551220	285134081	/nfs/dbraw/zinc/13/40/81/285134081.db2.gz	WQEFYBODKWBOCY-HNNXBMFYSA-N	1	1	303.362	1.832	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@@H]1CCC[C@@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000352657373	285201069	/nfs/dbraw/zinc/20/10/69/285201069.db2.gz	ACMSNRVTKOAGIH-KGLIPLIRSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@H]1CCC[C@H]1O	ZINC000352659457	285204092	/nfs/dbraw/zinc/20/40/92/285204092.db2.gz	JQPMKXHCGYSHGD-DDTOSNHZSA-N	1	1	307.350	1.767	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)[C@H]1CCC[C@@H]1O	ZINC000352659752	285204215	/nfs/dbraw/zinc/20/42/15/285204215.db2.gz	LDZFEUSGPDYADK-SWHYSGLUSA-N	1	1	307.350	1.767	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000155456598	197056950	/nfs/dbraw/zinc/05/69/50/197056950.db2.gz	VCMRCMOHSNFPHZ-TXEJJXNPSA-N	1	1	307.350	1.525	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000294978162	533216926	/nfs/dbraw/zinc/21/69/26/533216926.db2.gz	GKHWKYHRBQJRFA-INIZCTEOSA-N	1	1	322.361	1.915	20	5		DDBDMO
COc1cc(C[N@H+](C)C2(C(N)=O)CCCC2)ccc1[N+](=O)[O-]	ZINC000352781729	285297633	/nfs/dbraw/zinc/29/76/33/285297633.db2.gz	YYLWNRZNKHRMJI-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1cc(C[N@@H+](C)C2(C(N)=O)CCCC2)ccc1[N+](=O)[O-]	ZINC000352781729	285297634	/nfs/dbraw/zinc/29/76/34/285297634.db2.gz	YYLWNRZNKHRMJI-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000414215258	224313169	/nfs/dbraw/zinc/31/31/69/224313169.db2.gz	UJCRYSBAGVOQJB-LLVKDONJSA-N	1	1	307.350	1.541	20	5		DDBDMO
CO[C@@H]1C[C@@H]([N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C12CCC2	ZINC000451836359	533530421	/nfs/dbraw/zinc/53/04/21/533530421.db2.gz	BMXPNAAKLHINKJ-MGPQQGTHSA-N	1	1	324.381	1.042	20	5		DDBDMO
CC[N@@H+](CCc1cccs1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266565691	407563802	/nfs/dbraw/zinc/56/38/02/407563802.db2.gz	ZMTXVDMWURRXEI-CYBMUJFWSA-N	1	1	324.406	1.778	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000070069288	406805600	/nfs/dbraw/zinc/80/56/00/406805600.db2.gz	KDAYPIVAKDLDCM-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)CN1CC[NH+](C)CC1	ZINC000074137813	406902412	/nfs/dbraw/zinc/90/24/12/406902412.db2.gz	WCVPUIDYCJZLLB-CYBMUJFWSA-N	1	1	320.393	1.208	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000075848993	406943261	/nfs/dbraw/zinc/94/32/61/406943261.db2.gz	KJGXXGOMSHIQDM-GFCCVEGCSA-N	1	1	319.361	1.574	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000101976412	407318635	/nfs/dbraw/zinc/31/86/35/407318635.db2.gz	SCGMSCJTRXNSNA-UHFFFAOYSA-N	1	1	323.397	1.646	20	5		DDBDMO
O=C(NCCC[NH+]1CCOCC1)NCc1cccc([N+](=O)[O-])c1	ZINC000067722624	407281283	/nfs/dbraw/zinc/28/12/83/407281283.db2.gz	BJNCJJBFLASENA-UHFFFAOYSA-N	1	1	322.365	1.116	20	5		DDBDMO
C[N@@H+](CCc1ccccn1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000124344142	407355734	/nfs/dbraw/zinc/35/57/34/407355734.db2.gz	ZSYGWMHLZREQSE-UHFFFAOYSA-N	1	1	314.345	1.763	20	5		DDBDMO
Cc1[nH+]ccn1CCCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000124364539	407355951	/nfs/dbraw/zinc/35/59/51/407355951.db2.gz	XWKWPONPKQPHOI-UHFFFAOYSA-N	1	1	314.301	1.786	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000108784680	407390524	/nfs/dbraw/zinc/39/05/24/407390524.db2.gz	GIXPJSDPFCSXGQ-JTQLQIEISA-N	1	1	307.325	1.948	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000125636432	407394015	/nfs/dbraw/zinc/39/40/15/407394015.db2.gz	AHDPXVWDWSREPR-LLVKDONJSA-N	1	1	314.345	1.825	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000127497860	407439043	/nfs/dbraw/zinc/43/90/43/407439043.db2.gz	HVPMAKGSLRFCGD-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2	ZINC000111320756	407407389	/nfs/dbraw/zinc/40/73/89/407407389.db2.gz	FRLBOFORXPRZPD-ZEIJEMSESA-N	1	1	319.361	1.910	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000112310641	407425864	/nfs/dbraw/zinc/42/58/64/407425864.db2.gz	KZUSVZCODFXAPH-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000266555549	407556452	/nfs/dbraw/zinc/55/64/52/407556452.db2.gz	VVLGYKRKLZBDPH-WDEREUQCSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000266555549	407556456	/nfs/dbraw/zinc/55/64/56/407556456.db2.gz	VVLGYKRKLZBDPH-WDEREUQCSA-N	1	1	313.379	1.279	20	5		DDBDMO
C[NH+](C)C[C@H]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000114478673	407579620	/nfs/dbraw/zinc/57/96/20/407579620.db2.gz	JRIXGMMSFXWKNJ-CYBMUJFWSA-N	1	1	320.393	1.807	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000171192868	407623986	/nfs/dbraw/zinc/62/39/86/407623986.db2.gz	XNCUOZIHKRVUMO-AWEZNQCLSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[NH2+]CC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000261975690	407697742	/nfs/dbraw/zinc/69/77/42/407697742.db2.gz	QPTJGJVVUGHKRL-UHFFFAOYSA-N	1	1	306.366	1.125	20	5		DDBDMO
C[C@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000171759018	407761120	/nfs/dbraw/zinc/76/11/20/407761120.db2.gz	AAQFGLLOMFVSML-SWLSCSKDSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000171759018	407761126	/nfs/dbraw/zinc/76/11/26/407761126.db2.gz	AAQFGLLOMFVSML-SWLSCSKDSA-N	1	1	319.361	1.811	20	5		DDBDMO
CN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000153721250	407886895	/nfs/dbraw/zinc/88/68/95/407886895.db2.gz	CGXSTGQGPRJLKX-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000268102280	407888672	/nfs/dbraw/zinc/88/86/72/407888672.db2.gz	FTHXKLZLDONKFT-SMDDNHRTSA-N	1	1	318.377	1.877	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000153784972	407901556	/nfs/dbraw/zinc/90/15/56/407901556.db2.gz	WDIVRPSSFFXETD-CJNGLKHVSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000268216215	407952680	/nfs/dbraw/zinc/95/26/80/407952680.db2.gz	PNXGBLYEUFLPCL-CABZTGNLSA-N	1	1	304.350	1.390	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181088079	407956460	/nfs/dbraw/zinc/95/64/60/407956460.db2.gz	FZSSOMMVODAKNJ-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
CCCCNC(=O)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866834	407959428	/nfs/dbraw/zinc/95/94/28/407959428.db2.gz	KUJVCEGPNNCLGJ-LBPRGKRZSA-N	1	1	321.381	1.392	20	5		DDBDMO
CCCCNC(=O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000118866834	407959435	/nfs/dbraw/zinc/95/94/35/407959435.db2.gz	KUJVCEGPNNCLGJ-LBPRGKRZSA-N	1	1	321.381	1.392	20	5		DDBDMO
Cc1nc(N(C)CCC[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000268481278	408065285	/nfs/dbraw/zinc/06/52/85/408065285.db2.gz	LMWGSFKAIPHUBV-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CC[C@@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000154862857	408099663	/nfs/dbraw/zinc/09/96/63/408099663.db2.gz	MPIRBIBVYGPGJR-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
C[C@H]1CCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000154941780	408105298	/nfs/dbraw/zinc/10/52/98/408105298.db2.gz	RLCPDYHMTWFYJD-JTQLQIEISA-N	1	1	306.370	1.420	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+](CCCO)Cc2ccccc2)n1	ZINC000269013150	408225197	/nfs/dbraw/zinc/22/51/97/408225197.db2.gz	VWPKFBPWJLFDLX-UHFFFAOYSA-N	1	1	304.350	1.676	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)N1CCCC1	ZINC000122272754	408276319	/nfs/dbraw/zinc/27/63/19/408276319.db2.gz	MZXWKCAEKXVJLA-GFCCVEGCSA-N	1	1	319.365	1.098	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)N1CCCC1	ZINC000122272754	408276325	/nfs/dbraw/zinc/27/63/25/408276325.db2.gz	MZXWKCAEKXVJLA-GFCCVEGCSA-N	1	1	319.365	1.098	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCCn3ccnc3)C2)nc1	ZINC000183190417	408348087	/nfs/dbraw/zinc/34/80/87/408348087.db2.gz	MLOLLJIUQJUKTM-ZDUSSCGKSA-N	1	1	316.365	1.763	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@H+](C)C1CCCC1	ZINC000264221940	408409991	/nfs/dbraw/zinc/40/99/91/408409991.db2.gz	WBSAVOJOGJDVHI-UHFFFAOYSA-N	1	1	323.397	1.480	20	5		DDBDMO
Cc1nc(N[C@H](C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000274526597	408439033	/nfs/dbraw/zinc/43/90/33/408439033.db2.gz	XUQOYQFZNHZADF-GFCCVEGCSA-N	1	1	307.398	1.736	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000274667560	408488511	/nfs/dbraw/zinc/48/85/11/408488511.db2.gz	RPJRIBKTIRXOBK-INIZCTEOSA-N	1	1	322.361	1.873	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@H]1n1ccnc1	ZINC000247658923	408501019	/nfs/dbraw/zinc/50/10/19/408501019.db2.gz	XHRZIOTYENHYSJ-TZMCWYRMSA-N	1	1	304.354	1.571	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000192029884	408531770	/nfs/dbraw/zinc/53/17/70/408531770.db2.gz	AHOPVGYJAVIQDY-NWDGAFQWSA-N	1	1	322.365	1.514	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000248458521	408572243	/nfs/dbraw/zinc/57/22/43/408572243.db2.gz	NAHURKVYNLBLOG-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000248458521	408572245	/nfs/dbraw/zinc/57/22/45/408572245.db2.gz	NAHURKVYNLBLOG-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
CNC(=O)c1ccc(N(C)C[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000265186487	408574050	/nfs/dbraw/zinc/57/40/50/408574050.db2.gz	GFRZAMPCXJTVIL-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000248479641	408576658	/nfs/dbraw/zinc/57/66/58/408576658.db2.gz	ZXVGBDRWWXNVCC-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(O)CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000177311534	408578150	/nfs/dbraw/zinc/57/81/50/408578150.db2.gz	SVCQTSCIFYTVKT-CQSZACIVSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000192465094	408592242	/nfs/dbraw/zinc/59/22/42/408592242.db2.gz	BALWFRZQXHDMPY-TXEJJXNPSA-N	1	1	304.350	1.027	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000248594663	408593548	/nfs/dbraw/zinc/59/35/48/408593548.db2.gz	SNKOIZSTJNTCCX-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H]([C@H](C)O)C1	ZINC000248594663	408593552	/nfs/dbraw/zinc/59/35/52/408593552.db2.gz	SNKOIZSTJNTCCX-RYUDHWBXSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000270619763	408606825	/nfs/dbraw/zinc/60/68/25/408606825.db2.gz	RGNMKUUFYGAAKQ-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000270619763	408606828	/nfs/dbraw/zinc/60/68/28/408606828.db2.gz	RGNMKUUFYGAAKQ-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000270619763	408606830	/nfs/dbraw/zinc/60/68/30/408606830.db2.gz	RGNMKUUFYGAAKQ-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
COC(=O)CCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000265373651	408628148	/nfs/dbraw/zinc/62/81/48/408628148.db2.gz	WTFYUNSCUXYSST-UHFFFAOYSA-N	1	1	307.350	1.670	20	5		DDBDMO
C[C@H](c1cccnc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680738	408634090	/nfs/dbraw/zinc/63/40/90/408634090.db2.gz	UPNOSDPQCLECKZ-BXUZGUMPSA-N	1	1	305.338	1.240	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+](CCO)C1CCOCC1	ZINC000275669594	408640625	/nfs/dbraw/zinc/64/06/25/408640625.db2.gz	YXXJMQBYGYLJPI-UHFFFAOYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CC[C@@H](NC(=O)[C@@H]1C[N@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796389	408714738	/nfs/dbraw/zinc/71/47/38/408714738.db2.gz	QNEJPXFNMUPRQG-KGLIPLIRSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[C@@H](NC(=O)[C@@H]1C[N@@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796389	408714744	/nfs/dbraw/zinc/71/47/44/408714744.db2.gz	QNEJPXFNMUPRQG-KGLIPLIRSA-N	1	1	307.350	1.493	20	5		DDBDMO
Cc1cc(NC(=O)NCCC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000193514649	408723898	/nfs/dbraw/zinc/72/38/98/408723898.db2.gz	UHOXHOADCYZQIC-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000162670567	408725691	/nfs/dbraw/zinc/72/56/91/408725691.db2.gz	WGGAEJYSPPVETO-JQWIXIFHSA-N	1	1	319.365	1.407	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1C	ZINC000251655664	408784200	/nfs/dbraw/zinc/78/42/00/408784200.db2.gz	HTRFWMIFWMOBLC-WOSRLPQWSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC[C@@H]1CN(c2nc(C)ccc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000178213379	408788428	/nfs/dbraw/zinc/78/84/28/408788428.db2.gz	RFGNERWACTXVDD-CYBMUJFWSA-N	1	1	308.382	1.845	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCCO	ZINC000281622744	408898492	/nfs/dbraw/zinc/89/84/92/408898492.db2.gz	HRCOTUPBEBKQTN-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCO	ZINC000281622744	408898496	/nfs/dbraw/zinc/89/84/96/408898496.db2.gz	HRCOTUPBEBKQTN-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@H]([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000277404969	408934671	/nfs/dbraw/zinc/93/46/71/408934671.db2.gz	YRPYSVOXOZWZGE-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1cc(N)ccc1[N+](=O)[O-]	ZINC000286328484	408964009	/nfs/dbraw/zinc/96/40/09/408964009.db2.gz	LHOVSEPJMQOGTQ-YPMHNXCESA-N	1	1	306.366	1.476	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000277630161	408980940	/nfs/dbraw/zinc/98/09/40/408980940.db2.gz	XBWGFHDDCWGJRS-LBPRGKRZSA-N	1	1	320.349	1.442	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000287310708	409017303	/nfs/dbraw/zinc/01/73/03/409017303.db2.gz	JKGPJECJYBQGSE-JSGCOSHPSA-N	1	1	312.366	1.427	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000277895381	409030102	/nfs/dbraw/zinc/03/01/02/409030102.db2.gz	GDRCOEPNCLMJOQ-JTQLQIEISA-N	1	1	309.370	1.483	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000294082095	409237421	/nfs/dbraw/zinc/23/74/21/409237421.db2.gz	JTDZTCLQKWGBDA-CQSZACIVSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294082095	409237423	/nfs/dbraw/zinc/23/74/23/409237423.db2.gz	JTDZTCLQKWGBDA-CQSZACIVSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000294082095	409237425	/nfs/dbraw/zinc/23/74/25/409237425.db2.gz	JTDZTCLQKWGBDA-CQSZACIVSA-N	1	1	307.354	1.184	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000279391110	409205094	/nfs/dbraw/zinc/20/50/94/409205094.db2.gz	UHCKQMIWIBKABR-CZUORRHYSA-N	1	1	324.377	1.835	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)C(=O)c1ccc([N+](=O)[O-])o1	ZINC000290053770	409292641	/nfs/dbraw/zinc/29/26/41/409292641.db2.gz	IFZXNLOWMDOABJ-UHFFFAOYSA-N	1	1	312.370	1.143	20	5		DDBDMO
CN(CCCN(C)C(=O)c1ccc([N+](=O)[O-])o1)CC[NH+](C)C	ZINC000290053770	409292644	/nfs/dbraw/zinc/29/26/44/409292644.db2.gz	IFZXNLOWMDOABJ-UHFFFAOYSA-N	1	1	312.370	1.143	20	5		DDBDMO
Cc1c(C[N@H+](C)[C@@H]2CCN3CCO[C@H]2C3)cccc1[N+](=O)[O-]	ZINC000295056427	409311122	/nfs/dbraw/zinc/31/11/22/409311122.db2.gz	AZFQBNRVCAZILP-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000280684772	409408554	/nfs/dbraw/zinc/40/85/54/409408554.db2.gz	HALQIVSWMVINKV-HNNXBMFYSA-N	1	1	320.349	1.121	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198839	164026246	/nfs/dbraw/zinc/02/62/46/164026246.db2.gz	NMIWHHPMHQMUFW-MJVIPROJSA-N	1	1	305.334	1.236	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000317198839	164026248	/nfs/dbraw/zinc/02/62/48/164026248.db2.gz	NMIWHHPMHQMUFW-MJVIPROJSA-N	1	1	305.334	1.236	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)n1	ZINC000319187107	164035148	/nfs/dbraw/zinc/03/51/48/164035148.db2.gz	OSBAEQIEXGKSQB-UWVGGRQHSA-N	1	1	308.338	1.671	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cccc1[N+](=O)[O-]	ZINC000321723616	164045101	/nfs/dbraw/zinc/04/51/01/164045101.db2.gz	ZXTUUSQAZQLYMG-OLZOCXBDSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3csc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000285592923	409502124	/nfs/dbraw/zinc/50/21/24/409502124.db2.gz	CALDFNMWFSPXNF-MNOVXSKESA-N	1	1	311.363	1.201	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CC[N@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000354077065	409636508	/nfs/dbraw/zinc/63/65/08/409636508.db2.gz	ZRIVKGSKOMDLHY-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000354077065	409636517	/nfs/dbraw/zinc/63/65/17/409636517.db2.gz	ZRIVKGSKOMDLHY-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356793985	409613190	/nfs/dbraw/zinc/61/31/90/409613190.db2.gz	LWBVGLBWLPTQQB-MNOVXSKESA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000356793985	409613198	/nfs/dbraw/zinc/61/31/98/409613198.db2.gz	LWBVGLBWLPTQQB-MNOVXSKESA-N	1	1	322.365	1.695	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000342533363	409703049	/nfs/dbraw/zinc/70/30/49/409703049.db2.gz	JLUVAFJIUVMWAH-LLVKDONJSA-N	1	1	311.313	1.184	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000356843276	409656439	/nfs/dbraw/zinc/65/64/39/409656439.db2.gz	GIBLQKDZLQTATP-STQMWFEESA-N	1	1	320.393	1.582	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000331596387	409673943	/nfs/dbraw/zinc/67/39/43/409673943.db2.gz	UCNSFDSJZCGBFG-KBPBESRZSA-N	1	1	312.370	1.043	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1C	ZINC000354405383	409833632	/nfs/dbraw/zinc/83/36/32/409833632.db2.gz	UQPXDKDFALEWRQ-PWSUYJOCSA-N	1	1	323.397	1.582	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1	ZINC000332061811	409845535	/nfs/dbraw/zinc/84/55/35/409845535.db2.gz	QVLVHKXDFAWQCW-LLVKDONJSA-N	1	1	321.333	1.614	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)CCO1	ZINC000332061811	409845540	/nfs/dbraw/zinc/84/55/40/409845540.db2.gz	QVLVHKXDFAWQCW-LLVKDONJSA-N	1	1	321.333	1.614	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346254950	409878471	/nfs/dbraw/zinc/87/84/71/409878471.db2.gz	HSTLVKNXIPQTTC-TUAOUCFPSA-N	1	1	321.381	1.131	20	5		DDBDMO
C[C@H]1CC[N@H+](C)CCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000354485095	409891766	/nfs/dbraw/zinc/89/17/66/409891766.db2.gz	BOVCAQAXZQHVFS-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000354485095	409891770	/nfs/dbraw/zinc/89/17/70/409891770.db2.gz	BOVCAQAXZQHVFS-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
CCNC(=O)NC(=O)[C@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338375371	409947626	/nfs/dbraw/zinc/94/76/26/409947626.db2.gz	DNVWEMITDVKVIL-NSHDSACASA-N	1	1	322.365	1.303	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000342938707	410014712	/nfs/dbraw/zinc/01/47/12/410014712.db2.gz	YLCKWYJLAPFHJZ-QWRGUYRKSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000342938707	410014715	/nfs/dbraw/zinc/01/47/15/410014715.db2.gz	YLCKWYJLAPFHJZ-QWRGUYRKSA-N	1	1	322.365	1.614	20	5		DDBDMO
O=c1c([N+](=O)[O-])cccn1Cc1[nH+]ccn1CC(F)(F)F	ZINC000343214994	410242337	/nfs/dbraw/zinc/24/23/37/410242337.db2.gz	XQAHYSOSLWRSRS-UHFFFAOYSA-N	1	1	302.212	1.564	20	5		DDBDMO
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347010716	410308387	/nfs/dbraw/zinc/30/83/87/410308387.db2.gz	HIHHMBGAUOULKK-OAHLLOKOSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCCC[C@H]1C	ZINC000347012136	410312911	/nfs/dbraw/zinc/31/29/11/410312911.db2.gz	LSJBRUAPOIIYCR-MNOVXSKESA-N	1	1	309.370	1.321	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000343457053	410468823	/nfs/dbraw/zinc/46/88/23/410468823.db2.gz	KOYBYCNWNJOCKQ-ZWNOBZJWSA-N	1	1	306.366	1.849	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000355373638	410475740	/nfs/dbraw/zinc/47/57/40/410475740.db2.gz	ULJOLMVAHWISJQ-HUUCEWRRSA-N	1	1	319.361	1.530	20	5		DDBDMO
C[C@H](O)CCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000339738358	410426917	/nfs/dbraw/zinc/42/69/17/410426917.db2.gz	HBRRZQMYYAWZEL-ZDUSSCGKSA-N	1	1	321.377	1.514	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CCC[N@H+]1C	ZINC000343427197	410442317	/nfs/dbraw/zinc/44/23/17/410442317.db2.gz	DQVDDGJGHLUTHY-PWSUYJOCSA-N	1	1	309.370	1.125	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@@H](NC(N)=O)C1	ZINC000347361673	410495934	/nfs/dbraw/zinc/49/59/34/410495934.db2.gz	PWMBVKBYKCWAIX-SVTZGKHISA-N	1	1	304.350	1.741	20	5		DDBDMO
CC[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](C)O	ZINC000352195633	410536805	/nfs/dbraw/zinc/53/68/05/410536805.db2.gz	SCARUSNGJHLICS-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H](C)O	ZINC000352195633	410536812	/nfs/dbraw/zinc/53/68/12/410536812.db2.gz	SCARUSNGJHLICS-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C[C@@H](C)O	ZINC000352202347	410543659	/nfs/dbraw/zinc/54/36/59/410543659.db2.gz	JHEFRJFPZHOZEO-LLVKDONJSA-N	1	1	309.366	1.935	20	5		DDBDMO
CN(C(=O)C[N@H+](C)[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000352201213	410544181	/nfs/dbraw/zinc/54/41/81/410544181.db2.gz	DZENGSJKRNKFIB-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000352201213	410544184	/nfs/dbraw/zinc/54/41/84/410544184.db2.gz	DZENGSJKRNKFIB-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cc1nn(C)c(N2CCC[C@H](Cc3[nH+]ccn3C)C2)c1[N+](=O)[O-]	ZINC000301717106	410779193	/nfs/dbraw/zinc/77/91/93/410779193.db2.gz	NRYPJZPGKOBCDI-GFCCVEGCSA-N	1	1	318.381	1.829	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000330571999	410789032	/nfs/dbraw/zinc/78/90/32/410789032.db2.gz	DKAINMBLKOZFIB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000330571999	410789035	/nfs/dbraw/zinc/78/90/35/410789035.db2.gz	DKAINMBLKOZFIB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301998370	410836968	/nfs/dbraw/zinc/83/69/68/410836968.db2.gz	PIFMNFHDUCOYAZ-NSHDSACASA-N	1	1	304.354	1.416	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000330689132	410879418	/nfs/dbraw/zinc/87/94/18/410879418.db2.gz	XTWUHEBUMXGGEM-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331078761	410935073	/nfs/dbraw/zinc/93/50/73/410935073.db2.gz	XSHOKWZAIFLAMY-LLVKDONJSA-N	1	1	309.370	1.067	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331078761	410935081	/nfs/dbraw/zinc/93/50/81/410935081.db2.gz	XSHOKWZAIFLAMY-LLVKDONJSA-N	1	1	309.370	1.067	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@H](O)C[C@H]2CO)o1	ZINC000359974849	410977450	/nfs/dbraw/zinc/97/74/50/410977450.db2.gz	PLDGINFVUMTOQM-NWDGAFQWSA-N	1	1	318.329	1.782	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@@H]2CC[C@H](O)[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000344085594	410946163	/nfs/dbraw/zinc/94/61/63/410946163.db2.gz	SLPDWASCHPXQQN-CQDKDKBSSA-N	1	1	319.361	1.260	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OC	ZINC000348556868	411015193	/nfs/dbraw/zinc/01/51/93/411015193.db2.gz	QCPRJOWQPBLULT-AAEUAGOBSA-N	1	1	310.350	1.957	20	5		DDBDMO
CC(C)Oc1nc(N[C@H]2CCc3[nH+]c[nH]c3C2)ccc1[N+](=O)[O-]	ZINC000580725714	422951198	/nfs/dbraw/zinc/95/11/98/422951198.db2.gz	UJYYCSZYGFKGTN-JTQLQIEISA-N	1	1	317.349	2.470	20	5		DDBDMO
CC(C)Oc1nc(N[C@H]2CCc3[nH]c[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000580725714	422951200	/nfs/dbraw/zinc/95/12/00/422951200.db2.gz	UJYYCSZYGFKGTN-JTQLQIEISA-N	1	1	317.349	2.470	20	5		DDBDMO
COCCCOCC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000271632754	209078243	/nfs/dbraw/zinc/07/82/43/209078243.db2.gz	YPMUVNQYGZSAGN-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+](CCCO)C1	ZINC000295588615	225020807	/nfs/dbraw/zinc/02/08/07/225020807.db2.gz	WGGFSCYTSDHNAM-CQSZACIVSA-N	1	1	321.377	1.100	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000373929379	418475002	/nfs/dbraw/zinc/47/50/02/418475002.db2.gz	OJIZHBWNPJVSBB-GXTWGEPZSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C1CO[C@@H]2CC[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2N1	ZINC000366784190	418517786	/nfs/dbraw/zinc/51/77/86/418517786.db2.gz	UKSZQTFYRKLPCA-UFYXKPLISA-N	1	1	317.345	1.197	20	5		DDBDMO
O=C1CO[C@@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2N1	ZINC000366784190	418517790	/nfs/dbraw/zinc/51/77/90/418517790.db2.gz	UKSZQTFYRKLPCA-UFYXKPLISA-N	1	1	317.345	1.197	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000374836179	418567986	/nfs/dbraw/zinc/56/79/86/418567986.db2.gz	ZICQNKHAXYJCMX-ZJUUUORDSA-N	1	1	322.340	1.673	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000375025227	418590198	/nfs/dbraw/zinc/59/01/98/418590198.db2.gz	YNFVPYGAQJSDTH-HIFRSBDPSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000375031386	418591656	/nfs/dbraw/zinc/59/16/56/418591656.db2.gz	NPCGQTGCLAWNHP-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000375102108	418605414	/nfs/dbraw/zinc/60/54/14/418605414.db2.gz	SAUZYTYIJFLUSV-NSHDSACASA-N	1	1	320.349	1.314	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1c1nc(Cc2ccc([N+](=O)[O-])cn2)no1	ZINC000361262703	418613948	/nfs/dbraw/zinc/61/39/48/418613948.db2.gz	OOIHAIMKVUPMRK-SKDRFNHKSA-N	1	1	303.322	1.629	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c1	ZINC000367841000	418644781	/nfs/dbraw/zinc/64/47/81/418644781.db2.gz	SQPGRNBDAXTQRU-GDNZZTSVSA-N	1	1	314.288	1.866	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c1	ZINC000367841000	418644782	/nfs/dbraw/zinc/64/47/82/418644782.db2.gz	SQPGRNBDAXTQRU-GDNZZTSVSA-N	1	1	314.288	1.866	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375610814	418661206	/nfs/dbraw/zinc/66/12/06/418661206.db2.gz	HDTQXXZUGZGHKB-ZIAGYGMSSA-N	1	1	323.397	1.149	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408144231	418789624	/nfs/dbraw/zinc/78/96/24/418789624.db2.gz	HNHNOXLHBMRBGU-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408144231	418789627	/nfs/dbraw/zinc/78/96/27/418789627.db2.gz	HNHNOXLHBMRBGU-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@]2(CCCCO2)C1	ZINC000364620492	418793929	/nfs/dbraw/zinc/79/39/29/418793929.db2.gz	TVUPZUQCDXLGGN-MRXNPFEDSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@H](Oc2ccccc2)C1	ZINC000371825689	418820424	/nfs/dbraw/zinc/82/04/24/418820424.db2.gz	XRPUQOWYRGBFKX-CYBMUJFWSA-N	1	1	302.334	1.982	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@H](Oc2ccccc2)C1	ZINC000371825689	418820427	/nfs/dbraw/zinc/82/04/27/418820427.db2.gz	XRPUQOWYRGBFKX-CYBMUJFWSA-N	1	1	302.334	1.982	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000411233345	418883328	/nfs/dbraw/zinc/88/33/28/418883328.db2.gz	CABWOBLFUNAHPE-NSHDSACASA-N	1	1	323.349	1.389	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000411921043	419490154	/nfs/dbraw/zinc/49/01/54/419490154.db2.gz	JDPDCIJGROCWFT-QWRGUYRKSA-N	1	1	307.306	1.318	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000411921043	419490162	/nfs/dbraw/zinc/49/01/62/419490162.db2.gz	JDPDCIJGROCWFT-QWRGUYRKSA-N	1	1	307.306	1.318	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000411935956	419502673	/nfs/dbraw/zinc/50/26/73/419502673.db2.gz	LHEFNKSCPDQNGN-GFCCVEGCSA-N	1	1	307.350	1.384	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000421699028	419683742	/nfs/dbraw/zinc/68/37/42/419683742.db2.gz	ABSJOZTUKWHEMM-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]([NH3+])C1CC1	ZINC000414884734	419858654	/nfs/dbraw/zinc/85/86/54/419858654.db2.gz	FZHOVYGFGKOITK-QMTHXVAHSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H](N)C1CC1	ZINC000414884734	419858659	/nfs/dbraw/zinc/85/86/59/419858659.db2.gz	FZHOVYGFGKOITK-QMTHXVAHSA-N	1	1	306.366	1.639	20	5		DDBDMO
COc1ccc(NC(=O)NCC[N@@H+]2CC=CCC2)cc1[N+](=O)[O-]	ZINC000432431803	229103600	/nfs/dbraw/zinc/10/36/00/229103600.db2.gz	DWGXSXHPNQERFM-UHFFFAOYSA-N	1	1	320.349	1.987	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CCCC[C@@H]1C	ZINC000299504319	229162595	/nfs/dbraw/zinc/16/25/95/229162595.db2.gz	LMZDZFUBGKDLBD-LBPRGKRZSA-N	1	1	323.397	1.480	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000415020543	419916335	/nfs/dbraw/zinc/91/63/35/419916335.db2.gz	BEQLZSPBZCEFHG-JWFUOXDNSA-N	1	1	304.350	1.119	20	5		DDBDMO
C[NH2+]CCCN(C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000420393941	420258685	/nfs/dbraw/zinc/25/86/85/420258685.db2.gz	ZEVMSNJGRKJLKV-UHFFFAOYSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](CCO)C[C@H]1C	ZINC000416291931	420310514	/nfs/dbraw/zinc/31/05/14/420310514.db2.gz	IFTBUKDPRHEWEQ-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](CCO)C[C@H]1C	ZINC000416291931	420310516	/nfs/dbraw/zinc/31/05/16/420310516.db2.gz	IFTBUKDPRHEWEQ-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000416294087	420311675	/nfs/dbraw/zinc/31/16/75/420311675.db2.gz	KOZFTFHJLBULLF-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000416294087	420311678	/nfs/dbraw/zinc/31/16/78/420311678.db2.gz	KOZFTFHJLBULLF-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](c3nnc[nH]3)C2)cc1	ZINC000425549782	420416529	/nfs/dbraw/zinc/41/65/29/420416529.db2.gz	ODALTHWXPCWRDP-LLVKDONJSA-N	1	1	303.322	1.581	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000417759892	420470800	/nfs/dbraw/zinc/47/08/00/420470800.db2.gz	FKUKPPAOAPKPAT-UHFFFAOYSA-N	1	1	302.281	1.031	20	5		DDBDMO
Cc1nn(C)c(NCCN2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000440681135	420596218	/nfs/dbraw/zinc/59/62/18/420596218.db2.gz	ZJVCYOLEEDUNDZ-UHFFFAOYSA-N	1	1	310.402	1.075	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452068838	420621298	/nfs/dbraw/zinc/62/12/98/420621298.db2.gz	PEASLJKCXMQBOJ-ZWNOBZJWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](O)C1	ZINC000452068838	420621301	/nfs/dbraw/zinc/62/13/01/420621301.db2.gz	PEASLJKCXMQBOJ-ZWNOBZJWSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000452069542	420621487	/nfs/dbraw/zinc/62/14/87/420621487.db2.gz	QCBAGQNWARKFBT-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000452069542	420621490	/nfs/dbraw/zinc/62/14/90/420621490.db2.gz	QCBAGQNWARKFBT-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](CO)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@H](C)O	ZINC000444686813	420759855	/nfs/dbraw/zinc/75/98/55/420759855.db2.gz	UEMOKZFSLIMOIA-ZJUUUORDSA-N	1	1	308.338	1.035	20	5		DDBDMO
C[C@H](CO)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@H](C)O	ZINC000444686813	420759858	/nfs/dbraw/zinc/75/98/58/420759858.db2.gz	UEMOKZFSLIMOIA-ZJUUUORDSA-N	1	1	308.338	1.035	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CCC[C@@H](CC[NH3+])C1	ZINC000443058084	420739506	/nfs/dbraw/zinc/73/95/06/420739506.db2.gz	JBRPLIPMNVTHFZ-ZDUSSCGKSA-N	1	1	320.393	1.903	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1CCO	ZINC000454142738	420805186	/nfs/dbraw/zinc/80/51/86/420805186.db2.gz	IWBQIAQGBZPNLR-TXEJJXNPSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1CCO	ZINC000454142738	420805188	/nfs/dbraw/zinc/80/51/88/420805188.db2.gz	IWBQIAQGBZPNLR-TXEJJXNPSA-N	1	1	322.365	1.514	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000493623088	420899211	/nfs/dbraw/zinc/89/92/11/420899211.db2.gz	MJQDXRKJYRKIGC-GCLPIYDQSA-N	1	1	311.288	1.674	20	5		DDBDMO
CCOC[C@H]1CCCC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000459706768	420853184	/nfs/dbraw/zinc/85/31/84/420853184.db2.gz	JEAHJLPCSPMOSU-OCCSQVGLSA-N	1	1	312.370	1.043	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@H](O)[C@H](CO)C3)o2)cc1	ZINC000459718389	420856337	/nfs/dbraw/zinc/85/63/37/420856337.db2.gz	XHCSYBPJSKIOHS-WFASDCNBSA-N	1	1	318.329	1.640	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@@H+](Cc2ccccc2[N+](=O)[O-])CC12COC2	ZINC000449355951	420996444	/nfs/dbraw/zinc/99/64/44/420996444.db2.gz	ALSZDKBBTFKIBP-ZDUSSCGKSA-N	1	1	320.345	1.606	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)cc1	ZINC000449430240	421011739	/nfs/dbraw/zinc/01/17/39/421011739.db2.gz	BVOPQTGUJLKBIW-NUEKZKHPSA-N	1	1	306.362	1.957	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000488725758	421108083	/nfs/dbraw/zinc/10/80/83/421108083.db2.gz	BDKBKHIBIKDFHE-NWDGAFQWSA-N	1	1	307.350	1.260	20	5		DDBDMO
Cc1cccc(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000456229012	421129036	/nfs/dbraw/zinc/12/90/36/421129036.db2.gz	RJVQLRLXIUTFIF-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000456229012	421129038	/nfs/dbraw/zinc/12/90/38/421129038.db2.gz	RJVQLRLXIUTFIF-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1cc(NC[C@H]2CCC[N@H+]2CCCO)ccc1[N+](=O)[O-]	ZINC000450602007	421216431	/nfs/dbraw/zinc/21/64/31/421216431.db2.gz	ZJGHGKZBZXLEQO-CYBMUJFWSA-N	1	1	309.366	1.862	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000561084002	421305496	/nfs/dbraw/zinc/30/54/96/421305496.db2.gz	XMRPGORDHCCTPW-UHFFFAOYSA-N	1	1	320.393	1.855	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CC[C@@H](C)C2)c1	ZINC000524775178	421270093	/nfs/dbraw/zinc/27/00/93/421270093.db2.gz	UOMAYEATFSEXHI-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649904	421443127	/nfs/dbraw/zinc/44/31/27/421443127.db2.gz	OCLZXUWIPLSZRH-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649904	421443129	/nfs/dbraw/zinc/44/31/29/421443129.db2.gz	OCLZXUWIPLSZRH-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1CN(C)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000514649904	421443134	/nfs/dbraw/zinc/44/31/34/421443134.db2.gz	OCLZXUWIPLSZRH-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
CNc1nccc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000563547528	421520154	/nfs/dbraw/zinc/52/01/54/421520154.db2.gz	VNYFWYKXLQCKLU-GHMZBOCLSA-N	1	1	321.381	1.586	20	5		DDBDMO
CC1(C)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000570474795	421647348	/nfs/dbraw/zinc/64/73/48/421647348.db2.gz	BTTQFYAGXNHYES-CQSZACIVSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC1(C)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000570474795	421647352	/nfs/dbraw/zinc/64/73/52/421647352.db2.gz	BTTQFYAGXNHYES-CQSZACIVSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cn2)CCCO1	ZINC000555762498	421690271	/nfs/dbraw/zinc/69/02/71/421690271.db2.gz	SKVXZIHZEGMDDH-GFCCVEGCSA-N	1	1	322.365	1.221	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cn3)C2)C1	ZINC000572672817	421810619	/nfs/dbraw/zinc/81/06/19/421810619.db2.gz	NKAVBRHCTMFOMV-OAHLLOKOSA-N	1	1	304.350	1.548	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000573932541	422034194	/nfs/dbraw/zinc/03/41/94/422034194.db2.gz	LZKFOPIDQBBXBB-JTQLQIEISA-N	1	1	307.354	1.176	20	5		DDBDMO
C[C@@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1C[N@H+](C)CCO1	ZINC000590694556	422322827	/nfs/dbraw/zinc/32/28/27/422322827.db2.gz	PHMSXOGQHWNILY-ABAIWWIYSA-N	1	1	316.361	2.274	20	5		DDBDMO
C[C@@H](Nc1nccc2cc([N+](=O)[O-])ccc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000590694556	422322833	/nfs/dbraw/zinc/32/28/33/422322833.db2.gz	PHMSXOGQHWNILY-ABAIWWIYSA-N	1	1	316.361	2.274	20	5		DDBDMO
CC1=CC[N@@H+](CCNc2cccc(C(N)=O)c2[N+](=O)[O-])CC1	ZINC000342850685	271542633	/nfs/dbraw/zinc/54/26/33/271542633.db2.gz	OYJMGFQDOAVMGG-UHFFFAOYSA-N	1	1	304.350	1.758	20	5		DDBDMO
CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])nc1	ZINC000344444381	272028375	/nfs/dbraw/zinc/02/83/75/272028375.db2.gz	YAEIFGITPZMRMW-CYBMUJFWSA-N	1	1	321.381	1.344	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-]	ZINC000344618703	272071988	/nfs/dbraw/zinc/07/19/88/272071988.db2.gz	PSFYCCFLWSFHBT-NSHDSACASA-N	1	1	323.397	1.731	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCN(c3[nH+]ccn3C)CC2)c1	ZINC000266730693	274118291	/nfs/dbraw/zinc/11/82/91/274118291.db2.gz	NRUWUOBOVLUWIS-UHFFFAOYSA-N	1	1	317.349	1.664	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](C(N)=O)C1	ZINC000187394372	274301958	/nfs/dbraw/zinc/30/19/58/274301958.db2.gz	VDXXBHKNNKMMFG-YPMHNXCESA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](C(N)=O)C1	ZINC000187394372	274301959	/nfs/dbraw/zinc/30/19/59/274301959.db2.gz	VDXXBHKNNKMMFG-YPMHNXCESA-N	1	1	307.350	1.559	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000286001992	277152684	/nfs/dbraw/zinc/15/26/84/277152684.db2.gz	ZAJJBUZCMFAFCU-KBPBESRZSA-N	1	1	305.334	1.140	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)[C@@H]2C1	ZINC000272188277	277178326	/nfs/dbraw/zinc/17/83/26/277178326.db2.gz	LOSVBPJDZDEBNU-JOYOIKCWSA-N	1	1	303.322	1.661	20	5		DDBDMO
COCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC(=O)N(C)C	ZINC000114562487	277217071	/nfs/dbraw/zinc/21/70/71/277217071.db2.gz	GUZOTUFOTSLHEJ-UHFFFAOYSA-N	1	1	309.366	1.174	20	5		DDBDMO
COCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC(=O)N(C)C	ZINC000114562487	277217072	/nfs/dbraw/zinc/21/70/72/277217072.db2.gz	GUZOTUFOTSLHEJ-UHFFFAOYSA-N	1	1	309.366	1.174	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000285240749	278267099	/nfs/dbraw/zinc/26/70/99/278267099.db2.gz	YTCZNHNAMAGKDY-AXFHLTTASA-N	1	1	309.370	1.414	20	5		DDBDMO
CC(C)[C@@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000487048853	280016355	/nfs/dbraw/zinc/01/63/55/280016355.db2.gz	QYMHPALAQVKSDE-AWEZNQCLSA-N	1	1	306.366	1.470	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933164	281030016	/nfs/dbraw/zinc/03/00/16/281030016.db2.gz	DLNGUECRMIZDCE-STQMWFEESA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933164	281030017	/nfs/dbraw/zinc/03/00/17/281030017.db2.gz	DLNGUECRMIZDCE-STQMWFEESA-N	1	1	321.377	1.650	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000128326866	281307458	/nfs/dbraw/zinc/30/74/58/281307458.db2.gz	XNKZMBPLNFXASI-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000128326866	281307462	/nfs/dbraw/zinc/30/74/62/281307462.db2.gz	XNKZMBPLNFXASI-NSHDSACASA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000354745193	306785558	/nfs/dbraw/zinc/78/55/58/306785558.db2.gz	YTOGOFQHRPEAPT-LLVKDONJSA-N	1	1	322.365	1.018	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000362982490	300193751	/nfs/dbraw/zinc/19/37/51/300193751.db2.gz	MEEQCJVGNRZGER-GWCFXTLKSA-N	1	1	304.350	1.072	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2CC([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1	ZINC000368440215	301028232	/nfs/dbraw/zinc/02/82/32/301028232.db2.gz	BCPRAQLQHRHTJP-LLVKDONJSA-N	1	1	307.306	1.971	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1	ZINC000377767454	302229087	/nfs/dbraw/zinc/22/90/87/302229087.db2.gz	MWILFINXCYXDFK-KGLIPLIRSA-N	1	1	306.366	1.825	20	5		DDBDMO
O=[N+]([O-])c1ccn(CCN2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@H]3C2)n1	ZINC000377963504	302257856	/nfs/dbraw/zinc/25/78/56/302257856.db2.gz	UYDKLOYVNBJCGI-HZSPNIEDSA-N	1	1	305.382	1.207	20	5		DDBDMO
[NH3+]CC(F)(F)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000521637587	302878246	/nfs/dbraw/zinc/87/82/46/302878246.db2.gz	WOCCCSJWIOCQNE-UHFFFAOYSA-N	1	1	302.281	1.107	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NCC[N@H+]2CC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000532913476	303301860	/nfs/dbraw/zinc/30/18/60/303301860.db2.gz	FHWDBHZJXBSXAP-JTQLQIEISA-N	1	1	309.370	1.513	20	5		DDBDMO
C[N@H+](CCN1C[C@H]2CC[C@@H](C1)O2)Cc1ccccc1[N+](=O)[O-]	ZINC000367592593	307099194	/nfs/dbraw/zinc/09/91/94/307099194.db2.gz	FETHYIYKHFZQKC-GASCZTMLSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[N@@H+](CCN1C[C@H]2CC[C@@H](C1)O2)Cc1ccccc1[N+](=O)[O-]	ZINC000367592593	307099195	/nfs/dbraw/zinc/09/91/95/307099195.db2.gz	FETHYIYKHFZQKC-GASCZTMLSA-N	1	1	305.378	1.890	20	5		DDBDMO
CN(CC[N@H+]1C[C@H]2CC[C@@H](C1)O2)Cc1ccccc1[N+](=O)[O-]	ZINC000367592593	307099196	/nfs/dbraw/zinc/09/91/96/307099196.db2.gz	FETHYIYKHFZQKC-GASCZTMLSA-N	1	1	305.378	1.890	20	5		DDBDMO
CN(CC[N@@H+]1C[C@H]2CC[C@@H](C1)O2)Cc1ccccc1[N+](=O)[O-]	ZINC000367592593	307099197	/nfs/dbraw/zinc/09/91/97/307099197.db2.gz	FETHYIYKHFZQKC-GASCZTMLSA-N	1	1	305.378	1.890	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)O1	ZINC000372614289	307172459	/nfs/dbraw/zinc/17/24/59/307172459.db2.gz	SOSIMKCGHGWBOV-HNNXBMFYSA-N	1	1	305.334	1.712	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000372658336	307172691	/nfs/dbraw/zinc/17/26/91/307172691.db2.gz	YAFABQJYWLYJIZ-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000372658336	307172692	/nfs/dbraw/zinc/17/26/92/307172692.db2.gz	YAFABQJYWLYJIZ-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000372658336	307172693	/nfs/dbraw/zinc/17/26/93/307172693.db2.gz	YAFABQJYWLYJIZ-RRFJBIMHSA-N	1	1	303.362	1.432	20	5		DDBDMO
CCOCC[C@@H](O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000373105549	307178731	/nfs/dbraw/zinc/17/87/31/307178731.db2.gz	AMDVVFHJZAYRGF-GXTWGEPZSA-N	1	1	312.370	1.216	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@](O)(C3CC3)C2)c1	ZINC000373907800	307198052	/nfs/dbraw/zinc/19/80/52/307198052.db2.gz	GQMQEIDHNYGMMN-GOEBONIOSA-N	1	1	322.361	1.181	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000374297896	307205103	/nfs/dbraw/zinc/20/51/03/307205103.db2.gz	SDQAQDNASQPLST-SNVBAGLBSA-N	1	1	313.321	1.365	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000376268383	307241993	/nfs/dbraw/zinc/24/19/93/307241993.db2.gz	VKHIKEGCHHZLGN-FZMZJTMJSA-N	1	1	308.338	1.066	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+]2C[C@H](O)C[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000412036303	307298618	/nfs/dbraw/zinc/29/86/18/307298618.db2.gz	MHNDMTOVROIHGC-CYZMBNFOSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@H](O)C[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000412036303	307298619	/nfs/dbraw/zinc/29/86/19/307298619.db2.gz	MHNDMTOVROIHGC-CYZMBNFOSA-N	1	1	321.377	1.933	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595875512	490371924	/nfs/dbraw/zinc/37/19/24/490371924.db2.gz	QIPYMBLZMCVMNE-ABAIWWIYSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595875512	490371932	/nfs/dbraw/zinc/37/19/32/490371932.db2.gz	QIPYMBLZMCVMNE-ABAIWWIYSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cc1c(CN2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000419331794	533846765	/nfs/dbraw/zinc/84/67/65/533846765.db2.gz	RUTJOXPZBVJYDN-OLZOCXBDSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@]12C[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000452055517	534189867	/nfs/dbraw/zinc/18/98/67/534189867.db2.gz	UMDLCUOOHJWRKQ-ZLTXHLNPSA-N	1	1	320.393	1.520	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](O)[C@H](CO)C1	ZINC000414564656	527502232	/nfs/dbraw/zinc/50/22/32/527502232.db2.gz	XVSSKKCMRHFVMZ-ZFYLUOEISA-N	1	1	306.362	1.673	20	5		DDBDMO
CCC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC	ZINC000337319383	535314839	/nfs/dbraw/zinc/31/48/39/535314839.db2.gz	AFAUSKIRLHWFOS-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC	ZINC000337319383	535314844	/nfs/dbraw/zinc/31/48/44/535314844.db2.gz	AFAUSKIRLHWFOS-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119755856	696685238	/nfs/dbraw/zinc/68/52/38/696685238.db2.gz	HAWKSSPNVJNQFF-UHFFFAOYSA-N	1	1	321.424	1.667	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCCC[NH+]1CCOCC1	ZINC000748495572	700122038	/nfs/dbraw/zinc/12/20/38/700122038.db2.gz	SXWCNHGSDDHKSX-DAXSKMNVSA-N	1	1	320.345	1.874	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)NCC(F)(F)C[NH3+])c1[N+](=O)[O-]	ZINC000193313158	697659159	/nfs/dbraw/zinc/65/91/59/697659159.db2.gz	HSRCVAPFFOTLPB-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
O=C1Nc2ccccc2[C@@]12CC[N@@H+](Cn1cc([N+](=O)[O-])cn1)C2	ZINC000777555472	698201347	/nfs/dbraw/zinc/20/13/47/698201347.db2.gz	BMYLPMCCXQGGIS-HNNXBMFYSA-N	1	1	313.317	1.345	20	5		DDBDMO
O=C1Nc2ccccc2[C@@]12CC[N@H+](Cn1cc([N+](=O)[O-])cn1)C2	ZINC000777555472	698201349	/nfs/dbraw/zinc/20/13/49/698201349.db2.gz	BMYLPMCCXQGGIS-HNNXBMFYSA-N	1	1	313.317	1.345	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000778275935	698255576	/nfs/dbraw/zinc/25/55/76/698255576.db2.gz	PUNVBKXZXPYOAW-UHFFFAOYSA-N	1	1	323.378	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC(=S)NCC[N@H+]2CCCOCC2)cc1	ZINC000782210858	698696626	/nfs/dbraw/zinc/69/66/26/698696626.db2.gz	UQIJRBHCSJSVMT-UHFFFAOYSA-N	1	1	324.406	1.604	20	5		DDBDMO
COc1cc(C[NH2+]C[C@H](O)C(F)(F)F)c([N+](=O)[O-])cc1OC	ZINC000788975748	699352436	/nfs/dbraw/zinc/35/24/36/699352436.db2.gz	PZDBZHNQVAQMTR-NSHDSACASA-N	1	1	324.255	1.625	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@H]2C)c1	ZINC000742242477	699869898	/nfs/dbraw/zinc/86/98/98/699869898.db2.gz	WDQZKQIIZDCWIT-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1cccc2c1CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000743846580	699928654	/nfs/dbraw/zinc/92/86/54/699928654.db2.gz	OCBGFFJQNBBRGW-HNNXBMFYSA-N	1	1	316.361	1.519	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000802141599	700372158	/nfs/dbraw/zinc/37/21/58/700372158.db2.gz	XPUHFYDNMJHTGY-CQSZACIVSA-N	1	1	322.361	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)[C@@H](C)C1	ZINC000761077258	700840395	/nfs/dbraw/zinc/84/03/95/700840395.db2.gz	NSJRNHKQSISBLY-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)[C@@H](C)C1	ZINC000761077093	700840459	/nfs/dbraw/zinc/84/04/59/700840459.db2.gz	MWUKMYPUXFOCSA-NWDGAFQWSA-N	1	1	306.366	1.558	20	5		DDBDMO
O=C(CC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CC1	ZINC000767361267	701100952	/nfs/dbraw/zinc/10/09/52/701100952.db2.gz	LARPATDVEMPVIN-UHFFFAOYSA-N	1	1	304.350	1.481	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@@H]1C[N@H+](C)CCO1	ZINC000770474561	701279504	/nfs/dbraw/zinc/27/95/04/701279504.db2.gz	BLXWGIBIDQMIGU-KWQFWETISA-N	1	1	307.310	1.262	20	5		DDBDMO
C[C@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000770474561	701279505	/nfs/dbraw/zinc/27/95/05/701279505.db2.gz	BLXWGIBIDQMIGU-KWQFWETISA-N	1	1	307.310	1.262	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCOC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000840222262	702034073	/nfs/dbraw/zinc/03/40/73/702034073.db2.gz	BYJMBODSGDPZBW-LBPRGKRZSA-N	1	1	310.354	1.599	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@@H+]2CCCN3c4ccccc4C[C@H]3C2)c1	ZINC000811783770	702057340	/nfs/dbraw/zinc/05/73/40/702057340.db2.gz	JNFXRUNLBUULPB-AWEZNQCLSA-N	1	1	313.361	1.886	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@H+]2CCCN3c4ccccc4C[C@H]3C2)c1	ZINC000811783770	702057345	/nfs/dbraw/zinc/05/73/45/702057345.db2.gz	JNFXRUNLBUULPB-AWEZNQCLSA-N	1	1	313.361	1.886	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2CCC[N@H+]2Cc2ccccc21	ZINC000841066294	702333480	/nfs/dbraw/zinc/33/34/80/702333480.db2.gz	ZYVJESPAMCDDBT-GZBFAFLISA-N	1	1	301.346	1.663	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000817679647	702449091	/nfs/dbraw/zinc/44/90/91/702449091.db2.gz	VENUOKWZJGOQBL-KGLIPLIRSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000831550077	706729647	/nfs/dbraw/zinc/72/96/47/706729647.db2.gz	JNXXETJKHKSAAY-CQSZACIVSA-N	1	1	305.334	1.006	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000818978641	704041041	/nfs/dbraw/zinc/04/10/41/704041041.db2.gz	XUUTXXOVYBHXKP-LLVKDONJSA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000818978641	704041042	/nfs/dbraw/zinc/04/10/42/704041042.db2.gz	XUUTXXOVYBHXKP-LLVKDONJSA-N	1	1	322.321	1.669	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000852498157	704063516	/nfs/dbraw/zinc/06/35/16/704063516.db2.gz	ZSNVSCGAGKAOQS-MFKMUULPSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3cc(F)ccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000852498157	704063518	/nfs/dbraw/zinc/06/35/18/704063518.db2.gz	ZSNVSCGAGKAOQS-MFKMUULPSA-N	1	1	307.325	1.834	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000852701695	704102696	/nfs/dbraw/zinc/10/26/96/704102696.db2.gz	DXFSUVZJJPASQZ-QMTHXVAHSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000852701695	704102697	/nfs/dbraw/zinc/10/26/97/704102697.db2.gz	DXFSUVZJJPASQZ-QMTHXVAHSA-N	1	1	309.322	1.953	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)[C@@H](C)C2)c([N+](=O)[O-])cc1C	ZINC000853485663	704247531	/nfs/dbraw/zinc/24/75/31/704247531.db2.gz	NACBTAGHYXXBGC-LBPRGKRZSA-N	1	1	309.366	1.415	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)[C@@H](C)C2)c([N+](=O)[O-])cc1C	ZINC000853485663	704247534	/nfs/dbraw/zinc/24/75/34/704247534.db2.gz	NACBTAGHYXXBGC-LBPRGKRZSA-N	1	1	309.366	1.415	20	5		DDBDMO
COc1cc(N2CC([N@@H+]3CC[C@@H](O)C3)C2)c([N+](=O)[O-])cc1C	ZINC000853713912	704303946	/nfs/dbraw/zinc/30/39/46/704303946.db2.gz	RPVMJGZLHCNFPJ-GFCCVEGCSA-N	1	1	307.350	1.167	20	5		DDBDMO
COc1cc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c([N+](=O)[O-])cc1C	ZINC000853713912	704303948	/nfs/dbraw/zinc/30/39/48/704303948.db2.gz	RPVMJGZLHCNFPJ-GFCCVEGCSA-N	1	1	307.350	1.167	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000855164307	704471905	/nfs/dbraw/zinc/47/19/05/704471905.db2.gz	HZWMLGKGQDZONT-NSHDSACASA-N	1	1	306.366	1.780	20	5		DDBDMO
CC[N@@H+](CCNc1nccc(C(=O)OC)c1[N+](=O)[O-])C(C)C	ZINC000856728439	704535555	/nfs/dbraw/zinc/53/55/55/704535555.db2.gz	SSOUGCGPUFZGBZ-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
Nc1ncc2c(n1)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000857926359	704643533	/nfs/dbraw/zinc/64/35/33/704643533.db2.gz	UBHPETIFHJRCIU-AWEZNQCLSA-N	1	1	315.333	1.059	20	5		DDBDMO
Nc1ncc2c(n1)C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000857926359	704643535	/nfs/dbraw/zinc/64/35/35/704643535.db2.gz	UBHPETIFHJRCIU-AWEZNQCLSA-N	1	1	315.333	1.059	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000874823242	705182212	/nfs/dbraw/zinc/18/22/12/705182212.db2.gz	GVSKQFHBATWMDZ-KBPBESRZSA-N	1	1	321.352	1.972	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000823987727	705350352	/nfs/dbraw/zinc/35/03/52/705350352.db2.gz	QREMFNOKEWKNCH-ONGXEEELSA-N	1	1	307.354	1.781	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CCCC[N@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000862792430	705799360	/nfs/dbraw/zinc/79/93/60/705799360.db2.gz	VHPUCENWAHWFBS-GFCCVEGCSA-N	1	1	320.393	1.947	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(OC[C@@H]3CCCO3)CC2)c([N+](=O)[O-])n1	ZINC000876650407	705802144	/nfs/dbraw/zinc/80/21/44/705802144.db2.gz	RKKJJYZREOBJRR-AWEZNQCLSA-N	1	1	324.381	1.488	20	5		DDBDMO
C[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@H]1C[C@@H](C(N)=O)C1	ZINC000863322201	705900957	/nfs/dbraw/zinc/90/09/57/705900957.db2.gz	POPNVOBCMPGHCR-KLPPZKSPSA-N	1	1	303.322	1.098	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC[C@@H]21	ZINC000827338035	705979646	/nfs/dbraw/zinc/97/96/46/705979646.db2.gz	NADCRRXYAWFPCD-SKDRFNHKSA-N	1	1	322.340	1.482	20	5		DDBDMO
CCOC(=O)[C@@H](C)C1C[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000871993183	707272466	/nfs/dbraw/zinc/27/24/66/707272466.db2.gz	MHTJCIKNHLKMQT-NHYWBVRUSA-N	1	1	322.361	1.759	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](c3nccn3C)C2)c([N+](=O)[O-])n1	ZINC000877481126	706118562	/nfs/dbraw/zinc/11/85/62/706118562.db2.gz	VSUMMNRUUWXCCA-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCC(C)(C)[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000829736424	706386122	/nfs/dbraw/zinc/38/61/22/706386122.db2.gz	IKKYZFNWBMQDEL-GFCCVEGCSA-N	1	1	315.414	1.126	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1	ZINC000865999004	706589815	/nfs/dbraw/zinc/58/98/15/706589815.db2.gz	VXIKYXUKOCTFKR-JTQLQIEISA-N	1	1	314.773	1.900	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136796	706887850	/nfs/dbraw/zinc/88/78/50/706887850.db2.gz	SGDINAJZXIAXOI-OAGGEKHMSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136796	706887853	/nfs/dbraw/zinc/88/78/53/706887853.db2.gz	SGDINAJZXIAXOI-OAGGEKHMSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CCC[C@@H]2[C@H]1CC[N@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880136796	706887856	/nfs/dbraw/zinc/88/78/56/706887856.db2.gz	SGDINAJZXIAXOI-OAGGEKHMSA-N	1	1	305.378	1.797	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCCCCCNC(=O)CC2)c(C)c1[N+](=O)[O-]	ZINC000872663245	707544473	/nfs/dbraw/zinc/54/44/73/707544473.db2.gz	HYSQKLKARNCDNV-UHFFFAOYSA-N	1	1	323.397	1.748	20	5		DDBDMO
Cc1nn(C[N@H+]2CCCCCCNC(=O)CC2)c(C)c1[N+](=O)[O-]	ZINC000872663245	707544475	/nfs/dbraw/zinc/54/44/75/707544475.db2.gz	HYSQKLKARNCDNV-UHFFFAOYSA-N	1	1	323.397	1.748	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000882481237	707651228	/nfs/dbraw/zinc/65/12/28/707651228.db2.gz	AARWEMUGVOGANQ-LLVKDONJSA-N	1	1	302.334	1.900	20	5		DDBDMO
C[N@@H+](CCNc1c(F)cc([N+](=O)[O-])cc1F)CCOCCO	ZINC000882951963	707868686	/nfs/dbraw/zinc/86/86/86/707868686.db2.gz	CYIRJADKITXTBN-UHFFFAOYSA-N	1	1	319.308	1.226	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C	ZINC000882959994	707874042	/nfs/dbraw/zinc/87/40/42/707874042.db2.gz	WHYPWGYSSIIWOZ-JTQLQIEISA-N	1	1	319.365	1.291	20	5		DDBDMO
O=C(NC[C@@H](c1cccs1)[NH+]1CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839461966	708049391	/nfs/dbraw/zinc/04/93/91/708049391.db2.gz	AFTAHLQBBVQCNW-UTUOFQBUSA-N	1	1	309.391	1.666	20	5		DDBDMO
C[C@H](CNC(=O)[C@]1(C)C[C@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000887399069	709036648	/nfs/dbraw/zinc/03/66/48/709036648.db2.gz	MBGMKGZHPLNGQO-WQGACYEGSA-N	1	1	321.377	1.270	20	5		DDBDMO
C[N@@H+](CCO)CCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC000899741982	709186333	/nfs/dbraw/zinc/18/63/33/709186333.db2.gz	YGEQLCMSFLOOHF-UHFFFAOYSA-N	1	1	321.377	1.057	20	5		DDBDMO
C[C@H](NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000892112655	710374227	/nfs/dbraw/zinc/37/42/27/710374227.db2.gz	UEZCKTLOXKANKH-FPMFFAJLSA-N	1	1	318.377	1.859	20	5		DDBDMO
CCC[C@H]1CN(c2c([N+](=O)[O-])cnn2C)CC[N@H+]1CCOC	ZINC000893055778	710547895	/nfs/dbraw/zinc/54/78/95/710547895.db2.gz	HNANMVQRSRYYMZ-LBPRGKRZSA-N	1	1	311.386	1.265	20	5		DDBDMO
COc1c(O)ccc(CNCC[N@H+]2CC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000893353720	710614104	/nfs/dbraw/zinc/61/41/04/710614104.db2.gz	BPMTVAVBOSOGHR-NSHDSACASA-N	1	1	309.366	1.740	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]CCN2CC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000893353720	710614106	/nfs/dbraw/zinc/61/41/06/710614106.db2.gz	BPMTVAVBOSOGHR-NSHDSACASA-N	1	1	309.366	1.740	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928446191	713199852	/nfs/dbraw/zinc/19/98/52/713199852.db2.gz	VCVPHJQOJPNRSR-NOZJJQNGSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000928455742	713204630	/nfs/dbraw/zinc/20/46/30/713204630.db2.gz	UMMYINBGMWZOOQ-GWCFXTLKSA-N	1	1	306.366	1.483	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)C1	ZINC000913385147	713206598	/nfs/dbraw/zinc/20/65/98/713206598.db2.gz	RFZJHNOKWRKRPD-VIFPVBQESA-N	1	1	315.732	1.955	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F	ZINC000911475766	710814049	/nfs/dbraw/zinc/81/40/49/710814049.db2.gz	ITEJLNQOXORDBP-UHFFFAOYSA-N	1	1	301.293	1.831	20	5		DDBDMO
COc1cc([C@H](C)NC[C@]2(O)CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000903154148	711049790	/nfs/dbraw/zinc/04/97/90/711049790.db2.gz	TVNDCMKFHJZYMU-XHDPSFHLSA-N	1	1	309.366	1.321	20	5		DDBDMO
COc1cc([C@H](C)[NH2+]C[C@]2(O)CCN(C)C2)cc([N+](=O)[O-])c1	ZINC000903154148	711049794	/nfs/dbraw/zinc/04/97/94/711049794.db2.gz	TVNDCMKFHJZYMU-XHDPSFHLSA-N	1	1	309.366	1.321	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@H]1CC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318420	711096057	/nfs/dbraw/zinc/09/60/57/711096057.db2.gz	PMQIJENKOFUFDS-HUUCEWRRSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@H]1CC[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318420	711096059	/nfs/dbraw/zinc/09/60/59/711096059.db2.gz	PMQIJENKOFUFDS-HUUCEWRRSA-N	1	1	315.377	1.711	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2N[C@H]2Cc3c[nH+]cn3C2)s1	ZINC000894996778	711356608	/nfs/dbraw/zinc/35/66/08/711356608.db2.gz	QBDGEERUUOCUEB-ZETCQYMHSA-N	1	1	302.319	1.833	20	5		DDBDMO
C[C@H]1[C@@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737551	711590928	/nfs/dbraw/zinc/59/09/28/711590928.db2.gz	BJCXSFDWTZCKML-JQWIXIFHSA-N	1	1	316.361	1.951	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F	ZINC000895771350	711601912	/nfs/dbraw/zinc/60/19/12/711601912.db2.gz	YXDHAYSALHHMNH-NSHDSACASA-N	1	1	324.356	1.687	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1F	ZINC000895771350	711601914	/nfs/dbraw/zinc/60/19/14/711601914.db2.gz	YXDHAYSALHHMNH-NSHDSACASA-N	1	1	324.356	1.687	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)C[C@]2(C)C1	ZINC000904437673	711858228	/nfs/dbraw/zinc/85/82/28/711858228.db2.gz	SGJFBPSHRIRLTQ-CJNGLKHVSA-N	1	1	315.377	1.786	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000914325477	713378825	/nfs/dbraw/zinc/37/88/25/713378825.db2.gz	LECWURGBXPVETF-FZMZJTMJSA-N	1	1	306.366	1.529	20	5		DDBDMO
CCOc1ccccc1C[N@@H+]1CCN(CC[N+](=O)[O-])[C@H](C)C1	ZINC000930321997	713802972	/nfs/dbraw/zinc/80/29/72/713802972.db2.gz	BUABQDDBRBKQQY-CQSZACIVSA-N	1	1	307.394	1.868	20	5		DDBDMO
CCOc1ccccc1C[N@H+]1CCN(CC[N+](=O)[O-])[C@H](C)C1	ZINC000930321997	713802975	/nfs/dbraw/zinc/80/29/75/713802975.db2.gz	BUABQDDBRBKQQY-CQSZACIVSA-N	1	1	307.394	1.868	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@@H](C)C[N@H+]1CCC[C@@H](C)C1	ZINC000930544323	713862741	/nfs/dbraw/zinc/86/27/41/713862741.db2.gz	FZPHLQURULSURK-NEPJUHHUSA-N	1	1	323.397	1.336	20	5		DDBDMO
O=[N+]([O-])CCN1CCO[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]21	ZINC000930849529	713937056	/nfs/dbraw/zinc/93/70/56/713937056.db2.gz	NISJLVXVZGMSAN-JKSUJKDBSA-N	1	1	305.378	1.238	20	5		DDBDMO
COc1cc(CN[C@@H]2CC[N@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557440	714087695	/nfs/dbraw/zinc/08/76/95/714087695.db2.gz	OEOVQLIWOIYUAL-ZYHUDNBSSA-N	1	1	309.366	1.794	20	5		DDBDMO
COc1cc(CN[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557440	714087700	/nfs/dbraw/zinc/08/77/00/714087700.db2.gz	OEOVQLIWOIYUAL-ZYHUDNBSSA-N	1	1	309.366	1.794	20	5		DDBDMO
C[NH+](C)CC1(O)CCN(CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000931484530	714108395	/nfs/dbraw/zinc/10/83/95/714108395.db2.gz	PZWUNWBXQJMBQN-UHFFFAOYSA-N	1	1	323.393	1.362	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](C3OCCO3)C2)cc1	ZINC000932007474	714232638	/nfs/dbraw/zinc/23/26/38/714232638.db2.gz	GOUHXGZNELCSAZ-GFCCVEGCSA-N	1	1	308.334	1.668	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1c1ccnn1C	ZINC000932262639	714294621	/nfs/dbraw/zinc/29/46/21/714294621.db2.gz	OHGDIYCXSXNOQT-ZDUSSCGKSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1c1ccnn1C	ZINC000932262639	714294622	/nfs/dbraw/zinc/29/46/22/714294622.db2.gz	OHGDIYCXSXNOQT-ZDUSSCGKSA-N	1	1	304.354	1.670	20	5		DDBDMO
CN(C(=O)CN1CC[C@H](CC[NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000923486169	714372381	/nfs/dbraw/zinc/37/23/81/714372381.db2.gz	CAVDQWMHPAMTGZ-LBPRGKRZSA-N	1	1	306.366	1.228	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C)C[C@@H]1CC(C)C	ZINC000933251078	714547068	/nfs/dbraw/zinc/54/70/68/714547068.db2.gz	JJVCDCSFNCSVHN-AWEZNQCLSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCN(C)C[C@@H]1CC(C)C	ZINC000933251078	714547072	/nfs/dbraw/zinc/54/70/72/714547072.db2.gz	JJVCDCSFNCSVHN-AWEZNQCLSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCN(C)C[C@@H]1CC(C)C	ZINC000933251078	714547074	/nfs/dbraw/zinc/54/70/74/714547074.db2.gz	JJVCDCSFNCSVHN-AWEZNQCLSA-N	1	1	309.414	1.762	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000933735323	714658554	/nfs/dbraw/zinc/65/85/54/714658554.db2.gz	HFXIGNMSBPRNSW-KBMXLJTQSA-N	1	1	305.378	1.512	20	5		DDBDMO
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)cc1[N+](=O)[O-]	ZINC000934271841	714782691	/nfs/dbraw/zinc/78/26/91/714782691.db2.gz	HFENQDOAEIMLST-JKSUJKDBSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@H]2[C@@H](CCC[N@@H+]2C)C1	ZINC000934889914	714925051	/nfs/dbraw/zinc/92/50/51/714925051.db2.gz	KUJIQDSEROSXDY-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1cc(C[NH2+]C2(C)CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)on1	ZINC000940107308	716626743	/nfs/dbraw/zinc/62/67/43/716626743.db2.gz	HRVPDUZABALRFE-CHWSQXEVSA-N	1	1	322.365	1.119	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000351508210	719250253	/nfs/dbraw/zinc/25/02/53/719250253.db2.gz	GKEJBALPRLSIPC-QWRGUYRKSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000351508210	719250257	/nfs/dbraw/zinc/25/02/57/719250257.db2.gz	GKEJBALPRLSIPC-QWRGUYRKSA-N	1	1	322.365	1.695	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](CO)[C@H](CCO)C1	ZINC001184364205	744020010	/nfs/dbraw/zinc/02/00/10/744020010.db2.gz	OOJSGTIPHGIZPV-VFGVELGVSA-N	1	1	320.389	1.921	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1ncc[nH]1	ZINC001031658771	747331709	/nfs/dbraw/zinc/33/17/09/747331709.db2.gz	WLVYRSWLGPBEMH-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@H]1[C@H]1CCCO1	ZINC001198685216	747577153	/nfs/dbraw/zinc/57/71/53/747577153.db2.gz	HZUCEWJFBCCKJK-LSDHHAIUSA-N	1	1	321.377	1.790	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](CO)[C@@H](CCO)C2)c(Cl)c1	ZINC001198752037	747598983	/nfs/dbraw/zinc/59/89/83/747598983.db2.gz	HZEKDJBMNMFTRD-CMPLNLGQSA-N	1	1	314.769	1.671	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cc[nH+]c(N(C)C)c1	ZINC001127650355	748031840	/nfs/dbraw/zinc/03/18/40/748031840.db2.gz	YZJKKXBNYPDLJW-UHFFFAOYSA-N	1	1	304.310	1.199	20	5		DDBDMO
Cc1noc(C)c1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000996429649	749587871	/nfs/dbraw/zinc/58/78/71/749587871.db2.gz	QXCDLQHHXZEZQV-TZMCWYRMSA-N	1	1	322.365	1.037	20	5		DDBDMO
O=C1c2ccccc2[C@@H]2C[N@@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CCN12	ZINC001169010274	762177976	/nfs/dbraw/zinc/17/79/76/762177976.db2.gz	CCIKQPDPOMNBPE-IOASZLSFSA-N	1	1	315.373	1.945	20	5		DDBDMO
CCNC(=O)CO[C@@H]1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169039940	762193590	/nfs/dbraw/zinc/19/35/90/762193590.db2.gz	WAXJDACLXJLFCZ-MELADBBJSA-N	1	1	313.398	1.049	20	5		DDBDMO
COc1ccc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054469	762209498	/nfs/dbraw/zinc/20/94/98/762209498.db2.gz	MEGADDRCOXJBCA-KCQAQPDRSA-N	1	1	321.377	1.989	20	5		DDBDMO
Cc1ccc(F)cc1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001020138982	760612863	/nfs/dbraw/zinc/61/28/63/760612863.db2.gz	KZZLGVFRTIMCRF-KBUPBQIOSA-N	1	1	321.352	1.536	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](O)[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC001170334409	766256531	/nfs/dbraw/zinc/25/65/31/766256531.db2.gz	DGUXSSZQEXHVRR-GHJWDPDVSA-N	1	1	324.377	1.210	20	5		DDBDMO
COc1ccc(C[C@H](C)N2C[C@@H]3C[C@H]2C[N@H+]3C)c([N+](=O)[O-])c1	ZINC001170354414	766260290	/nfs/dbraw/zinc/26/02/90/766260290.db2.gz	KWEOFSBBEJTLCJ-UBHSHLNASA-N	1	1	305.378	1.923	20	5		DDBDMO
CCC(=O)NCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC001096259772	768799318	/nfs/dbraw/zinc/79/93/18/768799318.db2.gz	JDMZWRQGEZKLCT-UHFFFAOYSA-N	1	1	320.393	1.551	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1cc([N+](=O)[O-])cc(Br)n1	ZINC001170898518	771897976	/nfs/dbraw/zinc/89/79/76/771897976.db2.gz	CTTRMNZXDOHFKW-QMMMGPOBSA-N	1	1	304.148	1.188	20	5		DDBDMO
CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1ccc([N+](=O)[O-])cc1	ZINC001100546784	776292798	/nfs/dbraw/zinc/29/27/98/776292798.db2.gz	QWRXLGQCESAPEZ-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
CCN(CC[NH2+]Cc1ccc(F)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268450387	840211055	/nfs/dbraw/zinc/21/10/55/840211055.db2.gz	VNBSOSNITLXKSA-ZIAGYGMSSA-N	1	1	309.341	1.429	20	5		DDBDMO
CC(C)OCC(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001268703441	840690667	/nfs/dbraw/zinc/69/06/67/840690667.db2.gz	MHVCPTZSSCFOGN-UHFFFAOYSA-N	1	1	321.377	1.568	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@@H]2CCNC(=O)C2)ncc1[N+](=O)[O-]	ZINC001154940071	861588711	/nfs/dbraw/zinc/58/87/11/861588711.db2.gz	LFRQGHVFDLXTIR-DUMNWFOQSA-N	1	1	319.365	1.460	20	5		DDBDMO
CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(F)F	ZINC001319967095	852178228	/nfs/dbraw/zinc/17/82/28/852178228.db2.gz	VPMPFLRWMRYZCW-UHFFFAOYSA-N	1	1	301.293	1.750	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)C(F)F	ZINC001319967095	852178230	/nfs/dbraw/zinc/17/82/30/852178230.db2.gz	VPMPFLRWMRYZCW-UHFFFAOYSA-N	1	1	301.293	1.750	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001325875288	860909193	/nfs/dbraw/zinc/90/91/93/860909193.db2.gz	UILNHUPTGUHFSQ-CVEARBPZSA-N	1	1	308.378	1.969	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCC(=O)OCc2ccc([N+](=O)[O-])cc2)C1	ZINC001224986733	881624929	/nfs/dbraw/zinc/62/49/29/881624929.db2.gz	JTOYNSIIANSEKB-CQSZACIVSA-N	1	1	308.334	1.749	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCc2cccnn2)ncc1[N+](=O)[O-]	ZINC001156603498	863180801	/nfs/dbraw/zinc/18/08/01/863180801.db2.gz	KOEKGLKFTYJDPS-FNORWQNLSA-N	1	1	300.322	1.924	20	5		DDBDMO
O=c1cc[nH]c(O[C@H]2CC[C@H]([NH+]3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC001225666765	881966538	/nfs/dbraw/zinc/96/65/38/881966538.db2.gz	MDGZHQSJZFTQLE-HAQNSBGRSA-N	1	1	323.349	1.718	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])c(C)c1NCCn1cc[nH+]c1C	ZINC001163920083	868792750	/nfs/dbraw/zinc/79/27/50/868792750.db2.gz	QTNLKCVSKJUIKM-UHFFFAOYSA-N	1	1	319.321	1.702	20	5		DDBDMO
Cc1[nH]c(=O)nc(O[C@H](C)C[N+](C)(C)C)c1Br	ZINC001226787635	882653324	/nfs/dbraw/zinc/65/33/24/882653324.db2.gz	JURVNNNIIJOBKO-SSDOTTSWSA-O	1	1	305.196	1.727	20	5		DDBDMO
CC(C)(CCC(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1)[N+](=O)[O-]	ZINC001345667588	873470448	/nfs/dbraw/zinc/47/04/48/873470448.db2.gz	ZNGWXXBCZRJNRW-ZDUSSCGKSA-N	1	1	314.382	1.618	20	5		DDBDMO
COc1cccc(CO[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c1[N+](=O)[O-]	ZINC001223812898	881107150	/nfs/dbraw/zinc/10/71/50/881107150.db2.gz	RLUISUQMTHJRFZ-NJZAAPMLSA-N	1	1	320.345	1.924	20	5		DDBDMO
O=c1[nH]c(C2CC2)nc(OC2CC[NH+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC001228602398	883569850	/nfs/dbraw/zinc/56/98/50/883569850.db2.gz	ARWFDDRELVOVCR-UHFFFAOYSA-N	1	1	320.349	1.973	20	5		DDBDMO
Cc1cc2[nH]c(O[C@H](C)C[NH+]3CCOCC3)nc2cc1[N+](=O)[O-]	ZINC001228676311	883610213	/nfs/dbraw/zinc/61/02/13/883610213.db2.gz	ZIZVYUDURMVQCT-LLVKDONJSA-N	1	1	320.349	1.879	20	5		DDBDMO
CSCC(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC001233639244	887179621	/nfs/dbraw/zinc/17/96/21/887179621.db2.gz	CQDOUOZLEVMUQR-UHFFFAOYSA-N	1	1	311.407	1.896	20	5		DDBDMO
N[C@@]12CC[C@H]1C[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865058	892954672	/nfs/dbraw/zinc/95/46/72/892954672.db2.gz	XVZNMKRVJWRGNR-SUMWQHHRSA-N	1	1	316.405	1.987	20	5		DDBDMO
N[C@@]12CC[C@H]1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865058	892954687	/nfs/dbraw/zinc/95/46/87/892954687.db2.gz	XVZNMKRVJWRGNR-SUMWQHHRSA-N	1	1	316.405	1.987	20	5		DDBDMO
O=C(NCCC[N@@H+](Cc1ccns1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001265161713	901647637	/nfs/dbraw/zinc/64/76/37/901647637.db2.gz	YFRYRDDFFGQROE-CHWSQXEVSA-N	1	1	324.406	1.279	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000451935505	231240037	/nfs/dbraw/zinc/24/00/37/231240037.db2.gz	WEYLLFFOUADFER-HNNXBMFYSA-N	1	1	310.350	1.304	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000444260992	529465177	/nfs/dbraw/zinc/46/51/77/529465177.db2.gz	PYIDFOUHGSIRQS-MNOVXSKESA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000444260992	529465178	/nfs/dbraw/zinc/46/51/78/529465178.db2.gz	PYIDFOUHGSIRQS-MNOVXSKESA-N	1	1	323.397	1.825	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](CC)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000444260992	529465180	/nfs/dbraw/zinc/46/51/80/529465180.db2.gz	PYIDFOUHGSIRQS-MNOVXSKESA-N	1	1	323.397	1.825	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000451248529	529481418	/nfs/dbraw/zinc/48/14/18/529481418.db2.gz	DEGIQWNYCRFFRP-IVMMDQJWSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000452064916	231286573	/nfs/dbraw/zinc/28/65/73/231286573.db2.gz	GVJCZNSNDVTOCR-SMDDNHRTSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000495209184	529575060	/nfs/dbraw/zinc/57/50/60/529575060.db2.gz	APFPIHFKAFOCKW-SWLSCSKDSA-N	1	1	310.350	1.181	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000614925179	362081454	/nfs/dbraw/zinc/08/14/54/362081454.db2.gz	VZFKFDJGOIWRFF-LLVKDONJSA-N	1	1	322.287	1.835	20	5		DDBDMO
CO[C@]1(C(F)(F)F)CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000614925179	362081460	/nfs/dbraw/zinc/08/14/60/362081460.db2.gz	VZFKFDJGOIWRFF-LLVKDONJSA-N	1	1	322.287	1.835	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090551565	185302714	/nfs/dbraw/zinc/30/27/14/185302714.db2.gz	OZQOCNDWGACBQT-CQSZACIVSA-N	1	1	322.409	1.420	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)N2CCC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000283128316	282278705	/nfs/dbraw/zinc/27/87/05/282278705.db2.gz	ZKVWLNZWGPGHJT-UHFFFAOYSA-N	1	1	324.356	1.578	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000425061036	529821857	/nfs/dbraw/zinc/82/18/57/529821857.db2.gz	XNIANAIKDMJGLR-SWLSCSKDSA-N	1	1	321.352	1.829	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000425061405	529822675	/nfs/dbraw/zinc/82/26/75/529822675.db2.gz	ZBPLUXARQNUZAL-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O	ZINC000305806503	529984265	/nfs/dbraw/zinc/98/42/65/529984265.db2.gz	KCGGJXJDSFVEFN-ZFWWWQNUSA-N	1	1	321.377	1.677	20	5		DDBDMO
CN(c1nccc(C(N)=O)c1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000291143152	282353019	/nfs/dbraw/zinc/35/30/19/282353019.db2.gz	OEZIKIHISYYORV-ZACCUICWSA-N	1	1	319.365	1.150	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)CC[N@H+]1C	ZINC000330790360	232070635	/nfs/dbraw/zinc/07/06/35/232070635.db2.gz	AOGWGFBYFQORTF-VHSXEESVSA-N	1	1	307.354	1.127	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000330850688	232112287	/nfs/dbraw/zinc/11/22/87/232112287.db2.gz	PQGRTNZXEBMZMW-JTQLQIEISA-N	1	1	311.769	1.953	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000330850688	232112291	/nfs/dbraw/zinc/11/22/91/232112291.db2.gz	PQGRTNZXEBMZMW-JTQLQIEISA-N	1	1	311.769	1.953	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)[C@H]2C1	ZINC000272616692	210015786	/nfs/dbraw/zinc/01/57/86/210015786.db2.gz	LHZIWVGJOXKKOY-GWCFXTLKSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000138649371	186018322	/nfs/dbraw/zinc/01/83/22/186018322.db2.gz	ARJHYFJUWAIJNK-OUAUKWLOSA-N	1	1	309.370	1.414	20	5		DDBDMO
C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000138649371	186018324	/nfs/dbraw/zinc/01/83/24/186018324.db2.gz	ARJHYFJUWAIJNK-OUAUKWLOSA-N	1	1	309.370	1.414	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000138649371	186018325	/nfs/dbraw/zinc/01/83/25/186018325.db2.gz	ARJHYFJUWAIJNK-OUAUKWLOSA-N	1	1	309.370	1.414	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@H](C)O	ZINC000159546683	186126639	/nfs/dbraw/zinc/12/66/39/186126639.db2.gz	DMASRMZUCHSRBC-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](C[C@H]1CCOC1)C1CC1	ZINC000159744699	186139253	/nfs/dbraw/zinc/13/92/53/186139253.db2.gz	YPFTXDLGCOCICW-GFCCVEGCSA-N	1	1	307.350	1.257	20	5		DDBDMO
COc1ccc(NC(=O)CC[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC000026159751	352206038	/nfs/dbraw/zinc/20/60/38/352206038.db2.gz	FKWWTHVYRRFLQM-UHFFFAOYSA-N	1	1	309.322	1.264	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCC[C@H](O)C2)c([N+](=O)[O-])c1	ZINC000041886259	352317593	/nfs/dbraw/zinc/31/75/93/352317593.db2.gz	ORSGZGVQTWBHPD-NSHDSACASA-N	1	1	323.349	1.389	20	5		DDBDMO
CCOC(=O)CC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000055058542	352713529	/nfs/dbraw/zinc/71/35/29/352713529.db2.gz	VMIAQSXPYNFXFJ-UHFFFAOYSA-N	1	1	308.338	1.065	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000069425216	353160965	/nfs/dbraw/zinc/16/09/65/353160965.db2.gz	IMPSTBZNMGARGM-UHFFFAOYSA-N	1	1	310.354	1.225	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000069528144	353164829	/nfs/dbraw/zinc/16/48/29/353164829.db2.gz	MXZQHBIWKKQHDJ-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1cc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000073000319	353231463	/nfs/dbraw/zinc/23/14/63/353231463.db2.gz	JIBQCRMLVQKSCB-AWEZNQCLSA-N	1	1	321.425	1.982	20	5		DDBDMO
Cc1cc(N2CC[NH+](CCOC(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000074773542	353330280	/nfs/dbraw/zinc/33/02/80/353330280.db2.gz	GEADOSUFOONTEP-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000174511728	198344064	/nfs/dbraw/zinc/34/40/64/198344064.db2.gz	MXGYABOORIPLKP-ZDUSSCGKSA-N	1	1	320.393	1.807	20	5		DDBDMO
CCCC[N@@H+](CCCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000182130309	199390913	/nfs/dbraw/zinc/39/09/13/199390913.db2.gz	APVNEQSGQYJOSH-UHFFFAOYSA-N	1	1	309.366	1.678	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1CC1	ZINC000076967092	353445799	/nfs/dbraw/zinc/44/57/99/353445799.db2.gz	BDBJQZKOBMENBA-UHFFFAOYSA-N	1	1	310.329	1.530	20	5		DDBDMO
Cc1ccccc1N1CC[NH+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000174810107	198388664	/nfs/dbraw/zinc/38/86/64/198388664.db2.gz	DRECVKLLIXIWQO-UHFFFAOYSA-N	1	1	315.377	1.922	20	5		DDBDMO
Cc1cnc(N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)c([N+](=O)[O-])c1	ZINC000078632060	353526251	/nfs/dbraw/zinc/52/62/51/353526251.db2.gz	AAFNLQFZZPJSRD-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@H]1CCC[C@@H]1O	ZINC000080466985	353609370	/nfs/dbraw/zinc/60/93/70/353609370.db2.gz	MJJOEPKTTUQPIO-ZFWWWQNUSA-N	1	1	319.361	1.329	20	5		DDBDMO
CCc1nn(C)c(N(C)CCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000091670030	353833655	/nfs/dbraw/zinc/83/36/55/353833655.db2.gz	QTYXUZFLPCBJNM-UHFFFAOYSA-N	1	1	306.370	1.922	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CCCCC1	ZINC000090526535	353794958	/nfs/dbraw/zinc/79/49/58/353794958.db2.gz	VSPWEGBYSJDDKX-CYBMUJFWSA-N	1	1	323.393	1.772	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ncc([N+](=O)[O-])cc2C)CC1	ZINC000092612742	353863306	/nfs/dbraw/zinc/86/33/06/353863306.db2.gz	LHWMIYAVXDYZCA-ZDUSSCGKSA-N	1	1	321.425	1.984	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOC[C@@H]1C	ZINC000164712103	354248019	/nfs/dbraw/zinc/24/80/19/354248019.db2.gz	FENDGUFXEHEHSD-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCOC[C@@H]1C	ZINC000164712103	354248021	/nfs/dbraw/zinc/24/80/21/354248021.db2.gz	FENDGUFXEHEHSD-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CCc3c[nH+]cn3C2)c([N+](=O)[O-])c1	ZINC000588067578	354898688	/nfs/dbraw/zinc/89/86/88/354898688.db2.gz	AADFNHOZZAZWGH-SNVBAGLBSA-N	1	1	317.305	1.400	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587224640	354881988	/nfs/dbraw/zinc/88/19/88/354881988.db2.gz	VKJPLZDNZVKUQO-NSHDSACASA-N	1	1	308.382	1.956	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000588810198	354938721	/nfs/dbraw/zinc/93/87/21/354938721.db2.gz	WOZXAGDNWDCBAN-ZDUSSCGKSA-N	1	1	323.397	1.421	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000593479730	355898010	/nfs/dbraw/zinc/89/80/10/355898010.db2.gz	IHEBSOLSZUOCDS-UHFFFAOYSA-N	1	1	309.370	1.479	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1	ZINC000594056824	356101976	/nfs/dbraw/zinc/10/19/76/356101976.db2.gz	ZDMUANCVQLISCI-JTQLQIEISA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1	ZINC000594056824	356101979	/nfs/dbraw/zinc/10/19/79/356101979.db2.gz	ZDMUANCVQLISCI-JTQLQIEISA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H](O)C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000594063065	356103727	/nfs/dbraw/zinc/10/37/27/356103727.db2.gz	IGXQALUFLNGGLL-AAEUAGOBSA-N	1	1	310.350	1.180	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C[C@H](C)O)C2CC2)c([N+](=O)[O-])c1	ZINC000594066321	356103860	/nfs/dbraw/zinc/10/38/60/356103860.db2.gz	VPGMSRBSAMKBOS-NSHDSACASA-N	1	1	310.350	1.827	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594614694	356266880	/nfs/dbraw/zinc/26/68/80/356266880.db2.gz	ZAISAYMHTCYTDF-ACYLFWIKSA-N	1	1	303.362	1.359	20	5		DDBDMO
Cc1noc([C@H]2CCC[N@H+](Cc3onc(C)c3[N+](=O)[O-])C2)n1	ZINC000595295383	356438310	/nfs/dbraw/zinc/43/83/10/356438310.db2.gz	KZWNHQAUIJHWSV-JTQLQIEISA-N	1	1	307.310	1.962	20	5		DDBDMO
Cc1noc([C@H]2CCC[N@@H+](Cc3onc(C)c3[N+](=O)[O-])C2)n1	ZINC000595295383	356438314	/nfs/dbraw/zinc/43/83/14/356438314.db2.gz	KZWNHQAUIJHWSV-JTQLQIEISA-N	1	1	307.310	1.962	20	5		DDBDMO
O=C1C[C@H](C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000595521968	356531785	/nfs/dbraw/zinc/53/17/85/356531785.db2.gz	HHNSATOMPDZWQN-JSGCOSHPSA-N	1	1	303.362	1.910	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000081579880	192295686	/nfs/dbraw/zinc/29/56/86/192295686.db2.gz	SWCXIPBGAUJXEB-GFCCVEGCSA-N	1	1	309.366	1.678	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000595663086	356598709	/nfs/dbraw/zinc/59/87/09/356598709.db2.gz	QXDWVMWWJTWTOY-INIZCTEOSA-N	1	1	324.377	1.837	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1CCO	ZINC000595706888	356617369	/nfs/dbraw/zinc/61/73/69/356617369.db2.gz	YEYWJSSLLYJQPZ-TZMCWYRMSA-N	1	1	309.366	1.239	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CC1=CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000595750934	356636033	/nfs/dbraw/zinc/63/60/33/356636033.db2.gz	DELVDTSUQJHCIC-UHFFFAOYSA-N	1	1	319.361	1.836	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC1=CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000595750934	356636037	/nfs/dbraw/zinc/63/60/37/356636037.db2.gz	DELVDTSUQJHCIC-UHFFFAOYSA-N	1	1	319.361	1.836	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000595766815	356644140	/nfs/dbraw/zinc/64/41/40/356644140.db2.gz	RCGOOCFTOXKNDC-SMDDNHRTSA-N	1	1	307.350	1.403	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@]3(O)C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000595758705	356640933	/nfs/dbraw/zinc/64/09/33/356640933.db2.gz	UGSMPSZZYIQOAF-MQIPJXDCSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@]3(O)C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000595758705	356640937	/nfs/dbraw/zinc/64/09/37/356640937.db2.gz	UGSMPSZZYIQOAF-MQIPJXDCSA-N	1	1	319.361	1.687	20	5		DDBDMO
NC(=O)c1cc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000596081869	356766115	/nfs/dbraw/zinc/76/61/15/356766115.db2.gz	AXYKFFQPWVOZEN-NEPJUHHUSA-N	1	1	304.350	1.732	20	5		DDBDMO
C[N@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)CC2	ZINC000596183044	356805179	/nfs/dbraw/zinc/80/51/79/356805179.db2.gz	WMGGSRKCLGFNML-UHFFFAOYSA-N	1	1	318.377	1.758	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3cc[nH]c(=O)c3[N+](=O)[O-])C2)CC1	ZINC000596123074	356781373	/nfs/dbraw/zinc/78/13/73/356781373.db2.gz	MJUZAAZTHXYMEL-LLVKDONJSA-N	1	1	321.381	1.276	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@@H](Nc3cc[nH]c(=O)c3[N+](=O)[O-])C2)CC1	ZINC000596123074	356781377	/nfs/dbraw/zinc/78/13/77/356781377.db2.gz	MJUZAAZTHXYMEL-LLVKDONJSA-N	1	1	321.381	1.276	20	5		DDBDMO
C[C@@H](CNc1c(Cl)cncc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000596133308	356785543	/nfs/dbraw/zinc/78/55/43/356785543.db2.gz	HAVNBBFFPSPGMS-JTQLQIEISA-N	1	1	314.773	1.445	20	5		DDBDMO
Cc1ccnc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1[N+](=O)[O-]	ZINC000596537458	356910098	/nfs/dbraw/zinc/91/00/98/356910098.db2.gz	GPAZZBLEXFKPBT-CYBMUJFWSA-N	1	1	306.366	1.334	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1ccc([N+](=O)[O-])cn1)C2	ZINC000597716682	357299876	/nfs/dbraw/zinc/29/98/76/357299876.db2.gz	RREHIXCMCPSYTH-OAHLLOKOSA-N	1	1	304.350	1.548	20	5		DDBDMO
COC(=O)c1ccnc(NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000598636459	357664668	/nfs/dbraw/zinc/66/46/68/357664668.db2.gz	XQXDYCOMIAYAMM-FGWVZKOKSA-N	1	1	320.349	1.814	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1CO	ZINC000598648474	357669304	/nfs/dbraw/zinc/66/93/04/357669304.db2.gz	RYJWXIMRZIMVHH-MNOVXSKESA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1CO	ZINC000598648474	357669309	/nfs/dbraw/zinc/66/93/09/357669309.db2.gz	RYJWXIMRZIMVHH-MNOVXSKESA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1CCCN1C(=O)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000347788939	283277687	/nfs/dbraw/zinc/27/76/87/283277687.db2.gz	KMUVNKVVGLDORD-GFCCVEGCSA-N	1	1	318.377	1.749	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NCC(F)(F)C[NH3+])c(C)c1[N+](=O)[O-]	ZINC000598716512	357701596	/nfs/dbraw/zinc/70/15/96/357701596.db2.gz	KPZKFORDKYBDAS-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
CC(C)c1ncc2c(n1)CC[N@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000598936104	357763662	/nfs/dbraw/zinc/76/36/62/357763662.db2.gz	BLNTZNMPYBIFIV-UHFFFAOYSA-N	1	1	316.365	1.763	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC1COC1)c1ccc([N+](=O)[O-])cc1	ZINC000599079330	357808861	/nfs/dbraw/zinc/80/88/61/357808861.db2.gz	DPNXININDUOBQN-CQSZACIVSA-N	1	1	302.334	1.654	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000599142321	357828277	/nfs/dbraw/zinc/82/82/77/357828277.db2.gz	UQCYPHJXQPYMID-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]2CC[C@@H](C1)S2	ZINC000599552355	357971293	/nfs/dbraw/zinc/97/12/93/357971293.db2.gz	AKHXGIBCWUJAQU-OLZOCXBDSA-N	1	1	309.391	1.726	20	5		DDBDMO
COC[C@]1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000599695354	358029959	/nfs/dbraw/zinc/02/99/59/358029959.db2.gz	XNQYPISQBCPATH-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@]1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000599695354	358029961	/nfs/dbraw/zinc/02/99/61/358029961.db2.gz	XNQYPISQBCPATH-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([N@H+]3CC[C@H](O)C3)C2)c1	ZINC000599939519	358086108	/nfs/dbraw/zinc/08/61/08/358086108.db2.gz	WCQSNWKSFXQUOO-STQMWFEESA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000600312438	358192285	/nfs/dbraw/zinc/19/22/85/358192285.db2.gz	SFCYNPRZEYVDNE-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1(C(N)=O)CCCC1	ZINC000180700056	199199305	/nfs/dbraw/zinc/19/93/05/199199305.db2.gz	GEMOSGFIZZIGHO-ZDUSSCGKSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601131509	358415486	/nfs/dbraw/zinc/41/54/86/358415486.db2.gz	ZMDDOVADHKCTCQ-PWSUYJOCSA-N	1	1	303.318	1.729	20	5		DDBDMO
CCN1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000601170752	358431495	/nfs/dbraw/zinc/43/14/95/358431495.db2.gz	DNJXTUPDUZIIBZ-SNVBAGLBSA-N	1	1	300.318	1.598	20	5		DDBDMO
O=[N+]([O-])c1nccn1C[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000601961866	358754591	/nfs/dbraw/zinc/75/45/91/358754591.db2.gz	AYGQTNSNRPSYHX-AWEZNQCLSA-N	1	1	302.334	1.211	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000602078897	358802934	/nfs/dbraw/zinc/80/29/34/358802934.db2.gz	BNJDYCAMEJLDJG-LBPRGKRZSA-N	1	1	307.350	1.704	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CC1	ZINC000602771405	359179957	/nfs/dbraw/zinc/17/99/57/359179957.db2.gz	IVFRJIYGRSDWIS-JTQLQIEISA-N	1	1	310.354	1.373	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1[C@H](O)C(F)(F)F	ZINC000602775668	359181774	/nfs/dbraw/zinc/18/17/74/359181774.db2.gz	MAFJAVFFTSAAQN-ONGXEEELSA-N	1	1	322.287	1.487	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602775854	359182117	/nfs/dbraw/zinc/18/21/17/359182117.db2.gz	CIDNRSDEAMTOPM-GXTWGEPZSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602775854	359182137	/nfs/dbraw/zinc/18/21/37/359182137.db2.gz	CIDNRSDEAMTOPM-GXTWGEPZSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000602775854	359182140	/nfs/dbraw/zinc/18/21/40/359182140.db2.gz	CIDNRSDEAMTOPM-GXTWGEPZSA-N	1	1	309.414	1.904	20	5		DDBDMO
Cn1cc(C[N@H+](CCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602780443	359185934	/nfs/dbraw/zinc/18/59/34/359185934.db2.gz	UQWWQJYEQXSABV-OAHLLOKOSA-N	1	1	316.361	1.810	20	5		DDBDMO
Cn1cc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602780443	359185936	/nfs/dbraw/zinc/18/59/36/359185936.db2.gz	UQWWQJYEQXSABV-OAHLLOKOSA-N	1	1	316.361	1.810	20	5		DDBDMO
Cn1cc(C[N@@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839132	359228477	/nfs/dbraw/zinc/22/84/77/359228477.db2.gz	HIYUBLTVPDNQLB-UONOGXRCSA-N	1	1	302.334	1.636	20	5		DDBDMO
Cn1cc(C[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602839132	359228484	/nfs/dbraw/zinc/22/84/84/359228484.db2.gz	HIYUBLTVPDNQLB-UONOGXRCSA-N	1	1	302.334	1.636	20	5		DDBDMO
COc1cc([N+](=O)[O-])cn(CC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1=O	ZINC000603356601	359590238	/nfs/dbraw/zinc/59/02/38/359590238.db2.gz	BNDXTKHCVDDRNA-TXEJJXNPSA-N	1	1	309.366	1.743	20	5		DDBDMO
CC1(C)[C@@H](Nc2ncc([N+](=O)[O-])cn2)C[C@@H]1[NH+]1CCOCC1	ZINC000603400425	359616562	/nfs/dbraw/zinc/61/65/62/359616562.db2.gz	XBEXQESDPOCIIO-RYUDHWBXSA-N	1	1	307.354	1.296	20	5		DDBDMO
Cn1cc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)c([N+](=O)[O-])n1	ZINC000603430806	359635555	/nfs/dbraw/zinc/63/55/55/359635555.db2.gz	VAIXNJCVJXTNOS-MJBXVCDLSA-N	1	1	323.397	1.189	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000604198286	359725816	/nfs/dbraw/zinc/72/58/16/359725816.db2.gz	FLIZECBHDHLYLN-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C(C)(C)CO1	ZINC000610369645	360422579	/nfs/dbraw/zinc/42/25/79/360422579.db2.gz	MHDHDNZYMKIAKQ-GFCCVEGCSA-N	1	1	312.370	1.042	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1C	ZINC000611271194	360685996	/nfs/dbraw/zinc/68/59/96/360685996.db2.gz	UQVLJTFLXLWSBS-LBPRGKRZSA-N	1	1	321.377	1.892	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000194608796	201261515	/nfs/dbraw/zinc/26/15/15/201261515.db2.gz	IDIGGTWWMCVEOW-UHFFFAOYSA-N	1	1	308.338	1.391	20	5		DDBDMO
Cc1ccc(C(=O)NC[C@H]2C[N@H+]3CCN2CCC3)cc1[N+](=O)[O-]	ZINC000619873732	364170759	/nfs/dbraw/zinc/17/07/59/364170759.db2.gz	SVMCDIPZUMDFES-AWEZNQCLSA-N	1	1	318.377	1.023	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275347801	212284122	/nfs/dbraw/zinc/28/41/22/212284122.db2.gz	JAPOOYRZSSNTPK-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275347801	212284125	/nfs/dbraw/zinc/28/41/25/212284125.db2.gz	JAPOOYRZSSNTPK-UWVGGRQHSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](O)CC1	ZINC000293037210	223364350	/nfs/dbraw/zinc/36/43/50/223364350.db2.gz	GSXKKSCTWHLNOF-RISCZKNCSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](O)CC1	ZINC000293037210	223364352	/nfs/dbraw/zinc/36/43/52/223364352.db2.gz	GSXKKSCTWHLNOF-RISCZKNCSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000275232181	212212697	/nfs/dbraw/zinc/21/26/97/212212697.db2.gz	MSHWOGZZVWDSEL-UHFFFAOYSA-N	1	1	306.366	1.606	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCCC3)C2)c1[N+](=O)[O-]	ZINC000264580223	204008123	/nfs/dbraw/zinc/00/81/23/204008123.db2.gz	CHNPREUXKLHVAF-LLVKDONJSA-N	1	1	321.381	1.581	20	5		DDBDMO
C[C@H](CNc1ncc([N+](=O)[O-])c(N)n1)[N@@H+](C)Cc1ccccc1	ZINC000264722824	204104170	/nfs/dbraw/zinc/10/41/70/204104170.db2.gz	HVNODJLPFHWTBZ-LLVKDONJSA-N	1	1	316.365	1.899	20	5		DDBDMO
C[C@@H](CNc1ncc([N+](=O)[O-])c(N)n1)[N@@H+](C)Cc1ccccc1	ZINC000264722826	204104741	/nfs/dbraw/zinc/10/47/41/204104741.db2.gz	HVNODJLPFHWTBZ-NSHDSACASA-N	1	1	316.365	1.899	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1	ZINC000288243906	220040172	/nfs/dbraw/zinc/04/01/72/220040172.db2.gz	DUBJXGUIZFLICF-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cccc([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000284495595	218052006	/nfs/dbraw/zinc/05/20/06/218052006.db2.gz	CDWNOOZLBUPUDB-KBPBESRZSA-N	1	1	307.350	1.386	20	5		DDBDMO
Cc1ccc(CN2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000284719172	218148595	/nfs/dbraw/zinc/14/85/95/218148595.db2.gz	UTHHUGJRDMOMSA-JKSUJKDBSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[N@H+](CCCS(C)(=O)=O)CCc1ccccc1[N+](=O)[O-]	ZINC000285316710	218378877	/nfs/dbraw/zinc/37/88/77/218378877.db2.gz	MNPICCPSJIPUID-UHFFFAOYSA-N	1	1	300.380	1.504	20	5		DDBDMO
C[N@@H+](CCCS(C)(=O)=O)CCc1ccccc1[N+](=O)[O-]	ZINC000285316710	218378878	/nfs/dbraw/zinc/37/88/78/218378878.db2.gz	MNPICCPSJIPUID-UHFFFAOYSA-N	1	1	300.380	1.504	20	5		DDBDMO
Cn1cc(CC[N@@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)cn1	ZINC000352621212	285179699	/nfs/dbraw/zinc/17/96/99/285179699.db2.gz	NKYMTCLCXXGSGW-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
Cn1cc(CC[N@H+]2CCOc3ccc([N+](=O)[O-])cc3C2)cn1	ZINC000352621212	285179702	/nfs/dbraw/zinc/17/97/02/285179702.db2.gz	NKYMTCLCXXGSGW-UHFFFAOYSA-N	1	1	302.334	1.765	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2C[C@H](O)C[C@H]2c2ccccc2)c1	ZINC000411938076	285189507	/nfs/dbraw/zinc/18/95/07/285189507.db2.gz	JOCWHSLPFUPVNQ-CABCVRRESA-N	1	1	302.334	1.599	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCC[C@H]1O	ZINC000352657400	285201928	/nfs/dbraw/zinc/20/19/28/285201928.db2.gz	AEEYUQQXBRDGAU-QWHCGFSZSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCC[C@H]1O	ZINC000352657400	285201932	/nfs/dbraw/zinc/20/19/32/285201932.db2.gz	AEEYUQQXBRDGAU-QWHCGFSZSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1	ZINC000294710133	224184055	/nfs/dbraw/zinc/18/40/55/224184055.db2.gz	BLJBJPPVTQTAMZ-NFBGWVBBSA-N	1	1	307.325	1.768	20	5		DDBDMO
CO[C@@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCC2	ZINC000451864619	533529892	/nfs/dbraw/zinc/52/98/92/533529892.db2.gz	ZXEVRKUAACTEAM-ZIAGYGMSSA-N	1	1	321.377	1.646	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@]1(C)CO)c1ccc([N+](=O)[O-])cc1	ZINC000569862155	304383626	/nfs/dbraw/zinc/38/36/26/304383626.db2.gz	ZXCZMLFGNFKVHF-HNNXBMFYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000051591596	407140893	/nfs/dbraw/zinc/14/08/93/407140893.db2.gz	JFKWGBYVMVXDCS-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000051591596	407140895	/nfs/dbraw/zinc/14/08/95/407140895.db2.gz	JFKWGBYVMVXDCS-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@@](C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(N)=O	ZINC000089913375	407158369	/nfs/dbraw/zinc/15/83/69/407158369.db2.gz	IBEPUNQTSFHRHI-OAHLLOKOSA-N	1	1	318.333	1.993	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000066832926	407260096	/nfs/dbraw/zinc/26/00/96/407260096.db2.gz	JOTRDEHLGFQHCT-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000066832926	407260097	/nfs/dbraw/zinc/26/00/97/407260097.db2.gz	JOTRDEHLGFQHCT-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](CCO)CC2)c(Cl)c1	ZINC000122817681	407311662	/nfs/dbraw/zinc/31/16/62/407311662.db2.gz	IDVYEAJMWGPTDD-UHFFFAOYSA-N	1	1	300.746	1.148	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@H+](CCO)CC2)c(Cl)c1	ZINC000122817681	407311663	/nfs/dbraw/zinc/31/16/63/407311663.db2.gz	IDVYEAJMWGPTDD-UHFFFAOYSA-N	1	1	300.746	1.148	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1CCOC1	ZINC000106885832	407364988	/nfs/dbraw/zinc/36/49/88/407364988.db2.gz	NWNDGKZSCPNNEC-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CN1CC[NH+]([C@H]2CCCCN(c3ncccc3[N+](=O)[O-])C2)CC1	ZINC000127021818	407426223	/nfs/dbraw/zinc/42/62/23/407426223.db2.gz	AHVVSIIZANSAGJ-AWEZNQCLSA-N	1	1	319.409	1.596	20	5		DDBDMO
Cc1cnc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000266213278	407533998	/nfs/dbraw/zinc/53/39/98/407533998.db2.gz	NOYSATCSJBRHAJ-OAHLLOKOSA-N	1	1	321.425	1.982	20	5		DDBDMO
CC[C@H](c1ccncc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000130150958	407659417	/nfs/dbraw/zinc/65/94/17/407659417.db2.gz	PWTOXOXDNXDGBV-LSDHHAIUSA-N	1	1	319.365	1.630	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OC	ZINC000129485258	407613818	/nfs/dbraw/zinc/61/38/18/407613818.db2.gz	BZMWSHRZGIWRQJ-OAHLLOKOSA-N	1	1	310.350	1.959	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@@](C)(O)C2)c([N+](=O)[O-])cc1OC	ZINC000129485258	407613825	/nfs/dbraw/zinc/61/38/25/407613825.db2.gz	BZMWSHRZGIWRQJ-OAHLLOKOSA-N	1	1	310.350	1.959	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000271339263	407645002	/nfs/dbraw/zinc/64/50/02/407645002.db2.gz	CIUTTXXTHJYPHS-NSHDSACASA-N	1	1	309.370	1.323	20	5		DDBDMO
C[C@H]([NH3+])C1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000261865523	407646969	/nfs/dbraw/zinc/64/69/69/407646969.db2.gz	GKUBYUNEJRGWNF-JTQLQIEISA-N	1	1	306.366	1.253	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H](CO)C3)n2)cc1	ZINC000267162642	407772606	/nfs/dbraw/zinc/77/26/06/407772606.db2.gz	QXPCYLXQULKKBG-NSHDSACASA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](CO)C3)n2)cc1	ZINC000267162642	407772612	/nfs/dbraw/zinc/77/26/12/407772612.db2.gz	QXPCYLXQULKKBG-NSHDSACASA-N	1	1	318.333	1.849	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000132365915	407781874	/nfs/dbraw/zinc/78/18/74/407781874.db2.gz	KGCCBBLIHBYOJK-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@@H+]2CC)c1[N+](=O)[O-]	ZINC000171873518	407787397	/nfs/dbraw/zinc/78/73/97/407787397.db2.gz	RLYZYNHKVCBBRR-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
Cc1nn(CCC(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000153760436	407897249	/nfs/dbraw/zinc/89/72/49/407897249.db2.gz	MERJHNTWXQVHTB-CYBMUJFWSA-N	1	1	323.397	1.351	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000268135977	407907894	/nfs/dbraw/zinc/90/78/94/407907894.db2.gz	CIGUGXFLKUAGKB-ZANVPECISA-N	1	1	304.350	1.390	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000268248139	407967592	/nfs/dbraw/zinc/96/75/92/407967592.db2.gz	WKVDDGCYFPWOSJ-ABAIWWIYSA-N	1	1	303.362	1.736	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCCC[C@@H]2C[NH+](C)C)c1[N+](=O)[O-]	ZINC000188411513	407940237	/nfs/dbraw/zinc/94/02/37/407940237.db2.gz	UPJAPNGNJONBDC-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
Cc1nc(N2CCN(c3ccc(N)[nH+]c3)CC2)ccc1[N+](=O)[O-]	ZINC000268490522	408068487	/nfs/dbraw/zinc/06/84/87/408068487.db2.gz	NRZPSILVUZBVOJ-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
C[C@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCC[C@@H](C)C1	ZINC000245853952	408080313	/nfs/dbraw/zinc/08/03/13/408080313.db2.gz	DGUGWEBIWSYPPM-GHMZBOCLSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269301476	408261255	/nfs/dbraw/zinc/26/12/55/408261255.db2.gz	USIPWXOTPRHTAA-HZMBPMFUSA-N	1	1	307.350	1.713	20	5		DDBDMO
C[C@H]1C[N@H+](C)CC[C@@H]1N(C)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269301476	408261257	/nfs/dbraw/zinc/26/12/57/408261257.db2.gz	USIPWXOTPRHTAA-HZMBPMFUSA-N	1	1	307.350	1.713	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000269387388	408290464	/nfs/dbraw/zinc/29/04/64/408290464.db2.gz	LCXLXWTZXXACFI-SNVBAGLBSA-N	1	1	307.354	1.362	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000269387388	408290469	/nfs/dbraw/zinc/29/04/69/408290469.db2.gz	LCXLXWTZXXACFI-SNVBAGLBSA-N	1	1	307.354	1.362	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000269387388	408290475	/nfs/dbraw/zinc/29/04/75/408290475.db2.gz	LCXLXWTZXXACFI-SNVBAGLBSA-N	1	1	307.354	1.362	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000269390669	408290701	/nfs/dbraw/zinc/29/07/01/408290701.db2.gz	RHAFSSABJVZSFO-WDEREUQCSA-N	1	1	321.381	1.798	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000183357185	408388664	/nfs/dbraw/zinc/38/86/64/408388664.db2.gz	LOEFWJROOHZNNS-LBPRGKRZSA-N	1	1	313.379	1.027	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](NS(C)(=O)=O)C1	ZINC000183357185	408388670	/nfs/dbraw/zinc/38/86/70/408388670.db2.gz	LOEFWJROOHZNNS-LBPRGKRZSA-N	1	1	313.379	1.027	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000183555154	408440096	/nfs/dbraw/zinc/44/00/96/408440096.db2.gz	LKYWIPUPRNYJEG-QWRGUYRKSA-N	1	1	307.354	1.936	20	5		DDBDMO
[NH3+][C@@H]1CC[C@@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@H]12	ZINC000248621532	408601455	/nfs/dbraw/zinc/60/14/55/408601455.db2.gz	NBERQTNIEKNCIX-JFUSQASVSA-N	1	1	315.333	1.280	20	5		DDBDMO
C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)(C)O	ZINC000265168423	408566241	/nfs/dbraw/zinc/56/62/41/408566241.db2.gz	YBDTXFIYTXPKII-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)(C)O	ZINC000265168423	408566244	/nfs/dbraw/zinc/56/62/44/408566244.db2.gz	YBDTXFIYTXPKII-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000192522039	408602521	/nfs/dbraw/zinc/60/25/21/408602521.db2.gz	LWYLMKJRPMQRES-OKILXGFUSA-N	1	1	303.362	1.547	20	5		DDBDMO
C[C@@H](CCN1CC[NH+](C)CC1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000184337692	408593150	/nfs/dbraw/zinc/59/31/50/408593150.db2.gz	XUVLXWWKATVMPM-ZDUSSCGKSA-N	1	1	320.393	1.351	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1	ZINC000177159468	408540404	/nfs/dbraw/zinc/54/04/04/408540404.db2.gz	QULFGRXFEHRGLQ-GHMZBOCLSA-N	1	1	319.361	1.958	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c1[N+](=O)[O-]	ZINC000248636977	408605252	/nfs/dbraw/zinc/60/52/52/408605252.db2.gz	QNRDFNIVVJHSNI-LPEHRKFASA-N	1	1	307.354	1.080	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270746075	408663849	/nfs/dbraw/zinc/66/38/49/408663849.db2.gz	HFGOYJOEADUIFR-TUAOUCFPSA-N	1	1	323.397	1.425	20	5		DDBDMO
C[C@@H]1CC[NH2+]C[C@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000193407623	408716105	/nfs/dbraw/zinc/71/61/05/408716105.db2.gz	WSQAGDWVZYWXJI-PSASIEDQSA-N	1	1	317.342	1.010	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000162955431	408747661	/nfs/dbraw/zinc/74/76/61/408747661.db2.gz	FGJVMEXIJZIKML-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CO	ZINC000162955431	408747670	/nfs/dbraw/zinc/74/76/70/408747670.db2.gz	FGJVMEXIJZIKML-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCO1	ZINC000250415624	408778539	/nfs/dbraw/zinc/77/85/39/408778539.db2.gz	AAESGRFUUFXDJT-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000286012227	408906967	/nfs/dbraw/zinc/90/69/67/408906967.db2.gz	QLWVXVHIEUYGGF-GDLCADMTSA-N	1	1	304.350	1.754	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000286012227	408906969	/nfs/dbraw/zinc/90/69/69/408906969.db2.gz	QLWVXVHIEUYGGF-GDLCADMTSA-N	1	1	304.350	1.754	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000192684160	163231925	/nfs/dbraw/zinc/23/19/25/163231925.db2.gz	ABHLWUBWOOMTGF-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]([C@@H](O)C(F)(F)F)C2)c1	ZINC000277678357	408991036	/nfs/dbraw/zinc/99/10/36/408991036.db2.gz	GDMNTLCUGLZLNR-MWLCHTKSSA-N	1	1	322.287	1.427	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](OCc3ccncc3)C2)n1	ZINC000287639391	409068791	/nfs/dbraw/zinc/06/87/91/409068791.db2.gz	GBRKRXPOJCQONG-CQSZACIVSA-N	1	1	317.349	1.477	20	5		DDBDMO
COc1cc(C[N@H+](C)CCOCCO)c([N+](=O)[O-])cc1OC	ZINC000282412189	409049082	/nfs/dbraw/zinc/04/90/82/409049082.db2.gz	DEJDBNZURHJXEV-UHFFFAOYSA-N	1	1	314.338	1.053	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCOCCO)c([N+](=O)[O-])cc1OC	ZINC000282412189	409049084	/nfs/dbraw/zinc/04/90/84/409049084.db2.gz	DEJDBNZURHJXEV-UHFFFAOYSA-N	1	1	314.338	1.053	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293630265	409150152	/nfs/dbraw/zinc/15/01/52/409150152.db2.gz	FFMLYUQYNHSFAH-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293630265	409150154	/nfs/dbraw/zinc/15/01/54/409150154.db2.gz	FFMLYUQYNHSFAH-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000293630265	409150156	/nfs/dbraw/zinc/15/01/56/409150156.db2.gz	FFMLYUQYNHSFAH-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000283449734	409158783	/nfs/dbraw/zinc/15/87/83/409158783.db2.gz	DOUPHGLMWKYNHR-ZDUSSCGKSA-N	1	1	321.425	1.863	20	5		DDBDMO
Cc1nn(CCC(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000293875246	409198789	/nfs/dbraw/zinc/19/87/89/409198789.db2.gz	CFHWJBRVHWBOEC-PHIMTYICSA-N	1	1	323.397	1.349	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1	ZINC000294093332	409238509	/nfs/dbraw/zinc/23/85/09/409238509.db2.gz	XTNYEWLVABBERZ-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1	ZINC000294093332	409238510	/nfs/dbraw/zinc/23/85/10/409238510.db2.gz	XTNYEWLVABBERZ-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000284000551	409255058	/nfs/dbraw/zinc/25/50/58/409255058.db2.gz	NOIVAWXWPDWRMV-UHFFFAOYSA-N	1	1	324.356	1.872	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000293895017	409201677	/nfs/dbraw/zinc/20/16/77/409201677.db2.gz	NEDMRRLFWKYBON-MRXNPFEDSA-N	1	1	303.362	1.692	20	5		DDBDMO
COc1cc(C[NH2+][C@H]2COC[C@@H]2OC)c([N+](=O)[O-])cc1F	ZINC000290101003	409302051	/nfs/dbraw/zinc/30/20/51/409302051.db2.gz	IRESZQBBHYBZLG-GWCFXTLKSA-N	1	1	300.286	1.246	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]2OCCN(C)[C@H]2C1	ZINC000284328665	409322259	/nfs/dbraw/zinc/32/22/59/409322259.db2.gz	KOYJWIPLSYPJBD-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
C[C@@H]([NH2+][C@H](CO)c1cnn(C)c1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000284983336	409388206	/nfs/dbraw/zinc/38/82/06/409388206.db2.gz	GFNYMNOZRHTYML-NOZJJQNGSA-N	1	1	305.338	1.295	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@@H+](CCCO)C2)c1	ZINC000295556200	409346491	/nfs/dbraw/zinc/34/64/91/409346491.db2.gz	UAJCOELLMHADML-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CC1	ZINC000285395957	409425449	/nfs/dbraw/zinc/42/54/49/409425449.db2.gz	DTTNBHHFRKATND-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CC1	ZINC000285395957	409425454	/nfs/dbraw/zinc/42/54/54/409425454.db2.gz	DTTNBHHFRKATND-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)c(N)c([N+](=O)[O-])c1	ZINC000295309547	409427966	/nfs/dbraw/zinc/42/79/66/409427966.db2.gz	VWFOYMMVOZTOJT-CQSZACIVSA-N	1	1	310.329	1.259	20	5		DDBDMO
C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000321308457	164044299	/nfs/dbraw/zinc/04/42/99/164044299.db2.gz	CRQAVIMZPOZAPU-WCQYABFASA-N	1	1	318.377	1.876	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356725186	409551112	/nfs/dbraw/zinc/55/11/12/409551112.db2.gz	DSTOOFZDYMHJKQ-LLVKDONJSA-N	1	1	318.337	1.138	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1C1CCOCC1	ZINC000348947558	409603151	/nfs/dbraw/zinc/60/31/51/409603151.db2.gz	JLUPVZQASZAZAD-HNNXBMFYSA-N	1	1	321.377	1.648	20	5		DDBDMO
COC[C@@]1(C)CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000296787998	409643146	/nfs/dbraw/zinc/64/31/46/409643146.db2.gz	QNVUGJWMFUCFGU-HNNXBMFYSA-N	1	1	307.350	1.892	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000296787998	409643155	/nfs/dbraw/zinc/64/31/55/409643155.db2.gz	QNVUGJWMFUCFGU-HNNXBMFYSA-N	1	1	307.350	1.892	20	5		DDBDMO
COc1c(C(=O)NCC[N@@H+]2CC=C(C)CC2)cccc1[N+](=O)[O-]	ZINC000356841078	409654000	/nfs/dbraw/zinc/65/40/00/409654000.db2.gz	VTWVKJYOGVIUCO-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000356843161	409655118	/nfs/dbraw/zinc/65/51/18/409655118.db2.gz	GBLWLEUAMPODOX-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[N@H+]2CCN1CCC2)c1ccccc1[N+](=O)[O-]	ZINC000342475241	409663418	/nfs/dbraw/zinc/66/34/18/409663418.db2.gz	RNUSOYXKEITLHJ-DOMZBBRYSA-N	1	1	318.377	1.162	20	5		DDBDMO
C[C@@H]1CC[N@H+](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000354513298	409910671	/nfs/dbraw/zinc/91/06/71/409910671.db2.gz	OMMLFINIQRIZQO-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000354513298	409910676	/nfs/dbraw/zinc/91/06/76/409910676.db2.gz	OMMLFINIQRIZQO-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[NH+](C)[C@H](C)C2)n1	ZINC000319479763	409897997	/nfs/dbraw/zinc/89/79/97/409897997.db2.gz	XAWNGFFAPXEYSW-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
C[C@@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1	ZINC000357308541	409966365	/nfs/dbraw/zinc/96/63/65/409966365.db2.gz	WNYSRUZWRVXNEZ-MNOVXSKESA-N	1	1	321.381	1.621	20	5		DDBDMO
NC(=O)c1ccnc(N2CCC(c3[nH]cc[nH+]3)CC2)c1[N+](=O)[O-]	ZINC000357188122	409928695	/nfs/dbraw/zinc/92/86/95/409928695.db2.gz	JHNYGRFNELWWCN-UHFFFAOYSA-N	1	1	316.321	1.196	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+]2CCOC[C@H]2C)c([N+](=O)[O-])c1	ZINC000297843841	410019630	/nfs/dbraw/zinc/01/96/30/410019630.db2.gz	KTSKDPHLKCNUDI-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCOC[C@H]2C)c([N+](=O)[O-])c1	ZINC000297843841	410019633	/nfs/dbraw/zinc/01/96/33/410019633.db2.gz	KTSKDPHLKCNUDI-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCC[N@H+]([C@@H](C)CO)CC2)c1	ZINC000338706024	410034301	/nfs/dbraw/zinc/03/43/01/410034301.db2.gz	RBHUHPAAFLIBKD-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@H](C)[NH+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000338795233	410037361	/nfs/dbraw/zinc/03/73/61/410037361.db2.gz	OMAQOXAJINQAAC-QWRGUYRKSA-N	1	1	322.365	1.614	20	5		DDBDMO
Cn1nccc1CC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298195649	410128526	/nfs/dbraw/zinc/12/85/26/410128526.db2.gz	XIEYDKQGPCRGNC-UHFFFAOYSA-N	1	1	316.365	1.088	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@@H](O)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000355043806	410263893	/nfs/dbraw/zinc/26/38/93/410263893.db2.gz	SNXIWNUJOQSTQZ-JQWIXIFHSA-N	1	1	324.333	1.102	20	5		DDBDMO
COc1ccc(OCCN2CC[C@@H]([C@@H](C)[NH3+])C2)c([N+](=O)[O-])c1	ZINC000351847590	410285520	/nfs/dbraw/zinc/28/55/20/410285520.db2.gz	AQPRIDCYSKHMQV-VXGBXAGGSA-N	1	1	309.366	1.651	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343460455	410471105	/nfs/dbraw/zinc/47/11/05/410471105.db2.gz	RVBOVKYMYFVITK-CHWSQXEVSA-N	1	1	320.393	1.996	20	5		DDBDMO
COc1ccc(C(=O)NCCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000299037738	410494065	/nfs/dbraw/zinc/49/40/65/410494065.db2.gz	UCEWQXUJAOSIMA-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343609417	410568520	/nfs/dbraw/zinc/56/85/20/410568520.db2.gz	SJUUGEFOEVFGRD-WCQYABFASA-N	1	1	306.366	1.877	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[NH2+]C2(C(F)F)CCCCC2)c1	ZINC000352202162	410543108	/nfs/dbraw/zinc/54/31/08/410543108.db2.gz	IJNCFNLYQJEVMB-LLVKDONJSA-N	1	1	318.324	1.710	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000353058223	410764296	/nfs/dbraw/zinc/76/42/96/410764296.db2.gz	RNEJDRRBABUGIW-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
Cc1ccnc(NC[C@@H]2C[N@@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301851251	410813331	/nfs/dbraw/zinc/81/33/31/410813331.db2.gz	FQNFOHSQIWESEZ-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccnc(NC[C@@H]2C[N@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301851251	410813334	/nfs/dbraw/zinc/81/33/34/410813334.db2.gz	FQNFOHSQIWESEZ-QWHCGFSZSA-N	1	1	306.366	1.963	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301953350	410835543	/nfs/dbraw/zinc/83/55/43/410835543.db2.gz	CRRGJRRINQBJNB-NSHDSACASA-N	1	1	304.354	1.924	20	5		DDBDMO
COc1cc(CN[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000330679902	410874058	/nfs/dbraw/zinc/87/40/58/410874058.db2.gz	YESWMKLXPYYBOU-CMPLNLGQSA-N	1	1	309.366	1.881	20	5		DDBDMO
CC1CC[NH+](CC2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000360108659	411050004	/nfs/dbraw/zinc/05/00/04/411050004.db2.gz	XYHZISKHQJGHOX-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](CN1)[N@@H+]2C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000353667908	411103132	/nfs/dbraw/zinc/10/31/32/411103132.db2.gz	WASPELRIADEQTK-JRFBKZHLSA-N	1	1	301.346	1.961	20	5		DDBDMO
C[C@H]1COCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000374343423	418520681	/nfs/dbraw/zinc/52/06/81/418520681.db2.gz	XXNKZUCLYUREHI-LLVKDONJSA-N	1	1	308.334	1.930	20	5		DDBDMO
C[C@H]1COCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000374343423	418520688	/nfs/dbraw/zinc/52/06/88/418520688.db2.gz	XXNKZUCLYUREHI-LLVKDONJSA-N	1	1	308.334	1.930	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CCC[N@H+]1CCOC	ZINC000360965899	418555802	/nfs/dbraw/zinc/55/58/02/418555802.db2.gz	KJYPWFKBMXKMAR-GFCCVEGCSA-N	1	1	311.386	1.642	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000188140763	222008170	/nfs/dbraw/zinc/00/81/70/222008170.db2.gz	VGEKPQOXXDSULP-UHFFFAOYSA-N	1	1	301.368	1.213	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000190063966	222066174	/nfs/dbraw/zinc/06/61/74/222066174.db2.gz	ZXASDKLSINTJPX-MFKMUULPSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](O)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000190063966	222066176	/nfs/dbraw/zinc/06/61/76/222066176.db2.gz	ZXASDKLSINTJPX-MFKMUULPSA-N	1	1	310.350	1.815	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361267857	418615554	/nfs/dbraw/zinc/61/55/54/418615554.db2.gz	SKIXRKJMERQGHW-SECBINFHSA-N	1	1	306.322	1.712	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000361267857	418615556	/nfs/dbraw/zinc/61/55/56/418615556.db2.gz	SKIXRKJMERQGHW-SECBINFHSA-N	1	1	306.322	1.712	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2C(=O)NC(=O)[C@H]2C1	ZINC000367836209	418643208	/nfs/dbraw/zinc/64/32/08/418643208.db2.gz	RTQOLCUZXMFHDJ-ICCXJUOJSA-N	1	1	303.318	1.250	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000361293307	418620446	/nfs/dbraw/zinc/62/04/46/418620446.db2.gz	WNBCFRFCADELGR-BXUZGUMPSA-N	1	1	304.350	1.546	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392284	418634000	/nfs/dbraw/zinc/63/40/00/418634000.db2.gz	NNEFQRNJVKMRKE-NWDGAFQWSA-N	1	1	323.397	1.731	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392284	418634001	/nfs/dbraw/zinc/63/40/01/418634001.db2.gz	NNEFQRNJVKMRKE-NWDGAFQWSA-N	1	1	323.397	1.731	20	5		DDBDMO
COc1ccc(CN[C@@H]2CCOC[C@H]2[C@H](C)[NH3+])cc1[N+](=O)[O-]	ZINC000422945646	227273029	/nfs/dbraw/zinc/27/30/29/227273029.db2.gz	NOEDKENZSZCAOH-WCFLWFBJSA-N	1	1	309.366	1.445	20	5		DDBDMO
C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000372125448	418838194	/nfs/dbraw/zinc/83/81/94/418838194.db2.gz	KBCVMYVNGCFKNW-KCPJHIHWSA-N	1	1	318.377	1.388	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000417859233	419356118	/nfs/dbraw/zinc/35/61/18/419356118.db2.gz	VWFCIRVJWGHFEV-SECBINFHSA-N	1	1	316.308	1.857	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915444	419367739	/nfs/dbraw/zinc/36/77/39/419367739.db2.gz	HHQVQVAKCIJVMZ-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915444	419367744	/nfs/dbraw/zinc/36/77/44/419367744.db2.gz	HHQVQVAKCIJVMZ-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420936794	419369890	/nfs/dbraw/zinc/36/98/90/419369890.db2.gz	ITWSWATYCPCXEL-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420936794	419369911	/nfs/dbraw/zinc/36/99/11/419369911.db2.gz	ITWSWATYCPCXEL-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
CC(C)[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C[C@@H]1CCC(=O)N1	ZINC000412082296	419634838	/nfs/dbraw/zinc/63/48/38/419634838.db2.gz	OZFJOAQHYKSYLW-ZDUSSCGKSA-N	1	1	321.377	1.963	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@@](C)(CN)C(C)C)c([N+](=O)[O-])c1	ZINC000430540691	420132243	/nfs/dbraw/zinc/13/22/43/420132243.db2.gz	AIBDESYXPRUAPI-HNNXBMFYSA-N	1	1	311.382	1.945	20	5		DDBDMO
COc1ccc(OCCN[C@@](C)(C[NH3+])C(C)C)c([N+](=O)[O-])c1	ZINC000430540691	420132244	/nfs/dbraw/zinc/13/22/44/420132244.db2.gz	AIBDESYXPRUAPI-HNNXBMFYSA-N	1	1	311.382	1.945	20	5		DDBDMO
CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CNCCO2)cc1[N+](=O)[O-]	ZINC000423550557	420079377	/nfs/dbraw/zinc/07/93/77/420079377.db2.gz	FQCURCUGPJNMRL-DGCLKSJQSA-N	1	1	309.366	1.633	20	5		DDBDMO
[NH3+]C[C@H]1CCN(CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000430928866	420211111	/nfs/dbraw/zinc/21/11/11/420211111.db2.gz	VCYINTQIYAWDDN-LLVKDONJSA-N	1	1	320.349	1.173	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000416301903	420319446	/nfs/dbraw/zinc/31/94/46/420319446.db2.gz	VWAAVNSGLKYPQA-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000416301903	420319449	/nfs/dbraw/zinc/31/94/49/420319449.db2.gz	VWAAVNSGLKYPQA-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000457122574	420621485	/nfs/dbraw/zinc/62/14/85/420621485.db2.gz	OUONMQHGLMTUHE-CYBMUJFWSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)c1	ZINC000449433158	421012033	/nfs/dbraw/zinc/01/20/33/421012033.db2.gz	LASCQXKMVCSYIC-BMFZPTHFSA-N	1	1	306.362	1.957	20	5		DDBDMO
CNc1nc(C(=O)NCC2=CC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000455995661	421086086	/nfs/dbraw/zinc/08/60/86/421086086.db2.gz	OGFSHFPFSFGXNN-UHFFFAOYSA-N	1	1	305.338	1.023	20	5		DDBDMO
COc1cccc(C(=O)NC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000559823906	421226686	/nfs/dbraw/zinc/22/66/86/421226686.db2.gz	PAOFLCUBUYYQQA-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
Cc1ccc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)cc1[N+](=O)[O-]	ZINC000548391299	421432740	/nfs/dbraw/zinc/43/27/40/421432740.db2.gz	UYTRMMABDZWDPR-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000563053547	421446064	/nfs/dbraw/zinc/44/60/64/421446064.db2.gz	ZAPJSTGAPBZCPQ-NSHDSACASA-N	1	1	313.379	1.140	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000563053547	421446066	/nfs/dbraw/zinc/44/60/66/421446066.db2.gz	ZAPJSTGAPBZCPQ-NSHDSACASA-N	1	1	313.379	1.140	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000551892049	421550932	/nfs/dbraw/zinc/55/09/32/421550932.db2.gz	BTGPGJFKHKATMS-VIFPVBQESA-N	1	1	303.322	1.039	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H]1c1ccccn1	ZINC000551270340	421529697	/nfs/dbraw/zinc/52/96/97/421529697.db2.gz	GVGSPAKFHOQYOC-HNNXBMFYSA-N	1	1	314.345	1.989	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000531634629	421641191	/nfs/dbraw/zinc/64/11/91/421641191.db2.gz	BSILMQBNOYCVHL-BXUZGUMPSA-N	1	1	306.366	1.792	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000571577375	421728212	/nfs/dbraw/zinc/72/82/12/421728212.db2.gz	OWLBBQTYIFDNEC-QWRGUYRKSA-N	1	1	318.377	1.992	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000558756533	421824566	/nfs/dbraw/zinc/82/45/66/421824566.db2.gz	GRAONBGMRCDRHV-CHWSQXEVSA-N	1	1	315.333	1.146	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000558984009	421828402	/nfs/dbraw/zinc/82/84/02/421828402.db2.gz	IYARFIJJSWVZKB-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000558984009	421828404	/nfs/dbraw/zinc/82/84/04/421828404.db2.gz	IYARFIJJSWVZKB-NSHDSACASA-N	1	1	322.365	1.697	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000540951058	421778907	/nfs/dbraw/zinc/77/89/07/421778907.db2.gz	XMRPBUMPUZGQOR-LLVKDONJSA-N	1	1	307.350	1.761	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000540951058	421778910	/nfs/dbraw/zinc/77/89/10/421778910.db2.gz	XMRPBUMPUZGQOR-LLVKDONJSA-N	1	1	307.350	1.761	20	5		DDBDMO
C[C@@H](C(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)[NH+]1CC(C)C1	ZINC000580842305	421847241	/nfs/dbraw/zinc/84/72/41/421847241.db2.gz	CGFOGAMDHSJOPF-JTQLQIEISA-N	1	1	317.349	1.428	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CCNCC1([NH3+])CCC1	ZINC000342125510	271308698	/nfs/dbraw/zinc/30/86/98/271308698.db2.gz	IXPFJEZFFAFXNP-UHFFFAOYSA-N	1	1	322.365	1.403	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]CC1(N)CCC1	ZINC000342125510	271308702	/nfs/dbraw/zinc/30/87/02/271308702.db2.gz	IXPFJEZFFAFXNP-UHFFFAOYSA-N	1	1	322.365	1.403	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])nc2)CC1	ZINC000344416436	272020925	/nfs/dbraw/zinc/02/09/25/272020925.db2.gz	JDYZOXRTRCPRKI-ZDUSSCGKSA-N	1	1	307.398	1.675	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@]1(O)CC[N@@H+](C)C1	ZINC000344869428	272132330	/nfs/dbraw/zinc/13/23/30/272132330.db2.gz	RSIKXSZJQXYRFY-OIQJVACTSA-N	1	1	305.378	1.654	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@@]1(O)CC[N@H+](C)C1	ZINC000344869428	272132331	/nfs/dbraw/zinc/13/23/31/272132331.db2.gz	RSIKXSZJQXYRFY-OIQJVACTSA-N	1	1	305.378	1.654	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)CO	ZINC000278292686	274267066	/nfs/dbraw/zinc/26/70/66/274267066.db2.gz	CTORGVGFVFUHLJ-NXEZZACHSA-N	1	1	313.310	1.067	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)CO	ZINC000278292686	274267067	/nfs/dbraw/zinc/26/70/67/274267067.db2.gz	CTORGVGFVFUHLJ-NXEZZACHSA-N	1	1	313.310	1.067	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@H](C)[N@H+]1C	ZINC000293887613	274332032	/nfs/dbraw/zinc/33/20/32/274332032.db2.gz	DFQPTWPRDICYLK-AOOOYVTPSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@H](C)[N@@H+]1C	ZINC000293887613	274332033	/nfs/dbraw/zinc/33/20/33/274332033.db2.gz	DFQPTWPRDICYLK-AOOOYVTPSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000171759015	274358349	/nfs/dbraw/zinc/35/83/49/274358349.db2.gz	AAQFGLLOMFVSML-IUODEOHRSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CCCO1	ZINC000171759015	274358350	/nfs/dbraw/zinc/35/83/50/274358350.db2.gz	AAQFGLLOMFVSML-IUODEOHRSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000413251928	274370622	/nfs/dbraw/zinc/37/06/22/274370622.db2.gz	RHANKJKIDOJFLE-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(C)C1=O	ZINC000338332323	276000318	/nfs/dbraw/zinc/00/03/18/276000318.db2.gz	KEZCUWPAAFYHPL-AWEZNQCLSA-N	1	1	319.361	1.607	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)Cc1c(F)c(OC)ccc1[N+](=O)[O-]	ZINC000412116270	276069214	/nfs/dbraw/zinc/06/92/14/276069214.db2.gz	KGHNTWITXCLTJL-UHFFFAOYSA-N	1	1	313.329	1.353	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1OC)C1CC1	ZINC000277556445	276130479	/nfs/dbraw/zinc/13/04/79/276130479.db2.gz	JLICUYWVXMNVIL-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4ncccc4c3[N+](=O)[O-])C[C@@H]21	ZINC000153187170	277124720	/nfs/dbraw/zinc/12/47/20/277124720.db2.gz	RCMXGAJOFAHAOL-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
COC(=O)C1(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)CC1	ZINC000459507031	277308631	/nfs/dbraw/zinc/30/86/31/277308631.db2.gz	KIHWIGGILJTGII-UHFFFAOYSA-N	1	1	320.349	1.065	20	5		DDBDMO
C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000289926243	279118306	/nfs/dbraw/zinc/11/83/06/279118306.db2.gz	URGVVZBQDTVQAX-CZUORRHYSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[C@H](CO)[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@H](C)O	ZINC000278292710	279358094	/nfs/dbraw/zinc/35/80/94/279358094.db2.gz	CTORGVGFVFUHLJ-ZJUUUORDSA-N	1	1	313.310	1.067	20	5		DDBDMO
C[C@H](CO)[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@H](C)O	ZINC000278292710	279358095	/nfs/dbraw/zinc/35/80/95/279358095.db2.gz	CTORGVGFVFUHLJ-ZJUUUORDSA-N	1	1	313.310	1.067	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000295425853	280188252	/nfs/dbraw/zinc/18/82/52/280188252.db2.gz	UJKSOZLRZBBUIA-SECBINFHSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000295425853	280188254	/nfs/dbraw/zinc/18/82/54/280188254.db2.gz	UJKSOZLRZBBUIA-SECBINFHSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000295425853	280188255	/nfs/dbraw/zinc/18/82/55/280188255.db2.gz	UJKSOZLRZBBUIA-SECBINFHSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCCC[N@@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299435449	280189355	/nfs/dbraw/zinc/18/93/55/280189355.db2.gz	GXEJNFBXRKWARZ-NSHDSACASA-N	1	1	323.397	1.868	20	5		DDBDMO
O=C(CC[NH+]1CCN(C2CC2)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000126083126	281225972	/nfs/dbraw/zinc/22/59/72/281225972.db2.gz	PWDLLHNRIRGGCN-UHFFFAOYSA-N	1	1	318.377	1.703	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccc(F)cn3)CC2)n1	ZINC000362487427	300076511	/nfs/dbraw/zinc/07/65/11/300076511.db2.gz	PAURWUBHZGQCNC-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000362972742	300191335	/nfs/dbraw/zinc/19/13/35/300191335.db2.gz	ANUWQWHOPWDAFT-LXTVHRRPSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000362972742	300191338	/nfs/dbraw/zinc/19/13/38/300191338.db2.gz	ANUWQWHOPWDAFT-LXTVHRRPSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000362972742	300191340	/nfs/dbraw/zinc/19/13/40/300191340.db2.gz	ANUWQWHOPWDAFT-LXTVHRRPSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000362972740	300191409	/nfs/dbraw/zinc/19/14/09/300191409.db2.gz	ANUWQWHOPWDAFT-CBBWQLFWSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000362972740	300191412	/nfs/dbraw/zinc/19/14/12/300191412.db2.gz	ANUWQWHOPWDAFT-CBBWQLFWSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000362972740	300191413	/nfs/dbraw/zinc/19/14/13/300191413.db2.gz	ANUWQWHOPWDAFT-CBBWQLFWSA-N	1	1	309.410	1.765	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1ccc([N+](=O)[O-])cn1	ZINC000363874437	300319872	/nfs/dbraw/zinc/31/98/72/300319872.db2.gz	JESNGQPTZPVPSG-NSHDSACASA-N	1	1	304.350	1.737	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000364020016	300335749	/nfs/dbraw/zinc/33/57/49/300335749.db2.gz	XKXIWJXPHMZODY-RYUDHWBXSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@H]21	ZINC000364300792	300372423	/nfs/dbraw/zinc/37/24/23/300372423.db2.gz	GURFOZRAFNSNMS-NXEZZACHSA-N	1	1	307.379	1.834	20	5		DDBDMO
CC(C)(C)C(=O)N1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000368403778	301020255	/nfs/dbraw/zinc/02/02/55/301020255.db2.gz	GKWVZXFTHZVAOY-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
CC(C)(C)C(=O)N1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000368403778	301020257	/nfs/dbraw/zinc/02/02/57/301020257.db2.gz	GKWVZXFTHZVAOY-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])C[C@@H]21	ZINC000368590257	301059836	/nfs/dbraw/zinc/05/98/36/301059836.db2.gz	KJKJCAFWGXTFHR-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[NH+]1CCN(C[C@H]2CCCN(c3ncccc3[N+](=O)[O-])C2)CC1	ZINC000369027632	301121093	/nfs/dbraw/zinc/12/10/93/301121093.db2.gz	PSHMFEFJUPZKPX-CQSZACIVSA-N	1	1	319.409	1.454	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000370445626	301340805	/nfs/dbraw/zinc/34/08/05/301340805.db2.gz	WHMUTWSFPFXMPS-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@H]2OCC[C@H]2C1	ZINC000376048122	302031140	/nfs/dbraw/zinc/03/11/40/302031140.db2.gz	PYFBGFASRWGYQX-GZBFAFLISA-N	1	1	322.361	1.445	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CNc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000377120686	302145637	/nfs/dbraw/zinc/14/56/37/302145637.db2.gz	PWRLTOJAHNFMDV-MRVPVSSYSA-N	1	1	309.351	1.342	20	5		DDBDMO
C[N@H+]1CCO[C@H](CNc2ncnc3sc([N+](=O)[O-])cc32)C1	ZINC000377120686	302145639	/nfs/dbraw/zinc/14/56/39/302145639.db2.gz	PWRLTOJAHNFMDV-MRVPVSSYSA-N	1	1	309.351	1.342	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)S(C)(=O)=O	ZINC000533129076	303311299	/nfs/dbraw/zinc/31/12/99/303311299.db2.gz	WUZALUKHSIKQRN-SNVBAGLBSA-N	1	1	316.379	1.516	20	5		DDBDMO
C[C@@H](CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000357624730	306899956	/nfs/dbraw/zinc/89/99/56/306899956.db2.gz	BMZVOJLEUDUIBD-LBPRGKRZSA-N	1	1	307.350	1.435	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN2CC[NH+]([C@H]3CCOC3)CC2)c1	ZINC000367413794	307092630	/nfs/dbraw/zinc/09/26/30/307092630.db2.gz	WHPMIYMUABUIBG-HOTGVXAUSA-N	1	1	321.377	1.035	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2C[C@H]2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608741	307192039	/nfs/dbraw/zinc/19/20/39/307192039.db2.gz	DTVBFYPHPNCEIB-ZMSDIMECSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1	ZINC000373608741	307192040	/nfs/dbraw/zinc/19/20/40/307192040.db2.gz	DTVBFYPHPNCEIB-ZMSDIMECSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608741	307192041	/nfs/dbraw/zinc/19/20/41/307192041.db2.gz	DTVBFYPHPNCEIB-ZMSDIMECSA-N	1	1	317.389	1.823	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(Cn2cccn2)CC1	ZINC000374052345	307201029	/nfs/dbraw/zinc/20/10/29/307201029.db2.gz	CSVSXRDKPUZROZ-UHFFFAOYSA-N	1	1	304.354	1.437	20	5		DDBDMO
Cc1nc(C)n(C[C@@H]2CCC[N@H+]2Cc2c([N+](=O)[O-])ncn2C)n1	ZINC000374052764	307201095	/nfs/dbraw/zinc/20/10/95/307201095.db2.gz	FUKWUIALZQAHQX-LBPRGKRZSA-N	1	1	319.369	1.201	20	5		DDBDMO
Cc1nc(C)n(C[C@@H]2CCC[N@@H+]2Cc2c([N+](=O)[O-])ncn2C)n1	ZINC000374052764	307201096	/nfs/dbraw/zinc/20/10/96/307201096.db2.gz	FUKWUIALZQAHQX-LBPRGKRZSA-N	1	1	319.369	1.201	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000374297894	307205068	/nfs/dbraw/zinc/20/50/68/307205068.db2.gz	SDQAQDNASQPLST-JTQLQIEISA-N	1	1	313.321	1.365	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](c3nnc[nH]3)C2)c1	ZINC000377988180	307279836	/nfs/dbraw/zinc/27/98/36/307279836.db2.gz	JNRZXPBBYFVXEG-LBPRGKRZSA-N	1	1	317.349	1.971	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000421026126	307300711	/nfs/dbraw/zinc/30/07/11/307300711.db2.gz	UACIOBPBOKHCOS-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000421026126	307300712	/nfs/dbraw/zinc/30/07/12/307300712.db2.gz	UACIOBPBOKHCOS-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000570120483	308159715	/nfs/dbraw/zinc/15/97/15/308159715.db2.gz	SPSHJSYSRREYTL-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000570120483	308159717	/nfs/dbraw/zinc/15/97/17/308159717.db2.gz	SPSHJSYSRREYTL-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CCC(CC)Nc1cc[nH+]cc1NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000577024573	308356938	/nfs/dbraw/zinc/35/69/38/308356938.db2.gz	BHVDAYRZQOXBKL-UHFFFAOYSA-N	1	1	318.337	1.988	20	5		DDBDMO
COc1ccc(CN[C@H](C)C[C@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000422951212	533697770	/nfs/dbraw/zinc/69/77/70/533697770.db2.gz	ZWAARSCEDWYBJX-YPMHNXCESA-N	1	1	309.366	1.460	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000584435354	337325566	/nfs/dbraw/zinc/32/55/66/337325566.db2.gz	CYYVTTDOWYKKIZ-ZDUSSCGKSA-N	1	1	321.377	1.762	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1F	ZINC000590767510	483927275	/nfs/dbraw/zinc/92/72/75/483927275.db2.gz	ILGYEBQLIKQDOU-TVQRCGJNSA-N	1	1	323.324	1.519	20	5		DDBDMO
NC(=O)NC(=O)OCCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000494676622	534387008	/nfs/dbraw/zinc/38/70/08/534387008.db2.gz	JOAHZEDHWVUXKD-UHFFFAOYSA-N	1	1	322.321	1.148	20	5		DDBDMO
NC(=O)NC(=O)OCCC[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000494676622	534387013	/nfs/dbraw/zinc/38/70/13/534387013.db2.gz	JOAHZEDHWVUXKD-UHFFFAOYSA-N	1	1	322.321	1.148	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCn3ccc([N+](=O)[O-])n3)[C@@H]2C1	ZINC000158413175	523728384	/nfs/dbraw/zinc/72/83/84/523728384.db2.gz	RPYCQNDTIORNGG-JHJVBQTASA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)[C@@H]2C1	ZINC000158413175	523728391	/nfs/dbraw/zinc/72/83/91/523728391.db2.gz	RPYCQNDTIORNGG-JHJVBQTASA-N	1	1	310.354	1.060	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000491561350	534776648	/nfs/dbraw/zinc/77/66/48/534776648.db2.gz	JRXKHSIFJNDSNL-ZHAHRWAOSA-N	1	1	301.346	1.961	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3C[NH+]4CCN3CC4)c2c1	ZINC000413193532	534885383	/nfs/dbraw/zinc/88/53/83/534885383.db2.gz	AFHWXVVYNAWFFX-CQSZACIVSA-N	1	1	313.361	1.555	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451931296	527785633	/nfs/dbraw/zinc/78/56/33/527785633.db2.gz	BJWCPJPRQMDLDO-DGCLKSJQSA-N	1	1	323.349	1.235	20	5		DDBDMO
CC(C)c1ccc(C[N@@H+]2CC[C@@H](O)[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557085	528094196	/nfs/dbraw/zinc/09/41/96/528094196.db2.gz	KZOZTBGXWAXMJB-XJKSGUPXSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CC[C@@H](O)[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC000414557085	528094198	/nfs/dbraw/zinc/09/41/98/528094198.db2.gz	KZOZTBGXWAXMJB-XJKSGUPXSA-N	1	1	308.378	1.893	20	5		DDBDMO
CC(C)[C@@H]([NH3+])CN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803805	528533700	/nfs/dbraw/zinc/53/37/00/528533700.db2.gz	WVXWYEILVWPLLG-RISCZKNCSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@@H](N)C[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803805	528533703	/nfs/dbraw/zinc/53/37/03/528533703.db2.gz	WVXWYEILVWPLLG-RISCZKNCSA-N	1	1	308.382	1.885	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C1(C(N)=O)CCCC1	ZINC000746475477	700026104	/nfs/dbraw/zinc/02/61/04/700026104.db2.gz	MBELCOFXSJDYOA-UHFFFAOYSA-N	1	1	320.349	1.229	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+](C)C1CCN(C(=O)C2CC2)CC1	ZINC000985191027	697465874	/nfs/dbraw/zinc/46/58/74/697465874.db2.gz	PZRKCFXHKCEWPF-UHFFFAOYSA-N	1	1	321.381	1.161	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+](C)C1CCN(C(=O)C2CC2)CC1	ZINC000985191027	697465877	/nfs/dbraw/zinc/46/58/77/697465877.db2.gz	PZRKCFXHKCEWPF-UHFFFAOYSA-N	1	1	321.381	1.161	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776583090	698121710	/nfs/dbraw/zinc/12/17/10/698121710.db2.gz	ZLXFRRANJPGGTM-SCDSUCTJSA-N	1	1	307.350	1.214	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000780868436	698566304	/nfs/dbraw/zinc/56/63/04/698566304.db2.gz	XFLZNWXWKOGPJT-NSHDSACASA-N	1	1	313.379	1.357	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H]2C[C@]2(CO)C1	ZINC000782613671	698750519	/nfs/dbraw/zinc/75/05/19/698750519.db2.gz	BLBOUXBJQLIGNH-BLLLJJGKSA-N	1	1	319.361	1.546	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C	ZINC000787326593	699206190	/nfs/dbraw/zinc/20/61/90/699206190.db2.gz	IMCGWWXDCBCSOX-LERXQTSPSA-N	1	1	308.334	1.512	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000712532592	699263382	/nfs/dbraw/zinc/26/33/82/699263382.db2.gz	XKRJDHJUGJUNJY-MRVPVSSYSA-N	1	1	301.144	1.868	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000712532592	699263384	/nfs/dbraw/zinc/26/33/84/699263384.db2.gz	XKRJDHJUGJUNJY-MRVPVSSYSA-N	1	1	301.144	1.868	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[NH2+]C[C@H](O)C(F)(F)F)OCCO2	ZINC000788975156	699352428	/nfs/dbraw/zinc/35/24/28/699352428.db2.gz	FZZHBQAXYHHPOJ-NSHDSACASA-N	1	1	322.239	1.379	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCCNC(=O)C2)cccc1[N+](=O)[O-]	ZINC000726792124	699380663	/nfs/dbraw/zinc/38/06/63/699380663.db2.gz	LDEAUWVBERCXFZ-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCCNC(=O)C2)cccc1[N+](=O)[O-]	ZINC000726792124	699380668	/nfs/dbraw/zinc/38/06/68/699380668.db2.gz	LDEAUWVBERCXFZ-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@H+]2CCC[C@H]2C)cc1[N+](=O)[O-]	ZINC000744349547	699946352	/nfs/dbraw/zinc/94/63/52/699946352.db2.gz	KSXNXPVMLBDNDE-GFCCVEGCSA-N	1	1	321.377	1.746	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCC1	ZINC000751479413	700293563	/nfs/dbraw/zinc/29/35/63/700293563.db2.gz	OXHGRTZMUTUKNZ-UHFFFAOYSA-N	1	1	318.333	1.884	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H]1C	ZINC000801930504	700356255	/nfs/dbraw/zinc/35/62/55/700356255.db2.gz	CFXQASFROQVIGS-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C[C@H]1C	ZINC000801930504	700356261	/nfs/dbraw/zinc/35/62/61/700356261.db2.gz	CFXQASFROQVIGS-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC)C[C@@H]1C	ZINC000754079787	700481619	/nfs/dbraw/zinc/48/16/19/700481619.db2.gz	LTTIGIGTZUNFBD-NSHDSACASA-N	1	1	306.366	1.485	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2C[N@@H+](C3CC3)C[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000758336321	700699578	/nfs/dbraw/zinc/69/95/78/700699578.db2.gz	PVEFHNWFDPSHDM-GWCFXTLKSA-N	1	1	318.377	1.698	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771404458	701318590	/nfs/dbraw/zinc/31/85/90/701318590.db2.gz	JCWZYHCBJGRYQF-UWVGGRQHSA-N	1	1	322.321	1.668	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000771404458	701318591	/nfs/dbraw/zinc/31/85/91/701318591.db2.gz	JCWZYHCBJGRYQF-UWVGGRQHSA-N	1	1	322.321	1.668	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CCC[NH+]2CCCC2)CC1	ZINC000839711265	701792680	/nfs/dbraw/zinc/79/26/80/701792680.db2.gz	UUAWVIBJQWDLEF-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839729424	701800635	/nfs/dbraw/zinc/80/06/35/701800635.db2.gz	XWHYBZIWTHZGEZ-BZUAXINKSA-N	1	1	319.405	1.924	20	5		DDBDMO
CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839729424	701800642	/nfs/dbraw/zinc/80/06/42/701800642.db2.gz	XWHYBZIWTHZGEZ-BZUAXINKSA-N	1	1	319.405	1.924	20	5		DDBDMO
CC(C)[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839729424	701800646	/nfs/dbraw/zinc/80/06/46/701800646.db2.gz	XWHYBZIWTHZGEZ-BZUAXINKSA-N	1	1	319.405	1.924	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@H]3C[C@@]3(CO)C2)c1	ZINC000811493551	701993914	/nfs/dbraw/zinc/99/39/14/701993914.db2.gz	JAUPWXXZHQWEJD-DOMZBBRYSA-N	1	1	306.318	1.196	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H]3C[C@@]3(CO)C2)c1	ZINC000811493551	701993917	/nfs/dbraw/zinc/99/39/17/701993917.db2.gz	JAUPWXXZHQWEJD-DOMZBBRYSA-N	1	1	306.318	1.196	20	5		DDBDMO
Cc1ccc(CNC(=O)NC[C@@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000868362398	702084131	/nfs/dbraw/zinc/08/41/31/702084131.db2.gz	WZAJWSGXFFDGOF-ZDUSSCGKSA-N	1	1	306.366	1.797	20	5		DDBDMO
Cc1ccc(CNC(=O)NC[C@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000868362397	702084451	/nfs/dbraw/zinc/08/44/51/702084451.db2.gz	WZAJWSGXFFDGOF-CYBMUJFWSA-N	1	1	306.366	1.797	20	5		DDBDMO
CNC(=O)NC[C@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000879332925	706652443	/nfs/dbraw/zinc/65/24/43/706652443.db2.gz	NITXSJKYUGEATK-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
CNC(=O)NC[C@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000879332925	706652444	/nfs/dbraw/zinc/65/24/44/706652444.db2.gz	NITXSJKYUGEATK-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000841102602	702348197	/nfs/dbraw/zinc/34/81/97/702348197.db2.gz	GBYUTKNOMRFMFE-UHFFFAOYSA-N	1	1	308.672	1.964	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000868927124	702389798	/nfs/dbraw/zinc/38/97/98/702389798.db2.gz	HZAALTVMUHVOFI-GFCCVEGCSA-N	1	1	309.341	1.829	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H](N2CC[NH2+]CC2)C1	ZINC000843120798	702823703	/nfs/dbraw/zinc/82/37/03/702823703.db2.gz	CVDHYRHUPSMAMV-OICCZTGUSA-N	1	1	316.405	1.588	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000846921252	703351828	/nfs/dbraw/zinc/35/18/28/703351828.db2.gz	REWZLMBIIVVDEW-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CON1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000846977012	703360017	/nfs/dbraw/zinc/36/00/17/703360017.db2.gz	HYLPLMGNPNCGSP-UHFFFAOYSA-N	1	1	322.365	1.411	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000848353162	703542267	/nfs/dbraw/zinc/54/22/67/703542267.db2.gz	YIITWRMBONOIPY-QWHCGFSZSA-N	1	1	319.365	1.319	20	5		DDBDMO
CC[N@H+](CCOC)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848474336	703554385	/nfs/dbraw/zinc/55/43/85/703554385.db2.gz	BHRBRWPWVIGCMD-OAHLLOKOSA-N	1	1	321.377	1.837	20	5		DDBDMO
CC[N@@H+](CCOC)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848474336	703554387	/nfs/dbraw/zinc/55/43/87/703554387.db2.gz	BHRBRWPWVIGCMD-OAHLLOKOSA-N	1	1	321.377	1.837	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000848659583	703572880	/nfs/dbraw/zinc/57/28/80/703572880.db2.gz	MPSLQAVJWCFHTJ-VXGBXAGGSA-N	1	1	307.350	1.879	20	5		DDBDMO
CC1(C)OC[C@@H](C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851843155	703868787	/nfs/dbraw/zinc/86/87/87/703868787.db2.gz	ATWWYMWDOLCOQL-DGCLKSJQSA-N	1	1	322.365	1.628	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)CN1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000851869838	703874713	/nfs/dbraw/zinc/87/47/13/703874713.db2.gz	SOEMWIHKIKLJLD-CQSZACIVSA-N	1	1	307.394	1.654	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@](O)(C3CC3)C2)c1	ZINC000852500982	704064051	/nfs/dbraw/zinc/06/40/51/704064051.db2.gz	HFWBVBZQQYVKLA-CVEARBPZSA-N	1	1	306.362	1.865	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCc3cn[nH]c3C2)cc1	ZINC000819154242	704077671	/nfs/dbraw/zinc/07/76/71/704077671.db2.gz	GCTPNVCFSNXMEI-WFASDCNBSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCc3[nH]cnc3C2)cc1	ZINC000819321971	704107325	/nfs/dbraw/zinc/10/73/25/704107325.db2.gz	OGRPXRRHNZKITM-NHYWBVRUSA-N	1	1	302.334	1.498	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cn1ncc3cc([N+](=O)[O-])ccc31)C2	ZINC000853565542	704271978	/nfs/dbraw/zinc/27/19/78/704271978.db2.gz	HBZNGGOPEKKTDR-DOMZBBRYSA-N	1	1	302.334	1.870	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000822237613	704896443	/nfs/dbraw/zinc/89/64/43/704896443.db2.gz	BLSXKQJMFCOXKK-ZDUSSCGKSA-N	1	1	315.414	1.295	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]12	ZINC000860158275	705116674	/nfs/dbraw/zinc/11/66/74/705116674.db2.gz	LGKVJVBXCVEFKN-BXUZGUMPSA-N	1	1	306.318	1.469	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860161403	705119361	/nfs/dbraw/zinc/11/93/61/705119361.db2.gz	XZMROFUHIQGYGJ-OPQQBVKSSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860161403	705119364	/nfs/dbraw/zinc/11/93/64/705119364.db2.gz	XZMROFUHIQGYGJ-OPQQBVKSSA-N	1	1	319.317	1.027	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000860176335	705123234	/nfs/dbraw/zinc/12/32/34/705123234.db2.gz	CWPPCGXTUCIRBD-HZPDHXFCSA-N	1	1	321.377	1.619	20	5		DDBDMO
Cc1ccnc(C2CC[NH+](Cc3cn(C)nc3[N+](=O)[O-])CC2)n1	ZINC000877331462	706067048	/nfs/dbraw/zinc/06/70/48/706067048.db2.gz	PGTFKTSBDQLNTM-UHFFFAOYSA-N	1	1	316.365	1.806	20	5		DDBDMO
CCOC(=O)[C@H]1CCC[N@@H+]1C1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000877380833	706087709	/nfs/dbraw/zinc/08/77/09/706087709.db2.gz	VDRMQCQWMHRDMX-GCZXYKMCSA-N	1	1	308.338	1.522	20	5		DDBDMO
CCOC(=O)[C@H]1CCC[N@H+]1C1CC(n2cc([N+](=O)[O-])cn2)C1	ZINC000877380833	706087713	/nfs/dbraw/zinc/08/77/13/706087713.db2.gz	VDRMQCQWMHRDMX-GCZXYKMCSA-N	1	1	308.338	1.522	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(O)(c3ccccc3)CC2)c([N+](=O)[O-])n1	ZINC000877384401	706090257	/nfs/dbraw/zinc/09/02/57/706090257.db2.gz	GEWSSPIFXOFAJV-UHFFFAOYSA-N	1	1	316.361	1.812	20	5		DDBDMO
O=C1CC2(CCC2)[N@H+](Cc2c(F)cccc2[N+](=O)[O-])CCN1	ZINC000880170980	706900529	/nfs/dbraw/zinc/90/05/29/706900529.db2.gz	ZOUYKNHICJXXCN-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
O=C1CC2(CCC2)[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])CCN1	ZINC000880170980	706900530	/nfs/dbraw/zinc/90/05/30/706900530.db2.gz	ZOUYKNHICJXXCN-UHFFFAOYSA-N	1	1	307.325	1.979	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]2C1	ZINC000880310321	706936850	/nfs/dbraw/zinc/93/68/50/706936850.db2.gz	VLPQPWFGWPALTH-BETUJISGSA-N	1	1	307.325	1.644	20	5		DDBDMO
C[C@H]1c2sccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000880377832	706956450	/nfs/dbraw/zinc/95/64/50/706956450.db2.gz	GMMNFRWPBVZAQK-GXFFZTMASA-N	1	1	322.390	1.833	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)CCC(C)(C)[N+](=O)[O-])[C@H]2C1	ZINC000832866749	706996851	/nfs/dbraw/zinc/99/68/51/706996851.db2.gz	XEENBNYUPFZNPZ-QWHCGFSZSA-N	1	1	313.398	1.144	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880528822	707005512	/nfs/dbraw/zinc/00/55/12/707005512.db2.gz	HBIPXIIVAMFXCW-CFVMTHIKSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880528822	707005516	/nfs/dbraw/zinc/00/55/16/707005516.db2.gz	HBIPXIIVAMFXCW-CFVMTHIKSA-N	1	1	319.361	1.229	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000880564952	707019659	/nfs/dbraw/zinc/01/96/59/707019659.db2.gz	ALSKIPFRDOPQGH-ABAIWWIYSA-N	1	1	308.334	1.574	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNc2ccnc(F)c2[N+](=O)[O-])C1	ZINC000881772862	707361490	/nfs/dbraw/zinc/36/14/90/707361490.db2.gz	DSLIHNPTYBZJIG-LLVKDONJSA-N	1	1	312.345	1.898	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CN1CC2(COC2)CC1=O	ZINC000872604547	707508218	/nfs/dbraw/zinc/50/82/18/707508218.db2.gz	GWVHQJABFGNCPD-UHFFFAOYSA-N	1	1	319.361	1.276	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CN1CC2(COC2)CC1=O	ZINC000872604547	707508222	/nfs/dbraw/zinc/50/82/22/707508222.db2.gz	GWVHQJABFGNCPD-UHFFFAOYSA-N	1	1	319.361	1.276	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000882486321	707657041	/nfs/dbraw/zinc/65/70/41/707657041.db2.gz	QCEHBKSNMHRRRC-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000838285914	707887516	/nfs/dbraw/zinc/88/75/16/707887516.db2.gz	PTAKEWZAGFWCOA-CQSZACIVSA-N	1	1	319.317	1.767	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c1	ZINC000897218127	708256386	/nfs/dbraw/zinc/25/63/86/708256386.db2.gz	BCLCBHKBTOAKAM-KBPBESRZSA-N	1	1	321.377	1.639	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897219631	708257284	/nfs/dbraw/zinc/25/72/84/708257284.db2.gz	MEXGMYHIKGALJH-OLZOCXBDSA-N	1	1	322.365	1.034	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000886341409	708745855	/nfs/dbraw/zinc/74/58/55/708745855.db2.gz	URFWAKYPIKGMEE-MXWKQRLJSA-N	1	1	305.334	1.882	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000886341409	708745856	/nfs/dbraw/zinc/74/58/56/708745856.db2.gz	URFWAKYPIKGMEE-MXWKQRLJSA-N	1	1	305.334	1.882	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[N@H+](C)C[C@H]1CC(C)C	ZINC000886602162	708791278	/nfs/dbraw/zinc/79/12/78/708791278.db2.gz	LCVJREXQFSTCEI-CYBMUJFWSA-N	1	1	323.397	1.288	20	5		DDBDMO
CC1CC[NH+](Cc2cn(-c3ccc([N+](=O)[O-])cn3)nn2)CC1	ZINC000887417274	709040661	/nfs/dbraw/zinc/04/06/61/709040661.db2.gz	FZWYVBQTVPESRA-UHFFFAOYSA-N	1	1	302.338	1.802	20	5		DDBDMO
Cc1c(NC(=O)C2C[NH+]([C@@H]3CCOC3)C2)cccc1[N+](=O)[O-]	ZINC000899934944	709242485	/nfs/dbraw/zinc/24/24/85/709242485.db2.gz	FNHJSRXWOGIFHB-GFCCVEGCSA-N	1	1	305.334	1.562	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000890075197	709736150	/nfs/dbraw/zinc/73/61/50/709736150.db2.gz	CEKCEQSFQSPUTA-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)N2CCc3c2cccc3[N+](=O)[O-])C1	ZINC000900770627	709751047	/nfs/dbraw/zinc/75/10/47/709751047.db2.gz	FFDVAFCRTAEAKF-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC(C)(CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])o1	ZINC000912954750	713134431	/nfs/dbraw/zinc/13/44/31/713134431.db2.gz	IOHVPQVSPZMUGH-UHFFFAOYSA-N	1	1	311.338	1.419	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331560	710012409	/nfs/dbraw/zinc/01/24/09/710012409.db2.gz	XTCOLYBPDLLWJQ-FIXISWKDSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000901331560	710012413	/nfs/dbraw/zinc/01/24/13/710012413.db2.gz	XTCOLYBPDLLWJQ-FIXISWKDSA-N	1	1	307.350	1.227	20	5		DDBDMO
COc1c(O)ccc(CNCC[N@H+]2CC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000893353719	710614394	/nfs/dbraw/zinc/61/43/94/710614394.db2.gz	BPMTVAVBOSOGHR-LLVKDONJSA-N	1	1	309.366	1.740	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]CCN2CC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000893353719	710614397	/nfs/dbraw/zinc/61/43/97/710614397.db2.gz	BPMTVAVBOSOGHR-LLVKDONJSA-N	1	1	309.366	1.740	20	5		DDBDMO
COc1cc(OCC(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000928442804	713198072	/nfs/dbraw/zinc/19/80/72/713198072.db2.gz	CFFOFIPZLTVHGL-ZYHUDNBSSA-N	1	1	323.349	1.191	20	5		DDBDMO
C[C@H](Nc1nc2sccn2c1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895247161	711464680	/nfs/dbraw/zinc/46/46/80/711464680.db2.gz	FEOHBFKRLSFPLT-UWVGGRQHSA-N	1	1	324.410	1.350	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000895767839	711600658	/nfs/dbraw/zinc/60/06/58/711600658.db2.gz	SAJILWICXFUUSD-LBPRGKRZSA-N	1	1	304.350	1.603	20	5		DDBDMO
Nc1ccc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c([N+](=O)[O-])c1	ZINC000896523027	711737728	/nfs/dbraw/zinc/73/77/28/711737728.db2.gz	LYKGNZVNOQOPIZ-ZDUSSCGKSA-N	1	1	306.366	1.842	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@@H+]1C[C@@H]2COC[C@]2(c2ccccc2)C1	ZINC000905677013	712114925	/nfs/dbraw/zinc/11/49/25/712114925.db2.gz	UPZDFPKOKGDWJH-ZBFHGGJFSA-N	1	1	314.345	1.649	20	5		DDBDMO
O=[N+]([O-])c1ccnn1C[N@H+]1C[C@@H]2COC[C@]2(c2ccccc2)C1	ZINC000905677013	712114927	/nfs/dbraw/zinc/11/49/27/712114927.db2.gz	UPZDFPKOKGDWJH-ZBFHGGJFSA-N	1	1	314.345	1.649	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000917789288	713513939	/nfs/dbraw/zinc/51/39/39/713513939.db2.gz	MLOUYNZUJNVMGO-SMDDNHRTSA-N	1	1	322.365	1.365	20	5		DDBDMO
CCOCCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000929153854	713558154	/nfs/dbraw/zinc/55/81/54/713558154.db2.gz	COXJHPIAQDASBE-UHFFFAOYSA-N	1	1	323.393	1.770	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](C[C@@H](O)C2(O)CCC2)C2CC2)cc1	ZINC000930140858	713765780	/nfs/dbraw/zinc/76/57/80/713765780.db2.gz	IQDJXXRJWNZPNY-OAHLLOKOSA-N	1	1	306.362	1.835	20	5		DDBDMO
COc1ccc(NC(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000930770640	713916531	/nfs/dbraw/zinc/91/65/31/713916531.db2.gz	AEPCUNMTHCXYES-PHIMTYICSA-N	1	1	320.349	1.629	20	5		DDBDMO
C[C@@]1(C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)COC(=O)N1	ZINC000932102056	714259214	/nfs/dbraw/zinc/25/92/14/714259214.db2.gz	MQLVJYHZSOSVKS-HNNXBMFYSA-N	1	1	320.349	1.700	20	5		DDBDMO
CN1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC[N@@H+](C)CC1	ZINC000933992695	714717070	/nfs/dbraw/zinc/71/70/70/714717070.db2.gz	PGZDEQMFAWSMLZ-UHFFFAOYSA-N	1	1	310.373	1.413	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CCN(C)CC[N@@H+](C)CC1	ZINC000933993865	714717692	/nfs/dbraw/zinc/71/76/92/714717692.db2.gz	QPUXWWQLIOLILV-UHFFFAOYSA-N	1	1	322.409	1.283	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)cc1F	ZINC000934265792	714780175	/nfs/dbraw/zinc/78/01/75/714780175.db2.gz	NPMPFAOUQJSPQG-JKSUJKDBSA-N	1	1	323.368	1.765	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CC[N@@H+](C)[C@H]1C	ZINC000925309438	714803343	/nfs/dbraw/zinc/80/33/43/714803343.db2.gz	ZYLBKTMLDMCLLC-ONGXEEELSA-N	1	1	308.338	1.818	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(N2C[C@@H]3OCC[N@H+](C)[C@H]3C2)nc1Cl	ZINC001164664945	719385507	/nfs/dbraw/zinc/38/55/07/719385507.db2.gz	DAHCHOGOLPNYCK-QWRGUYRKSA-N	1	1	312.757	1.471	20	5		DDBDMO
Cc1cnc(N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922020	721849449	/nfs/dbraw/zinc/84/94/49/721849449.db2.gz	PQLPXMCEHCNYNH-KGLIPLIRSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1cnc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c([N+](=O)[O-])c1	ZINC001164922020	721849451	/nfs/dbraw/zinc/84/94/51/721849451.db2.gz	PQLPXMCEHCNYNH-KGLIPLIRSA-N	1	1	319.409	1.513	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCc3cccs3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025778090	736849560	/nfs/dbraw/zinc/84/95/60/736849560.db2.gz	RCPUIKOWHWIGCU-RGDJUOJXSA-N	1	1	321.402	1.002	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](CCc3cccs3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025778090	736849563	/nfs/dbraw/zinc/84/95/63/736849563.db2.gz	RCPUIKOWHWIGCU-RGDJUOJXSA-N	1	1	321.402	1.002	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](CCc3cccs3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025778090	736849565	/nfs/dbraw/zinc/84/95/65/736849565.db2.gz	RCPUIKOWHWIGCU-RGDJUOJXSA-N	1	1	321.402	1.002	20	5		DDBDMO
O=C(Cc1cnc[nH]1)NCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1	ZINC001167355585	733282312	/nfs/dbraw/zinc/28/23/12/733282312.db2.gz	QQVIMNIVWBIRPP-UHFFFAOYSA-N	1	1	317.349	1.157	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccn2)CC1	ZINC001005379857	749946828	/nfs/dbraw/zinc/94/68/28/749946828.db2.gz	YCNRMCHIGXBXCS-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2C[C@H]3CN(c4ncccn4)C[C@H]3C2)C1	ZINC001169018401	762199410	/nfs/dbraw/zinc/19/94/10/762199410.db2.gz	BDAIJUPTLOVRLH-KBXIAJHMSA-N	1	1	317.393	1.290	20	5		DDBDMO
COC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169018749	762199509	/nfs/dbraw/zinc/19/95/09/762199509.db2.gz	DIQCMSLLZLLXRR-KWCYVHTRSA-N	1	1	308.382	1.411	20	5		DDBDMO
O=C(NCc1ccc2c(c1)C[N@H+](CCCF)C2)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001054264356	759370552	/nfs/dbraw/zinc/37/05/52/759370552.db2.gz	BBQCVYRSOOPDTG-HUUCEWRRSA-N	1	1	321.352	1.643	20	5		DDBDMO
O=C(NCc1ccc2c(c1)C[N@@H+](CCCF)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC001054264356	759370564	/nfs/dbraw/zinc/37/05/64/759370564.db2.gz	BBQCVYRSOOPDTG-HUUCEWRRSA-N	1	1	321.352	1.643	20	5		DDBDMO
O=C(NCc1ccc2c(c1)C[N@H+](CCCF)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC001054264356	759370576	/nfs/dbraw/zinc/37/05/76/759370576.db2.gz	BBQCVYRSOOPDTG-HUUCEWRRSA-N	1	1	321.352	1.643	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2ccccn2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001393533	762820366	/nfs/dbraw/zinc/82/03/66/762820366.db2.gz	DEFJKBFZSZBWCH-HUUCEWRRSA-N	1	1	318.377	1.075	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1cc2c(c([N+](=O)[O-])c1)NN(C)C2	ZINC001170344894	766276992	/nfs/dbraw/zinc/27/69/92/766276992.db2.gz	VPXCLYNXSPRUKY-UHFFFAOYSA-N	1	1	318.337	1.068	20	5		DDBDMO
Cc1ncc(C[NH3+])c(=N)n1[C@H](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001173218533	777050958	/nfs/dbraw/zinc/05/09/58/777050958.db2.gz	PTYVSOVPLYHCNU-SNVBAGLBSA-N	1	1	301.350	1.842	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(CF)cc1	ZINC001267241364	837589525	/nfs/dbraw/zinc/58/95/25/837589525.db2.gz	UNYGOLGKQDFNRB-HUUCEWRRSA-N	1	1	323.368	1.759	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(CF)cc1	ZINC001267241364	837589535	/nfs/dbraw/zinc/58/95/35/837589535.db2.gz	UNYGOLGKQDFNRB-HUUCEWRRSA-N	1	1	323.368	1.759	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(CF)cc1	ZINC001267241364	837589544	/nfs/dbraw/zinc/58/95/44/837589544.db2.gz	UNYGOLGKQDFNRB-HUUCEWRRSA-N	1	1	323.368	1.759	20	5		DDBDMO
C[N@@H+](CC1CCC1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001029964567	844358057	/nfs/dbraw/zinc/35/80/57/844358057.db2.gz	OVCDPYXXFNMLTQ-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
C[N@H+](CC1CCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001029964567	844358069	/nfs/dbraw/zinc/35/80/69/844358069.db2.gz	OVCDPYXXFNMLTQ-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
C[N@@H+](CC1CCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001029964567	844358074	/nfs/dbraw/zinc/35/80/74/844358074.db2.gz	OVCDPYXXFNMLTQ-HUUCEWRRSA-N	1	1	309.410	1.622	20	5		DDBDMO
O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1cocn1	ZINC001268523189	840380806	/nfs/dbraw/zinc/38/08/06/840380806.db2.gz	PTUGCWPMPFSFQY-OWOJBTEDSA-N	1	1	322.346	1.720	20	5		DDBDMO
COc1ncnc2c1CC[N@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169021294	850518114	/nfs/dbraw/zinc/51/81/14/850518114.db2.gz	KLLPFFRQTUERTH-NEPJUHHUSA-N	1	1	306.366	1.331	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCC1(N(C)C)CC[NH+](C)CC1	ZINC001156176087	862777781	/nfs/dbraw/zinc/77/77/81/862777781.db2.gz	JJHLUCRLVYIWGH-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CC[C@H]2[C@@H](CC[N@H+]2C)C1	ZINC001122733056	858951212	/nfs/dbraw/zinc/95/12/12/858951212.db2.gz	WJLPDSCDCIPOKJ-STQMWFEESA-N	1	1	322.413	1.241	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1C[N@@H+]2CCN1C[C@@H]2C	ZINC001123879896	859452171	/nfs/dbraw/zinc/45/21/71/859452171.db2.gz	JVSVCNQCEQGZSZ-FZMZJTMJSA-N	1	1	318.377	1.538	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1C[C@@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975894	859507029	/nfs/dbraw/zinc/50/70/29/859507029.db2.gz	GUSQVLAMRAVGBN-HUBLWGQQSA-N	1	1	318.377	1.160	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]21	ZINC001157266669	863695115	/nfs/dbraw/zinc/69/51/15/863695115.db2.gz	VXJIZHOIWLFAHZ-SKDRFNHKSA-N	1	1	307.310	1.428	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001157265912	863695599	/nfs/dbraw/zinc/69/55/99/863695599.db2.gz	LIBVLZJHMNBHNH-PWSUYJOCSA-N	1	1	320.349	1.307	20	5		DDBDMO
[NH3+]Cc1ncn(-c2nc(C(F)(F)F)nc(Cl)c2[N+](=O)[O-])n1	ZINC001157931479	864277087	/nfs/dbraw/zinc/27/70/87/864277087.db2.gz	OSXSRAJPXHDROB-UHFFFAOYSA-N	1	1	323.622	1.096	20	5		DDBDMO
COc1cc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160722164	866068055	/nfs/dbraw/zinc/06/80/55/866068055.db2.gz	FKVHXZISEQSIFB-NEPJUHHUSA-N	1	1	322.365	1.664	20	5		DDBDMO
CCCOC(=O)CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001162490562	867574239	/nfs/dbraw/zinc/57/42/39/867574239.db2.gz	IHGAGOPMPVGDCZ-AATRIKPKSA-N	1	1	308.338	1.887	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC001325113609	867783206	/nfs/dbraw/zinc/78/32/06/867783206.db2.gz	MEQKXEBFEBUHKH-LLVKDONJSA-N	1	1	307.354	1.265	20	5		DDBDMO
O=[N+]([O-])c1cc[n+]([O-])c(NCC[C@@H]2CC[NH2+]CC2(F)F)c1	ZINC001162808110	867841913	/nfs/dbraw/zinc/84/19/13/867841913.db2.gz	LUGWAIQRSLNKAY-VIFPVBQESA-N	1	1	302.281	1.275	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])ccc1O[C@H]1CCc2[nH+]ccn2C1	ZINC001226169396	882245071	/nfs/dbraw/zinc/24/50/71/882245071.db2.gz	CUXLKFKWPUDMHZ-JTQLQIEISA-N	1	1	302.290	1.284	20	5		DDBDMO
CN1CCC[C@@H](C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001336763996	869130612	/nfs/dbraw/zinc/13/06/12/869130612.db2.gz	WRWDKIAJGLWVAZ-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C[NH+](C)C	ZINC001336779627	869136510	/nfs/dbraw/zinc/13/65/10/869136510.db2.gz	VQNCFAMUSVNLNR-OCCSQVGLSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@H](C[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1)CN(C)C	ZINC001336779627	869136513	/nfs/dbraw/zinc/13/65/13/869136513.db2.gz	VQNCFAMUSVNLNR-OCCSQVGLSA-N	1	1	311.382	1.122	20	5		DDBDMO
C[N@H+]1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1(C)C	ZINC001337168675	869359603	/nfs/dbraw/zinc/35/96/03/869359603.db2.gz	AZVVQUWDEVPYLJ-UHFFFAOYSA-N	1	1	303.366	1.928	20	5		DDBDMO
C[N@@H+](C1CN(c2cc([N+](=O)[O-])c3cc[nH]c3n2)C1)[C@@H]1CCOC1	ZINC001165205512	869429348	/nfs/dbraw/zinc/42/93/48/869429348.db2.gz	LILPKJVGWRYNDC-SNVBAGLBSA-N	1	1	317.349	1.380	20	5		DDBDMO
CN(CC[N@@H+]1CCOC(C)(C)C1)c1cc(N)c([N+](=O)[O-])cn1	ZINC001337854025	869658527	/nfs/dbraw/zinc/65/85/27/869658527.db2.gz	IKPLIOVRYFDCOZ-UHFFFAOYSA-N	1	1	309.370	1.119	20	5		DDBDMO
CN(CC[N@H+]1CCOC(C)(C)C1)c1cc(N)c([N+](=O)[O-])cn1	ZINC001337854025	869658533	/nfs/dbraw/zinc/65/85/33/869658533.db2.gz	IKPLIOVRYFDCOZ-UHFFFAOYSA-N	1	1	309.370	1.119	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1CCCC[N@H+]1C	ZINC001338020101	869748611	/nfs/dbraw/zinc/74/86/11/869748611.db2.gz	BARXBUBEQMJWOE-LBPRGKRZSA-N	1	1	306.366	1.851	20	5		DDBDMO
Cn1c[nH+]cc1C1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC001340015143	870840627	/nfs/dbraw/zinc/84/06/27/870840627.db2.gz	UZYBCHGBUISPAI-UHFFFAOYSA-N	1	1	303.322	1.813	20	5		DDBDMO
C[N@@H+](CCCCC(F)(F)F)CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001317448415	871337031	/nfs/dbraw/zinc/33/70/31/871337031.db2.gz	TWORLBOXUFEOIC-NXEZZACHSA-N	1	1	311.304	1.432	20	5		DDBDMO
C[N@H+](CCCCC(F)(F)F)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317448415	871337051	/nfs/dbraw/zinc/33/70/51/871337051.db2.gz	TWORLBOXUFEOIC-NXEZZACHSA-N	1	1	311.304	1.432	20	5		DDBDMO
C[N@@H+](CCCCC(F)(F)F)CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317448415	871337069	/nfs/dbraw/zinc/33/70/69/871337069.db2.gz	TWORLBOXUFEOIC-NXEZZACHSA-N	1	1	311.304	1.432	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(F)ccc3[N+](=O)[O-])[C@@H]2C1	ZINC001347539437	874178914	/nfs/dbraw/zinc/17/89/14/874178914.db2.gz	KYJTWLVQHSFMKV-BIMULSAOSA-N	1	1	307.325	1.804	20	5		DDBDMO
C[N+](C)(C)C[C@H](O)CC(=O)Oc1nc2ccc(Cl)cc2[nH]1	ZINC001227262260	882942228	/nfs/dbraw/zinc/94/22/28/882942228.db2.gz	LGJUOXGUSSXHNH-SNVBAGLBSA-N	1	1	312.777	1.579	20	5		DDBDMO
CC[N@H+]1CC[C@@H](OCc2ccc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001223413621	880951984	/nfs/dbraw/zinc/95/19/84/880951984.db2.gz	MHOOCIOSSDZKBQ-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1	ZINC001234361137	887908106	/nfs/dbraw/zinc/90/81/06/887908106.db2.gz	ZJVOHBQQUTYRQP-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001254564400	896501285	/nfs/dbraw/zinc/50/12/85/896501285.db2.gz	LNDLKGKDQROGFX-JSGCOSHPSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)COC[C@@H]2C1	ZINC001254564400	896501303	/nfs/dbraw/zinc/50/13/03/896501303.db2.gz	LNDLKGKDQROGFX-JSGCOSHPSA-N	1	1	319.361	1.069	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[NH+]([C@H]3CCOC3)CC1)C2	ZINC001254596753	896522929	/nfs/dbraw/zinc/52/29/29/896522929.db2.gz	GAYUFNYIZDIGGT-DLBZAZTESA-N	1	1	317.389	1.469	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN([C@H]3CCOC3)CC1)C2	ZINC001254596753	896522942	/nfs/dbraw/zinc/52/29/42/896522942.db2.gz	GAYUFNYIZDIGGT-DLBZAZTESA-N	1	1	317.389	1.469	20	5		DDBDMO
COC(=O)C[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612381	896534360	/nfs/dbraw/zinc/53/43/60/896534360.db2.gz	VUYOGICDLSYQKN-ABAIWWIYSA-N	1	1	304.346	1.947	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC001263980016	900854359	/nfs/dbraw/zinc/85/43/59/900854359.db2.gz	LEJBWASZLQXSAR-NILFDRSVSA-N	1	1	303.362	1.973	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CN1	ZINC000278741790	214368611	/nfs/dbraw/zinc/36/86/11/214368611.db2.gz	AGLZGFZRDDLQHX-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)CN1	ZINC000278741790	214368614	/nfs/dbraw/zinc/36/86/14/214368614.db2.gz	AGLZGFZRDDLQHX-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000452113976	231306390	/nfs/dbraw/zinc/30/63/90/231306390.db2.gz	JDDJVBZRAOBHFN-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CCO)c1cccc([N+](=O)[O-])c1	ZINC000452395975	231377133	/nfs/dbraw/zinc/37/71/33/231377133.db2.gz	XNXQBQWXHKBLMA-AWEZNQCLSA-N	1	1	307.350	1.171	20	5		DDBDMO
CN(C)C1(C[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CCC1	ZINC000614992372	362108393	/nfs/dbraw/zinc/10/83/93/362108393.db2.gz	FJHMPAISCMPKOI-UHFFFAOYSA-N	1	1	321.377	1.940	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)[N@@H+](C)C1CC1	ZINC000181465855	199300726	/nfs/dbraw/zinc/30/07/26/199300726.db2.gz	SGSCRUKHOVTNPE-VIFPVBQESA-N	1	1	321.333	1.536	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cc[nH]n1	ZINC000358218008	299101793	/nfs/dbraw/zinc/10/17/93/299101793.db2.gz	YIHPCSQRTDIHOR-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cc[nH]n1	ZINC000358218008	299101796	/nfs/dbraw/zinc/10/17/96/299101796.db2.gz	YIHPCSQRTDIHOR-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[C@H](CNc1cccc(C(N)=O)c1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000342346036	282553522	/nfs/dbraw/zinc/55/35/22/282553522.db2.gz	HQINPSLYZLQCFW-LLVKDONJSA-N	1	1	322.365	1.074	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000279730485	215099220	/nfs/dbraw/zinc/09/92/20/215099220.db2.gz	JOINSVHHWXOAGR-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000279730485	215099223	/nfs/dbraw/zinc/09/92/23/215099223.db2.gz	JOINSVHHWXOAGR-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1CCC(C(N)=O)CC1	ZINC000021847346	352174749	/nfs/dbraw/zinc/17/47/49/352174749.db2.gz	IXRVXUICYBKVER-JTQLQIEISA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000046863490	352466714	/nfs/dbraw/zinc/46/67/14/352466714.db2.gz	KZKZRBGGVBEHAY-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1	ZINC000053572008	352660750	/nfs/dbraw/zinc/66/07/50/352660750.db2.gz	ZPXWNKGSSDBAKB-ZIAGYGMSSA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1ccccc1C[NH+]1CCC(NC(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000053968488	352674475	/nfs/dbraw/zinc/67/44/75/352674475.db2.gz	ABDUDTMYONNUPN-HOTGVXAUSA-N	1	1	317.389	1.741	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000063707051	352920138	/nfs/dbraw/zinc/92/01/38/352920138.db2.gz	KHKUUAABIIENTH-CYBMUJFWSA-N	1	1	305.378	1.984	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](c1ccco1)[NH+](C)C	ZINC000068409786	353109397	/nfs/dbraw/zinc/10/93/97/353109397.db2.gz	SRDUHXPHMNNTBI-NSHDSACASA-N	1	1	321.337	1.112	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000069529188	353165676	/nfs/dbraw/zinc/16/56/76/353165676.db2.gz	JPVJIFFOVWMPKC-GFCCVEGCSA-N	1	1	307.350	1.435	20	5		DDBDMO
CC(C)NC(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174248288	198310212	/nfs/dbraw/zinc/31/02/12/198310212.db2.gz	VFZUCXGUZMEWLV-UHFFFAOYSA-N	1	1	321.377	1.963	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)c1ncc([N+](=O)[O-])c(N)n1	ZINC000076268929	353409727	/nfs/dbraw/zinc/40/97/27/353409727.db2.gz	ANUMSSZWJGAROL-UHFFFAOYSA-N	1	1	308.386	1.668	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000174705056	198373325	/nfs/dbraw/zinc/37/33/25/198373325.db2.gz	CJIWUNZYYZCYRC-LLVKDONJSA-N	1	1	323.349	1.246	20	5		DDBDMO
COCC[N@@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000077742302	353485452	/nfs/dbraw/zinc/48/54/52/353485452.db2.gz	OTPCCUNRDVRXDE-UHFFFAOYSA-N	1	1	313.379	1.451	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000077742302	353485456	/nfs/dbraw/zinc/48/54/56/353485456.db2.gz	OTPCCUNRDVRXDE-UHFFFAOYSA-N	1	1	313.379	1.451	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000078404364	353515278	/nfs/dbraw/zinc/51/52/78/353515278.db2.gz	RRSULMXUKRXQDG-ZDUSSCGKSA-N	1	1	306.366	1.457	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000080433657	353607117	/nfs/dbraw/zinc/60/71/17/353607117.db2.gz	YCESAOVMHNHANS-AWEZNQCLSA-N	1	1	321.402	1.858	20	5		DDBDMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083170728	353706483	/nfs/dbraw/zinc/70/64/83/353706483.db2.gz	FNRXNPQHMWKNTR-VHSXEESVSA-N	1	1	318.333	1.822	20	5		DDBDMO
CCN1CC[NH+](CCCNc2ncc([N+](=O)[O-])cc2C)CC1	ZINC000092607669	353863463	/nfs/dbraw/zinc/86/34/63/353863463.db2.gz	LWLNJYOPKQHLGA-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC)C1	ZINC000112076012	353970278	/nfs/dbraw/zinc/97/02/78/353970278.db2.gz	FVBVSYNSQNCSJO-LLVKDONJSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000108342750	353951116	/nfs/dbraw/zinc/95/11/16/353951116.db2.gz	GILLHDNGKFHMJM-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000108346738	353951175	/nfs/dbraw/zinc/95/11/75/353951175.db2.gz	GELRCCKKJUEHSV-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](O)[C@H](C)C2)c1	ZINC000589514775	354998553	/nfs/dbraw/zinc/99/85/53/354998553.db2.gz	LNSYVYHLUHZHFD-YGRLFVJLSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](O)[C@H](C)C2)c1	ZINC000589514775	354998556	/nfs/dbraw/zinc/99/85/56/354998556.db2.gz	LNSYVYHLUHZHFD-YGRLFVJLSA-N	1	1	308.334	1.584	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)[C@@H]2C1	ZINC000590010681	355040145	/nfs/dbraw/zinc/04/01/45/355040145.db2.gz	OSRDJTJXTLYSJK-XHDPSFHLSA-N	1	1	319.361	1.597	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[NH+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000590575310	355118522	/nfs/dbraw/zinc/11/85/22/355118522.db2.gz	KBBPWYHVSXWZNF-UHFFFAOYSA-N	1	1	306.322	1.061	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)[C@@H]2C1	ZINC000590445476	355098858	/nfs/dbraw/zinc/09/88/58/355098858.db2.gz	MYSYZPLZJCWVOV-ZUZCIYMTSA-N	1	1	314.345	1.852	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+]2CCC[C@@H]2C1	ZINC000332580474	235140617	/nfs/dbraw/zinc/14/06/17/235140617.db2.gz	HTPDBWDARYWDLN-CYBMUJFWSA-N	1	1	318.377	1.622	20	5		DDBDMO
Cc1cnc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000591744916	355376208	/nfs/dbraw/zinc/37/62/08/355376208.db2.gz	OABUIASOISNUBE-GFCCVEGCSA-N	1	1	323.374	1.889	20	5		DDBDMO
COC(=O)[C@H]1C[C@H](O)C[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532027	355616957	/nfs/dbraw/zinc/61/69/57/355616957.db2.gz	LYUNHNXBZMUJMA-STQMWFEESA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)[C@H]1C[C@H](O)C[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000592532027	355616959	/nfs/dbraw/zinc/61/69/59/355616959.db2.gz	LYUNHNXBZMUJMA-STQMWFEESA-N	1	1	308.334	1.259	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@H]3C[N@@H+](C)C[C@H]32)c1	ZINC000593029327	355774589	/nfs/dbraw/zinc/77/45/89/355774589.db2.gz	FFXPAVAPRACXDH-SWLSCSKDSA-N	1	1	319.361	1.517	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000593187837	355821283	/nfs/dbraw/zinc/82/12/83/355821283.db2.gz	USWHIQWUFBGJCU-QJPTWQEYSA-N	1	1	309.370	1.121	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594081517	356108031	/nfs/dbraw/zinc/10/80/31/356108031.db2.gz	OFPMLORGBRPJLP-DGCLKSJQSA-N	1	1	319.365	1.550	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595298325	356439584	/nfs/dbraw/zinc/43/95/84/356439584.db2.gz	QKAAAHFGRLSSTN-NSHDSACASA-N	1	1	310.354	1.629	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])C1	ZINC000595298325	356439590	/nfs/dbraw/zinc/43/95/90/356439590.db2.gz	QKAAAHFGRLSSTN-NSHDSACASA-N	1	1	310.354	1.629	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000081522084	192281261	/nfs/dbraw/zinc/28/12/61/192281261.db2.gz	LURJJRARIKCLPW-NSHDSACASA-N	1	1	307.350	1.552	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595755462	356637118	/nfs/dbraw/zinc/63/71/18/356637118.db2.gz	ARLLWCNSJQONHQ-XHBSWPGZSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[NH2+]C[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000237063732	202138977	/nfs/dbraw/zinc/13/89/77/202138977.db2.gz	HFWJJXCGKUJCLZ-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H](C3CCC3)C2)c1	ZINC000595838737	356673675	/nfs/dbraw/zinc/67/36/75/356673675.db2.gz	VHVLNKQLXHPJTC-HIFRSBDPSA-N	1	1	308.382	1.664	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596160435	356797310	/nfs/dbraw/zinc/79/73/10/356797310.db2.gz	VVNNXDDLNSNAIV-YPMHNXCESA-N	1	1	318.377	1.757	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596166794	356799454	/nfs/dbraw/zinc/79/94/54/356799454.db2.gz	WQOGNJRHMGBWAQ-FZMZJTMJSA-N	1	1	318.377	1.614	20	5		DDBDMO
CC(C)[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C	ZINC000596206012	356813571	/nfs/dbraw/zinc/81/35/71/356813571.db2.gz	JWLIDHNVNHCMNZ-AWEZNQCLSA-N	1	1	306.366	1.470	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000597853876	357358306	/nfs/dbraw/zinc/35/83/06/357358306.db2.gz	CSCIVSGMVPXBNL-LLVKDONJSA-N	1	1	309.370	1.028	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000597857314	357360221	/nfs/dbraw/zinc/36/02/21/357360221.db2.gz	DBVIPDAFQVIQKB-LLVKDONJSA-N	1	1	323.397	1.515	20	5		DDBDMO
CCN(C(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597944553	357393531	/nfs/dbraw/zinc/39/35/31/357393531.db2.gz	FBKDZTXRTDRAII-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597946005	357393806	/nfs/dbraw/zinc/39/38/06/357393806.db2.gz	MKQIXAHPBPAMNO-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@H+](C)C1	ZINC000597946005	357393811	/nfs/dbraw/zinc/39/38/11/357393811.db2.gz	MKQIXAHPBPAMNO-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597946005	357393817	/nfs/dbraw/zinc/39/38/17/357393817.db2.gz	MKQIXAHPBPAMNO-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CC[N@@H+](C)C1	ZINC000597946879	357394700	/nfs/dbraw/zinc/39/47/00/357394700.db2.gz	RVLJNSDNAPGQSL-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000178866893	198943508	/nfs/dbraw/zinc/94/35/08/198943508.db2.gz	DPESEKAWIDKYPG-DZGCQCFKSA-N	1	1	308.334	1.513	20	5		DDBDMO
NC(=O)c1ccnc(NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000599163076	357834718	/nfs/dbraw/zinc/83/47/18/357834718.db2.gz	ATCHAGJVUDDUOQ-NSHDSACASA-N	1	1	319.365	1.518	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2NCC[N@@H+]2CC[C@H](O)C2)s1	ZINC000599199221	357847617	/nfs/dbraw/zinc/84/76/17/357847617.db2.gz	HJORLFBIMJVBEM-QMMMGPOBSA-N	1	1	309.351	1.078	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000599568556	357977898	/nfs/dbraw/zinc/97/78/98/357977898.db2.gz	UBCNXGDLALPIRQ-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000599568556	357977903	/nfs/dbraw/zinc/97/79/03/357977903.db2.gz	UBCNXGDLALPIRQ-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599682289	358023726	/nfs/dbraw/zinc/02/37/26/358023726.db2.gz	ZTLKWICUURUNDJ-SGIREYDYSA-N	1	1	319.361	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21	ZINC000599682289	358023728	/nfs/dbraw/zinc/02/37/28/358023728.db2.gz	ZTLKWICUURUNDJ-SGIREYDYSA-N	1	1	319.361	1.687	20	5		DDBDMO
C[NH+](C)[C@@H]1[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@H]21	ZINC000599988956	358096957	/nfs/dbraw/zinc/09/69/57/358096957.db2.gz	PIICXECXOGQSEW-YABSGUDNSA-N	1	1	315.333	1.103	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OC	ZINC000180860888	199220207	/nfs/dbraw/zinc/22/02/07/199220207.db2.gz	RFYHUUHNTCHBKA-GHMZBOCLSA-N	1	1	310.350	1.815	20	5		DDBDMO
CNC(=O)[C@H]1CCC[C@@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601136388	358417105	/nfs/dbraw/zinc/41/71/05/358417105.db2.gz	QNCCGBFQAOPMAV-FZMZJTMJSA-N	1	1	314.345	1.892	20	5		DDBDMO
COc1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC000601150535	358422580	/nfs/dbraw/zinc/42/25/80/358422580.db2.gz	YZWPOZXWYRKVLR-INIZCTEOSA-N	1	1	317.345	1.996	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](CO)[C@H]3CCOC3)c2c1	ZINC000601159134	358426434	/nfs/dbraw/zinc/42/64/34/358426434.db2.gz	HRMJCTSXDCRKGS-NWDGAFQWSA-N	1	1	317.345	1.622	20	5		DDBDMO
Cc1nn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000601956661	358753048	/nfs/dbraw/zinc/75/30/48/358753048.db2.gz	GWJCLDUZARHMCY-INIZCTEOSA-N	1	1	316.361	1.737	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974881	358761010	/nfs/dbraw/zinc/76/10/10/358761010.db2.gz	SCSVDLMICGNQEI-SDDRHHMPSA-N	1	1	305.334	1.500	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974881	358761012	/nfs/dbraw/zinc/76/10/12/358761012.db2.gz	SCSVDLMICGNQEI-SDDRHHMPSA-N	1	1	305.334	1.500	20	5		DDBDMO
CO[C@@]1(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCOC1	ZINC000602472606	359001665	/nfs/dbraw/zinc/00/16/65/359001665.db2.gz	JBTCOSOISMCYIR-IUODEOHRSA-N	1	1	322.365	1.282	20	5		DDBDMO
Cn1cc(C[N@H+](C)CCCNC(=O)C2CCC2)c([N+](=O)[O-])n1	ZINC000602637835	359090724	/nfs/dbraw/zinc/09/07/24/359090724.db2.gz	OEYNNSPOLUMUJV-UHFFFAOYSA-N	1	1	309.370	1.067	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCCNC(=O)C2CCC2)c([N+](=O)[O-])n1	ZINC000602637835	359090727	/nfs/dbraw/zinc/09/07/27/359090727.db2.gz	OEYNNSPOLUMUJV-UHFFFAOYSA-N	1	1	309.370	1.067	20	5		DDBDMO
COCCO[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602795264	359198176	/nfs/dbraw/zinc/19/81/76/359198176.db2.gz	ADBXHDQYXPLJGD-CYBMUJFWSA-N	1	1	312.370	1.227	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000602831702	359223410	/nfs/dbraw/zinc/22/34/10/359223410.db2.gz	PWHXIDNHNMMMKF-DOTOQJQBSA-N	1	1	322.405	1.981	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](CO)C1	ZINC000602930626	359300846	/nfs/dbraw/zinc/30/08/46/359300846.db2.gz	IDILTDPBBBZSBQ-RDBSUJKOSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC000602946800	359313314	/nfs/dbraw/zinc/31/33/14/359313314.db2.gz	DXFMVGFDQALZSK-CYBMUJFWSA-N	1	1	321.381	1.524	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602963070	359326170	/nfs/dbraw/zinc/32/61/70/359326170.db2.gz	SUXQZCXHFSPJPB-ZBFHGGJFSA-N	1	1	307.394	1.876	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1O	ZINC000186861198	200023754	/nfs/dbraw/zinc/02/37/54/200023754.db2.gz	OWIIRDVAXMTBFR-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1O	ZINC000186861198	200023757	/nfs/dbraw/zinc/02/37/57/200023757.db2.gz	OWIIRDVAXMTBFR-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](O)[C@H](C)C1	ZINC000186864511	200024204	/nfs/dbraw/zinc/02/42/04/200024204.db2.gz	KVSLQAPEGLWDSI-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](O)[C@H](C)C1	ZINC000186864511	200024206	/nfs/dbraw/zinc/02/42/06/200024206.db2.gz	KVSLQAPEGLWDSI-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCOC1	ZINC000603854340	359687853	/nfs/dbraw/zinc/68/78/53/359687853.db2.gz	GUIPMQLYMTZGHR-UKRRQHHQSA-N	1	1	324.377	1.693	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[NH+](C2CC2)CC1	ZINC000604473492	359754445	/nfs/dbraw/zinc/75/44/45/359754445.db2.gz	PWSQNPSJHHERSS-UHFFFAOYSA-N	1	1	318.377	1.622	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000604290911	359732410	/nfs/dbraw/zinc/73/24/10/359732410.db2.gz	LXZWBRUKWNTYKG-LBPRGKRZSA-N	1	1	322.365	1.497	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)C(C)C	ZINC000609583291	360329277	/nfs/dbraw/zinc/32/92/77/360329277.db2.gz	RBALMNFUTHNQRY-UHFFFAOYSA-N	1	1	323.349	1.784	20	5		DDBDMO
CN(CC(=O)N[C@@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000610292834	360411165	/nfs/dbraw/zinc/41/11/65/360411165.db2.gz	QJOJKEIKAZPASC-GFCCVEGCSA-N	1	1	306.366	1.241	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762616	360530992	/nfs/dbraw/zinc/53/09/92/360530992.db2.gz	GUAXHQIEJUSUCF-GXTWGEPZSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762616	360530997	/nfs/dbraw/zinc/53/09/97/360530997.db2.gz	GUAXHQIEJUSUCF-GXTWGEPZSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](n2ccnc2)C1	ZINC000611185064	360652924	/nfs/dbraw/zinc/65/29/24/360652924.db2.gz	HAEWWYZKLCMALE-ZDUSSCGKSA-N	1	1	317.349	1.290	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000611088443	360620221	/nfs/dbraw/zinc/62/02/21/360620221.db2.gz	WMJPJUZVFDQFGO-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000611088443	360620223	/nfs/dbraw/zinc/62/02/23/360620223.db2.gz	WMJPJUZVFDQFGO-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
O=[N+]([O-])c1ccc(O)cc1CN1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000611268418	360683999	/nfs/dbraw/zinc/68/39/99/360683999.db2.gz	LNIPCCMFWJOJDE-CVEARBPZSA-N	1	1	321.377	1.331	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H](C)C[NH+]2CCOCC2)n1	ZINC000611616852	360777046	/nfs/dbraw/zinc/77/70/46/360777046.db2.gz	QWLVLGCAUYLBSS-LLVKDONJSA-N	1	1	308.382	1.987	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCC([N@@H+](C)CCCO)CC2)n1	ZINC000611616489	360777353	/nfs/dbraw/zinc/77/73/53/360777353.db2.gz	SVBVLZPRZKGNBD-UHFFFAOYSA-N	1	1	322.409	1.890	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1	ZINC000271899824	209308733	/nfs/dbraw/zinc/30/87/33/209308733.db2.gz	GOQBGJPDYAQCEF-UHFFFAOYSA-N	1	1	308.313	1.308	20	5		DDBDMO
CC1(C)C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000619187186	363926649	/nfs/dbraw/zinc/92/66/49/363926649.db2.gz	WDBROXIAHXDXFK-KBPBESRZSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC1(C)C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000619187186	363926653	/nfs/dbraw/zinc/92/66/53/363926653.db2.gz	WDBROXIAHXDXFK-KBPBESRZSA-N	1	1	319.361	1.403	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CCC[N@H+](CCO)CC1)CCN2	ZINC000275333315	212275652	/nfs/dbraw/zinc/27/56/52/212275652.db2.gz	GIQVZMVBMNRBRT-UHFFFAOYSA-N	1	1	306.366	1.067	20	5		DDBDMO
C[C@H]1CN(CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)CCO1	ZINC000282538871	217072617	/nfs/dbraw/zinc/07/26/17/217072617.db2.gz	VWWODLAKRZJBRA-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C(=O)NCCF	ZINC000282545533	217078800	/nfs/dbraw/zinc/07/88/00/217078800.db2.gz	CLJKGSDBLKZABP-MRVPVSSYSA-N	1	1	303.721	1.812	20	5		DDBDMO
C[N@@H+](CCNc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1)C1CC1	ZINC000288297543	220070526	/nfs/dbraw/zinc/07/05/26/220070526.db2.gz	GZPBMYJIXFQALK-UHFFFAOYSA-N	1	1	303.322	1.750	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000288454409	220152163	/nfs/dbraw/zinc/15/21/63/220152163.db2.gz	NYUSAFHNXIGABO-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@@H+](CC=Cc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000284780500	218174902	/nfs/dbraw/zinc/17/49/02/218174902.db2.gz	KLZREBRAKKDVSR-HNLSUCLVSA-N	1	1	316.361	1.706	20	5		DDBDMO
CN1C(=O)N[C@@H]2C[N@H+](CC=Cc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000284780500	218174904	/nfs/dbraw/zinc/17/49/04/218174904.db2.gz	KLZREBRAKKDVSR-HNLSUCLVSA-N	1	1	316.361	1.706	20	5		DDBDMO
CC(C)(C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000338670297	250084291	/nfs/dbraw/zinc/08/42/91/250084291.db2.gz	BQPFSPNPUCROKD-RYUDHWBXSA-N	1	1	321.381	1.269	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(C)=O)CC1	ZINC000288581053	220259023	/nfs/dbraw/zinc/25/90/23/220259023.db2.gz	XKLYLDVHCATHNB-ZDUSSCGKSA-N	1	1	321.377	1.690	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000285090696	218287421	/nfs/dbraw/zinc/28/74/21/218287421.db2.gz	DMCBIJLQIVNOMV-GJZGRUSLSA-N	1	1	319.361	1.448	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](O)C[C@@H]1C	ZINC000340925921	251281813	/nfs/dbraw/zinc/28/18/13/251281813.db2.gz	IVVXCMIYBPCONN-WCQYABFASA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNc2ncc([N+](=O)[O-])cn2)C[C@H](C)O1	ZINC000273138615	210515226	/nfs/dbraw/zinc/51/52/26/210515226.db2.gz	DIUHYVKXVPUMPY-QWRGUYRKSA-N	1	1	309.370	1.685	20	5		DDBDMO
C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000272995108	210376837	/nfs/dbraw/zinc/37/68/37/210376837.db2.gz	QNZKCRPEPIBKFN-GFCCVEGCSA-N	1	1	319.361	1.740	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1cccc(F)c1	ZINC000158952879	197313837	/nfs/dbraw/zinc/31/38/37/197313837.db2.gz	NHKTZTMUXOCLBN-LLVKDONJSA-N	1	1	321.312	1.490	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000272951045	210338961	/nfs/dbraw/zinc/33/89/61/210338961.db2.gz	MRXDCBVLZAMSQC-SNVBAGLBSA-N	1	1	304.350	1.557	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCOC2CCC2)CC1	ZINC000298057241	285165561	/nfs/dbraw/zinc/16/55/61/285165561.db2.gz	JRLVFAQUNJTDTO-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
COc1cc(C[N@@H+](C)C[C@@H]2CCN(C(C)=O)C2)ccc1[N+](=O)[O-]	ZINC000352765923	285285582	/nfs/dbraw/zinc/28/55/82/285285582.db2.gz	APMYHTHAQWMQFV-AWEZNQCLSA-N	1	1	321.377	1.904	20	5		DDBDMO
COc1cc(C(=O)NCCCn2cc[nH+]c2C)ccc1[N+](=O)[O-]	ZINC000299687123	533533925	/nfs/dbraw/zinc/53/39/25/533533925.db2.gz	URVKVTBYGQIBLP-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
COc1c(C(=O)NCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000353331579	285666303	/nfs/dbraw/zinc/66/63/03/285666303.db2.gz	AIEWXBBSKJNMAF-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1	ZINC000103201166	407333867	/nfs/dbraw/zinc/33/38/67/407333867.db2.gz	CIVVDHXMPXRLHJ-UHFFFAOYSA-N	1	1	318.337	1.659	20	5		DDBDMO
CC[C@H]1CN(c2nc(C)ccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000124696811	407366072	/nfs/dbraw/zinc/36/60/72/407366072.db2.gz	BQBKKBGKQQEUEE-OLZOCXBDSA-N	1	1	308.382	1.580	20	5		DDBDMO
CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000178516321	407477405	/nfs/dbraw/zinc/47/74/05/407477405.db2.gz	LMTDELSNMWZXOZ-NSHDSACASA-N	1	1	310.354	1.455	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000170793071	407508024	/nfs/dbraw/zinc/50/80/24/407508024.db2.gz	JRXXNWSBBWIJQM-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000170911874	407551062	/nfs/dbraw/zinc/55/10/62/407551062.db2.gz	YETBDWMJEPSBTE-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC[N@@H+](CC)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000185885737	407531323	/nfs/dbraw/zinc/53/13/23/407531323.db2.gz	LQAULHNAXRYHKB-UHFFFAOYSA-N	1	1	315.395	1.605	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000114063540	407539035	/nfs/dbraw/zinc/53/90/35/407539035.db2.gz	BYOAASGWJBPKBY-NSHDSACASA-N	1	1	323.349	1.664	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)CC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000114139113	407544827	/nfs/dbraw/zinc/54/48/27/407544827.db2.gz	GLSYVHXNUDCYSB-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000114727663	407605878	/nfs/dbraw/zinc/60/58/78/407605878.db2.gz	CGBHQUGOGATAFS-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CC(C)(C)O)c([N+](=O)[O-])c1	ZINC000114727663	407605883	/nfs/dbraw/zinc/60/58/83/407605883.db2.gz	CGBHQUGOGATAFS-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
CNC(=O)NC(=O)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000130372105	407680309	/nfs/dbraw/zinc/68/03/09/407680309.db2.gz	WGIRARKUCDBKMS-UHFFFAOYSA-N	1	1	320.349	1.405	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000171803846	407770074	/nfs/dbraw/zinc/77/00/74/407770074.db2.gz	PSTLOWSBRHJFBF-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
COc1cc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000153771356	407898448	/nfs/dbraw/zinc/89/84/48/407898448.db2.gz	BNUXUKCAWKBFNT-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000272527318	407966441	/nfs/dbraw/zinc/96/64/41/407966441.db2.gz	IAQOFUNTCFSODX-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000189571682	408053354	/nfs/dbraw/zinc/05/33/54/408053354.db2.gz	IGDURHQZAHBJBW-ZENOOKHLSA-N	1	1	323.393	1.015	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000272570091	407987914	/nfs/dbraw/zinc/98/79/14/407987914.db2.gz	CWQLOFHNJHPERV-MNOVXSKESA-N	1	1	306.366	1.732	20	5		DDBDMO
COc1ccc(NC(=O)NC[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000272865604	408013882	/nfs/dbraw/zinc/01/38/82/408013882.db2.gz	SVGSUJZWFBCGHL-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
CC[C@@H]1CN(c2ccc([N+](=O)[O-])c(C)n2)CC[N@H+]1CCOC	ZINC000150768368	408197478	/nfs/dbraw/zinc/19/74/78/408197478.db2.gz	ONSMJZDDWHBYTP-CYBMUJFWSA-N	1	1	308.382	1.845	20	5		DDBDMO
CC[NH+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000121440014	408209427	/nfs/dbraw/zinc/20/94/27/408209427.db2.gz	KCDPHRKNQWBVJC-UHFFFAOYSA-N	1	1	316.361	1.783	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000269390666	408291138	/nfs/dbraw/zinc/29/11/38/408291138.db2.gz	RHAFSSABJVZSFO-QWRGUYRKSA-N	1	1	321.381	1.798	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000246641628	408310303	/nfs/dbraw/zinc/31/03/03/408310303.db2.gz	FRZJXCDJLKYKBR-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000246810226	408344796	/nfs/dbraw/zinc/34/47/96/408344796.db2.gz	DGQAWKPSBNGHOA-CMPLNLGQSA-N	1	1	306.366	1.636	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205958	408386153	/nfs/dbraw/zinc/38/61/53/408386153.db2.gz	ROBLWIBQQIZFCS-RTXFEEFZSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000191205958	408386154	/nfs/dbraw/zinc/38/61/54/408386154.db2.gz	ROBLWIBQQIZFCS-RTXFEEFZSA-N	1	1	308.338	1.065	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000247318435	408448879	/nfs/dbraw/zinc/44/88/79/408448879.db2.gz	SCUBNYFGNCYQMZ-GXTWGEPZSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])c2nonc21)[NH+]1CCOCC1	ZINC000264187219	408395570	/nfs/dbraw/zinc/39/55/70/408395570.db2.gz	BVPFWGWOYKKRHJ-VHSXEESVSA-N	1	1	321.337	1.652	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000191540155	408442645	/nfs/dbraw/zinc/44/26/45/408442645.db2.gz	GFPXQLBUJHWENA-LBPRGKRZSA-N	1	1	306.366	1.781	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000247285283	408444577	/nfs/dbraw/zinc/44/45/77/408444577.db2.gz	GDPPBWZYJCQJLZ-TZMCWYRMSA-N	1	1	320.393	1.805	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000176962899	408484735	/nfs/dbraw/zinc/48/47/35/408484735.db2.gz	NNKANWZMAPSQKZ-LBPRGKRZSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000176989644	408491486	/nfs/dbraw/zinc/49/14/86/408491486.db2.gz	QMPVBLWYBQFYSK-CMPLNLGQSA-N	1	1	304.350	1.486	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC000264543341	408529109	/nfs/dbraw/zinc/52/91/09/408529109.db2.gz	BCDNWUYCUBWCPI-CYBMUJFWSA-N	1	1	307.350	1.930	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC000264543341	408529115	/nfs/dbraw/zinc/52/91/15/408529115.db2.gz	BCDNWUYCUBWCPI-CYBMUJFWSA-N	1	1	307.350	1.930	20	5		DDBDMO
C[C@H](C[NH+]1CCN(C)CC1)Nc1ccc([N+](=O)[O-])c2nonc21	ZINC000264387798	408472081	/nfs/dbraw/zinc/47/20/81/408472081.db2.gz	JZGVFCYTJFYWDT-SNVBAGLBSA-N	1	1	320.353	1.179	20	5		DDBDMO
C[C@H](CCN1CC[NH+](C)CC1)NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000184337346	408592760	/nfs/dbraw/zinc/59/27/60/408592760.db2.gz	VVLCBWAAEWLYBX-CYBMUJFWSA-N	1	1	320.393	1.351	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000161369147	408594992	/nfs/dbraw/zinc/59/49/92/408594992.db2.gz	AHUMEXGWCLDOTE-CABZTGNLSA-N	1	1	324.356	1.775	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000161401027	408597956	/nfs/dbraw/zinc/59/79/56/408597956.db2.gz	BPZHPKOFDGUVHB-WFASDCNBSA-N	1	1	305.378	1.982	20	5		DDBDMO
C[C@@H]1[NH2+]CCC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000193558643	408727511	/nfs/dbraw/zinc/72/75/11/408727511.db2.gz	WKGPLULPBKGMAC-KWQFWETISA-N	1	1	303.322	1.341	20	5		DDBDMO
COc1cccc(NC[C@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000185454474	408810299	/nfs/dbraw/zinc/81/02/99/408810299.db2.gz	IBZWEMUNVLFPNY-LBPRGKRZSA-N	1	1	309.366	1.984	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C)CC2(C)C)cc1[N+](=O)[O-]	ZINC000270926824	408744586	/nfs/dbraw/zinc/74/45/86/408744586.db2.gz	PBCKSQWAZFMUFU-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)CC2(C)C)cc1[N+](=O)[O-]	ZINC000270926824	408744589	/nfs/dbraw/zinc/74/45/89/408744589.db2.gz	PBCKSQWAZFMUFU-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270929680	408746501	/nfs/dbraw/zinc/74/65/01/408746501.db2.gz	DYGWHWRHOCJMIW-GFCCVEGCSA-N	1	1	323.397	1.713	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)n1	ZINC000177999710	408754127	/nfs/dbraw/zinc/75/41/27/408754127.db2.gz	RDIUNDSWDTWQKS-HNNXBMFYSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[C@H]1C[C@H](Nc2ccc(C(N)=O)cc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000290840047	408842714	/nfs/dbraw/zinc/84/27/14/408842714.db2.gz	VQPLXSDNOHAHHA-ONGXEEELSA-N	1	1	304.350	1.731	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H]1CCC[N@H+]1CCOC	ZINC000192561851	163226969	/nfs/dbraw/zinc/22/69/69/163226969.db2.gz	QJLYZYOFXGIEJS-LBPRGKRZSA-N	1	1	311.386	1.642	20	5		DDBDMO
CN(C(=O)CCn1cc([N+](=O)[O-])cn1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000286267840	408951944	/nfs/dbraw/zinc/95/19/44/408951944.db2.gz	QKDCAXKDCYOGTP-FUNVUKJBSA-N	1	1	321.381	1.265	20	5		DDBDMO
COc1cc(C[N@H+](C)CCOCCO)c([N+](=O)[O-])cc1F	ZINC000282282391	409026396	/nfs/dbraw/zinc/02/63/96/409026396.db2.gz	DYDCXLWETWRVQX-UHFFFAOYSA-N	1	1	302.302	1.183	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCOCCO)c([N+](=O)[O-])cc1F	ZINC000282282391	409026398	/nfs/dbraw/zinc/02/63/98/409026398.db2.gz	DYDCXLWETWRVQX-UHFFFAOYSA-N	1	1	302.302	1.183	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000278156556	409074630	/nfs/dbraw/zinc/07/46/30/409074630.db2.gz	AACLIJJOPTYDTL-LLVKDONJSA-N	1	1	304.354	1.129	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278156556	409074631	/nfs/dbraw/zinc/07/46/31/409074631.db2.gz	AACLIJJOPTYDTL-LLVKDONJSA-N	1	1	304.354	1.129	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000278156556	409074632	/nfs/dbraw/zinc/07/46/32/409074632.db2.gz	AACLIJJOPTYDTL-LLVKDONJSA-N	1	1	304.354	1.129	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](O)CC1	ZINC000293260980	409077598	/nfs/dbraw/zinc/07/75/98/409077598.db2.gz	UKNFNWAUAINCEY-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](O)CC1	ZINC000293260980	409077602	/nfs/dbraw/zinc/07/76/02/409077602.db2.gz	UKNFNWAUAINCEY-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F	ZINC000293462510	409117829	/nfs/dbraw/zinc/11/78/29/409117829.db2.gz	DHMVMWFIHRANJD-VIFPVBQESA-N	1	1	322.283	1.789	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C[C@H]2C1	ZINC000279200783	409169291	/nfs/dbraw/zinc/16/92/91/409169291.db2.gz	LPBVETQNLUROHC-PHIMTYICSA-N	1	1	314.345	1.710	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCCC[N@H+](C)CCN(C)C	ZINC000290239153	409332838	/nfs/dbraw/zinc/33/28/38/409332838.db2.gz	WQOOKQQSKWUQIP-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCCCN(C)CC[NH+](C)C	ZINC000290239153	409332840	/nfs/dbraw/zinc/33/28/40/409332840.db2.gz	WQOOKQQSKWUQIP-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C)[C@H](C)C2)n1	ZINC000319187112	164034917	/nfs/dbraw/zinc/03/49/17/164034917.db2.gz	OSBAEQIEXGKSQB-ZJUUUORDSA-N	1	1	308.338	1.671	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(NC(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	ZINC000331643342	409728437	/nfs/dbraw/zinc/72/84/37/409728437.db2.gz	JNOPSXAFMYVSPT-UHFFFAOYSA-N	1	1	318.337	1.055	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC000357029286	409806364	/nfs/dbraw/zinc/80/63/64/409806364.db2.gz	CSFDTOJKCUYDAP-CHWSQXEVSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)C2)C1	ZINC000346263208	409891862	/nfs/dbraw/zinc/89/18/62/409891862.db2.gz	BXJPKZALBQTUPV-HNNXBMFYSA-N	1	1	321.381	1.081	20	5		DDBDMO
C[C@H]1[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@@H+]1C	ZINC000354548071	409930972	/nfs/dbraw/zinc/93/09/72/409930972.db2.gz	RRUWPZCROHOOCK-GWCFXTLKSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1[C@@H](NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000354548071	409930976	/nfs/dbraw/zinc/93/09/76/409930976.db2.gz	RRUWPZCROHOOCK-GWCFXTLKSA-N	1	1	313.379	1.356	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CCC[NH3+])CC2CCCC2)c1[N+](=O)[O-]	ZINC000357383470	410003651	/nfs/dbraw/zinc/00/36/51/410003651.db2.gz	UZIUDNHONDOXPH-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000357701780	410195940	/nfs/dbraw/zinc/19/59/40/410195940.db2.gz	XSIILHYNWIWGGS-ONGXEEELSA-N	1	1	308.338	1.671	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](O)[C@@H](C)C1	ZINC000351787262	410235167	/nfs/dbraw/zinc/23/51/67/410235167.db2.gz	YTGXOEZMEGSNIZ-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCC(C)(C)C1	ZINC000347427552	410540381	/nfs/dbraw/zinc/54/03/81/410540381.db2.gz	JCBJJTBWLTZEPY-UHFFFAOYSA-N	1	1	309.370	1.180	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000330569425	410784564	/nfs/dbraw/zinc/78/45/64/410784564.db2.gz	MCUIDYLCPHOQLE-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1nn(CCC(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000330605533	410821665	/nfs/dbraw/zinc/82/16/65/410821665.db2.gz	ZDVYNUWHKZJQQQ-WDEREUQCSA-N	1	1	323.397	1.349	20	5		DDBDMO
C[NH+](C)CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000356285898	410943642	/nfs/dbraw/zinc/94/36/42/410943642.db2.gz	XAGAHXJBQCHIAN-UHFFFAOYSA-N	1	1	317.349	1.637	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](CCCN1CCOCC1)CC2	ZINC000131399829	196164760	/nfs/dbraw/zinc/16/47/60/196164760.db2.gz	BOZPAEUFRTXJBN-UHFFFAOYSA-N	1	1	305.378	1.675	20	5		DDBDMO
C[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000131920940	196209743	/nfs/dbraw/zinc/20/97/43/196209743.db2.gz	VGOXDEZXWDYMIA-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000131920940	196209745	/nfs/dbraw/zinc/20/97/45/196209745.db2.gz	VGOXDEZXWDYMIA-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
CCOc1cc(CN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000373913784	418472450	/nfs/dbraw/zinc/47/24/50/418472450.db2.gz	VTLVLLAMHVAYOQ-OKILXGFUSA-N	1	1	305.378	1.987	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000360741655	418505465	/nfs/dbraw/zinc/50/54/65/418505465.db2.gz	XTQYZHSRISIQJK-CYBMUJFWSA-N	1	1	309.322	1.263	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)Nc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000360741655	418505468	/nfs/dbraw/zinc/50/54/68/418505468.db2.gz	XTQYZHSRISIQJK-CYBMUJFWSA-N	1	1	309.322	1.263	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCC[NH+]1CCN(CC)CC1	ZINC000360961364	418556239	/nfs/dbraw/zinc/55/62/39/418556239.db2.gz	PRRPNFYLQSLUFG-UHFFFAOYSA-N	1	1	324.429	1.559	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2C(=O)NC[C@H]2C1	ZINC000368232016	418707388	/nfs/dbraw/zinc/70/73/88/418707388.db2.gz	YVSRPARRAMNZRF-WCQYABFASA-N	1	1	305.334	1.171	20	5		DDBDMO
C[C@@](O)(C[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614005	418662830	/nfs/dbraw/zinc/66/28/30/418662830.db2.gz	SXPBEALEFKPULM-GXSJLCMTSA-N	1	1	322.287	1.742	20	5		DDBDMO
C[C@@](O)(C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614005	418662833	/nfs/dbraw/zinc/66/28/33/418662833.db2.gz	SXPBEALEFKPULM-GXSJLCMTSA-N	1	1	322.287	1.742	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H]3C(=O)NC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000368063182	418683021	/nfs/dbraw/zinc/68/30/21/418683021.db2.gz	MLSLBHXJOMLPQM-OLZOCXBDSA-N	1	1	319.361	1.561	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000368133900	418694366	/nfs/dbraw/zinc/69/43/66/418694366.db2.gz	IDLDZDDNNXPULU-UNQGMJICSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000368133900	418694369	/nfs/dbraw/zinc/69/43/69/418694369.db2.gz	IDLDZDDNNXPULU-UNQGMJICSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000368133900	418694371	/nfs/dbraw/zinc/69/43/71/418694371.db2.gz	IDLDZDDNNXPULU-UNQGMJICSA-N	1	1	303.362	1.288	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365840936	418914962	/nfs/dbraw/zinc/91/49/62/418914962.db2.gz	XBJOLLCGFALCMQ-BZNIZROVSA-N	1	1	319.361	1.769	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2CCO)c2c(c1)COCO2	ZINC000426230923	419411496	/nfs/dbraw/zinc/41/14/96/419411496.db2.gz	NXMYATSCNFTSJK-ZDUSSCGKSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411798510	419415982	/nfs/dbraw/zinc/41/59/82/419415982.db2.gz	LWDWIJFFQCGZBQ-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC(=O)[C@H]1CN([C@@H](C)c2ccccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000411912325	419479810	/nfs/dbraw/zinc/47/98/10/419479810.db2.gz	VGKZXMDOVOWJLI-QWHCGFSZSA-N	1	1	321.377	1.692	20	5		DDBDMO
COC(=O)[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411915480	419484852	/nfs/dbraw/zinc/48/48/52/419484852.db2.gz	ZHEDROKJBCKGPO-ZDUSSCGKSA-N	1	1	307.350	1.131	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C[C@@H]1CCC[N@H+]1C	ZINC000421000787	419433418	/nfs/dbraw/zinc/43/34/18/419433418.db2.gz	KNIQYJOOQUCFOE-AWEZNQCLSA-N	1	1	320.393	1.868	20	5		DDBDMO
CN(C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[N@H+]1C	ZINC000421011085	419443861	/nfs/dbraw/zinc/44/38/61/419443861.db2.gz	RSQCCCUXZSVORW-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011085	419443873	/nfs/dbraw/zinc/44/38/73/419443873.db2.gz	RSQCCCUXZSVORW-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CCC[C@H]1C[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421011085	419443880	/nfs/dbraw/zinc/44/38/80/419443880.db2.gz	RSQCCCUXZSVORW-KBPBESRZSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1C[C@H](C)[N@H+](CCO)C[C@H]1C	ZINC000418122953	419555141	/nfs/dbraw/zinc/55/51/41/419555141.db2.gz	YGKIXUWHGVKXNG-UONOGXRCSA-N	1	1	307.394	1.790	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000411946400	419515380	/nfs/dbraw/zinc/51/53/80/419515380.db2.gz	SKMHUWOCPHSOQE-LBPRGKRZSA-N	1	1	307.350	1.384	20	5		DDBDMO
Cc1nnc([C@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)[nH]1	ZINC000412029360	419577449	/nfs/dbraw/zinc/57/74/49/419577449.db2.gz	OJHPQCWEVCCEIK-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n1	ZINC000412029360	419577454	/nfs/dbraw/zinc/57/74/54/419577454.db2.gz	OJHPQCWEVCCEIK-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1n[nH]c([C@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n1	ZINC000412029360	419577460	/nfs/dbraw/zinc/57/74/60/419577460.db2.gz	OJHPQCWEVCCEIK-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@H]2CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000412029360	419577464	/nfs/dbraw/zinc/57/74/64/419577464.db2.gz	OJHPQCWEVCCEIK-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
Cc1nc([C@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000412029360	419577472	/nfs/dbraw/zinc/57/74/72/419577472.db2.gz	OJHPQCWEVCCEIK-LBPRGKRZSA-N	1	1	317.349	1.890	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2C[C@H](O)C[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000412039585	419582603	/nfs/dbraw/zinc/58/26/03/419582603.db2.gz	PZPKGFHNALMULA-NWDGAFQWSA-N	1	1	310.350	1.685	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])[nH]1)CCC(F)(F)F	ZINC000427226983	419621711	/nfs/dbraw/zinc/62/17/11/419621711.db2.gz	VLVFYKNPHBGCJO-UHFFFAOYSA-N	1	1	322.287	1.927	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)[C@@H](C)C1	ZINC000421878632	419755281	/nfs/dbraw/zinc/75/52/81/419755281.db2.gz	VSPPQAMWKSZDSB-ZDUSSCGKSA-N	1	1	321.377	1.350	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000421878632	419755288	/nfs/dbraw/zinc/75/52/88/419755288.db2.gz	VSPPQAMWKSZDSB-ZDUSSCGKSA-N	1	1	321.377	1.350	20	5		DDBDMO
COCC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000428010768	419788040	/nfs/dbraw/zinc/78/80/40/419788040.db2.gz	MYCUINJYHJANJB-LBPRGKRZSA-N	1	1	323.349	1.141	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000428010768	419788043	/nfs/dbraw/zinc/78/80/43/419788043.db2.gz	MYCUINJYHJANJB-LBPRGKRZSA-N	1	1	323.349	1.141	20	5		DDBDMO
COCCC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000299266695	229018093	/nfs/dbraw/zinc/01/80/93/229018093.db2.gz	KUGPSOGXBAKXLX-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
COCCC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000299266695	229018095	/nfs/dbraw/zinc/01/80/95/229018095.db2.gz	KUGPSOGXBAKXLX-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@H](C(N)=O)CC[C@@H]1C	ZINC000430226202	420091776	/nfs/dbraw/zinc/09/17/76/420091776.db2.gz	MSQGDHJVRYWODF-CMPLNLGQSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420381746	420251481	/nfs/dbraw/zinc/25/14/81/420251481.db2.gz	ZJHWHSGTCDHDCS-XHBSWPGZSA-N	1	1	320.393	1.900	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)CN1CCOCC1	ZINC000434709122	420262412	/nfs/dbraw/zinc/26/24/12/420262412.db2.gz	FRKBWCINOMJVRJ-ZDUSSCGKSA-N	1	1	323.393	1.756	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@@H](C)CN1CCOCC1	ZINC000434709122	420262416	/nfs/dbraw/zinc/26/24/16/420262416.db2.gz	FRKBWCINOMJVRJ-ZDUSSCGKSA-N	1	1	323.393	1.756	20	5		DDBDMO
Cc1c(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000416294351	420310275	/nfs/dbraw/zinc/31/02/75/420310275.db2.gz	KVODYNCPAXUXRG-NWDGAFQWSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000416294351	420310278	/nfs/dbraw/zinc/31/02/78/420310278.db2.gz	KVODYNCPAXUXRG-NWDGAFQWSA-N	1	1	321.377	1.430	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000436009892	420301730	/nfs/dbraw/zinc/30/17/30/420301730.db2.gz	WQFWEDXBHYCHOU-NEPJUHHUSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000457004734	420586299	/nfs/dbraw/zinc/58/62/99/420586299.db2.gz	YMWPRHXNVZLNPA-GFCCVEGCSA-N	1	1	301.302	1.975	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1	ZINC000457121475	420622425	/nfs/dbraw/zinc/62/24/25/420622425.db2.gz	OLIPQTDHTFFIED-CYBMUJFWSA-N	1	1	323.397	1.431	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@@H](NC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000492739438	420648031	/nfs/dbraw/zinc/64/80/31/420648031.db2.gz	AIULVEURKHZMSP-LLVKDONJSA-N	1	1	308.338	1.236	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@H](NC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000492739438	420648036	/nfs/dbraw/zinc/64/80/36/420648036.db2.gz	AIULVEURKHZMSP-LLVKDONJSA-N	1	1	308.338	1.236	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C(N)=O)c1ccccn1	ZINC000449364562	420999293	/nfs/dbraw/zinc/99/92/93/420999293.db2.gz	SHYAZWFTNGFCJI-NHYWBVRUSA-N	1	1	314.345	1.737	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C/C=C\c1ccccc1[N+](=O)[O-]	ZINC000449786394	421082969	/nfs/dbraw/zinc/08/29/69/421082969.db2.gz	NMYODXAENJIQKC-SDQPKGBYSA-N	1	1	305.378	1.606	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000489333273	421146667	/nfs/dbraw/zinc/14/66/67/421146667.db2.gz	GHHHQAAQLOGCRE-ZDUSSCGKSA-N	1	1	324.356	1.728	20	5		DDBDMO
COc1cccc(NC[C@H]2CCC[N@H+]2CCCO)c1[N+](=O)[O-]	ZINC000450588319	421213042	/nfs/dbraw/zinc/21/30/42/421213042.db2.gz	AXMIUHQNTLXGLY-GFCCVEGCSA-N	1	1	309.366	1.862	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2CCC[N@H+]2CCCO)c1[N+](=O)[O-]	ZINC000450601233	421216075	/nfs/dbraw/zinc/21/60/75/421216075.db2.gz	YCBRQJDFWANUKT-LLVKDONJSA-N	1	1	311.386	1.149	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000525620063	421294231	/nfs/dbraw/zinc/29/42/31/421294231.db2.gz	ZESTYBXVEDMQJH-ZJUUUORDSA-N	1	1	321.333	1.536	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000516852236	421570561	/nfs/dbraw/zinc/57/05/61/421570561.db2.gz	JAAFMVGLRCJFAL-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000518650470	421661400	/nfs/dbraw/zinc/66/14/00/421661400.db2.gz	JPUXXUQMYFYGAT-CYBMUJFWSA-N	1	1	321.377	1.604	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000521500315	421790468	/nfs/dbraw/zinc/79/04/68/421790468.db2.gz	IODUYKAPUUEBDP-JTQLQIEISA-N	1	1	323.349	1.784	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000557919990	421794041	/nfs/dbraw/zinc/79/40/41/421794041.db2.gz	LSUBYROQWPRWCX-LBPRGKRZSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000557919990	421794044	/nfs/dbraw/zinc/79/40/44/421794044.db2.gz	LSUBYROQWPRWCX-LBPRGKRZSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000573932543	422034756	/nfs/dbraw/zinc/03/47/56/422034756.db2.gz	LZKFOPIDQBBXBB-SNVBAGLBSA-N	1	1	307.354	1.176	20	5		DDBDMO
Nc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cn1	ZINC000592430866	422333003	/nfs/dbraw/zinc/33/30/03/422333003.db2.gz	IKVLUVVWULYNIT-UHFFFAOYSA-N	1	1	313.361	1.894	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H]2OCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000578527776	422590239	/nfs/dbraw/zinc/59/02/39/422590239.db2.gz	QBWRQGVRMHVORI-DOMZBBRYSA-N	1	1	319.361	1.668	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CO)C[C@H]1C	ZINC000344143395	271958031	/nfs/dbraw/zinc/95/80/31/271958031.db2.gz	BQBAGPBVVZNXQB-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](CO)C[C@H]1C	ZINC000344143395	271958034	/nfs/dbraw/zinc/95/80/34/271958034.db2.gz	BQBAGPBVVZNXQB-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+]1C[C@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964281	272377356	/nfs/dbraw/zinc/37/73/56/272377356.db2.gz	QGPUQGUHNXXJDB-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964281	272377357	/nfs/dbraw/zinc/37/73/57/272377357.db2.gz	QGPUQGUHNXXJDB-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1C[C@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964281	272377360	/nfs/dbraw/zinc/37/73/60/272377360.db2.gz	QGPUQGUHNXXJDB-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964281	272377362	/nfs/dbraw/zinc/37/73/62/272377362.db2.gz	QGPUQGUHNXXJDB-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000346050859	272398890	/nfs/dbraw/zinc/39/88/90/272398890.db2.gz	RIDGHJDJRIVRCO-NWDGAFQWSA-N	1	1	323.397	1.431	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCC([N@@H+](C)CCCO)CC2)c1	ZINC000338667783	274117811	/nfs/dbraw/zinc/11/78/11/274117811.db2.gz	BOBQCTNSYXZUQS-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000177784756	276233428	/nfs/dbraw/zinc/23/34/28/276233428.db2.gz	BXURKPNUGPFUIJ-OLZOCXBDSA-N	1	1	318.377	1.997	20	5		DDBDMO
O=C([C@@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1)N1CCCC1	ZINC000357937510	299025745	/nfs/dbraw/zinc/02/57/45/299025745.db2.gz	WYPILQZYANJAFS-CYBMUJFWSA-N	1	1	321.381	1.126	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1csc([N+](=O)[O-])c1	ZINC000363143933	300219026	/nfs/dbraw/zinc/21/90/26/300219026.db2.gz	OBEHSWREMNLQJW-GHMZBOCLSA-N	1	1	311.363	1.249	20	5		DDBDMO
COc1ccc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000367995229	300929617	/nfs/dbraw/zinc/92/96/17/300929617.db2.gz	YFGCUBFWFYKKEF-JTQLQIEISA-N	1	1	315.276	1.283	20	5		DDBDMO
Cc1c(C(=O)N2CCC[N@H+]([C@H](C)CO)CC2)cccc1[N+](=O)[O-]	ZINC000368967056	301112924	/nfs/dbraw/zinc/11/29/24/301112924.db2.gz	UOUXEVPBLJWGPG-GFCCVEGCSA-N	1	1	321.377	1.432	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCO[C@H]3CCC[C@@H]32)c([N+](=O)[O-])c1	ZINC000369473840	301189630	/nfs/dbraw/zinc/18/96/30/301189630.db2.gz	UFPJXCZFQYOQHD-ZFWWWQNUSA-N	1	1	319.361	1.837	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@H](CNc2ccccn2)C1	ZINC000370045975	301265171	/nfs/dbraw/zinc/26/51/71/301265171.db2.gz	OYQAFRJLKFVDQA-LBPRGKRZSA-N	1	1	316.365	1.657	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@H](CNc2ccccn2)C1	ZINC000370045975	301265173	/nfs/dbraw/zinc/26/51/73/301265173.db2.gz	OYQAFRJLKFVDQA-LBPRGKRZSA-N	1	1	316.365	1.657	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000370591088	301369921	/nfs/dbraw/zinc/36/99/21/301369921.db2.gz	WXPJEZNDHIQBPG-UHFFFAOYSA-N	1	1	306.366	1.794	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@]2(CNC(=O)C2)C1	ZINC000370631124	301374559	/nfs/dbraw/zinc/37/45/59/301374559.db2.gz	LJODJUCHDSAZEA-HNNXBMFYSA-N	1	1	305.334	1.315	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1	ZINC000378572445	302337830	/nfs/dbraw/zinc/33/78/30/302337830.db2.gz	BPJBOASNXCEJRR-UHFFFAOYSA-N	1	1	321.381	1.607	20	5		DDBDMO
Cn1c[nH+]cc1CCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000401729818	302373220	/nfs/dbraw/zinc/37/32/20/302373220.db2.gz	AWPLKXZQZONWOA-UHFFFAOYSA-N	1	1	315.333	1.868	20	5		DDBDMO
CC[C@@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000531026000	303225900	/nfs/dbraw/zinc/22/59/00/303225900.db2.gz	SHBZZADJFVZNDX-RISCZKNCSA-N	1	1	317.345	1.959	20	5		DDBDMO
Cc1cccc(N2CCC[N@@H+](CCN(C)C)CC2)c1[N+](=O)[O-]	ZINC000364638652	307049043	/nfs/dbraw/zinc/04/90/43/307049043.db2.gz	RTSYICITOCNWTC-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
Cc1cccc(N2CCC[N@H+](CCN(C)C)CC2)c1[N+](=O)[O-]	ZINC000364638652	307049044	/nfs/dbraw/zinc/04/90/44/307049044.db2.gz	RTSYICITOCNWTC-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H](c3nnc[nH]3)C2)c1	ZINC000366652339	307078762	/nfs/dbraw/zinc/07/87/62/307078762.db2.gz	KMPDFEYWEMVKTL-OCCSQVGLSA-N	1	1	317.349	1.626	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000564782568	308005695	/nfs/dbraw/zinc/00/56/95/308005695.db2.gz	FPOHQTMVHGVUKZ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000564782568	308005697	/nfs/dbraw/zinc/00/56/97/308005697.db2.gz	FPOHQTMVHGVUKZ-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C1NCC[C@]12CCC[N@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000575427389	308277125	/nfs/dbraw/zinc/27/71/25/308277125.db2.gz	PYOCWAIRKBMDRX-OAHLLOKOSA-N	1	1	305.334	1.328	20	5		DDBDMO
O=C1NCC[C@]12CCC[N@@H+]2CCOc1ccccc1[N+](=O)[O-]	ZINC000575427389	308277126	/nfs/dbraw/zinc/27/71/26/308277126.db2.gz	PYOCWAIRKBMDRX-OAHLLOKOSA-N	1	1	305.334	1.328	20	5		DDBDMO
C[C@H](CCN(C)C)[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460688	308316026	/nfs/dbraw/zinc/31/60/26/308316026.db2.gz	XDXVCNRKCMJCMO-OCCSQVGLSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@H](CC[NH+](C)C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460688	308316027	/nfs/dbraw/zinc/31/60/27/308316027.db2.gz	XDXVCNRKCMJCMO-OCCSQVGLSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cnc2cc3ccccc3cc2c1=O	ZINC000582616700	337115364	/nfs/dbraw/zinc/11/53/64/337115364.db2.gz	PHIWMXRPJOZIRL-HNNXBMFYSA-N	1	1	311.385	1.862	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])NCCC[NH+]1CCOCC1	ZINC000211795249	490696310	/nfs/dbraw/zinc/69/63/10/490696310.db2.gz	SULYBWSDWMNQSC-SREVYHEPSA-N	1	1	319.361	1.447	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000299332000	534064408	/nfs/dbraw/zinc/06/44/08/534064408.db2.gz	PWGGKHMRUMNOGT-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@@H](O)C12CCCC2	ZINC000292839961	534320891	/nfs/dbraw/zinc/32/08/91/534320891.db2.gz	UUHSWKFYHIZJMX-CYBMUJFWSA-N	1	1	307.350	1.136	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCSC[C@@H]1C1CC1	ZINC000451646420	534321432	/nfs/dbraw/zinc/32/14/32/534321432.db2.gz	FKBCFBVPJHNJAB-CYBMUJFWSA-N	1	1	309.391	1.584	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1CCO	ZINC000452393411	534334141	/nfs/dbraw/zinc/33/41/41/534334141.db2.gz	SNAWSYIILAMRKX-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1ccnc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)c1[N+](=O)[O-]	ZINC000301244339	534402752	/nfs/dbraw/zinc/40/27/52/534402752.db2.gz	ACKJJHHQAOAWTR-GFCCVEGCSA-N	1	1	321.381	1.298	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N[C@H]3CCC[N@H+](CCCO)C3)nc2c1	ZINC000295006586	534884073	/nfs/dbraw/zinc/88/40/73/534884073.db2.gz	SAZSWNVOVMZRPG-NSHDSACASA-N	1	1	319.365	1.730	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000459597676	528035992	/nfs/dbraw/zinc/03/59/92/528035992.db2.gz	OUWVUZNJHSQZAU-UHFFFAOYSA-N	1	1	313.329	1.747	20	5		DDBDMO
CC(C)[C@@H](O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293086719	528626723	/nfs/dbraw/zinc/62/67/23/528626723.db2.gz	KCUWDZMBSDALJX-HNNXBMFYSA-N	1	1	321.377	1.370	20	5		DDBDMO
CC(C)[C@@](C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(N)=O	ZINC000459473944	528867709	/nfs/dbraw/zinc/86/77/09/528867709.db2.gz	DPLXVKFZIJQAQS-CQSZACIVSA-N	1	1	305.338	1.461	20	5		DDBDMO
Cc1c(C(=O)NCC[N@H+](C)C(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000101955496	696609504	/nfs/dbraw/zinc/60/95/04/696609504.db2.gz	JRUMXXAVTVLEDE-UHFFFAOYSA-N	1	1	324.337	1.881	20	5		DDBDMO
O=C(CC[N@H+]1CCC2(C1)OCCO2)Nc1ccccc1[N+](=O)[O-]	ZINC000104082992	696618112	/nfs/dbraw/zinc/61/81/12/696618112.db2.gz	DFIQHBVTWNRINC-UHFFFAOYSA-N	1	1	321.333	1.372	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1(C)C	ZINC000773369020	697750924	/nfs/dbraw/zinc/75/09/24/697750924.db2.gz	GOHFWRZTSHRRKR-UHFFFAOYSA-N	1	1	322.321	1.669	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1(C)C	ZINC000773369020	697750926	/nfs/dbraw/zinc/75/09/26/697750926.db2.gz	GOHFWRZTSHRRKR-UHFFFAOYSA-N	1	1	322.321	1.669	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)C(C)(C)C1	ZINC000773371375	697751494	/nfs/dbraw/zinc/75/14/94/697751494.db2.gz	VYUXLBIELZVYHU-UHFFFAOYSA-N	1	1	320.393	1.827	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)C(C)(C)C1	ZINC000773371375	697751495	/nfs/dbraw/zinc/75/14/95/697751495.db2.gz	VYUXLBIELZVYHU-UHFFFAOYSA-N	1	1	320.393	1.827	20	5		DDBDMO
C[NH+]1CCC2(CCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000780545959	698530120	/nfs/dbraw/zinc/53/01/20/698530120.db2.gz	BEHDPZGEHXGCAP-UHFFFAOYSA-N	1	1	305.334	1.611	20	5		DDBDMO
Cc1nccnc1[C@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000783243629	698824163	/nfs/dbraw/zinc/82/41/63/698824163.db2.gz	ONGVXCKJVUBETB-NSHDSACASA-N	1	1	315.333	1.983	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)C1	ZINC000729529337	699481737	/nfs/dbraw/zinc/48/17/37/699481737.db2.gz	RNYHHSVENKTLKV-LLVKDONJSA-N	1	1	315.333	1.875	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])c1C	ZINC000790679151	699591360	/nfs/dbraw/zinc/59/13/60/699591360.db2.gz	SWGWABALMOPUOZ-JTQLQIEISA-N	1	1	307.350	1.688	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)cc([N+](=O)[O-])c1C	ZINC000790679151	699591362	/nfs/dbraw/zinc/59/13/62/699591362.db2.gz	SWGWABALMOPUOZ-JTQLQIEISA-N	1	1	307.350	1.688	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@H](CO)C3CC3)n2)c1	ZINC000763062119	700923167	/nfs/dbraw/zinc/92/31/67/700923167.db2.gz	AHFGGBHVXAQUEV-GFCCVEGCSA-N	1	1	304.306	1.505	20	5		DDBDMO
COCC[N@H+]1CCCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804353057	701181631	/nfs/dbraw/zinc/18/16/31/701181631.db2.gz	FHMBJCIMZDZIFQ-UHFFFAOYSA-N	1	1	324.337	1.662	20	5		DDBDMO
COc1cccc(N2CCN(c3[nH+]ccn3C)CC2)c1[N+](=O)[O-]	ZINC000772070904	701342811	/nfs/dbraw/zinc/34/28/11/701342811.db2.gz	WWNZRHGQRKPDIA-UHFFFAOYSA-N	1	1	317.349	1.664	20	5		DDBDMO
CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839703452	701790431	/nfs/dbraw/zinc/79/04/31/701790431.db2.gz	DLTNIGJPYKEMCF-RBSFLKMASA-N	1	1	303.362	1.385	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000839703452	701790435	/nfs/dbraw/zinc/79/04/35/701790435.db2.gz	DLTNIGJPYKEMCF-RBSFLKMASA-N	1	1	303.362	1.385	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839703452	701790440	/nfs/dbraw/zinc/79/04/40/701790440.db2.gz	DLTNIGJPYKEMCF-RBSFLKMASA-N	1	1	303.362	1.385	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)OC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000810614155	701801013	/nfs/dbraw/zinc/80/10/13/701801013.db2.gz	BOCCXIUQTBXWNY-JTQLQIEISA-N	1	1	321.337	1.663	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1(C)C	ZINC000868029406	701900002	/nfs/dbraw/zinc/90/00/02/701900002.db2.gz	JUGOFNWMXIZJQS-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H]1CN(Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C[C@H](C)[N@@H+]1C	ZINC000840089885	701961916	/nfs/dbraw/zinc/96/19/16/701961916.db2.gz	KGMLEGMDJXIQEC-PHIMTYICSA-N	1	1	320.349	1.485	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C[C@H]1C	ZINC000840123116	701981879	/nfs/dbraw/zinc/98/18/79/701981879.db2.gz	KRTSZPWPDZINSY-YGRLFVJLSA-N	1	1	319.365	1.962	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@](C)(CO)C1	ZINC000879262750	706633691	/nfs/dbraw/zinc/63/36/91/706633691.db2.gz	ZIIGSPRBXDKZJZ-RRFJBIMHSA-N	1	1	310.350	1.100	20	5		DDBDMO
CC(C)(NC(=O)CC[NH+]1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000817038653	702258532	/nfs/dbraw/zinc/25/85/32/702258532.db2.gz	YLNYNJRVMWWLIN-UHFFFAOYSA-N	1	1	321.377	1.668	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000841012122	702310204	/nfs/dbraw/zinc/31/02/04/702310204.db2.gz	ZUXBGXPUXCOUHQ-UHFFFAOYSA-N	1	1	308.672	1.964	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@]2(CCC[NH2+]2)C1	ZINC000818017220	702555187	/nfs/dbraw/zinc/55/51/87/702555187.db2.gz	XTTUQWFASWGBBG-OAHLLOKOSA-N	1	1	315.333	1.439	20	5		DDBDMO
O=C1CC[C@@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C(=O)N1	ZINC000831538571	706728081	/nfs/dbraw/zinc/72/80/81/706728081.db2.gz	FEQNXDSZNFNWOX-TZMCWYRMSA-N	1	1	317.345	1.579	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534768	704070012	/nfs/dbraw/zinc/07/00/12/704070012.db2.gz	PNXFOWLMAUMQOX-BXUZGUMPSA-N	1	1	307.306	1.971	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000852534768	704070015	/nfs/dbraw/zinc/07/00/15/704070015.db2.gz	PNXFOWLMAUMQOX-BXUZGUMPSA-N	1	1	307.306	1.971	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000852664833	704096067	/nfs/dbraw/zinc/09/60/67/704096067.db2.gz	DNQGDSFIORBDOF-NWDGAFQWSA-N	1	1	307.306	1.971	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852695530	704101489	/nfs/dbraw/zinc/10/14/89/704101489.db2.gz	AKLUASHTLRPSKU-KWCYVHTRSA-N	1	1	308.334	1.512	20	5		DDBDMO
Cn1cc(Cl)c(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819346625	704110930	/nfs/dbraw/zinc/11/09/30/704110930.db2.gz	HABLMQURBPQTBT-CYBMUJFWSA-N	1	1	310.741	1.805	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000870874380	704153171	/nfs/dbraw/zinc/15/31/71/704153171.db2.gz	IVGVBGLNBOHXBP-BDJLRTHQSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000874834293	705191859	/nfs/dbraw/zinc/19/18/59/705191859.db2.gz	QWBCFIGOYMITMK-KBPBESRZSA-N	1	1	304.350	1.486	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000874834296	705192243	/nfs/dbraw/zinc/19/22/43/705192243.db2.gz	QWBCFIGOYMITMK-ZIAGYGMSSA-N	1	1	304.350	1.486	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000874839118	705194861	/nfs/dbraw/zinc/19/48/61/705194861.db2.gz	TUIMWCDHTLGSAI-QWHCGFSZSA-N	1	1	318.377	1.794	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000825688496	705714659	/nfs/dbraw/zinc/71/46/59/705714659.db2.gz	MIENZSOVSVJXOH-CQSZACIVSA-N	1	1	307.350	1.182	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](C/C=C\c3ccccc3[N+](=O)[O-])C[C@H]2C1=O	ZINC000877720292	706188619	/nfs/dbraw/zinc/18/86/19/706188619.db2.gz	NFRZRGFBHAZIHK-RWBPYIHSSA-N	1	1	315.329	1.155	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)CC(C)(C)C2)c1	ZINC000877752053	706199550	/nfs/dbraw/zinc/19/95/50/706199550.db2.gz	LZJDGKLJJXMRQX-ZDUSSCGKSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)CC(C)(C)C2)c1	ZINC000877752053	706199553	/nfs/dbraw/zinc/19/95/53/706199553.db2.gz	LZJDGKLJJXMRQX-ZDUSSCGKSA-N	1	1	322.361	1.974	20	5		DDBDMO
Cn1nnnc1C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1	ZINC000877781728	706209430	/nfs/dbraw/zinc/20/94/30/706209430.db2.gz	PUPKYFDOYPTTJC-UHFFFAOYSA-N	1	1	308.367	1.559	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000877892710	706233373	/nfs/dbraw/zinc/23/33/73/706233373.db2.gz	CKHQCDFIYVNJEA-LLVKDONJSA-N	1	1	308.338	1.819	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@@H](C(F)(F)F)CC1	ZINC000880050600	706864149	/nfs/dbraw/zinc/86/41/49/706864149.db2.gz	CXUSBUDTCGFVJQ-SNVBAGLBSA-N	1	1	322.287	1.753	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@@H](C(F)(F)F)CC1	ZINC000880050600	706864152	/nfs/dbraw/zinc/86/41/52/706864152.db2.gz	CXUSBUDTCGFVJQ-SNVBAGLBSA-N	1	1	322.287	1.753	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C[C@@H]1C(C)(C)C	ZINC000880614545	707042770	/nfs/dbraw/zinc/04/27/70/707042770.db2.gz	WPXILMHJLPXJFQ-CYBMUJFWSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@H]1COC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000837611759	707695688	/nfs/dbraw/zinc/69/56/88/707695688.db2.gz	GMNCJPJTUQDVIP-NSHDSACASA-N	1	1	310.354	1.748	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000883078283	707919949	/nfs/dbraw/zinc/91/99/49/707919949.db2.gz	MDWNEQRMTNDDAZ-AWEZNQCLSA-N	1	1	321.381	1.400	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000883372850	707986039	/nfs/dbraw/zinc/98/60/39/707986039.db2.gz	QFOGLHLWOXEMDT-CYBMUJFWSA-N	1	1	322.365	1.367	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897218460	708256381	/nfs/dbraw/zinc/25/63/81/708256381.db2.gz	CUFOEWYKWTUBCP-QWHCGFSZSA-N	1	1	323.397	1.155	20	5		DDBDMO
CCCNC(=O)C1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000885938007	708666714	/nfs/dbraw/zinc/66/67/14/708666714.db2.gz	PCZUFBNEWYADMC-UHFFFAOYSA-N	1	1	306.366	1.728	20	5		DDBDMO
CCOC(=O)[C@H]1C[N@H+](Cc2cccnc2[N+](=O)[O-])CC12COC2	ZINC000886220885	708718030	/nfs/dbraw/zinc/71/80/30/708718030.db2.gz	OVFXXJIQSVDNEI-GFCCVEGCSA-N	1	1	321.333	1.001	20	5		DDBDMO
CCOC(=O)[C@H]1C[N@@H+](Cc2cccnc2[N+](=O)[O-])CC12COC2	ZINC000886220885	708718032	/nfs/dbraw/zinc/71/80/32/708718032.db2.gz	OVFXXJIQSVDNEI-GFCCVEGCSA-N	1	1	321.333	1.001	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593764	708785407	/nfs/dbraw/zinc/78/54/07/708785407.db2.gz	ZEDMTKURQILELG-LLVKDONJSA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593764	708785409	/nfs/dbraw/zinc/78/54/09/708785409.db2.gz	ZEDMTKURQILELG-LLVKDONJSA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593764	708785411	/nfs/dbraw/zinc/78/54/11/708785411.db2.gz	ZEDMTKURQILELG-LLVKDONJSA-N	1	1	309.370	1.429	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593764	708785414	/nfs/dbraw/zinc/78/54/14/708785414.db2.gz	ZEDMTKURQILELG-LLVKDONJSA-N	1	1	309.370	1.429	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)C[C@@H]1CO	ZINC000912739803	713079478	/nfs/dbraw/zinc/07/94/78/713079478.db2.gz	HQIDKFGNWOXHQI-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)C[C@@H]1CO	ZINC000912739803	713079480	/nfs/dbraw/zinc/07/94/80/713079480.db2.gz	HQIDKFGNWOXHQI-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@]2(C)C1	ZINC000887934770	709170770	/nfs/dbraw/zinc/17/07/70/709170770.db2.gz	UFDGYQFZMOHGEA-BMIGLBTASA-N	1	1	307.325	1.758	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103549	713131854	/nfs/dbraw/zinc/13/18/54/713131854.db2.gz	RGHPDJVSVAXOQP-UONOGXRCSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103549	713131856	/nfs/dbraw/zinc/13/18/56/713131856.db2.gz	RGHPDJVSVAXOQP-UONOGXRCSA-N	1	1	321.402	1.904	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@@]2(C)C[C@@H](O)C[N@H+]2C)cc1[N+](=O)[O-]	ZINC000900968696	709854054	/nfs/dbraw/zinc/85/40/54/709854054.db2.gz	WRMDPUMODKBGAS-NORZTCDRSA-N	1	1	321.377	1.536	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000910286603	709867046	/nfs/dbraw/zinc/86/70/46/709867046.db2.gz	HICPOSWXEFAJJG-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNc2c([N+](=O)[O-])cnn2C)C[C@H](C)O1	ZINC000891652291	710257565	/nfs/dbraw/zinc/25/75/65/710257565.db2.gz	ICCRWTHMMCOUOR-PHIMTYICSA-N	1	1	311.386	1.628	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2c([N+](=O)[O-])cnn2C)C[C@H](C)O1	ZINC000891652291	710257566	/nfs/dbraw/zinc/25/75/66/710257566.db2.gz	ICCRWTHMMCOUOR-PHIMTYICSA-N	1	1	311.386	1.628	20	5		DDBDMO
COc1cc([C@@H](C)[NH2+][C@H](C)C(=O)N(C)OC)cc([N+](=O)[O-])c1	ZINC000903209001	711066015	/nfs/dbraw/zinc/06/60/15/711066015.db2.gz	DDHWHSWYRYJWII-NXEZZACHSA-N	1	1	311.338	1.662	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000928559274	713226660	/nfs/dbraw/zinc/22/66/60/713226660.db2.gz	WXXWLSZPQLDJCH-VIFPVBQESA-N	1	1	315.276	1.630	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000928559274	713226661	/nfs/dbraw/zinc/22/66/61/713226661.db2.gz	WXXWLSZPQLDJCH-VIFPVBQESA-N	1	1	315.276	1.630	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c1[N+](=O)[O-]	ZINC000895635981	711565725	/nfs/dbraw/zinc/56/57/25/711565725.db2.gz	PXMQMQUFGBYNFH-BLLLJJGKSA-N	1	1	322.361	1.903	20	5		DDBDMO
C[C@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000896554416	711749858	/nfs/dbraw/zinc/74/98/58/711749858.db2.gz	FLPQDDBXTWJUFP-HZMBPMFUSA-N	1	1	324.356	1.098	20	5		DDBDMO
CCOCCOCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000929245998	713575319	/nfs/dbraw/zinc/57/53/19/713575319.db2.gz	CVUSRHVUVATNAQ-UHFFFAOYSA-N	1	1	323.393	1.770	20	5		DDBDMO
O=[N+]([O-])CC[N@@H+]1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000930242416	713785111	/nfs/dbraw/zinc/78/51/11/713785111.db2.gz	VMGUFYUBOVIQMK-CYBMUJFWSA-N	1	1	301.350	1.928	20	5		DDBDMO
O=[N+]([O-])CC[N@H+]1CCC[C@@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000930242416	713785113	/nfs/dbraw/zinc/78/51/13/713785113.db2.gz	VMGUFYUBOVIQMK-CYBMUJFWSA-N	1	1	301.350	1.928	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)C1(O)CCCC1	ZINC000930440442	713835228	/nfs/dbraw/zinc/83/52/28/713835228.db2.gz	MQXQWZCXLYYZFG-HNNXBMFYSA-N	1	1	308.378	1.735	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H](O)C1(O)CCCC1	ZINC000930440444	713835327	/nfs/dbraw/zinc/83/53/27/713835327.db2.gz	MQXQWZCXLYYZFG-OAHLLOKOSA-N	1	1	308.378	1.735	20	5		DDBDMO
CC(C)[N@@H+](C)Cc1cc(O[C@@H]2CCN(CC[N+](=O)[O-])C2)ccn1	ZINC000931095725	714000076	/nfs/dbraw/zinc/00/00/76/714000076.db2.gz	ZIPZVSWCJNWQLT-MRXNPFEDSA-N	1	1	322.409	1.652	20	5		DDBDMO
CC[N@@H+](C)Cc1cc(O[C@H]2CCN(CC[N+](=O)[O-])C2)ccn1	ZINC000931095197	714000300	/nfs/dbraw/zinc/00/03/00/714000300.db2.gz	WYCXBPYDMUSYFA-HNNXBMFYSA-N	1	1	308.382	1.263	20	5		DDBDMO
C[N@H+]1CC[C@@H]2C[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931438999	714098136	/nfs/dbraw/zinc/09/81/36/714098136.db2.gz	MGMQUSBUTDCVHD-YCPHGPKFSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931438999	714098143	/nfs/dbraw/zinc/09/81/43/714098143.db2.gz	MGMQUSBUTDCVHD-YCPHGPKFSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000931438999	714098144	/nfs/dbraw/zinc/09/81/44/714098144.db2.gz	MGMQUSBUTDCVHD-YCPHGPKFSA-N	1	1	305.378	1.512	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000932979084	714448249	/nfs/dbraw/zinc/44/82/49/714448249.db2.gz	FSEYOOSRCGHGRP-HIFRSBDPSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000933165884	714526450	/nfs/dbraw/zinc/52/64/50/714526450.db2.gz	OUHRHFNLSFQGGI-ZYHUDNBSSA-N	1	1	310.354	1.373	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@H]2C[C@H]2CCCO2)c1	ZINC000933677971	714646195	/nfs/dbraw/zinc/64/61/95/714646195.db2.gz	SERZTNXEOSAVJB-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@H]2C[C@H]2CCCO2)c1	ZINC000933677971	714646196	/nfs/dbraw/zinc/64/61/96/714646196.db2.gz	SERZTNXEOSAVJB-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOC[C@H]2C[C@@H]2CCCO2)n1	ZINC000933682113	714647305	/nfs/dbraw/zinc/64/73/05/714647305.db2.gz	OMMSDXQRUWEYBV-OLZOCXBDSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC[C@H]2C[C@@H]2CCCO2)n1	ZINC000933682113	714647306	/nfs/dbraw/zinc/64/73/06/714647306.db2.gz	OMMSDXQRUWEYBV-OLZOCXBDSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCSC[C@@H]1C1CC1	ZINC000933913350	714700734	/nfs/dbraw/zinc/70/07/34/714700734.db2.gz	BJAZEUOXMAKSPM-CQSZACIVSA-N	1	1	323.418	1.974	20	5		DDBDMO
Cc1ccc(CN2CC[C@H]3[C@H]2CCC[N@H+]3CCO)cc1[N+](=O)[O-]	ZINC000934271496	714782365	/nfs/dbraw/zinc/78/23/65/714782365.db2.gz	HFENQDOAEIMLST-CVEARBPZSA-N	1	1	319.405	1.934	20	5		DDBDMO
Cn1cc(C[N@@H+]2C[C@@H](Cc3ccccc3)[C@H](O)C2)c([N+](=O)[O-])n1	ZINC000934432887	714820095	/nfs/dbraw/zinc/82/00/95/714820095.db2.gz	YYXAXUQFWXHMOZ-UKRRQHHQSA-N	1	1	316.361	1.364	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925343011	714820480	/nfs/dbraw/zinc/82/04/80/714820480.db2.gz	KVTHVQZDCIDNMQ-OCCSQVGLSA-N	1	1	320.393	1.871	20	5		DDBDMO
Cc1cc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cs1	ZINC001025775802	736853331	/nfs/dbraw/zinc/85/33/31/736853331.db2.gz	NCWSTRIMRXBBPM-RGDJUOJXSA-N	1	1	321.402	1.268	20	5		DDBDMO
Cc1cc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])cs1	ZINC001025775802	736853333	/nfs/dbraw/zinc/85/33/33/736853333.db2.gz	NCWSTRIMRXBBPM-RGDJUOJXSA-N	1	1	321.402	1.268	20	5		DDBDMO
Cc1cc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CC2[N+](=O)[O-])cs1	ZINC001025775802	736853335	/nfs/dbraw/zinc/85/33/35/736853335.db2.gz	NCWSTRIMRXBBPM-RGDJUOJXSA-N	1	1	321.402	1.268	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000894623327	740327793	/nfs/dbraw/zinc/32/77/93/740327793.db2.gz	OMCSQICIQLLHCK-ZDUSSCGKSA-N	1	1	322.365	1.034	20	5		DDBDMO
NC(=[NH2+])N(c1ccc(F)cc1)c1cc([N+](=O)[O-])c2nncn2c1	ZINC001167994401	740438754	/nfs/dbraw/zinc/43/87/54/740438754.db2.gz	JOSSJSJTVLGKMR-UHFFFAOYSA-N	1	1	315.268	1.808	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC1CCC1	ZINC001029305208	740551403	/nfs/dbraw/zinc/55/14/03/740551403.db2.gz	UUAXMOSZFVFTTR-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CCCC1CCC1	ZINC001029305208	740551408	/nfs/dbraw/zinc/55/14/08/740551408.db2.gz	UUAXMOSZFVFTTR-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCC1CCC1	ZINC001029305208	740551410	/nfs/dbraw/zinc/55/14/10/740551410.db2.gz	UUAXMOSZFVFTTR-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(c4ncc([N+](=O)[O-])c(N)n4)C[C@]2(C1)CCCC3	ZINC001187921372	744635646	/nfs/dbraw/zinc/63/56/46/744635646.db2.gz	SUHPXSVKNPKVSR-GASCZTMLSA-N	1	1	318.381	1.279	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](O)C1CC1	ZINC001191487273	745520235	/nfs/dbraw/zinc/52/02/35/745520235.db2.gz	YZKZTXMSSYBIAI-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H](O)C1CC1	ZINC001191487273	745520238	/nfs/dbraw/zinc/52/02/38/745520238.db2.gz	YZKZTXMSSYBIAI-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169035714	762191710	/nfs/dbraw/zinc/19/17/10/762191710.db2.gz	LGZDZDYTFSIANP-QNSTZXKLSA-N	1	1	312.366	1.084	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]2COC[C@H](C1)[N@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169035714	762191713	/nfs/dbraw/zinc/19/17/13/762191713.db2.gz	LGZDZDYTFSIANP-QNSTZXKLSA-N	1	1	312.366	1.084	20	5		DDBDMO
O=C(NC1CC1)[C@H]1C[C@H]2C[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]2C1	ZINC001169023549	762201114	/nfs/dbraw/zinc/20/11/14/762201114.db2.gz	OYWUCPYYTJYXPR-GRYWWWGRSA-N	1	1	321.421	1.668	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccnc(Cl)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020138984	760613122	/nfs/dbraw/zinc/61/31/22/760613122.db2.gz	LCCRMVDPWWDFJC-DDHJBXDOSA-N	1	1	324.768	1.137	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]Cc2cccc(F)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086082893	760943385	/nfs/dbraw/zinc/94/33/85/760943385.db2.gz	GYYHEMQMAVEMDK-FAAHXZRKSA-N	1	1	321.352	1.475	20	5		DDBDMO
O=C(NCC1CC[NH+](Cc2cccnc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001395444	762821493	/nfs/dbraw/zinc/82/14/93/762821493.db2.gz	MMVMYOJYZVFHNM-HUUCEWRRSA-N	1	1	318.377	1.075	20	5		DDBDMO
CC1(C)CCC(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001157767013	766563820	/nfs/dbraw/zinc/56/38/20/766563820.db2.gz	DEVSBOMAWYLBHG-ZIAGYGMSSA-N	1	1	311.426	1.964	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C(C)(C)C1CCC1	ZINC001131941239	768499647	/nfs/dbraw/zinc/49/96/47/768499647.db2.gz	ZAHSOSSOFBELFW-UHFFFAOYSA-N	1	1	323.397	1.360	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC001136839751	772170473	/nfs/dbraw/zinc/17/04/73/772170473.db2.gz	SPPPJOUHMQTPMU-SNVBAGLBSA-N	1	1	308.338	1.109	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172907598	776918203	/nfs/dbraw/zinc/91/82/03/776918203.db2.gz	GYVBLTOAYUESMD-ZFWWWQNUSA-N	1	1	303.362	1.792	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCN1CCN(C)CC1	ZINC001173217062	777049108	/nfs/dbraw/zinc/04/91/08/777049108.db2.gz	OXVXSLCVEFTXAJ-HNNXBMFYSA-N	1	1	320.437	1.753	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)[nH]n1	ZINC001116445204	780510068	/nfs/dbraw/zinc/51/00/68/780510068.db2.gz	QAPKZHKOTJHMBK-LLVKDONJSA-N	1	1	302.338	1.708	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)[nH]n1	ZINC001116445204	780510072	/nfs/dbraw/zinc/51/00/72/780510072.db2.gz	QAPKZHKOTJHMBK-LLVKDONJSA-N	1	1	302.338	1.708	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cnccn1)Cc1ccccc1[N+](=O)[O-]	ZINC001266253160	835991545	/nfs/dbraw/zinc/99/15/45/835991545.db2.gz	OLSZFWAEQGSXIH-UHFFFAOYSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cnccn1)Cc1ccccc1[N+](=O)[O-]	ZINC001266253160	835991547	/nfs/dbraw/zinc/99/15/47/835991547.db2.gz	OLSZFWAEQGSXIH-UHFFFAOYSA-N	1	1	315.333	1.247	20	5		DDBDMO
COCCCC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1	ZINC001268546971	840429170	/nfs/dbraw/zinc/42/91/70/840429170.db2.gz	LVZVKFLFCADCNG-UHFFFAOYSA-N	1	1	321.377	1.569	20	5		DDBDMO
CC(C)(C)CC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001072724819	857642071	/nfs/dbraw/zinc/64/20/71/857642071.db2.gz	FTATVXIUIGPTOZ-CHWSQXEVSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)(C)CC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001072724819	857642075	/nfs/dbraw/zinc/64/20/75/857642075.db2.gz	FTATVXIUIGPTOZ-CHWSQXEVSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)(C)CC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001072724819	857642078	/nfs/dbraw/zinc/64/20/78/857642078.db2.gz	FTATVXIUIGPTOZ-CHWSQXEVSA-N	1	1	309.410	1.622	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC001122111975	858688954	/nfs/dbraw/zinc/68/89/54/858688954.db2.gz	PWAOQURFPIUQHF-AWEZNQCLSA-N	1	1	320.393	1.921	20	5		DDBDMO
CC(=O)CCCC(=O)NCC[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC001123479485	859252268	/nfs/dbraw/zinc/25/22/68/859252268.db2.gz	CPSCXSWUOWNGIP-UHFFFAOYSA-N	1	1	313.379	1.621	20	5		DDBDMO
COc1cc(C)nc(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC001157266356	863695319	/nfs/dbraw/zinc/69/53/19/863695319.db2.gz	RBEHOKKRAQEZAW-RYUDHWBXSA-N	1	1	306.366	1.837	20	5		DDBDMO
Cc1nc(N[C@@H](C)C[N@H+](C)CCCN(C)C)ncc1[N+](=O)[O-]	ZINC001330685257	864534703	/nfs/dbraw/zinc/53/47/03/864534703.db2.gz	LNSXDSWCWHBYOT-NSHDSACASA-N	1	1	310.402	1.377	20	5		DDBDMO
Cc1nc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)ncc1[N+](=O)[O-]	ZINC001330685257	864534713	/nfs/dbraw/zinc/53/47/13/864534713.db2.gz	LNSXDSWCWHBYOT-NSHDSACASA-N	1	1	310.402	1.377	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](CCC2CC2)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001160107142	865679782	/nfs/dbraw/zinc/67/97/82/865679782.db2.gz	JSCVWLQTBMGITA-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
O=C(NCCC1=CC[N@H+](CCC2CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001160107142	865679790	/nfs/dbraw/zinc/67/97/90/865679790.db2.gz	JSCVWLQTBMGITA-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
O=C(NCCC1=CC[N@@H+](CCC2CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001160107142	865679796	/nfs/dbraw/zinc/67/97/96/865679796.db2.gz	JSCVWLQTBMGITA-HUUCEWRRSA-N	1	1	307.394	1.590	20	5		DDBDMO
Cc1nc(NCC[NH+]2CCC(F)(F)CC2)ncc1[N+](=O)[O-]	ZINC001160753377	866100217	/nfs/dbraw/zinc/10/02/17/866100217.db2.gz	CITKRLZZJQJCTE-UHFFFAOYSA-N	1	1	301.297	1.836	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[N@@H+](C2CC2)C[C@@H]1C	ZINC001161493745	866711532	/nfs/dbraw/zinc/71/15/32/866711532.db2.gz	HDTDJIHJANMAFS-NSHDSACASA-N	1	1	321.381	1.185	20	5		DDBDMO
[NH3+][C@@H]1CN(c2ncnc3cc([N+](=O)[O-])ccc32)CCC1(F)F	ZINC001164319624	869124127	/nfs/dbraw/zinc/12/41/27/869124127.db2.gz	KYXLDRJOQLGDQK-LLVKDONJSA-N	1	1	309.276	1.711	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNc2cc([N+](=O)[O-])c3nncn3c2)C1	ZINC001165290400	869499062	/nfs/dbraw/zinc/49/90/62/869499062.db2.gz	SPTDNBHTWVVREL-LLVKDONJSA-N	1	1	304.354	1.781	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC001337836247	869651773	/nfs/dbraw/zinc/65/17/73/869651773.db2.gz	OTYUDNUGSJGCBD-NILFDRSVSA-N	1	1	319.361	1.430	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NC)[C@@H](C)C1	ZINC001341741368	871799410	/nfs/dbraw/zinc/79/94/10/871799410.db2.gz	DPSUNRURBOALAY-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2NC)[C@@H](C)C1	ZINC001341741368	871799427	/nfs/dbraw/zinc/79/94/27/871799427.db2.gz	DPSUNRURBOALAY-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
Cc1cc(NC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cc([N+](=O)[O-])c1	ZINC001344874907	873157312	/nfs/dbraw/zinc/15/73/12/873157312.db2.gz	IHPKLVADFJJQTG-TXEJJXNPSA-N	1	1	304.350	1.929	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC001347599881	874206474	/nfs/dbraw/zinc/20/64/74/874206474.db2.gz	LWNNGFMJSUECTR-SWLSCSKDSA-N	1	1	322.413	1.099	20	5		DDBDMO
C[C@@H](C[N+](C)(C)C)Oc1[nH]c(=O)nc2ccc([N+](=O)[O-])cc21	ZINC001227095902	882831828	/nfs/dbraw/zinc/83/18/28/882831828.db2.gz	MGDWHUKXWLAHRD-VIFPVBQESA-O	1	1	307.330	1.717	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)C)CC1	ZINC001352294928	876682452	/nfs/dbraw/zinc/68/24/52/876682452.db2.gz	QFZPOKUWFDQVCC-UHFFFAOYSA-N	1	1	324.429	1.428	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CCC[N@H+]2CCC[C@H]2C1	ZINC001352915741	877006240	/nfs/dbraw/zinc/00/62/40/877006240.db2.gz	DJLQETHWDVNUFU-LBPRGKRZSA-N	1	1	319.365	1.422	20	5		DDBDMO
N[C@@H](Cc1c2ccccc2cc2ccccc21)C(=O)NCC[NH3+]	ZINC001219870638	878555204	/nfs/dbraw/zinc/55/52/04/878555204.db2.gz	NTIIXIZBZXFDEX-SFHVURJKSA-N	1	1	307.397	1.938	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCC[C@@H](C1)[C@@H]2Oc1nc2c[nH]cc([N+](=O)[O-])c-2n1	ZINC001230231463	884382034	/nfs/dbraw/zinc/38/20/34/884382034.db2.gz	KKVKIWCBEQOFRM-WDAIWFPHSA-N	1	1	317.349	1.975	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@H]3CC[NH2+]C[C@@H]3F)CC2)cc1	ZINC001246085801	892408338	/nfs/dbraw/zinc/40/83/38/892408338.db2.gz	IZMYRNDSEVCMNT-HOTGVXAUSA-N	1	1	322.384	1.853	20	5		DDBDMO
[NH3+]C[C@@]1(O)CCCCN([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001246564302	892701816	/nfs/dbraw/zinc/70/18/16/892701816.db2.gz	XHKYEOACEBKMRH-HOTGVXAUSA-N	1	1	305.378	1.238	20	5		DDBDMO
CC[C@@](N)(CO)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254469385	896455754	/nfs/dbraw/zinc/45/57/54/896455754.db2.gz	LTHVKZOGYBALLJ-HNNXBMFYSA-N	1	1	308.382	1.211	20	5		DDBDMO
CS(=O)(=O)[C@@H]1CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601273	896524768	/nfs/dbraw/zinc/52/47/68/896524768.db2.gz	XGZGQMQVTBZCOU-ZIAGYGMSSA-N	1	1	310.375	1.181	20	5		DDBDMO
CS(=O)(=O)[C@@H]1CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601273	896524779	/nfs/dbraw/zinc/52/47/79/896524779.db2.gz	XGZGQMQVTBZCOU-ZIAGYGMSSA-N	1	1	310.375	1.181	20	5		DDBDMO
CCc1nocc1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001280814363	897611571	/nfs/dbraw/zinc/61/15/71/897611571.db2.gz	NSIMVADBPQXVNY-TZMCWYRMSA-N	1	1	324.381	1.183	20	5		DDBDMO
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2C[N@@H+](CC[N+](=O)[O-])C[C@@H]21	ZINC001262256056	900055672	/nfs/dbraw/zinc/05/56/72/900055672.db2.gz	DYEHYZDGVASTLZ-RWMBFGLXSA-N	1	1	313.398	1.888	20	5		DDBDMO
C[N@H+]1C[C@@]23CN(C(=O)c4ccc([N+](=O)[O-])[nH]4)C[C@]2(C1)CCCC3	ZINC001262662204	900290950	/nfs/dbraw/zinc/29/09/50/900290950.db2.gz	UIPMSKXWWUVDIU-IYBDPMFKSA-N	1	1	318.377	1.871	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)NCc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC001263074193	900482434	/nfs/dbraw/zinc/48/24/34/900482434.db2.gz	ZQSAPGJGYPWFFI-IHRRRGAJSA-N	1	1	318.377	1.734	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000278364829	214119154	/nfs/dbraw/zinc/11/91/54/214119154.db2.gz	HUTNRHDWPRLVOG-SNVBAGLBSA-N	1	1	323.397	1.683	20	5		DDBDMO
C[C@H](C(=O)NC(N)=O)[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451543173	231122689	/nfs/dbraw/zinc/12/26/89/231122689.db2.gz	BDKDARNXQCSYSH-PWSUYJOCSA-N	1	1	320.349	1.358	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21	ZINC000451624120	529798157	/nfs/dbraw/zinc/79/81/57/529798157.db2.gz	MKXUFPLUBNGDHP-YGRLFVJLSA-N	1	1	301.350	1.607	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1	ZINC000413232434	529810551	/nfs/dbraw/zinc/81/05/51/529810551.db2.gz	NGHKJMSHALDTCA-NSHDSACASA-N	1	1	320.271	1.487	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000266191720	282300909	/nfs/dbraw/zinc/30/09/09/282300909.db2.gz	MMRWKOBSPZODQD-AWEZNQCLSA-N	1	1	305.378	1.938	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[C@@H]1CCC[N@H+](C)C1	ZINC000458180750	232269107	/nfs/dbraw/zinc/26/91/07/232269107.db2.gz	ZAOAVZBBGVOJHH-LBPRGKRZSA-N	1	1	306.366	1.760	20	5		DDBDMO
C[N@@H+]1CCCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000272604832	210003504	/nfs/dbraw/zinc/00/35/04/210003504.db2.gz	VTGMKUPROGZUAN-UHFFFAOYSA-N	1	1	313.304	1.851	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000272604832	210003507	/nfs/dbraw/zinc/00/35/07/210003507.db2.gz	VTGMKUPROGZUAN-UHFFFAOYSA-N	1	1	313.304	1.851	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000279785207	215143268	/nfs/dbraw/zinc/14/32/68/215143268.db2.gz	UWXOSIBUIBNCBP-BBRMVZONSA-N	1	1	323.393	1.281	20	5		DDBDMO
CCOC1CC([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000287000835	219263777	/nfs/dbraw/zinc/26/37/77/219263777.db2.gz	QBKCTQBSSWMQDW-NPCAHTBFSA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H](C[NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000265988618	186350490	/nfs/dbraw/zinc/35/04/90/186350490.db2.gz	MCRHJEZBCNONIT-LLVKDONJSA-N	1	1	307.354	1.184	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000617352631	363066761	/nfs/dbraw/zinc/06/67/61/363066761.db2.gz	JAILZQAVGAUBSM-LBPRGKRZSA-N	1	1	319.361	1.818	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCO[C@H](C)C1	ZINC000026342622	352207810	/nfs/dbraw/zinc/20/78/10/352207810.db2.gz	JVKGOCHMARDGOO-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@H](C)C1	ZINC000026342622	352207812	/nfs/dbraw/zinc/20/78/12/352207812.db2.gz	JVKGOCHMARDGOO-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH+]2CCC(CO)CC2)c2c(c1)COCO2	ZINC000046091301	352436996	/nfs/dbraw/zinc/43/69/96/352436996.db2.gz	BVLBVAWABQNZLP-UHFFFAOYSA-N	1	1	308.334	1.666	20	5		DDBDMO
COc1ccc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000057719406	352825826	/nfs/dbraw/zinc/82/58/26/352825826.db2.gz	FXRFCIXWYWMHHG-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ccc([N+](=O)[O-])cn2)CC1	ZINC000060380145	352870033	/nfs/dbraw/zinc/87/00/33/352870033.db2.gz	MDJQUGRPNNZXJH-ZDUSSCGKSA-N	1	1	307.398	1.675	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000069475540	353161986	/nfs/dbraw/zinc/16/19/86/353161986.db2.gz	IFIPFSOOIMOGSN-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
Cc1cc(N2CC[NH+](C[C@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC000074726075	353327204	/nfs/dbraw/zinc/32/72/04/353327204.db2.gz	BKXYGDOAIZAATQ-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[NH+]2CCC(CO)CC2)cccc1[N+](=O)[O-]	ZINC000076991784	353447158	/nfs/dbraw/zinc/44/71/58/353447158.db2.gz	LGFMKRMXAKSBRL-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H]1COc2ccccc2O1	ZINC000174809290	198387790	/nfs/dbraw/zinc/38/77/90/198387790.db2.gz	RCDXYNRODRTKOP-CYBMUJFWSA-N	1	1	318.333	1.563	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CCC[N@@H+](CCN(C)C)CC1	ZINC000080611828	353618202	/nfs/dbraw/zinc/61/82/02/353618202.db2.gz	PXHKPAGAJQNQLU-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CCC[N@H+](CCN(C)C)CC1	ZINC000080611828	353618207	/nfs/dbraw/zinc/61/82/07/353618207.db2.gz	PXHKPAGAJQNQLU-UHFFFAOYSA-N	1	1	306.410	1.977	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000089265529	353763503	/nfs/dbraw/zinc/76/35/03/353763503.db2.gz	JCWQSDFUPDQIFZ-GFCCVEGCSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000142976410	354146856	/nfs/dbraw/zinc/14/68/56/354146856.db2.gz	DGZGOHQYWOZCRA-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154685803	354207375	/nfs/dbraw/zinc/20/73/75/354207375.db2.gz	HTJOYPOEBNDORL-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1ccc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000154685803	354207379	/nfs/dbraw/zinc/20/73/79/354207379.db2.gz	HTJOYPOEBNDORL-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369405	354224439	/nfs/dbraw/zinc/22/44/39/354224439.db2.gz	LVHPFGXRKVIJEU-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369405	354224443	/nfs/dbraw/zinc/22/44/43/354224443.db2.gz	LVHPFGXRKVIJEU-RISCZKNCSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000346192522	283017372	/nfs/dbraw/zinc/01/73/72/283017372.db2.gz	NLMHDWPAINVCFG-DCAQKATOSA-N	1	1	307.354	1.120	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000322570963	354537647	/nfs/dbraw/zinc/53/76/47/354537647.db2.gz	FUMKGRKYHOUMSJ-STQMWFEESA-N	1	1	318.377	1.993	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccccc2c1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000405243341	354677967	/nfs/dbraw/zinc/67/79/67/354677967.db2.gz	XONCDGIGPZSKNX-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000590548465	355110819	/nfs/dbraw/zinc/11/08/19/355110819.db2.gz	FBVBGUNVRJWQIY-OLZOCXBDSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590446889	355099239	/nfs/dbraw/zinc/09/92/39/355099239.db2.gz	WVSFCDSZUZUFFU-OCCSQVGLSA-N	1	1	319.361	1.526	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000591510742	355323017	/nfs/dbraw/zinc/32/30/17/355323017.db2.gz	GADNKSURVSCSTA-SWLSCSKDSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000591510742	355323020	/nfs/dbraw/zinc/32/30/20/355323020.db2.gz	GADNKSURVSCSTA-SWLSCSKDSA-N	1	1	321.377	1.661	20	5		DDBDMO
CCCN(C(=O)Nc1ccncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592247153	355547039	/nfs/dbraw/zinc/54/70/39/355547039.db2.gz	SJQGRYPDKDTFAQ-LLVKDONJSA-N	1	1	307.354	1.360	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])C(C)C	ZINC000593019643	355770922	/nfs/dbraw/zinc/77/09/22/355770922.db2.gz	IFQKHHHYXJFMSE-ZDUSSCGKSA-N	1	1	323.349	1.242	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@@H](C)CCO)cccc1[N+](=O)[O-]	ZINC000593108010	355800891	/nfs/dbraw/zinc/80/08/91/355800891.db2.gz	STKPXDNRAJWSEI-NSHDSACASA-N	1	1	309.366	1.935	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)C(=O)NCCF	ZINC000595040804	356375936	/nfs/dbraw/zinc/37/59/36/356375936.db2.gz	XWBNLDADXVHTAV-ZJUUUORDSA-N	1	1	313.329	1.728	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)C1	ZINC000081362764	192256848	/nfs/dbraw/zinc/25/68/48/192256848.db2.gz	UIUOFNCWMXWGAW-CYBMUJFWSA-N	1	1	323.397	1.290	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH+]1C[C@H](C)C(O)[C@@H](C)C1	ZINC000595742452	356631616	/nfs/dbraw/zinc/63/16/16/356631616.db2.gz	GOZQKZSFLSYNOP-RYUDHWBXSA-N	1	1	321.377	1.790	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@]3(O)C[C@H]3C2)c([N+](=O)[O-])c1	ZINC000595756416	356639045	/nfs/dbraw/zinc/63/90/45/356639045.db2.gz	GJXQWCQHLPXKMF-XHDPSFHLSA-N	1	1	308.334	1.439	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000595872682	356686920	/nfs/dbraw/zinc/68/69/20/356686920.db2.gz	KQFWZSHIPVPKLP-WBMJQRKESA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@]1(C)CO	ZINC000595872682	356686924	/nfs/dbraw/zinc/68/69/24/356686924.db2.gz	KQFWZSHIPVPKLP-WBMJQRKESA-N	1	1	321.377	1.508	20	5		DDBDMO
C[NH+](C)CCC[C@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CCO1	ZINC000595907154	356700687	/nfs/dbraw/zinc/70/06/87/356700687.db2.gz	REDHPRKNCMTZAX-HNNXBMFYSA-N	1	1	323.393	1.843	20	5		DDBDMO
CCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000596420134	356873209	/nfs/dbraw/zinc/87/32/09/356873209.db2.gz	XEPQBVFKNHBYKC-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
CC(C)(C[NH+]1CCOCC1)Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596271106	356839777	/nfs/dbraw/zinc/83/97/77/356839777.db2.gz	KIJAEDWIVRVONG-UHFFFAOYSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CSc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596285543	356845364	/nfs/dbraw/zinc/84/53/64/356845364.db2.gz	NQZUZOBAMUSGEO-VIFPVBQESA-N	1	1	311.363	1.116	20	5		DDBDMO
C[N@H+]1CCO[C@H](CSc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596285543	356845367	/nfs/dbraw/zinc/84/53/67/356845367.db2.gz	NQZUZOBAMUSGEO-VIFPVBQESA-N	1	1	311.363	1.116	20	5		DDBDMO
Cc1cnc(N[C@@H](C)C[N@H+](C)CCCN(C)C)c([N+](=O)[O-])c1	ZINC000596360428	356863534	/nfs/dbraw/zinc/86/35/34/356863534.db2.gz	KKVFGZYPTNAOOZ-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1cnc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c([N+](=O)[O-])c1	ZINC000596360428	356863537	/nfs/dbraw/zinc/86/35/37/356863537.db2.gz	KKVFGZYPTNAOOZ-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000597922937	357382589	/nfs/dbraw/zinc/38/25/89/357382589.db2.gz	HEHQTSLPPCTRTM-LLVKDONJSA-N	1	1	309.370	1.170	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000598342506	357545970	/nfs/dbraw/zinc/54/59/70/357545970.db2.gz	OCWWWLZGKKAOOX-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598592795	357645293	/nfs/dbraw/zinc/64/52/93/357645293.db2.gz	NFYWTOABGQUJHH-NSHDSACASA-N	1	1	322.365	1.919	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000598627425	357660875	/nfs/dbraw/zinc/66/08/75/357660875.db2.gz	PYRKGRUNHCLYLY-HNNXBMFYSA-N	1	1	320.349	1.308	20	5		DDBDMO
C[C@H]1CCCN1C(=O)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000347788940	283277735	/nfs/dbraw/zinc/27/77/35/283277735.db2.gz	KMUVNKVVGLDORD-LBPRGKRZSA-N	1	1	318.377	1.749	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000599565998	357975707	/nfs/dbraw/zinc/97/57/07/357975707.db2.gz	BBUPFEQEEALGLH-HNNXBMFYSA-N	1	1	324.333	1.238	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O	ZINC000599632391	357998712	/nfs/dbraw/zinc/99/87/12/357998712.db2.gz	IIXWGNIOZSORMD-IFMYKAFSSA-N	1	1	324.402	1.959	20	5		DDBDMO
C[C@]1(CO)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@@]1(C)CO	ZINC000599624903	357997129	/nfs/dbraw/zinc/99/71/29/357997129.db2.gz	YMQGWCYQHSGDFF-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
C[C@]1(CO)C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@@]1(C)CO	ZINC000599624903	357997132	/nfs/dbraw/zinc/99/71/32/357997132.db2.gz	YMQGWCYQHSGDFF-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000180552980	199175044	/nfs/dbraw/zinc/17/50/44/199175044.db2.gz	SJGVEADVJFORGG-LLVKDONJSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[N@H+]1CCCN(CCCNc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601109938	358405446	/nfs/dbraw/zinc/40/54/46/358405446.db2.gz	WSEYAMIQMDYXBR-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
CN1CCC[N@H+](CCCNc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601109938	358405451	/nfs/dbraw/zinc/40/54/51/358405451.db2.gz	WSEYAMIQMDYXBR-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
CN1CCC[N@@H+](CCCNc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601109938	358405455	/nfs/dbraw/zinc/40/54/55/358405455.db2.gz	WSEYAMIQMDYXBR-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601137119	358417093	/nfs/dbraw/zinc/41/70/93/358417093.db2.gz	TVBJAUHYINMSQL-JGVFFNPUSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601137119	358417095	/nfs/dbraw/zinc/41/70/95/358417095.db2.gz	TVBJAUHYINMSQL-JGVFFNPUSA-N	1	1	321.303	1.876	20	5		DDBDMO
CCn1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC000601149863	358422040	/nfs/dbraw/zinc/42/20/40/358422040.db2.gz	QWZWVHDJEFILFH-OAHLLOKOSA-N	1	1	304.350	1.809	20	5		DDBDMO
C[C@@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000601150110	358422697	/nfs/dbraw/zinc/42/26/97/358422697.db2.gz	WHPMIOILKLYEPC-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
CC(=O)N[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1	ZINC000601175868	358433632	/nfs/dbraw/zinc/43/36/32/358433632.db2.gz	RBNOIJVYUONKRO-NSHDSACASA-N	1	1	300.318	1.858	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601975538	358761888	/nfs/dbraw/zinc/76/18/88/358761888.db2.gz	XLKPVYWPCLGLJW-TXEJJXNPSA-N	1	1	305.334	1.420	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601975538	358761889	/nfs/dbraw/zinc/76/18/89/358761889.db2.gz	XLKPVYWPCLGLJW-TXEJJXNPSA-N	1	1	305.334	1.420	20	5		DDBDMO
NC(=O)[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000602427401	358969639	/nfs/dbraw/zinc/96/96/39/358969639.db2.gz	GUBPGYRSBXYGLD-SECBINFHSA-N	1	1	317.267	1.921	20	5		DDBDMO
Cn1cc(CN2CC[NH+](Cc3cccs3)CC2)c([N+](=O)[O-])n1	ZINC000602430554	358970792	/nfs/dbraw/zinc/97/07/92/358970792.db2.gz	BXBXVCYUBBPSLK-UHFFFAOYSA-N	1	1	321.406	1.708	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CC1	ZINC000602771406	359179112	/nfs/dbraw/zinc/17/91/12/359179112.db2.gz	IVFRJIYGRSDWIS-SNVBAGLBSA-N	1	1	310.354	1.373	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@H](Cc2cnn(C)c2)C1	ZINC000602778370	359185072	/nfs/dbraw/zinc/18/50/72/359185072.db2.gz	AYXALHGQCISMIB-ZDUSSCGKSA-N	1	1	318.381	1.398	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@](CO)(C(C)C)C1	ZINC000602830174	359222099	/nfs/dbraw/zinc/22/20/99/359222099.db2.gz	AEEPNBQADHWBHI-OAHLLOKOSA-N	1	1	310.398	1.830	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@](C)(CO)C1	ZINC000602963638	359326572	/nfs/dbraw/zinc/32/65/72/359326572.db2.gz	HPSSJNDNLGQSAH-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000603140836	359429120	/nfs/dbraw/zinc/42/91/20/359429120.db2.gz	ALZXVHSAGLWYOB-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C)[C@@H](C(C)(C)C)C1	ZINC000603140836	359429124	/nfs/dbraw/zinc/42/91/24/359429124.db2.gz	ALZXVHSAGLWYOB-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@@H]1O	ZINC000186820159	200016973	/nfs/dbraw/zinc/01/69/73/200016973.db2.gz	SRJKWAIKGGPKBG-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@@H]1O	ZINC000186820159	200016974	/nfs/dbraw/zinc/01/69/74/200016974.db2.gz	SRJKWAIKGGPKBG-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](O)[C@H](C)C1	ZINC000186823146	200017387	/nfs/dbraw/zinc/01/73/87/200017387.db2.gz	CQJOBKLCANJOJP-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000187163632	200070153	/nfs/dbraw/zinc/07/01/53/200070153.db2.gz	YIGVFIPCWFGAFI-GFCCVEGCSA-N	1	1	324.381	1.269	20	5		DDBDMO
C[C@@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@@H]1C[N@H+](C)CCO1	ZINC000618588304	363684161	/nfs/dbraw/zinc/68/41/61/363684161.db2.gz	XCBNDNGXHGCPRH-RNCFNFMXSA-N	1	1	305.338	1.024	20	5		DDBDMO
C[C@@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@@H]1C[N@@H+](C)CCO1	ZINC000618588304	363684164	/nfs/dbraw/zinc/68/41/64/363684164.db2.gz	XCBNDNGXHGCPRH-RNCFNFMXSA-N	1	1	305.338	1.024	20	5		DDBDMO
Cc1cccc(C(=O)NCC[N@@H+]2CCCOCC2)c1[N+](=O)[O-]	ZINC000189387816	200391973	/nfs/dbraw/zinc/39/19/73/200391973.db2.gz	QKPKWAULOQRTCG-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1cccc(C(=O)NCC[N@H+]2CCCOCC2)c1[N+](=O)[O-]	ZINC000189387816	200391974	/nfs/dbraw/zinc/39/19/74/200391974.db2.gz	QKPKWAULOQRTCG-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609450476	360307787	/nfs/dbraw/zinc/30/77/87/360307787.db2.gz	YRSKKCWEWZUTAT-SECBINFHSA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000609450476	360307788	/nfs/dbraw/zinc/30/77/88/360307788.db2.gz	YRSKKCWEWZUTAT-SECBINFHSA-N	1	1	307.306	1.100	20	5		DDBDMO
CCC[C@H]1CN(c2cccnc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000611228214	360667817	/nfs/dbraw/zinc/66/78/17/360667817.db2.gz	UEUPOFMUMZFUAU-ZDUSSCGKSA-N	1	1	308.382	1.927	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C[N@@H+](C)CC3CC3)C2)n1	ZINC000611335231	360700632	/nfs/dbraw/zinc/70/06/32/360700632.db2.gz	HHVCQTBMGOXSFW-LBPRGKRZSA-N	1	1	321.381	1.132	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611564062	360761348	/nfs/dbraw/zinc/76/13/48/360761348.db2.gz	VAXGEIWCBLSGSI-RYUDHWBXSA-N	1	1	322.361	1.959	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCOCC3(CC3)C2)c1	ZINC000611813312	360831722	/nfs/dbraw/zinc/83/17/22/360831722.db2.gz	XKJMJMFKBGBVMO-CQSZACIVSA-N	1	1	322.361	1.447	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOCC3(CC3)C2)c1	ZINC000611813311	360832290	/nfs/dbraw/zinc/83/22/90/360832290.db2.gz	XKJMJMFKBGBVMO-AWEZNQCLSA-N	1	1	322.361	1.447	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)CCc2cccc([N+](=O)[O-])c2)CC1	ZINC000271957593	209340695	/nfs/dbraw/zinc/34/06/95/209340695.db2.gz	YNJOQNUXLIRGJB-UHFFFAOYSA-N	1	1	303.362	1.906	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000271902396	209310670	/nfs/dbraw/zinc/31/06/70/209310670.db2.gz	GZNUUDTXKBZPGZ-VOTSOKGWSA-N	1	1	301.346	1.986	20	5		DDBDMO
CNc1c(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613235007	361342090	/nfs/dbraw/zinc/34/20/90/361342090.db2.gz	LBZPWBGKJCSWPO-ZWNOBZJWSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613235007	361342095	/nfs/dbraw/zinc/34/20/95/361342095.db2.gz	LBZPWBGKJCSWPO-ZWNOBZJWSA-N	1	1	322.365	1.085	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000193690658	201104537	/nfs/dbraw/zinc/10/45/37/201104537.db2.gz	QWMQDBUVFDWWRX-NSHDSACASA-N	1	1	322.365	1.403	20	5		DDBDMO
CC1(C)C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000619187188	363926482	/nfs/dbraw/zinc/92/64/82/363926482.db2.gz	WDBROXIAHXDXFK-UONOGXRCSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC1(C)C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000619187188	363926485	/nfs/dbraw/zinc/92/64/85/363926485.db2.gz	WDBROXIAHXDXFK-UONOGXRCSA-N	1	1	319.361	1.403	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC=CCC1	ZINC000350075316	284143322	/nfs/dbraw/zinc/14/33/22/284143322.db2.gz	IRIXYBFRYCLHQJ-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=CCC1	ZINC000350075316	284143323	/nfs/dbraw/zinc/14/33/23/284143323.db2.gz	IRIXYBFRYCLHQJ-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC000264627349	204039376	/nfs/dbraw/zinc/03/93/76/204039376.db2.gz	SVXFDHZRCREMFL-LBPRGKRZSA-N	1	1	310.329	1.486	20	5		DDBDMO
Cc1cccc(C(=O)NCC[NH+]2CCSCC2)c1[N+](=O)[O-]	ZINC000264830461	204190223	/nfs/dbraw/zinc/19/02/23/204190223.db2.gz	TXQVAYQCXCPMAE-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000264941506	204288493	/nfs/dbraw/zinc/28/84/93/204288493.db2.gz	IJLZPCCPXSAWTO-LLVKDONJSA-N	1	1	321.381	1.765	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000334084038	249209725	/nfs/dbraw/zinc/20/97/25/249209725.db2.gz	WDAMABMGWKCZLV-QWRGUYRKSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@H]1OCC[NH2+][C@@H]1C(=O)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000284724456	218150222	/nfs/dbraw/zinc/15/02/22/218150222.db2.gz	VFKPXCAFZKVMBN-DOMZBBRYSA-N	1	1	321.377	1.411	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000061380222	184169994	/nfs/dbraw/zinc/16/99/94/184169994.db2.gz	IZNYTGFHTPMMEZ-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCCN1CC[N@@H+](C)C(C)(C)C1	ZINC000340903687	251266948	/nfs/dbraw/zinc/26/69/48/251266948.db2.gz	MURWRXQIQQXBNO-UHFFFAOYSA-N	1	1	324.429	1.558	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269110139	207248837	/nfs/dbraw/zinc/24/88/37/207248837.db2.gz	IESJCWOIFWESRD-MNOVXSKESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269110139	207248842	/nfs/dbraw/zinc/24/88/42/207248842.db2.gz	IESJCWOIFWESRD-MNOVXSKESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269110139	207248847	/nfs/dbraw/zinc/24/88/47/207248847.db2.gz	IESJCWOIFWESRD-MNOVXSKESA-N	1	1	307.354	1.183	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000412306003	224008075	/nfs/dbraw/zinc/00/80/75/224008075.db2.gz	DLZXXORAUAOUPU-UHFFFAOYSA-N	1	1	321.381	1.276	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000450959793	532956206	/nfs/dbraw/zinc/95/62/06/532956206.db2.gz	YXXGDUTWKVTWHG-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)C[C@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000450959793	532956212	/nfs/dbraw/zinc/95/62/12/532956212.db2.gz	YXXGDUTWKVTWHG-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
C[C@@H](NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C1=CC[N@@H+](C)CC1	ZINC000330762360	533040718	/nfs/dbraw/zinc/04/07/18/533040718.db2.gz	HTBRHCQMVTVMAN-LLVKDONJSA-N	1	1	321.381	1.293	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCC[C@H]1O	ZINC000286510270	219027491	/nfs/dbraw/zinc/02/74/91/219027491.db2.gz	MUFZGFYNYZMIQM-HUUCEWRRSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157305778	197177888	/nfs/dbraw/zinc/17/78/88/197177888.db2.gz	SCUBNYFGNCYQMZ-TZMCWYRMSA-N	1	1	321.381	1.124	20	5		DDBDMO
C[C@H](CO)[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000289486955	221011939	/nfs/dbraw/zinc/01/19/39/221011939.db2.gz	RESVVNXATQVARE-LLVKDONJSA-N	1	1	304.350	1.808	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](c2nc(=O)[nH][nH]2)C1	ZINC000289487171	221012253	/nfs/dbraw/zinc/01/22/53/221012253.db2.gz	SGSYDSXLJWGPLF-QWRGUYRKSA-N	1	1	317.349	1.947	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCC1(F)F	ZINC000289783085	221222393	/nfs/dbraw/zinc/22/23/93/221222393.db2.gz	LVOHORSOVGMZFO-MWLCHTKSSA-N	1	1	304.297	1.129	20	5		DDBDMO
C[C@@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C[NH+](C)C	ZINC001120489019	781979462	/nfs/dbraw/zinc/97/94/62/781979462.db2.gz	MEGIXRQYSVWZEM-STQMWFEESA-N	1	1	311.382	1.122	20	5		DDBDMO
C[C@@H](C[NH2+]C[C@H](O)COc1ccccc1[N+](=O)[O-])CN(C)C	ZINC001120489019	781979471	/nfs/dbraw/zinc/97/94/71/781979471.db2.gz	MEGIXRQYSVWZEM-STQMWFEESA-N	1	1	311.382	1.122	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299578632	533667392	/nfs/dbraw/zinc/66/73/92/533667392.db2.gz	XEDPTULILQQYAX-AXFHLTTASA-N	1	1	323.397	1.723	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CCCCO)c1cccc([N+](=O)[O-])c1	ZINC000353607516	285826021	/nfs/dbraw/zinc/82/60/21/285826021.db2.gz	PPEHELPNSYVQRP-AWEZNQCLSA-N	1	1	304.350	1.780	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000569162474	304339145	/nfs/dbraw/zinc/33/91/45/304339145.db2.gz	UGNJRLYFKNZICO-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000569162474	304339147	/nfs/dbraw/zinc/33/91/47/304339147.db2.gz	UGNJRLYFKNZICO-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000076345443	406963871	/nfs/dbraw/zinc/96/38/71/406963871.db2.gz	NMZBZPAPDWCOTL-ZFWWWQNUSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC(C)[N@@H+](CCO)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000085861062	407106225	/nfs/dbraw/zinc/10/62/25/407106225.db2.gz	UXAAVXFKIVSLTB-UHFFFAOYSA-N	1	1	307.350	1.187	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000079943477	407066366	/nfs/dbraw/zinc/06/63/66/407066366.db2.gz	ACKFFDPFOFNKGO-CYBMUJFWSA-N	1	1	322.409	1.878	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000055900371	407207917	/nfs/dbraw/zinc/20/79/17/407207917.db2.gz	VSWBSUUIOYEZQK-HNNXBMFYSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000065867570	407245966	/nfs/dbraw/zinc/24/59/66/407245966.db2.gz	OWWUOIZQMYLQAR-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123191215	407321575	/nfs/dbraw/zinc/32/15/75/407321575.db2.gz	LUXHWLWXCDWBQL-BXUZGUMPSA-N	1	1	320.393	1.608	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1	ZINC000101631743	407313271	/nfs/dbraw/zinc/31/32/71/407313271.db2.gz	HYXZZGUQFIYTNJ-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Nc1ccncc1[N+](=O)[O-])C2	ZINC000124563286	407362319	/nfs/dbraw/zinc/36/23/19/407362319.db2.gz	WZXSRVGDUFNNCS-WDEREUQCSA-N	1	1	305.338	1.690	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCn1cccn1	ZINC000111281185	407406395	/nfs/dbraw/zinc/40/63/95/407406395.db2.gz	UBBUVGKSFIFISJ-UHFFFAOYSA-N	1	1	317.349	1.752	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000111635723	407412620	/nfs/dbraw/zinc/41/26/20/407412620.db2.gz	ZZFBIHIIUYUCKB-JTQLQIEISA-N	1	1	308.338	1.300	20	5		DDBDMO
CN1CC[NH+]([C@@H]2CCCCN(c3ncccc3[N+](=O)[O-])C2)CC1	ZINC000127021618	407426320	/nfs/dbraw/zinc/42/63/20/407426320.db2.gz	AHVVSIIZANSAGJ-CQSZACIVSA-N	1	1	319.409	1.596	20	5		DDBDMO
CNC(=O)[C@@H]1CCCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000170911871	407552042	/nfs/dbraw/zinc/55/20/42/407552042.db2.gz	YETBDWMJEPSBTE-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000114062859	407535674	/nfs/dbraw/zinc/53/56/74/407535674.db2.gz	FRXWNAIAJNWQQY-QWRGUYRKSA-N	1	1	323.349	1.663	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2[C@H](O)C(F)(F)F)c1	ZINC000266907308	407672540	/nfs/dbraw/zinc/67/25/40/407672540.db2.gz	BOLNDTIPIMBBNL-UWVGGRQHSA-N	1	1	308.260	1.179	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](CN3CCOCC3)C2)c(F)c1	ZINC000267006354	407713857	/nfs/dbraw/zinc/71/38/57/407713857.db2.gz	FWUSDYFCYDSLTL-CYBMUJFWSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[NH2+]C[C@@H]1c1cccc(F)c1	ZINC000262108142	407741569	/nfs/dbraw/zinc/74/15/69/407741569.db2.gz	ZTSVVFYNWRALRE-CQSZACIVSA-N	1	1	318.308	1.849	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000272107402	407777620	/nfs/dbraw/zinc/77/76/20/407777620.db2.gz	MUDWPPDSMKLHGD-CHWSQXEVSA-N	1	1	320.393	1.408	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)N1CCOCC1	ZINC000153391613	407815647	/nfs/dbraw/zinc/81/56/47/407815647.db2.gz	JFZUCFVQJDFHOV-UHFFFAOYSA-N	1	1	319.361	1.202	20	5		DDBDMO
C[C@H](C(=O)NCCOc1ccc([N+](=O)[O-])cc1)[NH+]1CC(C)C1	ZINC000571102128	304437313	/nfs/dbraw/zinc/43/73/13/304437313.db2.gz	GRMGCLJWMGGBMC-GFCCVEGCSA-N	1	1	307.350	1.430	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000153659404	407870190	/nfs/dbraw/zinc/87/01/90/407870190.db2.gz	XOXYRYKYLLQBGX-MGPQQGTHSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[C@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000187727844	407884759	/nfs/dbraw/zinc/88/47/59/407884759.db2.gz	YGIRYTXGFJISRV-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000187727844	407884766	/nfs/dbraw/zinc/88/47/66/407884766.db2.gz	YGIRYTXGFJISRV-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000187727844	407884775	/nfs/dbraw/zinc/88/47/75/407884775.db2.gz	YGIRYTXGFJISRV-AWEZNQCLSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000268102276	407889391	/nfs/dbraw/zinc/88/93/91/407889391.db2.gz	FTHXKLZLDONKFT-FZMZJTMJSA-N	1	1	318.377	1.877	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000268253008	407971192	/nfs/dbraw/zinc/97/11/92/407971192.db2.gz	XGELCMDOAKECKZ-XHDPSFHLSA-N	1	1	319.361	1.573	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000272570164	407989708	/nfs/dbraw/zinc/98/97/08/407989708.db2.gz	FTCDKOMRRXAYDK-DOMZBBRYSA-N	1	1	319.361	1.526	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000154742635	408077798	/nfs/dbraw/zinc/07/77/98/408077798.db2.gz	HAWRYSQFCDECEZ-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
C[C@H]1C[C@H](C)C[NH+](CCCCNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000136205179	408090876	/nfs/dbraw/zinc/09/08/76/408090876.db2.gz	FSWAIRMBJUMVTD-RYUDHWBXSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CC1(O)CCOCC1	ZINC000189749645	408100928	/nfs/dbraw/zinc/10/09/28/408100928.db2.gz	LICSZVOVCVREIV-UHFFFAOYSA-N	1	1	324.377	1.837	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000175326441	408106058	/nfs/dbraw/zinc/10/60/58/408106058.db2.gz	XBIRNPJFFYGBLD-LLVKDONJSA-N	1	1	322.365	1.499	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]([NH+](CC)CC)C2)c1[N+](=O)[O-]	ZINC000175405490	408121459	/nfs/dbraw/zinc/12/14/59/408121459.db2.gz	WWVZXTYJWQYNKW-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc(OC)c([N+](=O)[O-])c1)C1CC1	ZINC000263657236	408192749	/nfs/dbraw/zinc/19/27/49/408192749.db2.gz	AGKHSMCYRLIXLY-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[C@@H]1C[NH+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000273317016	408149122	/nfs/dbraw/zinc/14/91/22/408149122.db2.gz	JPNBVBLOKNNHTG-VXGBXAGGSA-N	1	1	312.391	1.956	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000151201786	408275102	/nfs/dbraw/zinc/27/51/02/408275102.db2.gz	PPQHYZSTGZVYKW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000151201786	408275106	/nfs/dbraw/zinc/27/51/06/408275106.db2.gz	PPQHYZSTGZVYKW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@H+](C)C1CCCC1	ZINC000264138903	408378381	/nfs/dbraw/zinc/37/83/81/408378381.db2.gz	FZWIQFHJSLGXDG-UHFFFAOYSA-N	1	1	309.370	1.090	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000247289827	408445261	/nfs/dbraw/zinc/44/52/61/408445261.db2.gz	GJQNSQADNRSFSJ-QWRGUYRKSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000247289827	408445267	/nfs/dbraw/zinc/44/52/67/408445267.db2.gz	GJQNSQADNRSFSJ-QWRGUYRKSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000247289827	408445272	/nfs/dbraw/zinc/44/52/72/408445272.db2.gz	GJQNSQADNRSFSJ-QWRGUYRKSA-N	1	1	323.397	1.825	20	5		DDBDMO
C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000183583187	408446466	/nfs/dbraw/zinc/44/64/66/408446466.db2.gz	DCVYAGLEZXIJLE-NSHDSACASA-N	1	1	323.353	1.080	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1C[N@H+](C)CCN1C	ZINC000275543584	408595021	/nfs/dbraw/zinc/59/50/21/408595021.db2.gz	QSMHCDNDPOAZEW-ZDUSSCGKSA-N	1	1	321.381	1.271	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@@]3(C2)NC(=O)NC3=O)cccc1[N+](=O)[O-]	ZINC000192680953	408631577	/nfs/dbraw/zinc/63/15/77/408631577.db2.gz	CTAOZEDNXZEFTQ-HNNXBMFYSA-N	1	1	318.333	1.077	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@@]3(C2)NC(=O)NC3=O)cccc1[N+](=O)[O-]	ZINC000192680953	408631585	/nfs/dbraw/zinc/63/15/85/408631585.db2.gz	CTAOZEDNXZEFTQ-HNNXBMFYSA-N	1	1	318.333	1.077	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1O	ZINC000249527347	408736048	/nfs/dbraw/zinc/73/60/48/408736048.db2.gz	AGGVRCOBRWMDOF-MBNYWOFBSA-N	1	1	310.350	1.037	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1	ZINC000185222230	408782448	/nfs/dbraw/zinc/78/24/48/408782448.db2.gz	GYIWTLMGHHDPFB-UHFFFAOYSA-N	1	1	301.302	1.962	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)CC2(C)C)cccc1[N+](=O)[O-]	ZINC000270952612	408756893	/nfs/dbraw/zinc/75/68/93/408756893.db2.gz	VTIMFMCNPPMZNF-UHFFFAOYSA-N	1	1	305.378	1.998	20	5		DDBDMO
C[C@@H](C[S@](C)=O)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000185126336	408764469	/nfs/dbraw/zinc/76/44/69/408764469.db2.gz	NDDLCHFPWBEEST-YBTHPKLGSA-N	1	1	300.380	1.672	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@@](C)(C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000280840876	408844693	/nfs/dbraw/zinc/84/46/93/408844693.db2.gz	XBCHDTHBKJUMRE-OAHLLOKOSA-N	1	1	307.350	1.691	20	5		DDBDMO
[NH3+]CC[C@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000286040064	408912767	/nfs/dbraw/zinc/91/27/67/408912767.db2.gz	KSSZUPUVLPFLGP-SNVBAGLBSA-N	1	1	317.349	1.815	20	5		DDBDMO
C[N@@H+]1C[C@@H]2C[NH+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193601704	163259468	/nfs/dbraw/zinc/25/94/68/163259468.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[NH+]1C[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193601704	163259469	/nfs/dbraw/zinc/25/94/69/163259469.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[NH+]1C[C@@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193601704	163259471	/nfs/dbraw/zinc/25/94/71/163259471.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[N@H+]1C[C@H]2CN(CCCOc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000193601704	163259473	/nfs/dbraw/zinc/25/94/73/163259473.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(CCCOc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000193601704	163259474	/nfs/dbraw/zinc/25/94/74/163259474.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
CN1C[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193601704	163259476	/nfs/dbraw/zinc/25/94/76/163259476.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
CN1C[C@@H]2C[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000193601704	163259478	/nfs/dbraw/zinc/25/94/78/163259478.db2.gz	WSZIIQMZLHZNRV-OKILXGFUSA-N	1	1	305.378	1.857	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000193616232	163260762	/nfs/dbraw/zinc/26/07/62/163260762.db2.gz	ZQFYYQHACDCLDW-BETUJISGSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1ccc(Br)c([N+](=O)[O-])c1	ZINC000286262195	408952137	/nfs/dbraw/zinc/95/21/37/408952137.db2.gz	BGJVFMOEJFBQEM-UHFFFAOYSA-N	1	1	316.155	1.665	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)CN1	ZINC000278837663	409098442	/nfs/dbraw/zinc/09/84/42/409098442.db2.gz	IXLDDXANPCURAC-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](O)Cc1ccccc1	ZINC000293418624	409109224	/nfs/dbraw/zinc/10/92/24/409109224.db2.gz	SQDZBQGGJYZYMU-HNNXBMFYSA-N	1	1	304.350	1.327	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283623733	409185938	/nfs/dbraw/zinc/18/59/38/409185938.db2.gz	AXWCDJBBTZFICT-JTQLQIEISA-N	1	1	324.356	1.730	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCc1c[nH+]c(N(C)C)n1C	ZINC000288848469	409187637	/nfs/dbraw/zinc/18/76/37/409187637.db2.gz	KISKDRSOITXWOY-UHFFFAOYSA-N	1	1	307.358	1.531	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000279125035	409153185	/nfs/dbraw/zinc/15/31/85/409153185.db2.gz	VFTXBLPRROWMNH-BONVTDFDSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000279125035	409153188	/nfs/dbraw/zinc/15/31/88/409153188.db2.gz	VFTXBLPRROWMNH-BONVTDFDSA-N	1	1	318.333	1.330	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC1	ZINC000279146563	409157559	/nfs/dbraw/zinc/15/75/59/409157559.db2.gz	DULRRKVZSOEFKL-UHFFFAOYSA-N	1	1	324.356	1.578	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])[nH]1	ZINC000279166691	409161675	/nfs/dbraw/zinc/16/16/75/409161675.db2.gz	GQYKMJMWTXYWGV-NSHDSACASA-N	1	1	322.365	1.248	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000288793271	409179320	/nfs/dbraw/zinc/17/93/20/409179320.db2.gz	KDROLZXLTLMFNA-STQMWFEESA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000288793271	409179324	/nfs/dbraw/zinc/17/93/24/409179324.db2.gz	KDROLZXLTLMFNA-STQMWFEESA-N	1	1	321.377	1.650	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000284140218	409283571	/nfs/dbraw/zinc/28/35/71/409283571.db2.gz	VZWAQBLGKIJKHC-UHFFFAOYSA-N	1	1	310.329	1.484	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@](C)(C(N)=O)C2)c([N+](=O)[O-])cc1OC	ZINC000280278902	409283713	/nfs/dbraw/zinc/28/37/13/409283713.db2.gz	NDXFOGUXZVXWEV-OAHLLOKOSA-N	1	1	323.349	1.309	20	5		DDBDMO
Cc1nc(N[C@@H](C)CC[NH+]2CCN(C)CC2)ncc1[N+](=O)[O-]	ZINC000295117097	409329115	/nfs/dbraw/zinc/32/91/15/409329115.db2.gz	WDYQQQWUWXUDEC-NSHDSACASA-N	1	1	308.386	1.131	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422411	409310107	/nfs/dbraw/zinc/31/01/07/409310107.db2.gz	LYDYQVQSSKOKNT-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCO2	ZINC000280422411	409310110	/nfs/dbraw/zinc/31/01/10/409310110.db2.gz	LYDYQVQSSKOKNT-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1(C)C	ZINC000295978839	409389390	/nfs/dbraw/zinc/38/93/90/409389390.db2.gz	KWWSZAMVLJDHSQ-AWEZNQCLSA-N	1	1	321.377	1.941	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@](C)(C(=O)NC)C1	ZINC000280541775	409349905	/nfs/dbraw/zinc/34/99/05/409349905.db2.gz	DKSFFOWVIGTSKP-INIZCTEOSA-N	1	1	321.377	1.952	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000295355868	409448473	/nfs/dbraw/zinc/44/84/73/409448473.db2.gz	ZCCWGUSACRUYOC-HNNXBMFYSA-N	1	1	324.356	1.557	20	5		DDBDMO
COc1ccc(C[N@@H+](CCOCCO)C(C)C)cc1[N+](=O)[O-]	ZINC000319606562	164037757	/nfs/dbraw/zinc/03/77/57/164037757.db2.gz	WVHKMMDRZOBEGZ-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1	ZINC000357034101	164136916	/nfs/dbraw/zinc/13/69/16/164136916.db2.gz	CEHYZACCFDHIRA-GFCCVEGCSA-N	1	1	321.381	1.323	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)CC[NH+](C(C)C)C(C)C)c1[N+](=O)[O-]	ZINC000357057143	164138386	/nfs/dbraw/zinc/13/83/86/164138386.db2.gz	IPJOUMYXAALLIK-UHFFFAOYSA-N	1	1	311.386	1.817	20	5		DDBDMO
C[N@@H+](CC[C@@H]1CCCO1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000342602189	409755759	/nfs/dbraw/zinc/75/57/59/409755759.db2.gz	LWWGOVZWSFESCM-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1cc(C[N@H+](C)[C@@H](C)C[S@@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630495	409772918	/nfs/dbraw/zinc/77/29/18/409772918.db2.gz	FKWJIRCJPGGSPN-WVDJIFEKSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H](C)C[S@@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630495	409772921	/nfs/dbraw/zinc/77/29/21/409772921.db2.gz	FKWJIRCJPGGSPN-WVDJIFEKSA-N	1	1	300.380	1.802	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000357041244	409810860	/nfs/dbraw/zinc/81/08/60/409810860.db2.gz	QMAHKHJNKVKHEN-QWRGUYRKSA-N	1	1	306.366	1.218	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000357041247	409812221	/nfs/dbraw/zinc/81/22/21/409812221.db2.gz	QMAHKHJNKVKHEN-WDEREUQCSA-N	1	1	306.366	1.218	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(C[NH+]3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000332085952	409865487	/nfs/dbraw/zinc/86/54/87/409865487.db2.gz	GDCLADQSPLWJNH-UHFFFAOYSA-N	1	1	321.381	1.574	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1	ZINC000319220563	409890166	/nfs/dbraw/zinc/89/01/66/409890166.db2.gz	NDNSFPZDBWAYFL-PHIMTYICSA-N	1	1	307.350	1.910	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1nnnn1CC1CC1	ZINC000349645888	409899691	/nfs/dbraw/zinc/89/96/91/409899691.db2.gz	NOPXTEJVLFFGGN-HYXAFXHYSA-N	1	1	314.349	1.794	20	5		DDBDMO
C[C@@H]1CC[N@H+](C)CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354617540	409970794	/nfs/dbraw/zinc/97/07/94/409970794.db2.gz	UTUITKSJCWQDOB-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354617540	409970800	/nfs/dbraw/zinc/97/08/00/409970800.db2.gz	UTUITKSJCWQDOB-LLVKDONJSA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000332599263	410189088	/nfs/dbraw/zinc/18/90/88/410189088.db2.gz	IPGFPMLUOVHJEM-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000332599263	410189093	/nfs/dbraw/zinc/18/90/93/410189093.db2.gz	IPGFPMLUOVHJEM-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](C)[C@H]1C	ZINC000343432242	410449327	/nfs/dbraw/zinc/44/93/27/410449327.db2.gz	KLEQWZGKIDVONH-GXFFZTMASA-N	1	1	307.350	1.816	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@H](O)CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000339780961	410456621	/nfs/dbraw/zinc/45/66/21/410456621.db2.gz	SYBZWVHBRCFLHM-AWEZNQCLSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343460319	410471204	/nfs/dbraw/zinc/47/12/04/410471204.db2.gz	SHYHHJKYZNGYOU-SMDDNHRTSA-N	1	1	307.350	1.573	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000343432246	410448436	/nfs/dbraw/zinc/44/84/36/410448436.db2.gz	KLEQWZGKIDVONH-ZWNOBZJWSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC	ZINC000339883948	410528845	/nfs/dbraw/zinc/52/88/45/410528845.db2.gz	GYHVUZSMRQRZGM-GFCCVEGCSA-N	1	1	306.366	1.851	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1CC(OC)C1	ZINC000352232405	410565053	/nfs/dbraw/zinc/56/50/53/410565053.db2.gz	VGYVMWAZPLKGKC-UHFFFAOYSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C1CC(OC)C1	ZINC000352232405	410565060	/nfs/dbraw/zinc/56/50/60/410565060.db2.gz	VGYVMWAZPLKGKC-UHFFFAOYSA-N	1	1	323.349	1.651	20	5		DDBDMO
COCC[N@@H+](C)Cc1ccc(OCC(=O)OC)c([N+](=O)[O-])c1	ZINC000355588309	410594777	/nfs/dbraw/zinc/59/47/77/410594777.db2.gz	VTNBAGYKRUZOSH-UHFFFAOYSA-N	1	1	312.322	1.225	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2nc3ccccc3cc2[N+](=O)[O-])C1	ZINC000352361261	410648799	/nfs/dbraw/zinc/64/87/99/410648799.db2.gz	QQDFKBUHXQKLTA-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@@H](O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000337310868	410708262	/nfs/dbraw/zinc/70/82/62/410708262.db2.gz	BOZAOEYZSONRPI-YWPYICTPSA-N	1	1	319.361	1.626	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)NCCc2cccc([N+](=O)[O-])c2)no1	ZINC000359565763	410737561	/nfs/dbraw/zinc/73/75/61/410737561.db2.gz	IYXUZEMPHSRLIK-UHFFFAOYSA-N	1	1	318.333	1.617	20	5		DDBDMO
C[C@H](CNC(=O)Cn1ccc([N+](=O)[O-])n1)[N@H+]1CCCC[C@H]1C	ZINC000340267395	410808629	/nfs/dbraw/zinc/80/86/29/410808629.db2.gz	HYFYOIFIFATVMS-VXGBXAGGSA-N	1	1	309.370	1.170	20	5		DDBDMO
CCc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@H]3C2)c1[N+](=O)[O-]	ZINC000301917198	410830638	/nfs/dbraw/zinc/83/06/38/410830638.db2.gz	ANWRBMXTBASLGS-SGMGOOAPSA-N	1	1	319.409	1.811	20	5		DDBDMO
CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000348223781	410864380	/nfs/dbraw/zinc/86/43/80/410864380.db2.gz	XWZSPPVRKZHZMH-CQSZACIVSA-N	1	1	318.377	1.362	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344038836	410910819	/nfs/dbraw/zinc/91/08/19/410910819.db2.gz	GKCPKLRRRBTWPL-CORIIIEPSA-N	1	1	319.361	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2CC[C@@H](O)[C@H]2C1	ZINC000344038836	410910829	/nfs/dbraw/zinc/91/08/29/410910829.db2.gz	GKCPKLRRRBTWPL-CORIIIEPSA-N	1	1	319.361	1.544	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+](C)C1CC(O)C1	ZINC000353490438	411027415	/nfs/dbraw/zinc/02/74/15/411027415.db2.gz	QRGVXIXAIJYTLA-GCVQQVDUSA-N	1	1	323.349	1.386	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+](C)C1CC(O)C1	ZINC000353490438	411027421	/nfs/dbraw/zinc/02/74/21/411027421.db2.gz	QRGVXIXAIJYTLA-GCVQQVDUSA-N	1	1	323.349	1.386	20	5		DDBDMO
C[C@@H](CO)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353499266	411034122	/nfs/dbraw/zinc/03/41/22/411034122.db2.gz	CSPAYDOANSEHGE-BXUZGUMPSA-N	1	1	304.350	1.636	20	5		DDBDMO
CCNC(=O)C[N@@H+](CC)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000133506967	196329975	/nfs/dbraw/zinc/32/99/75/196329975.db2.gz	YLFKLMIENQWXEW-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
CNc1nccc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000519180177	416898460	/nfs/dbraw/zinc/89/84/60/416898460.db2.gz	KNASUCLAZKLQPH-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)CCN1CC[NH+](C)CC1	ZINC000361012715	418566153	/nfs/dbraw/zinc/56/61/53/418566153.db2.gz	HCXGNKBEMNVJOI-LBPRGKRZSA-N	1	1	324.429	1.558	20	5		DDBDMO
C[C@@H]1c2ccccc2C[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000361044804	418572760	/nfs/dbraw/zinc/57/27/60/418572760.db2.gz	JPOHSSPNVXSZEB-BXUZGUMPSA-N	1	1	302.334	1.729	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+]([C@@H]3CCSC3)CC2)s1	ZINC000367148502	418564222	/nfs/dbraw/zinc/56/42/22/418564222.db2.gz	XZQUJORMPMRLML-SECBINFHSA-N	1	1	300.409	1.679	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCSC2(CCOCC2)C1	ZINC000375220767	418619607	/nfs/dbraw/zinc/61/96/07/418619607.db2.gz	NWKGGBQODSVKNC-UHFFFAOYSA-N	1	1	312.395	1.426	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCSC2(CCOCC2)C1	ZINC000375220767	418619609	/nfs/dbraw/zinc/61/96/09/418619609.db2.gz	NWKGGBQODSVKNC-UHFFFAOYSA-N	1	1	312.395	1.426	20	5		DDBDMO
CC1CC[NH+](C2CCC(NC(=O)[C@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000370938558	418751565	/nfs/dbraw/zinc/75/15/65/418751565.db2.gz	BFUBWUIXPRNQAS-WUCCLRPBSA-N	1	1	309.410	1.811	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990177	418755642	/nfs/dbraw/zinc/75/56/42/418755642.db2.gz	BZKUJDSQYWJIFQ-OJLVUWQFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370990177	418755645	/nfs/dbraw/zinc/75/56/45/418755645.db2.gz	BZKUJDSQYWJIFQ-OJLVUWQFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[C@H](CNC(=O)[C@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370990177	418755646	/nfs/dbraw/zinc/75/56/46/418755646.db2.gz	BZKUJDSQYWJIFQ-OJLVUWQFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000408113049	418788288	/nfs/dbraw/zinc/78/82/88/418788288.db2.gz	PUCAZXFUQMTZSW-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000408113049	418788290	/nfs/dbraw/zinc/78/82/90/418788290.db2.gz	PUCAZXFUQMTZSW-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCO[C@@H]2CCC[C@H]21	ZINC000372352676	418860033	/nfs/dbraw/zinc/86/00/33/418860033.db2.gz	ZYEKAFWAMKQYQB-ZIAGYGMSSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000420952399	419379221	/nfs/dbraw/zinc/37/92/21/419379221.db2.gz	XWDXCUIEEUJJLA-NWDGAFQWSA-N	1	1	322.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3CCO)o2)cc1	ZINC000426256675	419421761	/nfs/dbraw/zinc/42/17/61/419421761.db2.gz	SWYYZTBPPXFLKX-GFCCVEGCSA-N	1	1	318.333	1.992	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](C(=O)N(C)C)C2)ccc1[N+](=O)[O-]	ZINC000411936336	419505686	/nfs/dbraw/zinc/50/56/86/419505686.db2.gz	FPBAVPZGZSPQQA-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)cc1C	ZINC000421776635	419725635	/nfs/dbraw/zinc/72/56/35/419725635.db2.gz	UPGAWBHFUKOGAL-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1c1cccc(F)c1	ZINC000423619807	420102153	/nfs/dbraw/zinc/10/21/53/420102153.db2.gz	VXTDHCJRDBSTCO-LLVKDONJSA-N	1	1	319.296	1.244	20	5		DDBDMO
COCCO[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430193210	420088045	/nfs/dbraw/zinc/08/80/45/420088045.db2.gz	FWOPKRJHZNACKN-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430193210	420088047	/nfs/dbraw/zinc/08/80/47/420088047.db2.gz	FWOPKRJHZNACKN-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](CNC(C)=O)C1	ZINC000430223275	420091964	/nfs/dbraw/zinc/09/19/64/420091964.db2.gz	UTNXCKNUATZBHW-CYBMUJFWSA-N	1	1	321.377	1.952	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C(N)=O)CC[C@@H]1C	ZINC000430226204	420092689	/nfs/dbraw/zinc/09/26/89/420092689.db2.gz	MSQGDHJVRYWODF-JQWIXIFHSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@H]1OCC[NH2+][C@@H]1C(=O)NCc1ccc([N+](=O)[O-])cc1Cl	ZINC000423857954	420230718	/nfs/dbraw/zinc/23/07/18/420230718.db2.gz	ZLMHKOULHNDWCF-PELKAZGASA-N	1	1	313.741	1.241	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC[N@@H+]1CCO	ZINC000492664094	420622751	/nfs/dbraw/zinc/62/27/51/420622751.db2.gz	SYAJZLSPPHLKHE-SZZPACECSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1CN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000492664094	420622752	/nfs/dbraw/zinc/62/27/52/420622752.db2.gz	SYAJZLSPPHLKHE-SZZPACECSA-N	1	1	319.361	1.133	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H](CO)[C@H]1CCCO1	ZINC000447911292	420817153	/nfs/dbraw/zinc/81/71/53/420817153.db2.gz	ZMWAQJXWMDWBER-WCQYABFASA-N	1	1	300.742	1.878	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H]3C[C@H]2CS3)c1	ZINC000459784536	420872080	/nfs/dbraw/zinc/87/20/80/420872080.db2.gz	ACAXREOGHXPCAM-SCRDCRAPSA-N	1	1	310.375	1.524	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@@H+]2CCCO)c(F)c1	ZINC000449384185	421002005	/nfs/dbraw/zinc/00/20/05/421002005.db2.gz	AGVMMESPKGQIKS-CQSZACIVSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCN2CCCO)c(F)c1	ZINC000449384185	421002010	/nfs/dbraw/zinc/00/20/10/421002010.db2.gz	AGVMMESPKGQIKS-CQSZACIVSA-N	1	1	311.357	1.670	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000487190412	421009044	/nfs/dbraw/zinc/00/90/44/421009044.db2.gz	DBMAVNRFPOBVFS-CYBMUJFWSA-N	1	1	307.354	1.216	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NC[C@@H]3CCC[N@@H+]3CCCO)[nH]c2c1	ZINC000450598817	421215645	/nfs/dbraw/zinc/21/56/45/421215645.db2.gz	RLULARZWAJTRGR-LBPRGKRZSA-N	1	1	319.365	1.152	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000514750069	421451100	/nfs/dbraw/zinc/45/11/00/421451100.db2.gz	KJGBNWAJACZZEB-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000514750069	421451105	/nfs/dbraw/zinc/45/11/05/421451105.db2.gz	KJGBNWAJACZZEB-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000563530337	421518248	/nfs/dbraw/zinc/51/82/48/421518248.db2.gz	OXQFHDRSPGEQCR-SNVBAGLBSA-N	1	1	315.276	1.283	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000531634749	421641540	/nfs/dbraw/zinc/64/15/40/421641540.db2.gz	JOTPWECCMASVLG-NEPJUHHUSA-N	1	1	306.366	1.935	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000572760742	421857068	/nfs/dbraw/zinc/85/70/68/421857068.db2.gz	YIIPZJHKEQOMKG-HNNXBMFYSA-N	1	1	316.361	1.829	20	5		DDBDMO
COc1ccc(CNC(=O)C[N@H+]2CC[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000582130959	422118413	/nfs/dbraw/zinc/11/84/13/422118413.db2.gz	SDBWSRGMIFILSV-NSHDSACASA-N	1	1	307.350	1.561	20	5		DDBDMO
Nc1ccc(N2CCN(c3cccnc3[N+](=O)[O-])CC2)c[nH+]1	ZINC000609505953	422463719	/nfs/dbraw/zinc/46/37/19/422463719.db2.gz	VUOUSDXEOULKLW-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000347479196	272703652	/nfs/dbraw/zinc/70/36/52/272703652.db2.gz	RUFGDDGNJQTUAN-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cc1nc(N2C[C@H]([NH+]3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000286175882	274843283	/nfs/dbraw/zinc/84/32/83/274843283.db2.gz	ADLRXUBZKVNDQH-WCQYABFASA-N	1	1	306.366	1.598	20	5		DDBDMO
CCC[C@@H]1CN(c2ncccc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000271012833	276031532	/nfs/dbraw/zinc/03/15/32/276031532.db2.gz	YBJDBGUUMFVXLC-CYBMUJFWSA-N	1	1	308.382	1.927	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269361861	276173657	/nfs/dbraw/zinc/17/36/57/276173657.db2.gz	JSOQEFDHECGJFL-SNVBAGLBSA-N	1	1	309.370	1.655	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])C(C)C	ZINC000184308251	277006707	/nfs/dbraw/zinc/00/67/07/277006707.db2.gz	KHRXQENNYWJFLK-ZDUSSCGKSA-N	1	1	313.329	1.603	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000357312601	299006101	/nfs/dbraw/zinc/00/61/01/299006101.db2.gz	JNAMULTUGNQHIS-NXEZZACHSA-N	1	1	305.338	1.127	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@@H](O)[C@H]3C2)c([N+](=O)[O-])cc1F	ZINC000362193322	300026077	/nfs/dbraw/zinc/02/60/77/300026077.db2.gz	YOVXSKKYDKNBIL-NURSFMCSSA-N	1	1	310.325	1.945	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000363026609	300200235	/nfs/dbraw/zinc/20/02/35/300200235.db2.gz	JVZMEJZCHFFVGX-DZGCQCFKSA-N	1	1	303.362	1.880	20	5		DDBDMO
Nc1c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-]	ZINC000363123020	300214754	/nfs/dbraw/zinc/21/47/54/300214754.db2.gz	WTDSOBFDQXEXQY-LLVKDONJSA-N	1	1	318.377	1.924	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)cccc1[N+](=O)[O-]	ZINC000363123021	300214950	/nfs/dbraw/zinc/21/49/50/300214950.db2.gz	WTDSOBFDQXEXQY-NSHDSACASA-N	1	1	318.377	1.924	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000364082714	300342197	/nfs/dbraw/zinc/34/21/97/300342197.db2.gz	JVISESNRMSOMRT-STQMWFEESA-N	1	1	318.377	1.750	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000368953013	301109332	/nfs/dbraw/zinc/10/93/32/301109332.db2.gz	ZGWFQIKJCFYHNR-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019115	301120260	/nfs/dbraw/zinc/12/02/60/301120260.db2.gz	OATBYQUDBBHFCH-ZYHUDNBSSA-N	1	1	307.354	1.095	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019115	301120263	/nfs/dbraw/zinc/12/02/63/301120263.db2.gz	OATBYQUDBBHFCH-ZYHUDNBSSA-N	1	1	307.354	1.095	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000369800027	301226531	/nfs/dbraw/zinc/22/65/31/301226531.db2.gz	QULYFLJBAYXYFX-CABCVRRESA-N	1	1	324.381	1.451	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@]2(CCCOC2)O1	ZINC000369800027	301226535	/nfs/dbraw/zinc/22/65/35/301226535.db2.gz	QULYFLJBAYXYFX-CABCVRRESA-N	1	1	324.381	1.451	20	5		DDBDMO
C[NH+](C)C1(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000397868044	302356438	/nfs/dbraw/zinc/35/64/38/302356438.db2.gz	IGLBJCKFRUZEOF-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000366633685	307078049	/nfs/dbraw/zinc/07/80/49/307078049.db2.gz	CKYCFGSEKRTCIW-JSGCOSHPSA-N	1	1	319.409	1.777	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN2CC[NH+]([C@@H]3CCOC3)CC2)c1	ZINC000367413795	307092637	/nfs/dbraw/zinc/09/26/37/307092637.db2.gz	WHPMIYMUABUIBG-HZPDHXFCSA-N	1	1	321.377	1.035	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000374348353	307206041	/nfs/dbraw/zinc/20/60/41/307206041.db2.gz	FWSFARXYUICYCD-LLVKDONJSA-N	1	1	315.333	1.421	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)n1	ZINC000427252856	307302950	/nfs/dbraw/zinc/30/29/50/307302950.db2.gz	ZBACYSYQQBXXMY-RYUDHWBXSA-N	1	1	323.397	1.804	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C\c1cccc([N+](=O)[O-])c1	ZINC000209701064	484137433	/nfs/dbraw/zinc/13/74/33/484137433.db2.gz	WALZMXZAHUKVBS-SREVYHEPSA-N	1	1	307.350	1.302	20	5		DDBDMO
C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CC1(C)C	ZINC000489475501	484223975	/nfs/dbraw/zinc/22/39/75/484223975.db2.gz	GYHGTQNGURTGMZ-ZDUSSCGKSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@H]1CC1(C)C	ZINC000489475501	484223981	/nfs/dbraw/zinc/22/39/81/484223981.db2.gz	GYHGTQNGURTGMZ-ZDUSSCGKSA-N	1	1	321.333	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000454924946	527812685	/nfs/dbraw/zinc/81/26/85/527812685.db2.gz	LFYJYRSMSLIPJO-SNVBAGLBSA-N	1	1	307.354	1.103	20	5		DDBDMO
CCC[N@H+]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1	ZINC000301966307	528218668	/nfs/dbraw/zinc/21/86/68/528218668.db2.gz	KPDMGWJDTWHSGS-UHFFFAOYSA-N	1	1	304.354	1.560	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000451730760	529290097	/nfs/dbraw/zinc/29/00/97/529290097.db2.gz	PSYBRLHSJWFPSG-AWEZNQCLSA-N	1	1	320.393	1.610	20	5		DDBDMO
CC[C@H](C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)OC	ZINC000419227150	529335714	/nfs/dbraw/zinc/33/57/14/529335714.db2.gz	SGRXIPNRNUGWDR-OAHLLOKOSA-N	1	1	321.377	1.778	20	5		DDBDMO
CCCC[N@@H+](C)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000821062155	606709254	/nfs/dbraw/zinc/70/92/54/606709254.db2.gz	UTOVXTKOPJLXHZ-UHFFFAOYSA-N	1	1	320.357	1.314	20	5		DDBDMO
Cc1cc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cs1	ZINC000983652412	697286532	/nfs/dbraw/zinc/28/65/32/697286532.db2.gz	CFNRGWDYKHEFNF-FMKGYKFTSA-N	1	1	323.418	1.706	20	5		DDBDMO
C[C@@H]1COCCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000772826073	697683030	/nfs/dbraw/zinc/68/30/30/697683030.db2.gz	RSFAERWGQRQWGE-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1COCCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000772826073	697683027	/nfs/dbraw/zinc/68/30/27/697683027.db2.gz	RSFAERWGQRQWGE-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1nn(C[N@H+]2CCCOC[C@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000772828104	697683048	/nfs/dbraw/zinc/68/30/48/697683048.db2.gz	XLRSMOJXPFEVCX-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCCOC[C@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000772828104	697683049	/nfs/dbraw/zinc/68/30/49/697683049.db2.gz	XLRSMOJXPFEVCX-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
CC(C)C1(O)C[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000773891037	697819168	/nfs/dbraw/zinc/81/91/68/697819168.db2.gz	MMVYPLXQJUJOAA-UHFFFAOYSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776581557	698121122	/nfs/dbraw/zinc/12/11/22/698121122.db2.gz	JZJBJXXZAGHWJI-GXTWGEPZSA-N	1	1	308.334	1.513	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776582448	698121515	/nfs/dbraw/zinc/12/15/15/698121515.db2.gz	QOYVJOBTSZLIDS-TZMCWYRMSA-N	1	1	307.350	1.086	20	5		DDBDMO
COC(=O)CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000776583149	698121667	/nfs/dbraw/zinc/12/16/67/698121667.db2.gz	XYCMXGUKXMHAOC-CQSZACIVSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776583088	698121719	/nfs/dbraw/zinc/12/17/19/698121719.db2.gz	ZLXFRRANJPGGTM-OSMZGAPFSA-N	1	1	307.350	1.214	20	5		DDBDMO
Cc1[nH+]ccn1CCCCOC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000778779468	698367064	/nfs/dbraw/zinc/36/70/64/698367064.db2.gz	WNKHIARNPHPWFS-UHFFFAOYSA-N	1	1	307.310	1.320	20	5		DDBDMO
C[C@@H]1[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCS1(=O)=O	ZINC000313428809	698683006	/nfs/dbraw/zinc/68/30/06/698683006.db2.gz	YORHQEGEYFURTC-LDYMZIIASA-N	1	1	318.782	1.913	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)(C)CO	ZINC000782494150	698730577	/nfs/dbraw/zinc/73/05/77/698730577.db2.gz	BUEQTZVGBBYNGN-UHFFFAOYSA-N	1	1	313.329	1.765	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)O[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000788114519	699280009	/nfs/dbraw/zinc/28/00/09/699280009.db2.gz	FCOOEUVZPJXXTJ-WCQYABFASA-N	1	1	308.338	1.351	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C2OCCO2)C1	ZINC000718986438	699296743	/nfs/dbraw/zinc/29/67/43/699296743.db2.gz	DPZVHBFHZLAXJP-LLVKDONJSA-N	1	1	308.334	1.798	20	5		DDBDMO
O=c1c(Br)cn(CC[NH+]2CCCC2)cc1[N+](=O)[O-]	ZINC000789930425	699423000	/nfs/dbraw/zinc/42/30/00/699423000.db2.gz	TVCUSUWEKJEIIG-UHFFFAOYSA-N	1	1	316.155	1.615	20	5		DDBDMO
C[C@@H]1C[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1	ZINC000738160283	699754409	/nfs/dbraw/zinc/75/44/09/699754409.db2.gz	HVFGNZWCUCCIQJ-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1	ZINC000738160283	699754410	/nfs/dbraw/zinc/75/44/10/699754410.db2.gz	HVFGNZWCUCCIQJ-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801939525	700358490	/nfs/dbraw/zinc/35/84/90/700358490.db2.gz	FNPHLGVIWLEHOA-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801939525	700358495	/nfs/dbraw/zinc/35/84/95/700358495.db2.gz	FNPHLGVIWLEHOA-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@H+]2Cn1nccc1[N+](=O)[O-]	ZINC000802748264	700424365	/nfs/dbraw/zinc/42/43/65/700424365.db2.gz	LFVLEMDXLJZNBK-YHWZYXNKSA-N	1	1	316.365	1.893	20	5		DDBDMO
Cn1nccc1C1C[C@H]2CC[C@@H](C1)[N@@H+]2Cn1nccc1[N+](=O)[O-]	ZINC000802748264	700424367	/nfs/dbraw/zinc/42/43/67/700424367.db2.gz	LFVLEMDXLJZNBK-YHWZYXNKSA-N	1	1	316.365	1.893	20	5		DDBDMO
C[C@@H](C(=O)OCCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000763400824	700936927	/nfs/dbraw/zinc/93/69/27/700936927.db2.gz	BBKVUNWNULRBAW-CYBMUJFWSA-N	1	1	322.361	1.964	20	5		DDBDMO
O=C(NCCN1CCc2c(Cl)cccc2C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839733145	701802119	/nfs/dbraw/zinc/80/21/19/701802119.db2.gz	IBKHOKQMANBUKC-TZMCWYRMSA-N	1	1	323.780	1.480	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000867982197	701871961	/nfs/dbraw/zinc/87/19/61/701871961.db2.gz	LXRYOIAYZOPOAF-PEYYIBSZSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[N@H+](CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC000840013921	701912335	/nfs/dbraw/zinc/91/23/35/701912335.db2.gz	VXPJRCVZIAXQED-HNNXBMFYSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[N@@H+](CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC000840013921	701912338	/nfs/dbraw/zinc/91/23/38/701912338.db2.gz	VXPJRCVZIAXQED-HNNXBMFYSA-N	1	1	305.334	1.974	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2CC[N@@H+](C)C[C@@H]2C1	ZINC000812324833	702150548	/nfs/dbraw/zinc/15/05/48/702150548.db2.gz	ZAOHAIZVYYXMNG-NWDGAFQWSA-N	1	1	319.361	1.627	20	5		DDBDMO
CN(C(=O)CCC(C)(C)[N+](=O)[O-])C(C)(C)C[NH+]1CCOCC1	ZINC000840567648	702157285	/nfs/dbraw/zinc/15/72/85/702157285.db2.gz	AMAVKIGBNSUFSH-UHFFFAOYSA-N	1	1	315.414	1.391	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(NC[C@H]3CCC[NH2+]3)CC2)cc1	ZINC000841036690	702318559	/nfs/dbraw/zinc/31/85/59/702318559.db2.gz	VUCUTBYAUQKUDG-CQSZACIVSA-N	1	1	304.394	1.905	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000841857395	702590164	/nfs/dbraw/zinc/59/01/64/702590164.db2.gz	XQJHTJJEFONGMK-UHFFFAOYSA-N	1	1	322.699	1.641	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[N@@H+](C)CCN1C	ZINC000843797212	702925764	/nfs/dbraw/zinc/92/57/64/702925764.db2.gz	YDSLDZJGIKWOPH-NSHDSACASA-N	1	1	324.356	1.018	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@H]1C[N@H+](C)CCN1C	ZINC000843797212	702925766	/nfs/dbraw/zinc/92/57/66/702925766.db2.gz	YDSLDZJGIKWOPH-NSHDSACASA-N	1	1	324.356	1.018	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1C[C@H]2CC[N@H+](C)[C@H]2C1	ZINC000843900829	702939717	/nfs/dbraw/zinc/93/97/17/702939717.db2.gz	KEJLJOZDLDBFCU-MFKMUULPSA-N	1	1	307.325	1.818	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3CSC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000879561541	706718114	/nfs/dbraw/zinc/71/81/14/706718114.db2.gz	QFXBGHGIWHEHGK-OLZOCXBDSA-N	1	1	321.402	1.879	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@H](O)c3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000879577503	706724988	/nfs/dbraw/zinc/72/49/88/706724988.db2.gz	JRKSOZRIZFNERO-BMFZPTHFSA-N	1	1	305.378	1.654	20	5		DDBDMO
CCN1C[C@@H](C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])OC1=O	ZINC000846901843	703349314	/nfs/dbraw/zinc/34/93/14/703349314.db2.gz	QGCQXFQUDUPCOX-CYBMUJFWSA-N	1	1	307.350	1.910	20	5		DDBDMO
COc1ccnc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1F	ZINC000849330824	703635945	/nfs/dbraw/zinc/63/59/45/703635945.db2.gz	CYHISLNEFLMYCC-CYBMUJFWSA-N	1	1	321.308	1.961	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CCOC(F)F)C2)nc1	ZINC000851843643	703868737	/nfs/dbraw/zinc/86/87/37/703868737.db2.gz	JYYLMWVDCQTHCH-VIFPVBQESA-N	1	1	302.281	1.715	20	5		DDBDMO
COC(CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)OC	ZINC000851843887	703868815	/nfs/dbraw/zinc/86/88/15/703868815.db2.gz	NYBWTXAJJLYTEE-NSHDSACASA-N	1	1	310.354	1.485	20	5		DDBDMO
O=C1NC2(CO1)CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2	ZINC000851924356	703884019	/nfs/dbraw/zinc/88/40/19/703884019.db2.gz	ZGGKDPBOXYNINY-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
CN(C[C@@H]1CCCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870922634	704170024	/nfs/dbraw/zinc/17/00/24/704170024.db2.gz	KQJWVWKAPSWVJP-BLLLJJGKSA-N	1	1	321.377	1.654	20	5		DDBDMO
CO[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC[C@@H]1C	ZINC000870927746	704171592	/nfs/dbraw/zinc/17/15/92/704171592.db2.gz	FHAFOIOVYGIODF-PEYYIBSZSA-N	1	1	321.377	1.652	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823994001	705350907	/nfs/dbraw/zinc/35/09/07/705350907.db2.gz	MXFJQKBJVQPSCA-LLVKDONJSA-N	1	1	321.381	1.983	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC[C@@H]21	ZINC000827310045	705973381	/nfs/dbraw/zinc/97/33/81/705973381.db2.gz	JJKDZNCTCYJWRH-ZFWWWQNUSA-N	1	1	303.362	1.690	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2C)C1	ZINC000827358352	705984929	/nfs/dbraw/zinc/98/49/29/705984929.db2.gz	XRYPVLAMQDANTA-BXUZGUMPSA-N	1	1	304.350	1.464	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC000827626233	706039733	/nfs/dbraw/zinc/03/97/33/706039733.db2.gz	UISVVSHFWCWQEE-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
CCOC(=O)[C@H](C)C1C[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000871993181	707272245	/nfs/dbraw/zinc/27/22/45/707272245.db2.gz	MHTJCIKNHLKMQT-ABAIWWIYSA-N	1	1	322.361	1.759	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000830110207	706456526	/nfs/dbraw/zinc/45/65/26/706456526.db2.gz	BQSDJGYEUARYBU-QPKOPYBWSA-N	1	1	303.362	1.907	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@H]1C	ZINC000866948392	706853234	/nfs/dbraw/zinc/85/32/34/706853234.db2.gz	HYMJYRDYVMHIAX-LLVKDONJSA-N	1	1	309.341	1.829	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@@H]2CCOC[C@@H]2OC)cc1[N+](=O)[O-]	ZINC000880425584	706970378	/nfs/dbraw/zinc/97/03/78/706970378.db2.gz	GHAWSLYHBHVUPG-DOMZBBRYSA-N	1	1	310.350	1.839	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CC=C[C@H]2CO)cccc1[N+](=O)[O-]	ZINC000880490159	706992750	/nfs/dbraw/zinc/99/27/50/706992750.db2.gz	MLQWBORTPHWEPB-LBPRGKRZSA-N	1	1	305.334	1.465	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000872779583	707597052	/nfs/dbraw/zinc/59/70/52/707597052.db2.gz	GTERTWXKJNRIIW-KBPBESRZSA-N	1	1	306.366	1.342	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000882487855	707659657	/nfs/dbraw/zinc/65/96/57/707659657.db2.gz	KCAMDNMJUWQMDR-LBPRGKRZSA-N	1	1	306.366	1.241	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000882636704	707726643	/nfs/dbraw/zinc/72/66/43/707726643.db2.gz	WCUYRQSATSUNSL-LLVKDONJSA-N	1	1	310.329	1.164	20	5		DDBDMO
Cc1ccnc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222609	708259929	/nfs/dbraw/zinc/25/99/29/708259929.db2.gz	WEXNUHHKLXNZFT-QWHCGFSZSA-N	1	1	306.366	1.334	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000912603695	713044134	/nfs/dbraw/zinc/04/41/34/713044134.db2.gz	LSOQTMQFURTIHX-UHFFFAOYSA-N	1	1	323.393	1.255	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000886021129	708682750	/nfs/dbraw/zinc/68/27/50/708682750.db2.gz	PJVCUCHRJZEGKR-ZDUSSCGKSA-N	1	1	306.366	1.144	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000886021129	708682753	/nfs/dbraw/zinc/68/27/53/708682753.db2.gz	PJVCUCHRJZEGKR-ZDUSSCGKSA-N	1	1	306.366	1.144	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCn3nncc3C2)cc1	ZINC000886463236	708764218	/nfs/dbraw/zinc/76/42/18/708764218.db2.gz	UKDPIHMRHWMSMO-CQSZACIVSA-N	1	1	303.322	1.126	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCn3nncc3C2)cc1	ZINC000886463236	708764220	/nfs/dbraw/zinc/76/42/20/708764220.db2.gz	UKDPIHMRHWMSMO-CQSZACIVSA-N	1	1	303.322	1.126	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887926289	709166447	/nfs/dbraw/zinc/16/64/47/709166447.db2.gz	CUDQBEHXHCSBRQ-ZUZCIYMTSA-N	1	1	319.365	1.055	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000889778943	709630673	/nfs/dbraw/zinc/63/06/73/709630673.db2.gz	CEBSESVAAWCXKD-GJZGRUSLSA-N	1	1	319.361	1.266	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCC3)C2)c1[N+](=O)[O-]	ZINC000912916749	713123042	/nfs/dbraw/zinc/12/30/42/713123042.db2.gz	RLZFVEFAVHALHZ-JTQLQIEISA-N	1	1	307.354	1.191	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103563	713131607	/nfs/dbraw/zinc/13/16/07/713131607.db2.gz	RGHPDJVSVAXOQP-ZIAGYGMSSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103563	713131609	/nfs/dbraw/zinc/13/16/09/713131609.db2.gz	RGHPDJVSVAXOQP-ZIAGYGMSSA-N	1	1	321.402	1.904	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@]3(C)C[NH+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000913289234	713192420	/nfs/dbraw/zinc/19/24/20/713192420.db2.gz	KJYHKQKYNAOAOR-ZIAGYGMSSA-N	1	1	307.354	1.040	20	5		DDBDMO
CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H]1CC[N@H+]1C	ZINC000928560790	713227345	/nfs/dbraw/zinc/22/73/45/713227345.db2.gz	VLOUWVGMLIPRFL-UKRRQHHQSA-N	1	1	305.378	1.984	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@@H]1CC[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317502	711096028	/nfs/dbraw/zinc/09/60/28/711096028.db2.gz	LRRAXEWTSGNXDW-LSDHHAIUSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@@H]1CC[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000903317502	711096032	/nfs/dbraw/zinc/09/60/32/711096032.db2.gz	LRRAXEWTSGNXDW-LSDHHAIUSA-N	1	1	315.377	1.711	20	5		DDBDMO
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1C[N@@H+](C)CCN1C	ZINC000895248478	711465236	/nfs/dbraw/zinc/46/52/36/711465236.db2.gz	LYUYYPNWFLNRFB-JOYOIKCWSA-N	1	1	313.789	1.689	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1cc(CN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000895771331	711602134	/nfs/dbraw/zinc/60/21/34/711602134.db2.gz	YHOLMYRLUUFVMP-CQSZACIVSA-N	1	1	320.393	1.543	20	5		DDBDMO
C[N@H+]1CCC[C@H]1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O	ZINC000917357464	713494700	/nfs/dbraw/zinc/49/47/00/713494700.db2.gz	UNAVSQRCYGLLOI-LBPRGKRZSA-N	1	1	304.306	1.506	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)C1(O)CCC1)C1CC1	ZINC000930061227	713746854	/nfs/dbraw/zinc/74/68/54/713746854.db2.gz	PGYQSKNINMUWHG-HNNXBMFYSA-N	1	1	306.362	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+](C[C@H](O)C1(O)CCC1)C1CC1	ZINC000930061227	713746855	/nfs/dbraw/zinc/74/68/55/713746855.db2.gz	PGYQSKNINMUWHG-HNNXBMFYSA-N	1	1	306.362	1.835	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1C[C@H]2COC[C@H]2O1	ZINC000930441074	713836020	/nfs/dbraw/zinc/83/60/20/713836020.db2.gz	QXWKVHMGTLHOKI-OFQRWUPVSA-N	1	1	306.362	1.873	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@]2(CCN(CC[N+](=O)[O-])C2)O1	ZINC000931704876	714165668	/nfs/dbraw/zinc/16/56/68/714165668.db2.gz	RZYPANHCMONAFE-RDJZCZTQSA-N	1	1	319.405	1.629	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@@H]1[NH2+]Cc1cc(F)ccc1[N+](=O)[O-]	ZINC000933040815	714506192	/nfs/dbraw/zinc/50/61/92/714506192.db2.gz	LLIQHOWCSZUEEN-CYBMUJFWSA-N	1	1	323.324	1.119	20	5		DDBDMO
COc1ccc(C[N@H+]2C[C@@H]3CCC[C@]3(C(N)=O)C2)cc1[N+](=O)[O-]	ZINC000933760589	714666290	/nfs/dbraw/zinc/66/62/90/714666290.db2.gz	VMAGLGXEBCTPKY-LRDDRELGSA-N	1	1	319.361	1.691	20	5		DDBDMO
Cc1cccc(C)c1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000933765891	714667654	/nfs/dbraw/zinc/66/76/54/714667654.db2.gz	BWDCRHQBAVHXQV-HNNXBMFYSA-N	1	1	318.377	1.901	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120311	714747118	/nfs/dbraw/zinc/74/71/18/714747118.db2.gz	SXFWWODOEKMBNS-ZIAGYGMSSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120311	714747120	/nfs/dbraw/zinc/74/71/20/714747120.db2.gz	SXFWWODOEKMBNS-ZIAGYGMSSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121650	714747873	/nfs/dbraw/zinc/74/78/73/714747873.db2.gz	NZZFCBHPBKAFSJ-KBPBESRZSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121650	714747876	/nfs/dbraw/zinc/74/78/76/714747876.db2.gz	NZZFCBHPBKAFSJ-KBPBESRZSA-N	1	1	307.350	1.951	20	5		DDBDMO
Cc1ccc(CN2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)cc1[N+](=O)[O-]	ZINC000934271498	714782391	/nfs/dbraw/zinc/78/23/91/714782391.db2.gz	HFENQDOAEIMLST-HOTGVXAUSA-N	1	1	319.405	1.934	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1	ZINC001121008533	782293338	/nfs/dbraw/zinc/29/33/38/782293338.db2.gz	FMVLKIVBSXDQOJ-MVWJERBFSA-N	1	1	320.349	1.529	20	5		DDBDMO
CCCC[N@@H+](C)CC1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1	ZINC001121299908	782448417	/nfs/dbraw/zinc/44/84/17/782448417.db2.gz	QZKGHHHDFPORGL-UHFFFAOYSA-N	1	1	324.429	1.540	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@@H](C)C(=O)N2CCCC2)c1[N+](=O)[O-]	ZINC001181244368	743108897	/nfs/dbraw/zinc/10/88/97/743108897.db2.gz	QKVAJAALUPIXRN-JTQLQIEISA-N	1	1	323.349	1.410	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC001181838908	743361255	/nfs/dbraw/zinc/36/12/55/743361255.db2.gz	IDGHKMDVQAPZES-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]([C@H](C)O)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC001194723992	746449889	/nfs/dbraw/zinc/44/98/89/746449889.db2.gz	PKXDHVRPLYZCIT-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
CCc1ccccc1C[NH+]1CC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001031661524	747337734	/nfs/dbraw/zinc/33/77/34/747337734.db2.gz	AGVCXQSRPYOZCF-HZPDHXFCSA-N	1	1	317.389	1.462	20	5		DDBDMO
O=C(NCC1=CCN(Cc2ccns2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001000674518	762078873	/nfs/dbraw/zinc/07/88/73/762078873.db2.gz	PMYBKNCQHWKTFB-CHWSQXEVSA-N	1	1	322.390	1.057	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCCF)C2)CC1	ZINC001035186921	751287866	/nfs/dbraw/zinc/28/78/66/751287866.db2.gz	LLSONHSYENPOCY-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CCCF)C2)CC1	ZINC001035186921	751287869	/nfs/dbraw/zinc/28/78/69/751287869.db2.gz	LLSONHSYENPOCY-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCCF)C2)CC1	ZINC001035186921	751287872	/nfs/dbraw/zinc/28/78/72/751287872.db2.gz	LLSONHSYENPOCY-CHWSQXEVSA-N	1	1	313.373	1.326	20	5		DDBDMO
CCn1nnc2c1CC[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]2COC	ZINC001169022282	762200900	/nfs/dbraw/zinc/20/09/00/762200900.db2.gz	RQTAVOGLFBBUGT-BZPMIXESSA-N	1	1	323.397	1.289	20	5		DDBDMO
CCn1nnc2c1CC[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)[C@H]2COC	ZINC001169022282	762200903	/nfs/dbraw/zinc/20/09/03/762200903.db2.gz	RQTAVOGLFBBUGT-BZPMIXESSA-N	1	1	323.397	1.289	20	5		DDBDMO
CC(=O)N1CCC2(C1)CC[NH+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC001040560227	762595024	/nfs/dbraw/zinc/59/50/24/762595024.db2.gz	IPFDITTWXDKFAE-UHFFFAOYSA-N	1	1	321.381	1.163	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CC1CC1)CC2	ZINC001040701306	762653720	/nfs/dbraw/zinc/65/37/20/762653720.db2.gz	YFVYRAJVBKCFEP-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2cccc(Cl)c2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139137	760612961	/nfs/dbraw/zinc/61/29/61/760612961.db2.gz	SDKHKEOOCHFBPS-AAVRWANBSA-N	1	1	323.780	1.742	20	5		DDBDMO
CSc1nc(Cl)nc(N[C@@H](N)CCC[NH3+])c1[N+](=O)[O-]	ZINC001159784945	771926272	/nfs/dbraw/zinc/92/62/72/771926272.db2.gz	MWIDWOMWEDEIHC-RXMQYKEDSA-N	1	1	306.779	1.196	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001093952615	775259828	/nfs/dbraw/zinc/25/98/28/775259828.db2.gz	IGYQKLWWCABVGU-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
O=C1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCN1	ZINC001172908780	776917905	/nfs/dbraw/zinc/91/79/05/776917905.db2.gz	ODVSUGWTODDAJM-AWEZNQCLSA-N	1	1	303.362	1.664	20	5		DDBDMO
C[C@H]1C(=O)NCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908137	776918095	/nfs/dbraw/zinc/91/80/95/776918095.db2.gz	BCKJZTCGPQFMBT-SMDDNHRTSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@H]1C(=O)NCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172908137	776918098	/nfs/dbraw/zinc/91/80/98/776918098.db2.gz	BCKJZTCGPQFMBT-SMDDNHRTSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](N2CCOCC2)C1	ZINC001173227587	777062488	/nfs/dbraw/zinc/06/24/88/777062488.db2.gz	RCKIUXRDKGIMCO-RHSMWYFYSA-N	1	1	319.405	1.932	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC001119948627	781693412	/nfs/dbraw/zinc/69/34/12/781693412.db2.gz	QELVHAFMNDOANR-YPMHNXCESA-N	1	1	305.382	1.781	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])c(OC(F)F)c1	ZINC001120058673	781742119	/nfs/dbraw/zinc/74/21/19/781742119.db2.gz	XVHSSIHSYLJBGU-UHFFFAOYSA-N	1	1	319.308	1.557	20	5		DDBDMO
CCN(CC[NH2+]Cc1ccc(OC)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268450221	840211676	/nfs/dbraw/zinc/21/16/76/840211676.db2.gz	STNMRCKRNDWVQY-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
CCOCCC[NH2+]C1(C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001274333454	852166870	/nfs/dbraw/zinc/16/68/70/852166870.db2.gz	UBJRULSEOSCROA-CHWSQXEVSA-N	1	1	313.398	1.049	20	5		DDBDMO
Cc1cc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)c(C)o1	ZINC001123397135	859213392	/nfs/dbraw/zinc/21/33/92/859213392.db2.gz	NZDWTOWFXJVLLI-UHFFFAOYSA-N	1	1	321.337	1.058	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CO[C@H](C[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC001224829519	881549557	/nfs/dbraw/zinc/54/95/57/881549557.db2.gz	JXUROGUQHXMQFO-SWLSCSKDSA-N	1	1	308.334	1.844	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1	ZINC001141313640	860825003	/nfs/dbraw/zinc/82/50/03/860825003.db2.gz	HKBSOLALDJVALY-GLPPDTDBSA-N	1	1	319.336	1.863	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2C[C@@H](F)C[C@H]2C1	ZINC001141313640	860825009	/nfs/dbraw/zinc/82/50/09/860825009.db2.gz	HKBSOLALDJVALY-GLPPDTDBSA-N	1	1	319.336	1.863	20	5		DDBDMO
Cc1nc(Cl)c([N+](=O)[O-])c(N2C[C@H]3[C@H](C2)CCC[N@@H+]3C)n1	ZINC001157260242	863688035	/nfs/dbraw/zinc/68/80/35/863688035.db2.gz	INIQPVVXJDNMCV-UWVGGRQHSA-N	1	1	311.773	1.877	20	5		DDBDMO
O=C(NCCC[NH2+]CC1CCC2(CC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775283	864131184	/nfs/dbraw/zinc/13/11/84/864131184.db2.gz	NMRRKXURQOQWOD-ZIAGYGMSSA-N	1	1	309.410	1.718	20	5		DDBDMO
C[N@H+]1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1(C)C	ZINC001331492355	865115513	/nfs/dbraw/zinc/11/55/13/865115513.db2.gz	IUCQGNOKWGVGBP-UHFFFAOYSA-N	1	1	303.366	1.928	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC001159884672	865580720	/nfs/dbraw/zinc/58/07/20/865580720.db2.gz	JVHDOLJHPXIQHN-LOWVWBTDSA-N	1	1	304.350	1.247	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H]1CCC[N@H+]2C	ZINC001332401692	865814924	/nfs/dbraw/zinc/81/49/24/865814924.db2.gz	KHYRDRSRDPNIIW-LSDHHAIUSA-N	1	1	318.377	1.945	20	5		DDBDMO
COCC(=O)NCC1=CC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001333269662	866577195	/nfs/dbraw/zinc/57/71/95/866577195.db2.gz	XIXZQXUSPCJTSA-UHFFFAOYSA-N	1	1	319.361	1.490	20	5		DDBDMO
COCC(=O)NCC1=CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001333269662	866577210	/nfs/dbraw/zinc/57/72/10/866577210.db2.gz	XIXZQXUSPCJTSA-UHFFFAOYSA-N	1	1	319.361	1.490	20	5		DDBDMO
CC[N@H+]1CCCN(c2nc(NC(C)=O)nc(C)c2[N+](=O)[O-])CC1	ZINC001163773675	868693635	/nfs/dbraw/zinc/69/36/35/868693635.db2.gz	WXXBBORFVDWYTK-UHFFFAOYSA-N	1	1	322.369	1.184	20	5		DDBDMO
C[C@@H](CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-])[NH+](C)C	ZINC001336754489	869125414	/nfs/dbraw/zinc/12/54/14/869125414.db2.gz	LRQAONLEWKGULJ-QWHCGFSZSA-N	1	1	311.382	1.264	20	5		DDBDMO
Cc1[nH+]cc2n1CCN(c1nc(C)nc(Cl)c1[N+](=O)[O-])C2	ZINC001165384610	869556108	/nfs/dbraw/zinc/55/61/08/869556108.db2.gz	KNISEQOYYLVHJT-UHFFFAOYSA-N	1	1	308.729	1.872	20	5		DDBDMO
Cc1[nH+]cc2n1CCN(c1c(Cl)[n+]([O-])ccc1[N+](=O)[O-])C2	ZINC001165385960	869559172	/nfs/dbraw/zinc/55/91/72/869559172.db2.gz	UUJOSCJZRUAEBN-UHFFFAOYSA-N	1	1	309.713	1.407	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1	ZINC001337678390	869591969	/nfs/dbraw/zinc/59/19/69/869591969.db2.gz	HTXRCCITBIOMGR-NHYWBVRUSA-N	1	1	308.382	1.650	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1cc(N)c([N+](=O)[O-])cn1)CC2	ZINC001166032323	869808460	/nfs/dbraw/zinc/80/84/60/869808460.db2.gz	FLGVYGMFEUTYCP-UHFFFAOYSA-N	1	1	320.353	1.206	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)c1	ZINC001226443543	882434647	/nfs/dbraw/zinc/43/46/47/882434647.db2.gz	XWBRNLVRLWEXJB-CUOATXAZSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c1	ZINC001226443543	882434655	/nfs/dbraw/zinc/43/46/55/882434655.db2.gz	XWBRNLVRLWEXJB-CUOATXAZSA-N	1	1	306.318	1.786	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC001339923681	870787566	/nfs/dbraw/zinc/78/75/66/870787566.db2.gz	WHIIBYKAXPFHKS-AWEZNQCLSA-N	1	1	306.366	1.878	20	5		DDBDMO
CCC(C)(C)C(=O)NCC1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001277157578	882672131	/nfs/dbraw/zinc/67/21/31/882672131.db2.gz	DZYUWKYZICQRJF-UHFFFAOYSA-N	1	1	323.397	1.503	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ncc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC001227109369	882839675	/nfs/dbraw/zinc/83/96/75/882839675.db2.gz	XZLKVQHOLCZVLD-JZYVYDRUSA-N	1	1	308.294	1.902	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+]1C1CCCC1	ZINC001350603641	875781319	/nfs/dbraw/zinc/78/13/19/875781319.db2.gz	WIPJIKGJGNQGND-JTQLQIEISA-N	1	1	307.354	1.407	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC001350914987	875955733	/nfs/dbraw/zinc/95/57/33/875955733.db2.gz	GAVKBMRVNSFFIJ-WFBYXXMGSA-N	1	1	307.325	1.804	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC[N@H+]1C1CCCC1	ZINC001352968657	877045706	/nfs/dbraw/zinc/04/57/06/877045706.db2.gz	HFRPTWUTKJDQIE-GFCCVEGCSA-N	1	1	321.381	1.267	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)C1	ZINC001355414030	878545032	/nfs/dbraw/zinc/54/50/32/878545032.db2.gz	ASNDSVMJQKZSSC-NEPJUHHUSA-N	1	1	310.402	1.321	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1COC[C@H]1C[N@H+](C)CCO1	ZINC001223449041	880966632	/nfs/dbraw/zinc/96/66/32/880966632.db2.gz	VNCYULBNXBBCDJ-CYBMUJFWSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1COC[C@H]1C[N@@H+](C)CCO1	ZINC001223449041	880966644	/nfs/dbraw/zinc/96/66/44/880966644.db2.gz	VNCYULBNXBBCDJ-CYBMUJFWSA-N	1	1	324.333	1.229	20	5		DDBDMO
COc1ccc(CO[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c([N+](=O)[O-])c1	ZINC001223513748	880988353	/nfs/dbraw/zinc/98/83/53/880988353.db2.gz	HBGHPJSKMYYGID-XZJROXQQSA-N	1	1	320.345	1.924	20	5		DDBDMO
C[N@@H+]1CCO[C@H](COCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001224095712	881212667	/nfs/dbraw/zinc/21/26/67/881212667.db2.gz	CTEQSUSHZZGJFH-LBPRGKRZSA-N	1	1	311.294	1.350	20	5		DDBDMO
C[N@H+]1CCO[C@H](COCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001224095712	881212682	/nfs/dbraw/zinc/21/26/82/881212682.db2.gz	CTEQSUSHZZGJFH-LBPRGKRZSA-N	1	1	311.294	1.350	20	5		DDBDMO
OC[C@@H]1CC[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@H]1O	ZINC001232219309	886166469	/nfs/dbraw/zinc/16/64/69/886166469.db2.gz	SOTSTVUVIYSOPA-DOTOQJQBSA-N	1	1	323.396	1.958	20	5		DDBDMO
COCCCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001234398730	887934761	/nfs/dbraw/zinc/93/47/61/887934761.db2.gz	UZPFOQCQVXHROG-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
O=C1C[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCN1	ZINC001254473897	896456943	/nfs/dbraw/zinc/45/69/43/896456943.db2.gz	JJDGIHRIFZYEPA-UHFFFAOYSA-N	1	1	318.377	1.386	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001254559556	896503003	/nfs/dbraw/zinc/50/30/03/896503003.db2.gz	KXDIZPGAHXQMRD-WCQYABFASA-N	1	1	305.334	1.662	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCN2C(=O)OC[C@H]2C1	ZINC001254559556	896503014	/nfs/dbraw/zinc/50/30/14/896503014.db2.gz	KXDIZPGAHXQMRD-WCQYABFASA-N	1	1	305.334	1.662	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612472	896532710	/nfs/dbraw/zinc/53/27/10/896532710.db2.gz	WTGHAYFTYDWFBV-GDBMZVCRSA-N	1	1	304.346	1.947	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)c1	ZINC001262826143	900388121	/nfs/dbraw/zinc/38/81/21/900388121.db2.gz	CTNNKWSMTICKHI-MRVWCRGKSA-N	1	1	303.362	1.973	20	5		DDBDMO
Cc1cc(NC(=O)C2C[NH+]([C@@H]3CCOC3)C2)cc([N+](=O)[O-])c1	ZINC001264010883	900871515	/nfs/dbraw/zinc/87/15/15/900871515.db2.gz	NTGOPCKNHJMBAM-CYBMUJFWSA-N	1	1	305.334	1.562	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C)[C@H]2CO)cccc1[N+](=O)[O-]	ZINC000248880791	282114665	/nfs/dbraw/zinc/11/46/65/282114665.db2.gz	DCRGXLTXMQCLSY-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@]12C[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C[C@@H]1[C@@H]1C=C[C@H]2C1	ZINC000451378585	231081870	/nfs/dbraw/zinc/08/18/70/231081870.db2.gz	YLHKBCFTWRHOJX-CXUGXGMPSA-N	1	1	315.373	1.901	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000295639899	529504193	/nfs/dbraw/zinc/50/41/93/529504193.db2.gz	GNYHOBVILAKFDN-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000295639899	529504194	/nfs/dbraw/zinc/50/41/94/529504194.db2.gz	GNYHOBVILAKFDN-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000452388731	231374574	/nfs/dbraw/zinc/37/45/74/231374574.db2.gz	KGEVGXGFFMILCK-AWEZNQCLSA-N	1	1	307.350	1.171	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@](C)(F)C1	ZINC000295175247	529786028	/nfs/dbraw/zinc/78/60/28/529786028.db2.gz	GTZUTAXWDQSJNY-HNNXBMFYSA-N	1	1	324.356	1.434	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@@H]21	ZINC000451627038	529798139	/nfs/dbraw/zinc/79/81/39/529798139.db2.gz	GHGOGRYTYMWSGP-MFKMUULPSA-N	1	1	302.334	1.872	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NCC[N@H+]1CCCOCC1	ZINC000445674724	529932864	/nfs/dbraw/zinc/93/28/64/529932864.db2.gz	IIGVGNHUURKGLE-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000458170332	530060421	/nfs/dbraw/zinc/06/04/21/530060421.db2.gz	PCCWDXMWRRDVLL-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)CC(C)(C)O	ZINC000181706447	199342188	/nfs/dbraw/zinc/34/21/88/199342188.db2.gz	ACZRTHRLTRGZIA-UHFFFAOYSA-N	1	1	313.329	1.765	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]([C@H](C)O)C1	ZINC000305640246	282398407	/nfs/dbraw/zinc/39/84/07/282398407.db2.gz	JOFILSGTWBLCKC-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]([C@H](C)O)C1	ZINC000305640246	282398409	/nfs/dbraw/zinc/39/84/09/282398409.db2.gz	JOFILSGTWBLCKC-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc(NC(=O)NC[C@@]2(O)CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000358453091	299156715	/nfs/dbraw/zinc/15/67/15/299156715.db2.gz	IDXRTJAKTNIADS-AWEZNQCLSA-N	1	1	308.338	1.091	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+][C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000459597742	233351140	/nfs/dbraw/zinc/35/11/40/233351140.db2.gz	PJNJWTWOOVVFHP-RBSFLKMASA-N	1	1	316.361	1.921	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2c(F)cccc2C1	ZINC000152635656	186092664	/nfs/dbraw/zinc/09/26/64/186092664.db2.gz	FVBMPQRAYCFDHH-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2c(F)cccc2C1	ZINC000152635656	186092666	/nfs/dbraw/zinc/09/26/66/186092666.db2.gz	FVBMPQRAYCFDHH-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
COc1cc(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000155790813	186113447	/nfs/dbraw/zinc/11/34/47/186113447.db2.gz	YPHSYEARDHOPMK-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1N)C1CCCC1	ZINC000171510155	186170950	/nfs/dbraw/zinc/17/09/50/186170950.db2.gz	JKJNDBNPDVQOQR-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)n1	ZINC000191854508	186264555	/nfs/dbraw/zinc/26/45/55/186264555.db2.gz	VMXLUOKTKZIKBP-NWDGAFQWSA-N	1	1	321.381	1.368	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000058298853	352842235	/nfs/dbraw/zinc/84/22/35/352842235.db2.gz	QXIRWGVNCCZTAQ-GJZGRUSLSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C	ZINC000065733067	352960671	/nfs/dbraw/zinc/96/06/71/352960671.db2.gz	YUHOHHCHOJRLKI-RYUDHWBXSA-N	1	1	323.397	1.479	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000067703540	353063366	/nfs/dbraw/zinc/06/33/66/353063366.db2.gz	NCFXVYKPHLZRAG-LLVKDONJSA-N	1	1	305.334	1.570	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2	ZINC000067191904	353038396	/nfs/dbraw/zinc/03/83/96/353038396.db2.gz	JDKPVLBQGKLRQM-UHFFFAOYSA-N	1	1	309.322	1.048	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)c1ccco1	ZINC000067285423	353042012	/nfs/dbraw/zinc/04/20/12/353042012.db2.gz	HPTNFLUUIGXJFD-GFCCVEGCSA-N	1	1	321.337	1.194	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000068775388	353129146	/nfs/dbraw/zinc/12/91/46/353129146.db2.gz	KVZSIWCGQQMTEI-UHFFFAOYSA-N	1	1	309.370	1.124	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000069529206	353166188	/nfs/dbraw/zinc/16/61/88/353166188.db2.gz	WRAKFHNQQNVCCX-CQSZACIVSA-N	1	1	307.350	1.435	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@]2(CNC(=O)C2)C1	ZINC000072831145	353220122	/nfs/dbraw/zinc/22/01/22/353220122.db2.gz	LOBLSTUSQIRXJG-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@]2(CNC(=O)C2)C1	ZINC000072831145	353220126	/nfs/dbraw/zinc/22/01/26/353220126.db2.gz	LOBLSTUSQIRXJG-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000080259136	353599153	/nfs/dbraw/zinc/59/91/53/353599153.db2.gz	HEQHXODKAMAHBV-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[NH+]2CCC(c3nc[nH]n3)CC2)cc1	ZINC000083444014	353709775	/nfs/dbraw/zinc/70/97/75/353709775.db2.gz	UQCGMFINKSYDNN-UHFFFAOYSA-N	1	1	317.349	1.971	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2cc(C)c([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000089265361	353763831	/nfs/dbraw/zinc/76/38/31/353763831.db2.gz	ZBKRSPBZEVKMSJ-LBPRGKRZSA-N	1	1	322.365	1.372	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038512	354223505	/nfs/dbraw/zinc/22/35/05/354223505.db2.gz	HONAWWFSCWSRTM-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038512	354223508	/nfs/dbraw/zinc/22/35/08/354223508.db2.gz	HONAWWFSCWSRTM-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H](C)C1	ZINC000346178541	283014180	/nfs/dbraw/zinc/01/41/80/283014180.db2.gz	LLZLRWIMXJCWIV-QJPTWQEYSA-N	1	1	321.381	1.131	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCCc2c[nH+]cn2C)n1	ZINC000401831881	354667175	/nfs/dbraw/zinc/66/71/75/354667175.db2.gz	GNLIJSJPIBYSBU-UHFFFAOYSA-N	1	1	305.294	1.165	20	5		DDBDMO
Cn1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])cc1=O	ZINC000586773492	354863617	/nfs/dbraw/zinc/86/36/17/354863617.db2.gz	DCSIYWTWOLAOPS-UHFFFAOYSA-N	1	1	301.346	1.968	20	5		DDBDMO
C[C@H]([C@H](C)Nc1cc(N)c([N+](=O)[O-])c(CO)c1)[NH+]1CCOCC1	ZINC000587882052	354886313	/nfs/dbraw/zinc/88/63/13/354886313.db2.gz	RVBINPWAZUTNER-WDEREUQCSA-N	1	1	324.381	1.190	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3c(F)cccc3[N+](=O)[O-])CC2)C1	ZINC000587979575	354888909	/nfs/dbraw/zinc/88/89/09/354888909.db2.gz	LTMAFOJHUCCGMG-ZDUSSCGKSA-N	1	1	322.384	1.950	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]([N@H+]3CC[C@@H](O)C3)C2)ccc1[N+](=O)[O-]	ZINC000588863062	354944071	/nfs/dbraw/zinc/94/40/71/354944071.db2.gz	OOFINFKFHLTVEX-UONOGXRCSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[C@@H]([N@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000588864065	354944469	/nfs/dbraw/zinc/94/44/69/354944469.db2.gz	ZWTFBWLLUHNZFK-ZIAGYGMSSA-N	1	1	319.361	1.184	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](CC(N)=O)C1	ZINC000588977626	354953761	/nfs/dbraw/zinc/95/37/61/354953761.db2.gz	QPXPQEGHZXDXJL-LLVKDONJSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000588977626	354953762	/nfs/dbraw/zinc/95/37/62/354953762.db2.gz	QPXPQEGHZXDXJL-LLVKDONJSA-N	1	1	320.349	1.039	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)CC2(O)CCC2)c1	ZINC000589510511	354997662	/nfs/dbraw/zinc/99/76/62/354997662.db2.gz	WFLJPPMXHNDTIX-UHFFFAOYSA-N	1	1	308.334	1.728	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000590044699	355043422	/nfs/dbraw/zinc/04/34/22/355043422.db2.gz	MFTWICXGYRRWNP-FZMZJTMJSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000590561798	355114743	/nfs/dbraw/zinc/11/47/43/355114743.db2.gz	GVVWGHBUWDPENZ-MNOVXSKESA-N	1	1	309.322	1.123	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH+](C)C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000590403329	355085773	/nfs/dbraw/zinc/08/57/73/355085773.db2.gz	KSBNHEGZLQRNQW-ONGXEEELSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000590443374	355097596	/nfs/dbraw/zinc/09/75/96/355097596.db2.gz	IMZHFRHEEDPNJG-RISCZKNCSA-N	1	1	305.334	1.136	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000590765854	355172812	/nfs/dbraw/zinc/17/28/12/355172812.db2.gz	ZMZRSMBLDAYZQJ-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@@H]1CN(CCO)CC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000590765854	355172816	/nfs/dbraw/zinc/17/28/16/355172816.db2.gz	ZMZRSMBLDAYZQJ-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@@H]1CN(CCO)CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000590765854	355172820	/nfs/dbraw/zinc/17/28/20/355172820.db2.gz	ZMZRSMBLDAYZQJ-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000591083759	355244921	/nfs/dbraw/zinc/24/49/21/355244921.db2.gz	DPLHDZOLGYCNDL-BVUBDWEXSA-N	1	1	315.373	1.861	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCNC1CC1	ZINC000591577222	355329626	/nfs/dbraw/zinc/32/96/26/355329626.db2.gz	CPJSDIDIILUTIN-LLVKDONJSA-N	1	1	306.366	1.654	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CSc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000591953442	355444948	/nfs/dbraw/zinc/44/49/48/355444948.db2.gz	HPQMGEHTXSVOOF-NSHDSACASA-N	1	1	320.374	1.961	20	5		DDBDMO
C[N@H+]1CCO[C@H](CSc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC000591953442	355444949	/nfs/dbraw/zinc/44/49/49/355444949.db2.gz	HPQMGEHTXSVOOF-NSHDSACASA-N	1	1	320.374	1.961	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC[C@@H]2C2CCC2)c1	ZINC000592198753	355534235	/nfs/dbraw/zinc/53/42/35/355534235.db2.gz	RUQZTPIGHVQUAO-LSDHHAIUSA-N	1	1	308.382	1.807	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000593107957	355800153	/nfs/dbraw/zinc/80/01/53/355800153.db2.gz	RTRVCCUDSCLMQD-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000593107957	355800156	/nfs/dbraw/zinc/80/01/56/355800156.db2.gz	RTRVCCUDSCLMQD-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@@H]1C	ZINC000593188848	355821321	/nfs/dbraw/zinc/82/13/21/355821321.db2.gz	RPHPUJJZCQSUDQ-MXWKQRLJSA-N	1	1	309.370	1.039	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000593420861	355880183	/nfs/dbraw/zinc/88/01/83/355880183.db2.gz	IJLAUQFQUWZODC-GFCCVEGCSA-N	1	1	307.325	1.629	20	5		DDBDMO
CCc1ccc(C(=O)N2CC([N@@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000593853853	356024022	/nfs/dbraw/zinc/02/40/22/356024022.db2.gz	GHVNXPISIAMMOY-CQSZACIVSA-N	1	1	319.361	1.048	20	5		DDBDMO
CCc1ccc(C(=O)N2CC([N@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000593853853	356024027	/nfs/dbraw/zinc/02/40/27/356024027.db2.gz	GHVNXPISIAMMOY-CQSZACIVSA-N	1	1	319.361	1.048	20	5		DDBDMO
O=[N+]([O-])c1cc(O)ccc1-n1cc(C[NH+]2CCCCC2)nn1	ZINC000594651300	356275137	/nfs/dbraw/zinc/27/51/37/356275137.db2.gz	BKMBRZNTJDVHPA-UHFFFAOYSA-N	1	1	303.322	1.867	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000594731222	356299931	/nfs/dbraw/zinc/29/99/31/356299931.db2.gz	GUAJIIITSFZYDI-GFCCVEGCSA-N	1	1	319.365	1.554	20	5		DDBDMO
Cc1cc(S(=O)(=O)N(C)CC2C[NH+](C)C2)ccc1[N+](=O)[O-]	ZINC000594847165	356335822	/nfs/dbraw/zinc/33/58/22/356335822.db2.gz	OLJILTQFWSERHJ-UHFFFAOYSA-N	1	1	313.379	1.085	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC000272209567	283153638	/nfs/dbraw/zinc/15/36/38/283153638.db2.gz	PXRNYWMHVZGYGQ-VHSXEESVSA-N	1	1	307.379	1.834	20	5		DDBDMO
CCN1CC[C@H]([N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373219	356469387	/nfs/dbraw/zinc/46/93/87/356469387.db2.gz	YPFNLAJVTUIKPC-YPMHNXCESA-N	1	1	319.365	1.097	20	5		DDBDMO
CCN1CC[C@H]([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000595373219	356469391	/nfs/dbraw/zinc/46/93/91/356469391.db2.gz	YPFNLAJVTUIKPC-YPMHNXCESA-N	1	1	319.365	1.097	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000595387621	356474577	/nfs/dbraw/zinc/47/45/77/356474577.db2.gz	FWHIGYOCGWFEMY-CQSZACIVSA-N	1	1	309.341	1.640	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3cccc(C(N)=O)c3[N+](=O)[O-])C2)C1	ZINC000488767895	283171062	/nfs/dbraw/zinc/17/10/62/283171062.db2.gz	LJRPKPDSVWXJPK-HNNXBMFYSA-N	1	1	304.350	1.226	20	5		DDBDMO
Cc1noc(C[NH+]2CCC3(CCN(C)C3=O)CC2)c1[N+](=O)[O-]	ZINC000595459902	356501437	/nfs/dbraw/zinc/50/14/37/356501437.db2.gz	AWAZWKXTXATVBT-UHFFFAOYSA-N	1	1	308.338	1.336	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(CCn1cc([N+](=O)[O-])ccc1=O)C2	ZINC000595505800	356522421	/nfs/dbraw/zinc/52/24/21/356522421.db2.gz	YNVNPIZHEWIAQG-MRXNPFEDSA-N	1	1	320.393	1.174	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595727837	356624500	/nfs/dbraw/zinc/62/45/00/356624500.db2.gz	DLFQCCWPAUKJJN-ZWNOBZJWSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]2N1	ZINC000595727837	356624503	/nfs/dbraw/zinc/62/45/03/356624503.db2.gz	DLFQCCWPAUKJJN-ZWNOBZJWSA-N	1	1	307.325	1.834	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1COCCO1	ZINC000595735753	356627948	/nfs/dbraw/zinc/62/79/48/356627948.db2.gz	CCUCLFOTKSXFOL-LLVKDONJSA-N	1	1	307.306	1.583	20	5		DDBDMO
C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1COCCO1	ZINC000595735753	356627951	/nfs/dbraw/zinc/62/79/51/356627951.db2.gz	CCUCLFOTKSXFOL-LLVKDONJSA-N	1	1	307.306	1.583	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@H]1COCCO1	ZINC000595738561	356629521	/nfs/dbraw/zinc/62/95/21/356629521.db2.gz	WFNGPFLJBBPIAX-AWEZNQCLSA-N	1	1	323.349	1.271	20	5		DDBDMO
C[NH+](C)CCC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CCO1	ZINC000595907155	356700942	/nfs/dbraw/zinc/70/09/42/356700942.db2.gz	REDHPRKNCMTZAX-OAHLLOKOSA-N	1	1	323.393	1.843	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596129859	356784865	/nfs/dbraw/zinc/78/48/65/356784865.db2.gz	RRRMSCGRJLLWHR-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC[N@H+]1C	ZINC000596137027	356787605	/nfs/dbraw/zinc/78/76/05/356787605.db2.gz	OCOUWMXJLSARGC-ZYHUDNBSSA-N	1	1	306.366	1.613	20	5		DDBDMO
C[C@@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000596299259	356849537	/nfs/dbraw/zinc/84/95/37/356849537.db2.gz	QZMAKEQLQYTNOS-GARJFASQSA-N	1	1	310.354	1.605	20	5		DDBDMO
C[C@@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000596299259	356849542	/nfs/dbraw/zinc/84/95/42/356849542.db2.gz	QZMAKEQLQYTNOS-GARJFASQSA-N	1	1	310.354	1.605	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cc1cc3c(cc1[N+](=O)[O-])OCCO3)C2	ZINC000597209902	357094473	/nfs/dbraw/zinc/09/44/73/357094473.db2.gz	FJOFLBIOCGYQFG-MLGOLLRUSA-N	1	1	320.345	1.834	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)n1	ZINC000597710892	357297015	/nfs/dbraw/zinc/29/70/15/357297015.db2.gz	PWZLBWNIGXGYAN-HNNXBMFYSA-N	1	1	321.381	1.369	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000597858783	357361097	/nfs/dbraw/zinc/36/10/97/357361097.db2.gz	OZTGKSTVTHGQOB-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597945618	357393885	/nfs/dbraw/zinc/39/38/85/357393885.db2.gz	JXKBXNZHCYLSJP-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@H+](CCC)C2)c1[N+](=O)[O-]	ZINC000598341876	357544292	/nfs/dbraw/zinc/54/42/92/357544292.db2.gz	HOLNBPDFYTWOGA-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000598341801	357544658	/nfs/dbraw/zinc/54/46/58/357544658.db2.gz	GJZBTRQTHPUKIN-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000598343142	357545836	/nfs/dbraw/zinc/54/58/36/357545836.db2.gz	RHPZVGRGYKPJOM-JTQLQIEISA-N	1	1	317.349	1.685	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1CO	ZINC000598643499	357666461	/nfs/dbraw/zinc/66/64/61/357666461.db2.gz	LMUYIPKAVOKOKM-UMVBOHGHSA-N	1	1	324.377	1.285	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([N@H+]3CC[C@@H](O)C3)C2)c1	ZINC000599939518	358086240	/nfs/dbraw/zinc/08/62/40/358086240.db2.gz	WCQSNWKSFXQUOO-QWHCGFSZSA-N	1	1	319.361	1.184	20	5		DDBDMO
CN(CCN1CCOCC1)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601111298	358406497	/nfs/dbraw/zinc/40/64/97/358406497.db2.gz	RDEKEVWYPKNXKS-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(NCC[N@@H+]3CC[C@H](O)C3)c2c1	ZINC000601204960	358446470	/nfs/dbraw/zinc/44/64/70/358446470.db2.gz	VNQLBDYOQDZOTL-LBPRGKRZSA-N	1	1	302.334	1.043	20	5		DDBDMO
CNC(=O)[C@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601140075	358418026	/nfs/dbraw/zinc/41/80/26/358418026.db2.gz	RACNZRBGLZSFIF-CQSZACIVSA-N	1	1	316.317	1.094	20	5		DDBDMO
CCn1cncc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149180	358422062	/nfs/dbraw/zinc/42/20/62/358422062.db2.gz	KIHUICBJLRHHAN-OAHLLOKOSA-N	1	1	304.350	1.809	20	5		DDBDMO
C[C@@H](O)[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601176305	358434984	/nfs/dbraw/zinc/43/49/84/358434984.db2.gz	USUQYTQOSAPINB-BMIGLBTASA-N	1	1	303.318	1.729	20	5		DDBDMO
Cc1nc(N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000565579970	304077241	/nfs/dbraw/zinc/07/72/41/304077241.db2.gz	OXGREKMDVBFPGM-STQMWFEESA-N	1	1	321.381	1.749	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000601776164	358690690	/nfs/dbraw/zinc/69/06/90/358690690.db2.gz	HICOPDMTSNUAEB-MLGOLLRUSA-N	1	1	321.377	1.260	20	5		DDBDMO
O=[N+]([O-])c1ccn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)n1	ZINC000601960889	358754635	/nfs/dbraw/zinc/75/46/35/358754635.db2.gz	XIWVXXGUSVBSGZ-HNNXBMFYSA-N	1	1	302.334	1.428	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000602099085	358812460	/nfs/dbraw/zinc/81/24/60/358812460.db2.gz	WXZCQUDVIWTMOF-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+]CCOC[C@@H]3CCOC3)nc2c1	ZINC000602534676	359031975	/nfs/dbraw/zinc/03/19/75/359031975.db2.gz	JAHJQHYJRJONIM-LLVKDONJSA-N	1	1	321.333	1.879	20	5		DDBDMO
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1C[C@H](O)C[C@H](O)C1	ZINC000602486612	359010611	/nfs/dbraw/zinc/01/06/11/359010611.db2.gz	VSYLWVHMINOXPU-PHIMTYICSA-N	1	1	320.267	1.541	20	5		DDBDMO
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1C[C@H](O)C[C@H](O)C1	ZINC000602486612	359010615	/nfs/dbraw/zinc/01/06/15/359010615.db2.gz	VSYLWVHMINOXPU-PHIMTYICSA-N	1	1	320.267	1.541	20	5		DDBDMO
Cn1cc(C[N@@H+]2CC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])n1	ZINC000602620620	359079297	/nfs/dbraw/zinc/07/92/97/359079297.db2.gz	YNAHQTCNGZFUEX-INIZCTEOSA-N	1	1	314.345	1.960	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@]3(C2)OCc2ccccc23)c([N+](=O)[O-])n1	ZINC000602620620	359079300	/nfs/dbraw/zinc/07/93/00/359079300.db2.gz	YNAHQTCNGZFUEX-INIZCTEOSA-N	1	1	314.345	1.960	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000602775856	359181904	/nfs/dbraw/zinc/18/19/04/359181904.db2.gz	CIDNRSDEAMTOPM-OCCSQVGLSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000602775856	359181925	/nfs/dbraw/zinc/18/19/25/359181925.db2.gz	CIDNRSDEAMTOPM-OCCSQVGLSA-N	1	1	309.414	1.904	20	5		DDBDMO
CCN1CC[C@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000602775856	359181928	/nfs/dbraw/zinc/18/19/28/359181928.db2.gz	CIDNRSDEAMTOPM-OCCSQVGLSA-N	1	1	309.414	1.904	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC(C)(C)[C@H]1[C@H]1CCCO1	ZINC000602835140	359226275	/nfs/dbraw/zinc/22/62/75/359226275.db2.gz	XVKOMGXTCAAMNZ-TZMCWYRMSA-N	1	1	308.382	1.989	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c([N+](=O)[O-])n1	ZINC000602837063	359228228	/nfs/dbraw/zinc/22/82/28/359228228.db2.gz	SSLCJSSRUCPKKP-MCIONIFRSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1nccn1CCC[N@H+](C)CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602799411	359200338	/nfs/dbraw/zinc/20/03/38/359200338.db2.gz	SMKYECCFPXLSCG-UHFFFAOYSA-N	1	1	306.370	1.627	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](C[C@H]1CCc3ncnn31)CC2	ZINC000602802390	359202112	/nfs/dbraw/zinc/20/21/12/359202112.db2.gz	QRAFTHPQYFBUMD-LLVKDONJSA-N	1	1	300.322	1.127	20	5		DDBDMO
COC(=O)[C@@H](C)[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCC1	ZINC000602827707	359220843	/nfs/dbraw/zinc/22/08/43/359220843.db2.gz	MZGYJASOCVUMLT-SNVBAGLBSA-N	1	1	310.354	1.516	20	5		DDBDMO
COC(=O)[C@@H](C)[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCC1	ZINC000602827707	359220845	/nfs/dbraw/zinc/22/08/45/359220845.db2.gz	MZGYJASOCVUMLT-SNVBAGLBSA-N	1	1	310.354	1.516	20	5		DDBDMO
COc1ccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)nc1	ZINC000602962493	359325787	/nfs/dbraw/zinc/32/57/87/359325787.db2.gz	KIKBKXNBPGGHJM-MRXNPFEDSA-N	1	1	317.345	1.996	20	5		DDBDMO
C[C@@](CO)(NCC[NH+]1CCCCC1)c1cccc([N+](=O)[O-])c1	ZINC000602963015	359325977	/nfs/dbraw/zinc/32/59/77/359325977.db2.gz	ROIRTBUMUCAAPI-INIZCTEOSA-N	1	1	307.394	1.878	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C[C@@H]1C(C)(C)C	ZINC000603144066	359433508	/nfs/dbraw/zinc/43/35/08/359433508.db2.gz	VQENQIOOQQLVDV-GFCCVEGCSA-N	1	1	322.365	1.498	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1CCC[C@H]1O	ZINC000611285738	360689725	/nfs/dbraw/zinc/68/97/25/360689725.db2.gz	KBFKHTJTMBTQGS-SMDDNHRTSA-N	1	1	322.361	1.959	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)n1	ZINC000611616294	360776892	/nfs/dbraw/zinc/77/68/92/360776892.db2.gz	UVILJOULOFNASV-QWHCGFSZSA-N	1	1	308.382	1.498	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619255013	363947033	/nfs/dbraw/zinc/94/70/33/363947033.db2.gz	SIMWKWIQUFEUSC-UONOGXRCSA-N	1	1	322.340	1.557	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000619566964	364063830	/nfs/dbraw/zinc/06/38/30/364063830.db2.gz	CVSMLBILXDBGDK-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1C	ZINC000094780177	193396925	/nfs/dbraw/zinc/39/69/25/193396925.db2.gz	QQOGYOJETRKXSB-UHFFFAOYSA-N	1	1	319.358	1.272	20	5		DDBDMO
C[N@H+](Cc1cccc(Cl)c1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266389346	205312639	/nfs/dbraw/zinc/31/26/39/205312639.db2.gz	BXBVAQDGNSRAFR-AWEZNQCLSA-N	1	1	324.768	1.938	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc(C)c([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000284752088	218162933	/nfs/dbraw/zinc/16/29/33/218162933.db2.gz	VTBDJKSNMNQMCP-KBPBESRZSA-N	1	1	321.377	1.694	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@@H]21	ZINC000285326949	218382759	/nfs/dbraw/zinc/38/27/59/218382759.db2.gz	RWOZACUMANJVNN-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2cc(C)ccc2[N+](=O)[O-])[C@H](C)C1	ZINC000340973931	251313465	/nfs/dbraw/zinc/31/34/65/251313465.db2.gz	ZCFKCKLXUBRKDI-CYBMUJFWSA-N	1	1	321.377	1.977	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@H](O)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000340982356	251318452	/nfs/dbraw/zinc/31/84/52/251318452.db2.gz	YTDXEHQHVMOBQV-CMPLNLGQSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[NH+](CCO)CC2)cc1[N+](=O)[O-]	ZINC000120022697	195082838	/nfs/dbraw/zinc/08/28/38/195082838.db2.gz	UDBUKMPVBAHVAX-UHFFFAOYSA-N	1	1	308.338	1.045	20	5		DDBDMO
C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC000272995112	210375773	/nfs/dbraw/zinc/37/57/73/210375773.db2.gz	QNZKCRPEPIBKFN-LBPRGKRZSA-N	1	1	319.361	1.740	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+](CCO)[C@H]2CCc3ccccc32)c1	ZINC000266926079	285189249	/nfs/dbraw/zinc/18/92/49/285189249.db2.gz	KJMQTILYMGDDQX-INIZCTEOSA-N	1	1	316.361	1.773	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C[N@H+]1C	ZINC000352783385	285298265	/nfs/dbraw/zinc/29/82/65/285298265.db2.gz	XYLTUYKSUSAAAS-MNOVXSKESA-N	1	1	309.341	1.827	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC1(C)C	ZINC000295908387	533413725	/nfs/dbraw/zinc/41/37/25/533413725.db2.gz	HJGRIXHMGOEQPN-CYBMUJFWSA-N	1	1	309.366	1.503	20	5		DDBDMO
C[C@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])N1CCN(C)CC1	ZINC000569115928	304336967	/nfs/dbraw/zinc/33/69/67/304336967.db2.gz	ARGXHVUPJIMMDD-CZUORRHYSA-N	1	1	318.421	1.808	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNCc1ccc([N+](=O)[O-])cc1Cl	ZINC000068805455	406662002	/nfs/dbraw/zinc/66/20/02/406662002.db2.gz	YYYRYXHBJOWAGN-CYBMUJFWSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CCN(C)[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000068805455	406662006	/nfs/dbraw/zinc/66/20/06/406662006.db2.gz	YYYRYXHBJOWAGN-CYBMUJFWSA-N	1	1	312.801	1.584	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCC[C@@H](C)C1	ZINC000046879089	407064451	/nfs/dbraw/zinc/06/44/51/407064451.db2.gz	KVLUADCYLKNJKN-LLVKDONJSA-N	1	1	306.366	1.760	20	5		DDBDMO
CCN1CC[NH+](C[C@@H](C)CNC(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000122487265	407303082	/nfs/dbraw/zinc/30/30/82/407303082.db2.gz	USYKPTQJSFXTNJ-LBPRGKRZSA-N	1	1	324.381	1.191	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000124357647	407356099	/nfs/dbraw/zinc/35/60/99/407356099.db2.gz	WBJSXKARKOMFSE-CYBMUJFWSA-N	1	1	323.397	1.276	20	5		DDBDMO
Cc1[nH+]cn(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1C	ZINC000112981040	407453691	/nfs/dbraw/zinc/45/36/91/407453691.db2.gz	PYNBKNZVBXUEIY-UHFFFAOYSA-N	1	1	300.318	1.997	20	5		DDBDMO
C[NH+](C)[C@@H](C(=O)NCCn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000178837261	407621637	/nfs/dbraw/zinc/62/16/37/407621637.db2.gz	OKLWPYPYEDSKEJ-CQSZACIVSA-N	1	1	317.349	1.210	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2[C@H](O)C(F)(F)F)c1	ZINC000266907312	407670315	/nfs/dbraw/zinc/67/03/15/407670315.db2.gz	BOLNDTIPIMBBNL-ZJUUUORDSA-N	1	1	308.260	1.179	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2C[C@H](C)[NH2+][C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000178954187	407670908	/nfs/dbraw/zinc/67/09/08/407670908.db2.gz	LNYSVLJPBBTDGC-QWRGUYRKSA-N	1	1	313.379	1.274	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C	ZINC000186487644	407680533	/nfs/dbraw/zinc/68/05/33/407680533.db2.gz	AEUAVUKWMKYAIH-IINYFYTJSA-N	1	1	317.349	1.739	20	5		DDBDMO
CC(C)C[C@H](C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000236602772	407731969	/nfs/dbraw/zinc/73/19/69/407731969.db2.gz	KTEHFXJAYMTEIC-SECBINFHSA-N	1	1	305.338	1.574	20	5		DDBDMO
C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000187132368	407825486	/nfs/dbraw/zinc/82/54/86/407825486.db2.gz	WRSBLYZEZHGEOI-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000187132368	407825491	/nfs/dbraw/zinc/82/54/91/407825491.db2.gz	WRSBLYZEZHGEOI-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000268177652	407931036	/nfs/dbraw/zinc/93/10/36/407931036.db2.gz	KWSHIZRJLPPIEF-IAQYHMDHSA-N	1	1	319.361	1.573	20	5		DDBDMO
Cn1cc([C@H]2C[NH2+]CCN2C(=O)c2ccc([N+](=O)[O-])s2)cn1	ZINC000181379481	407988874	/nfs/dbraw/zinc/98/88/74/407988874.db2.gz	CMVNGFPTOZSTKN-SNVBAGLBSA-N	1	1	321.362	1.177	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000272601483	408000024	/nfs/dbraw/zinc/00/00/24/408000024.db2.gz	HERRHLAHXCIDNP-JOYOIKCWSA-N	1	1	304.350	1.390	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000272601478	408002656	/nfs/dbraw/zinc/00/26/56/408002656.db2.gz	HERRHLAHXCIDNP-CABZTGNLSA-N	1	1	304.350	1.390	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000154310364	408013801	/nfs/dbraw/zinc/01/38/01/408013801.db2.gz	ZQJWZJJFOGIVNL-ZDUSSCGKSA-N	1	1	323.397	1.418	20	5		DDBDMO
CC(C)(C)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1O	ZINC000273244429	408123681	/nfs/dbraw/zinc/12/36/81/408123681.db2.gz	GERNIQHYFXWIGT-KGLIPLIRSA-N	1	1	323.393	1.485	20	5		DDBDMO
COc1ccc([C@H](CO)[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000176243406	408322028	/nfs/dbraw/zinc/32/20/28/408322028.db2.gz	DTEQQFHKMMYYSI-AWEZNQCLSA-N	1	1	320.349	1.465	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662239	408381940	/nfs/dbraw/zinc/38/19/40/408381940.db2.gz	QVMSHLBTGJHWHW-GJZGRUSLSA-N	1	1	319.361	1.371	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269662239	408381945	/nfs/dbraw/zinc/38/19/45/408381945.db2.gz	QVMSHLBTGJHWHW-GJZGRUSLSA-N	1	1	319.361	1.371	20	5		DDBDMO
C[C@@H]1CC(O)C[C@H](C)[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000191190289	408383930	/nfs/dbraw/zinc/38/39/30/408383930.db2.gz	ARTFGOJESFOSBV-PIGZVRMJSA-N	1	1	324.377	1.568	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CCC[N@H+](C(C)C)C1	ZINC000274427200	408401169	/nfs/dbraw/zinc/40/11/69/408401169.db2.gz	FIPJTARBIVLSKI-CYBMUJFWSA-N	1	1	323.397	1.479	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000270356235	408499744	/nfs/dbraw/zinc/49/97/44/408499744.db2.gz	ASNDKJZZAOKTMQ-LLVKDONJSA-N	1	1	313.379	1.185	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000177128932	408528207	/nfs/dbraw/zinc/52/82/07/408528207.db2.gz	KQFOATOKPVTRCR-DGCLKSJQSA-N	1	1	303.362	1.879	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)COc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177133893	408529984	/nfs/dbraw/zinc/52/99/84/408529984.db2.gz	FNIMYLZJIQDGDJ-VXGBXAGGSA-N	1	1	319.361	1.715	20	5		DDBDMO
CC[C@H](O)[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000269937113	408474508	/nfs/dbraw/zinc/47/45/08/408474508.db2.gz	YQQDXZNBRGGCQF-KGLIPLIRSA-N	1	1	309.366	1.382	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000248332137	408548234	/nfs/dbraw/zinc/54/82/34/408548234.db2.gz	FFSCZOLLSZKKHY-DZGCQCFKSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[C@@]1(O)CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000248332137	408548239	/nfs/dbraw/zinc/54/82/39/408548239.db2.gz	FFSCZOLLSZKKHY-DZGCQCFKSA-N	1	1	305.334	1.157	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000177205417	408553121	/nfs/dbraw/zinc/55/31/21/408553121.db2.gz	YFHHWYWDYAIPOT-QWRGUYRKSA-N	1	1	319.361	1.958	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000275543101	408595850	/nfs/dbraw/zinc/59/58/50/408595850.db2.gz	ZFKCGJCLFBREOE-DOMZBBRYSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177154572	408536105	/nfs/dbraw/zinc/53/61/05/408536105.db2.gz	XZBJJXOBUOCYFP-ONGXEEELSA-N	1	1	304.350	1.532	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1	ZINC000160922575	408540428	/nfs/dbraw/zinc/54/04/28/408540428.db2.gz	DIAVOYFGDXIBKY-LLVKDONJSA-N	1	1	303.322	1.351	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000177434645	408615056	/nfs/dbraw/zinc/61/50/56/408615056.db2.gz	JYTVBBBYUOJFKO-OAHLLOKOSA-N	1	1	308.334	1.859	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000248947681	408663606	/nfs/dbraw/zinc/66/36/06/408663606.db2.gz	COLOPABOEDCHGX-JJLQDPRZSA-N	1	1	321.377	1.791	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000248947681	408663611	/nfs/dbraw/zinc/66/36/11/408663611.db2.gz	COLOPABOEDCHGX-JJLQDPRZSA-N	1	1	321.377	1.791	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+](C[C@@H](O)Cn2cccn2)C2CC2)c1	ZINC000177999966	408753864	/nfs/dbraw/zinc/75/38/64/408753864.db2.gz	UGDSCMTVAAIFTD-MRXNPFEDSA-N	1	1	316.361	1.817	20	5		DDBDMO
CCOCCOCC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000276114547	408821364	/nfs/dbraw/zinc/82/13/64/408821364.db2.gz	AGGSAFDLHYJZRI-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H]1CCCC[N@H+]1C1CC1	ZINC000277432165	408939011	/nfs/dbraw/zinc/93/90/11/408939011.db2.gz	DTCZJRYFDUIFPJ-ZDUSSCGKSA-N	1	1	321.381	1.315	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000291892390	408940513	/nfs/dbraw/zinc/94/05/13/408940513.db2.gz	MLOZPHIKAUHSPH-GFCCVEGCSA-N	1	1	309.366	1.819	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000277690966	408993699	/nfs/dbraw/zinc/99/36/99/408993699.db2.gz	KJIPTQYKDIIJQM-MNOVXSKESA-N	1	1	307.354	1.237	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000279313538	409189514	/nfs/dbraw/zinc/18/95/14/409189514.db2.gz	NKOZJWBPKPHLMS-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F	ZINC000293720807	409168505	/nfs/dbraw/zinc/16/85/05/409168505.db2.gz	YKXBLGAGFGXRMU-UHFFFAOYSA-N	1	1	305.256	1.921	20	5		DDBDMO
COc1ccc(C[NH2+]CCS(=O)(=O)C(C)C)cc1[N+](=O)[O-]	ZINC000289223772	409234482	/nfs/dbraw/zinc/23/44/82/409234482.db2.gz	AFIQJRSZTFYEFP-UHFFFAOYSA-N	1	1	316.379	1.516	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000283732333	409205693	/nfs/dbraw/zinc/20/56/93/409205693.db2.gz	IAMRPGFBICMZSX-LLVKDONJSA-N	1	1	322.365	1.979	20	5		DDBDMO
CO[C@@]1(C)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000280359174	409299256	/nfs/dbraw/zinc/29/92/56/409299256.db2.gz	JPMIMRMNTQOBSB-HNNXBMFYSA-N	1	1	309.366	1.648	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCO[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000285326947	409408124	/nfs/dbraw/zinc/40/81/24/409408124.db2.gz	RWOZACUMANJVNN-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
CCc1nn(C)c(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000317844502	164028913	/nfs/dbraw/zinc/02/89/13/164028913.db2.gz	YAJXIMXGAIDACF-MNOVXSKESA-N	1	1	309.370	1.166	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cccc([N+](=O)[O-])c1NC)C1CC1	ZINC000318884672	164033899	/nfs/dbraw/zinc/03/38/99/164033899.db2.gz	NIFFVHGBSOZICD-UHFFFAOYSA-N	1	1	306.366	1.851	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357056812	164138193	/nfs/dbraw/zinc/13/81/93/164138193.db2.gz	XZGLJNYDMVITDQ-LLVKDONJSA-N	1	1	309.370	1.275	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000295425728	409475703	/nfs/dbraw/zinc/47/57/03/409475703.db2.gz	UHMSWWOSXKUJCI-JTQLQIEISA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000295425728	409475709	/nfs/dbraw/zinc/47/57/09/409475709.db2.gz	UHMSWWOSXKUJCI-JTQLQIEISA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000295425728	409475712	/nfs/dbraw/zinc/47/57/12/409475712.db2.gz	UHMSWWOSXKUJCI-JTQLQIEISA-N	1	1	321.381	1.437	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432670	409624565	/nfs/dbraw/zinc/62/45/65/409624565.db2.gz	PMDHQMOOWZFLDO-BXUZGUMPSA-N	1	1	305.334	1.014	20	5		DDBDMO
O=C1[C@H]([N@H+]2CC[C@@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432670	409624572	/nfs/dbraw/zinc/62/45/72/409624572.db2.gz	PMDHQMOOWZFLDO-BXUZGUMPSA-N	1	1	305.334	1.014	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000345170674	409656967	/nfs/dbraw/zinc/65/69/67/409656967.db2.gz	IVKJNMOZGWWJKW-QWRGUYRKSA-N	1	1	306.366	1.613	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881924	409685099	/nfs/dbraw/zinc/68/50/99/409685099.db2.gz	PEFAAVVSPYXNIO-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881924	409685105	/nfs/dbraw/zinc/68/51/05/409685105.db2.gz	PEFAAVVSPYXNIO-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881924	409685112	/nfs/dbraw/zinc/68/51/12/409685112.db2.gz	PEFAAVVSPYXNIO-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000356881924	409685118	/nfs/dbraw/zinc/68/51/18/409685118.db2.gz	PEFAAVVSPYXNIO-NXEZZACHSA-N	1	1	309.370	1.435	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000297126544	409815447	/nfs/dbraw/zinc/81/54/47/409815447.db2.gz	PNVVLQHEQXEXKG-UHFFFAOYSA-N	1	1	302.334	1.801	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000354515333	409910606	/nfs/dbraw/zinc/91/06/06/409910606.db2.gz	YBFNZIPHZFTLKE-NSHDSACASA-N	1	1	322.365	1.378	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000297497196	409921207	/nfs/dbraw/zinc/92/12/07/409921207.db2.gz	FYKWZJCAUHOHLZ-LBPRGKRZSA-N	1	1	324.381	1.269	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000324105237	409923542	/nfs/dbraw/zinc/92/35/42/409923542.db2.gz	JUGGCXKZCCFSMY-AWEZNQCLSA-N	1	1	319.365	1.554	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1O	ZINC000317766395	409871207	/nfs/dbraw/zinc/87/12/07/409871207.db2.gz	ATWSPEYRKHBZCD-TZMCWYRMSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[C@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)CS(C)(=O)=O	ZINC000338370276	409942439	/nfs/dbraw/zinc/94/24/39/409942439.db2.gz	ALWKKVDTFJSGNS-GFCCVEGCSA-N	1	1	314.407	1.750	20	5		DDBDMO
C[C@H](C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)CS(C)(=O)=O	ZINC000338370276	409942444	/nfs/dbraw/zinc/94/24/44/409942444.db2.gz	ALWKKVDTFJSGNS-GFCCVEGCSA-N	1	1	314.407	1.750	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@@H+]1C1CCN(C)CC1	ZINC000354741680	410052976	/nfs/dbraw/zinc/05/29/76/410052976.db2.gz	DAYJDQWWTDZNJD-ZDUSSCGKSA-N	1	1	319.409	1.595	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@H+]1C1CCN(C)CC1	ZINC000354741680	410052979	/nfs/dbraw/zinc/05/29/79/410052979.db2.gz	DAYJDQWWTDZNJD-ZDUSSCGKSA-N	1	1	319.409	1.595	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000339389469	410150095	/nfs/dbraw/zinc/15/00/95/410150095.db2.gz	CCSAYMMOILPBAN-JKSUJKDBSA-N	1	1	305.378	1.890	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000339395810	410157040	/nfs/dbraw/zinc/15/70/40/410157040.db2.gz	LYMRGMPUKVYWSK-CVEARBPZSA-N	1	1	305.378	1.890	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3csc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000339396115	410157242	/nfs/dbraw/zinc/15/72/42/410157242.db2.gz	TWECKCWIRXRMQP-CHWSQXEVSA-N	1	1	311.407	1.951	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000298270585	410162064	/nfs/dbraw/zinc/16/20/64/410162064.db2.gz	GPOINSKHXWILSI-GUTXKFCHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000298270585	410162075	/nfs/dbraw/zinc/16/20/75/410162075.db2.gz	GPOINSKHXWILSI-GUTXKFCHSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCC(=O)NCCn1cc([N+](=O)[O-])cn1	ZINC000355028096	410249504	/nfs/dbraw/zinc/24/95/04/410249504.db2.gz	QDFQFQDEKPRIHB-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC(C)[C@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000343206877	410234972	/nfs/dbraw/zinc/23/49/72/410234972.db2.gz	OOKWTTDBELCMQW-CYBMUJFWSA-N	1	1	306.366	1.470	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNC[C@@]1(O)CC[N@@H+](C)C1	ZINC000358132108	410377196	/nfs/dbraw/zinc/37/71/96/410377196.db2.gz	GMFMLLZVKOZNFX-HNNXBMFYSA-N	1	1	309.366	1.150	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790188	410400097	/nfs/dbraw/zinc/40/00/97/410400097.db2.gz	JMXYLJIUKWVAQU-MNOVXSKESA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000298790188	410400101	/nfs/dbraw/zinc/40/01/01/410400101.db2.gz	JMXYLJIUKWVAQU-MNOVXSKESA-N	1	1	321.333	1.417	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)c1	ZINC000351996692	410400888	/nfs/dbraw/zinc/40/08/88/410400888.db2.gz	PHPCKWJNSDOLKD-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)c1	ZINC000351996692	410400893	/nfs/dbraw/zinc/40/08/93/410400893.db2.gz	PHPCKWJNSDOLKD-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000298950645	410460156	/nfs/dbraw/zinc/46/01/56/410460156.db2.gz	SVZCKMGCIGEWFR-UHFFFAOYSA-N	1	1	322.365	1.451	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000343583948	410552922	/nfs/dbraw/zinc/55/29/22/410552922.db2.gz	ZIULSRCPHGZWRU-LBPRGKRZSA-N	1	1	323.397	1.517	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000301664705	410765918	/nfs/dbraw/zinc/76/59/18/410765918.db2.gz	WAVNFUIILLUCDN-LBPRGKRZSA-N	1	1	321.381	1.298	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330565225	410779990	/nfs/dbraw/zinc/77/99/90/410779990.db2.gz	ACZKFZRTZIDVSU-STQMWFEESA-N	1	1	320.393	1.582	20	5		DDBDMO
Cc1ccc(NC[C@@](C)(O)C[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC000301740610	410784238	/nfs/dbraw/zinc/78/42/38/410784238.db2.gz	DPAQYPQHWKLSME-OAHLLOKOSA-N	1	1	309.366	1.398	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330628564	410837745	/nfs/dbraw/zinc/83/77/45/410837745.db2.gz	LSAIBLVRRMKWLC-STQMWFEESA-N	1	1	305.378	1.997	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000302709282	410850041	/nfs/dbraw/zinc/85/00/41/410850041.db2.gz	DDRCDJFGXZZMDV-NEPJUHHUSA-N	1	1	316.365	1.558	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000341187157	410925173	/nfs/dbraw/zinc/92/51/73/410925173.db2.gz	CGVZSRHUSOHKHF-GXTWGEPZSA-N	1	1	320.393	1.919	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1cc([N+](=O)[O-])n[nH]1	ZINC000353369161	410944515	/nfs/dbraw/zinc/94/45/15/410944515.db2.gz	KCBNOMCVBKELDE-NSHDSACASA-N	1	1	307.354	1.312	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)C2CC(O)C2)c([N+](=O)[O-])c1	ZINC000353492837	411026716	/nfs/dbraw/zinc/02/67/16/411026716.db2.gz	VQUXRHNFVKLHLT-UHFFFAOYSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356654417	411117560	/nfs/dbraw/zinc/11/75/60/411117560.db2.gz	LNOGJJCWYFLLEN-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356654417	411117563	/nfs/dbraw/zinc/11/75/63/411117563.db2.gz	LNOGJJCWYFLLEN-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+](CCCO)C1	ZINC000295588611	225021168	/nfs/dbraw/zinc/02/11/68/225021168.db2.gz	WGGFSCYTSDHNAM-AWEZNQCLSA-N	1	1	321.377	1.100	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000295733390	225174668	/nfs/dbraw/zinc/17/46/68/225174668.db2.gz	WSFPQMXFZQTTKN-UHFFFAOYSA-N	1	1	320.397	1.767	20	5		DDBDMO
CN(CCCNc1nc2cc([N+](=O)[O-])ccc2[nH]1)CC[NH+](C)C	ZINC000295733390	225174674	/nfs/dbraw/zinc/17/46/74/225174674.db2.gz	WSFPQMXFZQTTKN-UHFFFAOYSA-N	1	1	320.397	1.767	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2nnc(N)cc2C1	ZINC000366611528	418496901	/nfs/dbraw/zinc/49/69/01/418496901.db2.gz	WDEQTUGRUXIIKM-UHFFFAOYSA-N	1	1	315.333	1.534	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2nnc(N)cc2C1	ZINC000366611528	418496903	/nfs/dbraw/zinc/49/69/03/418496903.db2.gz	WDEQTUGRUXIIKM-UHFFFAOYSA-N	1	1	315.333	1.534	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000190378207	222076841	/nfs/dbraw/zinc/07/68/41/222076841.db2.gz	HFPRSXBPTVQTSU-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[N@H+](C)C[C@H]1c1ccccc1	ZINC000375007214	418587074	/nfs/dbraw/zinc/58/70/74/418587074.db2.gz	ZONKNGOWOMVPJM-AWEZNQCLSA-N	1	1	315.377	1.817	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[N@@H+](C)C[C@H]1c1ccccc1	ZINC000375007214	418587077	/nfs/dbraw/zinc/58/70/77/418587077.db2.gz	ZONKNGOWOMVPJM-AWEZNQCLSA-N	1	1	315.377	1.817	20	5		DDBDMO
CNc1c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000361172487	418597515	/nfs/dbraw/zinc/59/75/15/418597515.db2.gz	TVIAVRHVJCOFNO-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@@H]2C1	ZINC000361199467	418605053	/nfs/dbraw/zinc/60/50/53/418605053.db2.gz	DUQVIHZZTVSCAF-TUAOUCFPSA-N	1	1	305.334	1.744	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)CCOc1ccc([N+](=O)[O-])cc1	ZINC000361583629	418685577	/nfs/dbraw/zinc/68/55/77/418685577.db2.gz	LPGOJQURIIQLMF-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000387549061	418743328	/nfs/dbraw/zinc/74/33/28/418743328.db2.gz	AZBCDJHDDZYUCH-LLVKDONJSA-N	1	1	306.366	1.637	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](CO)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000362055742	418745671	/nfs/dbraw/zinc/74/56/71/418745671.db2.gz	NHJIIEZLYDTUFR-KGYLQXTDSA-N	1	1	321.377	1.790	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](O)C[C@H]1C	ZINC000411413828	418901438	/nfs/dbraw/zinc/90/14/38/418901438.db2.gz	AONLDTWRLPHYJY-ZYHUDNBSSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000365249230	418845554	/nfs/dbraw/zinc/84/55/54/418845554.db2.gz	PZTQGNJCHGFBFZ-RYUDHWBXSA-N	1	1	319.361	1.960	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000373239740	418933190	/nfs/dbraw/zinc/93/31/90/418933190.db2.gz	BAAKPOKEWARYLZ-HNNXBMFYSA-N	1	1	305.334	1.041	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](C(=O)N(C)C)C2)cc1[N+](=O)[O-]	ZINC000411947659	419515692	/nfs/dbraw/zinc/51/56/92/419515692.db2.gz	UFBRCDAFXYVBLN-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000412079777	419635147	/nfs/dbraw/zinc/63/51/47/419635147.db2.gz	NATDXKPYNVKAED-NFAWXSAZSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H](NC(=O)NCC(F)(F)C[NH3+])c1ccc([N+](=O)[O-])cc1	ZINC000418231249	419630920	/nfs/dbraw/zinc/63/09/20/419630920.db2.gz	KTKCDQHWTLUKMY-QMMMGPOBSA-N	1	1	302.281	1.549	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000429166112	419981297	/nfs/dbraw/zinc/98/12/97/419981297.db2.gz	HTAWUMVGIBAGHM-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000429166112	419981303	/nfs/dbraw/zinc/98/13/03/419981303.db2.gz	HTAWUMVGIBAGHM-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
[NH3+]CC1CCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000430624753	420162820	/nfs/dbraw/zinc/16/28/20/420162820.db2.gz	PKHPYPSHIMXOSE-HNNXBMFYSA-N	1	1	318.377	1.371	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000423964890	420285972	/nfs/dbraw/zinc/28/59/72/420285972.db2.gz	HHSXPPZZRVYPBP-OAHLLOKOSA-N	1	1	312.329	1.777	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000420786159	420389677	/nfs/dbraw/zinc/38/96/77/420389677.db2.gz	VDEQVSSSRLUHBI-AWEZNQCLSA-N	1	1	306.366	1.830	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H](n3ccnn3)C2)c1	ZINC000425498856	420399824	/nfs/dbraw/zinc/39/98/24/420399824.db2.gz	HMCLGOCVRQBANO-AWEZNQCLSA-N	1	1	317.349	1.902	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@@H+]2CC=C(C)CC2)c1[N+](=O)[O-]	ZINC000444364088	230088956	/nfs/dbraw/zinc/08/89/56/230088956.db2.gz	PGUSAPMAFGGNKQ-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H](CC(F)(F)F)C2)c1	ZINC000444697970	230124271	/nfs/dbraw/zinc/12/42/71/230124271.db2.gz	RIFCAGAKKRDMMC-MWLCHTKSSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)[C@H](C)O1	ZINC000446061667	230224076	/nfs/dbraw/zinc/22/40/76/230224076.db2.gz	RCNGODKAIKJIBX-RFGFWPKPSA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)[C@H](C)O1	ZINC000446061667	230224081	/nfs/dbraw/zinc/22/40/81/230224081.db2.gz	RCNGODKAIKJIBX-RFGFWPKPSA-N	1	1	324.377	1.832	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)n1	ZINC000451345392	420597128	/nfs/dbraw/zinc/59/71/28/420597128.db2.gz	QROGHMBOQHWSSC-MCIONIFRSA-N	1	1	308.382	1.807	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000452068837	420619995	/nfs/dbraw/zinc/61/99/95/420619995.db2.gz	PEASLJKCXMQBOJ-GXFFZTMASA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000452068837	420619998	/nfs/dbraw/zinc/61/99/98/420619998.db2.gz	PEASLJKCXMQBOJ-GXFFZTMASA-N	1	1	307.350	1.544	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)ccc1[N+](=O)[O-]	ZINC000455744139	421058009	/nfs/dbraw/zinc/05/80/09/421058009.db2.gz	YDXNJKRNOJPETN-ZDUSSCGKSA-N	1	1	321.381	1.444	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)ccc1[N+](=O)[O-]	ZINC000455744139	421058013	/nfs/dbraw/zinc/05/80/13/421058013.db2.gz	YDXNJKRNOJPETN-ZDUSSCGKSA-N	1	1	321.381	1.444	20	5		DDBDMO
CNc1nc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000455769009	421059504	/nfs/dbraw/zinc/05/95/04/421059504.db2.gz	YJEWQDICMWXPSA-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455363205	421003458	/nfs/dbraw/zinc/00/34/58/421003458.db2.gz	WXSMNQILTLCFPQ-SNVBAGLBSA-N	1	1	309.370	1.492	20	5		DDBDMO
CC[C@@H](CNS(C)(=O)=O)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000449444194	421012875	/nfs/dbraw/zinc/01/28/75/421012875.db2.gz	ZAUGVUPDMVDZGK-JTQLQIEISA-N	1	1	319.358	1.151	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@](O)(C(F)F)C2)cc1[N+](=O)[O-]	ZINC000449471445	421017546	/nfs/dbraw/zinc/01/75/46/421017546.db2.gz	OWUPOQMRCMJFMF-CYBMUJFWSA-N	1	1	302.277	1.805	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@](O)(C(F)F)C2)cc1[N+](=O)[O-]	ZINC000449471445	421017550	/nfs/dbraw/zinc/01/75/50/421017550.db2.gz	OWUPOQMRCMJFMF-CYBMUJFWSA-N	1	1	302.277	1.805	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000456042403	421091906	/nfs/dbraw/zinc/09/19/06/421091906.db2.gz	YJENGSULZCJCIO-AOOOYVTPSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000456042403	421091909	/nfs/dbraw/zinc/09/19/09/421091909.db2.gz	YJENGSULZCJCIO-AOOOYVTPSA-N	1	1	307.354	1.196	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000456371965	421152700	/nfs/dbraw/zinc/15/27/00/421152700.db2.gz	GYQSSCGUSBTQHN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000456371965	421152705	/nfs/dbraw/zinc/15/27/05/421152705.db2.gz	GYQSSCGUSBTQHN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000456371965	421152709	/nfs/dbraw/zinc/15/27/09/421152709.db2.gz	GYQSSCGUSBTQHN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000456371965	421152712	/nfs/dbraw/zinc/15/27/12/421152712.db2.gz	GYQSSCGUSBTQHN-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CCOCC[N@@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)C[C@@H]1C	ZINC000450311681	421180327	/nfs/dbraw/zinc/18/03/27/421180327.db2.gz	IXYXKWABQIHZCK-NSHDSACASA-N	1	1	309.370	1.240	20	5		DDBDMO
CCOCC[N@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)C[C@@H]1C	ZINC000450311681	421180330	/nfs/dbraw/zinc/18/03/30/421180330.db2.gz	IXYXKWABQIHZCK-NSHDSACASA-N	1	1	309.370	1.240	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2CCC[N@H+]2CCCO)c1[N+](=O)[O-]	ZINC000450601234	421216585	/nfs/dbraw/zinc/21/65/85/421216585.db2.gz	YCBRQJDFWANUKT-NSHDSACASA-N	1	1	311.386	1.149	20	5		DDBDMO
CC[N@@H+](CCNc1ncc([N+](=O)[O-])c(C)n1)CCC(F)(F)F	ZINC000450487082	421202536	/nfs/dbraw/zinc/20/25/36/421202536.db2.gz	MNZQSBQNAZLYOO-UHFFFAOYSA-N	1	1	321.303	2.379	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]1(C)CO	ZINC000546809801	421311386	/nfs/dbraw/zinc/31/13/86/421311386.db2.gz	DUQYXVVSLHGNNJ-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]1(C)CO	ZINC000546809801	421311389	/nfs/dbraw/zinc/31/13/89/421311389.db2.gz	DUQYXVVSLHGNNJ-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000546104469	421284369	/nfs/dbraw/zinc/28/43/69/421284369.db2.gz	KHFGXGRUUMSMHX-DZGCQCFKSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000560615616	421284523	/nfs/dbraw/zinc/28/45/23/421284523.db2.gz	NXVNJBUIVGWGDY-AWEZNQCLSA-N	1	1	321.377	1.987	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000547756410	421363847	/nfs/dbraw/zinc/36/38/47/421363847.db2.gz	NXUNFNWRTOLOIB-SNVBAGLBSA-N	1	1	309.370	1.558	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000566453213	421605107	/nfs/dbraw/zinc/60/51/07/421605107.db2.gz	VCABHULQHQWGSK-LLVKDONJSA-N	1	1	323.397	1.882	20	5		DDBDMO
CC(C)COCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000558607712	421814814	/nfs/dbraw/zinc/81/48/14/421814814.db2.gz	SXGCKNXBNUQPBU-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C(C)C)C2)n1	ZINC000584089902	422254122	/nfs/dbraw/zinc/25/41/22/422254122.db2.gz	VIGMWIAEKHPEGA-LLVKDONJSA-N	1	1	309.370	1.271	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2ccc(O)cc2C1	ZINC000341674950	271164909	/nfs/dbraw/zinc/16/49/09/271164909.db2.gz	PPKDHKUSCWHBNY-UHFFFAOYSA-N	1	1	315.329	1.520	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2ccc(O)cc2C1	ZINC000341674950	271164913	/nfs/dbraw/zinc/16/49/13/271164913.db2.gz	PPKDHKUSCWHBNY-UHFFFAOYSA-N	1	1	315.329	1.520	20	5		DDBDMO
CC(C)OCC[NH+]1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000288550646	273540745	/nfs/dbraw/zinc/54/07/45/273540745.db2.gz	VNJWHODMKJNFQN-UHFFFAOYSA-N	1	1	308.382	1.724	20	5		DDBDMO
CO[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCC2	ZINC000451864616	274084540	/nfs/dbraw/zinc/08/45/40/274084540.db2.gz	ZXEVRKUAACTEAM-KBPBESRZSA-N	1	1	321.377	1.646	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CCC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000133123390	276300492	/nfs/dbraw/zinc/30/04/92/276300492.db2.gz	LUQPDJMLIPUTLU-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000331426533	277076128	/nfs/dbraw/zinc/07/61/28/277076128.db2.gz	XZWAFRJLCNNKKW-YPMHNXCESA-N	1	1	319.365	1.097	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338350925	278262837	/nfs/dbraw/zinc/26/28/37/278262837.db2.gz	QOEIPPCGBKQGSS-AWEZNQCLSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@@H]1C[NH2+]CCN1S(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000193355602	288319729	/nfs/dbraw/zinc/31/97/29/288319729.db2.gz	WVCUYSLZFNSUOU-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000248837348	295286985	/nfs/dbraw/zinc/28/69/85/295286985.db2.gz	OQQUABFCAZSULY-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)NCc1ccccc1	ZINC000357927970	299022486	/nfs/dbraw/zinc/02/24/86/299022486.db2.gz	JNYDNQRPWXXTML-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(=O)NCc1ccccc1	ZINC000357927970	299022488	/nfs/dbraw/zinc/02/24/88/299022488.db2.gz	JNYDNQRPWXXTML-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000362287193	300044617	/nfs/dbraw/zinc/04/46/17/300044617.db2.gz	OKAYVEIMXGJVHB-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363050832	300203905	/nfs/dbraw/zinc/20/39/05/300203905.db2.gz	NMAYFIITZFOZCJ-JYJNAYRXSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363050832	300203906	/nfs/dbraw/zinc/20/39/06/300203906.db2.gz	NMAYFIITZFOZCJ-JYJNAYRXSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363050832	300203908	/nfs/dbraw/zinc/20/39/08/300203908.db2.gz	NMAYFIITZFOZCJ-JYJNAYRXSA-N	1	1	317.389	1.632	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000363904169	300323630	/nfs/dbraw/zinc/32/36/30/300323630.db2.gz	LBUQBWLFSCICAU-GWCFXTLKSA-N	1	1	319.365	1.128	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000364262037	300364363	/nfs/dbraw/zinc/36/43/63/300364363.db2.gz	ABKZKETVDUKCGJ-ZDUSSCGKSA-N	1	1	323.393	1.634	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccco2)C(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000364457665	300399930	/nfs/dbraw/zinc/39/99/30/300399930.db2.gz	ORULYDCSLJEWTM-KBPBESRZSA-N	1	1	307.350	1.368	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[NH2+]C[C@H]1C(F)F	ZINC000368009101	300932437	/nfs/dbraw/zinc/93/24/37/300932437.db2.gz	WDSTZLRHOUCQPD-JTQLQIEISA-N	1	1	303.240	1.413	20	5		DDBDMO
Cc1c(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cccc1[N+](=O)[O-]	ZINC000368976269	301115321	/nfs/dbraw/zinc/11/53/21/301115321.db2.gz	VGECAVZOBQBKCJ-KCQAQPDRSA-N	1	1	303.362	1.989	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CC2(CCOCC2)O1	ZINC000369311309	301162453	/nfs/dbraw/zinc/16/24/53/301162453.db2.gz	FVLQDMTUFRHAHJ-GFCCVEGCSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC2(CCOCC2)O1	ZINC000369311309	301162454	/nfs/dbraw/zinc/16/24/54/301162454.db2.gz	FVLQDMTUFRHAHJ-GFCCVEGCSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCOC2)O1	ZINC000369546956	301196508	/nfs/dbraw/zinc/19/65/08/301196508.db2.gz	RCXPJEHGLQOKPW-TZMCWYRMSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000369709208	301215084	/nfs/dbraw/zinc/21/50/84/301215084.db2.gz	CHJBGEOSVBZVHU-QLFBSQMISA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000369709208	301215085	/nfs/dbraw/zinc/21/50/85/301215085.db2.gz	CHJBGEOSVBZVHU-QLFBSQMISA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000369709208	301215087	/nfs/dbraw/zinc/21/50/87/301215087.db2.gz	CHJBGEOSVBZVHU-QLFBSQMISA-N	1	1	303.362	1.385	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000370445623	301340652	/nfs/dbraw/zinc/34/06/52/301340652.db2.gz	WHMUTWSFPFXMPS-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC3(CCOCC3)C2)c1	ZINC000376223750	302052030	/nfs/dbraw/zinc/05/20/30/302052030.db2.gz	CEEJUERDDHHJCC-AWEZNQCLSA-N	1	1	324.381	1.045	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](CC(N)=O)C1	ZINC000377604868	302197154	/nfs/dbraw/zinc/19/71/54/302197154.db2.gz	JTLIBOBPEWBVQI-GHMZBOCLSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000377604868	302197157	/nfs/dbraw/zinc/19/71/57/302197157.db2.gz	JTLIBOBPEWBVQI-GHMZBOCLSA-N	1	1	320.349	1.119	20	5		DDBDMO
CC1CCC([NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000363673365	307033009	/nfs/dbraw/zinc/03/30/09/307033009.db2.gz	CBDKHKHILKBMRE-AXVKAWJUSA-N	1	1	309.410	1.811	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000366633684	307078144	/nfs/dbraw/zinc/07/81/44/307078144.db2.gz	CKYCFGSEKRTCIW-GXTWGEPZSA-N	1	1	319.409	1.777	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000371834243	307158589	/nfs/dbraw/zinc/15/85/89/307158589.db2.gz	IFIRIDZIFBDQML-DZGCQCFKSA-N	1	1	305.378	1.981	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCN2CCOC[C@H]2C1	ZINC000371834243	307158590	/nfs/dbraw/zinc/15/85/90/307158590.db2.gz	IFIRIDZIFBDQML-DZGCQCFKSA-N	1	1	305.378	1.981	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)n1	ZINC000427252857	307302858	/nfs/dbraw/zinc/30/28/58/307302858.db2.gz	ZBACYSYQQBXXMY-VXGBXAGGSA-N	1	1	323.397	1.804	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000570000419	308156194	/nfs/dbraw/zinc/15/61/94/308156194.db2.gz	NSOLFDQBVDOSHG-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000570000419	308156195	/nfs/dbraw/zinc/15/61/95/308156195.db2.gz	NSOLFDQBVDOSHG-JTQLQIEISA-N	1	1	317.349	1.637	20	5		DDBDMO
C[C@H](CCN(C)C)[NH2+]C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460773	308316140	/nfs/dbraw/zinc/31/61/40/308316140.db2.gz	XDXVCNRKCMJCMO-TZMCWYRMSA-N	1	1	311.382	1.264	20	5		DDBDMO
C[C@H](CC[NH+](C)C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000576460773	308316141	/nfs/dbraw/zinc/31/61/41/308316141.db2.gz	XDXVCNRKCMJCMO-TZMCWYRMSA-N	1	1	311.382	1.264	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)n1	ZINC000576686348	308331954	/nfs/dbraw/zinc/33/19/54/308331954.db2.gz	KZOPGTSBJZXLKC-MWLCHTKSSA-N	1	1	307.354	1.024	20	5		DDBDMO
O=c1[nH]cnc2cc(NCC[N@@H+]3CC=CCC3)c([N+](=O)[O-])cc21	ZINC000392830332	337066334	/nfs/dbraw/zinc/06/63/34/337066334.db2.gz	OMRJVNHONIWFEQ-UHFFFAOYSA-N	1	1	315.333	1.917	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@H+](CCn3cc([N+](=O)[O-])cn3)[C@@H]2C1	ZINC000158062630	523708469	/nfs/dbraw/zinc/70/84/69/523708469.db2.gz	KUBLSILTVRREKE-MCIONIFRSA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCn3cc([N+](=O)[O-])cn3)[C@@H]2C1	ZINC000158062630	523708478	/nfs/dbraw/zinc/70/84/78/523708478.db2.gz	KUBLSILTVRREKE-MCIONIFRSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@H+](C)CCO1	ZINC000154777453	525730891	/nfs/dbraw/zinc/73/08/91/525730891.db2.gz	SFYBMKYSJITJPQ-KCJUWKMLSA-N	1	1	300.746	1.774	20	5		DDBDMO
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@@H+](C)CCO1	ZINC000154777453	525730901	/nfs/dbraw/zinc/73/09/01/525730901.db2.gz	SFYBMKYSJITJPQ-KCJUWKMLSA-N	1	1	300.746	1.774	20	5		DDBDMO
CC(C)(C[NH+]1CCOCC1)NC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000413960169	527082532	/nfs/dbraw/zinc/08/25/32/527082532.db2.gz	PLPADMFCEKEVAC-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC(C)C[C@@H](C[NH+]1CCCC1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000452343613	528313574	/nfs/dbraw/zinc/31/35/74/528313574.db2.gz	LQUMMNZROANWMP-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
CC(C)[C@H]([NH3+])CN[C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803802	529071130	/nfs/dbraw/zinc/07/11/30/529071130.db2.gz	WVXWYEILVWPLLG-BXUZGUMPSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@H](N)C[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803802	529071134	/nfs/dbraw/zinc/07/11/34/529071134.db2.gz	WVXWYEILVWPLLG-BXUZGUMPSA-N	1	1	308.382	1.885	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@@H+]1C	ZINC000748348825	700112081	/nfs/dbraw/zinc/11/20/81/700112081.db2.gz	LDKMWCOOFJHLGA-LBPRGKRZSA-N	1	1	316.361	1.712	20	5		DDBDMO
C[C@H]1CN(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C	ZINC000748348825	700112082	/nfs/dbraw/zinc/11/20/82/700112082.db2.gz	LDKMWCOOFJHLGA-LBPRGKRZSA-N	1	1	316.361	1.712	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000157987871	696984961	/nfs/dbraw/zinc/98/49/61/696984961.db2.gz	OVAIUKVHOSXOKK-DOMZBBRYSA-N	1	1	305.382	1.698	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H](OCCO)C2)cc1	ZINC000776585043	698122167	/nfs/dbraw/zinc/12/21/67/698122167.db2.gz	RQPJJGMQMHEHPO-CABCVRRESA-N	1	1	310.350	1.102	20	5		DDBDMO
CN(C)C(=O)NCC[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000777717443	698217444	/nfs/dbraw/zinc/21/74/44/698217444.db2.gz	XWXTTZJDLJPJMF-UHFFFAOYSA-N	1	1	314.773	1.951	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000777717443	698217446	/nfs/dbraw/zinc/21/74/46/698217446.db2.gz	XWXTTZJDLJPJMF-UHFFFAOYSA-N	1	1	314.773	1.951	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000794927327	699836372	/nfs/dbraw/zinc/83/63/72/699836372.db2.gz	FLOBUBRMYNCKKV-FZMZJTMJSA-N	1	1	306.322	1.639	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000796556228	699938803	/nfs/dbraw/zinc/93/88/03/699938803.db2.gz	ODHIYUYCDFVFIL-WQVCFCJDSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000796556228	699938804	/nfs/dbraw/zinc/93/88/04/699938804.db2.gz	ODHIYUYCDFVFIL-WQVCFCJDSA-N	1	1	322.361	1.508	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000802138250	700371319	/nfs/dbraw/zinc/37/13/19/700371319.db2.gz	CRZVQUCRFXPMLO-LLVKDONJSA-N	1	1	311.338	1.199	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)OCCn1cc[nH+]c1C	ZINC000755654796	700576018	/nfs/dbraw/zinc/57/60/18/700576018.db2.gz	GALQQXRERDEKFH-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000763268527	700932553	/nfs/dbraw/zinc/93/25/53/700932553.db2.gz	SXNFQVWGTYCFOX-LBPRGKRZSA-N	1	1	323.349	1.443	20	5		DDBDMO
CCOC(C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1)OCC	ZINC000767763983	701134166	/nfs/dbraw/zinc/13/41/66/701134166.db2.gz	SORAREZAUCQMLV-UHFFFAOYSA-N	1	1	324.381	1.511	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1	ZINC000769636149	701250942	/nfs/dbraw/zinc/25/09/42/701250942.db2.gz	WYLPKMRAJDQSJQ-SEYXRHQNSA-N	1	1	321.377	1.429	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000771902778	701336113	/nfs/dbraw/zinc/33/61/13/701336113.db2.gz	DFNVAPCTJMNFIH-UHFFFAOYSA-N	1	1	305.290	1.722	20	5		DDBDMO
COc1ccc(CC(=O)OCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000771954788	701338292	/nfs/dbraw/zinc/33/82/92/701338292.db2.gz	TZHHLDTVRUKNMR-UHFFFAOYSA-N	1	1	319.317	1.894	20	5		DDBDMO
Cn1cncc1C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000810159079	701737641	/nfs/dbraw/zinc/73/76/41/701737641.db2.gz	CEGFAGGYSHEYDZ-UHFFFAOYSA-N	1	1	304.306	1.389	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000839636232	701762219	/nfs/dbraw/zinc/76/22/19/701762219.db2.gz	PEMDUCYTWWANKD-LLVKDONJSA-N	1	1	322.321	1.413	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839682854	701782712	/nfs/dbraw/zinc/78/27/12/701782712.db2.gz	ANUWQWHOPWDAFT-BYNSBNAKSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839682854	701782721	/nfs/dbraw/zinc/78/27/21/701782721.db2.gz	ANUWQWHOPWDAFT-BYNSBNAKSA-N	1	1	309.410	1.765	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1C[C@@H]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839682854	701782725	/nfs/dbraw/zinc/78/27/25/701782725.db2.gz	ANUWQWHOPWDAFT-BYNSBNAKSA-N	1	1	309.410	1.765	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839696697	701787790	/nfs/dbraw/zinc/78/77/90/701787790.db2.gz	NMAYFIITZFOZCJ-BZUAXINKSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839696697	701787794	/nfs/dbraw/zinc/78/77/94/701787794.db2.gz	NMAYFIITZFOZCJ-BZUAXINKSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839696697	701787798	/nfs/dbraw/zinc/78/77/98/701787798.db2.gz	NMAYFIITZFOZCJ-BZUAXINKSA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000867985315	701874437	/nfs/dbraw/zinc/87/44/37/701874437.db2.gz	AFOVKEQDEZTNIQ-WQGACYEGSA-N	1	1	321.377	1.795	20	5		DDBDMO
Cc1ccnc(N2CCC(N3CC[NH+](C)CC3)CC2)c1[N+](=O)[O-]	ZINC000866212121	706650521	/nfs/dbraw/zinc/65/05/21/706650521.db2.gz	IJSUNLVEQXQIEA-UHFFFAOYSA-N	1	1	319.409	1.514	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](CO)[C@H]1CO	ZINC000879364776	706662546	/nfs/dbraw/zinc/66/25/46/706662546.db2.gz	PHWHTIKULZQXNL-GXTWGEPZSA-N	1	1	310.350	1.169	20	5		DDBDMO
COCCCC[N@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000841690611	702540061	/nfs/dbraw/zinc/54/00/61/702540061.db2.gz	HBCQVKOEOOHYJP-UHFFFAOYSA-N	1	1	309.322	1.819	20	5		DDBDMO
COCCCC[N@@H+](C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000841690611	702540064	/nfs/dbraw/zinc/54/00/64/702540064.db2.gz	HBCQVKOEOOHYJP-UHFFFAOYSA-N	1	1	309.322	1.819	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1	ZINC000844435304	703031265	/nfs/dbraw/zinc/03/12/65/703031265.db2.gz	BWQDBZZCPDJUCQ-NWDGAFQWSA-N	1	1	316.308	1.273	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(CCOc3cccc([N+](=O)[O-])c3)CC[C@H]21	ZINC000879572792	706722914	/nfs/dbraw/zinc/72/29/14/706722914.db2.gz	RIDSMFZWWURFQI-XJKSGUPXSA-N	1	1	305.378	2.000	20	5		DDBDMO
CCC[N@@H+]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979990	704042083	/nfs/dbraw/zinc/04/20/83/704042083.db2.gz	FNOSITSFMQDNHV-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000818979990	704042085	/nfs/dbraw/zinc/04/20/85/704042085.db2.gz	FNOSITSFMQDNHV-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=C1OCCN1[C@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000852436485	704047984	/nfs/dbraw/zinc/04/79/84/704047984.db2.gz	INPYGQXUUOINRZ-KBPBESRZSA-N	1	1	321.333	1.155	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](N2CCOC2=O)C1	ZINC000852438601	704048966	/nfs/dbraw/zinc/04/89/66/704048966.db2.gz	UKRGFROVVWLUJF-ZDUSSCGKSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](N2CCOC2=O)C1	ZINC000852438601	704048969	/nfs/dbraw/zinc/04/89/69/704048969.db2.gz	UKRGFROVVWLUJF-ZDUSSCGKSA-N	1	1	321.333	1.630	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000852500944	704064071	/nfs/dbraw/zinc/06/40/71/704064071.db2.gz	UMCWJZTUEHMVBC-MSRIBSCDSA-N	1	1	309.322	1.952	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000852500944	704064073	/nfs/dbraw/zinc/06/40/73/704064073.db2.gz	UMCWJZTUEHMVBC-MSRIBSCDSA-N	1	1	309.322	1.952	20	5		DDBDMO
Cc1nn(C[N@@H+](C)CC2=CCCOC2)c2ncc([N+](=O)[O-])cc12	ZINC000853562166	704270929	/nfs/dbraw/zinc/27/09/29/704270929.db2.gz	FLGLCHVMKBMFRI-UHFFFAOYSA-N	1	1	317.349	1.884	20	5		DDBDMO
Cc1nn(C[N@H+](C)CC2=CCCOC2)c2ncc([N+](=O)[O-])cc12	ZINC000853562166	704270930	/nfs/dbraw/zinc/27/09/30/704270930.db2.gz	FLGLCHVMKBMFRI-UHFFFAOYSA-N	1	1	317.349	1.884	20	5		DDBDMO
COc1cc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c([N+](=O)[O-])cc1C	ZINC000853666483	704296150	/nfs/dbraw/zinc/29/61/50/704296150.db2.gz	NCRQVYFMMQZOFD-BETUJISGSA-N	1	1	323.393	1.803	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000821091295	704371190	/nfs/dbraw/zinc/37/11/90/704371190.db2.gz	AQQQGTGLIQSUEJ-JSGCOSHPSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000821091295	704371193	/nfs/dbraw/zinc/37/11/93/704371193.db2.gz	AQQQGTGLIQSUEJ-JSGCOSHPSA-N	1	1	321.377	1.661	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](CCOc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC000821323454	704390868	/nfs/dbraw/zinc/39/08/68/704390868.db2.gz	YHXYZVMNILFFTL-OKILXGFUSA-N	1	1	319.361	1.384	20	5		DDBDMO
C[C@H]([NH2+][C@H](CO)c1ccnn1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000858435833	704710861	/nfs/dbraw/zinc/71/08/61/704710861.db2.gz	UXTFIGKDAYFTIT-JOYOIKCWSA-N	1	1	305.338	1.295	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C[C@@H]12	ZINC000860159090	705117272	/nfs/dbraw/zinc/11/72/72/705117272.db2.gz	XHUWRJWBKHWSLP-DGCLKSJQSA-N	1	1	320.301	1.066	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])cc4c3OCOC4)C[C@@H]12	ZINC000860159090	705117277	/nfs/dbraw/zinc/11/72/77/705117277.db2.gz	XHUWRJWBKHWSLP-DGCLKSJQSA-N	1	1	320.301	1.066	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000823152737	705154022	/nfs/dbraw/zinc/15/40/22/705154022.db2.gz	XDLHWFIIRJJQQB-GFCCVEGCSA-N	1	1	301.387	1.049	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000874845931	705200494	/nfs/dbraw/zinc/20/04/94/705200494.db2.gz	YUROPSXLQFQSHA-HUUCEWRRSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000823987724	705350319	/nfs/dbraw/zinc/35/03/19/705350319.db2.gz	QREMFNOKEWKNCH-MWLCHTKSSA-N	1	1	307.354	1.781	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000824369055	705437641	/nfs/dbraw/zinc/43/76/41/705437641.db2.gz	VANYXIZMURAWIG-STQMWFEESA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000824658085	705500852	/nfs/dbraw/zinc/50/08/52/705500852.db2.gz	IHRIOANFWJBDNE-LBPRGKRZSA-N	1	1	323.397	1.336	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825505810	705683711	/nfs/dbraw/zinc/68/37/11/705683711.db2.gz	WJPDOLFFQPLBBE-IUODEOHRSA-N	1	1	321.377	1.476	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])ccc1F	ZINC000826867946	705887631	/nfs/dbraw/zinc/88/76/31/705887631.db2.gz	NOKKPJLUBYUDKS-LLVKDONJSA-N	1	1	307.325	1.948	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827265996	705963499	/nfs/dbraw/zinc/96/34/99/705963499.db2.gz	JKJMPYWRRUFQBX-AAEUAGOBSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CC[N@@H+]2C)C1	ZINC000827358353	705985129	/nfs/dbraw/zinc/98/51/29/705985129.db2.gz	XRYPVLAMQDANTA-FZMZJTMJSA-N	1	1	304.350	1.464	20	5		DDBDMO
C[C@@H]1[C@H](O)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000832226048	706875462	/nfs/dbraw/zinc/87/54/62/706875462.db2.gz	SPKJLPROBRZLST-NOZJJQNGSA-N	1	1	311.313	1.518	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000880433020	706974201	/nfs/dbraw/zinc/97/42/01/706974201.db2.gz	SSEABQYWVCCHAV-QLFBSQMISA-N	1	1	310.350	1.364	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880444473	706978629	/nfs/dbraw/zinc/97/86/29/706978629.db2.gz	TVZZITQGGWNCGF-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880529354	707006016	/nfs/dbraw/zinc/00/60/16/707006016.db2.gz	ALMXZUWXDKTOLB-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@@H]2CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880529354	707006017	/nfs/dbraw/zinc/00/60/17/707006017.db2.gz	ALMXZUWXDKTOLB-SWLSCSKDSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@@H](NCC(=O)N1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872029211	707282208	/nfs/dbraw/zinc/28/22/08/707282208.db2.gz	PBKITWNCUBXMOJ-LLVKDONJSA-N	1	1	324.356	1.159	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCO[C@H](C(F)F)CC2)c1	ZINC000872271348	707358482	/nfs/dbraw/zinc/35/84/82/707358482.db2.gz	NSPFZMJJCOXLJG-STQMWFEESA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCO[C@H](C(F)F)CC2)c1	ZINC000872271348	707358488	/nfs/dbraw/zinc/35/84/88/707358488.db2.gz	NSPFZMJJCOXLJG-STQMWFEESA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271629	707359040	/nfs/dbraw/zinc/35/90/40/707359040.db2.gz	TUFFVRFWRTWCJL-OLZOCXBDSA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@H](C(F)F)CC2)cc1	ZINC000872271629	707359051	/nfs/dbraw/zinc/35/90/51/707359051.db2.gz	TUFFVRFWRTWCJL-OLZOCXBDSA-N	1	1	316.304	1.984	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000836944583	707552302	/nfs/dbraw/zinc/55/23/02/707552302.db2.gz	BAIFWSWFUAMCEW-UKRRQHHQSA-N	1	1	321.377	1.571	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)CC[C@@H]21	ZINC000872725087	707573461	/nfs/dbraw/zinc/57/34/61/707573461.db2.gz	ORLJVDWTQBFOKT-DOMZBBRYSA-N	1	1	315.377	1.928	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000882449715	707638492	/nfs/dbraw/zinc/63/84/92/707638492.db2.gz	YHTOKCBFACBWBR-UHFFFAOYSA-N	1	1	324.356	1.820	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1	ZINC000884824927	708388516	/nfs/dbraw/zinc/38/85/16/708388516.db2.gz	WEBSMVQTJHFXIF-UHFFFAOYSA-N	1	1	305.281	1.532	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)cc1[N+](=O)[O-]	ZINC000887938815	709172770	/nfs/dbraw/zinc/17/27/70/709172770.db2.gz	ANSMOYCGLFFRMB-BLLLJJGKSA-N	1	1	318.377	1.660	20	5		DDBDMO
CN1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])CC[N@H+](C)CC1	ZINC000888977762	709419289	/nfs/dbraw/zinc/41/92/89/709419289.db2.gz	NELINWYMDWMHCD-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
CN1CCN(C(=O)c2c(F)cccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000888977762	709419292	/nfs/dbraw/zinc/41/92/92/709419292.db2.gz	NELINWYMDWMHCD-UHFFFAOYSA-N	1	1	324.356	1.053	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000892144410	710379919	/nfs/dbraw/zinc/37/99/19/710379919.db2.gz	OAHJCJKAVALSSE-JQWIXIFHSA-N	1	1	308.338	1.274	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3cccc([N+](=O)[O-])c3N)C[C@@]2(C)C1	ZINC000913281651	713190717	/nfs/dbraw/zinc/19/07/17/713190717.db2.gz	BKXWVECRULBESX-IYBDPMFKSA-N	1	1	318.377	1.591	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCOC(=O)c2ccccc2[N+](=O)[O-])CCO1	ZINC000893392357	710634136	/nfs/dbraw/zinc/63/41/36/710634136.db2.gz	QUHPPNAJERUCQH-GFCCVEGCSA-N	1	1	308.334	1.862	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOC(=O)c2ccccc2[N+](=O)[O-])CCO1	ZINC000893392357	710634139	/nfs/dbraw/zinc/63/41/39/710634139.db2.gz	QUHPPNAJERUCQH-GFCCVEGCSA-N	1	1	308.334	1.862	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000928573536	713234620	/nfs/dbraw/zinc/23/46/20/713234620.db2.gz	QSXPSLVVJKOUQT-CYBMUJFWSA-N	1	1	318.377	1.629	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000928573536	713234621	/nfs/dbraw/zinc/23/46/21/713234621.db2.gz	QSXPSLVVJKOUQT-CYBMUJFWSA-N	1	1	318.377	1.629	20	5		DDBDMO
[NH3+]CC1([C@H]2CCCCN2CCn2ccc([N+](=O)[O-])n2)CCC1	ZINC000903813816	711289393	/nfs/dbraw/zinc/28/93/93/711289393.db2.gz	ISANSSAZXPNXSK-CYBMUJFWSA-N	1	1	307.398	1.775	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccccc1	ZINC000913687342	713281416	/nfs/dbraw/zinc/28/14/16/713281416.db2.gz	HBUBDNMPYZUPBQ-BYNSBNAKSA-N	1	1	301.346	1.137	20	5		DDBDMO
C[C@H](CNC[C@@H](O)C[NH+]1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643918	712104982	/nfs/dbraw/zinc/10/49/82/712104982.db2.gz	OLJQCUOLNWWVKV-ZIAGYGMSSA-N	1	1	307.394	1.745	20	5		DDBDMO
C[C@H](C[NH2+]C[C@@H](O)CN1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643918	712104986	/nfs/dbraw/zinc/10/49/86/712104986.db2.gz	OLJQCUOLNWWVKV-ZIAGYGMSSA-N	1	1	307.394	1.745	20	5		DDBDMO
CC[N@H+](CCOC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000921047146	713709932	/nfs/dbraw/zinc/70/99/32/713709932.db2.gz	SPFPIBSJRIOKLX-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
CC[N@@H+](CCOC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000921047146	713709934	/nfs/dbraw/zinc/70/99/34/713709934.db2.gz	SPFPIBSJRIOKLX-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
COC(=O)/C=C(/C)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989010	713729902	/nfs/dbraw/zinc/72/99/02/713729902.db2.gz	POUJFPYDXUQZKY-RDQDRAATSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C=C(/C)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989010	713729903	/nfs/dbraw/zinc/72/99/03/713729903.db2.gz	POUJFPYDXUQZKY-RDQDRAATSA-N	1	1	320.349	1.595	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC[N+](=O)[O-])C[C@H]1CNC(=O)OC(C)(C)C	ZINC000930684317	713895824	/nfs/dbraw/zinc/89/58/24/713895824.db2.gz	OVJANDGHURFVPJ-VXGBXAGGSA-N	1	1	301.387	1.746	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1C(=O)NC(C)(C)C	ZINC000932436611	714330829	/nfs/dbraw/zinc/33/08/29/714330829.db2.gz	YYOVMGAAMPFFPC-LBPRGKRZSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H]1C(=O)NC(C)(C)C	ZINC000932436611	714330830	/nfs/dbraw/zinc/33/08/30/714330830.db2.gz	YYOVMGAAMPFFPC-LBPRGKRZSA-N	1	1	323.397	1.479	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](C3CCOCC3)C2)c([N+](=O)[O-])n1	ZINC000933088975	714514798	/nfs/dbraw/zinc/51/47/98/714514798.db2.gz	NXFJITWUOQYZOJ-CYBMUJFWSA-N	1	1	308.382	1.967	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4ccc([N+](=O)[O-])cc4n3)C[C@H]21	ZINC001164667040	719385867	/nfs/dbraw/zinc/38/58/67/719385867.db2.gz	MNXYLSYULDGMCU-CABCVRRESA-N	1	1	314.345	1.662	20	5		DDBDMO
Cc1cnc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)c([N+](=O)[O-])c1	ZINC001164965307	722067828	/nfs/dbraw/zinc/06/78/28/722067828.db2.gz	INIOPPYVUTYPBE-OKILXGFUSA-N	1	1	318.377	1.598	20	5		DDBDMO
O=C(NCC[NH2+]CC/C=C/c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936868	742853981	/nfs/dbraw/zinc/85/39/81/742853981.db2.gz	VGZSLUAHJPXVKA-GMLRFVCHSA-N	1	1	303.362	1.461	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C[NH+](CCC3CC3)C2)CC1	ZINC001035704261	751790736	/nfs/dbraw/zinc/79/07/36/751790736.db2.gz	IJQSRLKRPWIOBT-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
Cc1cc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cs1	ZINC001002786563	743428160	/nfs/dbraw/zinc/42/81/60/743428160.db2.gz	BUWWPMVQJMTTOE-ZIAGYGMSSA-N	1	1	323.418	1.802	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC001183611607	743861233	/nfs/dbraw/zinc/86/12/33/743861233.db2.gz	LGADBJNWEDIHCS-SNVBAGLBSA-N	1	1	321.381	1.193	20	5		DDBDMO
NC(=O)c1cc(N2CCc3cc[nH+]c(N)c3C2)ccc1[N+](=O)[O-]	ZINC001187870822	744630113	/nfs/dbraw/zinc/63/01/13/744630113.db2.gz	FRJSTJRHJPBWFV-UHFFFAOYSA-N	1	1	313.317	1.234	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCn1cnnc1	ZINC001197458644	747179368	/nfs/dbraw/zinc/17/93/68/747179368.db2.gz	KMNSCUVRAZXQKW-NSHDSACASA-N	1	1	318.337	1.145	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCn1cnnc1	ZINC001197458644	747179374	/nfs/dbraw/zinc/17/93/74/747179374.db2.gz	KMNSCUVRAZXQKW-NSHDSACASA-N	1	1	318.337	1.145	20	5		DDBDMO
CO[C@@H]1CCOC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC001198111684	747384285	/nfs/dbraw/zinc/38/42/85/747384285.db2.gz	IPACLMWCYZNVTC-CHWSQXEVSA-N	1	1	306.322	1.365	20	5		DDBDMO
Cc1ncc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)s1	ZINC000996429705	749588806	/nfs/dbraw/zinc/58/88/06/749588806.db2.gz	SXLJFKAXWODRMS-CHWSQXEVSA-N	1	1	324.406	1.197	20	5		DDBDMO
O=C1CC[C@H]2[C@H](CC[N@@H+]2[C@@H]2CC[C@@H](C[N+](=O)[O-])C2)N1CC1CC1	ZINC001169019307	762199997	/nfs/dbraw/zinc/19/99/97/762199997.db2.gz	HOAZBEKFZLGCFT-WCVJEAGWSA-N	1	1	321.421	1.907	20	5		DDBDMO
CCOCc1nnn2c1C[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CCC2	ZINC001169024848	762202082	/nfs/dbraw/zinc/20/20/82/762202082.db2.gz	RNRAIWWWUDDCGA-STQMWFEESA-N	1	1	323.397	1.466	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1nccc(Br)c1[N+](=O)[O-]	ZINC001170900031	771898964	/nfs/dbraw/zinc/89/89/64/771898964.db2.gz	HIRSRMILQRRLPC-ZETCQYMHSA-N	1	1	304.148	1.188	20	5		DDBDMO
[NH3+]Cc1nc(=O)[nH]n1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172901205	776915709	/nfs/dbraw/zinc/91/57/09/776915709.db2.gz	KYATZUUXTSCEIH-NSHDSACASA-N	1	1	303.322	1.471	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1C[C@H](O)[C@@H](CO)C1)CC2	ZINC001172905987	776917310	/nfs/dbraw/zinc/91/73/10/776917310.db2.gz	VYWFWNLHZXMGFN-FMKPAKJESA-N	1	1	306.362	1.127	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC(=O)N2CCC[C@@H]2C1	ZINC001173235331	777064358	/nfs/dbraw/zinc/06/43/58/777064358.db2.gz	WEURANYEBVCLFG-IUODEOHRSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC(=O)N2CCC[C@@H]2C1	ZINC001173235331	777064363	/nfs/dbraw/zinc/06/43/63/777064363.db2.gz	WEURANYEBVCLFG-IUODEOHRSA-N	1	1	303.362	1.832	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC001173235758	777064995	/nfs/dbraw/zinc/06/49/95/777064995.db2.gz	ZBICMRKMGHMXAD-RABLLNBGSA-N	1	1	304.346	1.877	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)Nc1cccnn1)c1ccccc1[N+](=O)[O-]	ZINC001175890585	777945696	/nfs/dbraw/zinc/94/56/96/777945696.db2.gz	DGSPKDFILVQTPR-JTQLQIEISA-N	1	1	301.306	1.674	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001119413172	781442427	/nfs/dbraw/zinc/44/24/27/781442427.db2.gz	PBJHAYAPGGBKSI-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)(C)C)CC1	ZINC001121792105	858598112	/nfs/dbraw/zinc/59/81/12/858598112.db2.gz	QBCVQBDQRUMUPN-UHFFFAOYSA-N	1	1	310.402	1.385	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1	ZINC001141313641	860824250	/nfs/dbraw/zinc/82/42/50/860824250.db2.gz	HKBSOLALDJVALY-YEZGLVMTSA-N	1	1	319.336	1.863	20	5		DDBDMO
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2C[C@@H](F)C[C@H]2C1	ZINC001141313641	860824256	/nfs/dbraw/zinc/82/42/56/860824256.db2.gz	HKBSOLALDJVALY-YEZGLVMTSA-N	1	1	319.336	1.863	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@H]([N@@H+](C)C(C)C)C2)c([N+](=O)[O-])c1	ZINC001157010085	863515208	/nfs/dbraw/zinc/51/52/08/863515208.db2.gz	OGRWJRGDKWLRNA-LBPRGKRZSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOc1nc(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC001157271751	863700665	/nfs/dbraw/zinc/70/06/65/863700665.db2.gz	JEPFBZOOKHSRLO-YPMHNXCESA-N	1	1	306.366	1.919	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001330570313	864458330	/nfs/dbraw/zinc/45/83/30/864458330.db2.gz	AESZOOKKNROUAC-ZLDLUXBVSA-N	1	1	321.377	1.569	20	5		DDBDMO
CC/C(C)=C\C(=O)NCC1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001277049248	881869046	/nfs/dbraw/zinc/86/90/46/881869046.db2.gz	PXKAHENYPJYCKK-XFFZJAGNSA-N	1	1	321.381	1.423	20	5		DDBDMO
O=C(NCC1([NH2+]CCCc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001277055002	881907839	/nfs/dbraw/zinc/90/78/39/881907839.db2.gz	LDYAHLMRHMHVFU-CHWSQXEVSA-N	1	1	323.418	1.584	20	5		DDBDMO
Cn1c(=O)c([N+](=O)[O-])c(NCC[NH+]2CC=CC2)c2ccccc21	ZINC001334941646	867930999	/nfs/dbraw/zinc/93/09/99/867930999.db2.gz	JDNHCTGSOFWLOG-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c1[N+](=O)[O-]	ZINC001336797186	869148583	/nfs/dbraw/zinc/14/85/83/869148583.db2.gz	KBQVQJMIRGZCGM-HNNXBMFYSA-N	1	1	308.334	1.656	20	5		DDBDMO
CCOCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC001317205208	870466808	/nfs/dbraw/zinc/46/68/08/870466808.db2.gz	QQWMYNNIEXQGQS-FOLVSLTJSA-N	1	1	319.361	1.178	20	5		DDBDMO
C[NH+]1CCN(c2cc(Nc3cccc([N+](=O)[O-])c3)ncn2)CC1	ZINC001204416262	871097976	/nfs/dbraw/zinc/09/79/76/871097976.db2.gz	TWCSDIMKRIBKNH-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(N2CCC[C@H](Cc3[nH+]ccn3C)C2)n1	ZINC001306995043	871389998	/nfs/dbraw/zinc/38/99/98/871389998.db2.gz	JETQVFCEJLQDDN-LLVKDONJSA-N	1	1	304.354	1.521	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[NH+](CC2CCCCCC2)CC1	ZINC001313444795	871805891	/nfs/dbraw/zinc/80/58/91/871805891.db2.gz	KBSUGZQGFTWMSA-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)c1	ZINC001349696119	875311327	/nfs/dbraw/zinc/31/13/27/875311327.db2.gz	ZFCMKJFTIVKZTG-LERXQTSPSA-N	1	1	319.361	1.673	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@]12CC[N@@H+](C1)CCC2	ZINC001350052768	875518422	/nfs/dbraw/zinc/51/84/22/875518422.db2.gz	JOBISYGAMUTDHI-MRXNPFEDSA-N	1	1	303.362	1.739	20	5		DDBDMO
C[C@@H](CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1)[NH+](C)C	ZINC001353298241	877238496	/nfs/dbraw/zinc/23/84/96/877238496.db2.gz	RVQGSUCOYOXWPT-JSGCOSHPSA-N	1	1	311.382	1.264	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2C)C1	ZINC001355414039	878544341	/nfs/dbraw/zinc/54/43/41/878544341.db2.gz	ASNDSVMJQKZSSC-VXGBXAGGSA-N	1	1	310.402	1.321	20	5		DDBDMO
COC(=O)c1cc(O[C@H]2C[NH+]3CCC2CC3)c(F)cc1[N+](=O)[O-]	ZINC001229943725	884243730	/nfs/dbraw/zinc/24/37/30/884243730.db2.gz	UJWAJFFDSDRHCF-AWEZNQCLSA-N	1	1	324.308	1.994	20	5		DDBDMO
CCCOCC(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001235137893	888431757	/nfs/dbraw/zinc/43/17/57/888431757.db2.gz	SGJYTQPZRQTEHP-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
C[C@H](CNC(=O)c1cnc(N)c([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](C)C1	ZINC001290900460	913536689	/nfs/dbraw/zinc/53/66/89/913536689.db2.gz	UYGRNIOCIRWHMR-GHMZBOCLSA-N	1	1	321.381	1.422	20	5		DDBDMO
CS(=O)(=O)[C@@H]1CC[N@@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601272	896524960	/nfs/dbraw/zinc/52/49/60/896524960.db2.gz	XGZGQMQVTBZCOU-UONOGXRCSA-N	1	1	310.375	1.181	20	5		DDBDMO
CS(=O)(=O)[C@@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254601272	896524972	/nfs/dbraw/zinc/52/49/72/896524972.db2.gz	XGZGQMQVTBZCOU-UONOGXRCSA-N	1	1	310.375	1.181	20	5		DDBDMO
O=C1NCC[C@H]2C[N@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]12	ZINC001254608761	896530742	/nfs/dbraw/zinc/53/07/42/896530742.db2.gz	SLUNJKYSTNQONM-TUKIKUTGSA-N	1	1	301.346	1.130	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCOC3(CCOCC3)C1)C2	ZINC001254608086	896530992	/nfs/dbraw/zinc/53/09/92/896530992.db2.gz	OZUVYJOOAOLJIR-INIZCTEOSA-N	1	1	318.373	1.943	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCCO1	ZINC001254610928	896531745	/nfs/dbraw/zinc/53/17/45/896531745.db2.gz	MTWOTTIBRBDBGM-LSDHHAIUSA-N	1	1	320.345	1.326	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2C)C[C@@H]1C	ZINC001262864549	900401966	/nfs/dbraw/zinc/40/19/66/900401966.db2.gz	JVURDXUIZSQWNV-JTQLQIEISA-N	1	1	320.353	1.514	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC(C)C)C[C@H]1C	ZINC001263415595	900605716	/nfs/dbraw/zinc/60/57/16/900605716.db2.gz	HFMFGEIQCCKOEG-CHWSQXEVSA-N	1	1	324.429	1.802	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[C@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC001293928023	914778140	/nfs/dbraw/zinc/77/81/40/914778140.db2.gz	LVTLVHMJSRGTFY-SNVBAGLBSA-N	1	1	321.333	1.662	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000295628503	529381810	/nfs/dbraw/zinc/38/18/10/529381810.db2.gz	FRPFWRQAHCRYGM-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000295628503	529381811	/nfs/dbraw/zinc/38/18/11/529381811.db2.gz	FRPFWRQAHCRYGM-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCO[C@H](Cc3ccccc3)C2)n1	ZINC000181545872	199314594	/nfs/dbraw/zinc/31/45/94/199314594.db2.gz	QQUHRFVBOZMCRQ-OAHLLOKOSA-N	1	1	316.361	1.735	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCO[C@H](Cc3ccccc3)C2)n1	ZINC000181545872	199314596	/nfs/dbraw/zinc/31/45/96/199314596.db2.gz	QQUHRFVBOZMCRQ-OAHLLOKOSA-N	1	1	316.361	1.735	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413244219	529810620	/nfs/dbraw/zinc/81/06/20/529810620.db2.gz	ZFBPQJSEUZTPPB-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O	ZINC000305806501	529983940	/nfs/dbraw/zinc/98/39/40/529983940.db2.gz	KCGGJXJDSFVEFN-HIFRSBDPSA-N	1	1	321.377	1.677	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000457118801	231993263	/nfs/dbraw/zinc/99/32/63/231993263.db2.gz	KKAHNYYGONKDKC-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000457118801	231993265	/nfs/dbraw/zinc/99/32/65/231993265.db2.gz	KKAHNYYGONKDKC-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
CC[N@H+]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000286770071	219157231	/nfs/dbraw/zinc/15/72/31/219157231.db2.gz	ZUBHWUABKQBPCV-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1nnc2n1CCOC2	ZINC000616488242	362720944	/nfs/dbraw/zinc/72/09/44/362720944.db2.gz	WEEJNEALMAQTCO-HYXAFXHYSA-N	1	1	315.333	1.520	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649274	210055367	/nfs/dbraw/zinc/05/53/67/210055367.db2.gz	ZAFAHVRAPVPCEE-AAEUAGOBSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000272649274	210055370	/nfs/dbraw/zinc/05/53/70/210055370.db2.gz	ZAFAHVRAPVPCEE-AAEUAGOBSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCn1cc(Cl)cn1)CC2	ZINC000459391721	233159111	/nfs/dbraw/zinc/15/91/11/233159111.db2.gz	CUCOOFPQTQCRCC-UHFFFAOYSA-N	1	1	307.741	1.898	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000155702427	186105161	/nfs/dbraw/zinc/10/51/61/186105161.db2.gz	JXPAUINOOLQWGD-UHFFFAOYSA-N	1	1	320.349	1.088	20	5		DDBDMO
CNC(=O)c1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000172717405	198140447	/nfs/dbraw/zinc/14/04/47/198140447.db2.gz	OCACZAGUXLVMJA-UHFFFAOYSA-N	1	1	317.349	1.283	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000047143874	352483097	/nfs/dbraw/zinc/48/30/97/352483097.db2.gz	ZWMQUKYXECALPP-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000069000607	353140285	/nfs/dbraw/zinc/14/02/85/353140285.db2.gz	XSJKHEUVCWQUTN-LBPRGKRZSA-N	1	1	306.366	1.849	20	5		DDBDMO
COCCC(=O)N1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000355725851	290984908	/nfs/dbraw/zinc/98/49/08/290984908.db2.gz	HIGSZXZCBZXWPP-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)CC1	ZINC000072562361	353202144	/nfs/dbraw/zinc/20/21/44/353202144.db2.gz	QKEOEJPRZOFNRE-UHFFFAOYSA-N	1	1	306.366	1.804	20	5		DDBDMO
CCc1ccc(C(=O)NCCC[N@@H+](C)CCOC)cc1[N+](=O)[O-]	ZINC000174087611	198290210	/nfs/dbraw/zinc/29/02/10/198290210.db2.gz	BRXHODJHYDMIGU-UHFFFAOYSA-N	1	1	323.393	1.855	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCCC1	ZINC000075645593	353373770	/nfs/dbraw/zinc/37/37/70/353373770.db2.gz	CUYUASODADZSNY-AWEZNQCLSA-N	1	1	312.370	1.043	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C1	ZINC000078583679	353523105	/nfs/dbraw/zinc/52/31/05/353523105.db2.gz	ZQJYWOQPFDPQLO-GFCCVEGCSA-N	1	1	320.393	1.732	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000081128186	353653892	/nfs/dbraw/zinc/65/38/92/353653892.db2.gz	CHJBGEOSVBZVHU-KFWWJZLASA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000081128186	353653897	/nfs/dbraw/zinc/65/38/97/353653897.db2.gz	CHJBGEOSVBZVHU-KFWWJZLASA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])C1	ZINC000081128186	353653888	/nfs/dbraw/zinc/65/38/88/353653888.db2.gz	CHJBGEOSVBZVHU-KFWWJZLASA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@H+](Cc1cccnc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182251020	199410270	/nfs/dbraw/zinc/41/02/70/199410270.db2.gz	VKRYPAIRIDIRFO-CQSZACIVSA-N	1	1	317.345	1.862	20	5		DDBDMO
C[C@@H](CNC(=O)NCc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000105199266	353934716	/nfs/dbraw/zinc/93/47/16/353934716.db2.gz	WERRSDFBIMWHMK-NSHDSACASA-N	1	1	306.366	1.877	20	5		DDBDMO
CC(C)[NH2+]CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000151751925	354186838	/nfs/dbraw/zinc/18/68/38/354186838.db2.gz	LSNVGXVWOHFUHX-UHFFFAOYSA-N	1	1	305.338	1.589	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157312714	354224373	/nfs/dbraw/zinc/22/43/73/354224373.db2.gz	OOLNTIGGWVKKCX-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC000157312714	354224377	/nfs/dbraw/zinc/22/43/77/354224377.db2.gz	OOLNTIGGWVKKCX-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[C@H]1C[C@@H]([NH3+])CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237517481	354343022	/nfs/dbraw/zinc/34/30/22/354343022.db2.gz	ZSGAGBBGMRRYHH-IUCAKERBSA-N	1	1	303.322	1.423	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000315940042	354498130	/nfs/dbraw/zinc/49/81/30/354498130.db2.gz	YOSOYYFXRYHQLI-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000315940042	354498131	/nfs/dbraw/zinc/49/81/31/354498131.db2.gz	YOSOYYFXRYHQLI-LLVKDONJSA-N	1	1	306.366	1.803	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000589198449	354972743	/nfs/dbraw/zinc/97/27/43/354972743.db2.gz	MWZPFVALOZDOKN-UHFFFAOYSA-N	1	1	321.377	1.892	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](CC(N)=O)C2)c1	ZINC000589517082	354998533	/nfs/dbraw/zinc/99/85/33/354998533.db2.gz	TZQFXYPMBVDGCI-SNVBAGLBSA-N	1	1	321.333	1.079	20	5		DDBDMO
COc1cc(CN2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])cc1F	ZINC000590011038	355040153	/nfs/dbraw/zinc/04/01/53/355040153.db2.gz	GHOUWWSSBDIVIL-IINYFYTJSA-N	1	1	309.341	1.878	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3Cl)[C@@H]2C1	ZINC000590446517	355099743	/nfs/dbraw/zinc/09/97/43/355099743.db2.gz	WBWYIZYCOOEZEF-SMDDNHRTSA-N	1	1	323.780	1.953	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)cn1	ZINC000590685650	355146655	/nfs/dbraw/zinc/14/66/55/355146655.db2.gz	HYNULAHNTKCNMM-CQSZACIVSA-N	1	1	306.366	1.681	20	5		DDBDMO
CCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@H]1CC[N@@H+](C)C1	ZINC000592830309	355705853	/nfs/dbraw/zinc/70/58/53/355705853.db2.gz	CSPWISRYVJKJMR-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
CCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@@H]1CC[N@@H+](C)C1	ZINC000592831447	355707361	/nfs/dbraw/zinc/70/73/61/355707361.db2.gz	MMQODIRDNHIOOR-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)C2CCC2)c1	ZINC000593025088	355772710	/nfs/dbraw/zinc/77/27/10/355772710.db2.gz	OPRPVTUBWMCFNP-UHFFFAOYSA-N	1	1	308.334	1.728	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594603135	356261704	/nfs/dbraw/zinc/26/17/04/356261704.db2.gz	KTNIOQNXNNKBMC-QWHCGFSZSA-N	1	1	314.345	1.398	20	5		DDBDMO
CCC[N@@H+](CC)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000080791375	192190726	/nfs/dbraw/zinc/19/07/26/192190726.db2.gz	JFJKFWJHLGVCFG-UHFFFAOYSA-N	1	1	315.395	1.605	20	5		DDBDMO
CC[N@H+]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000595535544	356538268	/nfs/dbraw/zinc/53/82/68/356538268.db2.gz	HBYFIXNVSDTIEY-ZDUSSCGKSA-N	1	1	308.382	1.173	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1C[N@H+]1CC[C@@H](Cn2ccnn2)C1	ZINC000595608765	356575933	/nfs/dbraw/zinc/57/59/33/356575933.db2.gz	VQSYUPMGLBXCAZ-LLVKDONJSA-N	1	1	305.313	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000595742403	356631361	/nfs/dbraw/zinc/63/13/61/356631361.db2.gz	FYZPQKPVSCLEMH-HBYGRHMLSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000595742403	356631365	/nfs/dbraw/zinc/63/13/65/356631365.db2.gz	FYZPQKPVSCLEMH-HBYGRHMLSA-N	1	1	307.350	1.482	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@H]3NC(=O)CC[C@H]3C2)cc1[N+](=O)[O-]	ZINC000595744273	356632466	/nfs/dbraw/zinc/63/24/66/356632466.db2.gz	VHQBGQPZIFARMN-QWHCGFSZSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760092	356640999	/nfs/dbraw/zinc/64/09/99/356640999.db2.gz	SAAVOGBZDSXQDV-NHYWBVRUSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760092	356641003	/nfs/dbraw/zinc/64/10/03/356641003.db2.gz	SAAVOGBZDSXQDV-NHYWBVRUSA-N	1	1	305.334	1.502	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000595857494	356680099	/nfs/dbraw/zinc/68/00/99/356680099.db2.gz	XVYUXKYSJBHEFP-JGZJWPJOSA-N	1	1	318.333	1.855	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000595857494	356680102	/nfs/dbraw/zinc/68/01/02/356680102.db2.gz	XVYUXKYSJBHEFP-JGZJWPJOSA-N	1	1	318.333	1.855	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1COCC[NH2+]1	ZINC000237257642	202207386	/nfs/dbraw/zinc/20/73/86/202207386.db2.gz	HSDOCWANYOEXFU-GFCCVEGCSA-N	1	1	313.741	1.195	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)ccc1[N+](=O)[O-]	ZINC000597574950	357234895	/nfs/dbraw/zinc/23/48/95/357234895.db2.gz	JEJUEPKJRNKHDZ-WDEREUQCSA-N	1	1	310.329	1.192	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000597680586	357282301	/nfs/dbraw/zinc/28/23/01/357282301.db2.gz	WYNCABKWTXFAGG-LLVKDONJSA-N	1	1	322.365	1.248	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000597669415	357276292	/nfs/dbraw/zinc/27/62/92/357276292.db2.gz	SWZDMYLSNMDUGE-ZDUSSCGKSA-N	1	1	307.350	1.871	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000597669415	357276295	/nfs/dbraw/zinc/27/62/95/357276295.db2.gz	SWZDMYLSNMDUGE-ZDUSSCGKSA-N	1	1	307.350	1.871	20	5		DDBDMO
CCN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)[C@H]1CC[N@@H+](C)C1	ZINC000597946292	357394588	/nfs/dbraw/zinc/39/45/88/357394588.db2.gz	NKFYEUQTEJYECG-ZDUSSCGKSA-N	1	1	323.397	1.351	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000598454588	357589517	/nfs/dbraw/zinc/58/95/17/357589517.db2.gz	WZCONPTVWWWYCE-OAHLLOKOSA-N	1	1	319.361	1.266	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000598595181	357646753	/nfs/dbraw/zinc/64/67/53/357646753.db2.gz	GUVMBIIUJKWFGM-NSHDSACASA-N	1	1	320.349	1.673	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCC([NH+]2CCOCC2)CC1	ZINC000599103277	357816377	/nfs/dbraw/zinc/81/63/77/357816377.db2.gz	IDPZDXSLZFUYBN-UHFFFAOYSA-N	1	1	323.397	1.421	20	5		DDBDMO
Cn1c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)ccc1[N+](=O)[O-]	ZINC000600472774	358234305	/nfs/dbraw/zinc/23/43/05/358234305.db2.gz	QIGCQVQDHVAZKR-LBPRGKRZSA-N	1	1	306.366	1.680	20	5		DDBDMO
CC(C)[C@@H]1CNCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000600715090	358292506	/nfs/dbraw/zinc/29/25/06/358292506.db2.gz	RILSLGAYESUCLY-HNNXBMFYSA-N	1	1	320.393	1.853	20	5		DDBDMO
CC(C)[C@@H]1CNCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000600715090	358292511	/nfs/dbraw/zinc/29/25/11/358292511.db2.gz	RILSLGAYESUCLY-HNNXBMFYSA-N	1	1	320.393	1.853	20	5		DDBDMO
Cc1cn(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(C)[nH+]1	ZINC000601080114	358397928	/nfs/dbraw/zinc/39/79/28/358397928.db2.gz	LTDOJWXBXKFFOK-UHFFFAOYSA-N	1	1	300.318	1.997	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181120015	199254601	/nfs/dbraw/zinc/25/46/01/199254601.db2.gz	JGITYEIENSIIIX-UHFFFAOYSA-N	1	1	317.349	1.892	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)[C@@H](CO)C1	ZINC000601979301	358763742	/nfs/dbraw/zinc/76/37/42/358763742.db2.gz	DIPHERIWOVCYNT-SNVBAGLBSA-N	1	1	317.292	1.309	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)[C@@H](CO)C1	ZINC000601979301	358763743	/nfs/dbraw/zinc/76/37/43/358763743.db2.gz	DIPHERIWOVCYNT-SNVBAGLBSA-N	1	1	317.292	1.309	20	5		DDBDMO
CCC(=O)N[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602770893	359178290	/nfs/dbraw/zinc/17/82/90/359178290.db2.gz	ZQTXUZYMLRJDHL-GFCCVEGCSA-N	1	1	309.370	1.090	20	5		DDBDMO
CC(C)c1ccc(CN2CC[N@@H+](C)C[C@H]2CO)cc1[N+](=O)[O-]	ZINC000602716948	359145561	/nfs/dbraw/zinc/14/55/61/359145561.db2.gz	VZYGJYPHRFUOEA-AWEZNQCLSA-N	1	1	307.394	1.827	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@H](C)C(=O)NC(C)(C)C	ZINC000602815662	359212190	/nfs/dbraw/zinc/21/21/90/359212190.db2.gz	FOWZWGKTNWPINC-SNVBAGLBSA-N	1	1	311.386	1.335	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](C)C(=O)NC(C)(C)C	ZINC000602815662	359212193	/nfs/dbraw/zinc/21/21/93/359212193.db2.gz	FOWZWGKTNWPINC-SNVBAGLBSA-N	1	1	311.386	1.335	20	5		DDBDMO
C[N@H+]1CCN(C(=O)NCc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000603431022	359636010	/nfs/dbraw/zinc/63/60/10/359636010.db2.gz	JJBNBJVQSHETAA-UHFFFAOYSA-N	1	1	306.366	1.830	20	5		DDBDMO
O=C(NCC[C@H]1CCC[NH2+]C1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000237879886	202377027	/nfs/dbraw/zinc/37/70/27/202377027.db2.gz	ZMVDIVYJPJASPB-SNVBAGLBSA-N	1	1	317.349	1.591	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CC(C)(C)O	ZINC000188688284	200287478	/nfs/dbraw/zinc/28/74/78/200287478.db2.gz	OSJCNIZGLJEERF-GFCCVEGCSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1cccc([N+](=O)[O-])c1	ZINC000189412223	200396672	/nfs/dbraw/zinc/39/66/72/200396672.db2.gz	OQYCCHPAVWFUGG-ZDUSSCGKSA-N	1	1	307.394	1.872	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000609383095	360302790	/nfs/dbraw/zinc/30/27/90/360302790.db2.gz	IZNVBMPHZPZDAV-CYBMUJFWSA-N	1	1	319.361	1.818	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000609399729	360304308	/nfs/dbraw/zinc/30/43/08/360304308.db2.gz	MLENLWSTPZLRND-AWEZNQCLSA-N	1	1	318.377	1.878	20	5		DDBDMO
CN1CCC([N@@H+](CCO)CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000609284391	360288266	/nfs/dbraw/zinc/28/82/66/360288266.db2.gz	TXJMNHXHKZTNRG-UHFFFAOYSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2sccc2[N+](=O)[O-])CC1	ZINC000611413830	360714658	/nfs/dbraw/zinc/71/46/58/360714658.db2.gz	ZDCIRLQOTITMGJ-LLVKDONJSA-N	1	1	324.406	1.399	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000194913718	201311999	/nfs/dbraw/zinc/31/19/99/201311999.db2.gz	WNJWEJQFEBYLFK-GFCCVEGCSA-N	1	1	323.397	1.487	20	5		DDBDMO
COc1c(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440432	364010087	/nfs/dbraw/zinc/01/00/87/364010087.db2.gz	GRFLTXONQVHRKC-MFKMUULPSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1c(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000619440432	364010089	/nfs/dbraw/zinc/01/00/89/364010089.db2.gz	GRFLTXONQVHRKC-MFKMUULPSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)C1CCOCC1	ZINC000275461291	212348562	/nfs/dbraw/zinc/34/85/62/212348562.db2.gz	BWLGWJFJSMCASL-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000262606727	203348319	/nfs/dbraw/zinc/34/83/19/203348319.db2.gz	ZGLPHFSHTJEFLM-NXEZZACHSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[C@H]1c2ccsc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266382012	205304391	/nfs/dbraw/zinc/30/43/91/205304391.db2.gz	AYSUYPNZTOOVQW-JQWIXIFHSA-N	1	1	322.390	1.833	20	5		DDBDMO
CCOc1ccc(NC(=O)CN2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000023991024	182371594	/nfs/dbraw/zinc/37/15/94/182371594.db2.gz	VSPMGWNOSGLVNQ-UHFFFAOYSA-N	1	1	322.365	1.179	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000105824041	194137653	/nfs/dbraw/zinc/13/76/53/194137653.db2.gz	VOFRVNBOCMZUAN-ZIAGYGMSSA-N	1	1	307.394	1.524	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000339226008	250351988	/nfs/dbraw/zinc/35/19/88/250351988.db2.gz	DLMMVQVNBYOBMI-NSHDSACASA-N	1	1	321.333	1.418	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CC(N)=O)C(C)C	ZINC000063483185	184282895	/nfs/dbraw/zinc/28/28/95/184282895.db2.gz	LEYDHUZLAGXUOH-UHFFFAOYSA-N	1	1	322.365	1.428	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[NH2+]Cc3ccccc32)c1[N+](=O)[O-]	ZINC000269169687	207291000	/nfs/dbraw/zinc/29/10/00/207291000.db2.gz	HKYHDRKRLQABMP-UHFFFAOYSA-N	1	1	301.306	1.376	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000408199439	285079874	/nfs/dbraw/zinc/07/98/74/285079874.db2.gz	SDWBDZIYOLXBMJ-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC[N@H+]2CCOC[C@H]2C1	ZINC000408199439	285079876	/nfs/dbraw/zinc/07/98/76/285079876.db2.gz	SDWBDZIYOLXBMJ-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000157498804	197192301	/nfs/dbraw/zinc/19/23/01/197192301.db2.gz	PCJVMRFPBCKNCU-UHFFFAOYSA-N	1	1	309.366	1.678	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C1CC1)[C@H]1CNCCO1	ZINC000422718200	533222182	/nfs/dbraw/zinc/22/21/82/533222182.db2.gz	PIEMKJNPXZSSRX-CVEARBPZSA-N	1	1	321.377	1.460	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000444348967	533399484	/nfs/dbraw/zinc/39/94/84/533399484.db2.gz	CPIADANUQANLFB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000444348967	533399486	/nfs/dbraw/zinc/39/94/86/533399486.db2.gz	CPIADANUQANLFB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2CCC[N@@H+](C)CC2)c([N+](=O)[O-])cc1F	ZINC000294409919	533517962	/nfs/dbraw/zinc/51/79/62/533517962.db2.gz	QARCCAKRWKGESV-UHFFFAOYSA-N	1	1	311.313	1.520	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1C(N)=O	ZINC000068369196	406636740	/nfs/dbraw/zinc/63/67/40/406636740.db2.gz	HJCFPSSDWGSHHR-CYBMUJFWSA-N	1	1	320.349	1.182	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@@H](C[NH+]2CCOCC2)C1	ZINC000069744288	406766794	/nfs/dbraw/zinc/76/67/94/406766794.db2.gz	OGPPXIYQBQUKMQ-LBPRGKRZSA-N	1	1	323.349	1.372	20	5		DDBDMO
C[C@H]1C[C@H](N(C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000123191410	407322326	/nfs/dbraw/zinc/32/23/26/407322326.db2.gz	LUXHWLWXCDWBQL-SMDDNHRTSA-N	1	1	320.393	1.608	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(OC)ccc1[N+](=O)[O-]	ZINC000067298489	407270386	/nfs/dbraw/zinc/27/03/86/407270386.db2.gz	QHBPDEFNJHUYKR-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000098104769	407306144	/nfs/dbraw/zinc/30/61/44/407306144.db2.gz	XPICEYVYJPLXJZ-SNVBAGLBSA-N	1	1	309.370	1.098	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076091	407346782	/nfs/dbraw/zinc/34/67/82/407346782.db2.gz	DYBGGNXVQRNWFN-QWRGUYRKSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076091	407346784	/nfs/dbraw/zinc/34/67/84/407346784.db2.gz	DYBGGNXVQRNWFN-QWRGUYRKSA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000107632171	407377487	/nfs/dbraw/zinc/37/74/87/407377487.db2.gz	NBTYALDRBNCRQO-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCN1CCOCC1	ZINC000255558765	407473099	/nfs/dbraw/zinc/47/30/99/407473099.db2.gz	WDAYHAZRIKAWCK-XQRVVYSFSA-N	1	1	305.378	1.872	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706295	407480387	/nfs/dbraw/zinc/48/03/87/407480387.db2.gz	MLBHCVWKULZFMP-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706295	407480400	/nfs/dbraw/zinc/48/04/00/407480400.db2.gz	MLBHCVWKULZFMP-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706295	407480402	/nfs/dbraw/zinc/48/04/02/407480402.db2.gz	MLBHCVWKULZFMP-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@H]2C(C)C)c1[N+](=O)[O-]	ZINC000185706295	407480408	/nfs/dbraw/zinc/48/04/08/407480408.db2.gz	MLBHCVWKULZFMP-NSHDSACASA-N	1	1	309.370	1.293	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000185725314	407486796	/nfs/dbraw/zinc/48/67/96/407486796.db2.gz	ULPXXBLXQSENTR-KOLCDFICSA-N	1	1	308.338	1.108	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000112925727	407447214	/nfs/dbraw/zinc/44/72/14/407447214.db2.gz	OJHYPUBBUMRDPW-UHFFFAOYSA-N	1	1	308.382	1.855	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000185910968	407535348	/nfs/dbraw/zinc/53/53/48/407535348.db2.gz	YGHSNHKDMOOOOU-HNNXBMFYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000185910968	407535354	/nfs/dbraw/zinc/53/53/54/407535354.db2.gz	YGHSNHKDMOOOOU-HNNXBMFYSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000114188013	407550273	/nfs/dbraw/zinc/55/02/73/407550273.db2.gz	FXFZWVBSSBXKJX-DZGCQCFKSA-N	1	1	321.377	1.819	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)NCC[N@@H+](C)C(C)C	ZINC000171161979	407615151	/nfs/dbraw/zinc/61/51/51/407615151.db2.gz	KUXWNUSDRNFLNH-UHFFFAOYSA-N	1	1	324.381	1.743	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1)C1CC1	ZINC000152783021	407687850	/nfs/dbraw/zinc/68/78/50/407687850.db2.gz	NAGGURHPINTMTK-UHFFFAOYSA-N	1	1	321.333	1.804	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc(C(=O)OC)cc([N+](=O)[O-])c1)C1CC1	ZINC000152783021	407687856	/nfs/dbraw/zinc/68/78/56/407687856.db2.gz	NAGGURHPINTMTK-UHFFFAOYSA-N	1	1	321.333	1.804	20	5		DDBDMO
CC[NH+](CC)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])CC(C)C	ZINC000152903766	407712451	/nfs/dbraw/zinc/71/24/51/407712451.db2.gz	IMUCKVAKTAKJPA-NSHDSACASA-N	1	1	311.386	1.804	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000261902501	407663444	/nfs/dbraw/zinc/66/34/44/407663444.db2.gz	GQXFJRPPJZSNQN-HNNXBMFYSA-N	1	1	312.329	1.777	20	5		DDBDMO
CC[N@@H+](CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000118121041	407894120	/nfs/dbraw/zinc/89/41/20/407894120.db2.gz	CSHTZRZYACTLHS-UHFFFAOYSA-N	1	1	320.349	1.134	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000268162937	407923423	/nfs/dbraw/zinc/92/34/23/407923423.db2.gz	ILSBHFSSDNCDSJ-MFKMUULPSA-N	1	1	319.361	1.816	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000153987520	407945138	/nfs/dbraw/zinc/94/51/38/407945138.db2.gz	DRSVDKDIDQUWJW-UHFFFAOYSA-N	1	1	319.321	1.363	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024087	408024612	/nfs/dbraw/zinc/02/46/12/408024612.db2.gz	LNIAOFZVFUROPF-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@H](C)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024087	408024620	/nfs/dbraw/zinc/02/46/20/408024620.db2.gz	LNIAOFZVFUROPF-MGPQQGTHSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000245603911	408026081	/nfs/dbraw/zinc/02/60/81/408026081.db2.gz	XKLIMMWUUVNKCH-ZFWWWQNUSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000245603911	408026116	/nfs/dbraw/zinc/02/61/16/408026116.db2.gz	XKLIMMWUUVNKCH-ZFWWWQNUSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000245603911	408026122	/nfs/dbraw/zinc/02/61/22/408026122.db2.gz	XKLIMMWUUVNKCH-ZFWWWQNUSA-N	1	1	322.409	1.419	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181888846	408049356	/nfs/dbraw/zinc/04/93/56/408049356.db2.gz	KDVUQCYUCGMXRW-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181888846	408049363	/nfs/dbraw/zinc/04/93/63/408049363.db2.gz	KDVUQCYUCGMXRW-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](c1cccc(O)c1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245452279	407988168	/nfs/dbraw/zinc/98/81/68/407988168.db2.gz	QFZOFCAXHORIPK-XHDPSFHLSA-N	1	1	320.349	1.551	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000190034275	408150654	/nfs/dbraw/zinc/15/06/54/408150654.db2.gz	XWDDTNNSCJNEMO-UHFFFAOYSA-N	1	1	323.349	1.246	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CC2(CO)CC2)c([N+](=O)[O-])c1	ZINC000190034275	408150660	/nfs/dbraw/zinc/15/06/60/408150660.db2.gz	XWDDTNNSCJNEMO-UHFFFAOYSA-N	1	1	323.349	1.246	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000190169645	408182341	/nfs/dbraw/zinc/18/23/41/408182341.db2.gz	FONRFWMXFAYBPV-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
C[NH+]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000121354935	408190655	/nfs/dbraw/zinc/19/06/55/408190655.db2.gz	CDIBHVKTTSNDBK-UHFFFAOYSA-N	1	1	302.334	1.393	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000190405237	408237850	/nfs/dbraw/zinc/23/78/50/408237850.db2.gz	ROEFFTLLCMCLJV-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCN(C)CC1	ZINC000122188160	408264132	/nfs/dbraw/zinc/26/41/32/408264132.db2.gz	FHFLWMBJHQWIOK-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176221237	408314598	/nfs/dbraw/zinc/31/45/98/408314598.db2.gz	SHWWDMWFIMONNO-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@H]1O	ZINC000246751975	408332808	/nfs/dbraw/zinc/33/28/08/408332808.db2.gz	OOWAGRPRUYSLNB-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269394927	408294215	/nfs/dbraw/zinc/29/42/15/408294215.db2.gz	MRUDOKGZYJESRZ-NSHDSACASA-N	1	1	323.397	1.855	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000269394927	408294220	/nfs/dbraw/zinc/29/42/20/408294220.db2.gz	MRUDOKGZYJESRZ-NSHDSACASA-N	1	1	323.397	1.855	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269394927	408294224	/nfs/dbraw/zinc/29/42/24/408294224.db2.gz	MRUDOKGZYJESRZ-NSHDSACASA-N	1	1	323.397	1.855	20	5		DDBDMO
CC[N@@H+]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000264169486	408387131	/nfs/dbraw/zinc/38/71/31/408387131.db2.gz	VHNIJCNIDYSQGI-UHFFFAOYSA-N	1	1	313.379	1.311	20	5		DDBDMO
CC[N@H+]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000264169486	408387138	/nfs/dbraw/zinc/38/71/38/408387138.db2.gz	VHNIJCNIDYSQGI-UHFFFAOYSA-N	1	1	313.379	1.311	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176714154	408422106	/nfs/dbraw/zinc/42/21/06/408422106.db2.gz	RSEYAPWAGBUPLH-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CCO)C(C)C	ZINC000177034652	408502106	/nfs/dbraw/zinc/50/21/06/408502106.db2.gz	YHDGLFUAYQULMA-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@H]12	ZINC000248621839	408601296	/nfs/dbraw/zinc/60/12/96/408601296.db2.gz	NBERQTNIEKNCIX-KPXOXKRLSA-N	1	1	315.333	1.280	20	5		DDBDMO
C[C@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000248450325	408567585	/nfs/dbraw/zinc/56/75/85/408567585.db2.gz	IPDLHFBVUAHXBB-QWHCGFSZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000248450325	408567590	/nfs/dbraw/zinc/56/75/90/408567590.db2.gz	IPDLHFBVUAHXBB-QWHCGFSZSA-N	1	1	324.377	1.834	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000265202226	408578853	/nfs/dbraw/zinc/57/88/53/408578853.db2.gz	REIWBFUYTHTKIP-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000265202226	408578856	/nfs/dbraw/zinc/57/88/56/408578856.db2.gz	REIWBFUYTHTKIP-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000265202226	408578861	/nfs/dbraw/zinc/57/88/61/408578861.db2.gz	REIWBFUYTHTKIP-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000265443820	408654875	/nfs/dbraw/zinc/65/48/75/408654875.db2.gz	ZZLILLFOZUOFOH-GFCCVEGCSA-N	1	1	322.365	1.745	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1O	ZINC000270855085	408710168	/nfs/dbraw/zinc/71/01/68/408710168.db2.gz	HGYXFZWRMWGFDJ-FZMZJTMJSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000251665686	408784223	/nfs/dbraw/zinc/78/42/23/408784223.db2.gz	LGRKVBSWWMXUKK-MNOVXSKESA-N	1	1	322.365	1.546	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[C@H]1C	ZINC000251655667	408784244	/nfs/dbraw/zinc/78/42/44/408784244.db2.gz	HTRFWMIFWMOBLC-XJKCOSOUSA-N	1	1	324.377	1.691	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000265756982	408772276	/nfs/dbraw/zinc/77/22/76/408772276.db2.gz	GITOOJMKOJQUNZ-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)C1CC1	ZINC000290802662	408835614	/nfs/dbraw/zinc/83/56/14/408835614.db2.gz	QAMMDGPRACTLPS-AWEZNQCLSA-N	1	1	316.361	1.913	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CCCOCC1	ZINC000189385351	163098477	/nfs/dbraw/zinc/09/84/77/163098477.db2.gz	SBUHPNNZXGMDMR-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCCOCC1	ZINC000189385351	163098478	/nfs/dbraw/zinc/09/84/78/163098478.db2.gz	SBUHPNNZXGMDMR-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)COc3ccccc3[N+](=O)[O-])C2)C1	ZINC000292111185	408981855	/nfs/dbraw/zinc/98/18/55/408981855.db2.gz	FVUZRMLNNBOQGI-MRXNPFEDSA-N	1	1	319.361	1.528	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](CCCCO)CC1	ZINC000293127464	409053758	/nfs/dbraw/zinc/05/37/58/409053758.db2.gz	MQDRTOMBAYZXIG-UHFFFAOYSA-N	1	1	307.350	1.125	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000293247942	409075559	/nfs/dbraw/zinc/07/55/59/409075559.db2.gz	BGXKXBUEIQABQF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000293247942	409075562	/nfs/dbraw/zinc/07/55/62/409075562.db2.gz	BGXKXBUEIQABQF-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000287831232	409099653	/nfs/dbraw/zinc/09/96/53/409099653.db2.gz	KSLNIWWPIUBWHD-JTQLQIEISA-N	1	1	322.365	1.979	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CC[N@@H+]1CCOC(C)(C)C1	ZINC000278877649	409106492	/nfs/dbraw/zinc/10/64/92/409106492.db2.gz	OJCKVXNKYYUCQI-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CC[N@H+]1CCOC(C)(C)C1	ZINC000278877649	409106495	/nfs/dbraw/zinc/10/64/95/409106495.db2.gz	OJCKVXNKYYUCQI-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000280213286	409270670	/nfs/dbraw/zinc/27/06/70/409270670.db2.gz	KUGLJSVMVKDTCZ-UHFFFAOYSA-N	1	1	304.350	1.385	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290555349	409443602	/nfs/dbraw/zinc/44/36/02/409443602.db2.gz	QXSWNAIFIVJIOC-NSHDSACASA-N	1	1	321.381	1.765	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000408093167	164225847	/nfs/dbraw/zinc/22/58/47/164225847.db2.gz	UZTNZWOQJBBREC-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000408093167	164225848	/nfs/dbraw/zinc/22/58/48/164225848.db2.gz	UZTNZWOQJBBREC-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000408111932	164231725	/nfs/dbraw/zinc/23/17/25/164231725.db2.gz	GFZLVOBDUXKHMM-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000408111932	164231727	/nfs/dbraw/zinc/23/17/27/164231727.db2.gz	GFZLVOBDUXKHMM-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000408130123	164236891	/nfs/dbraw/zinc/23/68/91/164236891.db2.gz	SVISMLNEOMLWSX-MWLCHTKSSA-N	1	1	309.370	1.191	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@@H+](C2CC2)C1	ZINC000295435931	409481449	/nfs/dbraw/zinc/48/14/49/409481449.db2.gz	VGXOQQZNLRBISC-NSHDSACASA-N	1	1	319.361	1.857	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC[N@H+](C2CC2)C1	ZINC000295435931	409481465	/nfs/dbraw/zinc/48/14/65/409481465.db2.gz	VGXOQQZNLRBISC-NSHDSACASA-N	1	1	319.361	1.857	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C[C@@H]21	ZINC000408463578	164339379	/nfs/dbraw/zinc/33/93/79/164339379.db2.gz	GJEABXPGXXOGLW-BMIGLBTASA-N	1	1	314.345	1.852	20	5		DDBDMO
Cc1nc(NCC(C)(C)[NH+]2C[C@@H](C)O[C@H](C)C2)ncc1[N+](=O)[O-]	ZINC000296453156	409564810	/nfs/dbraw/zinc/56/48/10/409564810.db2.gz	IWHUKZBRKONVSM-GHMZBOCLSA-N	1	1	323.397	1.993	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CCC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717253	409639846	/nfs/dbraw/zinc/63/98/46/409639846.db2.gz	NLQOMXZSKVCMJJ-SWLSCSKDSA-N	1	1	319.361	1.404	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304717253	409639852	/nfs/dbraw/zinc/63/98/52/409639852.db2.gz	NLQOMXZSKVCMJJ-SWLSCSKDSA-N	1	1	319.361	1.404	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000331520068	409593774	/nfs/dbraw/zinc/59/37/74/409593774.db2.gz	NVPNIHAVQHHCIW-GXFFZTMASA-N	1	1	319.361	1.816	20	5		DDBDMO
COc1c(C(=O)NCCCn2cc[nH+]c2C)cccc1[N+](=O)[O-]	ZINC000338173282	409773820	/nfs/dbraw/zinc/77/38/20/409773820.db2.gz	AHUFVDCJWUMCSZ-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000338181149	409780046	/nfs/dbraw/zinc/78/00/46/409780046.db2.gz	TZYFWVWPHXXWPL-UHFFFAOYSA-N	1	1	303.322	1.623	20	5		DDBDMO
COCCCNC(=O)[C@@H](C)[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338383396	409949684	/nfs/dbraw/zinc/94/96/84/409949684.db2.gz	RGMVDNZMULMPLJ-CYBMUJFWSA-N	1	1	323.393	1.610	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1	ZINC000357457932	410051409	/nfs/dbraw/zinc/05/14/09/410051409.db2.gz	WSCRCDGBGZIOJR-MRXNPFEDSA-N	1	1	316.361	1.913	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC000354791074	410087731	/nfs/dbraw/zinc/08/77/31/410087731.db2.gz	NURQQYQTHUEEAE-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C1(CCO)CCOCC1	ZINC000355009683	410237264	/nfs/dbraw/zinc/23/72/64/410237264.db2.gz	HSUZVYARSVKLDF-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357776431	410241218	/nfs/dbraw/zinc/24/12/18/410241218.db2.gz	VMGPUQCFVKOXRS-JTQLQIEISA-N	1	1	309.370	1.621	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(=O)n(CC[C@H]2CCCC[N@H+]2C)c1	ZINC000298505819	410263466	/nfs/dbraw/zinc/26/34/66/410263466.db2.gz	KSAFKPCFOSDHRG-GFCCVEGCSA-N	1	1	323.349	1.418	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)C(C)(C)c1ccccc1[N+](=O)[O-]	ZINC000346966864	410283081	/nfs/dbraw/zinc/28/30/81/410283081.db2.gz	GWYOWFGTSMCFKD-UHFFFAOYSA-N	1	1	323.393	1.303	20	5		DDBDMO
CCCC[N@@H+](CCO)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000298709687	410360040	/nfs/dbraw/zinc/36/00/40/410360040.db2.gz	YVYHSJZEQARVHC-ZDUSSCGKSA-N	1	1	312.366	1.429	20	5		DDBDMO
NC(=O)CC[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000339708510	410406649	/nfs/dbraw/zinc/40/66/49/410406649.db2.gz	MLPXYUYANZHDBX-CYBMUJFWSA-N	1	1	321.377	1.951	20	5		DDBDMO
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000299121874	410532314	/nfs/dbraw/zinc/53/23/14/410532314.db2.gz	VCXYSSMMDPPWCK-LBPRGKRZSA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000301664704	410767501	/nfs/dbraw/zinc/76/75/01/410767501.db2.gz	WAVNFUIILLUCDN-GFCCVEGCSA-N	1	1	321.381	1.298	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000330579871	410793336	/nfs/dbraw/zinc/79/33/36/410793336.db2.gz	IHOMCXCZHJJCMT-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
CO[C@H]1C[C@@H](CO)[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000330522658	410749773	/nfs/dbraw/zinc/74/97/73/410749773.db2.gz	JTYHFMVQIVLIIA-RYUDHWBXSA-N	1	1	300.742	1.830	20	5		DDBDMO
CO[C@H]1C[C@@H](CO)[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000330522658	410749781	/nfs/dbraw/zinc/74/97/81/410749781.db2.gz	JTYHFMVQIVLIIA-RYUDHWBXSA-N	1	1	300.742	1.830	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000301928575	410834060	/nfs/dbraw/zinc/83/40/60/410834060.db2.gz	ITWBEZSZLFXIID-AAEUAGOBSA-N	1	1	307.398	1.811	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000330675935	410869173	/nfs/dbraw/zinc/86/91/73/410869173.db2.gz	SVRUPTFWEWPPMD-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000330675935	410869180	/nfs/dbraw/zinc/86/91/80/410869180.db2.gz	SVRUPTFWEWPPMD-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000359783584	410876455	/nfs/dbraw/zinc/87/64/55/410876455.db2.gz	HVAGPFLYJSXNGN-LLVKDONJSA-N	1	1	311.386	1.661	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1NCCCn1cc[nH+]c1C	ZINC000337781789	410996662	/nfs/dbraw/zinc/99/66/62/410996662.db2.gz	BOXDZFAHKMVJDP-UHFFFAOYSA-N	1	1	317.349	1.962	20	5		DDBDMO
NC(=O)c1cccc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000341722585	411052689	/nfs/dbraw/zinc/05/26/89/411052689.db2.gz	OLOKNUXTFQUVRJ-MNOVXSKESA-N	1	1	304.350	1.732	20	5		DDBDMO
C[NH+](C)CCn1ccc(=NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]1	ZINC000344212749	411029296	/nfs/dbraw/zinc/02/92/96/411029296.db2.gz	NLRPOKCUTGIRHW-UHFFFAOYSA-N	1	1	321.312	1.744	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC[C@@H]([NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000331229620	411031152	/nfs/dbraw/zinc/03/11/52/411031152.db2.gz	ZQVZXPGNUWEFGC-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](C)[C@@H]1CO	ZINC000132908876	196295174	/nfs/dbraw/zinc/29/51/74/196295174.db2.gz	OGHXAYDOJRRBKF-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@@H]1CO	ZINC000132908876	196295176	/nfs/dbraw/zinc/29/51/76/196295176.db2.gz	OGHXAYDOJRRBKF-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1Cc1c(F)cccc1[N+](=O)[O-]	ZINC000419338961	226124319	/nfs/dbraw/zinc/12/43/19/226124319.db2.gz	ZPGZCUBKBBVYRX-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C2	ZINC000360416683	418429176	/nfs/dbraw/zinc/42/91/76/418429176.db2.gz	LEUPJUBUZCQEKH-UHFFFAOYSA-N	1	1	300.318	1.691	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N(C)CCC[NH+]1CCN(C)CC1	ZINC000360902997	418543689	/nfs/dbraw/zinc/54/36/89/418543689.db2.gz	ANPKSZIDFPIOIX-UHFFFAOYSA-N	1	1	324.429	1.193	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1	ZINC000360993553	418561538	/nfs/dbraw/zinc/56/15/38/418561538.db2.gz	CEEMJMYTMUQVEA-CYBMUJFWSA-N	1	1	321.377	1.690	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[N@@H+](C[C@@H](C)O)C[C@H]1C	ZINC000361006284	418563986	/nfs/dbraw/zinc/56/39/86/418563986.db2.gz	CHBKAXGVKDLERS-GHMZBOCLSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)n1	ZINC000191578119	222105352	/nfs/dbraw/zinc/10/53/52/222105352.db2.gz	XGVUUMKLQRWSDV-LLVKDONJSA-N	1	1	307.354	1.122	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)n1	ZINC000191578119	222105353	/nfs/dbraw/zinc/10/53/53/222105353.db2.gz	XGVUUMKLQRWSDV-LLVKDONJSA-N	1	1	307.354	1.122	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1	ZINC000367563093	418610802	/nfs/dbraw/zinc/61/08/02/418610802.db2.gz	KEGFLVVEXWMUCH-LLVKDONJSA-N	1	1	321.381	1.417	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](O)C1(C)C	ZINC000361420460	418649724	/nfs/dbraw/zinc/64/97/24/418649724.db2.gz	NORSSFFMCPMNDR-ZDUSSCGKSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](O)C1(C)C	ZINC000361420460	418649727	/nfs/dbraw/zinc/64/97/27/418649727.db2.gz	NORSSFFMCPMNDR-ZDUSSCGKSA-N	1	1	307.350	1.687	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1c([N+](=O)[O-])ncn1C)C2	ZINC000367796404	418636088	/nfs/dbraw/zinc/63/60/88/418636088.db2.gz	RIMFLMHQOWPCCW-HZMBPMFUSA-N	1	1	308.338	1.103	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000361575436	418682592	/nfs/dbraw/zinc/68/25/92/418682592.db2.gz	COHIBDCSPLAOBZ-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000361575436	418682594	/nfs/dbraw/zinc/68/25/94/418682594.db2.gz	COHIBDCSPLAOBZ-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362052227	418744959	/nfs/dbraw/zinc/74/49/59/418744959.db2.gz	DKEPZBCAXYRCFU-GRYCIOLGSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000371544174	418799475	/nfs/dbraw/zinc/79/94/75/418799475.db2.gz	DPLVYQAWWQXUDN-ZFWWWQNUSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)NC[C@@H]1CCCO1)c1ccccc1[N+](=O)[O-]	ZINC000411476556	418908180	/nfs/dbraw/zinc/90/81/80/418908180.db2.gz	BXFANZRKSKCEJC-RYUDHWBXSA-N	1	1	307.350	1.541	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420930533	419361160	/nfs/dbraw/zinc/36/11/60/419361160.db2.gz	CKRPACNPDIIOSE-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420930533	419361163	/nfs/dbraw/zinc/36/11/63/419361163.db2.gz	CKRPACNPDIIOSE-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3CCO)n2)c1	ZINC000426200169	419401146	/nfs/dbraw/zinc/40/11/46/419401146.db2.gz	VZTAEKORWPZOBX-GFCCVEGCSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCCC[C@H]1O	ZINC000426208546	419404930	/nfs/dbraw/zinc/40/49/30/419404930.db2.gz	DCHAZUAHTWZTGM-NUEKZKHPSA-N	1	1	324.377	1.570	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000420983403	419411409	/nfs/dbraw/zinc/41/14/09/419411409.db2.gz	ZJKYAIIYGUOWRL-VIFPVBQESA-N	1	1	311.313	1.310	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000420983403	419411418	/nfs/dbraw/zinc/41/14/18/419411418.db2.gz	ZJKYAIIYGUOWRL-VIFPVBQESA-N	1	1	311.313	1.310	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1CCC[N@H+]1C	ZINC000421003172	419442019	/nfs/dbraw/zinc/44/20/19/419442019.db2.gz	MWACXAADCICEON-CQSZACIVSA-N	1	1	321.377	1.987	20	5		DDBDMO
CC[N@H+](Cc1occc1C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000412024956	419566834	/nfs/dbraw/zinc/56/68/34/419566834.db2.gz	GUWXLXFFMFKWEU-ZDUSSCGKSA-N	1	1	308.338	1.576	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103857	419662599	/nfs/dbraw/zinc/66/25/99/419662599.db2.gz	ZKUCPNWBEXUSAX-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103857	419662607	/nfs/dbraw/zinc/66/26/07/419662607.db2.gz	ZKUCPNWBEXUSAX-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421704626	419685961	/nfs/dbraw/zinc/68/59/61/419685961.db2.gz	PHLOZSZMLBFASN-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cc([N+](=O)[O-])c(C)cc1C	ZINC000421866782	419750631	/nfs/dbraw/zinc/75/06/31/419750631.db2.gz	OHYNEDHQJUIZLZ-UHFFFAOYSA-N	1	1	309.366	1.256	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)n1	ZINC000418994792	420040962	/nfs/dbraw/zinc/04/09/62/420040962.db2.gz	IEJFYMGDEXZMRF-CHWSQXEVSA-N	1	1	308.382	1.498	20	5		DDBDMO
[NH3+]Cc1nc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)cs1	ZINC000430505814	420124757	/nfs/dbraw/zinc/12/47/57/420124757.db2.gz	SJECAUZPTOEBGJ-UHFFFAOYSA-N	1	1	318.358	1.709	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[C@](C)(C[NH3+])C2)c1[N+](=O)[O-]	ZINC000423982722	420289291	/nfs/dbraw/zinc/28/92/91/420289291.db2.gz	JYXUIJJXOBJBCT-YMTOWFKASA-N	1	1	309.370	1.327	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)ccc1[N+](=O)[O-]	ZINC000457003922	420585993	/nfs/dbraw/zinc/58/59/93/420585993.db2.gz	XQWBSIAZQZOJSO-ZDUSSCGKSA-N	1	1	314.345	1.720	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000443966225	420753999	/nfs/dbraw/zinc/75/39/99/420753999.db2.gz	SMQZZPDZDTUZHF-UHFFFAOYSA-N	1	1	318.381	2.171	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000455669591	421051379	/nfs/dbraw/zinc/05/13/79/421051379.db2.gz	VFJDORFYKOKZIO-UHFFFAOYSA-N	1	1	309.370	1.493	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)C[C@@H]1C	ZINC000456006772	421088849	/nfs/dbraw/zinc/08/88/49/421088849.db2.gz	CCMFUHDDPZHRBU-QWRGUYRKSA-N	1	1	321.381	1.586	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@](CO)(COC)C1	ZINC000449699582	421063168	/nfs/dbraw/zinc/06/31/68/421063168.db2.gz	QJMYPRMEUDLMQI-MRXNPFEDSA-N	1	1	324.377	1.824	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@](CO)(COC)C1	ZINC000449699582	421063170	/nfs/dbraw/zinc/06/31/70/421063170.db2.gz	QJMYPRMEUDLMQI-MRXNPFEDSA-N	1	1	324.377	1.824	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1C1CCCCC1)c1c[nH]nc1[N+](=O)[O-]	ZINC000549370669	421500121	/nfs/dbraw/zinc/50/01/21/421500121.db2.gz	ZYFYAQRZTCAJNI-GFCCVEGCSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(NC[C@H]3CC[N@H+](C4CC4)C3)c21	ZINC000566530357	421606761	/nfs/dbraw/zinc/60/67/61/421606761.db2.gz	PRMPWZMAXKUPMJ-LLVKDONJSA-N	1	1	313.361	2.434	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000530623648	421610290	/nfs/dbraw/zinc/61/02/90/421610290.db2.gz	WXFSGVUURYPOLB-ZDUSSCGKSA-N	1	1	304.350	1.674	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000530623645	421610732	/nfs/dbraw/zinc/61/07/32/421610732.db2.gz	WXFSGVUURYPOLB-CYBMUJFWSA-N	1	1	304.350	1.674	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757794	421665743	/nfs/dbraw/zinc/66/57/43/421665743.db2.gz	IPIDADDNTKXNEM-QWRGUYRKSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757794	421665746	/nfs/dbraw/zinc/66/57/46/421665746.db2.gz	IPIDADDNTKXNEM-QWRGUYRKSA-N	1	1	313.379	1.279	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2nccs2)c1	ZINC000519772395	421726131	/nfs/dbraw/zinc/72/61/31/421726131.db2.gz	UFCKSCBCZFRQSR-LLVKDONJSA-N	1	1	309.347	1.581	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cn2C)CC[N@H+](C2CC2)C1	ZINC000581232821	421926851	/nfs/dbraw/zinc/92/68/51/421926851.db2.gz	RTOWWDVZVMSBLY-LLVKDONJSA-N	1	1	306.366	1.490	20	5		DDBDMO
Cc1cc(C(=O)N2CCN(c3[nH]cc[nH+]3)CC2)cc([N+](=O)[O-])c1	ZINC000582041264	422094921	/nfs/dbraw/zinc/09/49/21/422094921.db2.gz	JJKDHJSNCDGDHR-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
Nc1ccc(NC[C@@H]2CCC[N@@H+](CC3CC3)C2)nc1[N+](=O)[O-]	ZINC000596569634	422380793	/nfs/dbraw/zinc/38/07/93/422380793.db2.gz	ALUCPJIEJRPVRY-LBPRGKRZSA-N	1	1	305.382	2.106	20	5		DDBDMO
CCN(C(=O)c1ccnc(NC)c1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000598038607	422393362	/nfs/dbraw/zinc/39/33/62/422393362.db2.gz	FCMPLJQRGHXUOY-NSHDSACASA-N	1	1	321.381	1.588	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2cccnc2)C1	ZINC000578765183	422643571	/nfs/dbraw/zinc/64/35/71/422643571.db2.gz	LFHJZLNFMFEOMD-AWEZNQCLSA-N	1	1	314.345	1.641	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000344617089	272071106	/nfs/dbraw/zinc/07/11/06/272071106.db2.gz	QDNTVTJHJKHVBL-NSHDSACASA-N	1	1	309.370	1.028	20	5		DDBDMO
CCOc1cc(N2CCC[N@H+]([C@@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000345044511	272162134	/nfs/dbraw/zinc/16/21/34/272162134.db2.gz	QCRSMDNZSQHBJY-ZDUSSCGKSA-N	1	1	323.393	1.886	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1c(Cl)cccc1[N+](=O)[O-]	ZINC000452121879	274348340	/nfs/dbraw/zinc/34/83/40/274348340.db2.gz	GZWMJFQRBIJJHY-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000354005081	298337137	/nfs/dbraw/zinc/33/71/37/298337137.db2.gz	DWZGMRVZFRCVOQ-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000354205240	298363219	/nfs/dbraw/zinc/36/32/19/298363219.db2.gz	QVVHZJYVJUNCGR-VHSXEESVSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000354205240	298363221	/nfs/dbraw/zinc/36/32/21/298363221.db2.gz	QVVHZJYVJUNCGR-VHSXEESVSA-N	1	1	321.333	1.992	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000362718760	300122386	/nfs/dbraw/zinc/12/23/86/300122386.db2.gz	AZIPGFODBMBENO-GJZGRUSLSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@H]2CO1)c1cccc([N+](=O)[O-])c1	ZINC000362718760	300122387	/nfs/dbraw/zinc/12/23/87/300122387.db2.gz	AZIPGFODBMBENO-GJZGRUSLSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000368009102	300932333	/nfs/dbraw/zinc/93/23/33/300932333.db2.gz	WDSTZLRHOUCQPD-SNVBAGLBSA-N	1	1	303.240	1.413	20	5		DDBDMO
Cc1ccc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973691	301114942	/nfs/dbraw/zinc/11/49/42/301114942.db2.gz	KZIZBVIZJKFZQW-GZBFAFLISA-N	1	1	303.362	1.989	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973691	301114944	/nfs/dbraw/zinc/11/49/44/301114944.db2.gz	KZIZBVIZJKFZQW-GZBFAFLISA-N	1	1	303.362	1.989	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000369136219	301135646	/nfs/dbraw/zinc/13/56/46/301135646.db2.gz	ARLBGOKATIXBSH-JTQLQIEISA-N	1	1	321.381	1.627	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)C1	ZINC000369212340	301146313	/nfs/dbraw/zinc/14/63/13/301146313.db2.gz	DBYCYRXNNFDKPX-AWEZNQCLSA-N	1	1	319.409	1.393	20	5		DDBDMO
C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000378310170	302310348	/nfs/dbraw/zinc/31/03/48/302310348.db2.gz	UHKFMKLURDJEOO-NWDGAFQWSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000378310170	302310351	/nfs/dbraw/zinc/31/03/51/302310351.db2.gz	UHKFMKLURDJEOO-NWDGAFQWSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000378310170	302310352	/nfs/dbraw/zinc/31/03/52/302310352.db2.gz	UHKFMKLURDJEOO-NWDGAFQWSA-N	1	1	315.333	1.146	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000362080131	307013159	/nfs/dbraw/zinc/01/31/59/307013159.db2.gz	JVAFAVVYXFCJES-LBPRGKRZSA-N	1	1	306.366	1.917	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC([C@@H]2CCCOC2)CC1	ZINC000365013373	307056345	/nfs/dbraw/zinc/05/63/45/307056345.db2.gz	NZVDPNIZVYMFMR-CYBMUJFWSA-N	1	1	308.382	1.967	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000366316043	307070496	/nfs/dbraw/zinc/07/04/96/307070496.db2.gz	TXZBQYXNATVWHL-MNOVXSKESA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000366316043	307070497	/nfs/dbraw/zinc/07/04/97/307070497.db2.gz	TXZBQYXNATVWHL-MNOVXSKESA-N	1	1	323.736	1.343	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN2CC[NH+]([C@@H]3CCOC3)CC2)c1	ZINC000367413793	307092678	/nfs/dbraw/zinc/09/26/78/307092678.db2.gz	WHPMIYMUABUIBG-CVEARBPZSA-N	1	1	321.377	1.035	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000371659987	307155614	/nfs/dbraw/zinc/15/56/14/307155614.db2.gz	KIQXWXCHRLSYGX-RZFFKMDDSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000371659987	307155615	/nfs/dbraw/zinc/15/56/15/307155615.db2.gz	KIQXWXCHRLSYGX-RZFFKMDDSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000371659987	307155616	/nfs/dbraw/zinc/15/56/16/307155616.db2.gz	KIQXWXCHRLSYGX-RZFFKMDDSA-N	1	1	318.377	1.073	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327765	307205916	/nfs/dbraw/zinc/20/59/16/307205916.db2.gz	IORIEYDAQSQEDX-SWLSCSKDSA-N	1	1	319.361	1.668	20	5		DDBDMO
C[C@@H]1COCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327765	307205917	/nfs/dbraw/zinc/20/59/17/307205917.db2.gz	IORIEYDAQSQEDX-SWLSCSKDSA-N	1	1	319.361	1.668	20	5		DDBDMO
O=C1NCC[C@H]1CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000575192654	308273323	/nfs/dbraw/zinc/27/33/23/308273323.db2.gz	JMIKJCRHCFVURF-RYUDHWBXSA-N	1	1	319.365	1.002	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+]Cc1ncccc1F	ZINC000583079960	337236752	/nfs/dbraw/zinc/23/67/52/337236752.db2.gz	SMQYPEGWUZEKEU-LLVKDONJSA-N	1	1	321.308	1.658	20	5		DDBDMO
O=C(N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)[C@H]1CC1[N+](=O)[O-]	ZINC000374894933	483943951	/nfs/dbraw/zinc/94/39/51/483943951.db2.gz	OEBYETRWWZLCHN-XJFOESAGSA-N	1	1	307.325	1.053	20	5		DDBDMO
CC(C)OC[C@H](O)C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000493796297	484239236	/nfs/dbraw/zinc/23/92/36/484239236.db2.gz	OTSKTBCHCUMZAA-GXTWGEPZSA-N	1	1	324.381	1.262	20	5		DDBDMO
NC(=O)c1ccc(NCC[NH+]2CCSCC2)c([N+](=O)[O-])c1	ZINC000226231236	490701443	/nfs/dbraw/zinc/70/14/43/490701443.db2.gz	GTPNKGCMKWAVGW-UHFFFAOYSA-N	1	1	310.379	1.154	20	5		DDBDMO
C[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+](C2CC2)C1	ZINC000296803084	533943509	/nfs/dbraw/zinc/94/35/09/533943509.db2.gz	UJYZUUNVNROAIO-ZDUSSCGKSA-N	1	1	320.393	1.173	20	5		DDBDMO
CCCNC(=O)[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157855424	519895979	/nfs/dbraw/zinc/89/59/79/519895979.db2.gz	URGHYPCOUJIGRW-LBPRGKRZSA-N	1	1	309.370	1.030	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+](CCCO)C1	ZINC000295916191	534704472	/nfs/dbraw/zinc/70/44/72/534704472.db2.gz	CQVFZMVNUGKNOT-AWEZNQCLSA-N	1	1	321.377	1.100	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H](O)[C@@H](CO)C1	ZINC000414564655	527501739	/nfs/dbraw/zinc/50/17/39/527501739.db2.gz	XVSSKKCMRHFVMZ-SOKLDJIMSA-N	1	1	306.362	1.673	20	5		DDBDMO
CCC[C@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000294877903	528244443	/nfs/dbraw/zinc/24/44/43/528244443.db2.gz	FROOQDVURRMWHN-HNNXBMFYSA-N	1	1	321.377	1.514	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000302456822	528311348	/nfs/dbraw/zinc/31/13/48/528311348.db2.gz	QPDDJNDBRQPHQA-STQMWFEESA-N	1	1	323.393	1.885	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000735856149	598298644	/nfs/dbraw/zinc/29/86/44/598298644.db2.gz	FMMFDZNRFPLYAI-UHFFFAOYSA-N	1	1	305.342	1.527	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](Cn3ccnn3)C2)c(C)c1[N+](=O)[O-]	ZINC000154904801	696939100	/nfs/dbraw/zinc/93/91/00/696939100.db2.gz	YQWCEPUHQQHXRJ-CYBMUJFWSA-N	1	1	319.369	1.369	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](Cn3ccnn3)C2)c(C)c1[N+](=O)[O-]	ZINC000154904801	696939101	/nfs/dbraw/zinc/93/91/01/696939101.db2.gz	YQWCEPUHQQHXRJ-CYBMUJFWSA-N	1	1	319.369	1.369	20	5		DDBDMO
Cc1noc(C)c1C[N@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000159741020	697312245	/nfs/dbraw/zinc/31/22/45/697312245.db2.gz	IKAWTQSVTTUQEO-UHFFFAOYSA-N	1	1	306.322	1.493	20	5		DDBDMO
Cc1noc(C)c1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000159741020	697312247	/nfs/dbraw/zinc/31/22/47/697312247.db2.gz	IKAWTQSVTTUQEO-UHFFFAOYSA-N	1	1	306.322	1.493	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582169	698121138	/nfs/dbraw/zinc/12/11/38/698121138.db2.gz	RVCURFPACBJKPP-UONOGXRCSA-N	1	1	307.350	1.358	20	5		DDBDMO
NC(=O)CC[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776583016	698121731	/nfs/dbraw/zinc/12/17/31/698121731.db2.gz	YNVFMJQMUPIYEW-IUODEOHRSA-N	1	1	321.377	1.606	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000776591750	698123519	/nfs/dbraw/zinc/12/35/19/698123519.db2.gz	WMRATURRMVCFQH-IJEWVQPXSA-N	1	1	306.362	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@H](n4cncn4)C3)c2c1	ZINC000776778469	698139121	/nfs/dbraw/zinc/13/91/21/698139121.db2.gz	UUCIZJMBQGTZFD-ZDUSSCGKSA-N	1	1	313.321	1.441	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@H](n4cncn4)C3)c2c1	ZINC000776778469	698139125	/nfs/dbraw/zinc/13/91/25/698139125.db2.gz	UUCIZJMBQGTZFD-ZDUSSCGKSA-N	1	1	313.321	1.441	20	5		DDBDMO
CC1(C)CN(c2nc3ccccn3c2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000780630932	698540404	/nfs/dbraw/zinc/54/04/04/698540404.db2.gz	XEIZKJGCMOZRER-UHFFFAOYSA-N	1	1	319.365	1.135	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000725827393	699335544	/nfs/dbraw/zinc/33/55/44/699335544.db2.gz	SOECFYCHSPBRRT-SECBINFHSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CC[C@@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000725827393	699335548	/nfs/dbraw/zinc/33/55/48/699335548.db2.gz	SOECFYCHSPBRRT-SECBINFHSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000796575371	699939841	/nfs/dbraw/zinc/93/98/41/699939841.db2.gz	OILNKEAFOLEXGZ-NILFDRSVSA-N	1	1	310.350	1.100	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000761287773	700854620	/nfs/dbraw/zinc/85/46/20/700854620.db2.gz	DZHJGXANIJJJND-NSHDSACASA-N	1	1	318.333	1.705	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000761287773	700854622	/nfs/dbraw/zinc/85/46/22/700854622.db2.gz	DZHJGXANIJJJND-NSHDSACASA-N	1	1	318.333	1.705	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000762816617	700908219	/nfs/dbraw/zinc/90/82/19/700908219.db2.gz	RUNVJAVKSHJRHW-ZDUSSCGKSA-N	1	1	308.363	1.683	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)C1CC1	ZINC000767430303	701106335	/nfs/dbraw/zinc/10/63/35/701106335.db2.gz	QSLHBVRFYPMORQ-GFCCVEGCSA-N	1	1	304.350	1.845	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCCC[NH+]1CCOCC1	ZINC000804318068	701178109	/nfs/dbraw/zinc/17/81/09/701178109.db2.gz	XXSWWJVQWCYIPI-UHFFFAOYSA-N	1	1	310.310	1.637	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000804396400	701186037	/nfs/dbraw/zinc/18/60/37/701186037.db2.gz	HFJVLQHZTHVVKU-WDEREUQCSA-N	1	1	322.321	1.778	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000839689176	701784304	/nfs/dbraw/zinc/78/43/04/701784304.db2.gz	LEFMFKBVTJFPDQ-FMCLSXCISA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000839689176	701784309	/nfs/dbraw/zinc/78/43/09/701784309.db2.gz	LEFMFKBVTJFPDQ-FMCLSXCISA-N	1	1	323.418	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000839689176	701784314	/nfs/dbraw/zinc/78/43/14/701784314.db2.gz	LEFMFKBVTJFPDQ-FMCLSXCISA-N	1	1	323.418	1.912	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@](C)(CO)C1	ZINC000879262751	706633420	/nfs/dbraw/zinc/63/34/20/706633420.db2.gz	ZIIGSPRBXDKZJZ-SOUVJXGZSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3c(C(N)=O)cccc3[N+](=O)[O-])CC[C@H]21	ZINC000866206842	706648686	/nfs/dbraw/zinc/64/86/86/706648686.db2.gz	GDWRGYANPJTHCS-ZYHUDNBSSA-N	1	1	304.350	1.224	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000868927126	702389770	/nfs/dbraw/zinc/38/97/70/702389770.db2.gz	HZAALTVMUHVOFI-LBPRGKRZSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@H]1C[C@@H](C[NH3+])C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000843362908	702866800	/nfs/dbraw/zinc/86/68/00/702866800.db2.gz	UNHAUDYIRSHNQE-QWRGUYRKSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000866540343	706724610	/nfs/dbraw/zinc/72/46/10/706724610.db2.gz	LYAKAWKTDUMUGS-QMTHXVAHSA-N	1	1	321.352	1.875	20	5		DDBDMO
Cc1nn(CCC(=O)OCC[C@@H]2CC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000847826197	703473322	/nfs/dbraw/zinc/47/33/22/703473322.db2.gz	CBIKQEHPEWPSJU-ZDUSSCGKSA-N	1	1	324.381	1.683	20	5		DDBDMO
Nc1ccc2c(c1)OCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000866690182	706766248	/nfs/dbraw/zinc/76/62/48/706766248.db2.gz	VGLTZFUPGZPPPV-UHFFFAOYSA-N	1	1	303.322	1.268	20	5		DDBDMO
Nc1ccc2c(c1)OCC[N@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000866690182	706766249	/nfs/dbraw/zinc/76/62/49/706766249.db2.gz	VGLTZFUPGZPPPV-UHFFFAOYSA-N	1	1	303.322	1.268	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(C(=O)NCC(C)C)CC2)c1[N+](=O)[O-]	ZINC000851717395	703836188	/nfs/dbraw/zinc/83/61/88/703836188.db2.gz	RQRKJCKCADOUHU-UHFFFAOYSA-N	1	1	324.381	1.875	20	5		DDBDMO
CC1(C)OC[C@H](C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851843154	703868649	/nfs/dbraw/zinc/86/86/49/703868649.db2.gz	ATWWYMWDOLCOQL-AAEUAGOBSA-N	1	1	322.365	1.628	20	5		DDBDMO
O=C1N[C@H]2CC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000852010056	703903488	/nfs/dbraw/zinc/90/34/88/703903488.db2.gz	WAPSSWLTCRMIGG-PWSUYJOCSA-N	1	1	309.297	1.664	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C[C@@H]2CO1	ZINC000852010056	703903489	/nfs/dbraw/zinc/90/34/89/703903489.db2.gz	WAPSSWLTCRMIGG-PWSUYJOCSA-N	1	1	309.297	1.664	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)N1	ZINC000852298427	704001384	/nfs/dbraw/zinc/00/13/84/704001384.db2.gz	ZTBKXOMUWWTWNK-OAHLLOKOSA-N	1	1	317.345	1.498	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCC3=C(CCC(=O)N3)C2)cc1[N+](=O)[O-]	ZINC000852299867	704001987	/nfs/dbraw/zinc/00/19/87/704001987.db2.gz	FZJCPHIZPHQTSX-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC3=C(CCC(=O)N3)C2)cc1[N+](=O)[O-]	ZINC000852299867	704001990	/nfs/dbraw/zinc/00/19/90/704001990.db2.gz	FZJCPHIZPHQTSX-UHFFFAOYSA-N	1	1	317.345	1.973	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000852701692	704102789	/nfs/dbraw/zinc/10/27/89/704102789.db2.gz	DXFSUVZJJPASQZ-HZMBPMFUSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000852701692	704102792	/nfs/dbraw/zinc/10/27/92/704102792.db2.gz	DXFSUVZJJPASQZ-HZMBPMFUSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCCSCC1)c1cccc([N+](=O)[O-])c1	ZINC000870874766	704153816	/nfs/dbraw/zinc/15/38/16/704153816.db2.gz	SVEZAZNRDGFISM-AWEZNQCLSA-N	1	1	309.391	1.734	20	5		DDBDMO
CC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@@H]1CCOC1	ZINC000853515397	704256436	/nfs/dbraw/zinc/25/64/36/704256436.db2.gz	NQBLZVRCTNZFPY-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)[C@@H]1CCOC1	ZINC000853515397	704256439	/nfs/dbraw/zinc/25/64/39/704256439.db2.gz	NQBLZVRCTNZFPY-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@]1(CO)C[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000859821229	705013446	/nfs/dbraw/zinc/01/34/46/705013446.db2.gz	IUNKDTBXAUXSEI-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
C[C@]1(CO)C[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000859821229	705013452	/nfs/dbraw/zinc/01/34/52/705013452.db2.gz	IUNKDTBXAUXSEI-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1CCNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000874708254	705141572	/nfs/dbraw/zinc/14/15/72/705141572.db2.gz	KWCWURYCXMNOFC-LBPRGKRZSA-N	1	1	301.387	1.049	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1CCNC(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000874708254	705141575	/nfs/dbraw/zinc/14/15/75/705141575.db2.gz	KWCWURYCXMNOFC-LBPRGKRZSA-N	1	1	301.387	1.049	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000823152738	705154089	/nfs/dbraw/zinc/15/40/89/705154089.db2.gz	XDLHWFIIRJJQQB-LBPRGKRZSA-N	1	1	301.387	1.049	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000874828750	705187483	/nfs/dbraw/zinc/18/74/83/705187483.db2.gz	HTYIKJFPUPURPI-OLZOCXBDSA-N	1	1	322.340	1.625	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836391	705193888	/nfs/dbraw/zinc/19/38/88/705193888.db2.gz	CCQQCIVJAKQEKN-RYUDHWBXSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874836391	705193890	/nfs/dbraw/zinc/19/38/90/705193890.db2.gz	CCQQCIVJAKQEKN-RYUDHWBXSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874836391	705193894	/nfs/dbraw/zinc/19/38/94/705193894.db2.gz	CCQQCIVJAKQEKN-RYUDHWBXSA-N	1	1	321.381	1.579	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000825648458	705708989	/nfs/dbraw/zinc/70/89/89/705708989.db2.gz	SEXVJLHSIGNKOA-AWEZNQCLSA-N	1	1	307.350	1.240	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)NCc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000825648458	705708993	/nfs/dbraw/zinc/70/89/93/705708993.db2.gz	SEXVJLHSIGNKOA-AWEZNQCLSA-N	1	1	307.350	1.240	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])CC[C@@H]21	ZINC000827234541	705957457	/nfs/dbraw/zinc/95/74/57/705957457.db2.gz	YIUJSOWODZCCQP-OCCSQVGLSA-N	1	1	321.352	1.829	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3c(N)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827290328	705969620	/nfs/dbraw/zinc/96/96/20/705969620.db2.gz	SWEQCZYCCNCYMZ-JQWIXIFHSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C1CCC1	ZINC000863900626	706032836	/nfs/dbraw/zinc/03/28/36/706032836.db2.gz	BJSUHJGLLKNUKO-UHFFFAOYSA-N	1	1	303.362	1.964	20	5		DDBDMO
CC(=O)c1c(NC[C@@H](C)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000881907148	707418694	/nfs/dbraw/zinc/41/86/94/707418694.db2.gz	DBLMNXNKEKMFTF-GFCCVEGCSA-N	1	1	320.393	1.845	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000829449526	706334918	/nfs/dbraw/zinc/33/49/18/706334918.db2.gz	CEDNZBPSZOMRCU-QLFBSQMISA-N	1	1	303.362	1.909	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC000829455184	706336574	/nfs/dbraw/zinc/33/65/74/706336574.db2.gz	LCKGZXLVLWIIND-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
CC(C)[C@H](O)CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000878251192	706338851	/nfs/dbraw/zinc/33/88/51/706338851.db2.gz	HPDSOKAPRYAFNY-GXTWGEPZSA-N	1	1	308.382	1.883	20	5		DDBDMO
C[C@@H](CNC(=O)Cc1cccc(F)c1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000865142269	706362095	/nfs/dbraw/zinc/36/20/95/706362095.db2.gz	CFFKXGGMNIFBOU-JTQLQIEISA-N	1	1	309.341	1.875	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCO[C@H](C(F)(F)F)CC2)n1	ZINC000880047597	706863286	/nfs/dbraw/zinc/86/32/86/706863286.db2.gz	VFVRUGYUDHFUTL-VIFPVBQESA-N	1	1	308.260	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCO[C@H](C(F)(F)F)CC2)n1	ZINC000880047597	706863289	/nfs/dbraw/zinc/86/32/89/706863289.db2.gz	VFVRUGYUDHFUTL-VIFPVBQESA-N	1	1	308.260	1.445	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000880148203	706892744	/nfs/dbraw/zinc/89/27/44/706892744.db2.gz	SYCXPVRGVVWPLU-STQMWFEESA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H](NC[C@@H]1C[N@@H+](C)CCN1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036703	707284445	/nfs/dbraw/zinc/28/44/45/707284445.db2.gz	VKXWGKMFSIKDOI-NWDGAFQWSA-N	1	1	310.373	1.630	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000836948428	707553145	/nfs/dbraw/zinc/55/31/45/707553145.db2.gz	RFZWPUMJJBDNNX-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC(C)([NH+]3CCC3)CC2)c1[N+](=O)[O-]	ZINC000882503866	707670262	/nfs/dbraw/zinc/67/02/62/707670262.db2.gz	XXBPVFVCRYJUMX-UHFFFAOYSA-N	1	1	307.354	1.327	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(c2ccnc(F)c2[N+](=O)[O-])C[C@@H]1C	ZINC000882515764	707676446	/nfs/dbraw/zinc/67/64/46/707676446.db2.gz	LBDFPLIVMLETNU-PHIMTYICSA-N	1	1	312.345	1.674	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ccnc(F)c2[N+](=O)[O-])C[C@@H]1C	ZINC000882515764	707676448	/nfs/dbraw/zinc/67/64/48/707676448.db2.gz	LBDFPLIVMLETNU-PHIMTYICSA-N	1	1	312.345	1.674	20	5		DDBDMO
C[N@@H+](CCNc1c(Cl)cccc1[N+](=O)[O-])CCOCCO	ZINC000882952289	707868678	/nfs/dbraw/zinc/86/86/78/707868678.db2.gz	PIHIVJXXDYDKEJ-UHFFFAOYSA-N	1	1	317.773	1.601	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000882959938	707873370	/nfs/dbraw/zinc/87/33/70/707873370.db2.gz	UNGAMZIXRLKQSB-SNVBAGLBSA-N	1	1	308.338	1.591	20	5		DDBDMO
O=C(NC[C@H](c1cccs1)[NH+]1CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839461964	708049468	/nfs/dbraw/zinc/04/94/68/708049468.db2.gz	AFTAHLQBBVQCNW-IJLUTSLNSA-N	1	1	309.391	1.666	20	5		DDBDMO
CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+](C)CC1	ZINC000897099373	708229844	/nfs/dbraw/zinc/22/98/44/708229844.db2.gz	YXTODQIODJTRTB-UHFFFAOYSA-N	1	1	312.801	1.932	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]2(O)CC[N@H+](C)C2)c1C	ZINC000897397983	708315189	/nfs/dbraw/zinc/31/51/89/708315189.db2.gz	PENAQBOCEMSDCF-HNNXBMFYSA-N	1	1	307.350	1.008	20	5		DDBDMO
C[C@@](O)(C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)C(F)F	ZINC000885954222	708670528	/nfs/dbraw/zinc/67/05/28/708670528.db2.gz	RCOODJSXZFYZBG-CQSZACIVSA-N	1	1	315.320	1.733	20	5		DDBDMO
C[C@](O)(C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)C(F)F	ZINC000885954221	708670622	/nfs/dbraw/zinc/67/06/22/708670622.db2.gz	RCOODJSXZFYZBG-AWEZNQCLSA-N	1	1	315.320	1.733	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H](CN2CCOCC2)C1	ZINC000886192018	708711826	/nfs/dbraw/zinc/71/18/26/708711826.db2.gz	DIAAXUMHCBEPEN-CQSZACIVSA-N	1	1	320.393	1.534	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](CN2CCOCC2)C1	ZINC000886192018	708711827	/nfs/dbraw/zinc/71/18/27/708711827.db2.gz	DIAAXUMHCBEPEN-CQSZACIVSA-N	1	1	320.393	1.534	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2C[C@@H]3CSC[C@@H]3C2)c1	ZINC000886553844	708776859	/nfs/dbraw/zinc/77/68/59/708776859.db2.gz	WQCPYQCMYSXJAN-SCRDCRAPSA-N	1	1	324.402	1.629	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@]1(C)C[C@H](O)C[N@H+]1C	ZINC000900159758	709311152	/nfs/dbraw/zinc/31/11/52/709311152.db2.gz	PVFIATGNZBNBEY-WFASDCNBSA-N	1	1	307.350	1.008	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@H](C)C1	ZINC000910280396	709862258	/nfs/dbraw/zinc/86/22/58/709862258.db2.gz	QYAJVGDLARNIFZ-SNVBAGLBSA-N	1	1	324.356	1.872	20	5		DDBDMO
C[C@H](NC(=O)CN1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000928249878	713157445	/nfs/dbraw/zinc/15/74/45/713157445.db2.gz	URTNCHNZWJOFDW-LBPRGKRZSA-N	1	1	306.366	1.019	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@@H](C)C[NH+]1CCOCC1	ZINC000892621087	710471266	/nfs/dbraw/zinc/47/12/66/710471266.db2.gz	GQGDETGODLIWQW-LLVKDONJSA-N	1	1	310.354	1.379	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928446195	713200223	/nfs/dbraw/zinc/20/02/23/713200223.db2.gz	VCVPHJQOJPNRSR-TVQRCGJNSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000928453738	713204154	/nfs/dbraw/zinc/20/41/54/713204154.db2.gz	PVXJLFAKZKTQIB-KOLCDFICSA-N	1	1	321.333	1.188	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C(C)(C)C)C1	ZINC000912030201	711133293	/nfs/dbraw/zinc/13/32/93/711133293.db2.gz	AYMIKHFBKSBJJM-CYBMUJFWSA-N	1	1	308.382	1.736	20	5		DDBDMO
C[N@@H+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])C[C@H]1CO	ZINC000894881985	711307061	/nfs/dbraw/zinc/30/70/61/711307061.db2.gz	QCRFMVXEHAZYFD-NSHDSACASA-N	1	1	320.324	1.395	20	5		DDBDMO
C[N@H+]1CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])C[C@H]1CO	ZINC000894881985	711307065	/nfs/dbraw/zinc/30/70/65/711307065.db2.gz	QCRFMVXEHAZYFD-NSHDSACASA-N	1	1	320.324	1.395	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H](C)[C@](C)(CO)C2)c1[N+](=O)[O-]	ZINC000895455595	711516412	/nfs/dbraw/zinc/51/64/12/711516412.db2.gz	CFMMLIRKVBKSCM-BMIGLBTASA-N	1	1	310.350	1.759	20	5		DDBDMO
CCO[C@@H]1C[N@@H+](Cc2ccccc2)C[C@H]1CNCC[N+](=O)[O-]	ZINC000905290590	711994440	/nfs/dbraw/zinc/99/44/40/711994440.db2.gz	KMYDQPZXMZQUOZ-HZPDHXFCSA-N	1	1	307.394	1.390	20	5		DDBDMO
C[N@@H+](Cc1cn(CCn2cc([N+](=O)[O-])cn2)nn1)C(C)(C)C	ZINC000905802375	712149427	/nfs/dbraw/zinc/14/94/27/712149427.db2.gz	XENOKUVBFLHPIN-UHFFFAOYSA-N	1	1	307.358	1.313	20	5		DDBDMO
CN1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@@H+](C)CC1	ZINC000929115484	713549631	/nfs/dbraw/zinc/54/96/31/713549631.db2.gz	HZRWZINWYAGOPZ-UHFFFAOYSA-N	1	1	321.381	1.306	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000930093814	713754766	/nfs/dbraw/zinc/75/47/66/713754766.db2.gz	FSKIAVWRHXKTMN-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1	ZINC000930875223	713947643	/nfs/dbraw/zinc/94/76/43/713947643.db2.gz	LMBKRLRZBVXPQV-GFCCVEGCSA-N	1	1	321.381	1.667	20	5		DDBDMO
O=[N+]([O-])CC[N@@H+]1CC[C@H](Oc2cncc(Br)c2)C1	ZINC000930901430	713953419	/nfs/dbraw/zinc/95/34/19/713953419.db2.gz	MKXYHJSWWFUEQY-JTQLQIEISA-N	1	1	316.155	1.574	20	5		DDBDMO
O=[N+]([O-])CC[N@H+]1CC[C@H](Oc2cncc(Br)c2)C1	ZINC000930901430	713953421	/nfs/dbraw/zinc/95/34/21/713953421.db2.gz	MKXYHJSWWFUEQY-JTQLQIEISA-N	1	1	316.155	1.574	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000932455630	714336475	/nfs/dbraw/zinc/33/64/75/714336475.db2.gz	MGTPULJXCJEJCM-HNNXBMFYSA-N	1	1	321.377	1.963	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000932649079	714375843	/nfs/dbraw/zinc/37/58/43/714375843.db2.gz	PGYAFGDKHYMZSK-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000932649079	714375845	/nfs/dbraw/zinc/37/58/45/714375845.db2.gz	PGYAFGDKHYMZSK-LLVKDONJSA-N	1	1	308.334	1.988	20	5		DDBDMO
CC(C)(C)[C@@H]1CNC(=O)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000933825196	714676664	/nfs/dbraw/zinc/67/66/64/714676664.db2.gz	CSFVQFQVUIULKZ-AWEZNQCLSA-N	1	1	305.378	1.984	20	5		DDBDMO
CC(C)(C)[C@@H]1CNC(=O)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000933825196	714676667	/nfs/dbraw/zinc/67/66/67/714676667.db2.gz	CSFVQFQVUIULKZ-AWEZNQCLSA-N	1	1	305.378	1.984	20	5		DDBDMO
CN1CCN(CCOc2ccccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000933997054	714718584	/nfs/dbraw/zinc/71/85/84/714718584.db2.gz	SDXGVYWMRFKRNR-UHFFFAOYSA-N	1	1	322.409	1.153	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000925410421	714846943	/nfs/dbraw/zinc/84/69/43/714846943.db2.gz	RNDCEQFXXKGJLE-HNNXBMFYSA-N	1	1	318.377	1.973	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000351508207	719249909	/nfs/dbraw/zinc/24/99/09/719249909.db2.gz	GKEJBALPRLSIPC-GHMZBOCLSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000351508207	719249911	/nfs/dbraw/zinc/24/99/11/719249911.db2.gz	GKEJBALPRLSIPC-GHMZBOCLSA-N	1	1	322.365	1.695	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](C)[N@H+](C)C[C@@H]2C)n1	ZINC001164631980	719255843	/nfs/dbraw/zinc/25/58/43/719255843.db2.gz	GSTXIWXRZISQES-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)n1	ZINC001164631980	719255845	/nfs/dbraw/zinc/25/58/45/719255845.db2.gz	GSTXIWXRZISQES-UWVGGRQHSA-N	1	1	308.338	1.305	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ncnc4cc([N+](=O)[O-])ccc43)C[C@H]21	ZINC001164667332	719389424	/nfs/dbraw/zinc/38/94/24/719389424.db2.gz	NVBGKOPMJYIDNC-ZIAGYGMSSA-N	1	1	315.333	1.057	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001120873810	782202076	/nfs/dbraw/zinc/20/20/76/782202076.db2.gz	GYEXGHRHKQUKQF-LRDDRELGSA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@@H]1CN(C)CC[N@@H+]1C	ZINC001120873810	782202079	/nfs/dbraw/zinc/20/20/79/782202079.db2.gz	GYEXGHRHKQUKQF-LRDDRELGSA-N	1	1	322.409	1.787	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@@H](C)[C@@H]1CN(C)CC[N@H+]1C	ZINC001120873810	782202083	/nfs/dbraw/zinc/20/20/83/782202083.db2.gz	GYEXGHRHKQUKQF-LRDDRELGSA-N	1	1	322.409	1.787	20	5		DDBDMO
CC(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC001025684976	736820175	/nfs/dbraw/zinc/82/01/75/736820175.db2.gz	CLNARFRWAZCAIS-FICVDOATSA-N	1	1	303.362	1.797	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2nc(NCC3([NH+]4CCCC4)COC3)ccc12	ZINC001168442860	744900125	/nfs/dbraw/zinc/90/01/25/744900125.db2.gz	SHPNPIOELYJDKM-UHFFFAOYSA-N	1	1	317.349	1.748	20	5		DDBDMO
CCc1ccc(C[NH+]2CC(CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001031661428	747337522	/nfs/dbraw/zinc/33/75/22/747337522.db2.gz	XUYPBCOOIHLWOX-HZPDHXFCSA-N	1	1	317.389	1.462	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)c1cc[nH]c1	ZINC001031692138	747390539	/nfs/dbraw/zinc/39/05/39/747390539.db2.gz	JBLQATWFGOWFNX-UHFFFAOYSA-N	1	1	314.345	1.785	20	5		DDBDMO
COCCCCC[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001200471847	748265048	/nfs/dbraw/zinc/26/50/48/748265048.db2.gz	KQMGVOXPMIDOQE-ZIAGYGMSSA-N	1	1	313.398	1.049	20	5		DDBDMO
O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169026252	762203233	/nfs/dbraw/zinc/20/32/33/762203233.db2.gz	WOEASBNNHKOJIK-REWIBIJMSA-N	1	1	307.394	1.519	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCS1	ZINC001169046746	762204847	/nfs/dbraw/zinc/20/48/47/762204847.db2.gz	MKCKNRQCOBDCHI-WOPDTQHZSA-N	1	1	302.396	1.412	20	5		DDBDMO
CC(C)C[N@H+]1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cc2C1	ZINC001054265679	759370618	/nfs/dbraw/zinc/37/06/18/759370618.db2.gz	VRRMRHFCSOVVCW-HZPDHXFCSA-N	1	1	317.389	1.940	20	5		DDBDMO
CC(C)C[N@@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1	ZINC001054265679	759370629	/nfs/dbraw/zinc/37/06/29/759370629.db2.gz	VRRMRHFCSOVVCW-HZPDHXFCSA-N	1	1	317.389	1.940	20	5		DDBDMO
CC(C)C[N@H+]1Cc2ccc(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cc2C1	ZINC001054265679	759370639	/nfs/dbraw/zinc/37/06/39/759370639.db2.gz	VRRMRHFCSOVVCW-HZPDHXFCSA-N	1	1	317.389	1.940	20	5		DDBDMO
CC(C)(C)CC[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001001400000	762825130	/nfs/dbraw/zinc/82/51/30/762825130.db2.gz	PDGVJJAJARKCDU-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
CCC(=O)N1CC2(C1)CC[NH+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC001050398588	763543019	/nfs/dbraw/zinc/54/30/19/763543019.db2.gz	FBLYHXFQWQGEQL-UHFFFAOYSA-N	1	1	321.381	1.163	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)[C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170346629	766277218	/nfs/dbraw/zinc/27/72/18/766277218.db2.gz	OWUZMLKAXUCNCE-LLVKDONJSA-N	1	1	309.366	1.602	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N(C)[C@H]1CC[N@@H+](CC)C[C@@H]1C	ZINC001121698268	782632157	/nfs/dbraw/zinc/63/21/57/782632157.db2.gz	FMIPUTPRBXVRJO-RYUDHWBXSA-N	1	1	310.402	1.241	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(c2cccc(F)c2[N+](=O)[O-])CC1	ZINC001096243419	768740658	/nfs/dbraw/zinc/74/06/58/768740658.db2.gz	WHSLCNQMFHJQOU-UHFFFAOYSA-N	1	1	324.356	1.382	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC001097036649	771590969	/nfs/dbraw/zinc/59/09/69/771590969.db2.gz	CNDZANFWLRWRHI-HAQNSBGRSA-N	1	1	321.381	1.389	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC001093674116	774988989	/nfs/dbraw/zinc/98/89/89/774988989.db2.gz	PKUBDGLQZLSJCN-UHFFFAOYSA-N	1	1	312.345	1.602	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCNC(=O)C[N@H+](C)C2CCC2)n1	ZINC001094221985	775543809	/nfs/dbraw/zinc/54/38/09/775543809.db2.gz	YUTAGGUZWKGOQP-UHFFFAOYSA-N	1	1	321.381	1.311	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001094574177	776049531	/nfs/dbraw/zinc/04/95/31/776049531.db2.gz	QOJGOKDNSQRHDV-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CCn1nnc(C)c1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001175323803	777750845	/nfs/dbraw/zinc/75/08/45/777750845.db2.gz	PUPMPLXFGWQXMQ-HNNXBMFYSA-N	1	1	319.365	1.512	20	5		DDBDMO
O=C(NCC1([NH2+]CCC2CC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001115530680	780217065	/nfs/dbraw/zinc/21/70/65/780217065.db2.gz	LGEQJQDJABLQNS-ZIAGYGMSSA-N	1	1	309.410	1.860	20	5		DDBDMO
CCOCC[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCCC1	ZINC001115530786	780217503	/nfs/dbraw/zinc/21/75/03/780217503.db2.gz	RIZVDQUUPIQULA-CHWSQXEVSA-N	1	1	313.398	1.097	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001117797906	780902300	/nfs/dbraw/zinc/90/23/00/780902300.db2.gz	MZAQQTIFSNKMQN-MPKXVKKWSA-N	1	1	307.350	1.227	20	5		DDBDMO
CN(C)C1(CNc2ncc([N+](=O)[O-])cc2N)CC[NH+](C)CC1	ZINC001156185083	862790538	/nfs/dbraw/zinc/79/05/38/862790538.db2.gz	MBOBLCHBPUZKKS-UHFFFAOYSA-N	1	1	308.386	1.010	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC001159884669	865581534	/nfs/dbraw/zinc/58/15/34/865581534.db2.gz	JVHDOLJHPXIQHN-DMDPSCGWSA-N	1	1	304.350	1.247	20	5		DDBDMO
COC(=O)C(C)(C)C[N@@H+](CC(C)C)Cn1cc([N+](=O)[O-])cn1	ZINC001332150311	865615248	/nfs/dbraw/zinc/61/52/48/865615248.db2.gz	YCBIADKLOJABOZ-UHFFFAOYSA-N	1	1	312.370	1.906	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3C[C@H](CCO)[C@H](CO)C3)c2c1	ZINC001336870502	869192418	/nfs/dbraw/zinc/19/24/18/869192418.db2.gz	VJABJNMPJXLLOD-RYUDHWBXSA-N	1	1	317.345	1.570	20	5		DDBDMO
COCCC[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC001165093197	869369459	/nfs/dbraw/zinc/36/94/59/869369459.db2.gz	AQUGBPKTZWOOQN-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
C[N@@H+](C1CN(c2ncc([N+](=O)[O-])cc2Cl)C1)[C@@H]1CCOC1	ZINC001165204086	869427334	/nfs/dbraw/zinc/42/73/34/869427334.db2.gz	SYHIYCJPNIKKKD-SECBINFHSA-N	1	1	312.757	1.553	20	5		DDBDMO
Cc1cnc(N2CCC3(CC(N(C)C)=[NH+]O3)CC2)c([N+](=O)[O-])c1	ZINC001166033089	869808258	/nfs/dbraw/zinc/80/82/58/869808258.db2.gz	UEBPYRUCGOXLRA-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1C[C@H](C)[N@@H+](CC)C[C@H]1C	ZINC001340012702	870837030	/nfs/dbraw/zinc/83/70/30/870837030.db2.gz	TVFQQSITVPWUBU-QWHCGFSZSA-N	1	1	324.429	1.426	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+]1C	ZINC001340856771	871390158	/nfs/dbraw/zinc/39/01/58/871390158.db2.gz	JXJSOYXBNJLVIS-CYBMUJFWSA-N	1	1	320.393	1.875	20	5		DDBDMO
O=C1N[C@@H]2C[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@H]2CO1	ZINC001307906486	871458404	/nfs/dbraw/zinc/45/84/04/871458404.db2.gz	XVJIOYUVBHCPAF-IACUBPJLSA-N	1	1	321.333	1.059	20	5		DDBDMO
COC(=O)CC(C)(C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC001319569066	872696631	/nfs/dbraw/zinc/69/66/31/872696631.db2.gz	ZXOFFPBDQFHSPP-UHFFFAOYSA-N	1	1	311.338	1.030	20	5		DDBDMO
CN1CCC[C@@H](C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC001353289327	877232521	/nfs/dbraw/zinc/23/25/21/877232521.db2.gz	XTBBAZJKTSVQNZ-DZGCQCFKSA-N	1	1	323.393	1.266	20	5		DDBDMO
COC(=O)c1ccc(COC[C@@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC001223414678	880953665	/nfs/dbraw/zinc/95/36/65/880953665.db2.gz	MKKGLQBMKAIIQT-ZDUSSCGKSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1ccc(COC[C@@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC001223414678	880953671	/nfs/dbraw/zinc/95/36/71/880953671.db2.gz	MKKGLQBMKAIIQT-ZDUSSCGKSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1c(O[C@@H]2CCc3[nH+]ccn3C2)cccc1[N+](=O)[O-]	ZINC001229049982	883791489	/nfs/dbraw/zinc/79/14/89/883791489.db2.gz	QCCYTWDTHOEEER-SNVBAGLBSA-N	1	1	317.301	1.972	20	5		DDBDMO
Nc1[nH]c2cc(O[C@@H]3COc4nc([N+](=O)[O-])cn4C3)ccc2[nH+]1	ZINC001230516847	884533936	/nfs/dbraw/zinc/53/39/36/884533936.db2.gz	VAQLWRQJOSUYIR-QMMMGPOBSA-N	1	1	316.277	1.090	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Oc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001233863734	887400050	/nfs/dbraw/zinc/40/00/50/887400050.db2.gz	YUTQRSQOIYHHSR-NSHDSACASA-N	1	1	309.322	1.640	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@H]3CC34C[NH2+]C4)CC2)cc1	ZINC001246442574	892627217	/nfs/dbraw/zinc/62/72/17/892627217.db2.gz	DCVMIGQHJJGKER-HNNXBMFYSA-N	1	1	302.378	1.515	20	5		DDBDMO
C[C@@H]1C[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(=O)N1	ZINC001254476628	896456097	/nfs/dbraw/zinc/45/60/97/896456097.db2.gz	URQARVSSBXTOAY-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(=O)N1	ZINC001254476628	896456103	/nfs/dbraw/zinc/45/61/03/896456103.db2.gz	URQARVSSBXTOAY-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
COC(=O)CN1CC[NH+]([C@H](C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC001254561125	896502007	/nfs/dbraw/zinc/50/20/07/896502007.db2.gz	FLRYLLQCJDKOFL-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CCNC(=O)[C@@H]2C1	ZINC001254567615	896505466	/nfs/dbraw/zinc/50/54/66/896505466.db2.gz	XSCGOVWJYXFGQZ-KWCYVHTRSA-N	1	1	303.362	1.594	20	5		DDBDMO
CCNC(=O)[C@@H]1CCC[N@H+]1[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254605223	896526980	/nfs/dbraw/zinc/52/69/80/896526980.db2.gz	AKDKZKQSCQPJNW-CABCVRRESA-N	1	1	303.362	1.663	20	5		DDBDMO
C[N@@H+](C1CN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1)[C@@H]1CCOC1	ZINC001254604613	896527907	/nfs/dbraw/zinc/52/79/07/896527907.db2.gz	WWFNXFGEJQDQEA-HZPDHXFCSA-N	1	1	317.389	1.467	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ncc([N+](=O)[O-])c2ccccc21	ZINC001262059740	899922181	/nfs/dbraw/zinc/92/21/81/899922181.db2.gz	IIHYGXMGMDFGIC-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CCN(C)[C@@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001262059740	899922188	/nfs/dbraw/zinc/92/21/88/899922188.db2.gz	IIHYGXMGMDFGIC-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001262059740	899922199	/nfs/dbraw/zinc/92/21/99/899922199.db2.gz	IIHYGXMGMDFGIC-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001262059740	899922210	/nfs/dbraw/zinc/92/22/10/899922210.db2.gz	IIHYGXMGMDFGIC-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC001262653901	900286010	/nfs/dbraw/zinc/28/60/10/900286010.db2.gz	SNFWAPWLJSKNBW-ZDUSSCGKSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248438512	282082953	/nfs/dbraw/zinc/08/29/53/282082953.db2.gz	BXARNSSQBODSOK-DOMZBBRYSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000081904031	192336343	/nfs/dbraw/zinc/33/63/43/192336343.db2.gz	FKEKIYQUUDLSOX-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)CO	ZINC000248926101	282118501	/nfs/dbraw/zinc/11/85/01/282118501.db2.gz	LQDZHFBZMBREHV-NXEZZACHSA-N	1	1	302.758	1.812	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@H]1CO	ZINC000248964914	282121789	/nfs/dbraw/zinc/12/17/89/282121789.db2.gz	ROEFFTLLCMCLJV-XHDPSFHLSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000181576554	199321361	/nfs/dbraw/zinc/32/13/61/199321361.db2.gz	IPDLHFBVUAHXBB-STQMWFEESA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC(C)(C)O1	ZINC000181576554	199321362	/nfs/dbraw/zinc/32/13/62/199321362.db2.gz	IPDLHFBVUAHXBB-STQMWFEESA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)COc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000425041352	529822018	/nfs/dbraw/zinc/82/20/18/529822018.db2.gz	BQBIQIRZBHCWPL-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)n1	ZINC000286752875	219146802	/nfs/dbraw/zinc/14/68/02/219146802.db2.gz	YVELIWOYXVZFRK-VHSXEESVSA-N	1	1	322.287	1.284	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000279723162	215092696	/nfs/dbraw/zinc/09/26/96/215092696.db2.gz	MCQSLXKZMJXTSB-CQSZACIVSA-N	1	1	323.393	1.626	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[N@H+]2CCC[C@H]2C1	ZINC000358395661	299142257	/nfs/dbraw/zinc/14/22/57/299142257.db2.gz	PGRGLIJPBIOLBN-ZDUSSCGKSA-N	1	1	307.325	1.583	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000272606287	210004426	/nfs/dbraw/zinc/00/44/26/210004426.db2.gz	JRFRMVBCCCPRSP-UKRRQHHQSA-N	1	1	303.362	1.690	20	5		DDBDMO
COc1cc(C(=O)NCC[N@@H+]2CC=CCC2)ccc1[N+](=O)[O-]	ZINC000279777362	215137305	/nfs/dbraw/zinc/13/73/05/215137305.db2.gz	CCEBHBPSKPLDEQ-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](O)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000279910133	215229995	/nfs/dbraw/zinc/22/99/95/215229995.db2.gz	VQQBOZAYCXDVCC-CQSZACIVSA-N	1	1	310.350	1.685	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000152401280	186068904	/nfs/dbraw/zinc/06/89/04/186068904.db2.gz	UHDJMXODBRTYPE-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CC[C@H]1CN(c2cc(C)c([N+](=O)[O-])cn2)CC[N@H+]1C[C@H](C)O	ZINC000266849094	186358392	/nfs/dbraw/zinc/35/83/92/186358392.db2.gz	QBOPVBYYCFYYRJ-STQMWFEESA-N	1	1	308.382	1.580	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CC[C@@H](C)C1	ZINC000617353071	363067186	/nfs/dbraw/zinc/06/71/86/363067186.db2.gz	USZZUBHCSOQZES-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H](C[NH+](C)C)C2)c1[N+](=O)[O-]	ZINC000172353683	198084499	/nfs/dbraw/zinc/08/44/99/198084499.db2.gz	TWGPPSBOYWRQDZ-SNVBAGLBSA-N	1	1	309.370	1.294	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1csc([N+](=O)[O-])c1	ZINC000172669676	198134939	/nfs/dbraw/zinc/13/49/39/198134939.db2.gz	NQUIJEUHWKYDIN-UHFFFAOYSA-N	1	1	301.368	1.354	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCOC1	ZINC000052071045	352599625	/nfs/dbraw/zinc/59/96/25/352599625.db2.gz	GUIPMQLYMTZGHR-ZFWWWQNUSA-N	1	1	324.377	1.693	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000061649811	352892693	/nfs/dbraw/zinc/89/26/93/352892693.db2.gz	MBRLWJCLNUGEMC-UONOGXRCSA-N	1	1	319.361	1.117	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000065866675	352966865	/nfs/dbraw/zinc/96/68/65/352966865.db2.gz	RLCXDNMPTCARSP-UHFFFAOYSA-N	1	1	308.382	1.853	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000564957590	304030187	/nfs/dbraw/zinc/03/01/87/304030187.db2.gz	QQCBHMMHDFSIGW-CQSZACIVSA-N	1	1	310.329	1.410	20	5		DDBDMO
O=[N+]([O-])c1cn(C[C@H](O)C[N@H+]2CCc3ccccc3C2)cn1	ZINC000066482908	353000622	/nfs/dbraw/zinc/00/06/22/353000622.db2.gz	TZLXARHSSDNFIF-CQSZACIVSA-N	1	1	302.334	1.211	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCOC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000067963879	353077667	/nfs/dbraw/zinc/07/76/67/353077667.db2.gz	AEKFKYHOJPIYNZ-NSHDSACASA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCOC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000067963879	353077668	/nfs/dbraw/zinc/07/76/68/353077668.db2.gz	AEKFKYHOJPIYNZ-NSHDSACASA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000083170725	353706613	/nfs/dbraw/zinc/70/66/13/353706613.db2.gz	FNRXNPQHMWKNTR-ZJUUUORDSA-N	1	1	318.333	1.822	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000093333209	353895494	/nfs/dbraw/zinc/89/54/94/353895494.db2.gz	PSOCEUPQLBYMFR-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H]1O	ZINC000093333209	353895497	/nfs/dbraw/zinc/89/54/97/353895497.db2.gz	PSOCEUPQLBYMFR-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H](O)[C@@H](O)C2)s1	ZINC000093483658	353901850	/nfs/dbraw/zinc/90/18/50/353901850.db2.gz	GLLOHFWHHSILMT-OKILXGFUSA-N	1	1	320.370	1.861	20	5		DDBDMO
COc1cc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156799106	354221560	/nfs/dbraw/zinc/22/15/60/354221560.db2.gz	NOIQEBRKNSMXIU-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156799106	354221563	/nfs/dbraw/zinc/22/15/63/354221563.db2.gz	NOIQEBRKNSMXIU-QMTHXVAHSA-N	1	1	323.349	1.052	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055594	354228574	/nfs/dbraw/zinc/22/85/74/354228574.db2.gz	CACLFRXXZRBNNI-YPMHNXCESA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)c1[N+](=O)[O-]	ZINC000158055594	354228577	/nfs/dbraw/zinc/22/85/77/354228577.db2.gz	CACLFRXXZRBNNI-YPMHNXCESA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000585707450	354830947	/nfs/dbraw/zinc/83/09/47/354830947.db2.gz	ZTMFEHOVVQJNDH-UHFFFAOYSA-N	1	1	305.338	1.676	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589497351	354996867	/nfs/dbraw/zinc/99/68/67/354996867.db2.gz	OLZVTGWDRMQDKT-UHFFFAOYSA-N	1	1	324.333	1.766	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589497351	354996870	/nfs/dbraw/zinc/99/68/70/354996870.db2.gz	OLZVTGWDRMQDKT-UHFFFAOYSA-N	1	1	324.333	1.766	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590044200	355042497	/nfs/dbraw/zinc/04/24/97/355042497.db2.gz	IFRXHFZPJYPXOM-HIFRSBDPSA-N	1	1	303.362	1.933	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000591028151	355235742	/nfs/dbraw/zinc/23/57/42/355235742.db2.gz	LJORTYWOXWTGBX-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]([NH3+])[C@@H](CC)C2)c1[N+](=O)[O-]	ZINC000592332239	355561292	/nfs/dbraw/zinc/56/12/92/355561292.db2.gz	IBHYNZFRMRFOPC-UWVGGRQHSA-N	1	1	309.370	1.470	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C	ZINC000592128499	355507386	/nfs/dbraw/zinc/50/73/86/355507386.db2.gz	XCYFNZGQIXYJPY-MWLCHTKSSA-N	1	1	318.333	1.712	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C	ZINC000592128499	355507389	/nfs/dbraw/zinc/50/73/89/355507389.db2.gz	XCYFNZGQIXYJPY-MWLCHTKSSA-N	1	1	318.333	1.712	20	5		DDBDMO
C[C@@H](CCO)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000593109967	355801810	/nfs/dbraw/zinc/80/18/10/355801810.db2.gz	PIXIVZSIDJVRIG-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](CCO)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000593109967	355801814	/nfs/dbraw/zinc/80/18/14/355801814.db2.gz	PIXIVZSIDJVRIG-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593679092	355964746	/nfs/dbraw/zinc/96/47/46/355964746.db2.gz	AMCSNTJGUZKNNE-OAHLLOKOSA-N	1	1	321.377	1.244	20	5		DDBDMO
O=C(NCCC1CC[NH2+]CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000593919060	356060502	/nfs/dbraw/zinc/06/05/02/356060502.db2.gz	NCHNBJQOKZPCRY-UHFFFAOYSA-N	1	1	317.349	1.591	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCCCC[C@H]2CO)c1	ZINC000594014455	356087185	/nfs/dbraw/zinc/08/71/85/356087185.db2.gz	DSXLYSZZRUDDDH-LSDHHAIUSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1(C)C	ZINC000594356951	356182158	/nfs/dbraw/zinc/18/21/58/356182158.db2.gz	ZBFUXZLXHYQVSP-UHFFFAOYSA-N	1	1	309.370	1.079	20	5		DDBDMO
C[N@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1(C)C	ZINC000594356951	356182159	/nfs/dbraw/zinc/18/21/59/356182159.db2.gz	ZBFUXZLXHYQVSP-UHFFFAOYSA-N	1	1	309.370	1.079	20	5		DDBDMO
COCC[N@@H+](C)CCN[C@@H](C)c1ccc([N+](=O)[O-])cc1OC	ZINC000595042033	356376140	/nfs/dbraw/zinc/37/61/40/356376140.db2.gz	SKKCGTXMLCFPNS-LBPRGKRZSA-N	1	1	311.382	1.832	20	5		DDBDMO
Cc1noc(CN2CCC([N@@H+](C)CCCO)CC2)c1[N+](=O)[O-]	ZINC000595317609	356447627	/nfs/dbraw/zinc/44/76/27/356447627.db2.gz	BGCVQTHCWOHZBT-UHFFFAOYSA-N	1	1	312.370	1.170	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@@H](C)C(=O)NC	ZINC000081539390	192286148	/nfs/dbraw/zinc/28/61/48/192286148.db2.gz	AHEBHBMDOCVIHC-LLVKDONJSA-N	1	1	309.366	1.807	20	5		DDBDMO
CN1C(=O)NCC12CC[NH+](Cc1ccc(F)cc1[N+](=O)[O-])CC2	ZINC000595554039	356548351	/nfs/dbraw/zinc/54/83/51/356548351.db2.gz	QQJWVJVPPKAQNF-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC[C@H]([NH3+])C(C)C)c1[N+](=O)[O-]	ZINC000236858163	202040631	/nfs/dbraw/zinc/04/06/31/202040631.db2.gz	RNEAGYFOJUPRQK-JTQLQIEISA-N	1	1	311.386	1.716	20	5		DDBDMO
Cc1noc(C[N@@H+](C)[C@@H](CO)Cc2ccccc2)c1[N+](=O)[O-]	ZINC000595591806	356565916	/nfs/dbraw/zinc/56/59/16/356565916.db2.gz	KRISDRATOPWZFL-CYBMUJFWSA-N	1	1	305.334	1.927	20	5		DDBDMO
Cc1noc(C[N@H+](C)[C@@H](CO)Cc2ccccc2)c1[N+](=O)[O-]	ZINC000595591806	356565921	/nfs/dbraw/zinc/56/59/21/356565921.db2.gz	KRISDRATOPWZFL-CYBMUJFWSA-N	1	1	305.334	1.927	20	5		DDBDMO
COC(=O)C[N@H+](CCn1ccc([N+](=O)[O-])n1)C1CCCCC1	ZINC000595662896	356598546	/nfs/dbraw/zinc/59/85/46/356598546.db2.gz	FCPWHFXDVJOSRH-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
COC(=O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C1CCCCC1	ZINC000595662896	356598551	/nfs/dbraw/zinc/59/85/51/356598551.db2.gz	FCPWHFXDVJOSRH-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000595767185	356644031	/nfs/dbraw/zinc/64/40/31/356644031.db2.gz	WPDQIRKVYFZDSF-DGCLKSJQSA-N	1	1	307.350	1.769	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596539249	356911101	/nfs/dbraw/zinc/91/11/01/356911101.db2.gz	NPVSFEOAZCDAIQ-ZDUSSCGKSA-N	1	1	323.397	1.155	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000597857375	357360247	/nfs/dbraw/zinc/36/02/47/357360247.db2.gz	FRVXFSMESXVEAB-JTQLQIEISA-N	1	1	306.366	1.780	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000598600357	357648762	/nfs/dbraw/zinc/64/87/62/357648762.db2.gz	AVUSQFCIORDKOK-UWVGGRQHSA-N	1	1	320.349	1.814	20	5		DDBDMO
Cn1cccc1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000179222564	199001291	/nfs/dbraw/zinc/00/12/91/199001291.db2.gz	PFXFMMLYMMWZSJ-OAHLLOKOSA-N	1	1	316.361	1.932	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@@H](O)C2)c(OC(F)F)c1	ZINC000599176012	357840045	/nfs/dbraw/zinc/84/00/45/357840045.db2.gz	ODFGSQDGDARXMJ-SNVBAGLBSA-N	1	1	317.292	1.675	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+](C[C@H](O)Cn2cccn2)C2CC2)cc1	ZINC000179520990	199049484	/nfs/dbraw/zinc/04/94/84/199049484.db2.gz	XRDTZRGJCRKCEC-INIZCTEOSA-N	1	1	316.361	1.817	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1	ZINC000599553488	357970678	/nfs/dbraw/zinc/97/06/78/357970678.db2.gz	WSYAFCVTZUFRKI-XQQFMLRXSA-N	1	1	312.395	1.122	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H]3CC[C@@H](O)[C@@H]32)c([N+](=O)[O-])c1	ZINC000599682295	358023242	/nfs/dbraw/zinc/02/32/42/358023242.db2.gz	ZXRQFUGNKMHYCA-SGIREYDYSA-N	1	1	322.361	1.827	20	5		DDBDMO
Cc1c(C(=O)NC2CC([NH+]3CCOCC3)C2)cccc1[N+](=O)[O-]	ZINC000600070149	358114623	/nfs/dbraw/zinc/11/46/23/358114623.db2.gz	YFOBYEZWPDFREG-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000600315920	358195079	/nfs/dbraw/zinc/19/50/79/358195079.db2.gz	XGGZBIUZOQUZIY-LBPRGKRZSA-N	1	1	323.397	1.375	20	5		DDBDMO
C[C@H](Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12)C(=O)NCCF	ZINC000601162229	358427526	/nfs/dbraw/zinc/42/75/26/358427526.db2.gz	KMQCQKYIGYDIDV-VIFPVBQESA-N	1	1	306.297	1.451	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)c1ncc(F)cc1[N+](=O)[O-]	ZINC000601165492	358428928	/nfs/dbraw/zinc/42/89/28/358428928.db2.gz	BIDRGNYCYLOXPT-UHFFFAOYSA-N	1	1	313.377	1.449	20	5		DDBDMO
CN(CCCN(C)c1ncc(F)cc1[N+](=O)[O-])CC[NH+](C)C	ZINC000601165492	358428932	/nfs/dbraw/zinc/42/89/32/358428932.db2.gz	BIDRGNYCYLOXPT-UHFFFAOYSA-N	1	1	313.377	1.449	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000601971556	358759553	/nfs/dbraw/zinc/75/95/53/358759553.db2.gz	DNVOTYKNQJTQOZ-TXEJJXNPSA-N	1	1	308.334	1.560	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)CCC(=O)OC(C)(C)C	ZINC000602787050	359191100	/nfs/dbraw/zinc/19/11/00/359191100.db2.gz	GLFNBRVMPWSDRT-UHFFFAOYSA-N	1	1	312.370	1.763	20	5		DDBDMO
C[C@H](C[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000602687981	359126139	/nfs/dbraw/zinc/12/61/39/359126139.db2.gz	SXULIVPRXYKUJM-SNVBAGLBSA-N	1	1	312.370	1.738	20	5		DDBDMO
C[C@H](C[N@@H+](C)Cc1cn(C)nc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000602687981	359126142	/nfs/dbraw/zinc/12/61/42/359126142.db2.gz	SXULIVPRXYKUJM-SNVBAGLBSA-N	1	1	312.370	1.738	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H](O)C[C@](C)(O)C1CC1	ZINC000602831706	359224074	/nfs/dbraw/zinc/22/40/74/359224074.db2.gz	PWHXIDNHNMMMKF-WBVHZDCISA-N	1	1	322.405	1.981	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@H]2CC[N@H+](C)C[C@H]21	ZINC000602951369	359316585	/nfs/dbraw/zinc/31/65/85/359316585.db2.gz	JAIATILNGJUXIF-DGCLKSJQSA-N	1	1	319.365	1.278	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCCn2cc(C[NH+]3CCCC3)nn2)c1	ZINC000603200302	359475985	/nfs/dbraw/zinc/47/59/85/359475985.db2.gz	HBTUZDHSXFBODK-UHFFFAOYSA-N	1	1	317.349	1.861	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000186959711	200038944	/nfs/dbraw/zinc/03/89/44/200038944.db2.gz	UJNKHPMKFFUXTK-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C[C@@H](C)O)C[C@@H]1C	ZINC000186959711	200038946	/nfs/dbraw/zinc/03/89/46/200038946.db2.gz	UJNKHPMKFFUXTK-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CCCOCC2)cc([N+](=O)[O-])c1	ZINC000189375275	200390132	/nfs/dbraw/zinc/39/01/32/200390132.db2.gz	JDGSXSOOIKMFFB-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@H+]2CCCOCC2)cc([N+](=O)[O-])c1	ZINC000189375275	200390134	/nfs/dbraw/zinc/39/01/34/200390134.db2.gz	JDGSXSOOIKMFFB-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C(C)(C)CO	ZINC000609894979	360363093	/nfs/dbraw/zinc/36/30/93/360363093.db2.gz	UZABVXYYDOZIEA-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C(C)(C)CO	ZINC000609894979	360363096	/nfs/dbraw/zinc/36/30/96/360363096.db2.gz	UZABVXYYDOZIEA-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846480	360355683	/nfs/dbraw/zinc/35/56/83/360355683.db2.gz	RTHJJMLEUZXLAE-PWSUYJOCSA-N	1	1	319.365	1.143	20	5		DDBDMO
C[C@H](C(=O)NC1CC1)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000609846480	360355685	/nfs/dbraw/zinc/35/56/85/360355685.db2.gz	RTHJJMLEUZXLAE-PWSUYJOCSA-N	1	1	319.365	1.143	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H](CO)C1)OCCO2	ZINC000610930137	360573415	/nfs/dbraw/zinc/57/34/15/360573415.db2.gz	BJFYZAQISOXJRM-NSHDSACASA-N	1	1	308.334	1.570	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@H](CO)C1)OCCO2	ZINC000610930137	360573417	/nfs/dbraw/zinc/57/34/17/360573417.db2.gz	BJFYZAQISOXJRM-NSHDSACASA-N	1	1	308.334	1.570	20	5		DDBDMO
CC[N@H+]1CCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611092571	360621431	/nfs/dbraw/zinc/62/14/31/360621431.db2.gz	ZXWZEJLEPRSPTL-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611092571	360621433	/nfs/dbraw/zinc/62/14/33/360621433.db2.gz	ZXWZEJLEPRSPTL-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611092571	360621435	/nfs/dbraw/zinc/62/14/35/360621435.db2.gz	ZXWZEJLEPRSPTL-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@@H](C[NH+]3CCOCC3)C2)n1	ZINC000611616726	360777518	/nfs/dbraw/zinc/77/75/18/360777518.db2.gz	AAKGMPHGYPGRBD-AWEZNQCLSA-N	1	1	320.393	1.765	20	5		DDBDMO
COc1cc(N2CC[N@@H+]3CCOC[C@@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000612451357	361021722	/nfs/dbraw/zinc/02/17/22/361021722.db2.gz	YZYMXHIOZMJZBP-JTQLQIEISA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1cc(N2CC[N@H+]3CCOC[C@@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000612451357	361021725	/nfs/dbraw/zinc/02/17/25/361021725.db2.gz	YZYMXHIOZMJZBP-JTQLQIEISA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1c(C(=O)N2CC[NH+](C3CCC3)CC2)cccc1[N+](=O)[O-]	ZINC000619436531	364007870	/nfs/dbraw/zinc/00/78/70/364007870.db2.gz	YWPSEMZYKFFLMD-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](n3cc(CO)nn3)C2)cc1	ZINC000292916557	223308089	/nfs/dbraw/zinc/30/80/89/223308089.db2.gz	HXIFUZHPBRIBDE-HNNXBMFYSA-N	1	1	317.349	1.516	20	5		DDBDMO
Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000261788438	203116446	/nfs/dbraw/zinc/11/64/46/203116446.db2.gz	UEISECTUAZENFF-ZDUSSCGKSA-N	1	1	315.333	1.115	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000264641189	204047510	/nfs/dbraw/zinc/04/75/10/204047510.db2.gz	OEVBRJKQZKZTRV-CYBMUJFWSA-N	1	1	303.362	1.738	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc2ncccc2c1[N+](=O)[O-]	ZINC000264796175	204163386	/nfs/dbraw/zinc/16/33/86/204163386.db2.gz	TZCOXTXMGVJDQQ-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC[C@H]1CCCO1	ZINC000282505032	217047112	/nfs/dbraw/zinc/04/71/12/217047112.db2.gz	RHEKMEVMPXKBBL-OAHLLOKOSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC[C@H]1CCCO1	ZINC000282505032	217047117	/nfs/dbraw/zinc/04/71/17/217047117.db2.gz	RHEKMEVMPXKBBL-OAHLLOKOSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC(C)[C@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200775	284308203	/nfs/dbraw/zinc/30/82/03/284308203.db2.gz	JOUNYNDRUJWCDV-GDBMZVCRSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000351200775	284308204	/nfs/dbraw/zinc/30/82/04/284308204.db2.gz	JOUNYNDRUJWCDV-GDBMZVCRSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[N@H+](Cc1cccc(Cl)c1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266389348	205312562	/nfs/dbraw/zinc/31/25/62/205312562.db2.gz	BXBVAQDGNSRAFR-CQSZACIVSA-N	1	1	324.768	1.938	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266503630	205392668	/nfs/dbraw/zinc/39/26/68/205392668.db2.gz	XIGAYAMFTLLMKR-HNNXBMFYSA-N	1	1	304.350	1.327	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@H]([NH+]3CCCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288473201	220166209	/nfs/dbraw/zinc/16/62/09/220166209.db2.gz	QNIACTBUTYEIDS-MWLCHTKSSA-N	1	1	307.354	1.325	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000285678574	296240450	/nfs/dbraw/zinc/24/04/50/296240450.db2.gz	HNJACADYCCCHNG-SUHUHFCYSA-N	1	1	304.350	1.754	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000285678574	296240452	/nfs/dbraw/zinc/24/04/52/296240452.db2.gz	HNJACADYCCCHNG-SUHUHFCYSA-N	1	1	304.350	1.754	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1	ZINC000268002007	206388296	/nfs/dbraw/zinc/38/82/96/206388296.db2.gz	WIUUPQLNPGCEAI-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NC[C@H](C)C[NH+]2CCOCC2)c1	ZINC000338671548	250084453	/nfs/dbraw/zinc/08/44/53/250084453.db2.gz	GEYOJYZYKRYSKV-LBPRGKRZSA-N	1	1	309.366	1.984	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[NH2+]C2(C(F)F)CCCCC2)c1	ZINC000352202163	284860984	/nfs/dbraw/zinc/86/09/84/284860984.db2.gz	IJNCFNLYQJEVMB-NSHDSACASA-N	1	1	318.324	1.710	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000057711995	184049017	/nfs/dbraw/zinc/04/90/17/184049017.db2.gz	JNVXCUSLWFWLCT-VIFPVBQESA-N	1	1	322.321	1.716	20	5		DDBDMO
C[C@H](O)C[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000156338670	197105541	/nfs/dbraw/zinc/10/55/41/197105541.db2.gz	PIKKIWQMXUIJEW-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000156338670	197105542	/nfs/dbraw/zinc/10/55/42/197105542.db2.gz	PIKKIWQMXUIJEW-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[N@H+]([C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)[C@@H]1CCC[C@H]1O	ZINC000352668260	285211249	/nfs/dbraw/zinc/21/12/49/285211249.db2.gz	QQJFICOFDACSCV-RBSFLKMASA-N	1	1	319.361	1.545	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ncc([N+](=O)[O-])cc1F	ZINC000413256991	224162981	/nfs/dbraw/zinc/16/29/81/224162981.db2.gz	AAMDYPAXLPYZLH-NSHDSACASA-N	1	1	324.356	1.818	20	5		DDBDMO
C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000289669488	221142947	/nfs/dbraw/zinc/14/29/47/221142947.db2.gz	FTRTXXZOZSHIKF-RHSMWYFYSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@@H]1[C@H](N2CCOCC2)CC[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000289902299	221304408	/nfs/dbraw/zinc/30/44/08/221304408.db2.gz	SNYMPGWFJWOWKC-DGCLKSJQSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1[C@H](N2CCOCC2)CC[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000289902299	221304412	/nfs/dbraw/zinc/30/44/12/221304412.db2.gz	SNYMPGWFJWOWKC-DGCLKSJQSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@@H]1[C@H]([NH+]2CCOCC2)CCN1Cc1csc([N+](=O)[O-])c1	ZINC000289902299	221304414	/nfs/dbraw/zinc/30/44/14/221304414.db2.gz	SNYMPGWFJWOWKC-DGCLKSJQSA-N	1	1	311.407	1.951	20	5		DDBDMO
COc1ccc(C(=O)N2CCC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000425048002	533301818	/nfs/dbraw/zinc/30/18/18/533301818.db2.gz	NKTLCUHLAQSAKP-GXTWGEPZSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000319016652	533635519	/nfs/dbraw/zinc/63/55/19/533635519.db2.gz	CPKLVXMJPCGWLS-SCZZXKLOSA-N	1	1	310.329	1.529	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1	ZINC000569743683	304376454	/nfs/dbraw/zinc/37/64/54/304376454.db2.gz	CIWHOXFHFMOOLW-LBPRGKRZSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000073818209	406895321	/nfs/dbraw/zinc/89/53/21/406895321.db2.gz	XMPPYHLRTSTSBT-OAHLLOKOSA-N	1	1	320.393	1.921	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078621138	407036641	/nfs/dbraw/zinc/03/66/41/407036641.db2.gz	JFWPYRGKIRQXAU-NSHDSACASA-N	1	1	314.345	1.808	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCc2nn(C)c(=O)cc2C1	ZINC000078621138	407036643	/nfs/dbraw/zinc/03/66/43/407036643.db2.gz	JFWPYRGKIRQXAU-NSHDSACASA-N	1	1	314.345	1.808	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC[NH2+][C@@H](C)C2)c1C	ZINC000088059573	407120744	/nfs/dbraw/zinc/12/07/44/407120744.db2.gz	IYHBKNQXUSAUFN-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
COc1ccc(C[NH+]2CCC(NC(C)=O)CC2)cc1[N+](=O)[O-]	ZINC000050990526	407133479	/nfs/dbraw/zinc/13/34/79/407133479.db2.gz	HSZDHRORFLPLAQ-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[C@@H](C)[NH2+]1	ZINC000123964256	407344137	/nfs/dbraw/zinc/34/41/37/407344137.db2.gz	FZGLJLNHCFQXAB-RKDXNWHRSA-N	1	1	317.342	1.105	20	5		DDBDMO
CCOC[C@@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000105795386	407354569	/nfs/dbraw/zinc/35/45/69/407354569.db2.gz	WZVCPCMDWFUWAI-ZDUSSCGKSA-N	1	1	309.366	1.114	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000107694967	407378466	/nfs/dbraw/zinc/37/84/66/407378466.db2.gz	DUOFPMUULPFVTK-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
NC(=O)CC[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000170731879	407487325	/nfs/dbraw/zinc/48/73/25/407487325.db2.gz	YVHWIEILBYXRKX-CYBMUJFWSA-N	1	1	321.377	1.951	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000270985686	407452189	/nfs/dbraw/zinc/45/21/89/407452189.db2.gz	XSKFXBVGHSWZGK-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000270985686	407452194	/nfs/dbraw/zinc/45/21/94/407452194.db2.gz	XSKFXBVGHSWZGK-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000265794795	407456966	/nfs/dbraw/zinc/45/69/66/407456966.db2.gz	MYMBIOUOXNCPSH-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](C)N1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000127717004	407457838	/nfs/dbraw/zinc/45/78/38/407457838.db2.gz	NRILAAWMYZHLJG-UONOGXRCSA-N	1	1	306.410	1.881	20	5		DDBDMO
C[C@H]1c2ccccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266540041	407552281	/nfs/dbraw/zinc/55/22/81/407552281.db2.gz	PRXSKKMKVQBXKL-WFASDCNBSA-N	1	1	316.361	1.772	20	5		DDBDMO
COCC1=CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000185815536	407510932	/nfs/dbraw/zinc/51/09/32/407510932.db2.gz	SVAPUADVUQQFDB-CQSZACIVSA-N	1	1	322.361	1.613	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000178627207	407517407	/nfs/dbraw/zinc/51/74/07/407517407.db2.gz	KBGUGJKJJZPNRT-SWLSCSKDSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000178640899	407522488	/nfs/dbraw/zinc/52/24/88/407522488.db2.gz	AARMECHHBSQGDS-IUODEOHRSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000178640889	407522948	/nfs/dbraw/zinc/52/29/48/407522948.db2.gz	AARMECHHBSQGDS-SWLSCSKDSA-N	1	1	318.377	1.702	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@H](C)C1	ZINC000265947305	407523026	/nfs/dbraw/zinc/52/30/26/407523026.db2.gz	KAYVJKIEIKPNQH-PWSUYJOCSA-N	1	1	323.397	1.439	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000271124555	407525553	/nfs/dbraw/zinc/52/55/53/407525553.db2.gz	ZLWTWEGREADZOL-AWEZNQCLSA-N	1	1	302.334	1.562	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](C)C2CCCCC2)n1	ZINC000271329755	407638707	/nfs/dbraw/zinc/63/87/07/407638707.db2.gz	ARJNQZJBKHWIQX-UHFFFAOYSA-N	1	1	323.397	1.713	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CC[NH2+][C@H](C)C1	ZINC000187155235	407827558	/nfs/dbraw/zinc/82/75/58/407827558.db2.gz	ZGHHCEGUOXKARN-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@H]1C[N@H+](C)CCO1	ZINC000133327080	407830181	/nfs/dbraw/zinc/83/01/81/407830181.db2.gz	BGMPYHBUFKTADF-SMDDNHRTSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCO1	ZINC000133327080	407830187	/nfs/dbraw/zinc/83/01/87/407830187.db2.gz	BGMPYHBUFKTADF-SMDDNHRTSA-N	1	1	322.365	1.113	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000133353405	407832932	/nfs/dbraw/zinc/83/29/32/407832932.db2.gz	MOUIZIYRVPZFRR-GFCCVEGCSA-N	1	1	321.381	1.090	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000267343402	407842543	/nfs/dbraw/zinc/84/25/43/407842543.db2.gz	CYSLXTMDQQTEGE-GFCCVEGCSA-N	1	1	320.267	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@](O)(C(F)(F)F)C2)cc1	ZINC000267343402	407842549	/nfs/dbraw/zinc/84/25/49/407842549.db2.gz	CYSLXTMDQQTEGE-GFCCVEGCSA-N	1	1	320.267	1.973	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000118117449	407896515	/nfs/dbraw/zinc/89/65/15/407896515.db2.gz	AVPVIQNYVQZLFN-NSHDSACASA-N	1	1	322.365	1.380	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000272570089	407989182	/nfs/dbraw/zinc/98/91/82/407989182.db2.gz	CWQLOFHNJHPERV-GHMZBOCLSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000245852739	408078430	/nfs/dbraw/zinc/07/84/30/408078430.db2.gz	DBZZVXKEZWXKQB-UKRRQHHQSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CC(C)(C)O	ZINC000189876838	408125869	/nfs/dbraw/zinc/12/58/69/408125869.db2.gz	IFWHNSMIVFVGIJ-CYBMUJFWSA-N	1	1	307.394	1.872	20	5		DDBDMO
CCOC(=O)C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000136805067	408126403	/nfs/dbraw/zinc/12/64/03/408126403.db2.gz	JPIAIMKVJQINBW-HNNXBMFYSA-N	1	1	322.361	1.903	20	5		DDBDMO
COC[C@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000273339204	408158491	/nfs/dbraw/zinc/15/84/91/408158491.db2.gz	NIMCEMDYUYQEKH-QWHCGFSZSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[C@H](C(=O)N1CCc2c1cccc2[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000182773608	408245347	/nfs/dbraw/zinc/24/53/47/408245347.db2.gz	CIKTVFVNNBZMPC-GFCCVEGCSA-N	1	1	318.377	1.120	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCN(C)CC1	ZINC000122188846	408263792	/nfs/dbraw/zinc/26/37/92/408263792.db2.gz	NSNJEVRYOYDFOT-UHFFFAOYSA-N	1	1	322.365	1.179	20	5		DDBDMO
Cn1cccc1[C@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246465401	408263952	/nfs/dbraw/zinc/26/39/52/408263952.db2.gz	AKJYTKNBPAHZKU-UKRRQHHQSA-N	1	1	319.365	1.328	20	5		DDBDMO
CSc1ccc(C(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000190253461	408200111	/nfs/dbraw/zinc/20/01/11/408200111.db2.gz	UYMZFAUTJSEQDF-UHFFFAOYSA-N	1	1	305.306	1.641	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCS[C@H]3COCC[C@H]32)c1	ZINC000246282976	408205828	/nfs/dbraw/zinc/20/58/28/408205828.db2.gz	NVVMKYAMGGBPLV-KFWWJZLASA-N	1	1	324.402	1.835	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CC([NH+](C)C)C1	ZINC000273479531	408216729	/nfs/dbraw/zinc/21/67/29/408216729.db2.gz	GAPHJCBYKNSDGK-UHFFFAOYSA-N	1	1	313.379	1.092	20	5		DDBDMO
C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000182689169	408225523	/nfs/dbraw/zinc/22/55/23/408225523.db2.gz	CNIDEYGKRCTDMW-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190850224	408330251	/nfs/dbraw/zinc/33/02/51/408330251.db2.gz	MWQTVAKGOCOSDS-WOPDTQHZSA-N	1	1	307.350	1.482	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1	ZINC000269330933	408270448	/nfs/dbraw/zinc/27/04/48/408270448.db2.gz	AFWMUINFLLNOMD-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269431983	408305369	/nfs/dbraw/zinc/30/53/69/408305369.db2.gz	ZZAOXTSEKAYCHX-UHFFFAOYSA-N	1	1	320.353	1.766	20	5		DDBDMO
CC[C@](C)([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C(N)=O	ZINC000133136489	162052364	/nfs/dbraw/zinc/05/23/64/162052364.db2.gz	VJYQFEIHFYKSTP-AWEZNQCLSA-N	1	1	308.338	1.085	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000264441944	408491537	/nfs/dbraw/zinc/49/15/37/408491537.db2.gz	BVXRPEOWIUYCRO-JTQLQIEISA-N	1	1	313.379	1.415	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000264441944	408491542	/nfs/dbraw/zinc/49/15/42/408491542.db2.gz	BVXRPEOWIUYCRO-JTQLQIEISA-N	1	1	313.379	1.415	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1Cc2ccccc2C1	ZINC000270566804	408581525	/nfs/dbraw/zinc/58/15/25/408581525.db2.gz	MISDHEBCXOAFSH-UHFFFAOYSA-N	1	1	313.357	1.856	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H]1C	ZINC000275387161	408588321	/nfs/dbraw/zinc/58/83/21/408588321.db2.gz	PYSWOEPDMHWHBM-RYUDHWBXSA-N	1	1	320.393	1.454	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000177144784	408535150	/nfs/dbraw/zinc/53/51/50/408535150.db2.gz	YYCGSTDKPLKFKD-UWVGGRQHSA-N	1	1	321.381	1.625	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1CO	ZINC000265378598	408630818	/nfs/dbraw/zinc/63/08/18/408630818.db2.gz	BZFOTBHEVNHDBE-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000192793986	408650848	/nfs/dbraw/zinc/65/08/48/408650848.db2.gz	JYYDHTAUOVLYQV-UHFFFAOYSA-N	1	1	308.382	1.460	20	5		DDBDMO
Cc1ccc(NC(=O)C(=O)N2CCC[N@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000161992483	408657624	/nfs/dbraw/zinc/65/76/24/408657624.db2.gz	QKJFJXOAIGLVOK-UHFFFAOYSA-N	1	1	320.349	1.006	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cncc(F)c3)CC2)n1	ZINC000270870763	408717044	/nfs/dbraw/zinc/71/70/44/408717044.db2.gz	JDLOGTNMLNVEIU-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000290814684	408837929	/nfs/dbraw/zinc/83/79/29/408837929.db2.gz	RQZRQIRZHWGZRH-JQWIXIFHSA-N	1	1	321.381	1.255	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C	ZINC000277482178	408948370	/nfs/dbraw/zinc/94/83/70/408948370.db2.gz	CPGBAXREHGDQDY-MNOVXSKESA-N	1	1	319.365	1.362	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CCC(N)=O	ZINC000286439177	408985718	/nfs/dbraw/zinc/98/57/18/408985718.db2.gz	LQPVVIXMQYEURG-SECBINFHSA-N	1	1	319.321	1.513	20	5		DDBDMO
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CCC(N)=O	ZINC000286439177	408985720	/nfs/dbraw/zinc/98/57/20/408985720.db2.gz	LQPVVIXMQYEURG-SECBINFHSA-N	1	1	319.321	1.513	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]2CO)cn1	ZINC000277920432	409035434	/nfs/dbraw/zinc/03/54/34/409035434.db2.gz	XYRPDRJYSAEDBK-HOCLYGCPSA-N	1	1	316.361	1.536	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC[N@H+](C2CCC2)C1	ZINC000293604294	409146775	/nfs/dbraw/zinc/14/67/75/409146775.db2.gz	DCMHEUKNMJIJKT-JTQLQIEISA-N	1	1	307.354	1.264	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000279486162	409224404	/nfs/dbraw/zinc/22/44/04/409224404.db2.gz	RENRAPWRKUQVIZ-ZANVPECISA-N	1	1	324.356	1.728	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2CC[NH+](C3CC3)CC2)c1[N+](=O)[O-]	ZINC000283752695	409208860	/nfs/dbraw/zinc/20/88/60/409208860.db2.gz	LLINMVYTSVMRDX-UHFFFAOYSA-N	1	1	320.349	1.369	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000280460136	409315765	/nfs/dbraw/zinc/31/57/65/409315765.db2.gz	ZRYVVJXMTIJDOH-UHFFFAOYSA-N	1	1	318.377	1.698	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3ncc([N+](=O)[O-])cc3Cl)C[C@@H]21	ZINC000284414804	409341375	/nfs/dbraw/zinc/34/13/75/409341375.db2.gz	BUPBFPSAYNBTBK-RYUDHWBXSA-N	1	1	312.757	1.553	20	5		DDBDMO
Nc1c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000317069884	164025400	/nfs/dbraw/zinc/02/54/00/164025400.db2.gz	JHEDHRGBJPQLLU-LLVKDONJSA-N	1	1	304.350	1.487	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+](CCCO)C1)c1ccc([N+](=O)[O-])s1	ZINC000295394486	409463406	/nfs/dbraw/zinc/46/34/06/409463406.db2.gz	HWWVGCALLMBTOI-JTQLQIEISA-N	1	1	313.379	1.233	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1ccc([N+](=O)[O-])s1	ZINC000295394486	409463409	/nfs/dbraw/zinc/46/34/09/409463409.db2.gz	HWWVGCALLMBTOI-JTQLQIEISA-N	1	1	313.379	1.233	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](CCCO)C1)c1ccc([N+](=O)[O-])s1	ZINC000295394487	409463792	/nfs/dbraw/zinc/46/37/92/409463792.db2.gz	HWWVGCALLMBTOI-SNVBAGLBSA-N	1	1	313.379	1.233	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1ccc([N+](=O)[O-])s1	ZINC000295394487	409463795	/nfs/dbraw/zinc/46/37/95/409463795.db2.gz	HWWVGCALLMBTOI-SNVBAGLBSA-N	1	1	313.379	1.233	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343609418	164087244	/nfs/dbraw/zinc/08/72/44/164087244.db2.gz	SJUUGEFOEVFGRD-YPMHNXCESA-N	1	1	306.366	1.877	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000363441652	164160297	/nfs/dbraw/zinc/16/02/97/164160297.db2.gz	LNUMVQUBVGJSGL-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H](C)C[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000356811741	409630657	/nfs/dbraw/zinc/63/06/57/409630657.db2.gz	PPHSXLWOGHBMEO-JTQLQIEISA-N	1	1	311.386	1.729	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC000357012405	409795190	/nfs/dbraw/zinc/79/51/90/409795190.db2.gz	YQJUYRQNWITJOT-STQMWFEESA-N	1	1	320.393	1.866	20	5		DDBDMO
CN(C(=O)c1cc([N+](=O)[O-])nn1C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000342799524	409912957	/nfs/dbraw/zinc/91/29/57/409912957.db2.gz	WXFXKHQDLSSLFO-ZACCUICWSA-N	1	1	307.354	1.026	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CCN1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298020339	410083206	/nfs/dbraw/zinc/08/32/06/410083206.db2.gz	DOYBNTLUUZDOFT-AWEZNQCLSA-N	1	1	319.409	1.596	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)N2CCC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000298087957	410107496	/nfs/dbraw/zinc/10/74/96/410107496.db2.gz	PZWPFJRQRDEMLI-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000298744291	410377008	/nfs/dbraw/zinc/37/70/08/410377008.db2.gz	YFYQHFIIBQSOPX-JTQLQIEISA-N	1	1	307.354	1.375	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343460318	410470098	/nfs/dbraw/zinc/47/00/98/410470098.db2.gz	SHYHHJKYZNGYOU-RISCZKNCSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)COc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343464890	410473170	/nfs/dbraw/zinc/47/31/70/410473170.db2.gz	YVUPJVFNUCZCRI-VXGBXAGGSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CCC[N@H+]1C	ZINC000343427196	410442930	/nfs/dbraw/zinc/44/29/30/410442930.db2.gz	DQVDDGJGHLUTHY-JQWIXIFHSA-N	1	1	309.370	1.125	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000347394887	410519466	/nfs/dbraw/zinc/51/94/66/410519466.db2.gz	XZERFUITGKMYLG-LBPRGKRZSA-N	1	1	306.366	1.727	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000340098173	410675558	/nfs/dbraw/zinc/67/55/58/410675558.db2.gz	VVPHIMVYLITDJU-JSGCOSHPSA-N	1	1	320.393	1.919	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000352366209	410649902	/nfs/dbraw/zinc/64/99/02/410649902.db2.gz	CDORECQOUUVABM-UHFFFAOYSA-N	1	1	318.377	2.523	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+][C@H](CO)c2c(F)cccc2F)c1	ZINC000359519365	410705327	/nfs/dbraw/zinc/70/53/27/410705327.db2.gz	GUBCRNOIFFYRRX-GFCCVEGCSA-N	1	1	312.276	1.393	20	5		DDBDMO
C[C@@H]1CC[C@@]2(CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)C1	ZINC000359555598	410728409	/nfs/dbraw/zinc/72/84/09/410728409.db2.gz	KRSMRNGVPDYUGD-VHDGCEQUSA-N	1	1	308.382	1.664	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1	ZINC000343829904	410730765	/nfs/dbraw/zinc/73/07/65/410730765.db2.gz	NHUCSGXQWPTVRC-IINYFYTJSA-N	1	1	319.361	1.816	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000330559655	410775268	/nfs/dbraw/zinc/77/52/68/410775268.db2.gz	HJIUFEVWOKUZIO-NEPJUHHUSA-N	1	1	308.382	1.784	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)[N@H+](C)C[C@@H]1C	ZINC000330575846	410792109	/nfs/dbraw/zinc/79/21/09/410792109.db2.gz	GEEHLZVIRMOIPO-OLZOCXBDSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1CN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330612439	410828292	/nfs/dbraw/zinc/82/82/92/410828292.db2.gz	QVYINUJPTYCPJK-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000353236589	410870626	/nfs/dbraw/zinc/87/06/26/410870626.db2.gz	SWFCGUJCGKVMOR-RISCZKNCSA-N	1	1	307.350	1.667	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC1(O)CCC1	ZINC000353476124	411012403	/nfs/dbraw/zinc/01/24/03/411012403.db2.gz	YMUSAGSIPMGPAH-UHFFFAOYSA-N	1	1	308.334	1.808	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)c1[N+](=O)[O-]	ZINC000331279111	411055287	/nfs/dbraw/zinc/05/52/87/411055287.db2.gz	ANEVLITVOWKVMG-UHFFFAOYSA-N	1	1	309.370	1.478	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000130782465	196109129	/nfs/dbraw/zinc/10/91/29/196109129.db2.gz	KHZHTBNXSASBIW-LLVKDONJSA-N	1	1	304.350	1.808	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000416731805	225043491	/nfs/dbraw/zinc/04/34/91/225043491.db2.gz	ORGDMNPVXXSNTO-NWDGAFQWSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000416731805	225043494	/nfs/dbraw/zinc/04/34/94/225043494.db2.gz	ORGDMNPVXXSNTO-NWDGAFQWSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000420930635	226591087	/nfs/dbraw/zinc/59/10/87/226591087.db2.gz	CRRPVFNDTKNSIB-CHWSQXEVSA-N	1	1	321.377	1.874	20	5		DDBDMO
Cc1c(CNC(=O)c2cc(C[NH+](C)C)on2)cccc1[N+](=O)[O-]	ZINC000360528113	418456530	/nfs/dbraw/zinc/45/65/30/418456530.db2.gz	KOQBPHKPKCTUTC-UHFFFAOYSA-N	1	1	318.333	1.883	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000366681726	418504072	/nfs/dbraw/zinc/50/40/72/418504072.db2.gz	PKOGVRQQXIYFMY-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@]2(CC[NH2+]C2)C1	ZINC000360831958	418528109	/nfs/dbraw/zinc/52/81/09/418528109.db2.gz	JVFRDCCCWCPGKU-HNNXBMFYSA-N	1	1	315.333	1.297	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(CCOc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000375028365	418589806	/nfs/dbraw/zinc/58/98/06/418589806.db2.gz	CJZVNEMITLNGDK-BBRMVZONSA-N	1	1	305.378	2.000	20	5		DDBDMO
CNc1c(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000361213712	418606382	/nfs/dbraw/zinc/60/63/82/418606382.db2.gz	ZSLLJZIPXDPYSQ-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CNc1c(C(=O)NCC[N@@H+](C)CCCOC)cccc1[N+](=O)[O-]	ZINC000361211406	418607170	/nfs/dbraw/zinc/60/71/70/418607170.db2.gz	HRXCDNHDTYMMHI-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]12	ZINC000367840328	418643910	/nfs/dbraw/zinc/64/39/10/418643910.db2.gz	QDSKXAXHFFTWHW-WDEREUQCSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])CC[C@H]12	ZINC000367840328	418643913	/nfs/dbraw/zinc/64/39/13/418643913.db2.gz	QDSKXAXHFFTWHW-WDEREUQCSA-N	1	1	323.736	1.343	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](OC)C1	ZINC000361363412	418635690	/nfs/dbraw/zinc/63/56/90/418635690.db2.gz	YPVKYYURTLMUAF-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000361788239	418711100	/nfs/dbraw/zinc/71/11/00/418711100.db2.gz	QWCLMXTVVGCOAI-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](CC2CC2)CC2CCC2)c1	ZINC000361557812	418677421	/nfs/dbraw/zinc/67/74/21/418677421.db2.gz	STQVQNFRGDYRLD-OAHLLOKOSA-N	1	1	308.382	1.664	20	5		DDBDMO
C[C@H]1OCC[C@H]1[N@@H+](CCO)CCOc1ccc([N+](=O)[O-])cc1	ZINC000361583628	418686677	/nfs/dbraw/zinc/68/66/77/418686677.db2.gz	LPGOJQURIIQLMF-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)[C@H]1CCO[C@H]1C	ZINC000361586104	418688205	/nfs/dbraw/zinc/68/82/05/418688205.db2.gz	LCDRNXUQOOIHQK-FZMZJTMJSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCO)[C@H]1CCO[C@H]1C	ZINC000361586104	418688208	/nfs/dbraw/zinc/68/82/08/418688208.db2.gz	LCDRNXUQOOIHQK-FZMZJTMJSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000372351424	418860142	/nfs/dbraw/zinc/86/01/42/418860142.db2.gz	RXXQAWZWGBXOIU-BPLDGKMQSA-N	1	1	321.377	1.502	20	5		DDBDMO
O=C(CC[N@H+](CCO)C1CCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000411609675	419360308	/nfs/dbraw/zinc/36/03/08/419360308.db2.gz	GELUMFYGFJKOGS-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2CCO)c2c(c1)COCO2	ZINC000426230922	419410633	/nfs/dbraw/zinc/41/06/33/419410633.db2.gz	NXMYATSCNFTSJK-CYBMUJFWSA-N	1	1	308.334	1.808	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3CCO)n2)cc1	ZINC000426225411	419413470	/nfs/dbraw/zinc/41/34/70/419413470.db2.gz	FBRYOVKMNVMLIP-GFCCVEGCSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000420943350	419372935	/nfs/dbraw/zinc/37/29/35/419372935.db2.gz	PSSHVQSGBFTFFP-OLZOCXBDSA-N	1	1	321.377	1.874	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000411913171	419477798	/nfs/dbraw/zinc/47/77/98/419477798.db2.gz	REPBQTHQZQZQRY-RYUDHWBXSA-N	1	1	300.742	1.830	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000411913171	419477808	/nfs/dbraw/zinc/47/78/08/419477808.db2.gz	REPBQTHQZQZQRY-RYUDHWBXSA-N	1	1	300.742	1.830	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@H]1C(C)C	ZINC000429364746	420007737	/nfs/dbraw/zinc/00/77/37/420007737.db2.gz	SUVKUZGGFQRFTR-STQMWFEESA-N	1	1	310.354	1.311	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](CCO)[C@@H]1CCO[C@@H]1C	ZINC000430248471	420096458	/nfs/dbraw/zinc/09/64/58/420096458.db2.gz	ZQKRBBPZMZWIOY-BXUZGUMPSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)[C@@H]1CCO[C@@H]1C	ZINC000430248471	420096462	/nfs/dbraw/zinc/09/64/62/420096462.db2.gz	ZQKRBBPZMZWIOY-BXUZGUMPSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000416288732	420307387	/nfs/dbraw/zinc/30/73/87/420307387.db2.gz	DOQBJUWSBCELLG-UWVGGRQHSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1csc([N+](=O)[O-])c1	ZINC000416288732	420307391	/nfs/dbraw/zinc/30/73/91/420307391.db2.gz	DOQBJUWSBCELLG-UWVGGRQHSA-N	1	1	313.379	1.183	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420601887	420328089	/nfs/dbraw/zinc/32/80/89/420328089.db2.gz	HOMUJZLKNRLVRM-UHFFFAOYSA-N	1	1	317.349	1.725	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000420636989	420335975	/nfs/dbraw/zinc/33/59/75/420335975.db2.gz	OCPSXSXTIOJVFG-LLVKDONJSA-N	1	1	317.349	1.774	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(c2ncc([N+](=O)[O-])s2)CC1	ZINC000425283122	420337582	/nfs/dbraw/zinc/33/75/82/420337582.db2.gz	SRKYUSWDEXNDMR-UHFFFAOYSA-N	1	1	300.384	1.598	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc(C)c([N+](=O)[O-])cc1C	ZINC000416390676	420352534	/nfs/dbraw/zinc/35/25/34/420352534.db2.gz	NQURDFYMIJNNTG-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000439696547	420532606	/nfs/dbraw/zinc/53/26/06/420532606.db2.gz	NMXWLNXCBOGLMJ-ZDUSSCGKSA-N	1	1	323.397	1.418	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)n1	ZINC000457082140	420606163	/nfs/dbraw/zinc/60/61/63/420606163.db2.gz	DOWWDCGNNOAHGB-NSHDSACASA-N	1	1	309.370	1.366	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000457000397	420584706	/nfs/dbraw/zinc/58/47/06/420584706.db2.gz	UQUKUJJLYKIOCC-AWEZNQCLSA-N	1	1	300.318	1.710	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000441692433	420660132	/nfs/dbraw/zinc/66/01/32/420660132.db2.gz	TUCRKFAXGKSFBY-XNRPHZJLSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCN1CCN(C)CC1	ZINC000449220722	420970593	/nfs/dbraw/zinc/97/05/93/420970593.db2.gz	RBIBRXNCSCYVNL-OAHLLOKOSA-N	1	1	320.437	1.753	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000487515347	421032428	/nfs/dbraw/zinc/03/24/28/421032428.db2.gz	KHQTVVDCKUSRLE-YPMHNXCESA-N	1	1	321.381	1.153	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CC[C@H](C)C2)c1	ZINC000524775179	421271126	/nfs/dbraw/zinc/27/11/26/421271126.db2.gz	UOMAYEATFSEXHI-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[N@H+]1CC=CCC1	ZINC000561929076	421336673	/nfs/dbraw/zinc/33/66/73/421336673.db2.gz	KMIJNEZKRMITPO-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NCC[N@@H+]1CC=CCC1	ZINC000561929076	421336675	/nfs/dbraw/zinc/33/66/75/421336675.db2.gz	KMIJNEZKRMITPO-UHFFFAOYSA-N	1	1	319.361	1.985	20	5		DDBDMO
C[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551039516	421526360	/nfs/dbraw/zinc/52/63/60/421526360.db2.gz	KIGZVAYNNFXMTC-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551039516	421526363	/nfs/dbraw/zinc/52/63/63/421526363.db2.gz	KIGZVAYNNFXMTC-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551039516	421526365	/nfs/dbraw/zinc/52/63/65/421526365.db2.gz	KIGZVAYNNFXMTC-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)CC1	ZINC000552057576	421571140	/nfs/dbraw/zinc/57/11/40/421571140.db2.gz	HQHLMQOZBBQVEX-UHFFFAOYSA-N	1	1	309.370	1.510	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000553785427	421625434	/nfs/dbraw/zinc/62/54/34/421625434.db2.gz	ZEFLTRVISQPIRV-YWPYICTPSA-N	1	1	318.377	1.792	20	5		DDBDMO
Cc1ccc(C[NH2+]C2(CCO)CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000519834654	421733918	/nfs/dbraw/zinc/73/39/18/421733918.db2.gz	UNSCGTXPGICSBO-UHFFFAOYSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCNCC1([NH3+])CCC1	ZINC000342146784	271318762	/nfs/dbraw/zinc/31/87/62/271318762.db2.gz	YUFYPQZVTSZPOD-UHFFFAOYSA-N	1	1	306.366	1.703	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]CC1(N)CCC1	ZINC000342146784	271318764	/nfs/dbraw/zinc/31/87/64/271318764.db2.gz	YUFYPQZVTSZPOD-UHFFFAOYSA-N	1	1	306.366	1.703	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000344645344	272078622	/nfs/dbraw/zinc/07/86/22/272078622.db2.gz	PDSUXDYYEZGEBC-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
COc1cc(N2CC[NH+](CCCO)CC2)c([N+](=O)[O-])cc1F	ZINC000270189700	274096474	/nfs/dbraw/zinc/09/64/74/274096474.db2.gz	BOJQOEOINXYOLV-UHFFFAOYSA-N	1	1	313.329	1.247	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)nc1	ZINC000274025843	275041228	/nfs/dbraw/zinc/04/12/28/275041228.db2.gz	WMZDQTWLXRGZIE-SMDDNHRTSA-N	1	1	303.366	1.838	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-]	ZINC000323707575	298261959	/nfs/dbraw/zinc/26/19/59/298261959.db2.gz	JYZZKQMROPUFIJ-INIZCTEOSA-N	1	1	318.377	1.804	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000354005080	298337086	/nfs/dbraw/zinc/33/70/86/298337086.db2.gz	DWZGMRVZFRCVOQ-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CN(C(=O)[C@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1	ZINC000362985817	300194082	/nfs/dbraw/zinc/19/40/82/300194082.db2.gz	JVZOOQBEOJIVBQ-HOTGVXAUSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)cccc1[N+](=O)[O-]	ZINC000363689685	300296266	/nfs/dbraw/zinc/29/62/66/300296266.db2.gz	GWNPRVCFQTYLCF-CHWSQXEVSA-N	1	1	319.361	1.496	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@]2(CCOC2)O1	ZINC000369546954	301196556	/nfs/dbraw/zinc/19/65/56/301196556.db2.gz	RCXPJEHGLQOKPW-JSGCOSHPSA-N	1	1	310.354	1.061	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000370069192	301270028	/nfs/dbraw/zinc/27/00/28/301270028.db2.gz	FLFQBASZFWSCDH-LLVKDONJSA-N	1	1	307.350	1.288	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@H](C)C[NH+]1CCOCC1	ZINC000194741993	302039302	/nfs/dbraw/zinc/03/93/02/302039302.db2.gz	LFFMABPVENKYJF-LBPRGKRZSA-N	1	1	321.377	1.601	20	5		DDBDMO
Cn1c(C(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-]	ZINC000261718217	302894465	/nfs/dbraw/zinc/89/44/65/302894465.db2.gz	KYFGEWIISAVGNM-CYBMUJFWSA-N	1	1	315.333	1.115	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCCCC2)C1)c1[nH]ncc1[N+](=O)[O-]	ZINC000362394291	307020745	/nfs/dbraw/zinc/02/07/45/307020745.db2.gz	CDKPKVFWHYTGSH-NSHDSACASA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](C2CCCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000362394291	307020746	/nfs/dbraw/zinc/02/07/46/307020746.db2.gz	CDKPKVFWHYTGSH-NSHDSACASA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCCCC2)C1)c1n[nH]cc1[N+](=O)[O-]	ZINC000362394291	307020747	/nfs/dbraw/zinc/02/07/47/307020747.db2.gz	CDKPKVFWHYTGSH-NSHDSACASA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C1OCC[C@@H]1CC[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369004144	307114235	/nfs/dbraw/zinc/11/42/35/307114235.db2.gz	YNPZAOVNUMJLEU-NWDGAFQWSA-N	1	1	308.338	1.381	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3ccc4ncc([N+](=O)[O-])n4n3)[C@H]2C1	ZINC000378507648	307290532	/nfs/dbraw/zinc/29/05/32/307290532.db2.gz	WPDYHAQXBHKEEU-MNOVXSKESA-N	1	1	302.338	1.168	20	5		DDBDMO
C[N@@H+](C[C@H](O)CNCc1nc2cc([N+](=O)[O-])ccc2[nH]1)C1CC1	ZINC000566123491	308044751	/nfs/dbraw/zinc/04/47/51/308044751.db2.gz	AOVVYQFFGCWJEE-GFCCVEGCSA-N	1	1	319.365	1.016	20	5		DDBDMO
C[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1(C)C	ZINC000567176324	308074841	/nfs/dbraw/zinc/07/48/41/308074841.db2.gz	AZCQIZKGPYUVKF-UHFFFAOYSA-N	1	1	303.366	1.997	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1CCC2)c1ccc([N+](=O)[O-])cc1	ZINC000452184214	533711448	/nfs/dbraw/zinc/71/14/48/533711448.db2.gz	RFGYLYCKLAEGKR-WFASDCNBSA-N	1	1	318.377	1.162	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000583297394	337310425	/nfs/dbraw/zinc/31/04/25/337310425.db2.gz	NAOHQUOZQUUEEZ-BETUJISGSA-N	1	1	319.361	1.166	20	5		DDBDMO
Cc1nc(N(C)CCC[N@H+](C)CCN(C)C)ncc1[N+](=O)[O-]	ZINC000295697469	534437488	/nfs/dbraw/zinc/43/74/88/534437488.db2.gz	PJQRESKUFLZODZ-UHFFFAOYSA-N	1	1	310.402	1.013	20	5		DDBDMO
Cc1nc(N(C)CCCN(C)CC[NH+](C)C)ncc1[N+](=O)[O-]	ZINC000295697469	534437490	/nfs/dbraw/zinc/43/74/90/534437490.db2.gz	PJQRESKUFLZODZ-UHFFFAOYSA-N	1	1	310.402	1.013	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000458170298	528546766	/nfs/dbraw/zinc/54/67/66/528546766.db2.gz	OYNHISMMELOEER-NSHDSACASA-N	1	1	323.397	1.732	20	5		DDBDMO
CC[N@H+](CCOC)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000299112302	528563589	/nfs/dbraw/zinc/56/35/89/528563589.db2.gz	BBYREDCMIZROPH-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
CC[N@@H+](CCOC)CC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000299112302	528563592	/nfs/dbraw/zinc/56/35/92/528563592.db2.gz	BBYREDCMIZROPH-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
CCN1CC[NH+](C[C@H](C)CNc2ncc([N+](=O)[O-])c(C)n2)CC1	ZINC000294776213	529148642	/nfs/dbraw/zinc/14/86/42/529148642.db2.gz	ABILGWYCHUZBHU-GFCCVEGCSA-N	1	1	322.413	1.379	20	5		DDBDMO
C[C@H]1C[C@H](Nc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000820668795	599589775	/nfs/dbraw/zinc/58/97/75/599589775.db2.gz	WOKYVNOMPPLBJS-GXSJLCMTSA-N	1	1	317.353	1.670	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@@H+]2CCC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000797629531	700016900	/nfs/dbraw/zinc/01/69/00/700016900.db2.gz	IJFIABWWFUKEQJ-ZDUSSCGKSA-N	1	1	321.377	1.883	20	5		DDBDMO
CCC[N@H+](C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000069062429	696380016	/nfs/dbraw/zinc/38/00/16/696380016.db2.gz	RMMZKAFAFWPNNB-OAHLLOKOSA-N	1	1	320.349	1.661	20	5		DDBDMO
CCC[N@@H+](C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000069062429	696380017	/nfs/dbraw/zinc/38/00/17/696380017.db2.gz	RMMZKAFAFWPNNB-OAHLLOKOSA-N	1	1	320.349	1.661	20	5		DDBDMO
C[C@H]1COCCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000772826074	697682979	/nfs/dbraw/zinc/68/29/79/697682979.db2.gz	RSFAERWGQRQWGE-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@H]1COCCC[N@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000772826074	697682981	/nfs/dbraw/zinc/68/29/81/697682981.db2.gz	RSFAERWGQRQWGE-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@H]2CCCOC2)c2ncc([N+](=O)[O-])cc12	ZINC000749951791	700193782	/nfs/dbraw/zinc/19/37/82/700193782.db2.gz	CVHUJLKVBKSUPM-GFCCVEGCSA-N	1	1	319.365	1.964	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000775777999	698031523	/nfs/dbraw/zinc/03/15/23/698031523.db2.gz	STIZPTWHCBAIMG-CQSZACIVSA-N	1	1	316.317	1.182	20	5		DDBDMO
NC(=O)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000776581531	698120847	/nfs/dbraw/zinc/12/08/47/698120847.db2.gz	JRXZQWUDTBNCMZ-AWEZNQCLSA-N	1	1	307.350	1.358	20	5		DDBDMO
NC(=O)CC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776583017	698121406	/nfs/dbraw/zinc/12/14/06/698121406.db2.gz	YNVFMJQMUPIYEW-SWLSCSKDSA-N	1	1	321.377	1.606	20	5		DDBDMO
CCOCCO[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776592137	698123602	/nfs/dbraw/zinc/12/36/02/698123602.db2.gz	YZRRWJVICUUHRF-HOTGVXAUSA-N	1	1	324.377	1.756	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCSC[C@@H]2CCO)c1	ZINC000750095183	700203572	/nfs/dbraw/zinc/20/35/72/700203572.db2.gz	WHGSUHRSMZVIKW-UONOGXRCSA-N	1	1	312.391	1.428	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)C1	ZINC000779708789	698455181	/nfs/dbraw/zinc/45/51/81/698455181.db2.gz	XYWHYOGIKJSHCV-RYUDHWBXSA-N	1	1	319.365	1.134	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@H]1O	ZINC000782524606	698734438	/nfs/dbraw/zinc/73/44/38/698734438.db2.gz	OMGPJTVWRLUXRF-NOZJJQNGSA-N	1	1	311.313	1.375	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000792865490	699719581	/nfs/dbraw/zinc/71/95/81/699719581.db2.gz	CALJQEVQJMMQGM-KOLCDFICSA-N	1	1	322.321	1.589	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000742197693	699865600	/nfs/dbraw/zinc/86/56/00/699865600.db2.gz	YBXJLCMDJUVXDY-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1CN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000742197693	699865602	/nfs/dbraw/zinc/86/56/02/699865602.db2.gz	YBXJLCMDJUVXDY-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000795751076	699889625	/nfs/dbraw/zinc/88/96/25/699889625.db2.gz	VLAISABETZSMLS-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000795751076	699889627	/nfs/dbraw/zinc/88/96/27/699889627.db2.gz	VLAISABETZSMLS-NSHDSACASA-N	1	1	305.338	1.778	20	5		DDBDMO
C[C@@H]1CN(C(=O)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)CCO1	ZINC000801600085	700326395	/nfs/dbraw/zinc/32/63/95/700326395.db2.gz	LAHKDRZCUYEQMR-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@@H]1CN(C(=O)C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)CCO1	ZINC000801600085	700326399	/nfs/dbraw/zinc/32/63/99/700326399.db2.gz	LAHKDRZCUYEQMR-CYBMUJFWSA-N	1	1	321.377	1.316	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@@H]1C	ZINC000754227530	700490740	/nfs/dbraw/zinc/49/07/40/700490740.db2.gz	ZFNMQHCAFNPXMS-LBPRGKRZSA-N	1	1	320.393	1.827	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C[C@@H]1C	ZINC000754227530	700490741	/nfs/dbraw/zinc/49/07/41/700490741.db2.gz	ZFNMQHCAFNPXMS-LBPRGKRZSA-N	1	1	320.393	1.827	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([NH2+]CC(F)(F)CO)CC2)cc1	ZINC000768284321	701166410	/nfs/dbraw/zinc/16/64/10/701166410.db2.gz	BZDAELCOTLAEKP-UHFFFAOYSA-N	1	1	315.320	1.781	20	5		DDBDMO
C[C@H]1COCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000769455705	701245551	/nfs/dbraw/zinc/24/55/51/701245551.db2.gz	JGOJHZGUOCIRIB-LLVKDONJSA-N	1	1	308.334	1.834	20	5		DDBDMO
C[C@H]1COCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000769455705	701245552	/nfs/dbraw/zinc/24/55/52/701245552.db2.gz	JGOJHZGUOCIRIB-LLVKDONJSA-N	1	1	308.334	1.834	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H]3COC(=O)N[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000830916915	706602301	/nfs/dbraw/zinc/60/23/01/706602301.db2.gz	UUSLSKBJQCYXGD-NEPJUHHUSA-N	1	1	321.333	1.534	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]3COC(=O)N[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000830916915	706602305	/nfs/dbraw/zinc/60/23/05/706602305.db2.gz	UUSLSKBJQCYXGD-NEPJUHHUSA-N	1	1	321.333	1.534	20	5		DDBDMO
O=[N+]([O-])c1c(N2CCN(c3[nH]cc[nH+]3)CC2)nc2ccccn21	ZINC000808049959	701495590	/nfs/dbraw/zinc/49/55/90/701495590.db2.gz	LXEHLVVDFMBLFK-UHFFFAOYSA-N	1	1	313.321	1.292	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](CC(N)=O)C2)c2ccc([N+](=O)[O-])cc12	ZINC000808228546	701509478	/nfs/dbraw/zinc/50/94/78/701509478.db2.gz	UJQJWKNSMJSNOM-LLVKDONJSA-N	1	1	317.349	1.408	20	5		DDBDMO
CN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1	ZINC000866068640	706609915	/nfs/dbraw/zinc/60/99/15/706609915.db2.gz	USDYQXYNGYMQJF-GFCCVEGCSA-N	1	1	309.341	1.829	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)C(C)(C)CC2)c([N+](=O)[O-])c1	ZINC000866113951	706622371	/nfs/dbraw/zinc/62/23/71/706622371.db2.gz	FQYCWNMXJYSSBS-UHFFFAOYSA-N	1	1	320.393	1.875	20	5		DDBDMO
COCCC[N@H+](C)CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839972710	701885095	/nfs/dbraw/zinc/88/50/95/701885095.db2.gz	GOONXQWWHOLFRL-OAHLLOKOSA-N	1	1	323.349	1.458	20	5		DDBDMO
COCCC[N@@H+](C)CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000839972710	701885100	/nfs/dbraw/zinc/88/51/00/701885100.db2.gz	GOONXQWWHOLFRL-OAHLLOKOSA-N	1	1	323.349	1.458	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)CC[C@H]21	ZINC000866205260	706647968	/nfs/dbraw/zinc/64/79/68/706647968.db2.gz	KSZXBAMMVLAMDL-GHMZBOCLSA-N	1	1	302.338	1.168	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[NH2+]C[C@H]3CCCO3)n2)c1	ZINC000842568124	702734054	/nfs/dbraw/zinc/73/40/54/702734054.db2.gz	HJTIGWHTGYWFFU-GFCCVEGCSA-N	1	1	304.306	1.913	20	5		DDBDMO
[NH3+]C[C@H]1CCCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843347176	702863587	/nfs/dbraw/zinc/86/35/87/702863587.db2.gz	BOFZFMKBLXRCEX-LLVKDONJSA-N	1	1	324.356	1.733	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@@H+](C)CCN1C	ZINC000843797211	702925776	/nfs/dbraw/zinc/92/57/76/702925776.db2.gz	YDSLDZJGIKWOPH-LLVKDONJSA-N	1	1	324.356	1.018	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000843797211	702925778	/nfs/dbraw/zinc/92/57/78/702925778.db2.gz	YDSLDZJGIKWOPH-LLVKDONJSA-N	1	1	324.356	1.018	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CC[C@H]21	ZINC000879583219	706727647	/nfs/dbraw/zinc/72/76/47/706727647.db2.gz	WQDKDLMIMHYUNA-XHDPSFHLSA-N	1	1	315.377	1.997	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000848659581	703572909	/nfs/dbraw/zinc/57/29/09/703572909.db2.gz	MPSLQAVJWCFHTJ-NWDGAFQWSA-N	1	1	307.350	1.879	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000879694144	706763005	/nfs/dbraw/zinc/76/30/05/706763005.db2.gz	SYWBHMBENMPIHT-OKILXGFUSA-N	1	1	324.377	1.415	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000879694144	706763008	/nfs/dbraw/zinc/76/30/08/706763008.db2.gz	SYWBHMBENMPIHT-OKILXGFUSA-N	1	1	324.377	1.415	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000852432979	704045801	/nfs/dbraw/zinc/04/58/01/704045801.db2.gz	RLOCQGLIALVUOU-CYBMUJFWSA-N	1	1	321.333	1.500	20	5		DDBDMO
CCc1nc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)co1	ZINC000819353237	704111789	/nfs/dbraw/zinc/11/17/89/704111789.db2.gz	AZBYNRBHPKWSRE-ZDUSSCGKSA-N	1	1	321.333	1.675	20	5		DDBDMO
C[N@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CCC1(C)C	ZINC000871153270	704232663	/nfs/dbraw/zinc/23/26/63/704232663.db2.gz	JEVIZJXTOZBUTG-UHFFFAOYSA-N	1	1	323.397	1.469	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@H](n3ccnn3)C2)cc1	ZINC000823468832	705249633	/nfs/dbraw/zinc/24/96/33/705249633.db2.gz	LIBKLMXKOFIXLQ-GJZGRUSLSA-N	1	1	317.349	1.557	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](n3ccnn3)C2)c1	ZINC000823469101	705250279	/nfs/dbraw/zinc/25/02/79/705250279.db2.gz	OQPLJUWJXPHQFP-HUUCEWRRSA-N	1	1	317.349	1.557	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000824369054	705437854	/nfs/dbraw/zinc/43/78/54/705437854.db2.gz	VANYXIZMURAWIG-QWHCGFSZSA-N	1	1	321.381	1.233	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825615413	705703571	/nfs/dbraw/zinc/70/35/71/705703571.db2.gz	VOVQYDSIGGGLGZ-RISCZKNCSA-N	1	1	309.366	1.475	20	5		DDBDMO
O=C([C@H](O)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CCC2)CC1	ZINC000825909630	705744409	/nfs/dbraw/zinc/74/44/09/705744409.db2.gz	DEJIIQGXFPDZTL-OAHLLOKOSA-N	1	1	319.361	1.325	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCCN(C(N)=O)CC1	ZINC000876656505	705805501	/nfs/dbraw/zinc/80/55/01/705805501.db2.gz	CDLKPDOTIQHUON-UHFFFAOYSA-N	1	1	306.366	1.798	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)CC[C@H]21	ZINC000827371931	705988354	/nfs/dbraw/zinc/98/83/54/705988354.db2.gz	BELWJINKVDYOSD-DGCLKSJQSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[C@H]1C[C@@H](N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000877831479	706226900	/nfs/dbraw/zinc/22/69/00/706226900.db2.gz	UXWOMRDUAOLYJZ-DDUYRFODSA-N	1	1	323.393	1.061	20	5		DDBDMO
C[C@H]1C[C@@H]([NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000877831479	706226902	/nfs/dbraw/zinc/22/69/02/706226902.db2.gz	UXWOMRDUAOLYJZ-DDUYRFODSA-N	1	1	323.393	1.061	20	5		DDBDMO
COc1ccc(CN[C@H]2CC[N@H+](CC(C)(C)O)C2)cc1[N+](=O)[O-]	ZINC000865659729	706489844	/nfs/dbraw/zinc/48/98/44/706489844.db2.gz	QRTVZFLOHHIXJY-ZDUSSCGKSA-N	1	1	323.393	1.538	20	5		DDBDMO
COc1ccc(CN[C@H]2CC[N@@H+](CC(C)(C)O)C2)cc1[N+](=O)[O-]	ZINC000865659729	706489846	/nfs/dbraw/zinc/48/98/46/706489846.db2.gz	QRTVZFLOHHIXJY-ZDUSSCGKSA-N	1	1	323.393	1.538	20	5		DDBDMO
COC(=O)Cc1ccc(N2CC[N@@H+](C)C(C)(C)C2)c([N+](=O)[O-])c1	ZINC000865914255	706562864	/nfs/dbraw/zinc/56/28/64/706562864.db2.gz	HLVPHKWSLMSRQS-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@H](C(F)(F)F)O1	ZINC000880059589	706866741	/nfs/dbraw/zinc/86/67/41/706866741.db2.gz	JKGZKGXQDKMUFS-MWLCHTKSSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC[C@H](C(F)(F)F)O1	ZINC000880059589	706866743	/nfs/dbraw/zinc/86/67/43/706866743.db2.gz	JKGZKGXQDKMUFS-MWLCHTKSSA-N	1	1	322.287	1.833	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])C2	ZINC000880329003	706941671	/nfs/dbraw/zinc/94/16/71/706941671.db2.gz	GTPWYVFHZAJTRP-FZMZJTMJSA-N	1	1	308.338	1.103	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCOC[C@@H]1OC	ZINC000880426000	706970384	/nfs/dbraw/zinc/97/03/84/706970384.db2.gz	RFROUJYYEIGOJR-ZFWWWQNUSA-N	1	1	310.350	1.839	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000832913229	706997613	/nfs/dbraw/zinc/99/76/13/706997613.db2.gz	YFGLIFYVVRURHO-VNHYZAJKSA-N	1	1	319.361	1.038	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880529349	707005730	/nfs/dbraw/zinc/00/57/30/707005730.db2.gz	ALMXZUWXDKTOLB-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)[C@H]12	ZINC000880529349	707005735	/nfs/dbraw/zinc/00/57/35/707005735.db2.gz	ALMXZUWXDKTOLB-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+]2C[C@H](O)CC3(CCOCC3)C2)c1	ZINC000880588941	707029593	/nfs/dbraw/zinc/02/95/93/707029593.db2.gz	IHZLLMMHDCDIJF-OAHLLOKOSA-N	1	1	306.362	1.958	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1cnn(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c1	ZINC000872786757	707601966	/nfs/dbraw/zinc/60/19/66/707601966.db2.gz	RRJFGRKRDTUVPX-OKILXGFUSA-N	1	1	314.345	1.994	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)OC[C@@H]1CCCC[N@@H+]1C(C)C	ZINC000837475165	707658764	/nfs/dbraw/zinc/65/87/64/707658764.db2.gz	HFUJIGSGAJZUNG-ZDUSSCGKSA-N	1	1	324.381	1.906	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)N1CCCC1	ZINC000838901074	707999705	/nfs/dbraw/zinc/99/97/05/707999705.db2.gz	NQUGYQYYEVQNML-UHFFFAOYSA-N	1	1	303.362	1.965	20	5		DDBDMO
C[C@@H](CNC(=O)NC[C@@H]1CC[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000896619911	708099083	/nfs/dbraw/zinc/09/90/83/708099083.db2.gz	OMGMOUBJDIKLFS-RYUDHWBXSA-N	1	1	306.366	1.702	20	5		DDBDMO
CC(=O)c1cc(N2CCN(C)CC[N@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000897094874	708228324	/nfs/dbraw/zinc/22/83/24/708228324.db2.gz	OCBQYMDMMYSUOX-UHFFFAOYSA-N	1	1	320.393	1.481	20	5		DDBDMO
O=C1CCCN1[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886250007	708725366	/nfs/dbraw/zinc/72/53/66/708725366.db2.gz	YHQBNOYWQHKNCP-CQSZACIVSA-N	1	1	318.377	1.967	20	5		DDBDMO
O=C1CCCN1[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886250007	708725368	/nfs/dbraw/zinc/72/53/68/708725368.db2.gz	YHQBNOYWQHKNCP-CQSZACIVSA-N	1	1	318.377	1.967	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c1	ZINC000886572806	708778852	/nfs/dbraw/zinc/77/88/52/708778852.db2.gz	BBEOHPVSADQTOP-LNSITVRQSA-N	1	1	320.345	1.584	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887933441	709170340	/nfs/dbraw/zinc/17/03/40/709170340.db2.gz	RGZRKVDNHGABFY-ABAIWWIYSA-N	1	1	307.325	1.758	20	5		DDBDMO
O=C(Cc1c[nH]cn1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000899941794	709244663	/nfs/dbraw/zinc/24/46/63/709244663.db2.gz	KZIGLUVPFUNHSU-UHFFFAOYSA-N	1	1	315.333	1.209	20	5		DDBDMO
C[C@@H](NC(=O)C[C@@]1(O)CCC[N@@H+](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000900267396	709512611	/nfs/dbraw/zinc/51/26/11/709512611.db2.gz	FHEOPOIWAPHJJS-WBMJQRKESA-N	1	1	321.377	1.619	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000893133767	710559713	/nfs/dbraw/zinc/55/97/13/710559713.db2.gz	COJGWQMCISCXIG-GXFFZTMASA-N	1	1	321.377	1.881	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000893133767	710559714	/nfs/dbraw/zinc/55/97/14/710559714.db2.gz	COJGWQMCISCXIG-GXFFZTMASA-N	1	1	321.377	1.881	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000893266681	710583034	/nfs/dbraw/zinc/58/30/34/710583034.db2.gz	SQKMOQGANXGWNB-DZGCQCFKSA-N	1	1	318.377	1.483	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOC(=O)c2cc([N+](=O)[O-])cn2C)CCO1	ZINC000893390495	710631469	/nfs/dbraw/zinc/63/14/69/710631469.db2.gz	GXCKKOTVHSKIJJ-LLVKDONJSA-N	1	1	311.338	1.201	20	5		DDBDMO
COc1cc([C@@H](C)NC[C@@H]2C[N@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091852	711029863	/nfs/dbraw/zinc/02/98/63/711029863.db2.gz	BMJJVKYGMXKSJU-IUODEOHRSA-N	1	1	322.409	1.500	20	5		DDBDMO
COc1cc([C@@H](C)NC[C@@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000903091852	711029866	/nfs/dbraw/zinc/02/98/66/711029866.db2.gz	BMJJVKYGMXKSJU-IUODEOHRSA-N	1	1	322.409	1.500	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc4nonc4c3[N+](=O)[O-])CC[C@@H]21	ZINC000895021672	711372909	/nfs/dbraw/zinc/37/29/09/711372909.db2.gz	HUOXPPDSBAEUGC-KOLCDFICSA-N	1	1	303.322	1.661	20	5		DDBDMO
Cn1cc(C[N@H+]2C[C@@H]3C[C@]3(O)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000895645424	711567870	/nfs/dbraw/zinc/56/78/70/711567870.db2.gz	BYDIDGHSTNMBGT-BBRMVZONSA-N	1	1	314.345	1.562	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000896282430	711700602	/nfs/dbraw/zinc/70/06/02/711700602.db2.gz	NLZLSFFHEUXVDV-CQSZACIVSA-N	1	1	321.377	1.963	20	5		DDBDMO
Cc1ccc(CNC(=O)C[C@@]2(O)CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000913754687	713295781	/nfs/dbraw/zinc/29/57/81/713295781.db2.gz	VBTMVXDEMMVSLV-INIZCTEOSA-N	1	1	321.377	1.366	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C1C[NH+]([C@H]2CCOC2)C1	ZINC000908268227	712724901	/nfs/dbraw/zinc/72/49/01/712724901.db2.gz	MKSRLDMSBHRVMF-ZDUSSCGKSA-N	1	1	319.361	1.871	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000930914220	713957088	/nfs/dbraw/zinc/95/70/88/713957088.db2.gz	GWZRQAHPYKHLRD-UPJWGTAASA-N	1	1	321.377	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459853	714102681	/nfs/dbraw/zinc/10/26/81/714102681.db2.gz	BEZZIGKDRYGVHU-YGRLFVJLSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2c[nH]nc21	ZINC000931459853	714102683	/nfs/dbraw/zinc/10/26/83/714102683.db2.gz	BEZZIGKDRYGVHU-YGRLFVJLSA-N	1	1	302.334	1.971	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000931639127	714146454	/nfs/dbraw/zinc/14/64/54/714146454.db2.gz	HRXSNKGRYHOMBD-FZMZJTMJSA-N	1	1	310.350	1.712	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000923264705	714289310	/nfs/dbraw/zinc/28/93/10/714289310.db2.gz	MFRKESDBCRHWAF-CFVMTHIKSA-N	1	1	319.361	1.323	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ncccn1)C1CC1	ZINC000932351650	714316728	/nfs/dbraw/zinc/31/67/28/714316728.db2.gz	CFLFOTSEDWCKOM-ZDUSSCGKSA-N	1	1	302.338	1.631	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H](O)[C@@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580220	714858015	/nfs/dbraw/zinc/85/80/15/714858015.db2.gz	XDEASSXBUQIEQA-QWHCGFSZSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H](O)[C@@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580220	714858017	/nfs/dbraw/zinc/85/80/17/714858017.db2.gz	XDEASSXBUQIEQA-QWHCGFSZSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)n1	ZINC000934838777	714914312	/nfs/dbraw/zinc/91/43/12/714914312.db2.gz	OZFOKYWGXRIRGD-KGLIPLIRSA-N	1	1	308.382	1.930	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001164638892	719217004	/nfs/dbraw/zinc/21/70/04/719217004.db2.gz	PSXUZRQZNFFMPY-IUCAKERBSA-N	1	1	300.746	1.410	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1cc([N+](=O)[O-])cc(Cl)[n+]1[O-]	ZINC001164638892	719217005	/nfs/dbraw/zinc/21/70/05/719217005.db2.gz	PSXUZRQZNFFMPY-IUCAKERBSA-N	1	1	300.746	1.410	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)n1	ZINC001164966171	722069232	/nfs/dbraw/zinc/06/92/32/722069232.db2.gz	WOLSHURQEQEZFG-BETUJISGSA-N	1	1	304.350	1.289	20	5		DDBDMO
CC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4ccc([N+](=O)[O-])cc4)C[C@H]32)CC1	ZINC001025799448	736859492	/nfs/dbraw/zinc/85/94/92/736859492.db2.gz	LCGVNKGNTNZPAF-FICVDOATSA-N	1	1	315.373	1.941	20	5		DDBDMO
CCN(CCNC(=O)Cc1cnc[nH]1)c1ccccc1[N+](=O)[O-]	ZINC001100734458	736498535	/nfs/dbraw/zinc/49/85/35/736498535.db2.gz	DEQQVXPHAVNXGA-UHFFFAOYSA-N	1	1	317.349	1.503	20	5		DDBDMO
CC(C)Cc1ccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001126938689	742863359	/nfs/dbraw/zinc/86/33/59/742863359.db2.gz	GYTXICPYXKLELM-HZPDHXFCSA-N	1	1	319.405	1.756	20	5		DDBDMO
CNC(=O)c1ccc(NCc2[nH]c(C)[nH+]c2C)c([N+](=O)[O-])c1	ZINC001187662966	744589013	/nfs/dbraw/zinc/58/90/13/744589013.db2.gz	QLEFSSRRCGCMLV-UHFFFAOYSA-N	1	1	303.322	1.906	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001193897165	746231024	/nfs/dbraw/zinc/23/10/24/746231024.db2.gz	BKEPZGVATJVOPQ-MNOVXSKESA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccccc2)CC1	ZINC000996428722	749587171	/nfs/dbraw/zinc/58/71/71/749587171.db2.gz	GSNZEELMGPMOET-HUUCEWRRSA-N	1	1	303.362	1.432	20	5		DDBDMO
CCOC(=O)C1([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCOCC1	ZINC001168960762	762154765	/nfs/dbraw/zinc/15/47/65/762154765.db2.gz	GYLJWYWSVPWPLJ-NWDGAFQWSA-N	1	1	300.355	1.134	20	5		DDBDMO
COc1ccc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054470	762209478	/nfs/dbraw/zinc/20/94/78/762209478.db2.gz	MEGADDRCOXJBCA-UMVBOHGHSA-N	1	1	321.377	1.989	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CC2CC(F)(F)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363277	761492531	/nfs/dbraw/zinc/49/25/31/761492531.db2.gz	LMJRTKWALNSUDE-HJQYOEGKSA-N	1	1	317.336	1.181	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCC(F)(F)F)CC1	ZINC001045437231	766306351	/nfs/dbraw/zinc/30/63/51/766306351.db2.gz	JBGLMSLTUQXIDC-NXEZZACHSA-N	1	1	323.315	1.575	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001093788017	775079580	/nfs/dbraw/zinc/07/95/80/775079580.db2.gz	SJYWPHJUVMPSJX-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)c1	ZINC001171936517	776536965	/nfs/dbraw/zinc/53/69/65/776536965.db2.gz	BKJLBXHVRVZDOR-CLWVCHIJSA-N	1	1	306.362	1.721	20	5		DDBDMO
Cc1cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)nn1	ZINC001175324170	777750451	/nfs/dbraw/zinc/75/04/51/777750451.db2.gz	SRITZCBTPWUQQA-INIZCTEOSA-N	1	1	316.361	1.999	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cncs1)Cc1cccc([N+](=O)[O-])c1	ZINC001266260368	836001893	/nfs/dbraw/zinc/00/18/93/836001893.db2.gz	OMJCHRAJLLENAU-UHFFFAOYSA-N	1	1	320.374	1.913	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cncs1)Cc1cccc([N+](=O)[O-])c1	ZINC001266260368	836001899	/nfs/dbraw/zinc/00/18/99/836001899.db2.gz	OMJCHRAJLLENAU-UHFFFAOYSA-N	1	1	320.374	1.913	20	5		DDBDMO
CCOCCC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1	ZINC001268702875	840689623	/nfs/dbraw/zinc/68/96/23/840689623.db2.gz	GUFRSZCWCWGILV-UHFFFAOYSA-N	1	1	321.377	1.569	20	5		DDBDMO
Nc1ccc[nH+]c1N1CCN(c2cc([N+](=O)[O-])ccn2)CC1	ZINC001154782777	861449810	/nfs/dbraw/zinc/44/98/10/861449810.db2.gz	YPPULBNXILWIHP-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[N@H+]2CCN1C[C@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975895	859507005	/nfs/dbraw/zinc/50/70/05/859507005.db2.gz	GUSQVLAMRAVGBN-JMSVASOKSA-N	1	1	318.377	1.160	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC001124003008	859518814	/nfs/dbraw/zinc/51/88/14/859518814.db2.gz	LTZJFFNLQYMPOH-TUKIKUTGSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[N@H+]1CCC[C@@H](OCC(=O)OCc2ccc([N+](=O)[O-])cc2)C1	ZINC001224986809	881625218	/nfs/dbraw/zinc/62/52/18/881625218.db2.gz	KKFKGSNVSNHFBG-CQSZACIVSA-N	1	1	308.334	1.749	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1cc(F)ccc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761361	864111431	/nfs/dbraw/zinc/11/14/31/864111431.db2.gz	PHSPFPWXOBFTBR-DGCLKSJQSA-N	1	1	313.304	1.226	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC001333928905	867163830	/nfs/dbraw/zinc/16/38/30/867163830.db2.gz	CHOLDMWUMQRXEE-QJPTWQEYSA-N	1	1	321.381	1.429	20	5		DDBDMO
COCC[NH+](CCOC)C1CN(c2nc(C)ccc2[N+](=O)[O-])C1	ZINC001336663228	869079730	/nfs/dbraw/zinc/07/97/30/869079730.db2.gz	ATAPVBWIUWCZBW-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
CC(=O)c1cc(N[C@H](C)[C@@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727477	869112372	/nfs/dbraw/zinc/11/23/72/869112372.db2.gz	WLMFEQYQKCLRNX-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727477	869112374	/nfs/dbraw/zinc/11/23/74/869112374.db2.gz	WLMFEQYQKCLRNX-BZNIZROVSA-N	1	1	320.393	1.844	20	5		DDBDMO
C[C@H](CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-])[NH+](C)C	ZINC001336754487	869125429	/nfs/dbraw/zinc/12/54/29/869125429.db2.gz	LRQAONLEWKGULJ-CHWSQXEVSA-N	1	1	311.382	1.264	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001338083762	869791099	/nfs/dbraw/zinc/79/10/99/869791099.db2.gz	JKWFCLSDLNHXRD-JQWIXIFHSA-N	1	1	309.370	1.045	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](Nc3ccc4nonc4c3[N+](=O)[O-])[C@H]2C1	ZINC001338298784	869909790	/nfs/dbraw/zinc/90/97/90/869909790.db2.gz	WFESJUUPYXEGOR-GUBZILKMSA-N	1	1	303.322	1.883	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC001339318230	870444442	/nfs/dbraw/zinc/44/44/42/870444442.db2.gz	SPVRSVWKEFGSQB-YNEHKIRRSA-N	1	1	319.361	1.673	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCC(F)(F)CC1	ZINC001317447912	870856235	/nfs/dbraw/zinc/85/62/35/870856235.db2.gz	JETBOLONZHRBEX-VXGBXAGGSA-N	1	1	319.352	1.525	20	5		DDBDMO
C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(F)(F)CC1	ZINC001317447912	870856247	/nfs/dbraw/zinc/85/62/47/870856247.db2.gz	JETBOLONZHRBEX-VXGBXAGGSA-N	1	1	319.352	1.525	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(F)(F)CC1	ZINC001317447912	870856249	/nfs/dbraw/zinc/85/62/49/870856249.db2.gz	JETBOLONZHRBEX-VXGBXAGGSA-N	1	1	319.352	1.525	20	5		DDBDMO
CCC(CC)C[NH2+]CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001205230710	871448931	/nfs/dbraw/zinc/44/89/31/871448931.db2.gz	TZDBDLWHBBQMRR-HUUCEWRRSA-N	1	1	311.426	1.916	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1O	ZINC001307740900	871449799	/nfs/dbraw/zinc/44/97/99/871449799.db2.gz	JUMIOICVQZMKOO-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1O	ZINC001307740900	871449808	/nfs/dbraw/zinc/44/98/08/871449808.db2.gz	JUMIOICVQZMKOO-LBPRGKRZSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NCC[NH+]2CC=CC2)cc1[N+](=O)[O-]	ZINC001318915631	872344076	/nfs/dbraw/zinc/34/40/76/872344076.db2.gz	UHMMEJDIGJKMDO-UHFFFAOYSA-N	1	1	320.305	1.413	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[N@@H+]2CCN1C[C@@H]2C	ZINC001345491710	873422012	/nfs/dbraw/zinc/42/20/12/873422012.db2.gz	PILBQZUMSUJYME-FZMZJTMJSA-N	1	1	304.350	1.230	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3cc(F)ccc3[N+](=O)[O-])[C@H]2C1	ZINC001347539441	874178618	/nfs/dbraw/zinc/17/86/18/874178618.db2.gz	KYJTWLVQHSFMKV-XDTLVQLUSA-N	1	1	307.325	1.804	20	5		DDBDMO
Cc1cc(NC(=O)[C@@H](C)N2CC[NH+](C)CC2)cc([N+](=O)[O-])c1	ZINC001348844304	874824580	/nfs/dbraw/zinc/82/45/80/874824580.db2.gz	VKRASQWFNKADNG-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC001349853100	875414455	/nfs/dbraw/zinc/41/44/55/875414455.db2.gz	RYOREFOJXUUJMS-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001350089626	875531039	/nfs/dbraw/zinc/53/10/39/875531039.db2.gz	VSHCNEHRKXSEJC-NWANDNLSSA-N	1	1	303.362	1.594	20	5		DDBDMO
COC(=O)c1ccc(OCC[N@@H+]2CC[C@@H](OC)C2)c([N+](=O)[O-])c1	ZINC001227297246	882958204	/nfs/dbraw/zinc/95/82/04/882958204.db2.gz	BLMSCNPLDIMXFB-GFCCVEGCSA-N	1	1	324.333	1.481	20	5		DDBDMO
Cc1ccc2nc(=O)[nH]c(OC(=O)C[C@@H](O)C[N+](C)(C)C)c2c1	ZINC001227351925	882982105	/nfs/dbraw/zinc/98/21/05/882982105.db2.gz	VJGRGAACRCBBNA-LLVKDONJSA-O	1	1	320.369	1.006	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2cc([N+](=O)[O-])sc2C(=O)OC)C1	ZINC001227541853	883070695	/nfs/dbraw/zinc/07/06/95/883070695.db2.gz	PPPLISHBSWPJGD-QMMMGPOBSA-N	1	1	300.336	1.916	20	5		DDBDMO
Cn1c(C[N+](=O)[O-])nnc1N1CCC[N@H+](C2CCCC2)CC1	ZINC001355419440	878548968	/nfs/dbraw/zinc/54/89/68/878548968.db2.gz	GXGAYBNLNBFNEK-UHFFFAOYSA-N	1	1	308.386	1.047	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)n1	ZINC001358285539	880390890	/nfs/dbraw/zinc/39/08/90/880390890.db2.gz	DVLSJANIDIXTLC-GFCCVEGCSA-N	1	1	315.333	1.115	20	5		DDBDMO
CC[N@@H+]1CC[C@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228808572	883680057	/nfs/dbraw/zinc/68/00/57/883680057.db2.gz	CBCBNWVUYDESCG-VIFPVBQESA-N	1	1	310.306	1.560	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC001228808572	883680060	/nfs/dbraw/zinc/68/00/60/883680060.db2.gz	CBCBNWVUYDESCG-VIFPVBQESA-N	1	1	310.306	1.560	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC001229492565	884008847	/nfs/dbraw/zinc/00/88/47/884008847.db2.gz	YFRTWXNELOECQO-LLVKDONJSA-N	1	1	307.306	1.836	20	5		DDBDMO
CCc1[nH+]ccn1Cc1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247148540	893125275	/nfs/dbraw/zinc/12/52/75/893125275.db2.gz	ZPPWQJIRKRXGAN-UHFFFAOYSA-N	1	1	318.268	1.986	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@@H]2C[C@H](CO)C[C@@H]21	ZINC001254553475	896498306	/nfs/dbraw/zinc/49/83/06/896498306.db2.gz	VQMKCQCKIIQZBL-UTJXIGIESA-N	1	1	320.389	1.998	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@H]2C[C@H](CO)C[C@@H]21	ZINC001254553475	896498314	/nfs/dbraw/zinc/49/83/14/896498314.db2.gz	VQMKCQCKIIQZBL-UTJXIGIESA-N	1	1	320.389	1.998	20	5		DDBDMO
COC(=O)CO[C@H]1CC[N@H+]([C@H](C)Cc2ccccc2[N+](=O)[O-])C1	ZINC001254571274	896508493	/nfs/dbraw/zinc/50/84/93/896508493.db2.gz	RMMZAFRBWLVADD-OCCSQVGLSA-N	1	1	322.361	1.790	20	5		DDBDMO
C[N@@H+](CCN1CCOCC1)[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254599664	896524536	/nfs/dbraw/zinc/52/45/36/896524536.db2.gz	OFHWZAYEFUHVMX-MRXNPFEDSA-N	1	1	305.378	1.326	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC001264010867	900870610	/nfs/dbraw/zinc/87/06/10/900870610.db2.gz	NJRNUDUVJQDELV-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@@H](C)[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000248996248	282125504	/nfs/dbraw/zinc/12/55/04/282125504.db2.gz	YBIRJTVNFNXFHY-YGRLFVJLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@@H](C)[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000248996248	282125505	/nfs/dbraw/zinc/12/55/05/282125505.db2.gz	YBIRJTVNFNXFHY-YGRLFVJLSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CCCCO)c1ccc([N+](=O)[O-])cc1	ZINC000278566924	214242791	/nfs/dbraw/zinc/24/27/91/214242791.db2.gz	FXXLMNDPFYOIMT-AWEZNQCLSA-N	1	1	304.350	1.780	20	5		DDBDMO
CC[C@H](CO)[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000295626688	529382870	/nfs/dbraw/zinc/38/28/70/529382870.db2.gz	FNDFZSDHFYNVLT-LLVKDONJSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000295626688	529382874	/nfs/dbraw/zinc/38/28/74/529382874.db2.gz	FNDFZSDHFYNVLT-LLVKDONJSA-N	1	1	306.322	1.848	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000452102745	231301493	/nfs/dbraw/zinc/30/14/93/231301493.db2.gz	LCHQKLZGTLFAJK-GFCCVEGCSA-N	1	1	321.377	1.942	20	5		DDBDMO
C[N@H+](CCc1ccccc1)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090517853	185299884	/nfs/dbraw/zinc/29/98/84/185299884.db2.gz	HYLMZLSMASNSGA-UHFFFAOYSA-N	1	1	301.346	1.931	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1ccnc2c1cccc2[N+](=O)[O-]	ZINC000432313338	529911902	/nfs/dbraw/zinc/91/19/02/529911902.db2.gz	NBLGPZPALVHWKX-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
C[C@@H]1CN(C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000330860128	232119306	/nfs/dbraw/zinc/11/93/06/232119306.db2.gz	VWMOXXFDSLBUBO-RDBSUJKOSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000330860128	232119308	/nfs/dbraw/zinc/11/93/08/232119308.db2.gz	VWMOXXFDSLBUBO-RDBSUJKOSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000330860128	232119311	/nfs/dbraw/zinc/11/93/11/232119311.db2.gz	VWMOXXFDSLBUBO-RDBSUJKOSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272670163	210074606	/nfs/dbraw/zinc/07/46/06/210074606.db2.gz	IRMJIGQWFFQMCZ-GFCCVEGCSA-N	1	1	303.362	1.904	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+][C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000459597740	233351182	/nfs/dbraw/zinc/35/11/82/233351182.db2.gz	PJNJWTWOOVVFHP-KFWWJZLASA-N	1	1	316.361	1.921	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Nc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000287146280	219341532	/nfs/dbraw/zinc/34/15/32/219341532.db2.gz	GASAUNCZWWZUMZ-UHFFFAOYSA-N	1	1	324.356	1.698	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC(C)(C)O	ZINC000181883622	186214876	/nfs/dbraw/zinc/21/48/76/186214876.db2.gz	ZDBWIQRTKSHOEF-LBPRGKRZSA-N	1	1	312.366	1.427	20	5		DDBDMO
Cc1[nH+]cn(CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)c1C	ZINC000171993763	198021862	/nfs/dbraw/zinc/02/18/62/198021862.db2.gz	CDWBJVRWKLYDAL-UHFFFAOYSA-N	1	1	318.289	1.776	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@H+](C)C[C@@H]1c1ccccc1	ZINC000029843316	352245511	/nfs/dbraw/zinc/24/55/11/352245511.db2.gz	XGMFUJBUOAOJRQ-CYBMUJFWSA-N	1	1	301.350	1.821	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC[N@@H+](C)C[C@@H]1c1ccccc1	ZINC000029843316	352245516	/nfs/dbraw/zinc/24/55/16/352245516.db2.gz	XGMFUJBUOAOJRQ-CYBMUJFWSA-N	1	1	301.350	1.821	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000052590859	352619773	/nfs/dbraw/zinc/61/97/73/352619773.db2.gz	KHUMVAZXWPCPKL-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c[nH]1)Cc1ccccc1	ZINC000053349128	352649193	/nfs/dbraw/zinc/64/91/93/352649193.db2.gz	ADNPMECTRDTKCL-UHFFFAOYSA-N	1	1	302.334	1.785	20	5		DDBDMO
C[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1)C1CC1	ZINC000066870877	353020431	/nfs/dbraw/zinc/02/04/31/353020431.db2.gz	YBWYQQWBDIJINK-UHFFFAOYSA-N	1	1	305.381	1.029	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000068121573	353090082	/nfs/dbraw/zinc/09/00/82/353090082.db2.gz	RLWHLALOPASPPU-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1Nc1cccc(C[NH+]2CCOCC2)c1	ZINC000068938069	353137858	/nfs/dbraw/zinc/13/78/58/353137858.db2.gz	OCJUUYBYWZBSSS-UHFFFAOYSA-N	1	1	317.349	1.904	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2	ZINC000072829659	353218839	/nfs/dbraw/zinc/21/88/39/353218839.db2.gz	CSMAPWHZDNIVAB-INIZCTEOSA-N	1	1	319.361	1.576	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000174173036	198301383	/nfs/dbraw/zinc/30/13/83/198301383.db2.gz	DJKCXOSHIONTCT-CYBMUJFWSA-N	1	1	319.361	1.389	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000174331984	198320964	/nfs/dbraw/zinc/32/09/64/198320964.db2.gz	SIZUWVKBBFPGAA-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)s1	ZINC000075712777	353377074	/nfs/dbraw/zinc/37/70/74/353377074.db2.gz	UXOFPUZTJBCWPH-GFCCVEGCSA-N	1	1	310.379	1.654	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2cc(C)ccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000089265553	353763797	/nfs/dbraw/zinc/76/37/97/353763797.db2.gz	ZCFKCKLXUBRKDI-ZDUSSCGKSA-N	1	1	321.377	1.977	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@H](O)C1	ZINC000093344417	353897784	/nfs/dbraw/zinc/89/77/84/353897784.db2.gz	LIASSDBOXRMLCT-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC)C1	ZINC000112076009	353970063	/nfs/dbraw/zinc/97/00/63/353970063.db2.gz	FVBVSYNSQNCSJO-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C[C@H](O)C1CC1	ZINC000156600886	354220717	/nfs/dbraw/zinc/22/07/17/354220717.db2.gz	ZCZYNHCFKYJDMU-HNNXBMFYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000157813444	354227168	/nfs/dbraw/zinc/22/71/68/354227168.db2.gz	OLNGSEGAEQVKJF-RNCFNFMXSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000157813444	354227170	/nfs/dbraw/zinc/22/71/70/354227170.db2.gz	OLNGSEGAEQVKJF-RNCFNFMXSA-N	1	1	311.313	1.183	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)COc1ccc(F)cc1[N+](=O)[O-]	ZINC000314680325	354488139	/nfs/dbraw/zinc/48/81/39/354488139.db2.gz	KEDSNWKMENDEPL-NSHDSACASA-N	1	1	302.302	1.052	20	5		DDBDMO
CCOc1cc(N2CCO[C@H]3CC[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000585783575	354842143	/nfs/dbraw/zinc/84/21/43/354842143.db2.gz	BDAHJNKVCRXLMR-GJZGRUSLSA-N	1	1	321.377	1.903	20	5		DDBDMO
CCc1nn(C)c(N(C)C[C@@H]2C[C@H](OC)C[N@H+]2C)c1[N+](=O)[O-]	ZINC000585783566	354842336	/nfs/dbraw/zinc/84/23/36/354842336.db2.gz	ZKBDNQWBESZSMG-QWRGUYRKSA-N	1	1	311.386	1.046	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@H]21	ZINC000588001109	354891705	/nfs/dbraw/zinc/89/17/05/354891705.db2.gz	ONQNTEZXBNMFNE-XHDPSFHLSA-N	1	1	320.393	1.590	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2cc(N)c([N+](=O)[O-])c(CO)c2)C[C@@H]1C	ZINC000588009278	354893488	/nfs/dbraw/zinc/89/34/88/354893488.db2.gz	DSMJUAXWGLCCQJ-WDEREUQCSA-N	1	1	308.382	1.588	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)[C@@H]2C1	ZINC000590044701	355043220	/nfs/dbraw/zinc/04/32/20/355043220.db2.gz	MFTWICXGYRRWNP-SMDDNHRTSA-N	1	1	314.345	1.852	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@H+]2CCN1CCC2	ZINC000590541653	355110042	/nfs/dbraw/zinc/11/00/42/355110042.db2.gz	JMJKAUAKVJNUTA-CYBMUJFWSA-N	1	1	318.377	1.023	20	5		DDBDMO
Cc1ccc(C[N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)nc1	ZINC000590754409	355166501	/nfs/dbraw/zinc/16/65/01/355166501.db2.gz	FXQYOMAMYXIVKS-UHFFFAOYSA-N	1	1	302.334	1.592	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)nc1	ZINC000590754409	355166504	/nfs/dbraw/zinc/16/65/04/355166504.db2.gz	FXQYOMAMYXIVKS-UHFFFAOYSA-N	1	1	302.334	1.592	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](O)[C@H](CO)C2)cc1	ZINC000591054809	355238473	/nfs/dbraw/zinc/23/84/73/355238473.db2.gz	DNSXFDCRCPXOCS-WFASDCNBSA-N	1	1	310.350	1.039	20	5		DDBDMO
C[C@@H](O)[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056164	355239621	/nfs/dbraw/zinc/23/96/21/355239621.db2.gz	CXRWCONQMQRKHM-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](O)[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056164	355239626	/nfs/dbraw/zinc/23/96/26/355239626.db2.gz	CXRWCONQMQRKHM-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([C@H]3CC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256115	355548224	/nfs/dbraw/zinc/54/82/24/355548224.db2.gz	ZJMFTGMECAGLEG-QWRGUYRKSA-N	1	1	307.354	1.088	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000592533592	355618586	/nfs/dbraw/zinc/61/85/86/355618586.db2.gz	UMBNYLVHFREOQY-IOKDEZFASA-N	1	1	320.345	1.464	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000592533592	355618590	/nfs/dbraw/zinc/61/85/90/355618590.db2.gz	UMBNYLVHFREOQY-IOKDEZFASA-N	1	1	320.345	1.464	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000593106711	355800173	/nfs/dbraw/zinc/80/01/73/355800173.db2.gz	BAVGZDBWGAKCNZ-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000593106711	355800175	/nfs/dbraw/zinc/80/01/75/355800175.db2.gz	BAVGZDBWGAKCNZ-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000593205410	355823520	/nfs/dbraw/zinc/82/35/20/355823520.db2.gz	YSIWZFMYKZKZEN-UHFFFAOYSA-N	1	1	311.386	1.276	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594600568	356261375	/nfs/dbraw/zinc/26/13/75/356261375.db2.gz	MFEFLQSWRUFQBP-OLZOCXBDSA-N	1	1	319.365	1.518	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCC(=O)N(C)C1=O	ZINC000595042997	356375832	/nfs/dbraw/zinc/37/58/32/356375832.db2.gz	DKPLGODMRPSMAR-BXKDBHETSA-N	1	1	321.333	1.401	20	5		DDBDMO
CCN(CC)C(=O)C1CC[NH+](Cc2onc(C)c2[N+](=O)[O-])CC1	ZINC000595297648	356438369	/nfs/dbraw/zinc/43/83/69/356438369.db2.gz	XXWLZEQWAHTUST-UHFFFAOYSA-N	1	1	324.381	1.972	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+]([C@@H]3CCCC[C@H]3O)C2)nc1	ZINC000595376665	356470829	/nfs/dbraw/zinc/47/08/29/356470829.db2.gz	RFPNOBNZBJHLPZ-IACUBPJLSA-N	1	1	306.366	1.780	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c(C)cc1[N+](=O)[O-]	ZINC000565243775	304057388	/nfs/dbraw/zinc/05/73/88/304057388.db2.gz	AIXKVJSZNMRFNH-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@@H](CN3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000595828553	356666715	/nfs/dbraw/zinc/66/67/15/356666715.db2.gz	LCJVCPSAGAXOHL-LLVKDONJSA-N	1	1	308.338	1.336	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@@H](CN3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000595828553	356666716	/nfs/dbraw/zinc/66/67/16/356666716.db2.gz	LCJVCPSAGAXOHL-LLVKDONJSA-N	1	1	308.338	1.336	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@H](CN3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000595828555	356666738	/nfs/dbraw/zinc/66/67/38/356666738.db2.gz	LCJVCPSAGAXOHL-NSHDSACASA-N	1	1	308.338	1.336	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@H](CN3CCCC3=O)C2)c1[N+](=O)[O-]	ZINC000595828555	356666739	/nfs/dbraw/zinc/66/67/39/356666739.db2.gz	LCJVCPSAGAXOHL-NSHDSACASA-N	1	1	308.338	1.336	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596090556	356768754	/nfs/dbraw/zinc/76/87/54/356768754.db2.gz	YEPQRXPOAGDTCC-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@@H]2C1	ZINC000596280994	356843717	/nfs/dbraw/zinc/84/37/17/356843717.db2.gz	GWDIGRKYKQKTQO-IINYFYTJSA-N	1	1	304.350	1.224	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596539297	356911257	/nfs/dbraw/zinc/91/12/57/356911257.db2.gz	OFQBCFZZJYCIJV-GFCCVEGCSA-N	1	1	309.341	1.769	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CC[N@H+](C2CCCCC2)C1	ZINC000598217750	357496522	/nfs/dbraw/zinc/49/65/22/357496522.db2.gz	AVWDLINCQGLZPI-LBPRGKRZSA-N	1	1	321.381	1.315	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000598594798	357645044	/nfs/dbraw/zinc/64/50/44/357645044.db2.gz	CSUMCRDCUQZKIP-JTQLQIEISA-N	1	1	308.338	1.530	20	5		DDBDMO
NC(=O)NC(=O)CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000179242432	283301714	/nfs/dbraw/zinc/30/17/14/283301714.db2.gz	QCEPITNGUMCBDZ-UHFFFAOYSA-N	1	1	320.349	1.534	20	5		DDBDMO
C[N@@H+](C[C@H]1C[C@@H](O)C1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000599654773	358009833	/nfs/dbraw/zinc/00/98/33/358009833.db2.gz	IJQHMVZECFKJPO-GLQYFDAESA-N	1	1	319.361	1.403	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@H]1C[C@@H](O)C1	ZINC000599670374	358018572	/nfs/dbraw/zinc/01/85/72/358018572.db2.gz	FEWCQUFDVCURIT-VDISTLRHSA-N	1	1	307.350	1.626	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000276711951	213060562	/nfs/dbraw/zinc/06/05/62/213060562.db2.gz	YLWKXRMZWYBBBZ-ZDUSSCGKSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nc2ccccc2cc1[N+](=O)[O-]	ZINC000276711951	213060564	/nfs/dbraw/zinc/06/05/64/213060564.db2.gz	YLWKXRMZWYBBBZ-ZDUSSCGKSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cn1	ZINC000600473128	358234417	/nfs/dbraw/zinc/23/44/17/358234417.db2.gz	RFDADZSXFJXQNO-LBPRGKRZSA-N	1	1	304.350	1.737	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CCC[N@H+]1C	ZINC000601109811	358405662	/nfs/dbraw/zinc/40/56/62/358405662.db2.gz	ZPXLFDRYGWENPJ-ZETCQYMHSA-N	1	1	307.276	1.853	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000601103270	358402841	/nfs/dbraw/zinc/40/28/41/358402841.db2.gz	SJPJHGGVRWQZOW-CYBMUJFWSA-N	1	1	324.356	1.820	20	5		DDBDMO
C[C@@H](CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)c1nncn1C	ZINC000601153971	358424119	/nfs/dbraw/zinc/42/41/19/358424119.db2.gz	VXBWCRRQYTWACP-JTQLQIEISA-N	1	1	312.333	1.909	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCC[C@@]3(O)CCOC3)c2c1	ZINC000601184187	358437465	/nfs/dbraw/zinc/43/74/65/358437465.db2.gz	HWAHHRSOWVODNF-OAHLLOKOSA-N	1	1	303.318	1.518	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@@H](CO)C1	ZINC000601980390	358765086	/nfs/dbraw/zinc/76/50/86/358765086.db2.gz	VCMYZAOQJUVPOE-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@@H](CO)C1	ZINC000601980390	358765090	/nfs/dbraw/zinc/76/50/90/358765090.db2.gz	VCMYZAOQJUVPOE-LLVKDONJSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[NH+](C)[C@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1(C)C	ZINC000602174244	358863286	/nfs/dbraw/zinc/86/32/86/358863286.db2.gz	SQUSVGQQXAZXRV-STQMWFEESA-N	1	1	307.350	1.759	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2nc[nH]n2)CC1	ZINC000602869608	359254510	/nfs/dbraw/zinc/25/45/10/359254510.db2.gz	MEUOZPZPTKKOEK-LBPRGKRZSA-N	1	1	316.365	1.905	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](C)C[C@@H]2CO)ccc1[N+](=O)[O-]	ZINC000602907661	359286101	/nfs/dbraw/zinc/28/61/01/359286101.db2.gz	ZSOGSBWINAQYED-CYBMUJFWSA-N	1	1	309.366	1.102	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](CO)Cc1ccccc1	ZINC000602882357	359265774	/nfs/dbraw/zinc/26/57/74/359265774.db2.gz	DDFNIVIKCKZGLR-OAHLLOKOSA-N	1	1	318.377	1.635	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](O)C[C@@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602901553	359283380	/nfs/dbraw/zinc/28/33/80/359283380.db2.gz	ZZASTAKXRNCCNN-WFASDCNBSA-N	1	1	310.350	1.311	20	5		DDBDMO
CCN(C(=O)Nc1c(C)cncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000602959757	359322927	/nfs/dbraw/zinc/32/29/27/359322927.db2.gz	FUJNKGFHRZJZBE-LLVKDONJSA-N	1	1	307.354	1.278	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC1(CO)CC1	ZINC000186777443	200008534	/nfs/dbraw/zinc/00/85/34/200008534.db2.gz	PFUYSCAFDCUHGV-UHFFFAOYSA-N	1	1	323.349	1.246	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC1(CO)CC1	ZINC000186777443	200008536	/nfs/dbraw/zinc/00/85/36/200008536.db2.gz	PFUYSCAFDCUHGV-UHFFFAOYSA-N	1	1	323.349	1.246	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])cc2F)CC1	ZINC000603400389	359616365	/nfs/dbraw/zinc/61/63/65/359616365.db2.gz	HGRXPNSIOMPJDF-LLVKDONJSA-N	1	1	324.356	1.818	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@H]1C[C@H]([NH+]2CCOCC2)C1(C)C	ZINC000603396389	359613687	/nfs/dbraw/zinc/61/36/87/359613687.db2.gz	ICBVGDJBWUUVAI-QWRGUYRKSA-N	1	1	309.370	1.240	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000188280582	200221152	/nfs/dbraw/zinc/22/11/52/200221152.db2.gz	PLZOFRMPFUXKBM-YPMHNXCESA-N	1	1	318.377	1.876	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)C1CC1	ZINC000610572834	360473343	/nfs/dbraw/zinc/47/33/43/360473343.db2.gz	HJLZKUHEMUYYCI-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H](O)C1CC1	ZINC000610572834	360473350	/nfs/dbraw/zinc/47/33/50/360473350.db2.gz	HJLZKUHEMUYYCI-CYBMUJFWSA-N	1	1	318.333	1.848	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610615617	360482489	/nfs/dbraw/zinc/48/24/89/360482489.db2.gz	ZOYYHHJGIDEGIQ-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610615617	360482493	/nfs/dbraw/zinc/48/24/93/360482493.db2.gz	ZOYYHHJGIDEGIQ-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](C(C)(C)CO)CC1	ZINC000611165956	360643352	/nfs/dbraw/zinc/64/33/52/360643352.db2.gz	NNFWIYZECZYBQG-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000611525673	360747134	/nfs/dbraw/zinc/74/71/34/360747134.db2.gz	DFPKHRLMPACTER-LBPRGKRZSA-N	1	1	322.409	1.837	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H](OC(F)F)C1	ZINC000611577249	360765274	/nfs/dbraw/zinc/76/52/74/360765274.db2.gz	HADDUTQAAYYCLU-NSHDSACASA-N	1	1	317.292	1.460	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](OC(F)F)C1	ZINC000611577249	360765276	/nfs/dbraw/zinc/76/52/76/360765276.db2.gz	HADDUTQAAYYCLU-NSHDSACASA-N	1	1	317.292	1.460	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000281291888	216215808	/nfs/dbraw/zinc/21/58/08/216215808.db2.gz	GXTOBPPXXVPZPQ-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612086272	360914280	/nfs/dbraw/zinc/91/42/80/360914280.db2.gz	LVWZMVSICSKQBS-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H](O)C1CC1	ZINC000612086863	360914905	/nfs/dbraw/zinc/91/49/05/360914905.db2.gz	YZYIHLRJYCOCLA-TZMCWYRMSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1cc(N2CC[N@@H+]3CCOC[C@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000612451358	361021911	/nfs/dbraw/zinc/02/19/11/361021911.db2.gz	YZYMXHIOZMJZBP-SNVBAGLBSA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1cc(N2CC[N@H+]3CCOC[C@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000612451358	361021914	/nfs/dbraw/zinc/02/19/14/361021914.db2.gz	YZYMXHIOZMJZBP-SNVBAGLBSA-N	1	1	311.313	1.263	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1c2c(ccc1[N+](=O)[O-])NCC2	ZINC000195186905	201355416	/nfs/dbraw/zinc/35/54/16/201355416.db2.gz	KHHNZFOPZQGJNC-UHFFFAOYSA-N	1	1	308.382	1.943	20	5		DDBDMO
O=C(CSc1ccc([N+](=O)[O-])cc1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000195326869	201379162	/nfs/dbraw/zinc/37/91/62/201379162.db2.gz	UEOCNYZSSCMWGM-CYBMUJFWSA-N	1	1	321.402	1.994	20	5		DDBDMO
C[C@H](c1ccncc1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000091990463	193138795	/nfs/dbraw/zinc/13/87/95/193138795.db2.gz	HVYPQZMUUUXEHI-GFCCVEGCSA-N	1	1	302.334	1.845	20	5		DDBDMO
Cc1nn(C)cc1C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000092047783	193147548	/nfs/dbraw/zinc/14/75/48/193147548.db2.gz	HNSKZAPUESAGCJ-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000271720218	296115803	/nfs/dbraw/zinc/11/58/03/296115803.db2.gz	KUGFSCXXOAFTID-JHJVBQTASA-N	1	1	321.377	1.881	20	5		DDBDMO
COCC[N@H+](CCO)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000093006262	193192100	/nfs/dbraw/zinc/19/21/00/193192100.db2.gz	UJIHIHPSSJGWDK-UHFFFAOYSA-N	1	1	320.292	1.637	20	5		DDBDMO
COCC[N@@H+](CCO)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000093006262	193192102	/nfs/dbraw/zinc/19/21/02/193192102.db2.gz	UJIHIHPSSJGWDK-UHFFFAOYSA-N	1	1	320.292	1.637	20	5		DDBDMO
CCOCC[NH+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000264644510	204050463	/nfs/dbraw/zinc/05/04/63/204050463.db2.gz	AAPBNBPHEQRGBS-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H](c2ccccc2)C1	ZINC000351486888	284337264	/nfs/dbraw/zinc/33/72/64/284337264.db2.gz	YJPGXAFELDWRIB-OCCSQVGLSA-N	1	1	314.345	1.751	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000282747778	217222762	/nfs/dbraw/zinc/22/27/62/217222762.db2.gz	BTUQGLAJMYNEDE-SECBINFHSA-N	1	1	310.329	1.388	20	5		DDBDMO
CN(CC[N@@H+](C)CCn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000174853150	248384499	/nfs/dbraw/zinc/38/44/99/248384499.db2.gz	JTOKOZHUGMJJJR-UHFFFAOYSA-N	1	1	303.366	1.860	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](O)C1	ZINC000041886295	183223394	/nfs/dbraw/zinc/22/33/94/183223394.db2.gz	ASFZPMFNPXFVGB-GFCCVEGCSA-N	1	1	323.349	1.389	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000109849736	194293726	/nfs/dbraw/zinc/29/37/26/194293726.db2.gz	CPEZCJMJBWHLBX-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H]2CC[N@H+](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000110651845	194346477	/nfs/dbraw/zinc/34/64/77/194346477.db2.gz	AXOBJQPQBUUAFI-JTQLQIEISA-N	1	1	322.321	1.493	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000110815856	194361465	/nfs/dbraw/zinc/36/14/65/194361465.db2.gz	WIIIAVBFBOWFRX-UHFFFAOYSA-N	1	1	322.321	1.671	20	5		DDBDMO
COc1cc(NCCC[NH+]2CCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000271072345	208599891	/nfs/dbraw/zinc/59/98/91/208599891.db2.gz	FNSHEOWTAOFKQQ-UHFFFAOYSA-N	1	1	313.329	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1NCC[N@H+]1CCCOCC1)CCN2	ZINC000278294436	285146783	/nfs/dbraw/zinc/14/67/83/285146783.db2.gz	GHWRWHOSKSVACM-UHFFFAOYSA-N	1	1	306.366	1.697	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000294939658	533217542	/nfs/dbraw/zinc/21/75/42/533217542.db2.gz	CCWLTWPMDCNIPW-HNNXBMFYSA-N	1	1	308.334	1.606	20	5		DDBDMO
C[N@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CC1	ZINC000271584650	209033880	/nfs/dbraw/zinc/03/38/80/209033880.db2.gz	FDWPZIUDMQXKHO-UHFFFAOYSA-N	1	1	319.408	1.566	20	5		DDBDMO
C[N@@H+](CCNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])C1CC1	ZINC000271584650	209033885	/nfs/dbraw/zinc/03/38/85/209033885.db2.gz	FDWPZIUDMQXKHO-UHFFFAOYSA-N	1	1	319.408	1.566	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000414205052	224312546	/nfs/dbraw/zinc/31/25/46/224312546.db2.gz	IICZGLNKFQFUDQ-LLVKDONJSA-N	1	1	307.350	1.541	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000330889569	533599189	/nfs/dbraw/zinc/59/91/89/533599189.db2.gz	BMNRAYCQQARCQI-MNOVXSKESA-N	1	1	309.370	1.125	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000452095061	533675171	/nfs/dbraw/zinc/67/51/71/533675171.db2.gz	KOTBOXWRTBVDEL-BNOWGMLFSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000032269064	406947228	/nfs/dbraw/zinc/94/72/28/406947228.db2.gz	KRDJEKXQZITRKK-CYBMUJFWSA-N	1	1	324.381	1.020	20	5		DDBDMO
C[C@@H]1COC[C@@H](C)[NH+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000077368718	406987047	/nfs/dbraw/zinc/98/70/47/406987047.db2.gz	UJCROWLDZBLADJ-BZPMIXESSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H]1CCCCNC1=O	ZINC000105613129	407354221	/nfs/dbraw/zinc/35/42/21/407354221.db2.gz	HESBUEOKACSPDG-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000124569770	407362142	/nfs/dbraw/zinc/36/21/42/407362142.db2.gz	SGFUAXNSFBZDOJ-OAHLLOKOSA-N	1	1	310.350	1.829	20	5		DDBDMO
Nc1ccc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000108783145	407390742	/nfs/dbraw/zinc/39/07/42/407390742.db2.gz	DOLUTBXXIPAMOS-JTQLQIEISA-N	1	1	304.350	1.391	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000107892732	407381304	/nfs/dbraw/zinc/38/13/04/407381304.db2.gz	YNNJVWSYAYKFJO-JTQLQIEISA-N	1	1	322.321	1.575	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000113196894	407473782	/nfs/dbraw/zinc/47/37/82/407473782.db2.gz	XEXCATKZZGNSFQ-LBPRGKRZSA-N	1	1	323.397	1.631	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000170793190	407507481	/nfs/dbraw/zinc/50/74/81/407507481.db2.gz	XOISEXPUJUGHCS-UHFFFAOYSA-N	1	1	319.321	1.213	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000170793190	407507487	/nfs/dbraw/zinc/50/74/87/407507487.db2.gz	XOISEXPUJUGHCS-UHFFFAOYSA-N	1	1	319.321	1.213	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](C)N1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000127717184	407456946	/nfs/dbraw/zinc/45/69/46/407456946.db2.gz	NRILAAWMYZHLJG-ZIAGYGMSSA-N	1	1	306.410	1.881	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H](O)C3)o2)c1	ZINC000114470345	407577950	/nfs/dbraw/zinc/57/79/50/407577950.db2.gz	CVIKAMVRXSSHBD-ZDUSSCGKSA-N	1	1	303.318	1.859	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2C1	ZINC000171481545	407692226	/nfs/dbraw/zinc/69/22/26/407692226.db2.gz	BXUVAXAHNHYSDF-UHFFFAOYSA-N	1	1	315.333	1.270	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)c2ccccc2C1	ZINC000171481545	407692233	/nfs/dbraw/zinc/69/22/33/407692233.db2.gz	BXUVAXAHNHYSDF-UHFFFAOYSA-N	1	1	315.333	1.270	20	5		DDBDMO
Cc1ccc(CN2CC[C@H](N3CC[NH2+]CC3)C2)cc1[N+](=O)[O-]	ZINC000262181169	407759171	/nfs/dbraw/zinc/75/91/71/407759171.db2.gz	WRBRRBSBVDKNSR-HNNXBMFYSA-N	1	1	304.394	1.383	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H](C)Cn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000171804068	407770628	/nfs/dbraw/zinc/77/06/28/407770628.db2.gz	FOJNVNBWKUVECF-VIFPVBQESA-N	1	1	320.353	1.451	20	5		DDBDMO
CCc1[nH]nc(C(=O)Nc2cc[nH+]c(N(C)C)c2)c1[N+](=O)[O-]	ZINC000267285684	407819608	/nfs/dbraw/zinc/81/96/08/407819608.db2.gz	XCFJEPFCKPWWHW-UHFFFAOYSA-N	1	1	304.310	1.594	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000272520991	407961428	/nfs/dbraw/zinc/96/14/28/407961428.db2.gz	PWWGFRJQIGPQFO-XJKSGUPXSA-N	1	1	317.389	1.998	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000272451593	407926063	/nfs/dbraw/zinc/92/60/63/407926063.db2.gz	NPPYYGUIWXXNMR-RYUDHWBXSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCC(CO)CC1	ZINC000268341387	408006318	/nfs/dbraw/zinc/00/63/18/408006318.db2.gz	CIVBIGQIRZWLGB-UHFFFAOYSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)C[C@H](C)O	ZINC000245765070	408063587	/nfs/dbraw/zinc/06/35/87/408063587.db2.gz	JINJVWZMNLFTIV-DTWKUNHWSA-N	1	1	315.757	1.888	20	5		DDBDMO
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)C[C@H](C)O	ZINC000245765070	408063602	/nfs/dbraw/zinc/06/36/02/408063602.db2.gz	JINJVWZMNLFTIV-DTWKUNHWSA-N	1	1	315.757	1.888	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182224853	408099893	/nfs/dbraw/zinc/09/98/93/408099893.db2.gz	BXARNSSQBODSOK-WFASDCNBSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCOC[C@@H]1C1CC1	ZINC000182297703	408119851	/nfs/dbraw/zinc/11/98/51/408119851.db2.gz	DCFFUNWRYHJCRQ-DZGCQCFKSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCOC[C@@H]1C1CC1	ZINC000182297703	408119854	/nfs/dbraw/zinc/11/98/54/408119854.db2.gz	DCFFUNWRYHJCRQ-DZGCQCFKSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCS[C@@H]3COCC[C@H]32)c1	ZINC000246282992	408205176	/nfs/dbraw/zinc/20/51/76/408205176.db2.gz	NVVMKYAMGGBPLV-RBSFLKMASA-N	1	1	324.402	1.835	20	5		DDBDMO
CCOC(=O)C[C@H](C)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000182628107	408209029	/nfs/dbraw/zinc/20/90/29/408209029.db2.gz	ZGZWIKIGMIJSNK-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)C[C@H](C)[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000182628107	408209032	/nfs/dbraw/zinc/20/90/32/408209032.db2.gz	ZGZWIKIGMIJSNK-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+](C)CCCO)CC2)ccc1[N+](=O)[O-]	ZINC000150843756	408211056	/nfs/dbraw/zinc/21/10/56/408211056.db2.gz	JSCYTBGWRZKGSK-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000190325593	408222351	/nfs/dbraw/zinc/22/23/51/408222351.db2.gz	IXSDBEJORDRNOU-UHFFFAOYSA-N	1	1	305.306	1.397	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000269333248	408271410	/nfs/dbraw/zinc/27/14/10/408271410.db2.gz	ATGZKHRKRVHBSG-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000269333248	408271416	/nfs/dbraw/zinc/27/14/16/408271416.db2.gz	ATGZKHRKRVHBSG-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1CO	ZINC000190895233	408339065	/nfs/dbraw/zinc/33/90/65/408339065.db2.gz	NHQPITCKCCIFJK-YPMHNXCESA-N	1	1	319.361	1.044	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](O)CN1CCOCC1	ZINC000274244928	408339273	/nfs/dbraw/zinc/33/92/73/408339273.db2.gz	SNWGRWSVIZJDAK-CZUORRHYSA-N	1	1	323.393	1.281	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)c1	ZINC000158744787	408357475	/nfs/dbraw/zinc/35/74/75/408357475.db2.gz	YYXBFTIBMUBFJV-UHFFFAOYSA-N	1	1	316.317	1.854	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269631599	408367638	/nfs/dbraw/zinc/36/76/38/408367638.db2.gz	FWXWSESOKRYCRB-RISCZKNCSA-N	1	1	307.350	1.216	20	5		DDBDMO
CC[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(N)=O	ZINC000191721270	408478056	/nfs/dbraw/zinc/47/80/56/408478056.db2.gz	XSKDOAYYQRELBI-UHFFFAOYSA-N	1	1	318.333	1.600	20	5		DDBDMO
CC[N@@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(N)=O	ZINC000191721270	408478060	/nfs/dbraw/zinc/47/80/60/408478060.db2.gz	XSKDOAYYQRELBI-UHFFFAOYSA-N	1	1	318.333	1.600	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000177144811	408534599	/nfs/dbraw/zinc/53/45/99/408534599.db2.gz	YYCGSTDKPLKFKD-ZJUUUORDSA-N	1	1	321.381	1.625	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000248650911	408608220	/nfs/dbraw/zinc/60/82/20/408608220.db2.gz	AHOPVGYJAVIQDY-NEPJUHHUSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@H]1CO	ZINC000248900266	408659241	/nfs/dbraw/zinc/65/92/41/408659241.db2.gz	HEWIKXRIRHGSRD-HZMBPMFUSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCC(F)(F)C[NH3+])cc1C	ZINC000162638722	408721691	/nfs/dbraw/zinc/72/16/91/408721691.db2.gz	YMIUCBCDEIOAJB-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1	ZINC000275845694	408693986	/nfs/dbraw/zinc/69/39/86/408693986.db2.gz	KKNYDTCOAQUYMX-MGPQQGTHSA-N	1	1	324.377	1.570	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000178347960	408810463	/nfs/dbraw/zinc/81/04/63/408810463.db2.gz	BIDBDBXQIXEQFI-LBPRGKRZSA-N	1	1	310.350	1.951	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000270933308	408747591	/nfs/dbraw/zinc/74/75/91/408747591.db2.gz	QNEVXHFXIKNUPN-UHFFFAOYSA-N	1	1	322.321	1.669	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000270933308	408747597	/nfs/dbraw/zinc/74/75/97/408747597.db2.gz	QNEVXHFXIKNUPN-UHFFFAOYSA-N	1	1	322.321	1.669	20	5		DDBDMO
C[C@H](C(=O)NC[C@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000185183466	408775631	/nfs/dbraw/zinc/77/56/31/408775631.db2.gz	NWUZMFDDRQWAGM-WDEREUQCSA-N	1	1	309.341	1.905	20	5		DDBDMO
Cc1c(CC(=O)N2CC[NH+](C3CC3)CC2)cccc1[N+](=O)[O-]	ZINC000163408819	408775805	/nfs/dbraw/zinc/77/58/05/408775805.db2.gz	OZCFBSQNNYNFQX-UHFFFAOYSA-N	1	1	303.362	1.752	20	5		DDBDMO
CCN(CCC[NH+](C)C)C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000276239567	408826970	/nfs/dbraw/zinc/82/69/70/408826970.db2.gz	PFYCZFOQHCSZNL-UHFFFAOYSA-N	1	1	311.386	1.855	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000188746233	163065115	/nfs/dbraw/zinc/06/51/15/163065115.db2.gz	AWPFKBIOLMVUJH-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cc([N+](=O)[O-])c1	ZINC000188746233	163065116	/nfs/dbraw/zinc/06/51/16/163065116.db2.gz	AWPFKBIOLMVUJH-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190908402	163164251	/nfs/dbraw/zinc/16/42/51/163164251.db2.gz	DKEPZBCAXYRCFU-UTUOFQBUSA-N	1	1	307.350	1.482	20	5		DDBDMO
CN(CCC[NH+]1CCCC1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000281846001	408940476	/nfs/dbraw/zinc/94/04/76/408940476.db2.gz	XTOCMJDLGBXNJZ-UHFFFAOYSA-N	1	1	307.350	1.858	20	5		DDBDMO
Nc1c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cccc1[N+](=O)[O-]	ZINC000277610463	408977657	/nfs/dbraw/zinc/97/76/57/408977657.db2.gz	VFTQPMXPGQPLQU-LBPRGKRZSA-N	1	1	318.377	1.924	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)CO	ZINC000292187876	408996718	/nfs/dbraw/zinc/99/67/18/408996718.db2.gz	MWNBOVHWDUJJBQ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](C)CO	ZINC000292187876	408996721	/nfs/dbraw/zinc/99/67/21/408996721.db2.gz	MWNBOVHWDUJJBQ-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC	ZINC000283199537	409109128	/nfs/dbraw/zinc/10/91/28/409109128.db2.gz	GJBSKCMWKBYQLV-UHFFFAOYSA-N	1	1	309.322	1.418	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(=O)OC	ZINC000283199537	409109131	/nfs/dbraw/zinc/10/91/31/409109131.db2.gz	GJBSKCMWKBYQLV-UHFFFAOYSA-N	1	1	309.322	1.418	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000278939118	409117129	/nfs/dbraw/zinc/11/71/29/409117129.db2.gz	XJYRFYYSQMGONE-NSHDSACASA-N	1	1	323.349	1.513	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@H](O)[C@H]2C)c([N+](=O)[O-])c1	ZINC000295094888	409321089	/nfs/dbraw/zinc/32/10/89/409321089.db2.gz	AKOIHAMSFCFIRT-BXUZGUMPSA-N	1	1	310.350	1.827	20	5		DDBDMO
CN(CC(=O)N1CC[NH2+]C[C@](C)(F)C1)c1ccccc1[N+](=O)[O-]	ZINC000295217820	409380220	/nfs/dbraw/zinc/38/02/20/409380220.db2.gz	MHGIILTZDFZNPS-HNNXBMFYSA-N	1	1	324.356	1.191	20	5		DDBDMO
Cc1ccc(C[N@H+](C)[C@H]2CCN3CCO[C@H]2C3)cc1[N+](=O)[O-]	ZINC000295135109	409337285	/nfs/dbraw/zinc/33/72/85/409337285.db2.gz	PAJALHKMOURMLX-HOCLYGCPSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cccc([N+](=O)[O-])c2NC)C1	ZINC000317537928	164028333	/nfs/dbraw/zinc/02/83/33/164028333.db2.gz	ARKYQLYRRXCJHC-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290684383	409486874	/nfs/dbraw/zinc/48/68/74/409486874.db2.gz	SUOMGKJCRMMDKA-QWRGUYRKSA-N	1	1	321.381	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@@H]3CCCOC3)C2)nc1	ZINC000331461073	409535048	/nfs/dbraw/zinc/53/50/48/409535048.db2.gz	JJJPGOIZHQZKRY-STQMWFEESA-N	1	1	306.366	1.903	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cnc2C)C1	ZINC000338077886	409700308	/nfs/dbraw/zinc/70/03/08/409700308.db2.gz	IQQNFGUVJBIDNK-LBPRGKRZSA-N	1	1	306.366	1.760	20	5		DDBDMO
CN(C)C(=O)O[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000296829079	409654297	/nfs/dbraw/zinc/65/42/97/409654297.db2.gz	SDDSWQGSJCHJNY-AWEZNQCLSA-N	1	1	323.349	1.746	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3cccc(C(N)=O)c3[N+](=O)[O-])CC[C@H]21	ZINC000342706709	409832770	/nfs/dbraw/zinc/83/27/70/409832770.db2.gz	ROVWMGGYPISMEF-WCQYABFASA-N	1	1	318.377	1.614	20	5		DDBDMO
O=C(NCC1CC[NH2+]CC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000297188873	409846567	/nfs/dbraw/zinc/84/65/67/409846567.db2.gz	LPWNXXZELIRLLC-UHFFFAOYSA-N	1	1	303.322	1.201	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC000357012402	409792988	/nfs/dbraw/zinc/79/29/88/409792988.db2.gz	YQJUYRQNWITJOT-CHWSQXEVSA-N	1	1	320.393	1.866	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000342802718	409915401	/nfs/dbraw/zinc/91/54/01/409915401.db2.gz	PJRYSINSIBJCJM-UHFFFAOYSA-N	1	1	317.349	1.725	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)[C@@H]1CCN(C2CC2)C1=O	ZINC000338344862	409927304	/nfs/dbraw/zinc/92/73/04/409927304.db2.gz	CSCSAPHQNFUKHQ-OAHLLOKOSA-N	1	1	303.362	1.832	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CCC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000342835809	409940233	/nfs/dbraw/zinc/94/02/33/409940233.db2.gz	QOPXAQBAOVVKHY-PWSUYJOCSA-N	1	1	322.365	1.979	20	5		DDBDMO
CC1=CC[N@@H+](CCNc2nccc(C(N)=O)c2[N+](=O)[O-])CC1	ZINC000357451120	410049356	/nfs/dbraw/zinc/04/93/56/410049356.db2.gz	FPBCXOSXRPCQSO-UHFFFAOYSA-N	1	1	305.338	1.153	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000342986098	410052896	/nfs/dbraw/zinc/05/28/96/410052896.db2.gz	AMDUWSZGLVGNDO-KCJUWKMLSA-N	1	1	303.322	1.607	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000343392688	410416874	/nfs/dbraw/zinc/41/68/74/410416874.db2.gz	CKGRTIYGEVNADJ-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000343392688	410416879	/nfs/dbraw/zinc/41/68/79/410416879.db2.gz	CKGRTIYGEVNADJ-NSHDSACASA-N	1	1	323.349	1.807	20	5		DDBDMO
CCCC[N@@H+](CCO)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000298709685	410359864	/nfs/dbraw/zinc/35/98/64/410359864.db2.gz	YVYHSJZEQARVHC-CYBMUJFWSA-N	1	1	312.366	1.429	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCCC[C@H]3CO)n2)cc1	ZINC000298772497	410394229	/nfs/dbraw/zinc/39/42/29/410394229.db2.gz	TYZAYDRYTFZHSY-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@H]3CO)n2)cc1	ZINC000298772497	410394235	/nfs/dbraw/zinc/39/42/35/410394235.db2.gz	TYZAYDRYTFZHSY-ZDUSSCGKSA-N	1	1	318.333	1.992	20	5		DDBDMO
CCC[N@@H+]1CCC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000343555724	410530066	/nfs/dbraw/zinc/53/00/66/410530066.db2.gz	FMKMHTSCLACJOZ-LBPRGKRZSA-N	1	1	307.350	1.905	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000343555724	410530071	/nfs/dbraw/zinc/53/00/71/410530071.db2.gz	FMKMHTSCLACJOZ-LBPRGKRZSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000352185435	410530258	/nfs/dbraw/zinc/53/02/58/410530258.db2.gz	CJMXVBAGUNIJFI-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@@H+](CCCO)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000343689500	410623440	/nfs/dbraw/zinc/62/34/40/410623440.db2.gz	QASGIZVWILSDKE-CQSZACIVSA-N	1	1	307.350	1.404	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCC[N@H+]1C	ZINC000355924341	410735951	/nfs/dbraw/zinc/73/59/51/410735951.db2.gz	ZBDOFTHHXBSYOZ-SKDRFNHKSA-N	1	1	317.349	1.684	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C)[C@H]1CO	ZINC000330549383	410768359	/nfs/dbraw/zinc/76/83/59/410768359.db2.gz	DFIMTDQAFADQER-BXUZGUMPSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@H]1CO	ZINC000330549383	410768364	/nfs/dbraw/zinc/76/83/64/410768364.db2.gz	DFIMTDQAFADQER-BXUZGUMPSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1C	ZINC000330579882	410795596	/nfs/dbraw/zinc/79/55/96/410795596.db2.gz	IIXFFANDUBLSPZ-NEPJUHHUSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356157852	410869942	/nfs/dbraw/zinc/86/99/42/410869942.db2.gz	MGWOXURJOYPKIK-GFCCVEGCSA-N	1	1	323.397	1.570	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)CC2(O)CCC2)c([N+](=O)[O-])c1	ZINC000353525009	411046042	/nfs/dbraw/zinc/04/60/42/411046042.db2.gz	RLKSVLSYMDBDSG-UHFFFAOYSA-N	1	1	310.350	1.829	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000331280261	411054823	/nfs/dbraw/zinc/05/48/23/411054823.db2.gz	BKNQZXADBJHESF-UHFFFAOYSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@@H]1C[C@@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000353580636	411072640	/nfs/dbraw/zinc/07/26/40/411072640.db2.gz	IQFZFLPGDNRFQS-OLZOCXBDSA-N	1	1	320.393	1.853	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000344349935	411094664	/nfs/dbraw/zinc/09/46/64/411094664.db2.gz	KXMLGWSCCXMGLC-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000344349935	411094665	/nfs/dbraw/zinc/09/46/65/411094665.db2.gz	KXMLGWSCCXMGLC-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000129574622	196058945	/nfs/dbraw/zinc/05/89/45/196058945.db2.gz	BPRXYBZLLXHNCM-CQSZACIVSA-N	1	1	305.378	1.749	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CN1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000129574622	196058947	/nfs/dbraw/zinc/05/89/47/196058947.db2.gz	BPRXYBZLLXHNCM-CQSZACIVSA-N	1	1	305.378	1.749	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@H](CO)C(C)(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000134398680	196386885	/nfs/dbraw/zinc/38/68/85/196386885.db2.gz	JXSVOWXRCXRIDS-CQSZACIVSA-N	1	1	323.393	1.896	20	5		DDBDMO
C[C@@H]1COCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000374343426	418519742	/nfs/dbraw/zinc/51/97/42/418519742.db2.gz	XXNKZUCLYUREHI-NSHDSACASA-N	1	1	308.334	1.930	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000374343426	418519745	/nfs/dbraw/zinc/51/97/45/418519745.db2.gz	XXNKZUCLYUREHI-NSHDSACASA-N	1	1	308.334	1.930	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c2c(c1)COCO2	ZINC000366394606	418469890	/nfs/dbraw/zinc/46/98/90/418469890.db2.gz	FPPQAQGNOLZOGY-WDNDVIMCSA-N	1	1	306.318	1.131	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)c2c(c1)COCO2	ZINC000366394606	418469894	/nfs/dbraw/zinc/46/98/94/418469894.db2.gz	FPPQAQGNOLZOGY-WDNDVIMCSA-N	1	1	306.318	1.131	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@](O)(c2ccc(F)cc2)C1	ZINC000374861113	418570818	/nfs/dbraw/zinc/57/08/18/418570818.db2.gz	XUJGUOFXZMAJQP-HNNXBMFYSA-N	1	1	320.324	1.561	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@](O)(c2ccc(F)cc2)C1	ZINC000374861113	418570822	/nfs/dbraw/zinc/57/08/22/418570822.db2.gz	XUJGUOFXZMAJQP-HNNXBMFYSA-N	1	1	320.324	1.561	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000366956237	418543411	/nfs/dbraw/zinc/54/34/11/418543411.db2.gz	XRWRMOBWUIEBMS-ZDUSSCGKSA-N	1	1	315.333	1.094	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000366956237	418543412	/nfs/dbraw/zinc/54/34/12/418543412.db2.gz	XRWRMOBWUIEBMS-ZDUSSCGKSA-N	1	1	315.333	1.094	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@H+](CCO)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188369391	222012093	/nfs/dbraw/zinc/01/20/93/222012093.db2.gz	WCLHPTNNBVKQTQ-LLVKDONJSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1c(NC(=O)N2CC[N@@H+](CCO)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000188369391	222012095	/nfs/dbraw/zinc/01/20/95/222012095.db2.gz	WCLHPTNNBVKQTQ-LLVKDONJSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cn1c(NCCn2cc([N+](=O)[O-])cn2)[nH+]c2cccc(F)c21	ZINC000336980843	418618497	/nfs/dbraw/zinc/61/84/97/418618497.db2.gz	SGKSDQDKCVFQGN-UHFFFAOYSA-N	1	1	304.285	1.929	20	5		DDBDMO
CCn1cc(C[N@@H+](CCO)CCc2ccc([N+](=O)[O-])cc2)cn1	ZINC000361340168	418629729	/nfs/dbraw/zinc/62/97/29/418629729.db2.gz	ANTRYIQLDBCJSB-UHFFFAOYSA-N	1	1	318.377	1.848	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3ccc4ncc([N+](=O)[O-])n4n3)C2)C1	ZINC000368299410	418716802	/nfs/dbraw/zinc/71/68/02/418716802.db2.gz	OHZPRWDFONGXRI-CQSZACIVSA-N	1	1	302.338	1.170	20	5		DDBDMO
CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000361578139	418684291	/nfs/dbraw/zinc/68/42/91/418684291.db2.gz	PPEZKZSEMQWNAD-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000361578139	418684293	/nfs/dbraw/zinc/68/42/93/418684293.db2.gz	PPEZKZSEMQWNAD-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1CO	ZINC000362067897	418747162	/nfs/dbraw/zinc/74/71/62/418747162.db2.gz	RHVBBMQRZZTPEB-JQWIXIFHSA-N	1	1	318.333	1.705	20	5		DDBDMO
C[C@@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H](C)C[N@H+]1C	ZINC000408073940	418786542	/nfs/dbraw/zinc/78/65/42/418786542.db2.gz	VDSKGHUOPYGWPJ-NEPJUHHUSA-N	1	1	321.377	1.986	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000364939819	418826485	/nfs/dbraw/zinc/82/64/85/418826485.db2.gz	ZMDYSVNXNAXNBL-JTQLQIEISA-N	1	1	313.379	1.185	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c([N+](=O)[O-])c1	ZINC000372155905	418841085	/nfs/dbraw/zinc/84/10/85/418841085.db2.gz	HVBCRMVCOPUPMB-GXTWGEPZSA-N	1	1	319.361	1.552	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420970682	419393225	/nfs/dbraw/zinc/39/32/25/419393225.db2.gz	GVFIVGLNHMJEFY-SECBINFHSA-N	1	1	303.322	1.039	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000420970682	419393228	/nfs/dbraw/zinc/39/32/28/419393228.db2.gz	GVFIVGLNHMJEFY-SECBINFHSA-N	1	1	303.322	1.039	20	5		DDBDMO
CC(C)[C@H]1[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000427188145	419613918	/nfs/dbraw/zinc/61/39/18/419613918.db2.gz	WZAHFBFQEGKILY-UONOGXRCSA-N	1	1	308.382	1.663	20	5		DDBDMO
C[C@H]1CN(c2nccc3ccc([N+](=O)[O-])cc32)CC[N@H+]1CCO	ZINC000413251929	419776343	/nfs/dbraw/zinc/77/63/43/419776343.db2.gz	RHANKJKIDOJFLE-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)n1	ZINC000427705078	419716809	/nfs/dbraw/zinc/71/68/09/419716809.db2.gz	GYYIJRJCVAPKQI-NSHDSACASA-N	1	1	309.370	1.414	20	5		DDBDMO
CC[C@H]1CN(CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CCO1	ZINC000428067470	419807717	/nfs/dbraw/zinc/80/77/17/419807717.db2.gz	ALYYJSITRBKDPY-AWEZNQCLSA-N	1	1	323.349	1.141	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2C[NH2+]C[C@H]21	ZINC000415020540	419915014	/nfs/dbraw/zinc/91/50/14/419915014.db2.gz	BEQLZSPBZCEFHG-GCVYGYKWSA-N	1	1	304.350	1.119	20	5		DDBDMO
C[C@]12CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C[C@H]1C2(F)F	ZINC000428736055	419923185	/nfs/dbraw/zinc/92/31/85/419923185.db2.gz	RQGYYOFJHXSQDJ-YPMHNXCESA-N	1	1	313.304	1.734	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N(C1CC1)[C@H]1CC[NH2+]C1	ZINC000435244261	229366059	/nfs/dbraw/zinc/36/60/59/229366059.db2.gz	CKYAVMRFGJEGPK-NSHDSACASA-N	1	1	315.333	1.438	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCC1([NH3+])CCC1	ZINC000423316041	420011679	/nfs/dbraw/zinc/01/16/79/420011679.db2.gz	BNFMLAVVWBPPQV-NSHDSACASA-N	1	1	306.366	1.783	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(N)CCC1	ZINC000423316041	420011683	/nfs/dbraw/zinc/01/16/83/420011683.db2.gz	BNFMLAVVWBPPQV-NSHDSACASA-N	1	1	306.366	1.783	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C1(CO)CCOCC1	ZINC000430247682	420096187	/nfs/dbraw/zinc/09/61/87/420096187.db2.gz	WHRLKEXMQQHGQR-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@H](CN)[N@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000430924950	420208240	/nfs/dbraw/zinc/20/82/40/420208240.db2.gz	BWDVLAHQOSJQBL-SNVBAGLBSA-N	1	1	308.338	1.172	20	5		DDBDMO
C[C@H](CN)[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000430924950	420208242	/nfs/dbraw/zinc/20/82/42/420208242.db2.gz	BWDVLAHQOSJQBL-SNVBAGLBSA-N	1	1	308.338	1.172	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000416304219	420321114	/nfs/dbraw/zinc/32/11/14/420321114.db2.gz	YRTXKVJVWFEWJT-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000416304219	420321118	/nfs/dbraw/zinc/32/11/18/420321118.db2.gz	YRTXKVJVWFEWJT-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CCOC(=O)c1ccnc(N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000420633029	420336750	/nfs/dbraw/zinc/33/67/50/420336750.db2.gz	IQPMOTRQXCHRBV-LLVKDONJSA-N	1	1	322.365	1.697	20	5		DDBDMO
CNc1c(C(=O)NCC[N@@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000438677449	420462952	/nfs/dbraw/zinc/46/29/52/420462952.db2.gz	IMRQXRKNBVNFSJ-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
CNc1c(C(=O)NCC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000438677449	420462955	/nfs/dbraw/zinc/46/29/55/420462955.db2.gz	IMRQXRKNBVNFSJ-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCC[C@@H](C)C2)n1	ZINC000439102213	420479914	/nfs/dbraw/zinc/47/99/14/420479914.db2.gz	SLOOTAAGRDMNBY-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000457084939	420605868	/nfs/dbraw/zinc/60/58/68/420605868.db2.gz	GYFPFMFFXJUHHD-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000457084939	420605870	/nfs/dbraw/zinc/60/58/70/420605870.db2.gz	GYFPFMFFXJUHHD-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
CO[C@@H]1COC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000459823211	420884508	/nfs/dbraw/zinc/88/45/08/420884508.db2.gz	IPEOVBCZXJUPLX-DZGCQCFKSA-N	1	1	310.350	1.885	20	5		DDBDMO
CC(C)[C@H]1CN(CCn2cc([N+](=O)[O-])ccc2=O)CC[N@H+]1C	ZINC000487956635	421058947	/nfs/dbraw/zinc/05/89/47/421058947.db2.gz	VXQSIRKXGIBNQC-CQSZACIVSA-N	1	1	308.382	1.029	20	5		DDBDMO
CCOC(=O)[C@H]1C[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC12COC2	ZINC000449360233	420996696	/nfs/dbraw/zinc/99/66/96/420996696.db2.gz	HQONDZWPZJSPGM-CQSZACIVSA-N	1	1	320.345	1.606	20	5		DDBDMO
Cn1c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)ccc1[N+](=O)[O-]	ZINC000495123618	421007519	/nfs/dbraw/zinc/00/75/19/421007519.db2.gz	VELDELJYKJMJJZ-VXGBXAGGSA-N	1	1	306.366	1.490	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456017552	421089698	/nfs/dbraw/zinc/08/96/98/421089698.db2.gz	ZBKHHBNCDGUFIE-VHSXEESVSA-N	1	1	307.354	1.244	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000488721175	421107709	/nfs/dbraw/zinc/10/77/09/421107709.db2.gz	RNJVJSBHPMSJNV-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](CC)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000456335132	421144082	/nfs/dbraw/zinc/14/40/82/421144082.db2.gz	AFXTYCWTOUAARU-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](CC)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000456335132	421144086	/nfs/dbraw/zinc/14/40/86/421144086.db2.gz	AFXTYCWTOUAARU-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](CC)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000456335132	421144088	/nfs/dbraw/zinc/14/40/88/421144088.db2.gz	AFXTYCWTOUAARU-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](CC)C[C@@H]2CC)c1[N+](=O)[O-]	ZINC000456335132	421144092	/nfs/dbraw/zinc/14/40/92/421144092.db2.gz	AFXTYCWTOUAARU-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)[N@@H+](C)C1CC1	ZINC000524359404	421258881	/nfs/dbraw/zinc/25/88/81/421258881.db2.gz	SUFDPVCYNDQZKS-VIFPVBQESA-N	1	1	321.333	1.536	20	5		DDBDMO
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000547755800	421363146	/nfs/dbraw/zinc/36/31/46/421363146.db2.gz	AFWFOVWHCOSHSN-OUAUKWLOSA-N	1	1	309.370	1.414	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000548413940	421434928	/nfs/dbraw/zinc/43/49/28/421434928.db2.gz	FIADAOWQHXSJIR-UHFFFAOYSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000341786138	271212634	/nfs/dbraw/zinc/21/26/34/271212634.db2.gz	BFBIXHMGELJBRO-NSHDSACASA-N	1	1	309.370	1.079	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000341786138	271212636	/nfs/dbraw/zinc/21/26/36/271212636.db2.gz	BFBIXHMGELJBRO-NSHDSACASA-N	1	1	309.370	1.079	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](CCCO)c1ccccc1	ZINC000341873668	271228548	/nfs/dbraw/zinc/22/85/48/271228548.db2.gz	AGEVXFVMOIIZSO-CYBMUJFWSA-N	1	1	304.350	1.932	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](CC)C[C@@H]2C)n1	ZINC000344419521	272021749	/nfs/dbraw/zinc/02/17/49/272021749.db2.gz	GDOQXNXYRBTPQR-PHIMTYICSA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](CC)C[C@@H]2C)n1	ZINC000344419521	272021751	/nfs/dbraw/zinc/02/17/51/272021751.db2.gz	GDOQXNXYRBTPQR-PHIMTYICSA-N	1	1	309.370	1.366	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222800	276040782	/nfs/dbraw/zinc/04/07/82/276040782.db2.gz	VWDGZNAVKVWCDF-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222800	276040783	/nfs/dbraw/zinc/04/07/83/276040783.db2.gz	VWDGZNAVKVWCDF-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222800	276040784	/nfs/dbraw/zinc/04/07/84/276040784.db2.gz	VWDGZNAVKVWCDF-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)c1[N+](=O)[O-]	ZINC000331222800	276040786	/nfs/dbraw/zinc/04/07/86/276040786.db2.gz	VWDGZNAVKVWCDF-LLVKDONJSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])C1CC1	ZINC000269453989	276348682	/nfs/dbraw/zinc/34/86/82/276348682.db2.gz	RMIMCQUQZNGURQ-UHFFFAOYSA-N	1	1	309.370	1.655	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3cccc(C(N)=O)c3[N+](=O)[O-])C2)C1	ZINC000338745489	277087268	/nfs/dbraw/zinc/08/72/68/277087268.db2.gz	NRNFZRVTPWPINX-INIZCTEOSA-N	1	1	318.377	1.616	20	5		DDBDMO
CC(C)[C@@H]1CN(c2c(C(N)=O)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000420613907	280016254	/nfs/dbraw/zinc/01/62/54/280016254.db2.gz	UPGZTDIQWAYYGE-ZDUSSCGKSA-N	1	1	306.366	1.470	20	5		DDBDMO
C[C@@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000357965271	299034995	/nfs/dbraw/zinc/03/49/95/299034995.db2.gz	QTTVCIBXTITYGH-QWRGUYRKSA-N	1	1	309.370	1.321	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@@H]2C1	ZINC000363877255	300320071	/nfs/dbraw/zinc/32/00/71/300320071.db2.gz	UGILMMBVZONAEV-NJZAAPMLSA-N	1	1	316.361	1.546	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000368557869	301051782	/nfs/dbraw/zinc/05/17/82/301051782.db2.gz	RHPNRQCZJDPMFF-LLVKDONJSA-N	1	1	315.276	1.039	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1	ZINC000368590609	301060023	/nfs/dbraw/zinc/06/00/23/301060023.db2.gz	KZNRBRWFFIZYPJ-XHDPSFHLSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000368596676	301061107	/nfs/dbraw/zinc/06/11/07/301061107.db2.gz	VVHQXTMTTFQXKN-WFASDCNBSA-N	1	1	303.362	1.690	20	5		DDBDMO
COC[C@@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000369946821	301245312	/nfs/dbraw/zinc/24/53/12/301245312.db2.gz	COEHPQJDQYTXPG-CYBMUJFWSA-N	1	1	309.366	1.505	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000370148576	301283408	/nfs/dbraw/zinc/28/34/08/301283408.db2.gz	BFQHNSYPOOGNPN-UHOFOFEASA-N	1	1	305.378	1.654	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532144532	303277203	/nfs/dbraw/zinc/27/72/03/303277203.db2.gz	DVOVTOPTIUOTAF-GFCCVEGCSA-N	1	1	306.366	1.984	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000534349512	303332617	/nfs/dbraw/zinc/33/26/17/303332617.db2.gz	SMQHUBFECGTETN-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000534349512	303332618	/nfs/dbraw/zinc/33/26/18/303332618.db2.gz	SMQHUBFECGTETN-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000366678381	307079451	/nfs/dbraw/zinc/07/94/51/307079451.db2.gz	LYOZLCAJFMWHBA-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
CCN(C)C(=O)CC[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369001204	307113952	/nfs/dbraw/zinc/11/39/52/307113952.db2.gz	KZNTXMAKBHAXMF-LBPRGKRZSA-N	1	1	309.370	1.297	20	5		DDBDMO
COc1ccc(CNC(=O)CC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000576407201	308312574	/nfs/dbraw/zinc/31/25/74/308312574.db2.gz	CGSCCTXORMGKAY-UHFFFAOYSA-N	1	1	303.265	1.204	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000576974355	308353683	/nfs/dbraw/zinc/35/36/83/308353683.db2.gz	ZDJLATICECYHGE-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[N@H+]2CCCOCC2)c1	ZINC000445667733	534245688	/nfs/dbraw/zinc/24/56/88/534245688.db2.gz	HNULSTRDYLOWRS-UHFFFAOYSA-N	1	1	323.349	1.516	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1CCCO	ZINC000452344049	534333223	/nfs/dbraw/zinc/33/32/23/534333223.db2.gz	CEPBCOXNDTVKRL-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cn1nnc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1	ZINC000494388670	534336300	/nfs/dbraw/zinc/33/63/00/534336300.db2.gz	WKMPVXAYLZLOMX-GFCCVEGCSA-N	1	1	302.338	1.229	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000334041728	536521807	/nfs/dbraw/zinc/52/18/07/536521807.db2.gz	AGAMPOAMTMBBCM-JQWIXIFHSA-N	1	1	307.350	1.816	20	5		DDBDMO
CCOc1ccc(C(=O)NC2C[NH+](C(C)C)C2)cc1[N+](=O)[O-]	ZINC000457731964	528396994	/nfs/dbraw/zinc/39/69/94/528396994.db2.gz	DDFAKECGQOSKKO-UHFFFAOYSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C[C@H]1C	ZINC000825466206	607821930	/nfs/dbraw/zinc/82/19/30/607821930.db2.gz	XDKNXDXSXUGBLN-SNVBAGLBSA-N	1	1	317.353	1.305	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(CNC(=O)O2)CC1	ZINC000797520331	700012846	/nfs/dbraw/zinc/01/28/46/700012846.db2.gz	DWDRWKLLFNIQIP-UHFFFAOYSA-N	1	1	321.333	1.678	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C)[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000748355614	700113422	/nfs/dbraw/zinc/11/34/22/700113422.db2.gz	SLWSGHMHTYTUMD-SECBINFHSA-N	1	1	322.321	1.588	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000748355614	700113423	/nfs/dbraw/zinc/11/34/23/700113423.db2.gz	SLWSGHMHTYTUMD-SECBINFHSA-N	1	1	322.321	1.588	20	5		DDBDMO
C[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(Cl)nc1	ZINC000159870161	697312802	/nfs/dbraw/zinc/31/28/02/697312802.db2.gz	BFAMIAGRJOIWEO-UHFFFAOYSA-N	1	1	322.752	1.937	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1ccc(Cl)nc1	ZINC000159870161	697312803	/nfs/dbraw/zinc/31/28/03/697312803.db2.gz	BFAMIAGRJOIWEO-UHFFFAOYSA-N	1	1	322.752	1.937	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000194628712	697717138	/nfs/dbraw/zinc/71/71/38/697717138.db2.gz	PULFHUKJEDASLK-NSHDSACASA-N	1	1	322.321	1.717	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857802	698143865	/nfs/dbraw/zinc/14/38/65/698143865.db2.gz	NCGWNULFYVHVQS-BXUZGUMPSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857802	698143869	/nfs/dbraw/zinc/14/38/69/698143869.db2.gz	NCGWNULFYVHVQS-BXUZGUMPSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2C[C@@]2(CO)C1	ZINC000782627136	698754712	/nfs/dbraw/zinc/75/47/12/698754712.db2.gz	ZBBQUYCTXDHKBM-HFAKWTLXSA-N	1	1	305.334	1.236	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2C[C@@]2(CO)C1	ZINC000782627136	698754714	/nfs/dbraw/zinc/75/47/14/698754714.db2.gz	ZBBQUYCTXDHKBM-HFAKWTLXSA-N	1	1	305.334	1.236	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3C[C@]3(CO)C2)c([N+](=O)[O-])cc1OC	ZINC000783745360	698872883	/nfs/dbraw/zinc/87/28/83/698872883.db2.gz	WEEDQDLQHJCHEW-XHDPSFHLSA-N	1	1	308.334	1.426	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3C[C@]3(CO)C2)c([N+](=O)[O-])cc1OC	ZINC000783745360	698872886	/nfs/dbraw/zinc/87/28/86/698872886.db2.gz	WEEDQDLQHJCHEW-XHDPSFHLSA-N	1	1	308.334	1.426	20	5		DDBDMO
CO[C@H]1C[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@@H]1C	ZINC000783969072	698896452	/nfs/dbraw/zinc/89/64/52/698896452.db2.gz	RYPGQAHNVPSBMJ-HZMBPMFUSA-N	1	1	319.365	1.962	20	5		DDBDMO
CO[C@H]1C[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC[C@@H]1C	ZINC000783969072	698896459	/nfs/dbraw/zinc/89/64/59/698896459.db2.gz	RYPGQAHNVPSBMJ-HZMBPMFUSA-N	1	1	319.365	1.962	20	5		DDBDMO
O=C1NC2(CO1)CC[NH+](Cc1c(F)cccc1[N+](=O)[O-])CC2	ZINC000784459171	698940334	/nfs/dbraw/zinc/94/03/34/698940334.db2.gz	JUPVQSGRNXXNIM-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)OCCn1cc([N+](=O)[O-])ccc1=O	ZINC000785728512	699095525	/nfs/dbraw/zinc/09/55/25/699095525.db2.gz	IDNPGBUMOUGYRG-TXEJJXNPSA-N	1	1	323.349	1.173	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(=O)N(CC)CC	ZINC000725848404	699336019	/nfs/dbraw/zinc/33/60/19/699336019.db2.gz	RWTNHIXFDKGQTN-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
C[C@H]1COCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000729185178	699473177	/nfs/dbraw/zinc/47/31/77/699473177.db2.gz	MOHISKWHDUOOGP-VIFPVBQESA-N	1	1	307.310	1.264	20	5		DDBDMO
C[C@H]1COCC[N@H+]1CCNc1ccc([N+](=O)[O-])c2nonc21	ZINC000729185178	699473178	/nfs/dbraw/zinc/47/31/78/699473178.db2.gz	MOHISKWHDUOOGP-VIFPVBQESA-N	1	1	307.310	1.264	20	5		DDBDMO
CN(c1nc2ccccn2c1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000733192174	699582730	/nfs/dbraw/zinc/58/27/30/699582730.db2.gz	XFZXCUCSDDSDLF-GFCCVEGCSA-N	1	1	301.350	1.915	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000795673085	699882847	/nfs/dbraw/zinc/88/28/47/699882847.db2.gz	RIZLYLZPOOSMBC-KLPPZKSPSA-N	1	1	305.338	1.715	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000796578715	699940040	/nfs/dbraw/zinc/94/00/40/699940040.db2.gz	JXQYSNFJMUYYFS-CQDKDKBSSA-N	1	1	310.350	1.100	20	5		DDBDMO
C[C@@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[N@H+]1C	ZINC000761081932	700841633	/nfs/dbraw/zinc/84/16/33/700841633.db2.gz	OWNYBOAZBLSBQQ-LLVKDONJSA-N	1	1	307.350	1.597	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000762720665	700904530	/nfs/dbraw/zinc/90/45/30/700904530.db2.gz	YPCWMVQWVDHTRT-ONOODXEBSA-N	1	1	319.361	1.181	20	5		DDBDMO
Cc1nonc1C[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000809744243	701685001	/nfs/dbraw/zinc/68/50/01/701685001.db2.gz	CIYZOQIYMNOYAK-VIFPVBQESA-N	1	1	319.321	1.793	20	5		DDBDMO
Cn1ccnc1[C@@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000767116955	701085050	/nfs/dbraw/zinc/08/50/50/701085050.db2.gz	OSEKGCIFCAJLBZ-UKRRQHHQSA-N	1	1	316.361	1.851	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000808215935	701508485	/nfs/dbraw/zinc/50/84/85/701508485.db2.gz	FDWNDTLMJGVHGP-CQSZACIVSA-N	1	1	323.397	1.604	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000808215935	701508486	/nfs/dbraw/zinc/50/84/86/701508486.db2.gz	FDWNDTLMJGVHGP-CQSZACIVSA-N	1	1	323.397	1.604	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000839693876	701786896	/nfs/dbraw/zinc/78/68/96/701786896.db2.gz	RTFCTUSZDBIPCR-TUKIKUTGSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000839693876	701786899	/nfs/dbraw/zinc/78/68/99/701786899.db2.gz	RTFCTUSZDBIPCR-TUKIKUTGSA-N	1	1	303.362	1.861	20	5		DDBDMO
COCCN(CC(C)C)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867946622	701847671	/nfs/dbraw/zinc/84/76/71/701847671.db2.gz	SOGMYGGINGFILI-INIZCTEOSA-N	1	1	323.393	1.900	20	5		DDBDMO
COCCN(CCF)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867984821	701874766	/nfs/dbraw/zinc/87/47/66/701874766.db2.gz	PFZPUQNYNCISPF-CQSZACIVSA-N	1	1	313.329	1.213	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]2[C@H](O)c2ccccc2)n1	ZINC000879244224	706627581	/nfs/dbraw/zinc/62/75/81/706627581.db2.gz	PHSWNPLSDZTMLH-GOEBONIOSA-N	1	1	316.361	1.989	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c(C)c1[N+](=O)[O-]	ZINC000840118317	701978145	/nfs/dbraw/zinc/97/81/45/701978145.db2.gz	DBDZOADAHRXHMU-MCIONIFRSA-N	1	1	308.382	1.991	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H]3C[C@]3(CO)C2)c1	ZINC000811493556	701993901	/nfs/dbraw/zinc/99/39/01/701993901.db2.gz	JAUPWXXZHQWEJD-SWLSCSKDSA-N	1	1	306.318	1.196	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H]3C[C@]3(CO)C2)c1	ZINC000811493556	701993905	/nfs/dbraw/zinc/99/39/05/701993905.db2.gz	JAUPWXXZHQWEJD-SWLSCSKDSA-N	1	1	306.318	1.196	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000812344583	702167058	/nfs/dbraw/zinc/16/70/58/702167058.db2.gz	VUCXKKFQPJZQBM-NWDGAFQWSA-N	1	1	319.361	1.627	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000842625496	702744971	/nfs/dbraw/zinc/74/49/71/702744971.db2.gz	LVAHJVOWFJKYNH-OAHLLOKOSA-N	1	1	304.350	1.897	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000842625496	702744973	/nfs/dbraw/zinc/74/49/73/702744973.db2.gz	LVAHJVOWFJKYNH-OAHLLOKOSA-N	1	1	304.350	1.897	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H](CO)C[NH+]2CCCCC2)cc1	ZINC000843112601	702821285	/nfs/dbraw/zinc/82/12/85/702821285.db2.gz	IRMFVOHOFICZPS-HOCLYGCPSA-N	1	1	323.393	1.065	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000846290446	703262608	/nfs/dbraw/zinc/26/26/08/703262608.db2.gz	CKJNDYGBWJJBHT-UHFFFAOYSA-N	1	1	309.370	1.280	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)cc1F	ZINC000866582123	706735254	/nfs/dbraw/zinc/73/52/54/706735254.db2.gz	MPBFTZZHDKJXQH-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)cc1F	ZINC000866582123	706735256	/nfs/dbraw/zinc/73/52/56/706735256.db2.gz	MPBFTZZHDKJXQH-VIFPVBQESA-N	1	1	317.342	1.025	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485940	703556051	/nfs/dbraw/zinc/55/60/51/703556051.db2.gz	BEDOXGMMEVRBFL-DOMZBBRYSA-N	1	1	321.377	1.835	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848485940	703556052	/nfs/dbraw/zinc/55/60/52/703556052.db2.gz	BEDOXGMMEVRBFL-DOMZBBRYSA-N	1	1	321.377	1.835	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](N2CCOC2=O)C1	ZINC000852431435	704044715	/nfs/dbraw/zinc/04/47/15/704044715.db2.gz	RQFBZOYIRQKAQD-ZDUSSCGKSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](N2CCOC2=O)C1	ZINC000852431435	704044719	/nfs/dbraw/zinc/04/47/19/704044719.db2.gz	RQFBZOYIRQKAQD-ZDUSSCGKSA-N	1	1	321.333	1.630	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCc3[nH]cnc3C2)cc1	ZINC000819321972	704107333	/nfs/dbraw/zinc/10/73/33/704107333.db2.gz	OGRPXRRHNZKITM-XHDPSFHLSA-N	1	1	302.334	1.498	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](C(=O)NC(C)C)C2)c(C)c1[N+](=O)[O-]	ZINC000853602262	704282922	/nfs/dbraw/zinc/28/29/22/704282922.db2.gz	QGHLGBKTOHVOFZ-CYBMUJFWSA-N	1	1	323.397	1.602	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](C(=O)NC(C)C)C2)c(C)c1[N+](=O)[O-]	ZINC000853602262	704282924	/nfs/dbraw/zinc/28/29/24/704282924.db2.gz	QGHLGBKTOHVOFZ-CYBMUJFWSA-N	1	1	323.397	1.602	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@]34COC[C@@]3(C2)CCCC4)cc1[N+](=O)[O-]	ZINC000853623823	704288642	/nfs/dbraw/zinc/28/86/42/704288642.db2.gz	UFTIQYZAUOSXFK-GASCZTMLSA-N	1	1	306.366	1.950	20	5		DDBDMO
Cc1nn(C[N@@H+]2C[C@]34COC[C@@]3(C2)CCCC4)cc1[N+](=O)[O-]	ZINC000853623823	704288644	/nfs/dbraw/zinc/28/86/44/704288644.db2.gz	UFTIQYZAUOSXFK-GASCZTMLSA-N	1	1	306.366	1.950	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000821341805	704393587	/nfs/dbraw/zinc/39/35/87/704393587.db2.gz	FMUILUOTTFVXCO-MRXNPFEDSA-N	1	1	322.409	1.029	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000856795792	704538983	/nfs/dbraw/zinc/53/89/83/704538983.db2.gz	JZYGBHQKMXLJGP-CMPLNLGQSA-N	1	1	309.322	1.953	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H]1CO	ZINC000856795792	704538984	/nfs/dbraw/zinc/53/89/84/704538984.db2.gz	JZYGBHQKMXLJGP-CMPLNLGQSA-N	1	1	309.322	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC[NH+]1CCSCC1	ZINC000874462412	705076948	/nfs/dbraw/zinc/07/69/48/705076948.db2.gz	OCEUKGKAIVLZLE-UHFFFAOYSA-N	1	1	323.418	1.990	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000874836564	705193961	/nfs/dbraw/zinc/19/39/61/705193961.db2.gz	GJWXXFVAYULFIT-CABCVRRESA-N	1	1	303.362	1.832	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1	ZINC000874846002	705200276	/nfs/dbraw/zinc/20/02/76/705200276.db2.gz	XBZSUSUIASOXQE-LSDHHAIUSA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[N@H+](C)[C@H](C(C)(C)C)C1	ZINC000824221300	705402440	/nfs/dbraw/zinc/40/24/40/705402440.db2.gz	FRPCMBBPWOBEGM-LBPRGKRZSA-N	1	1	323.397	1.288	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000861340624	705433477	/nfs/dbraw/zinc/43/34/77/705433477.db2.gz	KGMBBXXQNQFZRZ-ZFWWWQNUSA-N	1	1	308.334	1.861	20	5		DDBDMO
CCN(C(=O)Cn1c(C)ncc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000825017873	705578443	/nfs/dbraw/zinc/57/84/43/705578443.db2.gz	BXURNXPBOMFLOK-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000825722251	705722202	/nfs/dbraw/zinc/72/22/02/705722202.db2.gz	VSJFELKXXCTGTQ-HNNXBMFYSA-N	1	1	321.377	1.619	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(C(=O)CCC(C)(C)[N+](=O)[O-])CC2)c1	ZINC000827023022	705914101	/nfs/dbraw/zinc/91/41/01/705914101.db2.gz	OXOWXPPTEAKCCV-UHFFFAOYSA-N	1	1	320.393	1.874	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc(F)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000827300686	705971820	/nfs/dbraw/zinc/97/18/20/705971820.db2.gz	NCAPKWQUKMILIL-GWCFXTLKSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC[C@@H]21	ZINC000827339433	705979892	/nfs/dbraw/zinc/97/98/92/705979892.db2.gz	TUPMZCUBSQPLLA-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1C	ZINC000828249361	706146457	/nfs/dbraw/zinc/14/64/57/706146457.db2.gz	ZZZUWWDCXBVOAY-SUNKGSAMSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000828249361	706146461	/nfs/dbraw/zinc/14/64/61/706146461.db2.gz	ZZZUWWDCXBVOAY-SUNKGSAMSA-N	1	1	307.350	1.179	20	5		DDBDMO
CC(=O)c1c(NC[C@H](C)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000881907149	707418512	/nfs/dbraw/zinc/41/85/12/707418512.db2.gz	DBLMNXNKEKMFTF-LBPRGKRZSA-N	1	1	320.393	1.845	20	5		DDBDMO
Cc1ccc(CN2CCN(c3[nH]cc[nH+]3)CC2)cc1[N+](=O)[O-]	ZINC000878517382	706413828	/nfs/dbraw/zinc/41/38/28/706413828.db2.gz	LBHBICBULJYXNQ-UHFFFAOYSA-N	1	1	301.350	1.949	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000830112906	706457803	/nfs/dbraw/zinc/45/78/03/706457803.db2.gz	UIILPSNCEFOTFC-ZWNOBZJWSA-N	1	1	309.341	1.875	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC3(COC3)C2)o1	ZINC000878991077	706554755	/nfs/dbraw/zinc/55/47/55/706554755.db2.gz	DWRWMCUCFPNUDI-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC3(COC3)C2)o1	ZINC000878991077	706554758	/nfs/dbraw/zinc/55/47/58/706554758.db2.gz	DWRWMCUCFPNUDI-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
C[C@H]1c2sccc2CC[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000880377831	706956802	/nfs/dbraw/zinc/95/68/02/706956802.db2.gz	GMMNFRWPBVZAQK-GWCFXTLKSA-N	1	1	322.390	1.833	20	5		DDBDMO
CC[NH+](CC)Cc1cn(C[C@@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000881410807	707243910	/nfs/dbraw/zinc/24/39/10/707243910.db2.gz	LVNNOEWBWQRCCG-OAHLLOKOSA-N	1	1	319.365	1.762	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)c(Cl)c1	ZINC000872757421	707586568	/nfs/dbraw/zinc/58/65/68/707586568.db2.gz	BXRMXZLITMWNLR-GXSJLCMTSA-N	1	1	312.757	1.289	20	5		DDBDMO
C[N@@H+](CCNc1cc(Cl)ccc1[N+](=O)[O-])CCOCCO	ZINC000882951662	707867325	/nfs/dbraw/zinc/86/73/25/707867325.db2.gz	PHFWMDHORNFCJW-UHFFFAOYSA-N	1	1	317.773	1.601	20	5		DDBDMO
C[C@H](CNC(=O)NC[C@H]1CC[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000896619912	708099032	/nfs/dbraw/zinc/09/90/32/708099032.db2.gz	OMGMOUBJDIKLFS-VXGBXAGGSA-N	1	1	306.366	1.702	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1	ZINC000896915077	708181881	/nfs/dbraw/zinc/18/18/81/708181881.db2.gz	VVFOUTJZHIWMLV-MEDUHNTESA-N	1	1	318.377	1.342	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000897219638	708257094	/nfs/dbraw/zinc/25/70/94/708257094.db2.gz	MFOKNTLWPWLAEH-GHMZBOCLSA-N	1	1	310.329	1.164	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000897710619	708426799	/nfs/dbraw/zinc/42/67/99/708426799.db2.gz	ZDADTLDQZZYRNI-UHFFFAOYSA-N	1	1	323.349	1.324	20	5		DDBDMO
CCc1ccc(C(=O)N(C)CC[N@@H+](C)CCO)cc1[N+](=O)[O-]	ZINC000912606039	713045643	/nfs/dbraw/zinc/04/56/43/713045643.db2.gz	IHJHAFNFZRPZJV-UHFFFAOYSA-N	1	1	309.366	1.153	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1cccnc1[N+](=O)[O-]	ZINC000886176597	708710248	/nfs/dbraw/zinc/71/02/48/708710248.db2.gz	HAIUUMGEKVZOPI-CYBMUJFWSA-N	1	1	320.393	1.675	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000886593529	708785329	/nfs/dbraw/zinc/78/53/29/708785329.db2.gz	SPGWJKXLOOJURP-ZDUSSCGKSA-N	1	1	323.397	1.370	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](c3ncccn3)C2)c1	ZINC000886680636	708812482	/nfs/dbraw/zinc/81/24/82/708812482.db2.gz	IWGGCZJXRAOFOR-GFCCVEGCSA-N	1	1	302.338	1.461	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403307	709037573	/nfs/dbraw/zinc/03/75/73/709037573.db2.gz	SZEOWTDITPDZOM-DOMZBBRYSA-N	1	1	321.377	1.535	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000887403307	709037579	/nfs/dbraw/zinc/03/75/79/709037579.db2.gz	SZEOWTDITPDZOM-DOMZBBRYSA-N	1	1	321.377	1.535	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096535	713129034	/nfs/dbraw/zinc/12/90/34/713129034.db2.gz	MVOBRTKUXJWBPO-JSGCOSHPSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096535	713129036	/nfs/dbraw/zinc/12/90/36/713129036.db2.gz	MVOBRTKUXJWBPO-JSGCOSHPSA-N	1	1	321.402	1.904	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OC[C@H]1CCCC[N@@H+]1C(C)C	ZINC000910205630	709813828	/nfs/dbraw/zinc/81/38/28/709813828.db2.gz	LXBYNPBMXIKZML-CYBMUJFWSA-N	1	1	324.381	1.906	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928435836	713194823	/nfs/dbraw/zinc/19/48/23/713194823.db2.gz	DEAFQGRXNCMFBS-RYUDHWBXSA-N	1	1	306.366	1.240	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640404	710835151	/nfs/dbraw/zinc/83/51/51/710835151.db2.gz	YNQFIRYNLAILAR-GXTWGEPZSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000902640404	710835173	/nfs/dbraw/zinc/83/51/73/710835173.db2.gz	YNQFIRYNLAILAR-GXTWGEPZSA-N	1	1	317.349	1.920	20	5		DDBDMO
COC(=O)N1CC([NH2+][C@@H](C)c2cc(OC)cc([N+](=O)[O-])c2)C1	ZINC000903124290	711040288	/nfs/dbraw/zinc/04/02/88/711040288.db2.gz	FAMNRGUGPORQAU-VIFPVBQESA-N	1	1	309.322	1.705	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@@H]([NH+]3CCC3)C2)c1	ZINC000903208820	711066182	/nfs/dbraw/zinc/06/61/82/711066182.db2.gz	ZTGVPCFOQDHCFW-GFCCVEGCSA-N	1	1	311.363	1.064	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(O)c(OC)c2[N+](=O)[O-])[C@H](C)C1	ZINC000894406202	711106237	/nfs/dbraw/zinc/10/62/37/711106237.db2.gz	OFHAQVJXUYSNKC-LLVKDONJSA-N	1	1	309.366	1.835	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CC([NH+]2CCCC2)C1	ZINC000912321315	711278035	/nfs/dbraw/zinc/27/80/35/711278035.db2.gz	HAJQFKRGYCSUTN-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H]3OCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000895102451	711412950	/nfs/dbraw/zinc/41/29/50/711412950.db2.gz	YHQOEDPDCNHGFS-MFKMUULPSA-N	1	1	308.334	1.920	20	5		DDBDMO
CC1(C)[C@@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CS1(=O)=O	ZINC000895977497	711659109	/nfs/dbraw/zinc/65/91/09/711659109.db2.gz	GIHFVBYCDHPOSM-VGVVRCBHSA-N	1	1	310.375	1.773	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC000896570063	711754952	/nfs/dbraw/zinc/75/49/52/711754952.db2.gz	XCFKTFONGULAJX-YGRLFVJLSA-N	1	1	324.356	1.098	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000914325479	713378738	/nfs/dbraw/zinc/37/87/38/713378738.db2.gz	LECWURGBXPVETF-SMDDNHRTSA-N	1	1	306.366	1.529	20	5		DDBDMO
COC/C(C)=C/C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000929171764	713560893	/nfs/dbraw/zinc/56/08/93/713560893.db2.gz	ODURHLSSXGXLEP-WLRTZDKTSA-N	1	1	306.366	1.705	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1C[C@H]2COC[C@H]2O1	ZINC000930353098	713811971	/nfs/dbraw/zinc/81/19/71/713811971.db2.gz	HFWIBODEMPHSNK-CWRNSKLLSA-N	1	1	306.362	1.873	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cnc2n1CCOC2	ZINC000921688520	713843669	/nfs/dbraw/zinc/84/36/69/713843669.db2.gz	ZIYSMFGATVZBRH-UHFFFAOYSA-N	1	1	318.333	1.620	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[N@H+](C(C)(C)C)CC1	ZINC000931123076	714008073	/nfs/dbraw/zinc/00/80/73/714008073.db2.gz	KPRKJQPZOXRRAV-UHFFFAOYSA-N	1	1	323.397	1.433	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H]2CCC[N@@H+]3CCO)cc1	ZINC000934255067	714775992	/nfs/dbraw/zinc/77/59/92/714775992.db2.gz	OJJICVSFFDOSSH-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3[C@@H]2CCCN3CCO)cc1	ZINC000934255067	714775994	/nfs/dbraw/zinc/77/59/94/714775994.db2.gz	OJJICVSFFDOSSH-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3[C@@H]2CCCN3CCO)cc1	ZINC000934255067	714775996	/nfs/dbraw/zinc/77/59/96/714775996.db2.gz	OJJICVSFFDOSSH-JKSUJKDBSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934272206	714783174	/nfs/dbraw/zinc/78/31/74/714783174.db2.gz	IISXQMYKXHFQDK-CABCVRRESA-N	1	1	323.368	1.765	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925343013	714820917	/nfs/dbraw/zinc/82/09/17/714820917.db2.gz	KVTHVQZDCIDNMQ-TZMCWYRMSA-N	1	1	320.393	1.871	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4cc3[N+](=O)[O-])C[C@H]21	ZINC000352355708	719413141	/nfs/dbraw/zinc/41/31/41/719413141.db2.gz	JIQZEOKLQLWFFL-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001120959089	782257522	/nfs/dbraw/zinc/25/75/22/782257522.db2.gz	FLZNAZYKKRXQIA-YPMHNXCESA-N	1	1	308.382	1.650	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c([N+](=O)[O-])c1	ZINC001121008532	782293198	/nfs/dbraw/zinc/29/31/98/782293198.db2.gz	FMVLKIVBSXDQOJ-ADEWGFFLSA-N	1	1	320.349	1.529	20	5		DDBDMO
CN(CCNC(=O)Cc1cnc[nH]1)c1ccc([N+](=O)[O-])cc1F	ZINC001100354150	738999349	/nfs/dbraw/zinc/99/93/49/738999349.db2.gz	MCQZGHZAEPSZPH-UHFFFAOYSA-N	1	1	321.312	1.252	20	5		DDBDMO
CC(C)CC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035707275	751794055	/nfs/dbraw/zinc/79/40/55/751794055.db2.gz	OIHYGKMLAGRZNM-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
Nc1nnc([C@@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)o1	ZINC001196527861	746887739	/nfs/dbraw/zinc/88/77/39/746887739.db2.gz	YBHBQDHLSPDBAM-LLVKDONJSA-N	1	1	303.322	1.940	20	5		DDBDMO
Cc1ccc(C[NH2+][C@@](C)(Cn2cccn2)C(N)=O)cc1[N+](=O)[O-]	ZINC001198574901	747531139	/nfs/dbraw/zinc/53/11/39/747531139.db2.gz	VGRWRFHLKCBOGD-HNNXBMFYSA-N	1	1	317.349	1.134	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2cscn2)CC1	ZINC000997774581	751272911	/nfs/dbraw/zinc/27/29/11/751272911.db2.gz	FXSHSHREEDEXBE-CHWSQXEVSA-N	1	1	324.406	1.137	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169017556	762197765	/nfs/dbraw/zinc/19/77/65/762197765.db2.gz	AOKLOEYQEHEVGY-AEGPPILISA-N	1	1	322.409	1.801	20	5		DDBDMO
O=C(NC1CC1)[C@H]1C[C@H]2C[N@H+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)C[C@H]2C1	ZINC001169023547	762201088	/nfs/dbraw/zinc/20/10/88/762201088.db2.gz	OYWUCPYYTJYXPR-FAHYXWLWSA-N	1	1	321.421	1.668	20	5		DDBDMO
Cc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)n1	ZINC001169052444	762207234	/nfs/dbraw/zinc/20/72/34/762207234.db2.gz	FXQUKIUJJHCXMG-MGPQQGTHSA-N	1	1	306.366	1.684	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347074	766278121	/nfs/dbraw/zinc/27/81/21/766278121.db2.gz	QAHMXNMPQXBTEB-BXUZGUMPSA-N	1	1	321.377	1.874	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347074	766278125	/nfs/dbraw/zinc/27/81/25/766278125.db2.gz	QAHMXNMPQXBTEB-BXUZGUMPSA-N	1	1	321.377	1.874	20	5		DDBDMO
CCOC(=O)C1=C(Nc2nc(OC)ccc2[N+](=O)[O-])CC[NH2+]C1	ZINC001170512966	767721264	/nfs/dbraw/zinc/72/12/64/767721264.db2.gz	AUXKMDQZKGEWGC-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC001097053599	771599883	/nfs/dbraw/zinc/59/98/83/771599883.db2.gz	VJPVHACUSTTZKR-JOCQHMNTSA-N	1	1	320.393	1.996	20	5		DDBDMO
CC[C@@]([NH3+])(CO)Nc1nccc(Br)c1[N+](=O)[O-]	ZINC001170865269	771777802	/nfs/dbraw/zinc/77/78/02/771777802.db2.gz	ZVJVUJSAUDKUFG-VIFPVBQESA-N	1	1	305.132	1.222	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001137039020	772275503	/nfs/dbraw/zinc/27/55/03/772275503.db2.gz	OKTULSKYHOQQBP-LLVKDONJSA-N	1	1	321.381	1.376	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCOC[C@@H](O)C1)CC2	ZINC001172903902	776917145	/nfs/dbraw/zinc/91/71/45/776917145.db2.gz	JKBXUHKTIIBVFR-ZBFHGGJFSA-N	1	1	306.362	1.535	20	5		DDBDMO
COc1ncnc2c1CC[N@H+]([C@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169021296	850518686	/nfs/dbraw/zinc/51/86/86/850518686.db2.gz	KLLPFFRQTUERTH-RYUDHWBXSA-N	1	1	306.366	1.331	20	5		DDBDMO
Cc1nc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC001327720241	862411575	/nfs/dbraw/zinc/41/15/75/862411575.db2.gz	CKHBGAQENQZNRB-GARJFASQSA-N	1	1	309.370	1.603	20	5		DDBDMO
Cc1nc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC001327720241	862411590	/nfs/dbraw/zinc/41/15/90/862411590.db2.gz	CKHBGAQENQZNRB-GARJFASQSA-N	1	1	309.370	1.603	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC001153801750	864115091	/nfs/dbraw/zinc/11/50/91/864115091.db2.gz	BPWGHKOKJYZAMH-LBPRGKRZSA-N	1	1	323.397	1.515	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001157818825	864169938	/nfs/dbraw/zinc/16/99/38/864169938.db2.gz	YFFGPQPZNWMBRS-NSHDSACASA-N	1	1	307.354	1.128	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001157818825	864169942	/nfs/dbraw/zinc/16/99/42/864169942.db2.gz	YFFGPQPZNWMBRS-NSHDSACASA-N	1	1	307.354	1.128	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccc2[nH]cc([N+](=O)[O-])c2n1	ZINC001159300235	865210301	/nfs/dbraw/zinc/21/03/01/865210301.db2.gz	XBGHAXWJYOHXRE-UHFFFAOYSA-N	1	1	302.294	1.172	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1ccc(-c2ccccc2[N+](=O)[O-])nn1	ZINC001159789039	865524429	/nfs/dbraw/zinc/52/44/29/865524429.db2.gz	PVGDLQYEYVQHJY-ZDUSSCGKSA-N	1	1	302.338	1.487	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C(C)C)[C@H](C)C1	ZINC001165198824	869422491	/nfs/dbraw/zinc/42/24/91/869422491.db2.gz	JFBPVLQZSLCLKT-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNc2ccc([N+](=O)[O-])c3c2CNC3=O)C1	ZINC001165301156	869508330	/nfs/dbraw/zinc/50/83/30/869508330.db2.gz	YKJOQVYWOOJFJB-NSHDSACASA-N	1	1	318.377	1.982	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCCc2[nH+]ccn2C)c1[N+](=O)[O-]	ZINC001337710744	869604144	/nfs/dbraw/zinc/60/41/44/869604144.db2.gz	XVYOZBFSVQSLLE-UHFFFAOYSA-N	1	1	319.321	1.473	20	5		DDBDMO
Cc1cc(OCC(=O)NC[C@H]2CCCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC001339268224	870429994	/nfs/dbraw/zinc/42/99/94/870429994.db2.gz	XCOVECHBCROMJM-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001339815421	870713286	/nfs/dbraw/zinc/71/32/86/870713286.db2.gz	MPDPUAWHOPFNBN-FZMZJTMJSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@@H]2CN(C)CC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815421	870713296	/nfs/dbraw/zinc/71/32/96/870713296.db2.gz	MPDPUAWHOPFNBN-FZMZJTMJSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@@H]2CN(C)CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815421	870713311	/nfs/dbraw/zinc/71/33/11/870713311.db2.gz	MPDPUAWHOPFNBN-FZMZJTMJSA-N	1	1	308.382	1.650	20	5		DDBDMO
COC(=O)c1cnc(NC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC001339859040	870741256	/nfs/dbraw/zinc/74/12/56/870741256.db2.gz	ZCHPTVXDNPZOLO-NSHDSACASA-N	1	1	308.338	1.673	20	5		DDBDMO
Cn1c[nH+]c(Cn2nc(-c3ccccc3[N+](=O)[O-])oc2=O)c1	ZINC001307340700	871422089	/nfs/dbraw/zinc/42/20/89/871422089.db2.gz	ZYLUOAFVQDXVGL-UHFFFAOYSA-N	1	1	301.262	1.193	20	5		DDBDMO
CCc1nc2c(c(O[C@H](C[N+](=O)[O-])c3cccnc3)n1)C[NH2+]C2	ZINC001218296172	877446732	/nfs/dbraw/zinc/44/67/32/877446732.db2.gz	KEIRVPZAMSKMRD-CYBMUJFWSA-N	1	1	315.333	1.434	20	5		DDBDMO
Nc1ccc2n(C(=O)[C@@H]3COC[NH2+]3)c3ccccc3cc-2c1=O	ZINC001219253943	878062136	/nfs/dbraw/zinc/06/21/36/878062136.db2.gz	PALODYRZEAOMJR-ZDUSSCGKSA-N	1	1	309.325	1.275	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3ncc([N+](=O)[O-])c4nc[nH]c43)[C@H]1CC(=O)C2	ZINC001227691481	883134048	/nfs/dbraw/zinc/13/40/48/883134048.db2.gz	OZCVOZBHQGJMRE-NMLBEHRDSA-N	1	1	317.305	1.049	20	5		DDBDMO
O=c1[nH]c(C2CC2)nc(O[C@H]2C[NH+]3CCC2CC3)c1[N+](=O)[O-]	ZINC001228604843	883569766	/nfs/dbraw/zinc/56/97/66/883569766.db2.gz	WXADJCGHHYNZGO-JTQLQIEISA-N	1	1	306.322	1.441	20	5		DDBDMO
CN1CCc2cc(OC(=O)C[C@@H](O)C[N+](C)(C)C)ccc2C1	ZINC001228936862	883739854	/nfs/dbraw/zinc/73/98/54/883739854.db2.gz	OTCDXMFTFYJOJP-OAHLLOKOSA-N	1	1	307.414	1.037	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1O[C@@H]1CCc2[nH+]ccn2C1	ZINC001229059779	883796086	/nfs/dbraw/zinc/79/60/86/883796086.db2.gz	VDTYFZSXCRJQKL-LLVKDONJSA-N	1	1	317.301	1.972	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2cccc(C(C)=O)c2[N+](=O)[O-])C1	ZINC001229138912	883844441	/nfs/dbraw/zinc/84/44/41/883844441.db2.gz	RIDHVVIYDMZAFQ-GFCCVEGCSA-N	1	1	308.334	1.897	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cccc(C(C)=O)c2[N+](=O)[O-])C1	ZINC001229138912	883844453	/nfs/dbraw/zinc/84/44/53/883844453.db2.gz	RIDHVVIYDMZAFQ-GFCCVEGCSA-N	1	1	308.334	1.897	20	5		DDBDMO
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2C[N@@H+](CC[N+](=O)[O-])C[C@@H]21	ZINC001262256054	900055771	/nfs/dbraw/zinc/05/57/71/900055771.db2.gz	DYEHYZDGVASTLZ-FRRDWIJNSA-N	1	1	313.398	1.888	20	5		DDBDMO
Cc1ncsc1C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001264985037	901393152	/nfs/dbraw/zinc/39/31/52/901393152.db2.gz	KXOJBXFTYVZJHX-GHMZBOCLSA-N	1	1	312.395	1.055	20	5		DDBDMO
Cc1ncsc1C[N@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985037	901393160	/nfs/dbraw/zinc/39/31/60/901393160.db2.gz	KXOJBXFTYVZJHX-GHMZBOCLSA-N	1	1	312.395	1.055	20	5		DDBDMO
Cc1ncsc1C[N@@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985037	901393168	/nfs/dbraw/zinc/39/31/68/901393168.db2.gz	KXOJBXFTYVZJHX-GHMZBOCLSA-N	1	1	312.395	1.055	20	5		DDBDMO
COCCO[C@H]1C[C@@H](CO)C[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000278261681	214053699	/nfs/dbraw/zinc/05/36/99/214053699.db2.gz	IGZVKZREEOZTEX-HIFRSBDPSA-N	1	1	324.377	1.441	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000305761234	231042629	/nfs/dbraw/zinc/04/26/29/231042629.db2.gz	LIASSDBOXRMLCT-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)CN1	ZINC000278765997	214385250	/nfs/dbraw/zinc/38/52/50/214385250.db2.gz	BZLHQJJBPIYRSN-OAHLLOKOSA-N	1	1	316.317	1.448	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)CN1	ZINC000278765988	214386069	/nfs/dbraw/zinc/38/60/69/214386069.db2.gz	BZLHQJJBPIYRSN-HNNXBMFYSA-N	1	1	316.317	1.448	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250336	529443678	/nfs/dbraw/zinc/44/36/78/529443678.db2.gz	IXQRRSOSLGFNBW-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@]1(O)CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250336	529443681	/nfs/dbraw/zinc/44/36/81/529443681.db2.gz	IXQRRSOSLGFNBW-NHYWBVRUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000452063835	231286899	/nfs/dbraw/zinc/28/68/99/231286899.db2.gz	CKWOCFPCJRPCEB-SMDDNHRTSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000452063835	231286903	/nfs/dbraw/zinc/28/69/03/231286903.db2.gz	CKWOCFPCJRPCEB-SMDDNHRTSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C2CC2)C[C@@H](C)C1	ZINC000452171778	231322579	/nfs/dbraw/zinc/32/25/79/231322579.db2.gz	RZZGRKJRRNSSSN-LLVKDONJSA-N	1	1	318.377	1.855	20	5		DDBDMO
CO[C@]1(C)CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000279313534	214785409	/nfs/dbraw/zinc/78/54/09/214785409.db2.gz	NKOZJWBPKPHLMS-GDBMZVCRSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000358335164	299124876	/nfs/dbraw/zinc/12/48/76/299124876.db2.gz	ZBKFUNWRLTUXAF-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1C1CC1	ZINC000272670739	210077140	/nfs/dbraw/zinc/07/71/40/210077140.db2.gz	KNLJKQDYOPFQJW-KOLCDFICSA-N	1	1	305.334	1.655	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000272670739	210077142	/nfs/dbraw/zinc/07/71/42/210077142.db2.gz	KNLJKQDYOPFQJW-KOLCDFICSA-N	1	1	305.334	1.655	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@H+]1CCO)c1ccc([N+](=O)[O-])s1	ZINC000331327395	233082259	/nfs/dbraw/zinc/08/22/59/233082259.db2.gz	NGJYZJNVWJJGLX-SNVBAGLBSA-N	1	1	313.379	1.233	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@@H+]1CCO)c1ccc([N+](=O)[O-])s1	ZINC000331327395	233082270	/nfs/dbraw/zinc/08/22/70/233082270.db2.gz	NGJYZJNVWJJGLX-SNVBAGLBSA-N	1	1	313.379	1.233	20	5		DDBDMO
CN(C(=O)Cc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000358458806	299158747	/nfs/dbraw/zinc/15/87/47/299158747.db2.gz	CJAGPNDINHXRHK-HNNXBMFYSA-N	1	1	303.362	1.832	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC[C@](O)(CO)C2)ccc1[N+](=O)[O-]	ZINC000459628650	233385604	/nfs/dbraw/zinc/38/56/04/233385604.db2.gz	FZYYTZXMRQUGDU-OAHLLOKOSA-N	1	1	310.350	1.313	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@](O)(CO)C2)ccc1[N+](=O)[O-]	ZINC000459628650	233385612	/nfs/dbraw/zinc/38/56/12/233385612.db2.gz	FZYYTZXMRQUGDU-OAHLLOKOSA-N	1	1	310.350	1.313	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCC[C@@H](OCCO)C2)cc1[N+](=O)[O-]	ZINC000172298924	198073590	/nfs/dbraw/zinc/07/35/90/198073590.db2.gz	BMWZTRKQQDOURR-CYBMUJFWSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@@H](OCCO)C2)cc1[N+](=O)[O-]	ZINC000172298924	198073591	/nfs/dbraw/zinc/07/35/91/198073591.db2.gz	BMWZTRKQQDOURR-CYBMUJFWSA-N	1	1	310.350	1.577	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000041716301	352311700	/nfs/dbraw/zinc/31/17/00/352311700.db2.gz	ABBNQTQHLRSBHG-UHFFFAOYSA-N	1	1	322.365	1.380	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-]	ZINC000064354018	352935367	/nfs/dbraw/zinc/93/53/67/352935367.db2.gz	KJQYUKBEXOGCRX-SECBINFHSA-N	1	1	307.310	1.252	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)[N@H+]1CCC[C@@H](C)C1	ZINC000065867396	352966897	/nfs/dbraw/zinc/96/68/97/352966897.db2.gz	UJBDVVJBXVMRNI-NEPJUHHUSA-N	1	1	323.397	1.336	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000358556342	299197148	/nfs/dbraw/zinc/19/71/48/299197148.db2.gz	RBSZDXMMMYURBO-UHFFFAOYSA-N	1	1	320.393	1.585	20	5		DDBDMO
O=C1CCCN1CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665036	353208027	/nfs/dbraw/zinc/20/80/27/353208027.db2.gz	XWOLIFAPHRBQEC-GFCCVEGCSA-N	1	1	319.365	1.098	20	5		DDBDMO
Cc1ccc(C(=O)NCc2c[nH+]c(N(C)C)n2C)cc1[N+](=O)[O-]	ZINC000074096053	353290209	/nfs/dbraw/zinc/29/02/09/353290209.db2.gz	NSYYKYIGPGNSHQ-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000174341867	198322189	/nfs/dbraw/zinc/32/21/89/198322189.db2.gz	BYZPLROHNFPBLI-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000174341867	198322190	/nfs/dbraw/zinc/32/21/90/198322190.db2.gz	BYZPLROHNFPBLI-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000078612849	353524386	/nfs/dbraw/zinc/52/43/86/353524386.db2.gz	SXQQDINFDDAANZ-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
CCn1nc2c(cc1=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000078612849	353524387	/nfs/dbraw/zinc/52/43/87/353524387.db2.gz	SXQQDINFDDAANZ-UHFFFAOYSA-N	1	1	314.345	1.730	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCC(O)(C(F)(F)F)CC2)c1	ZINC000089968764	353786459	/nfs/dbraw/zinc/78/64/59/353786459.db2.gz	ISDYEABCKMNBMF-UHFFFAOYSA-N	1	1	308.260	1.181	20	5		DDBDMO
Cc1cccc(OC[C@@H](O)C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000153796872	354201587	/nfs/dbraw/zinc/20/15/87/354201587.db2.gz	MTLKZMVBEPOREX-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cccc(OC[C@@H](O)C[N@H+]2C[C@@H](C)O[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000153796872	354201591	/nfs/dbraw/zinc/20/15/91/354201591.db2.gz	MTLKZMVBEPOREX-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423504	354225323	/nfs/dbraw/zinc/22/53/23/354225323.db2.gz	QHMBDNCOKOSXEB-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000157423504	354225327	/nfs/dbraw/zinc/22/53/27/354225327.db2.gz	QHMBDNCOKOSXEB-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[C@H](O)[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248470813	354368969	/nfs/dbraw/zinc/36/89/69/354368969.db2.gz	VJYJQXLRXJWSBF-MJBXVCDLSA-N	1	1	324.377	1.570	20	5		DDBDMO
CC[NH2+]CCCNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000313662824	354481221	/nfs/dbraw/zinc/48/12/21/354481221.db2.gz	LOZULBRJQHQJCU-UHFFFAOYSA-N	1	1	305.331	1.012	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000319123280	354520148	/nfs/dbraw/zinc/52/01/48/354520148.db2.gz	QUQFOVITXDOTBT-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C[C@@H]1C	ZINC000319123280	354520152	/nfs/dbraw/zinc/52/01/52/354520152.db2.gz	QUQFOVITXDOTBT-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000601310474	358490417	/nfs/dbraw/zinc/49/04/17/358490417.db2.gz	PMJFASSNPBLPCY-SKDRFNHKSA-N	1	1	307.325	1.946	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C(=O)OC)C2)c1	ZINC000589496338	354996047	/nfs/dbraw/zinc/99/60/47/354996047.db2.gz	QCLUDLDQQVFFLE-NSHDSACASA-N	1	1	322.317	1.376	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C(=O)OC)C2)c1	ZINC000589496338	354996049	/nfs/dbraw/zinc/99/60/49/354996049.db2.gz	QCLUDLDQQVFFLE-NSHDSACASA-N	1	1	322.317	1.376	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC000590010684	355039961	/nfs/dbraw/zinc/03/99/61/355039961.db2.gz	OTTZBKPGGDFLLC-GXTWGEPZSA-N	1	1	318.377	1.478	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000590047001	355043328	/nfs/dbraw/zinc/04/33/28/355043328.db2.gz	SCONKIOSKQMRRM-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590441585	355095722	/nfs/dbraw/zinc/09/57/22/355095722.db2.gz	DAKPKNWYHNDAFA-SMDDNHRTSA-N	1	1	304.350	1.413	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590443482	355097461	/nfs/dbraw/zinc/09/74/61/355097461.db2.gz	KMXMLCYFLYROCA-UWVGGRQHSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590443482	355097466	/nfs/dbraw/zinc/09/74/66/355097466.db2.gz	KMXMLCYFLYROCA-UWVGGRQHSA-N	1	1	307.354	1.217	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590443482	355097469	/nfs/dbraw/zinc/09/74/69/355097469.db2.gz	KMXMLCYFLYROCA-UWVGGRQHSA-N	1	1	307.354	1.217	20	5		DDBDMO
O=C1NC2(CO1)CC[NH+](Cc1ccc([N+](=O)[O-])cc1F)CC2	ZINC000495291594	235158872	/nfs/dbraw/zinc/15/88/72/235158872.db2.gz	KDKFOLGBHKLCBB-UHFFFAOYSA-N	1	1	309.297	1.808	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593165857	355816090	/nfs/dbraw/zinc/81/60/90/355816090.db2.gz	WTWAQKDXYUUNKS-CYBMUJFWSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cn2)[C@H](Cc2ccccc2)C1	ZINC000593505594	355906445	/nfs/dbraw/zinc/90/64/45/355906445.db2.gz	YAKPZRUQYDEXLS-CQSZACIVSA-N	1	1	313.361	1.748	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+](C(C)(C)CC)CC2)c1[N+](=O)[O-]	ZINC000594389039	356193435	/nfs/dbraw/zinc/19/34/35/356193435.db2.gz	DPANRKHEPODADW-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
O=[N+]([O-])c1ccc(-n2cc(C[N@H+]3CCC[C@H]3CO)nn2)cc1	ZINC000594640747	356269009	/nfs/dbraw/zinc/26/90/09/356269009.db2.gz	PSUPRSIYIVUQAU-AWEZNQCLSA-N	1	1	303.322	1.132	20	5		DDBDMO
O=[N+]([O-])c1ccc(-n2cc(C[N@@H+]3CCC[C@H]3CO)nn2)cc1	ZINC000594640747	356269014	/nfs/dbraw/zinc/26/90/14/356269014.db2.gz	PSUPRSIYIVUQAU-AWEZNQCLSA-N	1	1	303.322	1.132	20	5		DDBDMO
CCC[N@@H+](CC)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000080791380	192190694	/nfs/dbraw/zinc/19/06/94/192190694.db2.gz	CGPSEWFHCAYXLY-UHFFFAOYSA-N	1	1	315.395	1.605	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](C)S(C)(=O)=O	ZINC000595033063	356375224	/nfs/dbraw/zinc/37/52/24/356375224.db2.gz	AJLZHVHTAXNYFS-ZJUUUORDSA-N	1	1	316.379	1.687	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000595374585	356470118	/nfs/dbraw/zinc/47/01/18/356470118.db2.gz	HALOVOKNTAHWME-SNVBAGLBSA-N	1	1	319.321	1.673	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000595374585	356470121	/nfs/dbraw/zinc/47/01/21/356470121.db2.gz	HALOVOKNTAHWME-SNVBAGLBSA-N	1	1	319.321	1.673	20	5		DDBDMO
Cc1noc(CN2CCC([N@@H+]3CCOC[C@@H]3C)CC2)c1[N+](=O)[O-]	ZINC000595496404	356518948	/nfs/dbraw/zinc/51/89/48/356518948.db2.gz	BLJIFNFYEVADKU-NSHDSACASA-N	1	1	324.381	1.576	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1c[nH]cn1	ZINC000595595606	356568210	/nfs/dbraw/zinc/56/82/10/356568210.db2.gz	YOPPHXCGHHNBLB-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1c[nH]cn1	ZINC000595595606	356568215	/nfs/dbraw/zinc/56/82/15/356568215.db2.gz	YOPPHXCGHHNBLB-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cnc[nH]1	ZINC000595595606	356568220	/nfs/dbraw/zinc/56/82/20/356568220.db2.gz	YOPPHXCGHHNBLB-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cnc[nH]1	ZINC000595595606	356568223	/nfs/dbraw/zinc/56/82/23/356568223.db2.gz	YOPPHXCGHHNBLB-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC2(COC2)C1	ZINC000595835708	356671544	/nfs/dbraw/zinc/67/15/44/356671544.db2.gz	WYPIQJBOIARXJA-UHFFFAOYSA-N	1	1	305.334	1.564	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC2(COC2)C1	ZINC000595835708	356671547	/nfs/dbraw/zinc/67/15/47/356671547.db2.gz	WYPIQJBOIARXJA-UHFFFAOYSA-N	1	1	305.334	1.564	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595871947	356686801	/nfs/dbraw/zinc/68/68/01/356686801.db2.gz	IXWCYTFQLSDQEG-BONVTDFDSA-N	1	1	307.350	1.144	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)nc1	ZINC000596515138	356902315	/nfs/dbraw/zinc/90/23/15/356902315.db2.gz	WKBSHHNGXPOAFO-CHWSQXEVSA-N	1	1	319.365	1.440	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC3(COC3)C1)OCCO2	ZINC000597228572	357102900	/nfs/dbraw/zinc/10/29/00/357102900.db2.gz	DKEOQYILYAUYQH-UHFFFAOYSA-N	1	1	306.318	1.588	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC3(COC3)C1)OCCO2	ZINC000597228572	357102901	/nfs/dbraw/zinc/10/29/01/357102901.db2.gz	DKEOQYILYAUYQH-UHFFFAOYSA-N	1	1	306.318	1.588	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)C2	ZINC000597714279	357299148	/nfs/dbraw/zinc/29/91/48/357299148.db2.gz	HYYWNJNVSCZKMO-OAHLLOKOSA-N	1	1	321.381	1.126	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000597716944	357299931	/nfs/dbraw/zinc/29/99/31/357299931.db2.gz	UFHDEVMLWVCTPH-HNNXBMFYSA-N	1	1	306.366	1.491	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2cccc([O-])c2[N+](=O)[O-])CC1	ZINC000597599648	357247861	/nfs/dbraw/zinc/24/78/61/357247861.db2.gz	FJAJZEJQBUGHGD-UHFFFAOYSA-N	1	1	305.334	1.682	20	5		DDBDMO
CC1=CCN(CCNC(=O)c2cccc([O-])c2[N+](=O)[O-])CC1	ZINC000597599648	357247864	/nfs/dbraw/zinc/24/78/64/357247864.db2.gz	FJAJZEJQBUGHGD-UHFFFAOYSA-N	1	1	305.334	1.682	20	5		DDBDMO
CCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597947223	357395212	/nfs/dbraw/zinc/39/52/12/357395212.db2.gz	WABXGJMKMGWTNT-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000598466823	357593582	/nfs/dbraw/zinc/59/35/82/357593582.db2.gz	WNSPLXNYRQYETN-UHFFFAOYSA-N	1	1	311.386	1.418	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000598913255	357757028	/nfs/dbraw/zinc/75/70/28/357757028.db2.gz	GZTHGHCOYVPPDY-UHFFFAOYSA-N	1	1	308.672	1.964	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1(C)COC1	ZINC000599571863	357979190	/nfs/dbraw/zinc/97/91/90/357979190.db2.gz	VVQCYLZNPCSRDV-UHFFFAOYSA-N	1	1	319.361	1.452	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC1(C)COC1	ZINC000599571863	357979195	/nfs/dbraw/zinc/97/91/95/357979195.db2.gz	VVQCYLZNPCSRDV-UHFFFAOYSA-N	1	1	319.361	1.452	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H]1C[C@@H](O)C1	ZINC000599672347	358019382	/nfs/dbraw/zinc/01/93/82/358019382.db2.gz	MAFLANDALMINAM-WJONMLJTSA-N	1	1	308.334	1.664	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCCC[N@H+](C)C1	ZINC000600309482	358192264	/nfs/dbraw/zinc/19/22/64/358192264.db2.gz	AISYIBJKKWDQPM-GFCCVEGCSA-N	1	1	306.366	1.760	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@]3(CCO)CCOC3)c2c1	ZINC000601129183	358414553	/nfs/dbraw/zinc/41/45/53/358414553.db2.gz	CRQBNAJXLKTTRB-INIZCTEOSA-N	1	1	317.345	1.766	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)c1ccsc1[N+](=O)[O-]	ZINC000601165726	358429188	/nfs/dbraw/zinc/42/91/88/358429188.db2.gz	FRDCPJUAJFAYJI-UHFFFAOYSA-N	1	1	300.428	1.976	20	5		DDBDMO
CN(CCCN(C)c1ccsc1[N+](=O)[O-])CC[NH+](C)C	ZINC000601165726	358429192	/nfs/dbraw/zinc/42/91/92/358429192.db2.gz	FRDCPJUAJFAYJI-UHFFFAOYSA-N	1	1	300.428	1.976	20	5		DDBDMO
NC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000602427402	358969624	/nfs/dbraw/zinc/96/96/24/358969624.db2.gz	GUBPGYRSBXYGLD-VIFPVBQESA-N	1	1	317.267	1.921	20	5		DDBDMO
Cn1cc(CN2CC[C@@H](C[N@@H+](C)CC3CC3)C2)c([N+](=O)[O-])n1	ZINC000602479861	359005532	/nfs/dbraw/zinc/00/55/32/359005532.db2.gz	RGSZSPOIXZSPRB-ZDUSSCGKSA-N	1	1	307.398	1.492	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(c3ccncn3)CC2)c([N+](=O)[O-])n1	ZINC000602688711	359125741	/nfs/dbraw/zinc/12/57/41/359125741.db2.gz	YGIWLVOJFXYIGM-UHFFFAOYSA-N	1	1	302.338	1.498	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@H]([C@H](O)C(F)(F)F)C1	ZINC000602837807	359227564	/nfs/dbraw/zinc/22/75/64/359227564.db2.gz	AAEUEOCDPILXJZ-KOLCDFICSA-N	1	1	322.287	1.345	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C[C@@](C)(O)C1CC1	ZINC000602821804	359215965	/nfs/dbraw/zinc/21/59/65/359215965.db2.gz	ACWYRPRIPKJFLL-DLBZAZTESA-N	1	1	322.405	1.981	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000602951379	359317531	/nfs/dbraw/zinc/31/75/31/359317531.db2.gz	JAIATILNGJUXIF-YPMHNXCESA-N	1	1	319.365	1.278	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000602899322	359281281	/nfs/dbraw/zinc/28/12/81/359281281.db2.gz	PNCNHHNHGNOMIP-UKRRQHHQSA-N	1	1	310.350	1.181	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)CC[N@@H+](C)C2CC2)c1	ZINC000186740693	200001410	/nfs/dbraw/zinc/00/14/10/200001410.db2.gz	BFMXOBNVHQGZKG-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2c([N+](=O)[O-])ncn2C)CC1	ZINC000603401240	359617732	/nfs/dbraw/zinc/61/77/32/359617732.db2.gz	KICFDKWFIGFDRJ-LLVKDONJSA-N	1	1	309.370	1.018	20	5		DDBDMO
Cn1cc(CN2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)c([N+](=O)[O-])n1	ZINC000603430801	359635149	/nfs/dbraw/zinc/63/51/49/359635149.db2.gz	VAIXNJCVJXTNOS-MCIONIFRSA-N	1	1	323.397	1.189	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC1(O)CCOCC1	ZINC000187059862	200054854	/nfs/dbraw/zinc/05/48/54/200054854.db2.gz	QBUVMJNLOBTSLF-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](CCO)C1	ZINC000610213581	360391753	/nfs/dbraw/zinc/39/17/53/360391753.db2.gz	GZVRRJWHIHJNHP-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](CCO)C1	ZINC000610213581	360391757	/nfs/dbraw/zinc/39/17/57/360391757.db2.gz	GZVRRJWHIHJNHP-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
COC[C@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000610615796	360482272	/nfs/dbraw/zinc/48/22/72/360482272.db2.gz	XWBUQSZIOYXDOZ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000610615796	360482276	/nfs/dbraw/zinc/48/22/76/360482276.db2.gz	XWBUQSZIOYXDOZ-CQSZACIVSA-N	1	1	307.350	1.668	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[NH+](C(C)(C)CO)CC2)c1[N+](=O)[O-]	ZINC000611165998	360642999	/nfs/dbraw/zinc/64/29/99/360642999.db2.gz	VKCZGZJDGCLPRB-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000271889664	209299585	/nfs/dbraw/zinc/29/95/85/209299585.db2.gz	DLXBPHYEKYDLGP-UHFFFAOYSA-N	1	1	320.305	1.495	20	5		DDBDMO
NC(=O)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000193716509	201109472	/nfs/dbraw/zinc/10/94/72/201109472.db2.gz	SARPGNFPRMHHMJ-UHFFFAOYSA-N	1	1	322.321	1.590	20	5		DDBDMO
COc1cccc(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000194771735	201285759	/nfs/dbraw/zinc/28/57/59/201285759.db2.gz	ALINHKKVEDEFLC-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619253546	363946803	/nfs/dbraw/zinc/94/68/03/363946803.db2.gz	YTAIDAHXHDPLKB-GJZGRUSLSA-N	1	1	321.352	1.782	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000619473976	364028543	/nfs/dbraw/zinc/02/85/43/364028543.db2.gz	KRECUWJJKNRQJM-ZDUSSCGKSA-N	1	1	323.397	1.421	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)CC[NH+]2CCOCC2)c1	ZINC000359279055	299392403	/nfs/dbraw/zinc/39/24/03/299392403.db2.gz	BRASWVPSMITRTK-CYBMUJFWSA-N	1	1	321.377	1.744	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000264698900	204086873	/nfs/dbraw/zinc/08/68/73/204086873.db2.gz	VVWYBIJBFQBSDC-SECBINFHSA-N	1	1	309.370	1.483	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000264939354	204286260	/nfs/dbraw/zinc/28/62/60/204286260.db2.gz	VJMUCCSPRPEXSX-NSHDSACASA-N	1	1	302.334	1.900	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000266194177	205172753	/nfs/dbraw/zinc/17/27/53/205172753.db2.gz	HLFFQPLTUOJQNY-LLVKDONJSA-N	1	1	321.381	1.257	20	5		DDBDMO
C[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000282898394	217310010	/nfs/dbraw/zinc/31/00/10/217310010.db2.gz	WRHQSAJDUKYOAT-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000282898394	217310011	/nfs/dbraw/zinc/31/00/11/217310011.db2.gz	WRHQSAJDUKYOAT-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCOCC1	ZINC000267558126	206143749	/nfs/dbraw/zinc/14/37/49/206143749.db2.gz	ABJBLEFODYHPGX-LRDDRELGSA-N	1	1	323.368	1.886	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCOCC1	ZINC000267558126	206143755	/nfs/dbraw/zinc/14/37/55/206143755.db2.gz	ABJBLEFODYHPGX-LRDDRELGSA-N	1	1	323.368	1.886	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCCn2cc[nH+]c2C)n1	ZINC000338330637	249910497	/nfs/dbraw/zinc/91/04/97/249910497.db2.gz	DXIMRIMRYXLIHZ-UHFFFAOYSA-N	1	1	306.326	1.136	20	5		DDBDMO
C[N@@H+](CCCC(=O)NC(N)=O)CCc1ccccc1[N+](=O)[O-]	ZINC000285213795	218335747	/nfs/dbraw/zinc/33/57/47/218335747.db2.gz	DWQINGGKBPHLIY-UHFFFAOYSA-N	1	1	308.338	1.044	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+](CCN1CCOCC1)C1CC1	ZINC000340718626	251175759	/nfs/dbraw/zinc/17/57/59/251175759.db2.gz	IIOVIHXLSFVGBN-UHFFFAOYSA-N	1	1	305.378	1.891	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+](CCN1CCOCC1)C1CC1	ZINC000340718626	251175761	/nfs/dbraw/zinc/17/57/61/251175761.db2.gz	IIOVIHXLSFVGBN-UHFFFAOYSA-N	1	1	305.378	1.891	20	5		DDBDMO
C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)NC(C)(C)C	ZINC000065208958	184314493	/nfs/dbraw/zinc/31/44/93/184314493.db2.gz	JZKGASUWMXCRPK-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC(=O)NC(C)(C)C	ZINC000065208958	184314494	/nfs/dbraw/zinc/31/44/94/184314494.db2.gz	JZKGASUWMXCRPK-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(N3CC[NH+](C4CC4)CC3)n2)cc1	ZINC000486945258	285106875	/nfs/dbraw/zinc/10/68/75/285106875.db2.gz	YGOGZYGCZIBSGK-UHFFFAOYSA-N	1	1	315.333	1.929	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2cccc(F)c2C1	ZINC000157906003	197225255	/nfs/dbraw/zinc/22/52/55/197225255.db2.gz	NNOLJQHYZLEBST-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2cccc(F)c2C1	ZINC000157906003	197225257	/nfs/dbraw/zinc/22/52/57/197225257.db2.gz	NNOLJQHYZLEBST-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])[C@H](C)C1	ZINC000352660764	285204877	/nfs/dbraw/zinc/20/48/77/285204877.db2.gz	TVIVGBBDAJDQKS-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1[nH+]cc2n1CC[C@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)C2	ZINC000289755940	221203553	/nfs/dbraw/zinc/20/35/53/221203553.db2.gz	IOAFVWCSOWNKSN-ZDUSSCGKSA-N	1	1	314.345	1.979	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cnc(N(C)C)n1C	ZINC000414321914	533223398	/nfs/dbraw/zinc/22/33/98/533223398.db2.gz	DSONXHUTOQYFNL-UHFFFAOYSA-N	1	1	319.365	1.693	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000569041922	304331979	/nfs/dbraw/zinc/33/19/79/304331979.db2.gz	VIUTZWFLIJLKRY-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
COC(=O)CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)C	ZINC000074321280	406908023	/nfs/dbraw/zinc/90/80/23/406908023.db2.gz	UWOXKSHXKXQJMX-UHFFFAOYSA-N	1	1	323.349	1.467	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000078572711	407034548	/nfs/dbraw/zinc/03/45/48/407034548.db2.gz	GGEGAQUAOXFEJY-LLVKDONJSA-N	1	1	313.379	1.215	20	5		DDBDMO
CC1CC[NH+]([C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000050784398	407132781	/nfs/dbraw/zinc/13/27/81/407132781.db2.gz	WOBDKWAJXZGFHD-CQSZACIVSA-N	1	1	317.345	1.959	20	5		DDBDMO
CC[N@@H+](C)CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-]	ZINC000089620196	407142540	/nfs/dbraw/zinc/14/25/40/407142540.db2.gz	GHKVTMIVDOLSGG-UHFFFAOYSA-N	1	1	301.368	1.362	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](n2cccn2)C1	ZINC000090524937	407168248	/nfs/dbraw/zinc/16/82/48/407168248.db2.gz	OUDCIMBOEZKJMN-ZDUSSCGKSA-N	1	1	317.349	1.290	20	5		DDBDMO
CC(=O)N1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000055900361	407208009	/nfs/dbraw/zinc/20/80/09/407208009.db2.gz	GGCYQRRXPLCZFV-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
CC[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000125327009	407385301	/nfs/dbraw/zinc/38/53/01/407385301.db2.gz	FSZXQOYOXCVEAQ-SNVBAGLBSA-N	1	1	321.333	1.994	20	5		DDBDMO
CC[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000125327009	407385302	/nfs/dbraw/zinc/38/53/02/407385302.db2.gz	FSZXQOYOXCVEAQ-SNVBAGLBSA-N	1	1	321.333	1.994	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000125229540	407382717	/nfs/dbraw/zinc/38/27/17/407382717.db2.gz	WCEWVXPVYWNCPV-LLVKDONJSA-N	1	1	309.370	1.275	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C2	ZINC000185775415	407500678	/nfs/dbraw/zinc/50/06/78/407500678.db2.gz	DRHXKDUSUSXYEC-WDEREUQCSA-N	1	1	306.322	1.004	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000271005836	407462712	/nfs/dbraw/zinc/46/27/12/407462712.db2.gz	ZEZYSRVSKDWVEW-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@H]1O	ZINC000271005836	407462717	/nfs/dbraw/zinc/46/27/17/407462717.db2.gz	ZEZYSRVSKDWVEW-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000185820245	407511095	/nfs/dbraw/zinc/51/10/95/407511095.db2.gz	QTDXWVQKRDJVPU-PSASIEDQSA-N	1	1	306.322	1.050	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000114062257	407534484	/nfs/dbraw/zinc/53/44/84/407534484.db2.gz	WZIMANYCLBZJTG-NSHDSACASA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000114062257	407534492	/nfs/dbraw/zinc/53/44/92/407534492.db2.gz	WZIMANYCLBZJTG-NSHDSACASA-N	1	1	323.349	1.583	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000185945516	407546750	/nfs/dbraw/zinc/54/67/50/407546750.db2.gz	NRDTZBQHHSPDQH-OAHLLOKOSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000185945516	407546757	/nfs/dbraw/zinc/54/67/57/407546757.db2.gz	NRDTZBQHHSPDQH-OAHLLOKOSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[NH+](C)C[C@H]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000114199433	407549701	/nfs/dbraw/zinc/54/97/01/407549701.db2.gz	ZAYUULVCSNUWAN-CYBMUJFWSA-N	1	1	320.393	1.807	20	5		DDBDMO
C[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000171248585	407640705	/nfs/dbraw/zinc/64/07/05/407640705.db2.gz	XGOVJWSVOQPHTO-ZDUSSCGKSA-N	1	1	320.393	1.189	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000115437993	407679526	/nfs/dbraw/zinc/67/95/26/407679526.db2.gz	PEUCKJHWAOFQQQ-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1	ZINC000262029675	407717528	/nfs/dbraw/zinc/71/75/28/407717528.db2.gz	JRMBARQKEGORHL-PHIMTYICSA-N	1	1	311.363	1.110	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000117285304	407819651	/nfs/dbraw/zinc/81/96/51/407819651.db2.gz	FGDIXTBUUWOYKO-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000117285304	407819660	/nfs/dbraw/zinc/81/96/60/407819660.db2.gz	FGDIXTBUUWOYKO-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@H]1C	ZINC000117290553	407823962	/nfs/dbraw/zinc/82/39/62/407823962.db2.gz	DAROVFIZKYQWBC-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@H]1C	ZINC000117290553	407823964	/nfs/dbraw/zinc/82/39/64/407823964.db2.gz	DAROVFIZKYQWBC-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
CC[N@@H+](CCNC(=O)C(=O)Nc1cccc([N+](=O)[O-])c1)C(C)C	ZINC000118119474	407895164	/nfs/dbraw/zinc/89/51/64/407895164.db2.gz	ZIMJMCYUDXSSNY-UHFFFAOYSA-N	1	1	322.365	1.380	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Nc1ccc([N+](=O)[O-])c(C)c1	ZINC000153792641	407903452	/nfs/dbraw/zinc/90/34/52/407903452.db2.gz	MIIKYEDQKAFBNF-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000268147752	407913174	/nfs/dbraw/zinc/91/31/74/407913174.db2.gz	FKWCDIKLEIEZFC-OTYXRUKQSA-N	1	1	307.325	1.946	20	5		DDBDMO
CCOC(=O)c1ccnc(NC[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000133474562	407847788	/nfs/dbraw/zinc/84/77/88/407847788.db2.gz	MLHTZLQPTWIMHC-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000245442851	407983628	/nfs/dbraw/zinc/98/36/28/407983628.db2.gz	WQYCPTPBACKFJC-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](CO)C2)c([N+](=O)[O-])c1	ZINC000245442851	407983634	/nfs/dbraw/zinc/98/36/34/407983634.db2.gz	WQYCPTPBACKFJC-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC[N@@H+](C)CCN[C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272525897	407961550	/nfs/dbraw/zinc/96/15/50/407961550.db2.gz	LXQJSOKPHORXSM-HNNXBMFYSA-N	1	1	317.393	1.959	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2)C1CC1	ZINC000272447291	407926724	/nfs/dbraw/zinc/92/67/24/407926724.db2.gz	QCSUVTWCOIYCHV-UHFFFAOYSA-N	1	1	307.306	1.148	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181888821	408049801	/nfs/dbraw/zinc/04/98/01/408049801.db2.gz	KDVUQCYUCGMXRW-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181888821	408049810	/nfs/dbraw/zinc/04/98/10/408049810.db2.gz	KDVUQCYUCGMXRW-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
CSCC[C@@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245450843	407987351	/nfs/dbraw/zinc/98/73/51/407987351.db2.gz	OZRLKRWEXGKIDH-ZYHUDNBSSA-N	1	1	302.400	1.226	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591205	407998230	/nfs/dbraw/zinc/99/82/30/407998230.db2.gz	PMDGNDQFXFRXSX-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000272591205	407998238	/nfs/dbraw/zinc/99/82/38/407998238.db2.gz	PMDGNDQFXFRXSX-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000182325360	408125215	/nfs/dbraw/zinc/12/52/15/408125215.db2.gz	VCZWPRXSMCASAO-WFASDCNBSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000154753738	408078997	/nfs/dbraw/zinc/07/89/97/408078997.db2.gz	FZDURLJKZVVNKR-UHFFFAOYSA-N	1	1	302.334	1.825	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](C[C@H](C)O)CC1	ZINC000189743327	408097513	/nfs/dbraw/zinc/09/75/13/408097513.db2.gz	OFCIXADKQITKDJ-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(O)CCCC1	ZINC000182242309	408103758	/nfs/dbraw/zinc/10/37/58/408103758.db2.gz	MXDVAMIGJIGSGO-CYBMUJFWSA-N	1	1	324.377	1.571	20	5		DDBDMO
CCN1CCC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000190222091	408194582	/nfs/dbraw/zinc/19/45/82/408194582.db2.gz	INKBFDGUPAPIJF-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
CCN1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000190222091	408194587	/nfs/dbraw/zinc/19/45/87/408194587.db2.gz	INKBFDGUPAPIJF-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)[C@@H]2CO)cccc1[N+](=O)[O-]	ZINC000190419993	408239144	/nfs/dbraw/zinc/23/91/44/408239144.db2.gz	DCRGXLTXMQCLSY-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC1CCOCC1	ZINC000156159878	408239800	/nfs/dbraw/zinc/23/98/00/408239800.db2.gz	ZYIARUVATJWEHK-UHFFFAOYSA-N	1	1	307.350	1.552	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]1CO	ZINC000190364260	408229030	/nfs/dbraw/zinc/22/90/30/408229030.db2.gz	NHKDPQYNPIALBG-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]1CO	ZINC000190364260	408229036	/nfs/dbraw/zinc/22/90/36/408229036.db2.gz	NHKDPQYNPIALBG-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
CSCC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000138214576	162129235	/nfs/dbraw/zinc/12/92/35/162129235.db2.gz	SCYMSNAZCNQZPG-UHFFFAOYSA-N	1	1	309.391	1.779	20	5		DDBDMO
CSCC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000138214576	162129238	/nfs/dbraw/zinc/12/92/38/162129238.db2.gz	SCYMSNAZCNQZPG-UHFFFAOYSA-N	1	1	309.391	1.779	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000183182455	408345806	/nfs/dbraw/zinc/34/58/06/408345806.db2.gz	UVZJBTZZAIWLEJ-PWSUYJOCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269621938	408363583	/nfs/dbraw/zinc/36/35/83/408363583.db2.gz	BJCXZGMPKCVCEE-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000269621938	408363589	/nfs/dbraw/zinc/36/35/89/408363589.db2.gz	BJCXZGMPKCVCEE-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000247511976	408484757	/nfs/dbraw/zinc/48/47/57/408484757.db2.gz	VTHTYBKRYNZQCH-AAEUAGOBSA-N	1	1	323.397	1.431	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1cc([N+](=O)[O-])c(C)cc1C	ZINC000191897388	408505639	/nfs/dbraw/zinc/50/56/39/408505639.db2.gz	DQFRQXHLKSDJBE-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)(CO)CO	ZINC000270366115	408505923	/nfs/dbraw/zinc/50/59/23/408505923.db2.gz	ZJESQPWRPJOZEJ-UHFFFAOYSA-N	1	1	309.322	1.159	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)(CO)CO	ZINC000270366115	408505926	/nfs/dbraw/zinc/50/59/26/408505926.db2.gz	ZJESQPWRPJOZEJ-UHFFFAOYSA-N	1	1	309.322	1.159	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2	ZINC000274868171	408562880	/nfs/dbraw/zinc/56/28/80/408562880.db2.gz	DDMVXWIBVGHJIZ-UHFFFAOYSA-N	1	1	316.317	1.115	20	5		DDBDMO
C[C@@H]1COC[C@@H](C)[NH+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248475571	408577333	/nfs/dbraw/zinc/57/73/33/408577333.db2.gz	XUDAERMVVUVILN-JHJVBQTASA-N	1	1	310.350	1.444	20	5		DDBDMO
CCOCC[NH+]1CCN(c2c([N+](=O)[O-])c(C)nn2CC)CC1	ZINC000192568308	408611247	/nfs/dbraw/zinc/61/12/47/408611247.db2.gz	WSIFITUHAVMSKK-UHFFFAOYSA-N	1	1	311.386	1.278	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000192690353	408633151	/nfs/dbraw/zinc/63/31/51/408633151.db2.gz	CVCKGRKQBODRJU-QWRGUYRKSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CO)C1	ZINC000249332382	408716240	/nfs/dbraw/zinc/71/62/40/408716240.db2.gz	XACGOWKGCQCUCE-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](CO)C1	ZINC000249332382	408716244	/nfs/dbraw/zinc/71/62/44/408716244.db2.gz	XACGOWKGCQCUCE-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@H]1CO	ZINC000248997300	408674661	/nfs/dbraw/zinc/67/46/61/408674661.db2.gz	YCBSFIUNHOCDRG-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000162187934	408676207	/nfs/dbraw/zinc/67/62/07/408676207.db2.gz	ZXVLOKSGHZPPDO-LBPRGKRZSA-N	1	1	323.397	1.713	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1O	ZINC000270839069	408701851	/nfs/dbraw/zinc/70/18/51/408701851.db2.gz	DUBCZFTUOQZMBS-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@](C)(O)C1	ZINC000177973334	408748671	/nfs/dbraw/zinc/74/86/71/408748671.db2.gz	PZHIEVNLIZETFC-OAHLLOKOSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1	ZINC000185144606	408769598	/nfs/dbraw/zinc/76/95/98/408769598.db2.gz	VJKLRYLQCFULDH-SNVBAGLBSA-N	1	1	311.313	1.783	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1	ZINC000185144606	408769600	/nfs/dbraw/zinc/76/96/00/408769600.db2.gz	VJKLRYLQCFULDH-SNVBAGLBSA-N	1	1	311.313	1.783	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1	ZINC000285924746	408890406	/nfs/dbraw/zinc/89/04/06/408890406.db2.gz	UPXWZPNTQUWKED-UONOGXRCSA-N	1	1	323.324	1.279	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2ccccc2[N+](=O)[O-])CCCO1	ZINC000277343466	408922993	/nfs/dbraw/zinc/92/29/93/408922993.db2.gz	BDMHSISYKDYSSX-ZDUSSCGKSA-N	1	1	321.377	1.826	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](CCO)[C@@H](C)C1	ZINC000188786929	163068974	/nfs/dbraw/zinc/06/89/74/163068974.db2.gz	KZBKVCKRRBGXIR-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000188786929	163068978	/nfs/dbraw/zinc/06/89/78/163068978.db2.gz	KZBKVCKRRBGXIR-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000292099538	408980754	/nfs/dbraw/zinc/98/07/54/408980754.db2.gz	HUFMFAYEKOQQBW-GFCCVEGCSA-N	1	1	312.366	1.691	20	5		DDBDMO
CCC[C@]1(C(=O)OCC)CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000277920423	409034882	/nfs/dbraw/zinc/03/48/82/409034882.db2.gz	XYDKHAHFGNZYAC-OAHLLOKOSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCC[C@]1(C(=O)OCC)CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000277920423	409034884	/nfs/dbraw/zinc/03/48/84/409034884.db2.gz	XYDKHAHFGNZYAC-OAHLLOKOSA-N	1	1	324.381	1.989	20	5		DDBDMO
Cc1nc(N(C)CC[N@@H+]2CCOC(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000278949609	409119342	/nfs/dbraw/zinc/11/93/42/409119342.db2.gz	XBCDDLNEALADFL-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
Cc1nc(N(C)CC[N@H+]2CCOC(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000278949609	409119344	/nfs/dbraw/zinc/11/93/44/409119344.db2.gz	XBCDDLNEALADFL-UHFFFAOYSA-N	1	1	308.382	1.845	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC3(C2)Oc2ccccc2O3)c1	ZINC000289086764	409217067	/nfs/dbraw/zinc/21/70/67/409217067.db2.gz	UBGJTELBDYJQKR-UHFFFAOYSA-N	1	1	316.317	1.665	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC3(C2)Oc2ccccc2O3)c1	ZINC000289086764	409217069	/nfs/dbraw/zinc/21/70/69/409217069.db2.gz	UBGJTELBDYJQKR-UHFFFAOYSA-N	1	1	316.317	1.665	20	5		DDBDMO
O=c1nc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)[nH][nH]1	ZINC000289452640	409275507	/nfs/dbraw/zinc/27/55/07/409275507.db2.gz	PFGXZJDBPWYVIA-NSHDSACASA-N	1	1	303.322	1.386	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+]3CCC[C@H]3C2)c1	ZINC000284201015	409295510	/nfs/dbraw/zinc/29/55/10/409295510.db2.gz	ZOQJEOBCJYYYOO-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCCC[N@H+](C)CCN(C)C	ZINC000290203697	409321032	/nfs/dbraw/zinc/32/10/32/409321032.db2.gz	SUQAZPBAKBECCU-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCCCN(C)CC[NH+](C)C	ZINC000290203697	409321036	/nfs/dbraw/zinc/32/10/36/409321036.db2.gz	SUQAZPBAKBECCU-UHFFFAOYSA-N	1	1	322.409	1.517	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCc1c[nH+]c(N(C)C)n1C	ZINC000280661570	409397943	/nfs/dbraw/zinc/39/79/43/409397943.db2.gz	GQSRZPWKRXXWRU-UHFFFAOYSA-N	1	1	307.358	1.531	20	5		DDBDMO
C[C@@H]([NH2+]CCS(=O)(=O)N(C)C)c1ccccc1[N+](=O)[O-]	ZINC000230993719	287029685	/nfs/dbraw/zinc/02/96/85/287029685.db2.gz	GLSKUFOMJKRVDO-SNVBAGLBSA-N	1	1	301.368	1.137	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000317075300	164025532	/nfs/dbraw/zinc/02/55/32/164025532.db2.gz	ZCOPUBFPRKJFTO-MNOVXSKESA-N	1	1	304.350	1.534	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)cc(F)cc1[N+](=O)[O-]	ZINC000324549125	164051179	/nfs/dbraw/zinc/05/11/79/164051179.db2.gz	YAEUHGAPYHMVND-QWRGUYRKSA-N	1	1	322.340	1.673	20	5		DDBDMO
Cc1cn(C[C@@H](O)C[N@H+]2CCc3ccccc3C2)nc1[N+](=O)[O-]	ZINC000362330339	164155918	/nfs/dbraw/zinc/15/59/18/164155918.db2.gz	PSJLOTRDHNHEIG-HNNXBMFYSA-N	1	1	316.361	1.519	20	5		DDBDMO
C[C@@H]1CCOCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000373280174	164169243	/nfs/dbraw/zinc/16/92/43/164169243.db2.gz	JMGOGFHUOUVIAQ-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000408128957	164236408	/nfs/dbraw/zinc/23/64/08/164236408.db2.gz	MLEWTVLSYRLYIP-GXSJLCMTSA-N	1	1	309.370	1.049	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCC[N@H+]1C	ZINC000345075455	409616735	/nfs/dbraw/zinc/61/67/35/409616735.db2.gz	ODSZVTPOHWWGEL-CQSZACIVSA-N	1	1	320.393	1.873	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000354074615	409630983	/nfs/dbraw/zinc/63/09/83/409630983.db2.gz	IMSCUVGKAAJTHM-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000356867441	409678283	/nfs/dbraw/zinc/67/82/83/409678283.db2.gz	YRBZYJRZROCSEU-GHMZBOCLSA-N	1	1	309.341	1.827	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2ccc([N+](=O)[O-])n2)C[C@H]1C	ZINC000354379692	409811118	/nfs/dbraw/zinc/81/11/18/409811118.db2.gz	CHBINFKHNOOXFL-VXGBXAGGSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@H]1CC[N@H+](C)CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354617544	409971578	/nfs/dbraw/zinc/97/15/78/409971578.db2.gz	UTUITKSJCWQDOB-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000354617544	409971586	/nfs/dbraw/zinc/97/15/86/409971586.db2.gz	UTUITKSJCWQDOB-NSHDSACASA-N	1	1	313.379	1.310	20	5		DDBDMO
COc1ccc(CN2CCO[C@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000332321991	410065658	/nfs/dbraw/zinc/06/56/58/410065658.db2.gz	RORRSKDNHWUOAB-ZBFHGGJFSA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1ccc(CN2CCO[C@@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000332321985	410066166	/nfs/dbraw/zinc/06/61/66/410066166.db2.gz	RORRSKDNHWUOAB-GOEBONIOSA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670372	410067663	/nfs/dbraw/zinc/06/76/63/410067663.db2.gz	UOUSVWTYWOMCSV-HUBLWGQQSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670372	410067668	/nfs/dbraw/zinc/06/76/68/410067668.db2.gz	UOUSVWTYWOMCSV-HUBLWGQQSA-N	1	1	319.361	1.689	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000343034849	410090350	/nfs/dbraw/zinc/09/03/50/410090350.db2.gz	BHSHHDXRYNXIFA-LLVKDONJSA-N	1	1	307.350	1.300	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000343034849	410090355	/nfs/dbraw/zinc/09/03/55/410090355.db2.gz	BHSHHDXRYNXIFA-LLVKDONJSA-N	1	1	307.350	1.300	20	5		DDBDMO
O=C1[C@@H]([N@H+]2CCC[C@@H](O)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000339782695	410459832	/nfs/dbraw/zinc/45/98/32/410459832.db2.gz	HESNXNCXLGUGCK-CABCVRRESA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358407955	410462682	/nfs/dbraw/zinc/46/26/82/410462682.db2.gz	GCOLWDDGDUCFRG-BMIGLBTASA-N	1	1	321.352	1.875	20	5		DDBDMO
Cn1c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)ccc1[N+](=O)[O-]	ZINC000347319733	410466982	/nfs/dbraw/zinc/46/69/82/410466982.db2.gz	OKCOCRYHROZTGE-LBPRGKRZSA-N	1	1	306.366	1.680	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000343414689	410431850	/nfs/dbraw/zinc/43/18/50/410431850.db2.gz	BJRXUVVWMDTUDA-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000343414689	410431856	/nfs/dbraw/zinc/43/18/56/410431856.db2.gz	BJRXUVVWMDTUDA-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@H](C(N)=O)O[C@@H](C)C1	ZINC000347358665	410493432	/nfs/dbraw/zinc/49/34/32/410493432.db2.gz	LHFYVTZGTRSOBY-QZIOEJFTSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](C(N)=O)O[C@@H](C)C1	ZINC000347358665	410493434	/nfs/dbraw/zinc/49/34/34/410493434.db2.gz	LHFYVTZGTRSOBY-QZIOEJFTSA-N	1	1	319.361	1.573	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2CCC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000355610912	410605704	/nfs/dbraw/zinc/60/57/04/410605704.db2.gz	UIAMGJMTEBSGNE-GFCCVEGCSA-N	1	1	324.333	1.103	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CCC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000355610912	410605709	/nfs/dbraw/zinc/60/57/09/410605709.db2.gz	UIAMGJMTEBSGNE-GFCCVEGCSA-N	1	1	324.333	1.103	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2	ZINC000301137276	410664555	/nfs/dbraw/zinc/66/45/55/410664555.db2.gz	BUZYAUIQGGPDOA-UHFFFAOYSA-N	1	1	308.338	1.678	20	5		DDBDMO
COc1cncc(C[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000343775837	410689905	/nfs/dbraw/zinc/68/99/05/410689905.db2.gz	WNYBVJYKZHIJFD-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1cncc(C[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)c1	ZINC000343775837	410689908	/nfs/dbraw/zinc/68/99/08/410689908.db2.gz	WNYBVJYKZHIJFD-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)[N@H+](C)C1	ZINC000330514258	410743056	/nfs/dbraw/zinc/74/30/56/410743056.db2.gz	DLYDTRVTTYFQOA-SWHYSGLUSA-N	1	1	307.350	1.491	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000330514258	410743061	/nfs/dbraw/zinc/74/30/61/410743061.db2.gz	DLYDTRVTTYFQOA-SWHYSGLUSA-N	1	1	307.350	1.491	20	5		DDBDMO
Cc1ccnc(N2CCN([C@@H]3CCC[N@H+](C)C3)CC2)c1[N+](=O)[O-]	ZINC000301250332	410684538	/nfs/dbraw/zinc/68/45/38/410684538.db2.gz	BVLXVJYAUHBORM-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000330575849	410790340	/nfs/dbraw/zinc/79/03/40/410790340.db2.gz	GEEHLZVIRMOIPO-QWHCGFSZSA-N	1	1	320.393	1.866	20	5		DDBDMO
CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347928159	410795536	/nfs/dbraw/zinc/79/55/36/410795536.db2.gz	UUJBQVVWBLMHSQ-LLVKDONJSA-N	1	1	322.340	1.625	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCC[C@@H](C)C1	ZINC000330586038	410801311	/nfs/dbraw/zinc/80/13/11/410801311.db2.gz	SIRJJKNKNLOYKY-NEPJUHHUSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343851578	410748509	/nfs/dbraw/zinc/74/85/09/410748509.db2.gz	DMPRQEQLFFAHNJ-JSGCOSHPSA-N	1	1	320.393	1.919	20	5		DDBDMO
CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@@H]1C[NH+]2CCC1CC2	ZINC000356103784	410836649	/nfs/dbraw/zinc/83/66/49/410836649.db2.gz	VKLUAJXMHOFYOI-CQSZACIVSA-N	1	1	305.334	1.467	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)[C@H](C)C2)c([N+](=O)[O-])cc1F	ZINC000302382406	410842976	/nfs/dbraw/zinc/84/29/76/410842976.db2.gz	GVEVIJIIFGMIES-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)[C@H](C)C2)c([N+](=O)[O-])cc1F	ZINC000302382406	410842980	/nfs/dbraw/zinc/84/29/80/410842980.db2.gz	GVEVIJIIFGMIES-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000359766104	410862702	/nfs/dbraw/zinc/86/27/02/410862702.db2.gz	SMOIAJAEBMRKGP-SNVBAGLBSA-N	1	1	310.354	1.546	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000302823497	410869879	/nfs/dbraw/zinc/86/98/79/410869879.db2.gz	UYTOVVBFFMROMS-GFCCVEGCSA-N	1	1	309.341	1.892	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000348517814	410996060	/nfs/dbraw/zinc/99/60/60/410996060.db2.gz	YCAPDEDQGWVHGM-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000348517814	410996066	/nfs/dbraw/zinc/99/60/66/410996066.db2.gz	YCAPDEDQGWVHGM-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)c1[N+](=O)[O-]	ZINC000348517814	410996070	/nfs/dbraw/zinc/99/60/70/410996070.db2.gz	YCAPDEDQGWVHGM-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC(O)C1	ZINC000353519815	411042328	/nfs/dbraw/zinc/04/23/28/411042328.db2.gz	ODUSEZQRAXVRPC-UHFFFAOYSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC(O)C1	ZINC000353519815	411042332	/nfs/dbraw/zinc/04/23/32/411042332.db2.gz	ODUSEZQRAXVRPC-UHFFFAOYSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1Cc1c(F)cccc1[N+](=O)[O-]	ZINC000419338957	226123892	/nfs/dbraw/zinc/12/38/92/226123892.db2.gz	ZPGZCUBKBBVYRX-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H]2CCC[C@H]2[C@H]1C(N)=O	ZINC000373737044	418454511	/nfs/dbraw/zinc/45/45/11/418454511.db2.gz	FMRWXBWBEOBUHG-CFVMTHIKSA-N	1	1	303.362	1.989	20	5		DDBDMO
COc1ccc(NC(=O)c2cc(C[NH+](C)C)on2)cc1[N+](=O)[O-]	ZINC000360735436	418503792	/nfs/dbraw/zinc/50/37/92/418503792.db2.gz	DNFDHHGETVYFLH-UHFFFAOYSA-N	1	1	320.305	1.905	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290507292	418576718	/nfs/dbraw/zinc/57/67/18/418576718.db2.gz	LGIHTFAFNWQDHY-SNVBAGLBSA-N	1	1	307.354	1.375	20	5		DDBDMO
Cc1nn(C)c(C)c1C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375392743	418633519	/nfs/dbraw/zinc/63/35/19/418633519.db2.gz	OTHYUGKJENZTFT-CYBMUJFWSA-N	1	1	318.381	1.979	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000368238175	418708165	/nfs/dbraw/zinc/70/81/65/418708165.db2.gz	BLLGAWVFIYEJSD-ZYHUDNBSSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000368238175	418708167	/nfs/dbraw/zinc/70/81/67/418708167.db2.gz	BLLGAWVFIYEJSD-ZYHUDNBSSA-N	1	1	309.753	1.816	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H]3C(=O)NC[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000368067866	418684371	/nfs/dbraw/zinc/68/43/71/418684371.db2.gz	BSONQEBLQMMIQP-GHMZBOCLSA-N	1	1	323.324	1.310	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000364468281	418777918	/nfs/dbraw/zinc/77/79/18/418777918.db2.gz	ZOLKBZIFPFNPDL-KGLIPLIRSA-N	1	1	305.334	1.188	20	5		DDBDMO
CCCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000411170664	418875635	/nfs/dbraw/zinc/87/56/35/418875635.db2.gz	CCEOLHJQAUJDKM-UHFFFAOYSA-N	1	1	322.365	1.511	20	5		DDBDMO
O=C(CC[N@H+]1C[C@H]2CC[C@@H](C1)O2)Nc1ccccc1[N+](=O)[O-]	ZINC000372626879	418888774	/nfs/dbraw/zinc/88/87/74/418888774.db2.gz	KUTJNGDWAFGQQR-TXEJJXNPSA-N	1	1	305.334	1.787	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2CC[C@@H](C1)O2)Nc1ccccc1[N+](=O)[O-]	ZINC000372626879	418888777	/nfs/dbraw/zinc/88/87/77/418888777.db2.gz	KUTJNGDWAFGQQR-TXEJJXNPSA-N	1	1	305.334	1.787	20	5		DDBDMO
C[C@H]1C[C@@H](CO)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000420930639	419361962	/nfs/dbraw/zinc/36/19/62/419361962.db2.gz	CRRPVFNDTKNSIB-QWHCGFSZSA-N	1	1	321.377	1.874	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)[C@@H]1CCCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000426226207	419411028	/nfs/dbraw/zinc/41/10/28/419411028.db2.gz	GSXDLHZYGMWMIO-HUUCEWRRSA-N	1	1	321.377	1.793	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000425974224	419374826	/nfs/dbraw/zinc/37/48/26/419374826.db2.gz	LGIUCRBQQWZHIJ-GHMZBOCLSA-N	1	1	310.350	1.815	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@]23CCOC3)c1	ZINC000421041761	419464986	/nfs/dbraw/zinc/46/49/86/419464986.db2.gz	YPJDGCDNRPXWOY-HIFRSBDPSA-N	1	1	308.334	1.199	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O	ZINC000412995633	419765542	/nfs/dbraw/zinc/76/55/42/419765542.db2.gz	ZYKFKHWZSKVALH-LLVKDONJSA-N	1	1	322.365	1.118	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC000427708104	419718615	/nfs/dbraw/zinc/71/86/15/419718615.db2.gz	WBYBKPDREIAPCB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)[C@H](C)[C@H]1C	ZINC000427708104	419718620	/nfs/dbraw/zinc/71/86/20/419718620.db2.gz	WBYBKPDREIAPCB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C1	ZINC000428441565	419868464	/nfs/dbraw/zinc/86/84/64/419868464.db2.gz	WQAASDVLUJKEDT-HNNXBMFYSA-N	1	1	310.350	1.959	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000433748450	420254210	/nfs/dbraw/zinc/25/42/10/420254210.db2.gz	LCBQWOIFOLYZEF-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000433748450	420254214	/nfs/dbraw/zinc/25/42/14/420254214.db2.gz	LCBQWOIFOLYZEF-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[N@@H+](C)CC[C@H]2C)c1[N+](=O)[O-]	ZINC000433748450	420254221	/nfs/dbraw/zinc/25/42/21/420254221.db2.gz	LCBQWOIFOLYZEF-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H](C[NH3+])C1CC1	ZINC000423949473	420280137	/nfs/dbraw/zinc/28/01/37/420280137.db2.gz	MVHGOFHWGJPDBL-LBPRGKRZSA-N	1	1	303.322	1.280	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000425482001	420395629	/nfs/dbraw/zinc/39/56/29/420395629.db2.gz	QOPBZUXPMDCMDY-AWEZNQCLSA-N	1	1	308.382	1.029	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000456980611	420579885	/nfs/dbraw/zinc/57/98/85/420579885.db2.gz	DDCGZWPXJZWXSV-ZDUSSCGKSA-N	1	1	300.318	1.710	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000454283926	420830296	/nfs/dbraw/zinc/83/02/96/420830296.db2.gz	XOZCSZPYNTVNTI-OCCSQVGLSA-N	1	1	304.350	1.440	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000493392994	420836356	/nfs/dbraw/zinc/83/63/56/420836356.db2.gz	RGDQNIDBGATEGH-IRBQFCFKSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000493392994	420836359	/nfs/dbraw/zinc/83/63/59/420836359.db2.gz	RGDQNIDBGATEGH-IRBQFCFKSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000449576332	421030303	/nfs/dbraw/zinc/03/03/03/421030303.db2.gz	RTGBMYCVDZHSQW-CYBMUJFWSA-N	1	1	314.292	1.090	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456019964	421089567	/nfs/dbraw/zinc/08/95/67/421089567.db2.gz	IOKUWNFUAOTOEZ-BXKDBHETSA-N	1	1	319.365	1.244	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C/C=C\c1ccccc1[N+](=O)[O-]	ZINC000449786393	421082154	/nfs/dbraw/zinc/08/21/54/421082154.db2.gz	NMYODXAENJIQKC-KXQLTZBTSA-N	1	1	305.378	1.606	20	5		DDBDMO
COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCOC1	ZINC000490075668	421188165	/nfs/dbraw/zinc/18/81/65/421188165.db2.gz	YSMONSYUAYDLQL-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCOC1	ZINC000490075668	421188166	/nfs/dbraw/zinc/18/81/66/421188166.db2.gz	YSMONSYUAYDLQL-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000525727207	421298725	/nfs/dbraw/zinc/29/87/25/421298725.db2.gz	LBNDHBZBLDHKDG-GFCCVEGCSA-N	1	1	308.382	1.737	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000548414115	421435376	/nfs/dbraw/zinc/43/53/76/421435376.db2.gz	PRXHXPGSJLVGKK-LLVKDONJSA-N	1	1	321.381	1.422	20	5		DDBDMO
Cc1cc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)no1	ZINC000552836444	421595520	/nfs/dbraw/zinc/59/55/20/421595520.db2.gz	CCWSGBVJIBSSDX-CYBMUJFWSA-N	1	1	307.306	1.421	20	5		DDBDMO
COCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])c(OC(C)C)n1	ZINC000567915531	421616693	/nfs/dbraw/zinc/61/66/93/421616693.db2.gz	VSWGQARBZQNDHE-UHFFFAOYSA-N	1	1	312.370	1.767	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC000572185641	421767983	/nfs/dbraw/zinc/76/79/83/421767983.db2.gz	VEGHCHGOZMSKAC-NSHDSACASA-N	1	1	304.354	1.780	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000557572542	421777179	/nfs/dbraw/zinc/77/71/79/421777179.db2.gz	WHMFRNVJGNVYKA-LLVKDONJSA-N	1	1	322.365	1.839	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CC[C@@H](C)C1	ZINC000572425039	421786631	/nfs/dbraw/zinc/78/66/31/421786631.db2.gz	GLWAAVQQFGRMAY-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
COc1ccc(CC(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000559320868	421832814	/nfs/dbraw/zinc/83/28/14/421832814.db2.gz	PEQZPSRRGIIQBX-TXEJJXNPSA-N	1	1	321.377	1.697	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000345913761	272363307	/nfs/dbraw/zinc/36/33/07/272363307.db2.gz	WANITMJPBZLHSB-GHMZBOCLSA-N	1	1	309.370	1.041	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+](C3CCC3)CC2)n1	ZINC000287347657	274004239	/nfs/dbraw/zinc/00/42/39/274004239.db2.gz	NGAPUKYWENYSIT-UHFFFAOYSA-N	1	1	320.349	1.451	20	5		DDBDMO
COC(=O)c1cnc(N(C)CC[N@@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000189390498	274008160	/nfs/dbraw/zinc/00/81/60/274008160.db2.gz	BCLLVCJTQWEIPT-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
CCC[C@@H]1CN(c2ncc([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC000273948037	276031700	/nfs/dbraw/zinc/03/17/00/276031700.db2.gz	MKHZVNSZCZMZOZ-GFCCVEGCSA-N	1	1	309.370	1.322	20	5		DDBDMO
C[NH2+]Cc1noc(-c2cccc([N+](=O)[O-])c2N2CCOCC2)n1	ZINC000414641831	277288227	/nfs/dbraw/zinc/28/82/27/277288227.db2.gz	KFSPWAAVGQBGTD-UHFFFAOYSA-N	1	1	319.321	1.201	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCC(F)(F)C[NH3+]	ZINC000414939617	279247541	/nfs/dbraw/zinc/24/75/41/279247541.db2.gz	ZCSWEDVFXVTHMF-SECBINFHSA-N	1	1	316.308	1.496	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CN1CCN(C)CC1	ZINC000449122701	279382788	/nfs/dbraw/zinc/38/27/88/279382788.db2.gz	MKUYDOOLXQNXFS-HUUCEWRRSA-N	1	1	320.437	1.751	20	5		DDBDMO
CC[N@@H+](CCNC(=O)NCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000102006553	281047073	/nfs/dbraw/zinc/04/70/73/281047073.db2.gz	AGUCQQWPUDWSCC-UHFFFAOYSA-N	1	1	306.366	1.878	20	5		DDBDMO
O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000363305887	300248592	/nfs/dbraw/zinc/24/85/92/300248592.db2.gz	UNPPXEBNRRDBIT-JKSUJKDBSA-N	1	1	317.389	1.475	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000364350384	300382141	/nfs/dbraw/zinc/38/21/41/300382141.db2.gz	XTEZEFSDJIXDSR-HUUCEWRRSA-N	1	1	321.381	1.267	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000368596675	301061486	/nfs/dbraw/zinc/06/14/86/301061486.db2.gz	VVHQXTMTTFQXKN-SWLSCSKDSA-N	1	1	303.362	1.690	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@@H](N3CCNC3=O)C2)cccc1[N+](=O)[O-]	ZINC000368804837	301090128	/nfs/dbraw/zinc/09/01/28/301090128.db2.gz	JBOBJSACXYEBFU-CQSZACIVSA-N	1	1	318.377	1.893	20	5		DDBDMO
CN(C(=O)[C@H]1CC1[N+](=O)[O-])C1CC[NH+](Cc2ccncc2)CC1	ZINC000368818426	301092497	/nfs/dbraw/zinc/09/24/97/301092497.db2.gz	UIKMNBHQDOIQGO-GJZGRUSLSA-N	1	1	318.377	1.170	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCO[C@H]3CC[N@H+](C)C[C@@H]32)n1	ZINC000408028736	301204619	/nfs/dbraw/zinc/20/46/19/301204619.db2.gz	FMMSCEYJTUAKGG-STQMWFEESA-N	1	1	306.366	1.516	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000377495282	302185673	/nfs/dbraw/zinc/18/56/73/302185673.db2.gz	XOEWUGZNLFBFSR-NSHDSACASA-N	1	1	320.349	1.121	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc2c(c1)OCCO2	ZINC000530865543	303217821	/nfs/dbraw/zinc/21/78/21/303217821.db2.gz	QHDYNFWKSKGVAX-UHFFFAOYSA-N	1	1	318.333	1.695	20	5		DDBDMO
COC(C)(C)C[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000533344610	303316186	/nfs/dbraw/zinc/31/61/86/303316186.db2.gz	BLTCGFYPASEZFV-UHFFFAOYSA-N	1	1	309.366	1.914	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000533344610	303316188	/nfs/dbraw/zinc/31/61/88/303316188.db2.gz	BLTCGFYPASEZFV-UHFFFAOYSA-N	1	1	309.366	1.914	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C[N@@H+]1C	ZINC000534349515	303332851	/nfs/dbraw/zinc/33/28/51/303332851.db2.gz	SMQHUBFECGTETN-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C[N@H+]1C	ZINC000534349515	303332853	/nfs/dbraw/zinc/33/28/53/303332853.db2.gz	SMQHUBFECGTETN-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000366687347	307079691	/nfs/dbraw/zinc/07/96/91/307079691.db2.gz	MXNLFEOLZDSWJE-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC	ZINC000369683106	307126705	/nfs/dbraw/zinc/12/67/05/307126705.db2.gz	IXKOHSMTTVHZFX-INIZCTEOSA-N	1	1	322.361	1.959	20	5		DDBDMO
C[C@@H]1CN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC[N@@H+]1CCO	ZINC000576579709	308324417	/nfs/dbraw/zinc/32/44/17/308324417.db2.gz	JYCLYESVUJGCPL-GFCCVEGCSA-N	1	1	320.393	1.371	20	5		DDBDMO
C[C@@H]1CN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC[N@H+]1CCO	ZINC000576579709	308324418	/nfs/dbraw/zinc/32/44/18/308324418.db2.gz	JYCLYESVUJGCPL-GFCCVEGCSA-N	1	1	320.393	1.371	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)n1	ZINC000576762992	308338163	/nfs/dbraw/zinc/33/81/63/308338163.db2.gz	KBQAZJFDCIZIRV-SNVBAGLBSA-N	1	1	307.354	1.025	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nc(-c3ccccc3[N+](=O)[O-])oc2=O)C1	ZINC000577371156	308382894	/nfs/dbraw/zinc/38/28/94/308382894.db2.gz	QCUXFOWPIWFNHI-SNVBAGLBSA-N	1	1	304.306	1.363	20	5		DDBDMO
C[C@@H](O)[C@H]1C[C@H](C)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000443349075	533859263	/nfs/dbraw/zinc/85/92/63/533859263.db2.gz	SYPVCIUBNNRCJE-YRGRVCCFSA-N	1	1	309.366	1.238	20	5		DDBDMO
C[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000305770324	534055764	/nfs/dbraw/zinc/05/57/64/534055764.db2.gz	XINRGLZAGHATTP-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000305770324	534055769	/nfs/dbraw/zinc/05/57/69/534055769.db2.gz	XINRGLZAGHATTP-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC[N@H+]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000158221122	521612607	/nfs/dbraw/zinc/61/26/07/521612607.db2.gz	PAHOJLFBLMVWQB-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
CCN1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000158221122	521612610	/nfs/dbraw/zinc/61/26/10/521612610.db2.gz	PAHOJLFBLMVWQB-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
CCN1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000158221122	521612611	/nfs/dbraw/zinc/61/26/11/521612611.db2.gz	PAHOJLFBLMVWQB-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000154812936	525086591	/nfs/dbraw/zinc/08/65/91/525086591.db2.gz	WJTZSBJHICPBPC-BXUZGUMPSA-N	1	1	321.352	1.972	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452183359	527726841	/nfs/dbraw/zinc/72/68/41/527726841.db2.gz	OWPYOEKBDNRZOK-SMDDNHRTSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452183359	527726848	/nfs/dbraw/zinc/72/68/48/527726848.db2.gz	OWPYOEKBDNRZOK-SMDDNHRTSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC(C)[C@H](O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293086721	527732577	/nfs/dbraw/zinc/73/25/77/527732577.db2.gz	KCUWDZMBSDALJX-OAHLLOKOSA-N	1	1	321.377	1.370	20	5		DDBDMO
C[C@@H](CNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@@H+](C)C1CC1	ZINC000736027085	598500844	/nfs/dbraw/zinc/50/08/44/598500844.db2.gz	XABOFAGOOXGYJF-QMMMGPOBSA-N	1	1	318.341	1.065	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000746882330	700043333	/nfs/dbraw/zinc/04/33/33/700043333.db2.gz	LQOUHRLHVGCPGK-JTQLQIEISA-N	1	1	323.324	1.466	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cccc([N+](=O)[O-])c1Cl	ZINC000160425891	697317436	/nfs/dbraw/zinc/31/74/36/697317436.db2.gz	HEEPGAQGWSHIOA-UHFFFAOYSA-N	1	1	315.757	1.556	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000178776629	697428765	/nfs/dbraw/zinc/42/87/65/697428765.db2.gz	ZGKDOSZCIDNMLF-GFCCVEGCSA-N	1	1	318.333	1.930	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000178776629	697428766	/nfs/dbraw/zinc/42/87/66/697428766.db2.gz	ZGKDOSZCIDNMLF-GFCCVEGCSA-N	1	1	318.333	1.930	20	5		DDBDMO
Cc1oncc1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985425783	697508518	/nfs/dbraw/zinc/50/85/18/697508518.db2.gz	IYACQRDCGGKAEV-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1oncc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985425783	697508520	/nfs/dbraw/zinc/50/85/20/697508520.db2.gz	IYACQRDCGGKAEV-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1oncc1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985425783	697508521	/nfs/dbraw/zinc/50/85/21/697508521.db2.gz	IYACQRDCGGKAEV-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1nn(C[NH+]2CCC3(CCO3)CC2)c2ncc([N+](=O)[O-])cc12	ZINC000799956853	700177761	/nfs/dbraw/zinc/17/77/61/700177761.db2.gz	WOXWRSALWXWZST-UHFFFAOYSA-N	1	1	317.349	1.860	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2nnc3n2CCCC3)cc1	ZINC000776280131	698092029	/nfs/dbraw/zinc/09/20/29/698092029.db2.gz	ZXUZBOALSUPMFS-CYBMUJFWSA-N	1	1	317.349	1.346	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@@H]2C2OCCO2)cc1	ZINC000776582593	698121650	/nfs/dbraw/zinc/12/16/50/698121650.db2.gz	VSHLTWYEIJEWJW-HUUCEWRRSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCCC[C@@H]2C2OCCO2)cc1	ZINC000776582593	698121652	/nfs/dbraw/zinc/12/16/52/698121652.db2.gz	VSHLTWYEIJEWJW-HUUCEWRRSA-N	1	1	322.361	1.856	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2cnn(CC[NH+]3CCOCC3)c2)c1	ZINC000777936546	698232587	/nfs/dbraw/zinc/23/25/87/698232587.db2.gz	RTMOHXXAUGNNJW-UHFFFAOYSA-N	1	1	302.334	1.791	20	5		DDBDMO
C[N@@H+]1CCN(Cn2nccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000249703271	698396539	/nfs/dbraw/zinc/39/65/39/698396539.db2.gz	JYMVKUPQXKHQFU-CQSZACIVSA-N	1	1	301.350	1.738	20	5		DDBDMO
C[N@H+]1CCN(Cn2nccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000249703271	698396544	/nfs/dbraw/zinc/39/65/44/698396544.db2.gz	JYMVKUPQXKHQFU-CQSZACIVSA-N	1	1	301.350	1.738	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+](CCO)C2CCOCC2)cc1	ZINC000781983007	698669379	/nfs/dbraw/zinc/66/93/79/698669379.db2.gz	QJDLONHGJXORFS-OAHLLOKOSA-N	1	1	310.350	1.102	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CC[NH+](C[C@H]3CCCO3)CC2)c1	ZINC000800846287	700248035	/nfs/dbraw/zinc/24/80/35/700248035.db2.gz	IJYOIZNFDKYDRM-CYBMUJFWSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H]2C[C@@]2(CO)C1	ZINC000782613681	698750587	/nfs/dbraw/zinc/75/05/87/698750587.db2.gz	BLBOUXBJQLIGNH-WBMJQRKESA-N	1	1	319.361	1.546	20	5		DDBDMO
CS(=O)(=O)[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000714243764	699269857	/nfs/dbraw/zinc/26/98/57/699269857.db2.gz	JHICYLMKKQPTFW-HOMQSWHASA-N	1	1	318.782	1.913	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H](C2OCCO2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000719037034	699297761	/nfs/dbraw/zinc/29/77/61/699297761.db2.gz	WQTPSDRRLPUGEL-LLVKDONJSA-N	1	1	321.333	1.228	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H](C2OCCO2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000719037034	699297763	/nfs/dbraw/zinc/29/77/63/699297763.db2.gz	WQTPSDRRLPUGEL-LLVKDONJSA-N	1	1	321.333	1.228	20	5		DDBDMO
Cc1cc(C(=O)OCCC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000735894430	699709055	/nfs/dbraw/zinc/70/90/55/699709055.db2.gz	RNYIBBCCTHTLQT-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000742239460	699868863	/nfs/dbraw/zinc/86/88/63/699868863.db2.gz	NDZVPLKILFQDNT-JTQLQIEISA-N	1	1	317.349	1.685	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000742241718	699869395	/nfs/dbraw/zinc/86/93/95/699869395.db2.gz	RIGUFKQWKAXFBW-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801939524	700358072	/nfs/dbraw/zinc/35/80/72/700358072.db2.gz	FNPHLGVIWLEHOA-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801939524	700358073	/nfs/dbraw/zinc/35/80/73/700358073.db2.gz	FNPHLGVIWLEHOA-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
O=C(CC[NH+]1CCOCC1)Nc1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000759789973	700772883	/nfs/dbraw/zinc/77/28/83/700772883.db2.gz	NOPQZQACEDAGLL-UHFFFAOYSA-N	1	1	319.321	1.132	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845774	701140583	/nfs/dbraw/zinc/14/05/83/701140583.db2.gz	YKKIIYRLIWBMAT-MZJFNTNISA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000767845774	701140585	/nfs/dbraw/zinc/14/05/85/701140585.db2.gz	YKKIIYRLIWBMAT-MZJFNTNISA-N	1	1	300.380	1.327	20	5		DDBDMO
CN1CC[NH+](CCCNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804331641	701178986	/nfs/dbraw/zinc/17/89/86/701178986.db2.gz	RFCLFRLRBRACHN-UHFFFAOYSA-N	1	1	323.353	1.552	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839604316	701750832	/nfs/dbraw/zinc/75/08/32/701750832.db2.gz	CEVOVUOLUANJJF-MRVWCRGKSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+](Cc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839604316	701750835	/nfs/dbraw/zinc/75/08/35/701750835.db2.gz	CEVOVUOLUANJJF-MRVWCRGKSA-N	1	1	323.418	1.742	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839604316	701750840	/nfs/dbraw/zinc/75/08/40/701750840.db2.gz	CEVOVUOLUANJJF-MRVWCRGKSA-N	1	1	323.418	1.742	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839719797	701796477	/nfs/dbraw/zinc/79/64/77/701796477.db2.gz	AUPCEZWOSJWTOI-SLBVQIDZSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000839719797	701796480	/nfs/dbraw/zinc/79/64/80/701796480.db2.gz	AUPCEZWOSJWTOI-SLBVQIDZSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000839719797	701796486	/nfs/dbraw/zinc/79/64/86/701796486.db2.gz	AUPCEZWOSJWTOI-SLBVQIDZSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC1	ZINC000839782339	701825287	/nfs/dbraw/zinc/82/52/87/701825287.db2.gz	GIGPMJYQVFILFD-HUUCEWRRSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[N@H+](Cc1ccccc1)C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC1	ZINC000839782339	701825291	/nfs/dbraw/zinc/82/52/91/701825291.db2.gz	GIGPMJYQVFILFD-HUUCEWRRSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC1	ZINC000839782339	701825295	/nfs/dbraw/zinc/82/52/95/701825295.db2.gz	GIGPMJYQVFILFD-HUUCEWRRSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCCO1	ZINC000867949633	701849092	/nfs/dbraw/zinc/84/90/92/701849092.db2.gz	FGTPOUYGZBHEJE-NHYWBVRUSA-N	1	1	307.350	1.406	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CCC[C@@H]2OCC[C@@H]21)c1cccc([N+](=O)[O-])c1	ZINC000867984095	701873865	/nfs/dbraw/zinc/87/38/65/701873865.db2.gz	MXSZJVMIYOBKFJ-OFQRWUPVSA-N	1	1	319.361	1.549	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@H]2COC[C@@]2(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867985415	701874324	/nfs/dbraw/zinc/87/43/24/701874324.db2.gz	CPQVMESUOFVANX-APHBMKBZSA-N	1	1	319.361	1.264	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2[C@H](O)c2ccccc2)c1	ZINC000879245411	706627341	/nfs/dbraw/zinc/62/73/41/706627341.db2.gz	XLWALMHTLCZDBB-JKSUJKDBSA-N	1	1	316.361	1.989	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2C[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000816648795	702135462	/nfs/dbraw/zinc/13/54/62/702135462.db2.gz	PKBBDSZNQRQBQE-GHMZBOCLSA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000816648795	702135465	/nfs/dbraw/zinc/13/54/65/702135465.db2.gz	PKBBDSZNQRQBQE-GHMZBOCLSA-N	1	1	308.334	1.987	20	5		DDBDMO
CC[NH2+]Cc1noc(-c2cc([N+](=O)[O-])cc3c2OCCO3)n1	ZINC000843144378	702828323	/nfs/dbraw/zinc/82/83/23/702828323.db2.gz	XAYVYVVVPHYVAE-UHFFFAOYSA-N	1	1	306.278	1.526	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1	ZINC000844435308	703031188	/nfs/dbraw/zinc/03/11/88/703031188.db2.gz	BWQDBZZCPDJUCQ-VXGBXAGGSA-N	1	1	316.308	1.273	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3CSC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000879561540	706718145	/nfs/dbraw/zinc/71/81/45/706718145.db2.gz	QFXBGHGIWHEHGK-CHWSQXEVSA-N	1	1	321.402	1.879	20	5		DDBDMO
CC(C)[C@H]1CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000879601134	706734065	/nfs/dbraw/zinc/73/40/65/706734065.db2.gz	JXZNRKNEBDPHJX-CVEARBPZSA-N	1	1	307.394	1.900	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000818615101	703942996	/nfs/dbraw/zinc/94/29/96/703942996.db2.gz	ADKFPQXGIQJRFC-PHIMTYICSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000818615101	703943000	/nfs/dbraw/zinc/94/30/00/703943000.db2.gz	ADKFPQXGIQJRFC-PHIMTYICSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C[C@@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)n[nH]1	ZINC000819176517	704081588	/nfs/dbraw/zinc/08/15/88/704081588.db2.gz	FCIVOQBBWVMQDM-MEBBXXQBSA-N	1	1	304.350	1.881	20	5		DDBDMO
COC[C@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870886299	704157986	/nfs/dbraw/zinc/15/79/86/704157986.db2.gz	CRFDFFPHGWWVQO-BLLLJJGKSA-N	1	1	321.377	1.654	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@H](CN3CCCC3=O)C2)c(C)c1[N+](=O)[O-]	ZINC000853595343	704280487	/nfs/dbraw/zinc/28/04/87/704280487.db2.gz	ZPOBQHYDZPPQHQ-ZDUSSCGKSA-N	1	1	321.381	1.310	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@H](CN3CCCC3=O)C2)c(C)c1[N+](=O)[O-]	ZINC000853595343	704280489	/nfs/dbraw/zinc/28/04/89/704280489.db2.gz	ZPOBQHYDZPPQHQ-ZDUSSCGKSA-N	1	1	321.381	1.310	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@@H](C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)CC2	ZINC000854495678	704407909	/nfs/dbraw/zinc/40/79/09/704407909.db2.gz	QLSCNQAGUQAVJM-JTQLQIEISA-N	1	1	315.333	1.883	20	5		DDBDMO
Cc1ccc(O[C@@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)nc1	ZINC000858035950	704660455	/nfs/dbraw/zinc/66/04/55/704660455.db2.gz	MPTUIGCQDTTXOF-CYBMUJFWSA-N	1	1	317.349	1.648	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)C(=O)N(C)OC	ZINC000858580452	704729944	/nfs/dbraw/zinc/72/99/44/704729944.db2.gz	OWTGEUWCVHQBCD-ZJUUUORDSA-N	1	1	311.338	1.662	20	5		DDBDMO
O=C(CC[N@@H+]1CC=C[C@@H]1CO)Nc1cc([N+](=O)[O-])ccc1F	ZINC000880488785	706992043	/nfs/dbraw/zinc/99/20/43/706992043.db2.gz	MAXCSNSEVZQFHI-LLVKDONJSA-N	1	1	309.297	1.295	20	5		DDBDMO
CC[C@@H]([NH3+])c1nc(CC(=O)NCc2ccc([N+](=O)[O-])cc2)no1	ZINC000823116715	705144159	/nfs/dbraw/zinc/14/41/59/705144159.db2.gz	YZVWWVDHCMASFX-LLVKDONJSA-N	1	1	319.321	1.247	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2[C@H]1CCC[N@@H+]2C	ZINC000874842457	705197799	/nfs/dbraw/zinc/19/77/99/705197799.db2.gz	HSLDRILZNQFZLX-QWHCGFSZSA-N	1	1	321.381	1.185	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000861339616	705432843	/nfs/dbraw/zinc/43/28/43/705432843.db2.gz	CDWSWBMNCLSUOB-XHDPSFHLSA-N	1	1	308.334	1.861	20	5		DDBDMO
CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000861343130	705434643	/nfs/dbraw/zinc/43/46/43/705434643.db2.gz	YYEATNIWWZEMQO-IAQYHMDHSA-N	1	1	323.349	1.443	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@]1(CO)CCOC1	ZINC000862427151	705715952	/nfs/dbraw/zinc/71/59/52/705715952.db2.gz	UZLWNAXXOJFZCX-CYBMUJFWSA-N	1	1	300.742	1.831	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826646703	705833250	/nfs/dbraw/zinc/83/32/50/705833250.db2.gz	DRMGDQRVUIVVHS-WFASDCNBSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CC[C@@H]2OCC[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000876936149	705930143	/nfs/dbraw/zinc/93/01/43/705930143.db2.gz	IMUKAOLHRGDNPV-WPGHFRTFSA-N	1	1	319.361	1.406	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000827137221	705938066	/nfs/dbraw/zinc/93/80/66/705938066.db2.gz	VHAHOYQPYMMQOU-QLFBSQMISA-N	1	1	303.362	1.909	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC[C@@H]21	ZINC000827269713	705964832	/nfs/dbraw/zinc/96/48/32/705964832.db2.gz	ZCDXABHKJXFDJJ-RNCFNFMXSA-N	1	1	322.340	1.482	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000827373160	705988195	/nfs/dbraw/zinc/98/81/95/705988195.db2.gz	GWWIERAYORVNBO-UKRRQHHQSA-N	1	1	303.362	1.690	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)cc1[N+](=O)[O-]	ZINC000827375173	705989278	/nfs/dbraw/zinc/98/92/78/705989278.db2.gz	TYKVNXYNKGPWBD-CHWSQXEVSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cn1cc(Cl)c(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000877565069	706144394	/nfs/dbraw/zinc/14/43/94/706144394.db2.gz	RYWKEBMFLUFYRM-UHFFFAOYSA-N	1	1	310.745	1.672	20	5		DDBDMO
C[NH+]1CCN(Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1	ZINC000877943135	706247723	/nfs/dbraw/zinc/24/77/23/706247723.db2.gz	ZAHSBZAYRDPBRW-UHFFFAOYSA-N	1	1	303.322	1.392	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000829621911	706368368	/nfs/dbraw/zinc/36/83/68/706368368.db2.gz	CMPVOPIENZZLQQ-LBPRGKRZSA-N	1	1	315.414	1.126	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000830112627	706456739	/nfs/dbraw/zinc/45/67/39/706456739.db2.gz	UIILPSNCEFOTFC-MFKMUULPSA-N	1	1	309.341	1.875	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000880438421	706976436	/nfs/dbraw/zinc/97/64/36/706976436.db2.gz	HGMFVOBCJAVOBZ-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000872266962	707356166	/nfs/dbraw/zinc/35/61/66/707356166.db2.gz	IUNSXZFYRPVYQN-LSDHHAIUSA-N	1	1	321.377	1.571	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC[C@@H]3C2)c2ccc([N+](=O)[O-])cc12	ZINC000872785591	707601327	/nfs/dbraw/zinc/60/13/27/707601327.db2.gz	FKGMBANDEOVGJW-TXEJJXNPSA-N	1	1	302.334	1.789	20	5		DDBDMO
CCc1ccc([C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+](C)C)cc1	ZINC000839461511	708049159	/nfs/dbraw/zinc/04/91/59/708049159.db2.gz	ANFDRSZNOGURLM-RBSFLKMASA-N	1	1	305.378	1.633	20	5		DDBDMO
Cn1nnc2c1C[C@H](Nc1cc[nH+]c3ccc([N+](=O)[O-])cc13)CC2	ZINC000896675051	708115477	/nfs/dbraw/zinc/11/54/77/708115477.db2.gz	SYJYIQBVUZOGBD-SNVBAGLBSA-N	1	1	324.344	1.663	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@@H]3C[C@]34CCOC4)C2)nc1	ZINC000886067101	708691482	/nfs/dbraw/zinc/69/14/82/708691482.db2.gz	HFLYJRLAWYNQBR-ZENOOKHLSA-N	1	1	318.377	1.903	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](Cn2ccnn2)C1	ZINC000886084241	708695281	/nfs/dbraw/zinc/69/52/81/708695281.db2.gz	SZYGCJDRSKFNKL-LBPRGKRZSA-N	1	1	302.338	1.494	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593160	708785313	/nfs/dbraw/zinc/78/53/13/708785313.db2.gz	JQEBWJCOABWWHQ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593160	708785314	/nfs/dbraw/zinc/78/53/14/708785314.db2.gz	JQEBWJCOABWWHQ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593160	708785316	/nfs/dbraw/zinc/78/53/16/708785316.db2.gz	JQEBWJCOABWWHQ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)C[C@H]2CC(C)C)c1[N+](=O)[O-]	ZINC000886593160	708785317	/nfs/dbraw/zinc/78/53/17/708785317.db2.gz	JQEBWJCOABWWHQ-LLVKDONJSA-N	1	1	323.397	1.683	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103547	713131932	/nfs/dbraw/zinc/13/19/32/713131932.db2.gz	RGHPDJVSVAXOQP-KGLIPLIRSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1	ZINC000928103547	713131933	/nfs/dbraw/zinc/13/19/33/713131933.db2.gz	RGHPDJVSVAXOQP-KGLIPLIRSA-N	1	1	321.402	1.904	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928431521	713192687	/nfs/dbraw/zinc/19/26/87/713192687.db2.gz	FBEXYQXVJIIWOX-RISCZKNCSA-N	1	1	319.361	1.767	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1	ZINC000893374736	710622338	/nfs/dbraw/zinc/62/23/38/710622338.db2.gz	QSMXOVZJRRTJGU-NSHDSACASA-N	1	1	324.381	1.280	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000928456453	713204872	/nfs/dbraw/zinc/20/48/72/713204872.db2.gz	RPLYOWIDVQDINW-GWCFXTLKSA-N	1	1	318.377	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000893872091	710867476	/nfs/dbraw/zinc/86/74/76/710867476.db2.gz	OTEFATSXMQYBFE-LBPRGKRZSA-N	1	1	306.366	1.485	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2C[C@H](CO)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000894973831	711346516	/nfs/dbraw/zinc/34/65/16/711346516.db2.gz	BECKRDUSKGUBBT-WDEREUQCSA-N	1	1	310.350	1.759	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CN(C)CC[N@H+]1C	ZINC000895246835	711464612	/nfs/dbraw/zinc/46/46/12/711464612.db2.gz	QNLVKDDNNJISRN-YGRLFVJLSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[N@H+](C)CCN1C	ZINC000895246835	711464613	/nfs/dbraw/zinc/46/46/13/711464613.db2.gz	QNLVKDDNNJISRN-YGRLFVJLSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[C@@H](Nc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895246835	711464616	/nfs/dbraw/zinc/46/46/16/711464616.db2.gz	QNLVKDDNNJISRN-YGRLFVJLSA-N	1	1	318.381	1.517	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1	ZINC000895772269	711602552	/nfs/dbraw/zinc/60/25/52/711602552.db2.gz	ZSUHNHSOGRWFFC-ZDUSSCGKSA-N	1	1	318.377	1.947	20	5		DDBDMO
CCN(CC)S(=O)(=O)c1ccc(C[NH2+]CC[N+](=O)[O-])cc1	ZINC000905029569	711913135	/nfs/dbraw/zinc/91/31/35/711913135.db2.gz	YNJOHAYZJNQRGP-UHFFFAOYSA-N	1	1	315.395	1.083	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1C	ZINC000914290942	713371614	/nfs/dbraw/zinc/37/16/14/713371614.db2.gz	FIQKQXVWVFYDJR-ZWNOBZJWSA-N	1	1	322.365	1.495	20	5		DDBDMO
C[N@@H+]1CCC[C@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O	ZINC000917227398	713488017	/nfs/dbraw/zinc/48/80/17/713488017.db2.gz	CCCCUZGFMDLPNW-VIFPVBQESA-N	1	1	316.155	1.613	20	5		DDBDMO
C[N@H+]1CCC[C@H]1Cn1cc(Br)cc([N+](=O)[O-])c1=O	ZINC000917227398	713488019	/nfs/dbraw/zinc/48/80/19/713488019.db2.gz	CCCCUZGFMDLPNW-VIFPVBQESA-N	1	1	316.155	1.613	20	5		DDBDMO
CC[NH+]1CCN(C(=O)[C@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929110708	713548605	/nfs/dbraw/zinc/54/86/05/713548605.db2.gz	FUTJHLCMZUGKHH-CABCVRRESA-N	1	1	303.362	1.862	20	5		DDBDMO
Cc1nnc(CC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)o1	ZINC000929268622	713579446	/nfs/dbraw/zinc/57/94/46/713579446.db2.gz	GFZYDDCGQVBSLR-UHFFFAOYSA-N	1	1	317.349	1.651	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H]1C(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000929407749	713604701	/nfs/dbraw/zinc/60/47/01/713604701.db2.gz	HCTQLHOSXZKNOF-OAHLLOKOSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@H](C3OCCO3)C2)c1	ZINC000932004568	714231241	/nfs/dbraw/zinc/23/12/41/714231241.db2.gz	ZGPRZMRHWXEXNJ-GXTWGEPZSA-N	1	1	308.334	1.323	20	5		DDBDMO
Cc1cc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](C)C3)c(N)c([N+](=O)[O-])c1	ZINC000923279122	714295308	/nfs/dbraw/zinc/29/53/08/714295308.db2.gz	FOHFECAQWBNCKI-NWDGAFQWSA-N	1	1	318.377	1.794	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](C3CCOCC3)C2)c1	ZINC000933079257	714513389	/nfs/dbraw/zinc/51/33/89/714513389.db2.gz	KTQLPTDYNHVNGW-AWEZNQCLSA-N	1	1	308.382	1.930	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOC[C@H]1C[C@@H]1CCOC1	ZINC000933675768	714645943	/nfs/dbraw/zinc/64/59/43/714645943.db2.gz	OFIKESHARHOTQV-UONOGXRCSA-N	1	1	324.381	1.227	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOC[C@H]1C[C@@H]1CCOC1	ZINC000933675768	714645945	/nfs/dbraw/zinc/64/59/45/714645945.db2.gz	OFIKESHARHOTQV-UONOGXRCSA-N	1	1	324.381	1.227	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000934117984	714746068	/nfs/dbraw/zinc/74/60/68/714746068.db2.gz	QWTYMKBEIMBFFC-SGMGOOAPSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)[C@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000935693905	715118524	/nfs/dbraw/zinc/11/85/24/715118524.db2.gz	DRRDRDRBMWDWKK-XRGAULLZSA-N	1	1	315.373	1.718	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000936023338	715144678	/nfs/dbraw/zinc/14/46/78/715144678.db2.gz	PAQWOFXLXGNHNQ-NSHDSACASA-N	1	1	311.386	1.336	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4ccc([N+](=O)[O-])cc4n3)C[C@H]21	ZINC001164667045	719385397	/nfs/dbraw/zinc/38/53/97/719385397.db2.gz	MNXYLSYULDGMCU-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
Cc1nc(N2CC[C@@H]3[C@@H]2CC[N@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923255	721849098	/nfs/dbraw/zinc/84/90/98/721849098.db2.gz	UPJXCWCOVAEYTF-CABCVRRESA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1nc(N2CC[C@@H]3[C@@H]2CC[N@@H+]3CCN(C)C)ccc1[N+](=O)[O-]	ZINC001164923255	721849099	/nfs/dbraw/zinc/84/90/99/721849099.db2.gz	UPJXCWCOVAEYTF-CABCVRRESA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1cnc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC000610283863	721901676	/nfs/dbraw/zinc/90/16/76/721901676.db2.gz	IZJHEKKIVBLHIC-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H]2CO)o1	ZINC001167347329	733251271	/nfs/dbraw/zinc/25/12/71/733251271.db2.gz	KNWFEXCCEWKMJB-JTQLQIEISA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H]2CO)o1	ZINC001167347329	733251275	/nfs/dbraw/zinc/25/12/75/733251275.db2.gz	KNWFEXCCEWKMJB-JTQLQIEISA-N	1	1	304.306	1.602	20	5		DDBDMO
Cc1cc(CC(=O)NCC[NH2+]Cc2csc([N+](=O)[O-])c2)[nH]n1	ZINC001125541845	734446463	/nfs/dbraw/zinc/44/64/63/734446463.db2.gz	FVOLMTMKNJXQIK-UHFFFAOYSA-N	1	1	323.378	1.136	20	5		DDBDMO
Cc1ccccc1C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775633	736853157	/nfs/dbraw/zinc/85/31/57/736853157.db2.gz	KSHPRJWBPFTZJI-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
Cc1ccccc1C[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775633	736853160	/nfs/dbraw/zinc/85/31/60/736853160.db2.gz	KSHPRJWBPFTZJI-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
Cc1ccccc1C[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775633	736853162	/nfs/dbraw/zinc/85/31/62/736853162.db2.gz	KSHPRJWBPFTZJI-LJIZCISZSA-N	1	1	315.373	1.207	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCCC1	ZINC001029304649	740549969	/nfs/dbraw/zinc/54/99/69/740549969.db2.gz	DWNMICCUJVDKDM-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCCC1	ZINC001029304649	740549973	/nfs/dbraw/zinc/54/99/73/740549973.db2.gz	DWNMICCUJVDKDM-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCCC1	ZINC001029304649	740549977	/nfs/dbraw/zinc/54/99/77/740549977.db2.gz	DWNMICCUJVDKDM-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(Cl)c(F)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932430	742778416	/nfs/dbraw/zinc/77/84/16/742778416.db2.gz	XNWKUWUPQCGHFL-BXKDBHETSA-N	1	1	315.732	1.350	20	5		DDBDMO
Cc1cccc(CCC[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001126936835	742839261	/nfs/dbraw/zinc/83/92/61/742839261.db2.gz	TZQDGMZZWDIWSD-HUUCEWRRSA-N	1	1	305.378	1.299	20	5		DDBDMO
CCOCC(=O)N1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001194747049	746444658	/nfs/dbraw/zinc/44/46/58/746444658.db2.gz	PVUHXSXKHRVILW-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
CCOCC(=O)N1CCC[N@@H+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001194747049	746444662	/nfs/dbraw/zinc/44/46/62/746444662.db2.gz	PVUHXSXKHRVILW-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
Nc1nnc([C@H]2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)o1	ZINC001196527862	746887410	/nfs/dbraw/zinc/88/74/10/746887410.db2.gz	YBHBQDHLSPDBAM-NSHDSACASA-N	1	1	303.322	1.940	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2[C@H](C)CC[C@@H]2CO)c1	ZINC001197335400	747140956	/nfs/dbraw/zinc/14/09/56/747140956.db2.gz	NILAMROTXTUOEP-ZWNOBZJWSA-N	1	1	308.334	1.727	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NC/C=C\CNc1ncccc1[N+](=O)[O-]	ZINC001107321595	749798798	/nfs/dbraw/zinc/79/87/98/749798798.db2.gz	HERIVARRWGQZNC-PLNGDYQASA-N	1	1	321.381	1.416	20	5		DDBDMO
O=C(CCc1cnc[nH]1)NCC[NH2+]Cc1cccc([N+](=O)[O-])c1	ZINC001128986401	750687869	/nfs/dbraw/zinc/68/78/69/750687869.db2.gz	VIBBGSNOKXNDAS-UHFFFAOYSA-N	1	1	317.349	1.157	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CCC3CCCC3)C[C@@H]2C1	ZINC001048812295	769930163	/nfs/dbraw/zinc/93/01/63/769930163.db2.gz	FKRGWHLIEFJSHP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@@H+](CCC3CCCC3)C[C@@H]2C1	ZINC001048812295	769930173	/nfs/dbraw/zinc/93/01/73/769930173.db2.gz	FKRGWHLIEFJSHP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2C[N@H+](CCC3CCCC3)C[C@@H]2C1	ZINC001048812295	769930181	/nfs/dbraw/zinc/93/01/81/769930181.db2.gz	FKRGWHLIEFJSHP-QKPAOTATSA-N	1	1	321.421	1.622	20	5		DDBDMO
O=C1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCN1	ZINC001172908781	776917920	/nfs/dbraw/zinc/91/79/20/776917920.db2.gz	ODVSUGWTODDAJM-CQSZACIVSA-N	1	1	303.362	1.664	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CCN(CCC[NH3+])CC1	ZINC001173232674	777063200	/nfs/dbraw/zinc/06/32/00/777063200.db2.gz	FMOKQLQOWGDMBK-AWEZNQCLSA-N	1	1	306.410	1.492	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1	ZINC001175839398	777922409	/nfs/dbraw/zinc/92/24/09/777922409.db2.gz	XQBMBTRHWSXYOK-SECBINFHSA-N	1	1	312.757	1.654	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2cn(C)nn2)C1	ZINC001176886049	778294405	/nfs/dbraw/zinc/29/44/05/778294405.db2.gz	FHGFJXPNTVLDOL-LBPRGKRZSA-N	1	1	319.369	1.108	20	5		DDBDMO
CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NC[C@H]1CC[N@H+]1C	ZINC001178455279	779057222	/nfs/dbraw/zinc/05/72/22/779057222.db2.gz	DGNQZVWTBHZOAY-SECBINFHSA-N	1	1	324.312	1.126	20	5		DDBDMO
CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NC[C@H]1CC[N@@H+]1C	ZINC001178455279	779057227	/nfs/dbraw/zinc/05/72/27/779057227.db2.gz	DGNQZVWTBHZOAY-SECBINFHSA-N	1	1	324.312	1.126	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCC1(Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC001110227824	779267381	/nfs/dbraw/zinc/26/73/81/779267381.db2.gz	NKDNMWNNHSBEJG-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
Cc1nonc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001267233018	837575143	/nfs/dbraw/zinc/57/51/43/837575143.db2.gz	IIWIEZNFWPLJAK-UHFFFAOYSA-N	1	1	319.321	1.148	20	5		DDBDMO
Cc1nonc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC001267233018	837575148	/nfs/dbraw/zinc/57/51/48/837575148.db2.gz	IIWIEZNFWPLJAK-UHFFFAOYSA-N	1	1	319.321	1.148	20	5		DDBDMO
Cn1ccnc1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001154617398	861285688	/nfs/dbraw/zinc/28/56/88/861285688.db2.gz	MTHBLNWJBRKOCW-GQCTYLIASA-N	1	1	302.338	1.868	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001150119813	862098840	/nfs/dbraw/zinc/09/88/40/862098840.db2.gz	LJLLJXDRMCAQIV-OTYXRUKQSA-N	1	1	304.350	1.390	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC001327617514	862320564	/nfs/dbraw/zinc/32/05/64/862320564.db2.gz	SUTBYDWDJDYHGD-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
CN(C)C1(CNc2ncc([N+](=O)[O-])cc2F)CC[NH+](C)CC1	ZINC001156182349	862787723	/nfs/dbraw/zinc/78/77/23/862787723.db2.gz	QLNDROCMVCPSIG-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC001157265911	863694960	/nfs/dbraw/zinc/69/49/60/863694960.db2.gz	LIBVLZJHMNBHNH-JQWIXIFHSA-N	1	1	320.349	1.307	20	5		DDBDMO
Cc1ccc(F)c(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157767181	864117937	/nfs/dbraw/zinc/11/79/37/864117937.db2.gz	IPYVNMQFGQBBBB-TZMCWYRMSA-N	1	1	309.341	1.395	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC001331284353	864987554	/nfs/dbraw/zinc/98/75/54/864987554.db2.gz	ZOPVMUBHPUBLEY-LBPRGKRZSA-N	1	1	320.393	1.875	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])cc1O[C@@H]1CCc2[nH+]ccn2C1	ZINC001225450793	881842262	/nfs/dbraw/zinc/84/22/62/881842262.db2.gz	LHKJGWWMKUDHLV-LLVKDONJSA-N	1	1	317.301	1.972	20	5		DDBDMO
CC[C@@]([NH3+])(CO)Nc1nc(SC)nc(Cl)c1[N+](=O)[O-]	ZINC001159744215	865498006	/nfs/dbraw/zinc/49/80/06/865498006.db2.gz	SDXFVXRXEKURSA-VIFPVBQESA-N	1	1	307.763	1.229	20	5		DDBDMO
CC(C)=CC[N@@H+]1CC=C(CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001160090933	865675438	/nfs/dbraw/zinc/67/54/38/865675438.db2.gz	VSUCEBCYDLUNIK-HUUCEWRRSA-N	1	1	307.394	1.756	20	5		DDBDMO
CC(C)=CC[N@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001160090933	865675440	/nfs/dbraw/zinc/67/54/40/865675440.db2.gz	VSUCEBCYDLUNIK-HUUCEWRRSA-N	1	1	307.394	1.756	20	5		DDBDMO
CC(C)=CC[N@@H+]1CC=C(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001160090933	865675445	/nfs/dbraw/zinc/67/54/45/865675445.db2.gz	VSUCEBCYDLUNIK-HUUCEWRRSA-N	1	1	307.394	1.756	20	5		DDBDMO
COC(=O)N1CCC[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC001322291846	868099210	/nfs/dbraw/zinc/09/92/10/868099210.db2.gz	OVGPCJACNIYZSK-UHFFFAOYSA-N	1	1	323.349	1.748	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC001322291846	868099224	/nfs/dbraw/zinc/09/92/24/868099224.db2.gz	OVGPCJACNIYZSK-UHFFFAOYSA-N	1	1	323.349	1.748	20	5		DDBDMO
O=[N+]([O-])c1c2nonc2ccc1N1CC[NH+]([C@H]2CCOC2)CC1	ZINC001335518728	868357271	/nfs/dbraw/zinc/35/72/71/868357271.db2.gz	GKWNPUYWEHLQHO-JTQLQIEISA-N	1	1	319.321	1.042	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762925	869129063	/nfs/dbraw/zinc/12/90/63/869129063.db2.gz	JQZIEUZWERRKAH-XJKSGUPXSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@@H+]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762925	869129070	/nfs/dbraw/zinc/12/90/70/869129070.db2.gz	JQZIEUZWERRKAH-XJKSGUPXSA-N	1	1	307.394	1.948	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336762925	869129077	/nfs/dbraw/zinc/12/90/77/869129077.db2.gz	JQZIEUZWERRKAH-XJKSGUPXSA-N	1	1	307.394	1.948	20	5		DDBDMO
COc1ccc(C[N@@H+]2C[C@H](CCO)[C@H](CO)C2)cc1[N+](=O)[O-]	ZINC001308164984	871474772	/nfs/dbraw/zinc/47/47/72/871474772.db2.gz	WWGLQOVHGPDMKT-STQMWFEESA-N	1	1	310.350	1.026	20	5		DDBDMO
O=C(NCC1C[NH+](CCCCC(F)(F)F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001318119105	871759881	/nfs/dbraw/zinc/75/98/81/871759881.db2.gz	NFHJFPUVHANYRU-GHMZBOCLSA-N	1	1	323.315	1.432	20	5		DDBDMO
O=C(NCC[NH+]1CC=CC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC001318954422	872366301	/nfs/dbraw/zinc/36/63/01/872366301.db2.gz	ZPUIIPIZAUACRG-UHFFFAOYSA-N	1	1	316.361	1.771	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CCC[C@](C)(CO)C2)c1[N+](=O)[O-]	ZINC001342848863	872411332	/nfs/dbraw/zinc/41/13/32/872411332.db2.gz	ZAXKVEQDPTVJQU-HNNXBMFYSA-N	1	1	310.350	1.903	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@](C)(CO)C2)c1[N+](=O)[O-]	ZINC001342848863	872411346	/nfs/dbraw/zinc/41/13/46/872411346.db2.gz	ZAXKVEQDPTVJQU-HNNXBMFYSA-N	1	1	310.350	1.903	20	5		DDBDMO
C[C@@H]([NH2+][C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cnccn1	ZINC001207474588	873314508	/nfs/dbraw/zinc/31/45/08/873314508.db2.gz	HZRITMNALHDCGI-VCTAVGKDSA-N	1	1	318.333	1.130	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(O[C@@H]2CCc3[nH+]ccn3C2)c1	ZINC001227043353	882790942	/nfs/dbraw/zinc/79/09/42/882790942.db2.gz	DJGOTTMBFPRPLI-LLVKDONJSA-N	1	1	317.301	1.972	20	5		DDBDMO
COC(=O)c1cnc(O[C@@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1	ZINC001233865907	887404316	/nfs/dbraw/zinc/40/43/16/887404316.db2.gz	KNANBPXEJSTSDH-SNVBAGLBSA-N	1	1	318.289	1.367	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)NCc1ccc(C)c([N+](=O)[O-])c1	ZINC001234581680	888118367	/nfs/dbraw/zinc/11/83/67/888118367.db2.gz	IQALNDMNAPUFGZ-UHFFFAOYSA-N	1	1	324.381	1.017	20	5		DDBDMO
COc1ccc(C[C@H](C)[NH2+][C@@H]2CNCCC2=O)c([N+](=O)[O-])c1	ZINC001246294590	892519957	/nfs/dbraw/zinc/51/99/57/892519957.db2.gz	RIJBOVZNQNFTEJ-GXFFZTMASA-N	1	1	307.350	1.055	20	5		DDBDMO
COc1ccc(C[C@H](C)N[C@@H]2C[NH2+]CCC2=O)c([N+](=O)[O-])c1	ZINC001246294590	892519966	/nfs/dbraw/zinc/51/99/66/892519966.db2.gz	RIJBOVZNQNFTEJ-GXFFZTMASA-N	1	1	307.350	1.055	20	5		DDBDMO
[NH3+][C@@H](Cc1c[nH]cn1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247100866	893105976	/nfs/dbraw/zinc/10/59/76/893105976.db2.gz	NGDMRLXIIGTPMZ-QMMMGPOBSA-N	1	1	319.256	1.145	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1-c1noc(CCc2[nH]cc[nH+]2)n1	ZINC001247273515	893148741	/nfs/dbraw/zinc/14/87/41/893148741.db2.gz	DHPIYFLWKXYPTM-UHFFFAOYSA-N	1	1	304.241	1.687	20	5		DDBDMO
Cc1cc(N(C(N)=[NH2+])[C@@H](C)Cc2ccccc2[N+](=O)[O-])[nH]n1	ZINC001254550852	896499259	/nfs/dbraw/zinc/49/92/59/896499259.db2.gz	SHNHGRZTBUZGMN-JTQLQIEISA-N	1	1	302.338	1.957	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC001263996116	900865068	/nfs/dbraw/zinc/86/50/68/900865068.db2.gz	STGZXTBJEIJNCO-ATGSNQNLSA-N	1	1	319.361	1.085	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@H](C)[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000248969477	282122297	/nfs/dbraw/zinc/12/22/97/282122297.db2.gz	SKIBTXCYIIUYPB-RISCZKNCSA-N	1	1	310.350	1.685	20	5		DDBDMO
C[C@H](CO)[N@@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H](C)O	ZINC000248985807	282124013	/nfs/dbraw/zinc/12/40/13/282124013.db2.gz	WGOCPRNAGCYJAW-ZJUUUORDSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@H](CO)[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C[C@H](C)O	ZINC000248985807	282124015	/nfs/dbraw/zinc/12/40/15/282124015.db2.gz	WGOCPRNAGCYJAW-ZJUUUORDSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1O	ZINC000614661518	361968466	/nfs/dbraw/zinc/96/84/66/361968466.db2.gz	KLGVOJKKCKPLNO-ZWNOBZJWSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1O	ZINC000614661518	361968470	/nfs/dbraw/zinc/96/84/70/361968470.db2.gz	KLGVOJKKCKPLNO-ZWNOBZJWSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000451624713	231141504	/nfs/dbraw/zinc/14/15/04/231141504.db2.gz	BADDLCDEHNSWDT-TYNCELHUSA-N	1	1	318.377	1.558	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000451924397	231233898	/nfs/dbraw/zinc/23/38/98/231233898.db2.gz	DOHMEUJJUVRXDI-OAHLLOKOSA-N	1	1	310.350	1.434	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000614895209	362066734	/nfs/dbraw/zinc/06/67/34/362066734.db2.gz	QMDIPUSPZIJYST-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)C(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000614895209	362066737	/nfs/dbraw/zinc/06/67/37/362066737.db2.gz	QMDIPUSPZIJYST-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](CCO)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000614920491	362077938	/nfs/dbraw/zinc/07/79/38/362077938.db2.gz	IUTRTELFNOJSOW-UHFFFAOYSA-N	1	1	323.393	1.492	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000255414109	282255544	/nfs/dbraw/zinc/25/55/44/282255544.db2.gz	DSVZRLHBDONWON-TWGQIWQCSA-N	1	1	321.377	1.693	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1	ZINC000292352946	529811705	/nfs/dbraw/zinc/81/17/05/529811705.db2.gz	VOFNPVNQVFLDJQ-HNNXBMFYSA-N	1	1	307.325	1.902	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COCC(F)(F)F	ZINC000292578919	530004510	/nfs/dbraw/zinc/00/45/10/530004510.db2.gz	ZINUWOFZKQWCRU-LLVKDONJSA-N	1	1	322.283	1.966	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000299526827	530058049	/nfs/dbraw/zinc/05/80/49/530058049.db2.gz	CNVIWFLRLGHIKQ-LLVKDONJSA-N	1	1	302.334	1.900	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000330783995	232066247	/nfs/dbraw/zinc/06/62/47/232066247.db2.gz	RGGXFNOXTSORRT-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000330783995	232066250	/nfs/dbraw/zinc/06/62/50/232066250.db2.gz	RGGXFNOXTSORRT-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330913841	232158762	/nfs/dbraw/zinc/15/87/62/232158762.db2.gz	IDYZKNKNBAUNAU-LBPRGKRZSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330913841	232158765	/nfs/dbraw/zinc/15/87/65/232158765.db2.gz	IDYZKNKNBAUNAU-LBPRGKRZSA-N	1	1	306.366	1.194	20	5		DDBDMO
CC[N@H+]1CCN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000286770073	219157325	/nfs/dbraw/zinc/15/73/25/219157325.db2.gz	ZUBHWUABKQBPCV-ZIAGYGMSSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[NH+](C)[C@H]1CCC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000272663215	210066809	/nfs/dbraw/zinc/06/68/09/210066809.db2.gz	IFNLNRGLFWEVJV-RYUDHWBXSA-N	1	1	307.350	1.903	20	5		DDBDMO
C[C@H]([NH3+])[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000237498787	186298034	/nfs/dbraw/zinc/29/80/34/186298034.db2.gz	ZGLPHFSHTJEFLM-VHSXEESVSA-N	1	1	317.349	1.671	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H](OCCO)C2)c1	ZINC000172298875	198074542	/nfs/dbraw/zinc/07/45/42/198074542.db2.gz	QHRMWKLIQDYILM-HNNXBMFYSA-N	1	1	310.350	1.447	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1	ZINC000053572010	352660980	/nfs/dbraw/zinc/66/09/80/352660980.db2.gz	ZPXWNKGSSDBAKB-UONOGXRCSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000068211119	353096147	/nfs/dbraw/zinc/09/61/47/353096147.db2.gz	VKEZKUZPFPNOCX-QWHCGFSZSA-N	1	1	323.397	1.418	20	5		DDBDMO
C[C@H](O)CC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000072714902	353211827	/nfs/dbraw/zinc/21/18/27/353211827.db2.gz	RKUNUYNEDZFNLE-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@H](O)CC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000072714902	353211831	/nfs/dbraw/zinc/21/18/31/353211831.db2.gz	RKUNUYNEDZFNLE-NSHDSACASA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1csc([N+](=O)[O-])c1	ZINC000074104921	353292628	/nfs/dbraw/zinc/29/26/28/353292628.db2.gz	MBCNUFNQORKJOM-SNVBAGLBSA-N	1	1	313.379	1.497	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000074160856	353296494	/nfs/dbraw/zinc/29/64/94/353296494.db2.gz	AQVFYWMBYALQID-CYBMUJFWSA-N	1	1	320.393	1.778	20	5		DDBDMO
CC(C)[C@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000075744951	353379235	/nfs/dbraw/zinc/37/92/35/353379235.db2.gz	OEGKCHNRGHITIU-ZFWWWQNUSA-N	1	1	310.398	1.910	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000076269948	353410545	/nfs/dbraw/zinc/41/05/45/353410545.db2.gz	HTWMMQAEQGMHMV-SNVBAGLBSA-N	1	1	308.386	1.889	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)C[C@@H]2C(C)C)c([N+](=O)[O-])c1	ZINC000078022588	353501940	/nfs/dbraw/zinc/50/19/40/353501940.db2.gz	VYRSHBMMNOOMBW-OAHLLOKOSA-N	1	1	320.393	1.731	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000079914614	353581915	/nfs/dbraw/zinc/58/19/15/353581915.db2.gz	OXQIHQHUSVPXJH-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000093333663	353895734	/nfs/dbraw/zinc/89/57/34/353895734.db2.gz	NDMHONBHJREZFC-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
CCc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@@H]3C2)c1[N+](=O)[O-]	ZINC000094165942	353912446	/nfs/dbraw/zinc/91/24/46/353912446.db2.gz	ANWRBMXTBASLGS-OUCADQQQSA-N	1	1	319.409	1.811	20	5		DDBDMO
COc1cc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156798813	354221221	/nfs/dbraw/zinc/22/12/21/354221221.db2.gz	NOIQEBRKNSMXIU-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156798813	354221225	/nfs/dbraw/zinc/22/12/25/354221225.db2.gz	NOIQEBRKNSMXIU-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038358	354223141	/nfs/dbraw/zinc/22/31/41/354223141.db2.gz	HONAWWFSCWSRTM-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157038358	354223144	/nfs/dbraw/zinc/22/31/44/354223144.db2.gz	HONAWWFSCWSRTM-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)C(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000588774919	354936212	/nfs/dbraw/zinc/93/62/12/354936212.db2.gz	WJBBXWCHQMIRKD-UHFFFAOYSA-N	1	1	321.337	1.505	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@](C)(C(N)=O)C2)c1	ZINC000589515643	354998971	/nfs/dbraw/zinc/99/89/71/354998971.db2.gz	VSPOUUDQKKFIQC-OAHLLOKOSA-N	1	1	321.333	1.079	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590044220	355042454	/nfs/dbraw/zinc/04/24/54/355042454.db2.gz	ISKOCPSNGZIHLT-GXTWGEPZSA-N	1	1	319.361	1.308	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21)c1ccc([N+](=O)[O-])cc1F	ZINC000590045687	355043723	/nfs/dbraw/zinc/04/37/23/355043723.db2.gz	SVRKMGJNYXVODN-ZIBATOQPSA-N	1	1	321.352	2.000	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1	ZINC000590444722	355098747	/nfs/dbraw/zinc/09/87/47/355098747.db2.gz	KEKZHHWPPQVFME-MEBBXXQBSA-N	1	1	314.345	1.852	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000590655920	355139028	/nfs/dbraw/zinc/13/90/28/355139028.db2.gz	MZFNRPSVYUMKFS-YPMHNXCESA-N	1	1	322.361	1.959	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ncnc4sc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000590720119	355155347	/nfs/dbraw/zinc/15/53/47/355155347.db2.gz	UICIKPOQOHBTCY-SCZZXKLOSA-N	1	1	305.363	1.740	20	5		DDBDMO
C[C@@H](C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000590776499	355176376	/nfs/dbraw/zinc/17/63/76/355176376.db2.gz	OWMSTCBPFPZDDC-OSAQELSMSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000593000074	355765547	/nfs/dbraw/zinc/76/55/47/355765547.db2.gz	UTBVFWOZJKNNMV-MRXNPFEDSA-N	1	1	304.394	1.811	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H](C)C(C)(C)O)c1	ZINC000593029597	355774650	/nfs/dbraw/zinc/77/46/50/355774650.db2.gz	CTSLGAVMKAXGFX-JTQLQIEISA-N	1	1	310.350	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCCC[C@@H]1CO	ZINC000594017223	356089850	/nfs/dbraw/zinc/08/98/50/356089850.db2.gz	VQWCGWKJPHVLBY-ZIAGYGMSSA-N	1	1	324.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC[N@H+]3C[C@H](O)C[C@H]3C1)CCCC2	ZINC000594603721	356261527	/nfs/dbraw/zinc/26/15/27/356261527.db2.gz	MDMFUQCUNHFNNA-QWHCGFSZSA-N	1	1	318.377	1.124	20	5		DDBDMO
C[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1CCO	ZINC000595695905	356612401	/nfs/dbraw/zinc/61/24/01/356612401.db2.gz	JBFUFRFUZJUKGA-FZMZJTMJSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)[C@H]1O	ZINC000595744150	356632171	/nfs/dbraw/zinc/63/21/71/356632171.db2.gz	TVXJDOXJUXFWST-RSUWNVLCSA-N	1	1	324.377	1.283	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H]2NC(=O)CC[C@@H]2C1	ZINC000595736341	356628249	/nfs/dbraw/zinc/62/82/49/356628249.db2.gz	FAVGTCMYXPGLPT-BXUZGUMPSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)[C@](C)(CO)C1	ZINC000595869414	356685789	/nfs/dbraw/zinc/68/57/89/356685789.db2.gz	CWGFIAOHWNAVAQ-OZVIIMIRSA-N	1	1	321.377	1.872	20	5		DDBDMO
Cc1ccc(NC(=O)c2c[nH]nc2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-]	ZINC000595923676	356706497	/nfs/dbraw/zinc/70/64/97/356706497.db2.gz	AWZRCFXZVCOOTK-JTQLQIEISA-N	1	1	315.333	1.956	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596207448	356814089	/nfs/dbraw/zinc/81/40/89/356814089.db2.gz	QRLPSJUOJCXFBO-UHFFFAOYSA-N	1	1	318.337	1.510	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000596816516	356984693	/nfs/dbraw/zinc/98/46/93/356984693.db2.gz	JDNDLTZQVKXMJB-JTQLQIEISA-N	1	1	307.354	1.406	20	5		DDBDMO
CC(=O)NCC[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000347670950	283251032	/nfs/dbraw/zinc/25/10/32/283251032.db2.gz	YDJLZRQJVRLCTL-CYBMUJFWSA-N	1	1	309.370	1.030	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)n1	ZINC000597860241	357362783	/nfs/dbraw/zinc/36/27/83/357362783.db2.gz	MLQOYVBJABVMFX-JTQLQIEISA-N	1	1	309.370	1.414	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000597925916	357385293	/nfs/dbraw/zinc/38/52/93/357385293.db2.gz	YEQHDPLILCGKNW-JTQLQIEISA-N	1	1	308.338	1.298	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)c1	ZINC000599595783	357986784	/nfs/dbraw/zinc/98/67/84/357986784.db2.gz	KKHRHEBXUSDUAU-CWRNSKLLSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCO[C@@H]3CCC[C@@H]32)c1	ZINC000599595783	357986787	/nfs/dbraw/zinc/98/67/87/357986787.db2.gz	KKHRHEBXUSDUAU-CWRNSKLLSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000600528247	358249138	/nfs/dbraw/zinc/24/91/38/358249138.db2.gz	QOALUDXFZNWPHD-SNVBAGLBSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[C@@]1(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCC(=O)N1	ZINC000601172554	358432384	/nfs/dbraw/zinc/43/23/84/358432384.db2.gz	AOXWWVBTWFHTGL-HNNXBMFYSA-N	1	1	300.318	1.646	20	5		DDBDMO
O=C1NCCC[C@@H]1CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601173604	358433314	/nfs/dbraw/zinc/43/33/14/358433314.db2.gz	DOSQNLHPJXOQKI-SNVBAGLBSA-N	1	1	300.318	1.503	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1c1ccc(C(=O)NC)cc1[N+](=O)[O-]	ZINC000601192550	358441118	/nfs/dbraw/zinc/44/11/18/358441118.db2.gz	WRZFDEIKWGJSEF-ZDUSSCGKSA-N	1	1	320.393	1.875	20	5		DDBDMO
COc1ccc2c(c1)CC[N@H+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602624473	359081280	/nfs/dbraw/zinc/08/12/80/359081280.db2.gz	BOLAVMOEFJUHPB-UHFFFAOYSA-N	1	1	316.361	1.938	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCOc2ccccc2C1	ZINC000602767478	359177073	/nfs/dbraw/zinc/17/70/73/359177073.db2.gz	HYQMIRIKXZGPFF-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOc2ccccc2C1	ZINC000602767478	359177075	/nfs/dbraw/zinc/17/70/75/359177075.db2.gz	HYQMIRIKXZGPFF-UHFFFAOYSA-N	1	1	302.334	1.994	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@H](n2cc(Cl)cn2)C1	ZINC000602836713	359227623	/nfs/dbraw/zinc/22/76/23/359227623.db2.gz	GYFPVVHNNMRBDH-LBPRGKRZSA-N	1	1	324.772	1.897	20	5		DDBDMO
CS[C@H]1C[N@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000602797270	359199143	/nfs/dbraw/zinc/19/91/43/359199143.db2.gz	IBPQQAYJLGVXTI-RYUDHWBXSA-N	1	1	313.427	1.077	20	5		DDBDMO
CS[C@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@H]1N(C)C	ZINC000602797270	359199150	/nfs/dbraw/zinc/19/91/50/359199150.db2.gz	IBPQQAYJLGVXTI-RYUDHWBXSA-N	1	1	313.427	1.077	20	5		DDBDMO
Cn1cc(C[N@H+]2CC3(CCOCC3)CC[C@H]2CO)c([N+](=O)[O-])n1	ZINC000602917645	359294192	/nfs/dbraw/zinc/29/41/92/359294192.db2.gz	SVEZTOGQHJXZTJ-ZDUSSCGKSA-N	1	1	324.381	1.082	20	5		DDBDMO
Cn1c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)ccc1[N+](=O)[O-]	ZINC000603142475	359431278	/nfs/dbraw/zinc/43/12/78/359431278.db2.gz	MVMWJFKYMSUFJE-LBPRGKRZSA-N	1	1	308.382	1.736	20	5		DDBDMO
C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(CO)CC1	ZINC000186781285	200009537	/nfs/dbraw/zinc/00/95/37/200009537.db2.gz	JGDORMIKDKPWBR-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(CO)CC1	ZINC000186781285	200009539	/nfs/dbraw/zinc/00/95/39/200009539.db2.gz	JGDORMIKDKPWBR-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
CCCNC(=O)C[NH+]1CCC(Nc2cccnc2[N+](=O)[O-])CC1	ZINC000603855025	359688119	/nfs/dbraw/zinc/68/81/19/359688119.db2.gz	ZDCJGBSBTUDGEF-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1	ZINC000281153034	216115472	/nfs/dbraw/zinc/11/54/72/216115472.db2.gz	FQZXGBYUFUHSQA-OCCSQVGLSA-N	1	1	305.334	1.834	20	5		DDBDMO
Cc1cnc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC000610489135	360449997	/nfs/dbraw/zinc/44/99/97/360449997.db2.gz	FTQYOOWDKKMGBF-AWEZNQCLSA-N	1	1	320.393	1.989	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](n2ccnc2)C1	ZINC000611185063	360652821	/nfs/dbraw/zinc/65/28/21/360652821.db2.gz	HAEWWYZKLCMALE-CYBMUJFWSA-N	1	1	317.349	1.290	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCOc2ccccc2C1	ZINC000611185675	360653127	/nfs/dbraw/zinc/65/31/27/360653127.db2.gz	IFQNJYYJNIPGAF-UHFFFAOYSA-N	1	1	315.329	1.651	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOc2ccccc2C1	ZINC000611185675	360653133	/nfs/dbraw/zinc/65/31/33/360653133.db2.gz	IFQNJYYJNIPGAF-UHFFFAOYSA-N	1	1	315.329	1.651	20	5		DDBDMO
CCCC[N@@H+](CCO)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611249838	360679645	/nfs/dbraw/zinc/67/96/45/360679645.db2.gz	AUANLXUZNJILCU-UHFFFAOYSA-N	1	1	310.350	1.960	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCOC1	ZINC000611275762	360686899	/nfs/dbraw/zinc/68/68/99/360686899.db2.gz	UGIJWDLWKVVTED-LLVKDONJSA-N	1	1	308.334	1.834	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1ccc2c(c1)OCO2	ZINC000611567810	360763162	/nfs/dbraw/zinc/76/31/62/360763162.db2.gz	JLJMNDVTRAJBGJ-UHFFFAOYSA-N	1	1	318.333	1.960	20	5		DDBDMO
COc1cccc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000613869038	361609899	/nfs/dbraw/zinc/60/98/99/361609899.db2.gz	UXXPHMKRORKBOM-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
COc1cc(CNCC2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1OC	ZINC000271856168	209271363	/nfs/dbraw/zinc/27/13/63/209271363.db2.gz	UXNZJOJAEPAUBO-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
COc1cc(CNCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])cc1OC	ZINC000271856168	209271364	/nfs/dbraw/zinc/27/13/64/209271364.db2.gz	UXNZJOJAEPAUBO-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](C[C@H](C)O)CC2)c1	ZINC000275140069	212146027	/nfs/dbraw/zinc/14/60/27/212146027.db2.gz	NXVKESURXLXBQQ-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1CCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC000264627346	204039413	/nfs/dbraw/zinc/03/94/13/204039413.db2.gz	SVXFDHZRCREMFL-GFCCVEGCSA-N	1	1	310.329	1.486	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000264888453	204239965	/nfs/dbraw/zinc/23/99/65/204239965.db2.gz	WKRAXYTYTWJNKR-UHFFFAOYSA-N	1	1	310.379	1.765	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C3CCC3)CC2)c(N)c([N+](=O)[O-])c1	ZINC000265057862	204369177	/nfs/dbraw/zinc/36/91/77/204369177.db2.gz	LGDYSPSJBYZKLJ-UHFFFAOYSA-N	1	1	318.377	1.796	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC[C@@H]1CCCO1	ZINC000282505029	217047018	/nfs/dbraw/zinc/04/70/18/217047018.db2.gz	RHEKMEVMPXKBBL-HNNXBMFYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC[C@@H]1CCCO1	ZINC000282505029	217047020	/nfs/dbraw/zinc/04/70/20/217047020.db2.gz	RHEKMEVMPXKBBL-HNNXBMFYSA-N	1	1	321.377	1.364	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1CCC[N@H+]1C	ZINC000282728791	217206367	/nfs/dbraw/zinc/20/63/67/217206367.db2.gz	LAZWGSFMDIEBQJ-OAHLLOKOSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@@H](CC[NH+](C)C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000266151788	205139141	/nfs/dbraw/zinc/13/91/41/205139141.db2.gz	FURZHMIUGRSDHV-VIFPVBQESA-N	1	1	319.358	1.352	20	5		DDBDMO
C[C@@H](c1ccc(F)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266416827	205331391	/nfs/dbraw/zinc/33/13/91/205331391.db2.gz	HORHLHQYLUZQQV-NHYWBVRUSA-N	1	1	322.340	1.984	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H](C)[NH+](C)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000336894850	249284156	/nfs/dbraw/zinc/28/41/56/249284156.db2.gz	XGJWYUBSIQUISJ-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000339136978	250309322	/nfs/dbraw/zinc/30/93/22/250309322.db2.gz	NVMKYTOOKRRBMK-LBPRGKRZSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000341042250	251350454	/nfs/dbraw/zinc/35/04/54/251350454.db2.gz	HEUQOASJMYLDNJ-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+](CCO)[C@H]2CCc3ccccc32)n1	ZINC000176242618	285167989	/nfs/dbraw/zinc/16/79/89/285167989.db2.gz	FRUCHYSLPTTYSD-HNNXBMFYSA-N	1	1	316.361	1.773	20	5		DDBDMO
[NH3+]C[C@@H]1CCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000157647489	197204272	/nfs/dbraw/zinc/20/42/72/197204272.db2.gz	YRNOMQDDUCANHX-GZMMTYOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H]1CCC[C@@H]1O	ZINC000352661542	285205599	/nfs/dbraw/zinc/20/55/99/285205599.db2.gz	UALZPJGHNAVZEL-KBPBESRZSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=c1nc(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)[nH][nH]1	ZINC000289480646	221006992	/nfs/dbraw/zinc/00/69/92/221006992.db2.gz	RRJJFCRWFCDCSL-UHFFFAOYSA-N	1	1	321.312	1.525	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@H]2CCC[N@H+](CCCO)C2)c(Cl)c1	ZINC000294871080	224276486	/nfs/dbraw/zinc/27/64/86/224276486.db2.gz	DFSOBMKSQLIENO-JTQLQIEISA-N	1	1	314.773	1.902	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](F)C1	ZINC000451189558	533224070	/nfs/dbraw/zinc/22/40/70/533224070.db2.gz	FPFXJJDXFQVQSV-SNVBAGLBSA-N	1	1	311.313	1.976	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1nc(C)ccc1[N+](=O)[O-])C(C)C	ZINC000294955676	224337201	/nfs/dbraw/zinc/33/72/01/224337201.db2.gz	MMPYAWWPPGZILE-ZDUSSCGKSA-N	1	1	324.381	1.887	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000451578517	533415692	/nfs/dbraw/zinc/41/56/92/533415692.db2.gz	XKIGOQXZHCKPGW-IINYFYTJSA-N	1	1	307.350	1.551	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-]	ZINC000292364528	533525463	/nfs/dbraw/zinc/52/54/63/533525463.db2.gz	WHDZNWWUSNGCOW-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(S(=O)(=O)N2CC([NH+](C)C)C2)cc1C	ZINC000272156122	291991863	/nfs/dbraw/zinc/99/18/63/291991863.db2.gz	YJBNESJRRYODDK-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
CN(Cc1cnc[nH]1)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000569743895	304376589	/nfs/dbraw/zinc/37/65/89/304376589.db2.gz	GJCPKNQVCDHQOF-UHFFFAOYSA-N	1	1	310.335	1.280	20	5		DDBDMO
Cc1ccc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000070076665	406807737	/nfs/dbraw/zinc/80/77/37/406807737.db2.gz	BSMWHTIWZHNMHJ-PHIMTYICSA-N	1	1	313.379	1.274	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000066832886	407260365	/nfs/dbraw/zinc/26/03/65/407260365.db2.gz	JLMMPGPZUXHHML-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000123324416	407325619	/nfs/dbraw/zinc/32/56/19/407325619.db2.gz	QWGILHCXAKEIEZ-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000067412547	407272943	/nfs/dbraw/zinc/27/29/43/407272943.db2.gz	NSHJEQRPDLPIMG-AWEZNQCLSA-N	1	1	321.377	1.822	20	5		DDBDMO
CCN1CC[NH+](C[C@H](C)CNC(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000122487498	407302877	/nfs/dbraw/zinc/30/28/77/407302877.db2.gz	USYKPTQJSFXTNJ-GFCCVEGCSA-N	1	1	324.381	1.191	20	5		DDBDMO
CN(C(=O)C[NH2+][C@@H](C(N)=O)C(C)(C)C)c1ccc([N+](=O)[O-])cc1	ZINC000109331817	407397574	/nfs/dbraw/zinc/39/75/74/407397574.db2.gz	OXTDXIMCVAVQJF-ZDUSSCGKSA-N	1	1	322.365	1.047	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000126131509	407405981	/nfs/dbraw/zinc/40/59/81/407405981.db2.gz	IZKUHTCNYOHYDS-JTQLQIEISA-N	1	1	307.325	1.948	20	5		DDBDMO
C[NH+]1CCN([C@@H]2CCCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000127027037	407426054	/nfs/dbraw/zinc/42/60/54/407426054.db2.gz	FXPCDCBJBWTJIZ-OAHLLOKOSA-N	1	1	319.409	1.596	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000170793080	407509972	/nfs/dbraw/zinc/50/99/72/407509972.db2.gz	NCYPLSJJRICMBY-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
COC(=O)[C@H](C)C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000114062592	407536351	/nfs/dbraw/zinc/53/63/51/407536351.db2.gz	BXOCKCRSWAEZJM-LLVKDONJSA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000114062592	407536355	/nfs/dbraw/zinc/53/63/55/407536355.db2.gz	BXOCKCRSWAEZJM-LLVKDONJSA-N	1	1	323.349	1.583	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000114063109	407536583	/nfs/dbraw/zinc/53/65/83/407536583.db2.gz	RIUHJVSKSCFNIJ-NSHDSACASA-N	1	1	323.349	1.664	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCC[C@@H]1C(N)=O	ZINC000271257745	407599584	/nfs/dbraw/zinc/59/95/84/407599584.db2.gz	ALBJXMNCIBUMIF-GFCCVEGCSA-N	1	1	307.354	1.050	20	5		DDBDMO
COC(=O)C1(O)CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1	ZINC000271476201	407697976	/nfs/dbraw/zinc/69/79/76/407697976.db2.gz	VEXUMBZJRUWGDA-NSHDSACASA-N	1	1	308.334	1.656	20	5		DDBDMO
C[NH+](C)C1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000272095565	407772782	/nfs/dbraw/zinc/77/27/82/407772782.db2.gz	KHQSSCZYPFFYJE-UHFFFAOYSA-N	1	1	319.770	1.183	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000153195311	407776865	/nfs/dbraw/zinc/77/68/65/407776865.db2.gz	XBZSQMVLVPEEKY-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@@H]2C(N)=O)c1	ZINC000268034001	407862517	/nfs/dbraw/zinc/86/25/17/407862517.db2.gz	LTRCVEVCIHXLKH-CQSZACIVSA-N	1	1	306.366	1.655	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272493324	407947697	/nfs/dbraw/zinc/94/76/97/407947697.db2.gz	CPQSZZCAQHMBKT-QMTHXVAHSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272493324	407947704	/nfs/dbraw/zinc/94/77/04/407947704.db2.gz	CPQSZZCAQHMBKT-QMTHXVAHSA-N	1	1	305.334	1.467	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2CC[N@H+](C)C[C@H]21	ZINC000272428618	407914436	/nfs/dbraw/zinc/91/44/36/407914436.db2.gz	HJCOHNICAFFRFT-CHWSQXEVSA-N	1	1	321.381	1.042	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000174316989	407929444	/nfs/dbraw/zinc/92/94/44/407929444.db2.gz	FAUWCGNHJAQGEY-VHSXEESVSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000174316989	407929448	/nfs/dbraw/zinc/92/94/48/407929448.db2.gz	FAUWCGNHJAQGEY-VHSXEESVSA-N	1	1	313.379	1.183	20	5		DDBDMO
C[C@H](CO)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272477262	407940379	/nfs/dbraw/zinc/94/03/79/407940379.db2.gz	BJBUIBIZNLUJJS-SMDDNHRTSA-N	1	1	304.350	1.636	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])c(N)n1	ZINC000119079808	407989398	/nfs/dbraw/zinc/98/93/98/407989398.db2.gz	XWHZHBWLBJNGKU-LLVKDONJSA-N	1	1	308.386	1.889	20	5		DDBDMO
CO[C@H](C)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000182341669	408131633	/nfs/dbraw/zinc/13/16/33/408131633.db2.gz	CDYHPKGCIFQJJB-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246142571	408154187	/nfs/dbraw/zinc/15/41/87/408154187.db2.gz	KPSHJFXDYIEGPH-NWDGAFQWSA-N	1	1	321.381	1.391	20	5		DDBDMO
CCCNC(=O)[C@H](C)[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000246142571	408154191	/nfs/dbraw/zinc/15/41/91/408154191.db2.gz	KPSHJFXDYIEGPH-NWDGAFQWSA-N	1	1	321.381	1.391	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000121239887	408168505	/nfs/dbraw/zinc/16/85/05/408168505.db2.gz	KRXSLTVHWKYVIE-STQMWFEESA-N	1	1	321.377	1.772	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269302061	408261193	/nfs/dbraw/zinc/26/11/93/408261193.db2.gz	USIPWXOTPRHTAA-QMTHXVAHSA-N	1	1	307.350	1.713	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CC[C@H]1N(C)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269302061	408261196	/nfs/dbraw/zinc/26/11/96/408261196.db2.gz	USIPWXOTPRHTAA-QMTHXVAHSA-N	1	1	307.350	1.713	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176221405	408315196	/nfs/dbraw/zinc/31/51/96/408315196.db2.gz	CHWIDDVXVJJSMS-CYBMUJFWSA-N	1	1	323.397	1.420	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190850245	408331192	/nfs/dbraw/zinc/33/11/92/408331192.db2.gz	MWQTVAKGOCOSDS-UTUOFQBUSA-N	1	1	307.350	1.482	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000157425289	408304364	/nfs/dbraw/zinc/30/43/64/408304364.db2.gz	JCJWWMZMKKWBKJ-LLVKDONJSA-N	1	1	316.361	1.687	20	5		DDBDMO
NC(=O)CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000176199582	408306028	/nfs/dbraw/zinc/30/60/28/408306028.db2.gz	PSDZWBUNXSVSHC-UHFFFAOYSA-N	1	1	317.349	1.169	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H](C(F)(F)F)C2)c1	ZINC000246627080	408306084	/nfs/dbraw/zinc/30/60/84/408306084.db2.gz	AQCXSAHEEAAVIC-MWLCHTKSSA-N	1	1	322.287	1.427	20	5		DDBDMO
Cn1cc[nH+]c1Cn1cc(Br)c(=O)c([N+](=O)[O-])c1	ZINC000132566951	162039464	/nfs/dbraw/zinc/03/94/64/162039464.db2.gz	GRHTYYWRWXJWRL-UHFFFAOYSA-N	1	1	313.111	1.301	20	5		DDBDMO
C[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])[NH+]1CCSCC1	ZINC000269699304	408396994	/nfs/dbraw/zinc/39/69/94/408396994.db2.gz	QGVADBUWSQDGDX-GFCCVEGCSA-N	1	1	323.418	1.691	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000274466377	408416664	/nfs/dbraw/zinc/41/66/64/408416664.db2.gz	KRKSQUOFAIIPAE-GFCCVEGCSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000274505627	408432053	/nfs/dbraw/zinc/43/20/53/408432053.db2.gz	PZGDAKWDDVMJFT-LBPRGKRZSA-N	1	1	306.366	1.780	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000247523648	408486916	/nfs/dbraw/zinc/48/69/16/408486916.db2.gz	WPZVXRQXTAEJLT-IUODEOHRSA-N	1	1	321.377	1.772	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177131096	408528146	/nfs/dbraw/zinc/52/81/46/408528146.db2.gz	IPPDAVNWHXXDAH-DGCLKSJQSA-N	1	1	303.362	1.879	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC000264543343	408529515	/nfs/dbraw/zinc/52/95/15/408529515.db2.gz	BCDNWUYCUBWCPI-ZDUSSCGKSA-N	1	1	307.350	1.930	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC000264543343	408529519	/nfs/dbraw/zinc/52/95/19/408529519.db2.gz	BCDNWUYCUBWCPI-ZDUSSCGKSA-N	1	1	307.350	1.930	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000176866516	408461663	/nfs/dbraw/zinc/46/16/63/408461663.db2.gz	FGQZCAKNIMSQHN-JQWIXIFHSA-N	1	1	306.366	1.589	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)cc1O	ZINC000177214866	408555627	/nfs/dbraw/zinc/55/56/27/408555627.db2.gz	IKPAEQBGQIHZKJ-UHFFFAOYSA-N	1	1	306.322	1.638	20	5		DDBDMO
C[NH+]1CCN(CCC(C)(C)NC(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000184180259	408564103	/nfs/dbraw/zinc/56/41/03/408564103.db2.gz	XKPJHOBJANNHGV-UHFFFAOYSA-N	1	1	324.381	1.334	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534280	408566297	/nfs/dbraw/zinc/56/62/97/408566297.db2.gz	WDMVXQYWFPEHNU-WFASDCNBSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@H]1CCC[C@@H](CO)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534280	408566299	/nfs/dbraw/zinc/56/62/99/408566299.db2.gz	WDMVXQYWFPEHNU-WFASDCNBSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275333424	408585588	/nfs/dbraw/zinc/58/55/88/408585588.db2.gz	GKGNAUPGRWGQCN-MNOVXSKESA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275333424	408585592	/nfs/dbraw/zinc/58/55/92/408585592.db2.gz	GKGNAUPGRWGQCN-MNOVXSKESA-N	1	1	324.337	1.394	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC000177162518	408538626	/nfs/dbraw/zinc/53/86/26/408538626.db2.gz	GXZLDTRBHQKFAE-GXSJLCMTSA-N	1	1	304.350	1.653	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000264697663	408543827	/nfs/dbraw/zinc/54/38/27/408543827.db2.gz	SQUZSEYDZLHAHP-JTQLQIEISA-N	1	1	302.334	1.758	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000248943490	408665830	/nfs/dbraw/zinc/66/58/30/408665830.db2.gz	CZQCZPOLZLBHOQ-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000248943490	408665838	/nfs/dbraw/zinc/66/58/38/408665838.db2.gz	CZQCZPOLZLBHOQ-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000270858202	408711723	/nfs/dbraw/zinc/71/17/23/408711723.db2.gz	HTWVJMCUVITGLF-CQSZACIVSA-N	1	1	319.361	1.670	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3cncc(F)c3)CC2)c1	ZINC000270921359	408742100	/nfs/dbraw/zinc/74/21/00/408742100.db2.gz	PBMUMKSULWQZME-UHFFFAOYSA-N	1	1	320.328	1.148	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CCO)C(C)C	ZINC000177972007	408747887	/nfs/dbraw/zinc/74/78/87/408747887.db2.gz	FBWJGKWEKXAPHD-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CCO)C(C)C	ZINC000177972007	408747895	/nfs/dbraw/zinc/74/78/95/408747895.db2.gz	FBWJGKWEKXAPHD-UHFFFAOYSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000276191481	408824710	/nfs/dbraw/zinc/82/47/10/408824710.db2.gz	IHQNGUUENJMOSD-NSHDSACASA-N	1	1	306.366	1.780	20	5		DDBDMO
Cc1c(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000285953354	408895860	/nfs/dbraw/zinc/89/58/60/408895860.db2.gz	WHZJGQCERZADPG-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
Nc1ccc(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-]	ZINC000277585744	408971962	/nfs/dbraw/zinc/97/19/62/408971962.db2.gz	RXIFLFXTBKHNHI-ZDUSSCGKSA-N	1	1	318.377	1.924	20	5		DDBDMO
CSC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000292297393	409019714	/nfs/dbraw/zinc/01/97/14/409019714.db2.gz	CXSYZMMMOCSARM-GFCCVEGCSA-N	1	1	311.407	1.832	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](O)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000292309047	409021741	/nfs/dbraw/zinc/02/17/41/409021741.db2.gz	DROUYNUUQQKJQW-RYUDHWBXSA-N	1	1	310.350	1.827	20	5		DDBDMO
CC[C@@](C)(O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293314741	409087556	/nfs/dbraw/zinc/08/75/56/409087556.db2.gz	XFRFZVMZYHVTPN-MRXNPFEDSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](C)CO	ZINC000293510748	409128412	/nfs/dbraw/zinc/12/84/12/409128412.db2.gz	VCCJKIXCZNXTMY-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H](C)CO	ZINC000293510748	409128413	/nfs/dbraw/zinc/12/84/13/409128413.db2.gz	VCCJKIXCZNXTMY-JTQLQIEISA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H]1[C@H]([N@@H+](C)CCO)CCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000293638749	409152551	/nfs/dbraw/zinc/15/25/51/409152551.db2.gz	JMTSGVJSMPYBGP-BXUZGUMPSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC(C)(CCC[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000293690975	409161560	/nfs/dbraw/zinc/16/15/60/409161560.db2.gz	PATXRYWYGDJITP-UHFFFAOYSA-N	1	1	305.338	1.718	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]2OCCN(C)[C@@H]2C1	ZINC000284328660	409321262	/nfs/dbraw/zinc/32/12/62/409321262.db2.gz	KOYJWIPLSYPJBD-CVEARBPZSA-N	1	1	305.378	1.808	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)C[N@@H+](C)C1CC1	ZINC000289447478	409274121	/nfs/dbraw/zinc/27/41/21/409274121.db2.gz	ULJVSGFOCCMMBA-MRXNPFEDSA-N	1	1	307.394	1.524	20	5		DDBDMO
CN(C[C@H](O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000289447478	409274124	/nfs/dbraw/zinc/27/41/24/409274124.db2.gz	ULJVSGFOCCMMBA-MRXNPFEDSA-N	1	1	307.394	1.524	20	5		DDBDMO
CN(C[C@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000289447478	409274129	/nfs/dbraw/zinc/27/41/29/409274129.db2.gz	ULJVSGFOCCMMBA-MRXNPFEDSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000296054269	409414322	/nfs/dbraw/zinc/41/43/22/409414322.db2.gz	FWXVLUPPDSSGIR-IAQYHMDHSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1[C@H](O)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000296054269	409414329	/nfs/dbraw/zinc/41/43/29/409414329.db2.gz	FWXVLUPPDSSGIR-IAQYHMDHSA-N	1	1	319.361	1.329	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)nc2sccn21	ZINC000316905080	164024578	/nfs/dbraw/zinc/02/45/78/164024578.db2.gz	XYHZFJRXEWLBRM-NXEZZACHSA-N	1	1	323.378	1.579	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccnc2c1cccc2[N+](=O)[O-]	ZINC000322079788	164046071	/nfs/dbraw/zinc/04/60/71/164046071.db2.gz	RLLRZYRAVVMPMR-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1	ZINC000322079788	164046074	/nfs/dbraw/zinc/04/60/74/164046074.db2.gz	RLLRZYRAVVMPMR-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1	ZINC000322079788	164046076	/nfs/dbraw/zinc/04/60/76/164046076.db2.gz	RLLRZYRAVVMPMR-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CC[N@@H+](CCNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-])C(C)C	ZINC000342101258	409559684	/nfs/dbraw/zinc/55/96/84/409559684.db2.gz	WXGIHMBBZJEXIG-UHFFFAOYSA-N	1	1	324.381	2.227	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H](C)O	ZINC000304000676	409562834	/nfs/dbraw/zinc/56/28/34/409562834.db2.gz	RCGKAGFNSRCILD-GFCCVEGCSA-N	1	1	321.377	1.575	20	5		DDBDMO
C[C@H]1C[N@@H+](C2CC2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798507	409617367	/nfs/dbraw/zinc/61/73/67/409617367.db2.gz	GLOLHYMIOYYQEO-XPTSAGLGSA-N	1	1	305.334	1.513	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356798507	409617373	/nfs/dbraw/zinc/61/73/73/409617373.db2.gz	GLOLHYMIOYYQEO-XPTSAGLGSA-N	1	1	305.334	1.513	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000348924734	409590593	/nfs/dbraw/zinc/59/05/93/409590593.db2.gz	YJVJXLLZSDCOOK-UHFFFAOYSA-N	1	1	310.354	1.177	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000354007495	409595736	/nfs/dbraw/zinc/59/57/36/409595736.db2.gz	QDQWECMOTXLDPT-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000356835188	409645975	/nfs/dbraw/zinc/64/59/75/409645975.db2.gz	CILRDVXOIWPNKM-QWRGUYRKSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000356835188	409645978	/nfs/dbraw/zinc/64/59/78/409645978.db2.gz	CILRDVXOIWPNKM-QWRGUYRKSA-N	1	1	309.370	1.077	20	5		DDBDMO
Cc1cccc(C(=O)N=c2ccn(CC[NH+](C)C)[nH]2)c1[N+](=O)[O-]	ZINC000354139886	409688062	/nfs/dbraw/zinc/68/80/62/409688062.db2.gz	WCNVZTMJMCZQOM-UHFFFAOYSA-N	1	1	317.349	1.914	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000346144005	409818536	/nfs/dbraw/zinc/81/85/36/409818536.db2.gz	UCIWFUGLJSCOKH-GHMZBOCLSA-N	1	1	323.397	1.873	20	5		DDBDMO
CN(CC1CC1)C(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338375337	409948243	/nfs/dbraw/zinc/94/82/43/409948243.db2.gz	DHHGUBFNMJVIOV-UHFFFAOYSA-N	1	1	305.378	1.938	20	5		DDBDMO
CN(CC1CC1)C(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338375337	409948248	/nfs/dbraw/zinc/94/82/48/409948248.db2.gz	DHHGUBFNMJVIOV-UHFFFAOYSA-N	1	1	305.378	1.938	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000354665354	410001639	/nfs/dbraw/zinc/00/16/39/410001639.db2.gz	QLWMGJWPHVGUCC-ZJUUUORDSA-N	1	1	309.370	1.619	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000332238816	410003295	/nfs/dbraw/zinc/00/32/95/410003295.db2.gz	UEXCPKNCNOOZAN-VXGBXAGGSA-N	1	1	321.377	1.986	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1C	ZINC000357460897	410052327	/nfs/dbraw/zinc/05/23/27/410052327.db2.gz	RRFGCWKBNDADCO-UWVGGRQHSA-N	1	1	307.354	1.008	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1CCCC[C@H]1C	ZINC000343076668	410125424	/nfs/dbraw/zinc/12/54/24/410125424.db2.gz	NHECTAVUUKKFOV-VXGBXAGGSA-N	1	1	308.382	1.926	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343472889	410479544	/nfs/dbraw/zinc/47/95/44/410479544.db2.gz	ZGDWPQBAXGHDIO-STQMWFEESA-N	1	1	320.393	1.630	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)CC1	ZINC000355306658	410431295	/nfs/dbraw/zinc/43/12/95/410431295.db2.gz	ATBXZBJMVKNANW-UHFFFAOYSA-N	1	1	319.361	1.742	20	5		DDBDMO
O=C(CCN1C[C@H]2C[NH2+]C[C@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000359305963	410592134	/nfs/dbraw/zinc/59/21/34/410592134.db2.gz	MHMFQNWKKZXTNC-TXEJJXNPSA-N	1	1	304.350	1.075	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([C@@H]3CCC[NH2+]3)CC2)c1[N+](=O)[O-]	ZINC000353068158	410765473	/nfs/dbraw/zinc/76/54/73/410765473.db2.gz	QMQOSLPKSVOLQB-NSHDSACASA-N	1	1	307.354	1.231	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000359628210	410781041	/nfs/dbraw/zinc/78/10/41/410781041.db2.gz	ZITSRWYQJGBUFR-ZDUSSCGKSA-N	1	1	305.334	1.410	20	5		DDBDMO
CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347928160	410795323	/nfs/dbraw/zinc/79/53/23/410795323.db2.gz	UUJBQVVWBLMHSQ-NSHDSACASA-N	1	1	322.340	1.625	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000330612442	410827027	/nfs/dbraw/zinc/82/70/27/410827027.db2.gz	QVYINUJPTYCPJK-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000330652072	410849741	/nfs/dbraw/zinc/84/97/41/410849741.db2.gz	KLMZZELQQXHDAC-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CN(C)S(=O)(=O)CCC[N@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000344176416	411009711	/nfs/dbraw/zinc/00/97/11/411009711.db2.gz	RYZGQPZMBYEDHG-UHFFFAOYSA-N	1	1	315.395	1.308	20	5		DDBDMO
CN(C)S(=O)(=O)CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000344176416	411009718	/nfs/dbraw/zinc/00/97/18/411009718.db2.gz	RYZGQPZMBYEDHG-UHFFFAOYSA-N	1	1	315.395	1.308	20	5		DDBDMO
CC[N@@H+](C)CCN[C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353494859	411029908	/nfs/dbraw/zinc/02/99/08/411029908.db2.gz	GHELZFQKHSRGEV-OAHLLOKOSA-N	1	1	317.393	1.959	20	5		DDBDMO
C[N@@H+](CCc1ccccc1O)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000344230935	411042716	/nfs/dbraw/zinc/04/27/16/411042716.db2.gz	YYCHRQHRAPDORL-AWEZNQCLSA-N	1	1	320.349	1.032	20	5		DDBDMO
CC[C@H](CO)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000353671090	411106388	/nfs/dbraw/zinc/10/63/88/411106388.db2.gz	JMKGGUFHADQMEI-TZMCWYRMSA-N	1	1	304.350	1.778	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000132503975	196260570	/nfs/dbraw/zinc/26/05/70/196260570.db2.gz	BHGAEKZUNHXSMU-SNVBAGLBSA-N	1	1	307.325	1.948	20	5		DDBDMO
C[NH+](C)C1(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000419005134	226002843	/nfs/dbraw/zinc/00/28/43/226002843.db2.gz	FSLQBXUKZYUPTH-UHFFFAOYSA-N	1	1	319.408	1.566	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]3C(=O)NC[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000368067867	418684481	/nfs/dbraw/zinc/68/44/81/418684481.db2.gz	BSONQEBLQMMIQP-MNOVXSKESA-N	1	1	323.324	1.310	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000364922016	418822227	/nfs/dbraw/zinc/82/22/27/418822227.db2.gz	LUSBLPVFAFVWCZ-AWEZNQCLSA-N	1	1	307.394	1.792	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@@H]12	ZINC000365655246	418890152	/nfs/dbraw/zinc/89/01/52/418890152.db2.gz	IHTQXHIZRLQKBK-KBUVRSHFSA-N	1	1	301.346	1.676	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)C[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344355	418894330	/nfs/dbraw/zinc/89/43/30/418894330.db2.gz	JDFDCYLZUQBWII-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1CO[C@@H](CO)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344355	418894332	/nfs/dbraw/zinc/89/43/32/418894332.db2.gz	JDFDCYLZUQBWII-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
CN1C[C@H]2C[N@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373216801	418932476	/nfs/dbraw/zinc/93/24/76/418932476.db2.gz	BUQCUFAJBYETOA-ZDUSSCGKSA-N	1	1	320.349	1.025	20	5		DDBDMO
CN1C[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373216801	418932477	/nfs/dbraw/zinc/93/24/77/418932477.db2.gz	BUQCUFAJBYETOA-ZDUSSCGKSA-N	1	1	320.349	1.025	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420936525	419371142	/nfs/dbraw/zinc/37/11/42/419371142.db2.gz	ITWSWATYCPCXEL-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420936525	419371148	/nfs/dbraw/zinc/37/11/48/419371148.db2.gz	ITWSWATYCPCXEL-DGCLKSJQSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@H](O)[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103858	419663526	/nfs/dbraw/zinc/66/35/26/419663526.db2.gz	ZKUCPNWBEXUSAX-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H](O)[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000412103858	419663536	/nfs/dbraw/zinc/66/35/36/419663536.db2.gz	ZKUCPNWBEXUSAX-SMDDNHRTSA-N	1	1	323.349	1.005	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCNc2cccc(C)[nH+]2)n1	ZINC000427836595	419748006	/nfs/dbraw/zinc/74/80/06/419748006.db2.gz	DCFIMQSTHFTQTL-UHFFFAOYSA-N	1	1	318.337	1.357	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](CC[C@H]3CCOC3)C2)nc1	ZINC000438096548	420439865	/nfs/dbraw/zinc/43/98/65/420439865.db2.gz	OWDGXCZLZIKYRK-STQMWFEESA-N	1	1	306.366	1.903	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000439162719	420482610	/nfs/dbraw/zinc/48/26/10/420482610.db2.gz	ZUOPFRSNRSMDFD-NSHDSACASA-N	1	1	306.366	1.980	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000457097815	420612595	/nfs/dbraw/zinc/61/25/95/420612595.db2.gz	LDOXRAZDETWXRL-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000457097815	420612599	/nfs/dbraw/zinc/61/25/99/420612599.db2.gz	LDOXRAZDETWXRL-CYBMUJFWSA-N	1	1	321.377	1.052	20	5		DDBDMO
CC[N@H+]1CC[C@H](NC(=O)/C=C\c2ccc(F)cc2[N+](=O)[O-])C1	ZINC000493700483	420919160	/nfs/dbraw/zinc/91/91/60/420919160.db2.gz	XREIQTVPRSKORQ-AGLBCWCQSA-N	1	1	307.325	1.958	20	5		DDBDMO
CC(C)[C@H]1CN(c2ccc3ncc([N+](=O)[O-])n3n2)CC[N@H+]1C	ZINC000487084096	421001383	/nfs/dbraw/zinc/00/13/83/421001383.db2.gz	JDARCFMHSUJSTC-LLVKDONJSA-N	1	1	304.354	1.414	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456073877	421095758	/nfs/dbraw/zinc/09/57/58/421095758.db2.gz	WROIMGZXRBGFMR-NSHDSACASA-N	1	1	323.397	1.882	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000488721174	421108414	/nfs/dbraw/zinc/10/84/14/421108414.db2.gz	RNJVJSBHPMSJNV-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@]1(CO)CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000545398077	421258217	/nfs/dbraw/zinc/25/82/17/421258217.db2.gz	VVKUQCMDSUHHOO-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000545398077	421258221	/nfs/dbraw/zinc/25/82/21/421258221.db2.gz	VVKUQCMDSUHHOO-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000546104472	421285454	/nfs/dbraw/zinc/28/54/54/421285454.db2.gz	KHFGXGRUUMSMHX-ZFWWWQNUSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000516490537	421548246	/nfs/dbraw/zinc/54/82/46/421548246.db2.gz	TYMIBVISCYULJZ-NSHDSACASA-N	1	1	321.381	1.422	20	5		DDBDMO
CC(=O)NCC[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000563883721	421552188	/nfs/dbraw/zinc/55/21/88/421552188.db2.gz	WBKNKDCSKNYUIX-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000553544880	421619329	/nfs/dbraw/zinc/61/93/29/421619329.db2.gz	OKQUGQJDPCUPAD-VIFPVBQESA-N	1	1	303.322	1.751	20	5		DDBDMO
CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000570826066	421672172	/nfs/dbraw/zinc/67/21/72/421672172.db2.gz	YPRAOLZBOGRWJA-LLVKDONJSA-N	1	1	323.397	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000537814621	421736553	/nfs/dbraw/zinc/73/65/53/421736553.db2.gz	FXYBWTMIMGMJGL-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000537814621	421736556	/nfs/dbraw/zinc/73/65/56/421736556.db2.gz	FXYBWTMIMGMJGL-NXEZZACHSA-N	1	1	321.333	1.488	20	5		DDBDMO
Nc1ccc(NCCc2cn3c([nH+]2)CCCC3)nc1[N+](=O)[O-]	ZINC000596072442	422361603	/nfs/dbraw/zinc/36/16/03/422361603.db2.gz	ARDKPMMHLBEXHH-UHFFFAOYSA-N	1	1	302.338	1.759	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2NCC[N@@H+]2CC[C@H](O)C2)c1	ZINC000599199229	422404438	/nfs/dbraw/zinc/40/44/38/422404438.db2.gz	HNEOJGJYVNLVJP-ZDUSSCGKSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000578160504	422513172	/nfs/dbraw/zinc/51/31/72/422513172.db2.gz	LUMBCZVYLRHWHR-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
COC(=O)[C@@](C)(O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000343997907	271928701	/nfs/dbraw/zinc/92/87/01/271928701.db2.gz	YDNUFDCETJTWJP-HNNXBMFYSA-N	1	1	310.350	1.729	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000345916004	272364605	/nfs/dbraw/zinc/36/46/05/272364605.db2.gz	YZAZCAXIQRZOND-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](O)C[C@H]1C	ZINC000340904202	274118731	/nfs/dbraw/zinc/11/87/31/274118731.db2.gz	JAGOJEHLMOKFGU-PWSUYJOCSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCCNC1	ZINC000414866949	274206549	/nfs/dbraw/zinc/20/65/49/274206549.db2.gz	NMYSGJYNAAXFHI-WCQYABFASA-N	1	1	306.366	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCCO)CC2)c([N+](=O)[O-])c1	ZINC000072058747	275036267	/nfs/dbraw/zinc/03/62/67/275036267.db2.gz	AMZZIGQNXZTESX-UHFFFAOYSA-N	1	1	310.310	1.007	20	5		DDBDMO
CC[N@H+]1CCCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000287531620	276165392	/nfs/dbraw/zinc/16/53/92/276165392.db2.gz	VQDKRMKFBRJXRO-UHFFFAOYSA-N	1	1	322.365	1.617	20	5		DDBDMO
CCC[C@H]1C[NH2+]CCN1S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000440863780	278959939	/nfs/dbraw/zinc/95/99/39/278959939.db2.gz	VMFGLLXWTIUWPC-VIFPVBQESA-N	1	1	319.408	1.419	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)C(C)(C)C[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000416332062	280187116	/nfs/dbraw/zinc/18/71/16/280187116.db2.gz	FEGAFSBDOIODMP-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362072670	300000534	/nfs/dbraw/zinc/00/05/34/300000534.db2.gz	PLYQHHQFKHGCMC-VXGBXAGGSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362072670	300000535	/nfs/dbraw/zinc/00/05/35/300000535.db2.gz	PLYQHHQFKHGCMC-VXGBXAGGSA-N	1	1	307.350	1.402	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)Cn2cc([N+](=O)[O-])nc2C)CC1	ZINC000363443246	300268661	/nfs/dbraw/zinc/26/86/61/300268661.db2.gz	VLECRNJRYZBLGQ-UHFFFAOYSA-N	1	1	309.370	1.044	20	5		DDBDMO
COCC[C@@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000364151086	300350733	/nfs/dbraw/zinc/35/07/33/300350733.db2.gz	QEMYKPZMODIEJV-AWEZNQCLSA-N	1	1	323.393	1.895	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N)C[C@H]21	ZINC000364307976	300373065	/nfs/dbraw/zinc/37/30/65/300373065.db2.gz	NTTLXUNWYNSWHL-QMTHXVAHSA-N	1	1	304.350	1.343	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000368976930	301116168	/nfs/dbraw/zinc/11/61/68/301116168.db2.gz	ZVOQIXYJCRFJCJ-MYPMTAMASA-N	1	1	319.361	1.214	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CCC[C@H]3COC[C@H]32)c([N+](=O)[O-])c1	ZINC000370299638	301312104	/nfs/dbraw/zinc/31/21/04/301312104.db2.gz	UKGHVHIJPVJIKN-GXTWGEPZSA-N	1	1	305.334	1.305	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H]3COC[C@H]32)c([N+](=O)[O-])c1	ZINC000370299638	301312107	/nfs/dbraw/zinc/31/21/07/301312107.db2.gz	UKGHVHIJPVJIKN-GXTWGEPZSA-N	1	1	305.334	1.305	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@@H+]4CCOC[C@@H]4C3)ccc2c1	ZINC000375849084	302003693	/nfs/dbraw/zinc/00/36/93/302003693.db2.gz	PCJDFWMIXQZISL-AWEZNQCLSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4CCOC[C@@H]4C3)ccc2c1	ZINC000375849084	302003697	/nfs/dbraw/zinc/00/36/97/302003697.db2.gz	PCJDFWMIXQZISL-AWEZNQCLSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CC[C@H]12	ZINC000377717984	302218335	/nfs/dbraw/zinc/21/83/35/302218335.db2.gz	CWZIFSXAVOLACA-WFASDCNBSA-N	1	1	319.361	1.432	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCC[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000378015724	302263746	/nfs/dbraw/zinc/26/37/46/302263746.db2.gz	ZZMDDGDRRDBWTA-ZDUSSCGKSA-N	1	1	321.377	1.652	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2ccccn2)c1	ZINC000530963065	303222759	/nfs/dbraw/zinc/22/27/59/303222759.db2.gz	BJBIZILWCHPDFY-DZGCQCFKSA-N	1	1	317.349	1.384	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1cc([N+](=O)[O-])ccc1N)CC2	ZINC000364965702	307055033	/nfs/dbraw/zinc/05/50/33/307055033.db2.gz	ZLNCKMGKICEEFN-UHFFFAOYSA-N	1	1	318.377	1.877	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000365027813	307056848	/nfs/dbraw/zinc/05/68/48/307056848.db2.gz	QLAGKGYJYZPBFP-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000365027813	307056849	/nfs/dbraw/zinc/05/68/49/307056849.db2.gz	QLAGKGYJYZPBFP-ZDUSSCGKSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3C[C@H]4[C@H](CO)[C@H]4C3)n2)c1	ZINC000366408810	307072735	/nfs/dbraw/zinc/07/27/35/307072735.db2.gz	UXLYHNTXGGMQNO-ITGUQSILSA-N	1	1	316.317	1.315	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3C[C@H]4[C@H](CO)[C@H]4C3)n2)c1	ZINC000366408810	307072736	/nfs/dbraw/zinc/07/27/36/307072736.db2.gz	UXLYHNTXGGMQNO-ITGUQSILSA-N	1	1	316.317	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000366655090	307078662	/nfs/dbraw/zinc/07/86/62/307078662.db2.gz	PPHGCWNJCJYTCS-ZIAGYGMSSA-N	1	1	322.361	1.759	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ncc([N+](=O)[O-])s1	ZINC000369503199	307122293	/nfs/dbraw/zinc/12/22/93/307122293.db2.gz	JFXSERHBLDDAIU-SNVBAGLBSA-N	1	1	312.395	1.741	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000371511974	307151903	/nfs/dbraw/zinc/15/19/03/307151903.db2.gz	ULRSRLPAANYTGF-CHWSQXEVSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)nc1	ZINC000371892910	307159564	/nfs/dbraw/zinc/15/95/64/307159564.db2.gz	BOZOJJHHZZXAGI-CHWSQXEVSA-N	1	1	307.354	1.440	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000376758804	307256012	/nfs/dbraw/zinc/25/60/12/307256012.db2.gz	RDCMYEFBKLYAIQ-OAHLLOKOSA-N	1	1	321.377	1.316	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N(C)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000376758804	307256013	/nfs/dbraw/zinc/25/60/13/307256013.db2.gz	RDCMYEFBKLYAIQ-OAHLLOKOSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH3+])CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000571773012	308201789	/nfs/dbraw/zinc/20/17/89/308201789.db2.gz	VNCBMWOVCGFFFK-NEPJUHHUSA-N	1	1	306.366	1.735	20	5		DDBDMO
C[C@@H]1Cc2[nH+]cn(C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)c2C[C@@H]1C	ZINC000295067198	534089367	/nfs/dbraw/zinc/08/93/67/534089367.db2.gz	CGWUPRPRYITLLO-NTZNESFSSA-N	1	1	319.365	1.420	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCc3cn[nH]c3)C2)nc1	ZINC000459386770	534882534	/nfs/dbraw/zinc/88/25/34/534882534.db2.gz	YOMQYNYVMYDKKM-GFCCVEGCSA-N	1	1	302.338	1.442	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452185429	529053621	/nfs/dbraw/zinc/05/36/21/529053621.db2.gz	NBUIFTVNQIRBAI-WFASDCNBSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000452185429	529053625	/nfs/dbraw/zinc/05/36/25/529053625.db2.gz	NBUIFTVNQIRBAI-WFASDCNBSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820665055	599589604	/nfs/dbraw/zinc/58/96/04/599589604.db2.gz	DLEOMGJHWNNZIY-IUCAKERBSA-N	1	1	318.341	1.065	20	5		DDBDMO
Nc1ccc(C(=O)OCC[NH+]2CCSCC2)cc1[N+](=O)[O-]	ZINC000127495947	696771970	/nfs/dbraw/zinc/77/19/70/696771970.db2.gz	QPHVPSOPDDDUFZ-UHFFFAOYSA-N	1	1	311.363	1.383	20	5		DDBDMO
Cc1nn(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c(C)c1[N+](=O)[O-]	ZINC000129289398	696787557	/nfs/dbraw/zinc/78/75/57/696787557.db2.gz	UDZUMXOGBZWUGH-KBPBESRZSA-N	1	1	307.398	1.782	20	5		DDBDMO
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1	ZINC000151172118	696881501	/nfs/dbraw/zinc/88/15/01/696881501.db2.gz	RSLRKVPRTCOULR-PHIMTYICSA-N	1	1	315.329	1.880	20	5		DDBDMO
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[N@H+]1C[C@@H]2CCC[C@@H]2C1	ZINC000151172118	696881505	/nfs/dbraw/zinc/88/15/05/696881505.db2.gz	RSLRKVPRTCOULR-PHIMTYICSA-N	1	1	315.329	1.880	20	5		DDBDMO
Cc1ccccc1C[NH2+]C[C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000983653548	697286650	/nfs/dbraw/zinc/28/66/50/697286650.db2.gz	JOFCXFFDXUKZRG-DTZQCDIJSA-N	1	1	317.389	1.645	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000773196438	697726609	/nfs/dbraw/zinc/72/66/09/697726609.db2.gz	FFSIYVXBEIUUTA-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749953538	700194425	/nfs/dbraw/zinc/19/44/25/700194425.db2.gz	NSGWZSLPCRKACA-LBPRGKRZSA-N	1	1	319.365	1.964	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000776591752	698123785	/nfs/dbraw/zinc/12/37/85/698123785.db2.gz	WMRATURRMVCFQH-OFQRWUPVSA-N	1	1	306.362	1.987	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2C[C@]2(CO)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782618723	698752032	/nfs/dbraw/zinc/75/20/32/698752032.db2.gz	OKBGYCILPRLILP-ZUZCIYMTSA-N	1	1	323.324	1.377	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H]3C[C@@]3(CO)C2)c([N+](=O)[O-])c1	ZINC000782619983	698752282	/nfs/dbraw/zinc/75/22/82/698752282.db2.gz	JSTZMLFAKSQFSG-ABAIWWIYSA-N	1	1	308.334	1.296	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC1	ZINC000786190891	699133241	/nfs/dbraw/zinc/13/32/41/699133241.db2.gz	OOXHKPMGVAPKSV-HUUCEWRRSA-N	1	1	310.350	1.366	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000787329728	699206693	/nfs/dbraw/zinc/20/66/93/699206693.db2.gz	DEYFIXNZNRPAFU-RZFFKMDDSA-N	1	1	319.361	1.214	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000726195390	699353410	/nfs/dbraw/zinc/35/34/10/699353410.db2.gz	XUAJCPQLYVEDKX-UHFFFAOYSA-N	1	1	319.365	1.401	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nnnn1C1CC1	ZINC000790533072	699465673	/nfs/dbraw/zinc/46/56/73/699465673.db2.gz	JLZRTUIPDDUMDO-RNCFNFMXSA-N	1	1	318.337	1.300	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[NH+](CCO)CC3)sc2c1	ZINC000729629827	699483947	/nfs/dbraw/zinc/48/39/47/699483947.db2.gz	FSQPXWHHNDNHTG-UHFFFAOYSA-N	1	1	308.363	1.319	20	5		DDBDMO
C[C@H]1C[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1	ZINC000738160285	699754449	/nfs/dbraw/zinc/75/44/49/699754449.db2.gz	HVFGNZWCUCCIQJ-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@H]1C[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CCCO1	ZINC000738160285	699754450	/nfs/dbraw/zinc/75/44/50/699754450.db2.gz	HVFGNZWCUCCIQJ-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H]2C1	ZINC000794927325	699836269	/nfs/dbraw/zinc/83/62/69/699836269.db2.gz	FLOBUBRMYNCKKV-BXUZGUMPSA-N	1	1	306.322	1.639	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H]3[C@H](C(=O)OC)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000794970692	699838937	/nfs/dbraw/zinc/83/89/37/699838937.db2.gz	MQSLBPVVAJCPMQ-JYAVWHMHSA-N	1	1	320.345	1.844	20	5		DDBDMO
CCOc1cc(C[N@@H+]2C[C@H]3[C@H](C(=O)OC)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000794970692	699838939	/nfs/dbraw/zinc/83/89/39/699838939.db2.gz	MQSLBPVVAJCPMQ-JYAVWHMHSA-N	1	1	320.345	1.844	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000742240120	699869511	/nfs/dbraw/zinc/86/95/11/699869511.db2.gz	IXCMNUAFRWCGJD-SECBINFHSA-N	1	1	310.329	1.530	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000742240124	699869524	/nfs/dbraw/zinc/86/95/24/699869524.db2.gz	IXCMNUAFRWCGJD-VIFPVBQESA-N	1	1	310.329	1.530	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000796255363	699921963	/nfs/dbraw/zinc/92/19/63/699921963.db2.gz	QGFGJPKFWHGKDS-UHFFFAOYSA-N	1	1	307.310	1.803	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NCC[NH+]2CCC2)cc1[N+](=O)[O-]	ZINC000752629464	700376226	/nfs/dbraw/zinc/37/62/26/700376226.db2.gz	CTAUHHGSRROPHS-UHFFFAOYSA-N	1	1	308.294	1.247	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)[C@H](C)C1	ZINC000761077091	700840233	/nfs/dbraw/zinc/84/02/33/700840233.db2.gz	MWUKMYPUXFOCSA-NEPJUHHUSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@H]1CN(CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000761079871	700841452	/nfs/dbraw/zinc/84/14/52/700841452.db2.gz	GPUVVQXMODBGQH-LBPRGKRZSA-N	1	1	318.377	1.120	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839699020	701788457	/nfs/dbraw/zinc/78/84/57/701788457.db2.gz	UURHDVPYWKHEFK-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839699020	701788461	/nfs/dbraw/zinc/78/84/61/701788461.db2.gz	UURHDVPYWKHEFK-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839699020	701788463	/nfs/dbraw/zinc/78/84/63/701788463.db2.gz	UURHDVPYWKHEFK-DTZQCDIJSA-N	1	1	317.389	1.678	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000840092782	701965496	/nfs/dbraw/zinc/96/54/96/701965496.db2.gz	XVAMOJCBFBQMRG-NSHDSACASA-N	1	1	320.349	1.486	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1	ZINC000840137519	701990510	/nfs/dbraw/zinc/99/05/10/701990510.db2.gz	ITARNXSDURWLKY-OCCSQVGLSA-N	1	1	322.365	1.756	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1	ZINC000840137519	701990514	/nfs/dbraw/zinc/99/05/14/701990514.db2.gz	ITARNXSDURWLKY-OCCSQVGLSA-N	1	1	322.365	1.756	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000868581668	702210429	/nfs/dbraw/zinc/21/04/29/702210429.db2.gz	SSMUTLFIKUGWRH-PHIMTYICSA-N	1	1	309.341	1.827	20	5		DDBDMO
CC(C)(CCc1noc([C@H]2CCn3c[nH+]cc3C2)n1)[N+](=O)[O-]	ZINC000812812492	702246861	/nfs/dbraw/zinc/24/68/61/702246861.db2.gz	JMVCBWFGYHVNQN-JTQLQIEISA-N	1	1	305.338	1.984	20	5		DDBDMO
COC(=O)[C@]12C[N@H+](Cn3cc([N+](=O)[O-])c(C)n3)C[C@H]1CCCC2	ZINC000848490429	703556981	/nfs/dbraw/zinc/55/69/81/703556981.db2.gz	GLNDEFORXALMKR-IUODEOHRSA-N	1	1	322.365	1.722	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cn3cc([N+](=O)[O-])c(C)n3)C[C@H]1CCCC2	ZINC000848490429	703556983	/nfs/dbraw/zinc/55/69/83/703556983.db2.gz	GLNDEFORXALMKR-IUODEOHRSA-N	1	1	322.365	1.722	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CCN(c2[nH+]ccn2C)CC1	ZINC000848666122	703573512	/nfs/dbraw/zinc/57/35/12/703573512.db2.gz	XBZHSCRCEWKKKC-UHFFFAOYSA-N	1	1	317.349	1.664	20	5		DDBDMO
CC1(C)OC[C@@H](C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)O1	ZINC000851724456	703837319	/nfs/dbraw/zinc/83/73/19/703837319.db2.gz	XHCPNCGOJRCJPO-CYBMUJFWSA-N	1	1	321.377	1.868	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000852432326	704044530	/nfs/dbraw/zinc/04/45/30/704044530.db2.gz	MKNMLJLGZXXXBW-GFCCVEGCSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](N3CCOC3=O)C2)cc1[N+](=O)[O-]	ZINC000852432326	704044533	/nfs/dbraw/zinc/04/45/33/704044533.db2.gz	MKNMLJLGZXXXBW-GFCCVEGCSA-N	1	1	321.333	1.630	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H](N3CCOC3=O)C2)cccc1[N+](=O)[O-]	ZINC000852431657	704045075	/nfs/dbraw/zinc/04/50/75/704045075.db2.gz	JHGUHQFHJGPZCJ-CYBMUJFWSA-N	1	1	305.334	1.930	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000852569332	704076812	/nfs/dbraw/zinc/07/68/12/704076812.db2.gz	NJJDAAWLYLGWCZ-ZDUSSCGKSA-N	1	1	311.338	1.258	20	5		DDBDMO
CO[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CC[C@H]1C	ZINC000870927745	704171613	/nfs/dbraw/zinc/17/16/13/704171613.db2.gz	FHAFOIOVYGIODF-DJSGYFEHSA-N	1	1	321.377	1.652	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCC1(C)C	ZINC000871154940	704232206	/nfs/dbraw/zinc/23/22/06/704232206.db2.gz	KVUNPHCWPHSDOF-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCC1(C)C	ZINC000871154940	704232209	/nfs/dbraw/zinc/23/22/09/704232209.db2.gz	KVUNPHCWPHSDOF-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871153056	704232511	/nfs/dbraw/zinc/23/25/11/704232511.db2.gz	DOOZUKHONCKKGV-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871153056	704232514	/nfs/dbraw/zinc/23/25/14/704232514.db2.gz	DOOZUKHONCKKGV-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c1[N+](=O)[O-]	ZINC000871153056	704232515	/nfs/dbraw/zinc/23/25/15/704232515.db2.gz	DOOZUKHONCKKGV-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000832783685	706983425	/nfs/dbraw/zinc/98/34/25/706983425.db2.gz	SYZGQGGXXKCBNZ-NSHDSACASA-N	1	1	324.337	1.001	20	5		DDBDMO
CC(C)(CCC(=O)NCC[N@@H+]1CCOC(C)(C)C1)[N+](=O)[O-]	ZINC000822956240	705093223	/nfs/dbraw/zinc/09/32/23/705093223.db2.gz	OYNMACOTAKKROO-UHFFFAOYSA-N	1	1	301.387	1.049	20	5		DDBDMO
CC(C)(CCC(=O)NCC[N@H+]1CCOC(C)(C)C1)[N+](=O)[O-]	ZINC000822956240	705093226	/nfs/dbraw/zinc/09/32/26/705093226.db2.gz	OYNMACOTAKKROO-UHFFFAOYSA-N	1	1	301.387	1.049	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@@H]12	ZINC000860160359	705118797	/nfs/dbraw/zinc/11/87/97/705118797.db2.gz	RVJMZBSCUCYMLD-PSASIEDQSA-N	1	1	303.274	1.341	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@@H]12	ZINC000860160359	705118801	/nfs/dbraw/zinc/11/88/01/705118801.db2.gz	RVJMZBSCUCYMLD-PSASIEDQSA-N	1	1	303.274	1.341	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000874839116	705194994	/nfs/dbraw/zinc/19/49/94/705194994.db2.gz	TUIMWCDHTLGSAI-CHWSQXEVSA-N	1	1	318.377	1.794	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842037	705196950	/nfs/dbraw/zinc/19/69/50/705196950.db2.gz	ZNFYMKGSWSYDER-MNOVXSKESA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874842037	705196952	/nfs/dbraw/zinc/19/69/52/705196952.db2.gz	ZNFYMKGSWSYDER-MNOVXSKESA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842037	705196954	/nfs/dbraw/zinc/19/69/54/705196954.db2.gz	ZNFYMKGSWSYDER-MNOVXSKESA-N	1	1	307.354	1.189	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000874843459	705198561	/nfs/dbraw/zinc/19/85/61/705198561.db2.gz	NMZLDTOULMOHFI-LSDHHAIUSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000874850679	705202992	/nfs/dbraw/zinc/20/29/92/705202992.db2.gz	VUUDOEHAABRUPN-GJZGRUSLSA-N	1	1	303.362	1.832	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823933805	705341892	/nfs/dbraw/zinc/34/18/92/705341892.db2.gz	WSPGPHDGCGSROW-NSHDSACASA-N	1	1	307.354	1.735	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823968265	705346907	/nfs/dbraw/zinc/34/69/07/705346907.db2.gz	NHIWTVYXONFKSY-CQSZACIVSA-N	1	1	321.381	1.981	20	5		DDBDMO
CCOc1cc(C(=O)OCC[NH+]2CCC2)c([N+](=O)[O-])cc1OC	ZINC000861385920	705453329	/nfs/dbraw/zinc/45/33/29/705453329.db2.gz	DZKOWLPMXQQDAN-UHFFFAOYSA-N	1	1	324.333	1.865	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000827363508	705985598	/nfs/dbraw/zinc/98/55/98/705985598.db2.gz	BBEAWCZSVYSKJX-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000827491089	706013080	/nfs/dbraw/zinc/01/30/80/706013080.db2.gz	LXTGZYALLQDBLD-CQSZACIVSA-N	1	1	324.356	1.728	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc4cncn4c3)C2)c1	ZINC000877584017	706149697	/nfs/dbraw/zinc/14/96/97/706149697.db2.gz	NUTWMILGPZYJBL-UHFFFAOYSA-N	1	1	312.333	1.932	20	5		DDBDMO
CC1(C)C[C@@H](O)C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000877754131	706199917	/nfs/dbraw/zinc/19/99/17/706199917.db2.gz	WTMBMXUPXRUMFQ-GFCCVEGCSA-N	1	1	322.361	1.959	20	5		DDBDMO
CC1(C)C[C@@H](O)C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000877754131	706199918	/nfs/dbraw/zinc/19/99/18/706199918.db2.gz	WTMBMXUPXRUMFQ-GFCCVEGCSA-N	1	1	322.361	1.959	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1cc(F)c([N+](=O)[O-])cc1CO	ZINC000865443260	706432663	/nfs/dbraw/zinc/43/26/63/706432663.db2.gz	WQIZFENPLDEWOC-UHFFFAOYSA-N	1	1	315.345	1.606	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])CC1	ZINC000865619160	706479334	/nfs/dbraw/zinc/47/93/34/706479334.db2.gz	DCRQJOJEMOCCMO-UHFFFAOYSA-N	1	1	309.341	1.831	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000880442928	706978109	/nfs/dbraw/zinc/97/81/09/706978109.db2.gz	YGCZCILROIFFOZ-MRVWCRGKSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1ccc(CC(=O)OC)cc1[N+](=O)[O-]	ZINC000882959840	707873957	/nfs/dbraw/zinc/87/39/57/707873957.db2.gz	RSHDPONSCPBRBF-GFCCVEGCSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000882961266	707874515	/nfs/dbraw/zinc/87/45/15/707874515.db2.gz	JPTJIVQCRWTBJW-CYBMUJFWSA-N	1	1	318.377	1.993	20	5		DDBDMO
Nc1c(F)c(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221447	708259507	/nfs/dbraw/zinc/25/95/07/708259507.db2.gz	NBLFYSJHYRECOP-GHMZBOCLSA-N	1	1	324.356	1.352	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@@H](CO)C[C@@H]3CCCO3)c2c1	ZINC000884614249	708339145	/nfs/dbraw/zinc/33/91/45/708339145.db2.gz	IITSMZHKAPYOBM-YPMHNXCESA-N	1	1	317.345	1.907	20	5		DDBDMO
C[N@@H+](CCO)CCNc1c(Br)cccc1[N+](=O)[O-]	ZINC000884826289	708388681	/nfs/dbraw/zinc/38/86/81/708388681.db2.gz	VIAUHOMUVUYBJB-UHFFFAOYSA-N	1	1	318.171	1.693	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(Cc3cccnc3[N+](=O)[O-])CC2)C1	ZINC000886067792	708691777	/nfs/dbraw/zinc/69/17/77/708691777.db2.gz	OXGMZINZUUOLIQ-OAHLLOKOSA-N	1	1	319.409	1.202	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1	ZINC000887939236	709173563	/nfs/dbraw/zinc/17/35/63/709173563.db2.gz	WFWNGMVHAINJTE-CJNGLKHVSA-N	1	1	303.362	1.547	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099388	713129903	/nfs/dbraw/zinc/12/99/03/713129903.db2.gz	JTYUCHPVIXRPDE-UWVGGRQHSA-N	1	1	311.363	1.497	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099388	713129905	/nfs/dbraw/zinc/12/99/05/713129905.db2.gz	JTYUCHPVIXRPDE-UWVGGRQHSA-N	1	1	311.363	1.497	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099390	713130126	/nfs/dbraw/zinc/13/01/26/713130126.db2.gz	JTYUCHPVIXRPDE-ZJUUUORDSA-N	1	1	311.363	1.497	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099390	713130127	/nfs/dbraw/zinc/13/01/27/713130127.db2.gz	JTYUCHPVIXRPDE-ZJUUUORDSA-N	1	1	311.363	1.497	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CCN(c2[nH+]ccn2C)CC1	ZINC000892606418	710468118	/nfs/dbraw/zinc/46/81/18/710468118.db2.gz	AQNRMSAMYWZGCW-UHFFFAOYSA-N	1	1	318.337	1.059	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1C	ZINC000928444790	713198904	/nfs/dbraw/zinc/19/89/04/713198904.db2.gz	MLGGHNJTRINTNB-ONGXEEELSA-N	1	1	302.334	1.899	20	5		DDBDMO
CCOc1ccc(C(=O)NC[C@@H]2CC[N@H+]2CC)cc1[N+](=O)[O-]	ZINC000893872774	710867033	/nfs/dbraw/zinc/86/70/33/710867033.db2.gz	VFTKPFOEBANLGB-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000928564230	713229610	/nfs/dbraw/zinc/22/96/10/713229610.db2.gz	VOBQATULNRAPTI-CYBMUJFWSA-N	1	1	302.334	1.370	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCS(=O)(=O)C1CC1	ZINC000894915138	711317704	/nfs/dbraw/zinc/31/77/04/711317704.db2.gz	IYKPQGYRUBQHRV-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895249499	711465781	/nfs/dbraw/zinc/46/57/81/711465781.db2.gz	UVQBBJUJDQHKMM-RNCFNFMXSA-N	1	1	314.336	1.919	20	5		DDBDMO
CN1CC[C@@H]1CNc1nc(NC[C@@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000895770302	711601396	/nfs/dbraw/zinc/60/13/96/711601396.db2.gz	LUBOMHMXXRLYHB-NWDGAFQWSA-N	1	1	320.397	1.222	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C1CN(C)CC[N@@H+](C)C1	ZINC000905089701	711932875	/nfs/dbraw/zinc/93/28/75/711932875.db2.gz	MLIKYRBONMPNMY-UHFFFAOYSA-N	1	1	320.393	1.644	20	5		DDBDMO
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCC[N@@H+](CC[N+](=O)[O-])C1	ZINC000930032438	713739910	/nfs/dbraw/zinc/73/99/10/713739910.db2.gz	QMTPTTGFHXABAF-RYUDHWBXSA-N	1	1	301.387	1.888	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H]1C[C@H]3COC[C@@H]3O1)C2	ZINC000930100364	713756577	/nfs/dbraw/zinc/75/65/77/713756577.db2.gz	SVKMPGIGTSXUDK-XEZPLFJOSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H]1C[C@H]3COC[C@@H]3O1)C2	ZINC000930100364	713756578	/nfs/dbraw/zinc/75/65/78/713756578.db2.gz	SVKMPGIGTSXUDK-XEZPLFJOSA-N	1	1	304.346	1.757	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000921420069	713764986	/nfs/dbraw/zinc/76/49/86/713764986.db2.gz	SOGXMXMXETZVPT-LLVKDONJSA-N	1	1	312.757	1.752	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)C[C@]2(CCN(CC[N+](=O)[O-])C2)O1	ZINC000931704871	714165565	/nfs/dbraw/zinc/16/55/65/714165565.db2.gz	RZYPANHCMONAFE-DOTOQJQBSA-N	1	1	319.405	1.629	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000932348339	714315721	/nfs/dbraw/zinc/31/57/21/714315721.db2.gz	MVJBYCKZTWJVDC-JSGCOSHPSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@H]1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923368374	714330084	/nfs/dbraw/zinc/33/00/84/714330084.db2.gz	BHEBWAGJXUODRC-UKRRQHHQSA-N	1	1	323.393	1.312	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000933560408	714617360	/nfs/dbraw/zinc/61/73/60/714617360.db2.gz	UWINTAAYUBDXEA-BYCMXARLSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000933560408	714617362	/nfs/dbraw/zinc/61/73/62/714617362.db2.gz	UWINTAAYUBDXEA-BYCMXARLSA-N	1	1	303.362	1.861	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933972246	714711873	/nfs/dbraw/zinc/71/18/73/714711873.db2.gz	WBELVHXENXWVSD-LSDHHAIUSA-N	1	1	308.334	1.463	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933972246	714711875	/nfs/dbraw/zinc/71/18/75/714711875.db2.gz	WBELVHXENXWVSD-LSDHHAIUSA-N	1	1	308.334	1.463	20	5		DDBDMO
C/C(=C\C(=O)NC[C@@H]1C[C@@H](O)C[N@@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000924982052	714714916	/nfs/dbraw/zinc/71/49/16/714714916.db2.gz	OPLBNAWKSQZRGY-PFYGFVOHSA-N	1	1	319.361	1.179	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOC[C@@H]2CC2CCOCC2)n1	ZINC000934640931	714868397	/nfs/dbraw/zinc/86/83/97/714868397.db2.gz	JLJPLGBFLJGHSJ-AWEZNQCLSA-N	1	1	324.381	1.309	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOC[C@@H]2CC2CCOCC2)n1	ZINC000934640931	714868400	/nfs/dbraw/zinc/86/84/00/714868400.db2.gz	JLJPLGBFLJGHSJ-AWEZNQCLSA-N	1	1	324.381	1.309	20	5		DDBDMO
COc1cc(N2CC3(C2)CC[N@@H+](CC2CC2)C3)ncc1[N+](=O)[O-]	ZINC001164773987	721286058	/nfs/dbraw/zinc/28/60/58/721286058.db2.gz	VGILHUZKWZYALY-UHFFFAOYSA-N	1	1	318.377	1.921	20	5		DDBDMO
COc1cnc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC001165040131	721907920	/nfs/dbraw/zinc/90/79/20/721907920.db2.gz	ZDUUPILCJQISNV-LBPRGKRZSA-N	1	1	322.365	1.299	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1cc2cccnc2c2ncccc12	ZINC001167359003	733291996	/nfs/dbraw/zinc/29/19/96/733291996.db2.gz	GSCXBDBXNQJHSS-UHFFFAOYSA-N	1	1	302.341	1.907	20	5		DDBDMO
CCCOc1cccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001126936487	742841794	/nfs/dbraw/zinc/84/17/94/742841794.db2.gz	KUOZPMFYYBVSGR-HUUCEWRRSA-N	1	1	321.377	1.346	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC001181840549	743361482	/nfs/dbraw/zinc/36/14/82/743361482.db2.gz	TYWKWVDNYWLXLJ-ZDUSSCGKSA-N	1	1	321.377	1.699	20	5		DDBDMO
Cc1ncsc1C[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000996428427	749586086	/nfs/dbraw/zinc/58/60/86/749586086.db2.gz	CKMCACLDZIUYRD-VXGBXAGGSA-N	1	1	324.406	1.197	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034644453	750626262	/nfs/dbraw/zinc/62/62/62/750626262.db2.gz	HCAUXOFNZHRTEC-KBUPBQIOSA-N	1	1	309.410	1.859	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169022239	762200848	/nfs/dbraw/zinc/20/08/48/762200848.db2.gz	RDIJWWVYPTYAHZ-IHRRRGAJSA-N	1	1	308.382	1.407	20	5		DDBDMO
COC[C@H]1Cn2ccnc2C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169022239	762200851	/nfs/dbraw/zinc/20/08/51/762200851.db2.gz	RDIJWWVYPTYAHZ-IHRRRGAJSA-N	1	1	308.382	1.407	20	5		DDBDMO
O=C([C@@H]1CCCC[N@@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1)N1CCCC1	ZINC001169024993	762202507	/nfs/dbraw/zinc/20/25/07/762202507.db2.gz	IKACOTZHJRNTKI-KKUMJFAQSA-N	1	1	309.410	1.909	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CCC2CCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086363736	761499717	/nfs/dbraw/zinc/49/97/17/761499717.db2.gz	ICMUPYPDWRBNDT-KBUPBQIOSA-N	1	1	309.410	1.716	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCCNc1ncccc1[N+](=O)[O-]	ZINC001109496377	763754983	/nfs/dbraw/zinc/75/49/83/763754983.db2.gz	RQEIRQBWVSQSLM-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
CC[N@H+]1CCc2c(CNC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])cccc2C1	ZINC001051289080	764717269	/nfs/dbraw/zinc/71/72/69/764717269.db2.gz	CVKYGMBZUBQUMN-HUUCEWRRSA-N	1	1	303.362	1.346	20	5		DDBDMO
CC[N@@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1	ZINC001051289080	764717276	/nfs/dbraw/zinc/71/72/76/764717276.db2.gz	CVKYGMBZUBQUMN-HUUCEWRRSA-N	1	1	303.362	1.346	20	5		DDBDMO
CC[N@H+]1CCc2c(CNC(=O)[C@@H]3CC3[N+](=O)[O-])cccc2C1	ZINC001051289080	764717281	/nfs/dbraw/zinc/71/72/81/764717281.db2.gz	CVKYGMBZUBQUMN-HUUCEWRRSA-N	1	1	303.362	1.346	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+](C)CC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC001170344930	766276877	/nfs/dbraw/zinc/27/68/77/766276877.db2.gz	FRPPPTBOEXJNFB-NSHDSACASA-N	1	1	309.366	1.554	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+](C)CC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC001170344930	766276880	/nfs/dbraw/zinc/27/68/80/766276880.db2.gz	FRPPPTBOEXJNFB-NSHDSACASA-N	1	1	309.366	1.554	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+](C)CCC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC001170352041	766279977	/nfs/dbraw/zinc/27/99/77/766279977.db2.gz	KFWLEMIZZBISDF-LBPRGKRZSA-N	1	1	323.393	1.945	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ncc(C)cc1[N+](=O)[O-]	ZINC001094574362	776049919	/nfs/dbraw/zinc/04/99/19/776049919.db2.gz	VDORCKLAYBTALG-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](O)[C@H](CO)C1)CC2	ZINC001172903302	776915944	/nfs/dbraw/zinc/91/59/44/776915944.db2.gz	GNVMATFAQXNDJV-UXLLHSPISA-N	1	1	320.389	1.517	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1C[C@H](O)C[C@@H]1CO)CC2	ZINC001172908885	776917993	/nfs/dbraw/zinc/91/79/93/776917993.db2.gz	AZJVLYNMDYOMSZ-NUEKZKHPSA-N	1	1	306.362	1.270	20	5		DDBDMO
C[C@@H]1CNC(=O)C[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172921359	776930893	/nfs/dbraw/zinc/93/08/93/776930893.db2.gz	PENWSIJRWAQTDV-RISCZKNCSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H]1CNC(=O)C[N@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172921359	776930896	/nfs/dbraw/zinc/93/08/96/776930896.db2.gz	PENWSIJRWAQTDV-RISCZKNCSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC([N@@H+](C)[C@@H]2CCOC2)C1	ZINC001173235435	777064418	/nfs/dbraw/zinc/06/44/18/777064418.db2.gz	WYJLKJHLROVBGX-CZUORRHYSA-N	1	1	319.405	1.931	20	5		DDBDMO
CC(C)(C[NH2+]CCF)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001101540566	777231119	/nfs/dbraw/zinc/23/11/19/777231119.db2.gz	JUOJAXBZMSPKCC-CHWSQXEVSA-N	1	1	315.389	1.476	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1ccccc1[N+](=O)[O-]	ZINC001101704707	777415082	/nfs/dbraw/zinc/41/50/82/777415082.db2.gz	XWFNQPSJONLTKV-UHFFFAOYSA-N	1	1	308.382	1.807	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101712982	777424599	/nfs/dbraw/zinc/42/45/99/777424599.db2.gz	WATDPNYZBWRQRD-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NCCN1CC[N@H+](C)C(C)(C)C1	ZINC001326449238	861379003	/nfs/dbraw/zinc/37/90/03/861379003.db2.gz	KWFAHXZEXWGBQC-UHFFFAOYSA-N	1	1	307.398	1.158	20	5		DDBDMO
C[N@H+]1CCC[C@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)C1	ZINC001211877448	843253720	/nfs/dbraw/zinc/25/37/20/843253720.db2.gz	PTLQFGAGJMKHNN-QMMMGPOBSA-N	1	1	307.285	1.988	20	5		DDBDMO
CCc1noc(C)c1C[NH2+]CCN(CC)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001273376077	849739772	/nfs/dbraw/zinc/73/97/72/849739772.db2.gz	UOQXSRQURCAUGR-BXUZGUMPSA-N	1	1	324.381	1.149	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001150119815	862099955	/nfs/dbraw/zinc/09/99/55/862099955.db2.gz	LJLLJXDRMCAQIV-YMTOWFKASA-N	1	1	304.350	1.390	20	5		DDBDMO
COc1c(C(=O)NCc2[nH]c(C)[nH+]c2C)cccc1[N+](=O)[O-]	ZINC001156219646	862835909	/nfs/dbraw/zinc/83/59/09/862835909.db2.gz	DEQQKEXIOUKOAA-UHFFFAOYSA-N	1	1	304.306	1.873	20	5		DDBDMO
CN1C[C@H](Nc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CCC1=O	ZINC001156566201	863153497	/nfs/dbraw/zinc/15/34/97/863153497.db2.gz	CDZYXMQCYXICKT-NNNHXZLVSA-N	1	1	319.365	1.555	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc2c(c1)CCC2)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761048	864110843	/nfs/dbraw/zinc/11/08/43/864110843.db2.gz	LCNUQFBIQUXXOU-HZPDHXFCSA-N	1	1	317.389	1.436	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccccc1Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767190	864117569	/nfs/dbraw/zinc/11/75/69/864117569.db2.gz	IVONNWAVVPXBGZ-DGCLKSJQSA-N	1	1	311.769	1.601	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1cc([N+](=O)[O-])cc2c(Cl)ncnc12	ZINC001159788836	865525921	/nfs/dbraw/zinc/52/59/21/865525921.db2.gz	NFXLGNVGHWFWIO-JTQLQIEISA-N	1	1	310.745	1.627	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C	ZINC001225613013	881936867	/nfs/dbraw/zinc/93/68/67/881936867.db2.gz	MVTCJSMYTBMPGM-SUHUHFCYSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1O[C@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001225613013	881936881	/nfs/dbraw/zinc/93/68/81/881936881.db2.gz	MVTCJSMYTBMPGM-SUHUHFCYSA-N	1	1	306.318	1.786	20	5		DDBDMO
C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCNC1=O	ZINC001320080720	866458259	/nfs/dbraw/zinc/45/82/59/866458259.db2.gz	LLIAVZGHETUNQD-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCNC1=O	ZINC001320080720	866458261	/nfs/dbraw/zinc/45/82/61/866458261.db2.gz	LLIAVZGHETUNQD-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cn1c(Cl)cnc1C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001335888689	868598576	/nfs/dbraw/zinc/59/85/76/868598576.db2.gz	APBCXGYEDGZYSM-NSHDSACASA-N	1	1	310.741	1.805	20	5		DDBDMO
C[N@@H+](C1CN(c2cc(Cl)ncc2[N+](=O)[O-])C1)[C@@H]1CCOC1	ZINC001165203939	869426897	/nfs/dbraw/zinc/42/68/97/869426897.db2.gz	NSDUFRXZJPCZIO-SECBINFHSA-N	1	1	312.757	1.553	20	5		DDBDMO
CC(=O)OC1CN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001166640731	870119917	/nfs/dbraw/zinc/11/99/17/870119917.db2.gz	PFNXXDJEUAJFRB-SNAWJCMRSA-N	1	1	306.322	1.274	20	5		DDBDMO
COC(=O)C1([NH3+])CCN(c2cc(Cl)cc([N+](=O)[O-])n2)CC1	ZINC001166797289	870259253	/nfs/dbraw/zinc/25/92/53/870259253.db2.gz	LPVYNDIVKHTAMA-UHFFFAOYSA-N	1	1	314.729	1.114	20	5		DDBDMO
CC(C)(C)[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC001308169392	871477684	/nfs/dbraw/zinc/47/76/84/871477684.db2.gz	XQDKCRYCKLZLQH-CQSZACIVSA-N	1	1	323.393	1.894	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CC[C@]3(CNC(=O)C3)C2)c1[N+](=O)[O-]	ZINC001308724958	871520501	/nfs/dbraw/zinc/52/05/01/871520501.db2.gz	QGNFAWQSTJNTSN-HNNXBMFYSA-N	1	1	321.333	1.021	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@]3(CNC(=O)C3)C2)c1[N+](=O)[O-]	ZINC001308724958	871520513	/nfs/dbraw/zinc/52/05/13/871520513.db2.gz	QGNFAWQSTJNTSN-HNNXBMFYSA-N	1	1	321.333	1.021	20	5		DDBDMO
C[C@@H](COC(=O)c1ccccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC001349655489	875284901	/nfs/dbraw/zinc/28/49/01/875284901.db2.gz	LGGJMBHUOXXYHN-GFCCVEGCSA-N	1	1	308.334	1.720	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c([N+](=O)[O-])cnn2C)CC[N@H+]1C1CCCC1	ZINC001350602888	875781496	/nfs/dbraw/zinc/78/14/96/875781496.db2.gz	KMWUVPJAOGBRKF-NSHDSACASA-N	1	1	321.381	1.417	20	5		DDBDMO
Cc1nc(Cl)nc(O[C@@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-]	ZINC001227339724	882975756	/nfs/dbraw/zinc/97/57/56/882975756.db2.gz	JZTZNINDTISKMR-MRVPVSSYSA-N	1	1	309.713	1.937	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC001355171688	878453322	/nfs/dbraw/zinc/45/33/22/878453322.db2.gz	PIISSVFQHQWITE-CYZMBNFOSA-N	1	1	319.361	1.673	20	5		DDBDMO
Cn1c(-c2ccc([N+](=O)[O-])o2)nnc1N1CC[N@@H+](C)C(C)(C)C1	ZINC001355414530	878545170	/nfs/dbraw/zinc/54/51/70/878545170.db2.gz	DMODSYDWSOJAMR-UHFFFAOYSA-N	1	1	320.353	1.514	20	5		DDBDMO
COC(=O)[C@@H](O[C@@H]1CCC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC001223644523	881039829	/nfs/dbraw/zinc/03/98/29/881039829.db2.gz	VHJWCLKWPXEDKR-RISCZKNCSA-N	1	1	308.334	1.920	20	5		DDBDMO
[NH2+]=C(NO)c1ccc(O[C@H](C[N+](=O)[O-])c2cccnc2)cc1F	ZINC001229083097	883806050	/nfs/dbraw/zinc/80/60/50/883806050.db2.gz	NFTAOELZNJEDTR-CYBMUJFWSA-N	1	1	320.280	1.922	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCN4CC[C@H]4C3)CC2)cc1	ZINC001254482425	896455958	/nfs/dbraw/zinc/45/59/58/896455958.db2.gz	JBPJWJPOXQLQSU-KRWDZBQOSA-N	1	1	316.405	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N3CC[N@@H+]4CC[C@H]4C3)CC2)cc1	ZINC001254482425	896455967	/nfs/dbraw/zinc/45/59/67/896455967.db2.gz	JBPJWJPOXQLQSU-KRWDZBQOSA-N	1	1	316.405	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N3CC[N@H+]4CC[C@H]4C3)CC2)cc1	ZINC001254482425	896455974	/nfs/dbraw/zinc/45/59/74/896455974.db2.gz	JBPJWJPOXQLQSU-KRWDZBQOSA-N	1	1	316.405	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC([NH2+]C3COC3)C2)cc1OC(F)F	ZINC001307219165	916604622	/nfs/dbraw/zinc/60/46/22/916604622.db2.gz	JMVRPENEFPKJQG-UHFFFAOYSA-N	1	1	315.276	1.373	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000272863352	210256950	/nfs/dbraw/zinc/25/69/50/210256950.db2.gz	JIMZWWGCRGLIJB-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@H]1C(C)(C)O)c1ccc([N+](=O)[O-])cc1	ZINC000305468892	231010482	/nfs/dbraw/zinc/01/04/82/231010482.db2.gz	XNLXJZRPCSGMCY-AWEZNQCLSA-N	1	1	321.377	1.793	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)C2CC[NH+](CC)CC2)c1[N+](=O)[O-]	ZINC000331308988	529465140	/nfs/dbraw/zinc/46/51/40/529465140.db2.gz	YDBOCQGXGZNGIC-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072389	231290321	/nfs/dbraw/zinc/29/03/21/231290321.db2.gz	WPPMAFWQJZSQIP-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072389	231290326	/nfs/dbraw/zinc/29/03/26/231290326.db2.gz	WPPMAFWQJZSQIP-SUNKGSAMSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2cc(C)c([N+](=O)[O-])cc2F)CC1	ZINC000292806247	529510242	/nfs/dbraw/zinc/51/02/42/529510242.db2.gz	YVFBBPFKBIEZBG-LBPRGKRZSA-N	1	1	311.357	1.935	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CCCC[N@H+]2CCO)cc([N+](=O)[O-])c1	ZINC000452387952	231373713	/nfs/dbraw/zinc/37/37/13/231373713.db2.gz	INKLOVAZSYYTNM-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CCC(N)=O	ZINC000286593031	219071310	/nfs/dbraw/zinc/07/13/10/219071310.db2.gz	VZIKMMHKDZNGJH-UHFFFAOYSA-N	1	1	308.338	1.039	20	5		DDBDMO
C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](CO)CC(C)(C)C	ZINC000451774891	529984483	/nfs/dbraw/zinc/98/44/83/529984483.db2.gz	CBFYXXULPDIKRG-ZDUSSCGKSA-N	1	1	323.393	1.923	20	5		DDBDMO
CCn1ccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000616786193	362818781	/nfs/dbraw/zinc/81/87/81/362818781.db2.gz	NXBYJUKGJFPNBT-CQSZACIVSA-N	1	1	307.354	1.106	20	5		DDBDMO
CN(C(=O)C[N@@H+]1C[C@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000279783862	215143580	/nfs/dbraw/zinc/14/35/80/215143580.db2.gz	NUELTBOJYZHJQD-ZDUSSCGKSA-N	1	1	307.350	1.260	20	5		DDBDMO
CN(C(=O)C[N@H+]1C[C@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000279783862	215143583	/nfs/dbraw/zinc/14/35/83/215143583.db2.gz	NUELTBOJYZHJQD-ZDUSSCGKSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[NH+](C)C1(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CCCCCC1	ZINC000331417465	233394405	/nfs/dbraw/zinc/39/44/05/233394405.db2.gz	AMZZKEAWLKYFPT-UHFFFAOYSA-N	1	1	309.370	1.702	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000287519228	282749097	/nfs/dbraw/zinc/74/90/97/282749097.db2.gz	ZUJGDFAEJSVACT-UHFFFAOYSA-N	1	1	305.313	1.794	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CC[C@H](C)C1	ZINC000617353072	363066875	/nfs/dbraw/zinc/06/68/75/363066875.db2.gz	USZZUBHCSOQZES-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCO[C@@H](C)C1	ZINC000026342619	352207851	/nfs/dbraw/zinc/20/78/51/352207851.db2.gz	JVKGOCHMARDGOO-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@H](C)C1	ZINC000026342619	352207852	/nfs/dbraw/zinc/20/78/52/352207852.db2.gz	JVKGOCHMARDGOO-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)NCCc2ccc([N+](=O)[O-])cc2)no1	ZINC000355622237	290952132	/nfs/dbraw/zinc/95/21/32/290952132.db2.gz	AZXGTCDGFBZNGD-UHFFFAOYSA-N	1	1	318.333	1.617	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000028922237	352233658	/nfs/dbraw/zinc/23/36/58/352233658.db2.gz	HGEKGTVOQDGRMY-OUCADQQQSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000028922237	352233660	/nfs/dbraw/zinc/23/36/60/352233660.db2.gz	HGEKGTVOQDGRMY-OUCADQQQSA-N	1	1	310.350	1.444	20	5		DDBDMO
CN1CCN(C(C)(C)C[NH2+]Cc2csc([N+](=O)[O-])c2)CC1	ZINC000037562654	352297027	/nfs/dbraw/zinc/29/70/27/352297027.db2.gz	GDBYNOGGXZUDOS-UHFFFAOYSA-N	1	1	312.439	1.772	20	5		DDBDMO
C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)NC(C)(C)C	ZINC000051590471	352590193	/nfs/dbraw/zinc/59/01/93/352590193.db2.gz	YHGPNOSINURYHE-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC(=O)NC(C)(C)C	ZINC000051590471	352590196	/nfs/dbraw/zinc/59/01/96/352590196.db2.gz	YHGPNOSINURYHE-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000052192971	352604714	/nfs/dbraw/zinc/60/47/14/352604714.db2.gz	MJPWNWZEOJJZBK-UHFFFAOYSA-N	1	1	304.306	1.295	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NCC[N@@H+]1CCc2sccc2C1	ZINC000053580113	352661596	/nfs/dbraw/zinc/66/15/96/352661596.db2.gz	AJBKJHDLCJKEQE-UHFFFAOYSA-N	1	1	307.379	1.860	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NCC[N@H+]1CCc2sccc2C1	ZINC000053580113	352661600	/nfs/dbraw/zinc/66/16/00/352661600.db2.gz	AJBKJHDLCJKEQE-UHFFFAOYSA-N	1	1	307.379	1.860	20	5		DDBDMO
Cc1ccccc1C[NH+]1CCC(NC(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000053968490	352674399	/nfs/dbraw/zinc/67/43/99/352674399.db2.gz	ABDUDTMYONNUPN-JKSUJKDBSA-N	1	1	317.389	1.741	20	5		DDBDMO
COCCN1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000055900432	352749232	/nfs/dbraw/zinc/74/92/32/352749232.db2.gz	YYUSVMULRXZQER-UHFFFAOYSA-N	1	1	323.393	1.628	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000066149656	352980192	/nfs/dbraw/zinc/98/01/92/352980192.db2.gz	FUMGNXZAWJCOPP-NSHDSACASA-N	1	1	311.386	1.373	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000065810381	352964592	/nfs/dbraw/zinc/96/45/92/352964592.db2.gz	CAEXXPMZBLMITQ-UHFFFAOYSA-N	1	1	321.312	1.641	20	5		DDBDMO
O=C1[C@H]([NH+]2CCC(CO)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000067377214	353045993	/nfs/dbraw/zinc/04/59/93/353045993.db2.gz	ZZLUJCLDZNPYMJ-OAHLLOKOSA-N	1	1	319.361	1.404	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@H](C)[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000068195973	353095518	/nfs/dbraw/zinc/09/55/18/353095518.db2.gz	DCGFADAGLZPPHE-NSHDSACASA-N	1	1	321.377	1.745	20	5		DDBDMO
CCc1ccc(C(=O)NCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000173998363	198278770	/nfs/dbraw/zinc/27/87/70/198278770.db2.gz	KBEGEIMJVFNPFZ-UHFFFAOYSA-N	1	1	321.377	1.609	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1	ZINC000074074008	353289426	/nfs/dbraw/zinc/28/94/26/353289426.db2.gz	WBQLHEXWVFULBK-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
CCN1CC[NH+](CCCNc2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000074740456	353327807	/nfs/dbraw/zinc/32/78/07/353327807.db2.gz	GGUOUHPVIVRLNB-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
CC[N@@H+](CCc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174736478	198378425	/nfs/dbraw/zinc/37/84/25/198378425.db2.gz	NYOJPIKNUKLFGG-INIZCTEOSA-N	1	1	318.377	1.717	20	5		DDBDMO
Cc1c(C[N@@H+](C)C[C@H](O)CN2CCOCC2)cccc1[N+](=O)[O-]	ZINC000083244978	353709125	/nfs/dbraw/zinc/70/91/25/353709125.db2.gz	ZEZWHDJFHOANEX-HNNXBMFYSA-N	1	1	323.393	1.028	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCC[C@H](CO)CC2)c1	ZINC000293114307	354454088	/nfs/dbraw/zinc/45/40/88/354454088.db2.gz	LVKSBXOYNPTBIA-ZFWWWQNUSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H](O)C1CC1	ZINC000305239886	354469855	/nfs/dbraw/zinc/46/98/55/354469855.db2.gz	QLOPQBJCUKUMRD-HNNXBMFYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H](O)C1CC1	ZINC000305239886	354469858	/nfs/dbraw/zinc/46/98/58/354469858.db2.gz	QLOPQBJCUKUMRD-HNNXBMFYSA-N	1	1	319.361	1.187	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+]3CCC[C@@H]3C2)c1	ZINC000316903138	354506953	/nfs/dbraw/zinc/50/69/53/354506953.db2.gz	PAOXBICMQAWGIS-GFCCVEGCSA-N	1	1	305.334	1.666	20	5		DDBDMO
[NH3+]CC1(CCNS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000404618120	354676665	/nfs/dbraw/zinc/67/66/65/354676665.db2.gz	UXZBMHVMSYKGFI-UHFFFAOYSA-N	1	1	317.342	1.141	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)C[N@H+]1C1CC1	ZINC000589584122	355002105	/nfs/dbraw/zinc/00/21/05/355002105.db2.gz	GCANXYHTCVQIKG-SKDRFNHKSA-N	1	1	306.366	1.706	20	5		DDBDMO
C[C@H](C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1	ZINC000590045606	355043353	/nfs/dbraw/zinc/04/33/53/355043353.db2.gz	SKKDWERJXVPTKH-CORIIIEPSA-N	1	1	303.362	1.861	20	5		DDBDMO
Cc1cc(S(=O)(=O)NCC[N@H+](C)C2CC2)c([N+](=O)[O-])s1	ZINC000601317784	358493308	/nfs/dbraw/zinc/49/33/08/358493308.db2.gz	CJEBLOLZEXTJHB-UHFFFAOYSA-N	1	1	319.408	1.337	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000590763173	355171030	/nfs/dbraw/zinc/17/10/30/355171030.db2.gz	PFROAHRSGSYUOW-INIZCTEOSA-N	1	1	324.377	1.695	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2C[N@H+](C)C[C@H]21	ZINC000591534392	355324369	/nfs/dbraw/zinc/32/43/69/355324369.db2.gz	AHTTUCVQQBOUDM-IUODEOHRSA-N	1	1	303.362	1.988	20	5		DDBDMO
Cc1nc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])cs1	ZINC000591729005	355373725	/nfs/dbraw/zinc/37/37/25/355373725.db2.gz	CRRXEDVOKMDAGD-GFCCVEGCSA-N	1	1	323.374	1.889	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([C@@H]3CCC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256422	355548287	/nfs/dbraw/zinc/54/82/87/355548287.db2.gz	YYVKIUTXUBTMKW-VXGBXAGGSA-N	1	1	321.381	1.478	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000593017115	355771422	/nfs/dbraw/zinc/77/14/22/355771422.db2.gz	DRUQDWUFQOVUPM-TZMCWYRMSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000593017115	355771426	/nfs/dbraw/zinc/77/14/26/355771426.db2.gz	DRUQDWUFQOVUPM-TZMCWYRMSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000593017115	355771431	/nfs/dbraw/zinc/77/14/31/355771431.db2.gz	DRUQDWUFQOVUPM-TZMCWYRMSA-N	1	1	305.382	1.570	20	5		DDBDMO
CC[C@@H]1COC(C)(C)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000593058445	355782437	/nfs/dbraw/zinc/78/24/37/355782437.db2.gz	MFFZKZYJXOIWHI-GFCCVEGCSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@@H]1COC(C)(C)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000593058445	355782441	/nfs/dbraw/zinc/78/24/41/355782441.db2.gz	MFFZKZYJXOIWHI-GFCCVEGCSA-N	1	1	309.366	1.646	20	5		DDBDMO
C[C@H](CCO)[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000593107005	355800276	/nfs/dbraw/zinc/80/02/76/355800276.db2.gz	DCPFIBUEQJPUTQ-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@H](CCO)[N@@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000593107005	355800281	/nfs/dbraw/zinc/80/02/81/355800281.db2.gz	DCPFIBUEQJPUTQ-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(ccnc2N2CC([N@H+]3CC[C@@H](O)C3)C2)c1	ZINC000593505926	355907699	/nfs/dbraw/zinc/90/76/99/355907699.db2.gz	YMUMVCNTQYCPDT-CQSZACIVSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000593485966	355900506	/nfs/dbraw/zinc/90/05/06/355900506.db2.gz	DRZSJBMUUCYXHG-MFKMUULPSA-N	1	1	309.341	1.875	20	5		DDBDMO
C[C@@H](O)C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000594055360	356101631	/nfs/dbraw/zinc/10/16/31/356101631.db2.gz	KZDXKESHWMJTCX-RISCZKNCSA-N	1	1	310.350	1.180	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000594584484	356256058	/nfs/dbraw/zinc/25/60/58/356256058.db2.gz	DPNDOEMVGYTNEG-GFCCVEGCSA-N	1	1	324.381	1.280	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000594584484	356256060	/nfs/dbraw/zinc/25/60/60/356256060.db2.gz	DPNDOEMVGYTNEG-GFCCVEGCSA-N	1	1	324.381	1.280	20	5		DDBDMO
O=C(C[NH2+][C@@H]1CCCn2nccc21)Nc1ccccc1[N+](=O)[O-]	ZINC000595012792	356372449	/nfs/dbraw/zinc/37/24/49/356372449.db2.gz	OIOYNHOAHSTGPW-LLVKDONJSA-N	1	1	315.333	1.855	20	5		DDBDMO
Cc1noc(C[N@@H+](C)[C@H](CO)Cc2ccccc2)c1[N+](=O)[O-]	ZINC000595591807	356566033	/nfs/dbraw/zinc/56/60/33/356566033.db2.gz	KRISDRATOPWZFL-ZDUSSCGKSA-N	1	1	305.334	1.927	20	5		DDBDMO
Cc1noc(C[N@H+](C)[C@H](CO)Cc2ccccc2)c1[N+](=O)[O-]	ZINC000595591807	356566037	/nfs/dbraw/zinc/56/60/37/356566037.db2.gz	KRISDRATOPWZFL-ZDUSSCGKSA-N	1	1	305.334	1.927	20	5		DDBDMO
C[C@H](CO)[C@@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595679781	356608071	/nfs/dbraw/zinc/60/80/71/356608071.db2.gz	YCZWQXSMSAQCKQ-RISCZKNCSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@@H](CO)[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595679067	356606769	/nfs/dbraw/zinc/60/67/69/356606769.db2.gz	UTICLVPURXOESR-GXTWGEPZSA-N	1	1	309.366	1.239	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cc1cc([N+](=O)[O-])cc3c1OCOC3)C2	ZINC000595760623	356642057	/nfs/dbraw/zinc/64/20/57/356642057.db2.gz	UWYPFBDHFMEFMV-CJNGLKHVSA-N	1	1	320.345	1.930	20	5		DDBDMO
C[C@H]1COC2(CCCC2)C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000595816414	356662132	/nfs/dbraw/zinc/66/21/32/356662132.db2.gz	WZMKQJBKGLOCLA-GXTWGEPZSA-N	1	1	324.381	1.186	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1	ZINC000595867506	356684952	/nfs/dbraw/zinc/68/49/52/356684952.db2.gz	NOESAXJUQZPLHU-MRXNPFEDSA-N	1	1	305.378	1.626	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595873318	356686582	/nfs/dbraw/zinc/68/65/82/356686582.db2.gz	LLJFXEFQABKQIV-WBMJQRKESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595873318	356686586	/nfs/dbraw/zinc/68/65/86/356686586.db2.gz	LLJFXEFQABKQIV-WBMJQRKESA-N	1	1	321.377	1.792	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNS(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000276920201	213176034	/nfs/dbraw/zinc/17/60/34/213176034.db2.gz	OLSQZTOETSDQKG-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC000596146669	356791285	/nfs/dbraw/zinc/79/12/85/356791285.db2.gz	GVQHFHOUTSFLNJ-GFCCVEGCSA-N	1	1	306.366	1.864	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CCn3cc[nH+]c3C2)ccc1[N+](=O)[O-]	ZINC000596199689	356811087	/nfs/dbraw/zinc/81/10/87/356811087.db2.gz	FKQBPQWYYQTALW-JTQLQIEISA-N	1	1	301.306	1.317	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596257505	356835239	/nfs/dbraw/zinc/83/52/39/356835239.db2.gz	PCUWOVRNECHJDS-LLVKDONJSA-N	1	1	306.366	1.614	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1CO	ZINC000598643497	357666314	/nfs/dbraw/zinc/66/63/14/357666314.db2.gz	LMUYIPKAVOKOKM-IPYPFGDCSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000599139026	357826996	/nfs/dbraw/zinc/82/69/96/357826996.db2.gz	MQHREJKANJCWNA-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
CCOC(=O)C[C@H](O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000599412831	357925692	/nfs/dbraw/zinc/92/56/92/357925692.db2.gz	OWWAEGBLIQTIMQ-ZDUSSCGKSA-N	1	1	310.350	1.383	20	5		DDBDMO
C[C@]1(CO)C[N@@H+](Cc2c(F)cccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000599624924	357997367	/nfs/dbraw/zinc/99/73/67/357997367.db2.gz	ZCBOVWYKYIZLSY-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
C[C@]1(CO)C[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000599624924	357997372	/nfs/dbraw/zinc/99/73/72/357997372.db2.gz	ZCBOVWYKYIZLSY-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H]1C[C@@H](O)C1	ZINC000599668959	358016985	/nfs/dbraw/zinc/01/69/85/358016985.db2.gz	AHNNDDWISJDXIS-GSJFWJNXSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C[C@H]1C[C@@H](O)C1	ZINC000599668959	358016987	/nfs/dbraw/zinc/01/69/87/358016987.db2.gz	AHNNDDWISJDXIS-GSJFWJNXSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000599937115	358085422	/nfs/dbraw/zinc/08/54/22/358085422.db2.gz	DTRFOQPGDIQBCH-OCCSQVGLSA-N	1	1	323.324	1.015	20	5		DDBDMO
CC[N@H+](CCN)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000600717552	358293678	/nfs/dbraw/zinc/29/36/78/358293678.db2.gz	QUUQAZNJKQAUFO-UHFFFAOYSA-N	1	1	310.354	1.213	20	5		DDBDMO
CC[N@@H+](CCN)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000600717552	358293684	/nfs/dbraw/zinc/29/36/84/358293684.db2.gz	QUUQAZNJKQAUFO-UHFFFAOYSA-N	1	1	310.354	1.213	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000600808457	358320174	/nfs/dbraw/zinc/32/01/74/358320174.db2.gz	OYFCNKOISNKTEH-LBPRGKRZSA-N	1	1	313.741	1.045	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCCc3nnc4n3CCC4)c2c1	ZINC000601101893	358403108	/nfs/dbraw/zinc/40/31/08/358403108.db2.gz	WXHRYRQQDFDZDJ-UHFFFAOYSA-N	1	1	324.344	1.757	20	5		DDBDMO
O=C(CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12)N1CCCCC1	ZINC000601104284	358403519	/nfs/dbraw/zinc/40/35/19/358403519.db2.gz	RIHPFSDKRONICA-UHFFFAOYSA-N	1	1	314.345	1.989	20	5		DDBDMO
CN1CC[C@@H]([NH+]2CCC(Nc3sccc3[N+](=O)[O-])CC2)C1=O	ZINC000601177571	358435786	/nfs/dbraw/zinc/43/57/86/358435786.db2.gz	XEGKBUHYKBCCLX-GFCCVEGCSA-N	1	1	324.406	1.763	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCC[C@]3(O)CCCOC3)c2c1	ZINC000601184622	358438225	/nfs/dbraw/zinc/43/82/25/358438225.db2.gz	MUGPBEIFTCFCLW-MRXNPFEDSA-N	1	1	317.345	1.908	20	5		DDBDMO
CC[NH+]1CCN(C(=O)CNc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000181037775	199243202	/nfs/dbraw/zinc/24/32/02/199243202.db2.gz	IQKYCCALFPHRSY-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)C[C@@H]1CC[N@@H+](C)C1	ZINC000602073715	358801748	/nfs/dbraw/zinc/80/17/48/358801748.db2.gz	OJWIWQDPTMTPPW-NSHDSACASA-N	1	1	307.350	1.561	20	5		DDBDMO
C[S@@](=O)C1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000602655357	359104805	/nfs/dbraw/zinc/10/48/05/359104805.db2.gz	JXEVKFLBIPAGTK-OAQYLSRUSA-N	1	1	309.347	1.737	20	5		DDBDMO
COC(=O)C(C)(C)[C@@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602598445	359063039	/nfs/dbraw/zinc/06/30/39/359063039.db2.gz	ZCDJAQOOICFFHT-GFCCVEGCSA-N	1	1	324.381	1.740	20	5		DDBDMO
COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602598445	359063042	/nfs/dbraw/zinc/06/30/42/359063042.db2.gz	ZCDJAQOOICFFHT-GFCCVEGCSA-N	1	1	324.381	1.740	20	5		DDBDMO
COC(=O)COc1ccc(C[NH+]2CC(C)(C)C2)cc1[N+](=O)[O-]	ZINC000602751864	359169291	/nfs/dbraw/zinc/16/92/91/359169291.db2.gz	LRLKQSKVTVWZNC-UHFFFAOYSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602792802	359195657	/nfs/dbraw/zinc/19/56/57/359195657.db2.gz	COOYBKKAGPOJKV-YNEHKIRRSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)CC[N@@H+](C)C1CC1	ZINC000186744402	200002087	/nfs/dbraw/zinc/00/20/87/200002087.db2.gz	LDAJJRSCQMRKSL-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1NC[C@]1(CO)COCC[NH2+]1	ZINC000603418971	359628779	/nfs/dbraw/zinc/62/87/79/359628779.db2.gz	JXZUICYPISNVGP-LBPRGKRZSA-N	1	1	301.730	1.011	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000187041794	200051452	/nfs/dbraw/zinc/05/14/52/200051452.db2.gz	OYZNXPGTUOUNDN-LLVKDONJSA-N	1	1	322.365	1.546	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000604278139	359731758	/nfs/dbraw/zinc/73/17/58/359731758.db2.gz	JXKPDZXSASKZFK-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCC[N@H+](C)C1	ZINC000604278139	359731759	/nfs/dbraw/zinc/73/17/59/359731759.db2.gz	JXKPDZXSASKZFK-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NCC[N@H+]1CCCOCC1	ZINC000188501721	200257369	/nfs/dbraw/zinc/25/73/69/200257369.db2.gz	LCCLTQDHQRTPKE-UHFFFAOYSA-N	1	1	309.366	1.875	20	5		DDBDMO
CC1(C)CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+]1CCO	ZINC000618585345	363682524	/nfs/dbraw/zinc/68/25/24/363682524.db2.gz	ADATTXVWKMAFJX-UHFFFAOYSA-N	1	1	319.365	1.364	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@H]2CCCOC2)CC1	ZINC000610570056	360472603	/nfs/dbraw/zinc/47/26/03/360472603.db2.gz	SBAYFLBXGMFMGH-HNNXBMFYSA-N	1	1	319.361	1.532	20	5		DDBDMO
Cc1c(C(=O)N2CC[NH+](C(C)(C)CO)CC2)cccc1[N+](=O)[O-]	ZINC000611165909	360643179	/nfs/dbraw/zinc/64/31/79/360643179.db2.gz	IBYNZJQXBRDXKE-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000611525547	360747071	/nfs/dbraw/zinc/74/70/71/360747071.db2.gz	KEEGBZZHPRZSNQ-NSHDSACASA-N	1	1	308.382	1.813	20	5		DDBDMO
Cc1nn(C[C@H](O)C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-]	ZINC000611508422	360741218	/nfs/dbraw/zinc/74/12/18/360741218.db2.gz	FYQBMAJBLHZOSG-CQSZACIVSA-N	1	1	304.350	1.593	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)COc2ccc([N+](=O)[O-])cc2)CC1	ZINC000271969863	209347680	/nfs/dbraw/zinc/34/76/80/209347680.db2.gz	MPQDHBOOWYVKAN-UHFFFAOYSA-N	1	1	305.334	1.352	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@H](CCO)C1	ZINC000612070174	360909158	/nfs/dbraw/zinc/90/91/58/360909158.db2.gz	DAYJUXDTKYMMGY-KGLIPLIRSA-N	1	1	324.377	1.429	20	5		DDBDMO
COCC1([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000612110819	360923071	/nfs/dbraw/zinc/92/30/71/360923071.db2.gz	YIYXVOWGQGXLHK-GFCCVEGCSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(C1)NC(=O)NC2=O	ZINC000193474646	201057861	/nfs/dbraw/zinc/05/78/61/201057861.db2.gz	FTCVCYRWSUSMEW-OAHLLOKOSA-N	1	1	318.333	1.077	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1cc(N)ccc1[N+](=O)[O-]	ZINC000193485892	201061139	/nfs/dbraw/zinc/06/11/39/201061139.db2.gz	NPLLDVUEXOFDNY-UHFFFAOYSA-N	1	1	322.409	1.972	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C(=O)NCC[C@H]1C	ZINC000193633882	201091413	/nfs/dbraw/zinc/09/14/13/201091413.db2.gz	JMJVIXQRGVJDHE-ABAIWWIYSA-N	1	1	321.377	1.996	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000619578383	364070499	/nfs/dbraw/zinc/07/04/99/364070499.db2.gz	HAPQTGJOXYQHPT-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@H+](CCOC)C1	ZINC000264603652	204023089	/nfs/dbraw/zinc/02/30/89/204023089.db2.gz	NZPABKNCSPSSHY-AWEZNQCLSA-N	1	1	323.393	1.804	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN[C@H]1CC[N@@H+](CCOC)C1	ZINC000264603652	204023094	/nfs/dbraw/zinc/02/30/94/204023094.db2.gz	NZPABKNCSPSSHY-AWEZNQCLSA-N	1	1	323.393	1.804	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000264683938	204077279	/nfs/dbraw/zinc/07/72/79/204077279.db2.gz	LFYNKGWMZAZFTH-CQSZACIVSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000264662031	204060584	/nfs/dbraw/zinc/06/05/84/204060584.db2.gz	IUSDWRGZJSJFBV-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
CC[NH+](CC)C[C@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1	ZINC000266309774	205256369	/nfs/dbraw/zinc/25/63/69/205256369.db2.gz	NUHYABMXWZGRFH-LLVKDONJSA-N	1	1	309.370	1.430	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)C(C)(C)c3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000351590020	284397691	/nfs/dbraw/zinc/39/76/91/284397691.db2.gz	POQGOUMFMCDUNK-BETUJISGSA-N	1	1	317.389	1.892	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-]	ZINC000269104754	207243408	/nfs/dbraw/zinc/24/34/08/207243408.db2.gz	BLXKJRCGHSHNLZ-RYUDHWBXSA-N	1	1	321.381	1.193	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCNC(=O)CC1	ZINC000065955327	184383956	/nfs/dbraw/zinc/38/39/56/184383956.db2.gz	LRRDUTAIGJUJAV-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000352432627	285046677	/nfs/dbraw/zinc/04/66/77/285046677.db2.gz	UNNYFBNGQXKARM-JTQLQIEISA-N	1	1	321.333	1.490	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+](CCO)CC3CC3)n2)cc1	ZINC000352464996	285069940	/nfs/dbraw/zinc/06/99/40/285069940.db2.gz	ZVEDRHBLBZNAHI-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+](CCO)CC3CC3)n2)cc1	ZINC000352464996	285069941	/nfs/dbraw/zinc/06/99/41/285069941.db2.gz	ZVEDRHBLBZNAHI-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000286329487	218921005	/nfs/dbraw/zinc/92/10/05/218921005.db2.gz	VETPNMWUMZHINY-FUNVUKJBSA-N	1	1	321.381	1.183	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1cccs1	ZINC000158986604	197315942	/nfs/dbraw/zinc/31/59/42/197315942.db2.gz	VOYFWODXDZUECJ-QMMMGPOBSA-N	1	1	309.351	1.412	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000352546494	285131290	/nfs/dbraw/zinc/13/12/90/285131290.db2.gz	WCQCUGSKJXQUIW-HNNXBMFYSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCNC(=O)NC(=O)[C@@H](C)[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352545000	285130093	/nfs/dbraw/zinc/13/00/93/285130093.db2.gz	UMYQOPDHALCGJL-LLVKDONJSA-N	1	1	322.365	1.303	20	5		DDBDMO
CCNC(=O)NC(=O)[C@@H](C)[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352545000	285130097	/nfs/dbraw/zinc/13/00/97/285130097.db2.gz	UMYQOPDHALCGJL-LLVKDONJSA-N	1	1	322.365	1.303	20	5		DDBDMO
COC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCO1	ZINC000434790407	533093897	/nfs/dbraw/zinc/09/38/97/533093897.db2.gz	UJXFIFFABINDMG-UONOGXRCSA-N	1	1	320.349	1.755	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@H]1O	ZINC000352657974	285201728	/nfs/dbraw/zinc/20/17/28/285201728.db2.gz	CPNFMVGJLPMTBJ-CHWSQXEVSA-N	1	1	318.333	1.990	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H]1CCC[C@H]1O	ZINC000352701039	285238879	/nfs/dbraw/zinc/23/88/79/285238879.db2.gz	VFZYMSKBJSTRFK-UONOGXRCSA-N	1	1	307.350	1.687	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000451539474	533415807	/nfs/dbraw/zinc/41/58/07/533415807.db2.gz	FISFUGJRPFNBHY-DUVNUKRYSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299503934	533665961	/nfs/dbraw/zinc/66/59/61/533665961.db2.gz	DPBYZWLSUSXWOT-JTQLQIEISA-N	1	1	323.397	1.867	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCC[N@@H+](CC2CCC2)CC1	ZINC000568487945	304295519	/nfs/dbraw/zinc/29/55/19/304295519.db2.gz	VFTOYSYVWQQVKY-UHFFFAOYSA-N	1	1	306.366	1.871	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@H](C)[NH+]2CC(C)C2)cc1[N+](=O)[O-]	ZINC000568998303	304328964	/nfs/dbraw/zinc/32/89/64/304328964.db2.gz	TVQWXUBOFJCOQV-LLVKDONJSA-N	1	1	307.350	1.560	20	5		DDBDMO
C[NH+]1CCC(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000035084501	406966852	/nfs/dbraw/zinc/96/68/52/406966852.db2.gz	AYOZAZTXLDVXTB-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000079670166	407060747	/nfs/dbraw/zinc/06/07/47/407060747.db2.gz	JPFJZVVRNBKJRE-CYBMUJFWSA-N	1	1	318.377	1.878	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000054987137	407192549	/nfs/dbraw/zinc/19/25/49/407192549.db2.gz	IPACYHGRJIEKNL-OAHLLOKOSA-N	1	1	303.362	1.880	20	5		DDBDMO
C[NH+]1CCC(Nc2cccc(S(C)(=O)=O)c2[N+](=O)[O-])CC1	ZINC000089619630	407141762	/nfs/dbraw/zinc/14/17/62/407141762.db2.gz	QRCALZJISWXMBS-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
CCOCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000111417010	407410141	/nfs/dbraw/zinc/41/01/41/407410141.db2.gz	QIFZYXILQNSDJH-UHFFFAOYSA-N	1	1	322.365	1.781	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H]1CCOC1	ZINC000178760043	407589761	/nfs/dbraw/zinc/58/97/61/407589761.db2.gz	FNNGOLQTRZYCFE-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
[NH3+]CC1(NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CCCC1	ZINC000261773737	407609716	/nfs/dbraw/zinc/60/97/16/407609716.db2.gz	WHXUPVMMJBELQS-UHFFFAOYSA-N	1	1	317.342	1.284	20	5		DDBDMO
COC(=O)C[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000179148131	407738244	/nfs/dbraw/zinc/73/82/44/407738244.db2.gz	UODBSBRXOLKICN-LBPRGKRZSA-N	1	1	321.333	1.221	20	5		DDBDMO
C[N@@H+](CC1(CO)CC1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000186785016	407770759	/nfs/dbraw/zinc/77/07/59/407770759.db2.gz	XPZOUEPNCITEKX-CQSZACIVSA-N	1	1	319.361	1.404	20	5		DDBDMO
CN(Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCC[N@@H+](C)C1	ZINC000118841581	407954770	/nfs/dbraw/zinc/95/47/70/407954770.db2.gz	RZPPKMJOWJODGK-GFCCVEGCSA-N	1	1	320.393	1.467	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000268261568	407976493	/nfs/dbraw/zinc/97/64/93/407976493.db2.gz	ZJLIJBMCKPXAKK-LDYMZIIASA-N	1	1	307.354	1.093	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000273121058	408064751	/nfs/dbraw/zinc/06/47/51/408064751.db2.gz	HMMOILAFVIHNSM-BZPMIXESSA-N	1	1	310.350	1.037	20	5		DDBDMO
COCCO[C@@H]1CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000189654327	408071093	/nfs/dbraw/zinc/07/10/93/408071093.db2.gz	AVYKJPSOWSAYPC-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000189654327	408071098	/nfs/dbraw/zinc/07/10/98/408071098.db2.gz	AVYKJPSOWSAYPC-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@H](CO)C1	ZINC000182171086	408086480	/nfs/dbraw/zinc/08/64/80/408086480.db2.gz	TYTJKUCFSCMHCS-STQMWFEESA-N	1	1	310.350	1.039	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000245949967	408110916	/nfs/dbraw/zinc/11/09/16/408110916.db2.gz	SKFHYYDRQXYOON-HOCLYGCPSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@]1(O)CCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000245949967	408110920	/nfs/dbraw/zinc/11/09/20/408110920.db2.gz	SKFHYYDRQXYOON-HOCLYGCPSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1	ZINC000246411860	408249871	/nfs/dbraw/zinc/24/98/71/408249871.db2.gz	KBFUXBNLXVTJJU-WCQYABFASA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2csc([N+](=O)[O-])c2)C[C@H]1N1CCOCC1	ZINC000246411860	408249878	/nfs/dbraw/zinc/24/98/78/408249878.db2.gz	KBFUXBNLXVTJJU-WCQYABFASA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@H]1CN(Cc2csc([N+](=O)[O-])c2)C[C@H]1[NH+]1CCOCC1	ZINC000246411860	408249882	/nfs/dbraw/zinc/24/98/82/408249882.db2.gz	KBFUXBNLXVTJJU-WCQYABFASA-N	1	1	311.407	1.809	20	5		DDBDMO
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC(F)(F)C[NH3+]	ZINC000190253576	408200269	/nfs/dbraw/zinc/20/02/69/408200269.db2.gz	CWLHQIZXACIOSH-QMMMGPOBSA-N	1	1	319.333	1.786	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1CCOCC1	ZINC000155951180	408226564	/nfs/dbraw/zinc/22/65/64/408226564.db2.gz	LOFZDICNQLRPCR-HNNXBMFYSA-N	1	1	324.377	1.693	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000176086472	408282630	/nfs/dbraw/zinc/28/26/30/408282630.db2.gz	VQQQHQIITQYYLO-SNVBAGLBSA-N	1	1	308.338	1.109	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CCS1	ZINC000247237139	408436102	/nfs/dbraw/zinc/43/61/02/408436102.db2.gz	DKFYHXZEQKVNIN-OLZOCXBDSA-N	1	1	314.411	1.226	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000270386475	408513284	/nfs/dbraw/zinc/51/32/84/408513284.db2.gz	RJHLFQJIERXJRQ-AWEZNQCLSA-N	1	1	308.382	1.830	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000264545899	408530060	/nfs/dbraw/zinc/53/00/60/408530060.db2.gz	OFBOKHXSEIYRIR-ZDUSSCGKSA-N	1	1	307.350	1.354	20	5		DDBDMO
CC[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C[C@H](C)O	ZINC000247438242	408469566	/nfs/dbraw/zinc/46/95/66/408469566.db2.gz	ZLMUXWNHUOOKLZ-ZFWWWQNUSA-N	1	1	307.394	1.872	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)C[C@H]2C1	ZINC000192474562	408596018	/nfs/dbraw/zinc/59/60/18/408596018.db2.gz	YWODBLIEMMBPJV-AOOOYVTPSA-N	1	1	315.333	1.105	20	5		DDBDMO
C[N@H+]1C[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@H]2C1	ZINC000192474562	408596023	/nfs/dbraw/zinc/59/60/23/408596023.db2.gz	YWODBLIEMMBPJV-AOOOYVTPSA-N	1	1	315.333	1.105	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@H]2C1	ZINC000192474562	408596027	/nfs/dbraw/zinc/59/60/27/408596027.db2.gz	YWODBLIEMMBPJV-AOOOYVTPSA-N	1	1	315.333	1.105	20	5		DDBDMO
Cc1ccnc(N(C)CCC[NH+]2CCN(C)CC2)c1[N+](=O)[O-]	ZINC000265272680	408598921	/nfs/dbraw/zinc/59/89/21/408598921.db2.gz	UZRMVNOORUMMCF-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177154555	408537516	/nfs/dbraw/zinc/53/75/16/408537516.db2.gz	XZBJJXOBUOCYFP-KOLCDFICSA-N	1	1	304.350	1.532	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000192532333	408605870	/nfs/dbraw/zinc/60/58/70/408605870.db2.gz	QMHAKDDIBYTJLU-LLVKDONJSA-N	1	1	305.334	1.524	20	5		DDBDMO
C[C@H]1C[N@H+](CC(C)(C)O)CCN1c1ncc([N+](=O)[O-])s1	ZINC000192542332	408609682	/nfs/dbraw/zinc/60/96/82/408609682.db2.gz	MIBLFJFPYHFMHP-VIFPVBQESA-N	1	1	300.384	1.333	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ncc([N+](=O)[O-])s1	ZINC000192542332	408609685	/nfs/dbraw/zinc/60/96/85/408609685.db2.gz	MIBLFJFPYHFMHP-VIFPVBQESA-N	1	1	300.384	1.333	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1CCC[C@@H]1O	ZINC000162490873	408707827	/nfs/dbraw/zinc/70/78/27/408707827.db2.gz	IIQRPQSOFIXUDC-INWMFGNUSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270859338	408712310	/nfs/dbraw/zinc/71/23/10/408712310.db2.gz	ZOOOJOXTTRFXPD-NSHDSACASA-N	1	1	309.370	1.323	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@H]1O	ZINC000249555503	408741966	/nfs/dbraw/zinc/74/19/66/408741966.db2.gz	JOIWIKXANJMOSS-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC[C@H]1O	ZINC000249555503	408741969	/nfs/dbraw/zinc/74/19/69/408741969.db2.gz	JOIWIKXANJMOSS-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000195197171	163312697	/nfs/dbraw/zinc/31/26/97/163312697.db2.gz	DQDURFPKVGMXDZ-HNNXBMFYSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C(NC1CC1)[C@@H]1CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000195197171	163312701	/nfs/dbraw/zinc/31/27/01/163312701.db2.gz	DQDURFPKVGMXDZ-HNNXBMFYSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c(Cl)c1	ZINC000227650796	163339453	/nfs/dbraw/zinc/33/94/53/163339453.db2.gz	JFLGLJUACKKVPX-KOLCDFICSA-N	1	1	312.757	1.918	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)C2(CO)CCC2)c([N+](=O)[O-])c1	ZINC000292179687	408995795	/nfs/dbraw/zinc/99/57/95/408995795.db2.gz	QMRKCURWXGAOFJ-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)C2(CO)CCC2)c([N+](=O)[O-])c1	ZINC000292179687	408995798	/nfs/dbraw/zinc/99/57/98/408995798.db2.gz	QMRKCURWXGAOFJ-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CCC[C@@]1(CO)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000277755317	409005795	/nfs/dbraw/zinc/00/57/95/409005795.db2.gz	LULBGMZOUHTLOJ-HNNXBMFYSA-N	1	1	309.366	1.384	20	5		DDBDMO
C[N@@H+]1CCN(CCNCc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000282327488	409035191	/nfs/dbraw/zinc/03/51/91/409035191.db2.gz	LIWAROWMNRRPFP-UHFFFAOYSA-N	1	1	306.410	1.710	20	5		DDBDMO
C[N@H+]1CCN(CCNCc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000282327488	409035194	/nfs/dbraw/zinc/03/51/94/409035194.db2.gz	LIWAROWMNRRPFP-UHFFFAOYSA-N	1	1	306.410	1.710	20	5		DDBDMO
O=c1[nH]c(NCC[N@@H+]2CC=CCC2)nc2ccc([N+](=O)[O-])cc21	ZINC000287949834	409121016	/nfs/dbraw/zinc/12/10/16/409121016.db2.gz	YHBFIYUXILGNFO-UHFFFAOYSA-N	1	1	315.333	1.917	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000295502655	409319446	/nfs/dbraw/zinc/31/94/46/409319446.db2.gz	PIEMXRPWXIXDQC-ZDUSSCGKSA-N	1	1	307.350	1.171	20	5		DDBDMO
COC(=O)[C@@H](C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000280678684	409406377	/nfs/dbraw/zinc/40/63/77/409406377.db2.gz	GLNXYZKPJVDQFH-LLVKDONJSA-N	1	1	323.349	1.725	20	5		DDBDMO
COC(=O)[C@@H](C)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000280678684	409406382	/nfs/dbraw/zinc/40/63/82/409406382.db2.gz	GLNXYZKPJVDQFH-LLVKDONJSA-N	1	1	323.349	1.725	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000295283066	409413744	/nfs/dbraw/zinc/41/37/44/409413744.db2.gz	TUVPMUSYVZNGLE-AWEZNQCLSA-N	1	1	310.329	1.167	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000295283069	409414915	/nfs/dbraw/zinc/41/49/15/409414915.db2.gz	TUVPMUSYVZNGLE-CQSZACIVSA-N	1	1	310.329	1.167	20	5		DDBDMO
COCCOC[C@@H](O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000295299179	409420253	/nfs/dbraw/zinc/42/02/53/409420253.db2.gz	JXPQGKOYLOSRIS-HNNXBMFYSA-N	1	1	312.366	1.093	20	5		DDBDMO
COc1ccc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000295323750	409435875	/nfs/dbraw/zinc/43/58/75/409435875.db2.gz	XAUPUVOBVRTMMU-CQSZACIVSA-N	1	1	311.313	1.377	20	5		DDBDMO
C[C@]1(F)C[NH2+]CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000295331525	409437514	/nfs/dbraw/zinc/43/75/14/409437514.db2.gz	XOOGBIHLTJPDND-AWEZNQCLSA-N	1	1	311.313	1.134	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2C[N@@H+](C)CCN2C)c1	ZINC000322499186	164046652	/nfs/dbraw/zinc/04/66/52/164046652.db2.gz	DAYWAOMJMLQIMJ-GFCCVEGCSA-N	1	1	322.365	1.039	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]2OCC[N@@H+](C)[C@@H]2C1	ZINC000408028971	164202579	/nfs/dbraw/zinc/20/25/79/164202579.db2.gz	VMODWNOVYOAALR-NEPJUHHUSA-N	1	1	309.370	1.029	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCC[C@](O)(Cn3ccnn3)C2)cs1	ZINC000285582705	409496540	/nfs/dbraw/zinc/49/65/40/409496540.db2.gz	SUSLRYKPOZUYAI-CYBMUJFWSA-N	1	1	323.378	1.275	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@](O)(Cn3ccnn3)C2)cs1	ZINC000285582705	409496541	/nfs/dbraw/zinc/49/65/41/409496541.db2.gz	SUSLRYKPOZUYAI-CYBMUJFWSA-N	1	1	323.378	1.275	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356728514	409557634	/nfs/dbraw/zinc/55/76/34/409557634.db2.gz	FEOUQDHGNLNESO-CMPLNLGQSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NCC[N@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000337940580	409586062	/nfs/dbraw/zinc/58/60/62/409586062.db2.gz	LFTDLVTUACMKQX-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000356902459	409706733	/nfs/dbraw/zinc/70/67/33/409706733.db2.gz	OBNIIWBQXAHEPV-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000356902459	409706740	/nfs/dbraw/zinc/70/67/40/409706740.db2.gz	OBNIIWBQXAHEPV-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000356843268	409656919	/nfs/dbraw/zinc/65/69/19/409656919.db2.gz	GIBLQKDZLQTATP-CHWSQXEVSA-N	1	1	320.393	1.582	20	5		DDBDMO
COCCOC[C@@H](O)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000296851640	409666351	/nfs/dbraw/zinc/66/63/51/409666351.db2.gz	UJZQQMCCVXTDPZ-INIZCTEOSA-N	1	1	324.377	1.583	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(CCCC[NH+]3CCOCC3)n2)o1	ZINC000351140697	410040655	/nfs/dbraw/zinc/04/06/55/410040655.db2.gz	BXTUORPYBIUFBO-UHFFFAOYSA-N	1	1	322.321	1.893	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)N2CCC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000298087951	410109032	/nfs/dbraw/zinc/10/90/32/410109032.db2.gz	PZWPFJRQRDEMLI-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[N@@H+](C)CC1	ZINC000298642896	410327153	/nfs/dbraw/zinc/32/71/53/410327153.db2.gz	RVFUXRIOZCZBOE-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2N)C[C@@H]1C	ZINC000351940183	410354109	/nfs/dbraw/zinc/35/41/09/410354109.db2.gz	ZUCYTKUUCNAYSQ-UWVGGRQHSA-N	1	1	307.354	1.127	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347004173	410306294	/nfs/dbraw/zinc/30/62/94/410306294.db2.gz	BGCTZCGMAQWNFM-CYBMUJFWSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343459817	410471406	/nfs/dbraw/zinc/47/14/06/410471406.db2.gz	SHYHHJKYZNGYOU-FZMZJTMJSA-N	1	1	307.350	1.573	20	5		DDBDMO
CC(C)[N@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H](C)O	ZINC000343511143	410499998	/nfs/dbraw/zinc/49/99/98/410499998.db2.gz	NCZAJAZJKPNJRE-QWHCGFSZSA-N	1	1	312.366	1.426	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+](CCO)[C@H](C)C1	ZINC000347387459	410514153	/nfs/dbraw/zinc/51/41/53/410514153.db2.gz	ZWBCDWJGGLZYMM-BAAYTWLHSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCN(CCO)[C@H](C)C1	ZINC000347387459	410514164	/nfs/dbraw/zinc/51/41/64/410514164.db2.gz	ZWBCDWJGGLZYMM-BAAYTWLHSA-N	1	1	319.405	1.997	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCN(CCO)[C@H](C)C1	ZINC000347387459	410514167	/nfs/dbraw/zinc/51/41/67/410514167.db2.gz	ZWBCDWJGGLZYMM-BAAYTWLHSA-N	1	1	319.405	1.997	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000299210922	410569316	/nfs/dbraw/zinc/56/93/16/410569316.db2.gz	CUKTUDNTPCVFLW-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[C@H]1[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@@H+]1C	ZINC000343962358	410849451	/nfs/dbraw/zinc/84/94/51/410849451.db2.gz	BXKSCESVHMZYQB-GXFFZTMASA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@H]1[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343962358	410849456	/nfs/dbraw/zinc/84/94/56/410849456.db2.gz	BXKSCESVHMZYQB-GXFFZTMASA-N	1	1	313.379	1.356	20	5		DDBDMO
CCn1cc(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cn1	ZINC000348318992	410916424	/nfs/dbraw/zinc/91/64/24/410916424.db2.gz	KVRSBDMWIWKUIY-UHFFFAOYSA-N	1	1	301.350	1.807	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)c1	ZINC000339329518	306735824	/nfs/dbraw/zinc/73/58/24/306735824.db2.gz	RWDOWLRFFWZHFZ-MELADBBJSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CCS(=O)(=O)C1	ZINC000353774883	411127878	/nfs/dbraw/zinc/12/78/78/411127878.db2.gz	JIAWSDCAUJVRPY-BPJJOFIESA-N	1	1	324.402	1.975	20	5		DDBDMO
C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1CCS(=O)(=O)C1	ZINC000353774883	411127880	/nfs/dbraw/zinc/12/78/80/411127880.db2.gz	JIAWSDCAUJVRPY-BPJJOFIESA-N	1	1	324.402	1.975	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362073541	307012916	/nfs/dbraw/zinc/01/29/16/307012916.db2.gz	XNAXAFUMIYSNRX-NWDGAFQWSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362073541	307012917	/nfs/dbraw/zinc/01/29/17/307012917.db2.gz	XNAXAFUMIYSNRX-NWDGAFQWSA-N	1	1	307.350	1.402	20	5		DDBDMO
O=[N+]([O-])c1cnn([C@@H]2CCC[N@@H+](CCCn3ccnc3)C2)c1	ZINC000373581163	418442266	/nfs/dbraw/zinc/44/22/66/418442266.db2.gz	DLFGYDZYNYUHGP-CYBMUJFWSA-N	1	1	304.354	1.715	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000373795777	418460605	/nfs/dbraw/zinc/46/06/05/418460605.db2.gz	GCQQIUNHGYKOJF-OAHLLOKOSA-N	1	1	324.381	1.451	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC[C@@H]2c2ccccc2F)c1	ZINC000374109415	418489176	/nfs/dbraw/zinc/48/91/76/418489176.db2.gz	VBTOGBUXQVWPTJ-IUODEOHRSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]2c2ccccc2F)c1	ZINC000374109415	418489177	/nfs/dbraw/zinc/48/91/77/418489177.db2.gz	VBTOGBUXQVWPTJ-IUODEOHRSA-N	1	1	320.324	1.738	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)n1	ZINC000191678737	222107570	/nfs/dbraw/zinc/10/75/70/222107570.db2.gz	WECAAVLCWGPBQZ-VXGBXAGGSA-N	1	1	321.381	1.368	20	5		DDBDMO
CCOC1CC2(C1)CC[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000367601680	418614232	/nfs/dbraw/zinc/61/42/32/418614232.db2.gz	GVZREIODRASKTQ-NFOMZHRRSA-N	1	1	324.381	1.043	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1[C@@H]1CCCO1	ZINC000367724745	418627618	/nfs/dbraw/zinc/62/76/18/418627618.db2.gz	HFQBKASWMWDLAD-IHRRRGAJSA-N	1	1	324.381	1.042	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CCN1C[C@H]2CC[C@@H](C1)O2	ZINC000375628048	418666130	/nfs/dbraw/zinc/66/61/30/418666130.db2.gz	APAVTBIDDIQSDH-IYBDPMFKSA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@@H+](CCO)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000361588127	418687082	/nfs/dbraw/zinc/68/70/82/418687082.db2.gz	XQZHCFNGGAAHAH-CJNGLKHVSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C1NC[C@]2(CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)O1	ZINC000364787900	418810638	/nfs/dbraw/zinc/81/06/38/418810638.db2.gz	JAKKZRVUJNSOGK-HNNXBMFYSA-N	1	1	321.333	1.548	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCO[C@H]2CCC[C@H]21	ZINC000372352674	418860059	/nfs/dbraw/zinc/86/00/59/418860059.db2.gz	ZYEKAFWAMKQYQB-KGLIPLIRSA-N	1	1	307.350	1.400	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](C3CCCC3)C2)c1	ZINC000420966307	419388918	/nfs/dbraw/zinc/38/89/18/419388918.db2.gz	VBLOFDOAZGSXIY-HIFRSBDPSA-N	1	1	308.382	1.664	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H]3CCO)n2)c1	ZINC000426200170	419402083	/nfs/dbraw/zinc/40/20/83/419402083.db2.gz	VZTAEKORWPZOBX-LBPRGKRZSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000421002857	419438153	/nfs/dbraw/zinc/43/81/53/419438153.db2.gz	BTVXYPXAHKXSEJ-RISCZKNCSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000421002857	419438161	/nfs/dbraw/zinc/43/81/61/419438161.db2.gz	BTVXYPXAHKXSEJ-RISCZKNCSA-N	1	1	319.361	1.329	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CC[C@@]23CCOC3)c([N+](=O)[O-])c1	ZINC000421018712	419453773	/nfs/dbraw/zinc/45/37/73/419453773.db2.gz	LPUUIEKKDYALOF-HNNXBMFYSA-N	1	1	308.334	1.847	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@]23CCOC3)c([N+](=O)[O-])c1	ZINC000421018712	419453778	/nfs/dbraw/zinc/45/37/78/419453778.db2.gz	LPUUIEKKDYALOF-HNNXBMFYSA-N	1	1	308.334	1.847	20	5		DDBDMO
COc1cc(C[NH2+]CC2(N(C)C)CC2)c([N+](=O)[O-])cc1OC	ZINC000418110669	419538517	/nfs/dbraw/zinc/53/85/17/419538517.db2.gz	CHBHTTGBQLANQP-UHFFFAOYSA-N	1	1	309.366	1.796	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000412040780	419580888	/nfs/dbraw/zinc/58/08/88/419580888.db2.gz	KOTBOXWRTBVDEL-KWCYVHTRSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1ccc(C)c(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000429299015	419998724	/nfs/dbraw/zinc/99/87/24/419998724.db2.gz	FLPJYTHNUMXETE-INIZCTEOSA-N	1	1	318.377	1.901	20	5		DDBDMO
CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CNCCO2)cc1[N+](=O)[O-]	ZINC000423550556	420079413	/nfs/dbraw/zinc/07/94/13/420079413.db2.gz	FQCURCUGPJNMRL-AAEUAGOBSA-N	1	1	309.366	1.633	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H]1CCN(C(C)=O)C1	ZINC000430209443	420090444	/nfs/dbraw/zinc/09/04/44/420090444.db2.gz	XWAXUZWUEATYNV-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1CN	ZINC000420283564	420180505	/nfs/dbraw/zinc/18/05/05/420180505.db2.gz	CDIYZEASHPRQLL-IUODEOHRSA-N	1	1	320.393	1.983	20	5		DDBDMO
CC(C)(C)[C@H](C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000423959077	420284542	/nfs/dbraw/zinc/28/45/42/420284542.db2.gz	RCQPTLPBJCXXGR-NSHDSACASA-N	1	1	305.338	1.574	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420593918	420325723	/nfs/dbraw/zinc/32/57/23/420325723.db2.gz	CLZYENCOXISVQT-GFCCVEGCSA-N	1	1	320.393	1.862	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](c4nnc[nH]4)C3)nc2c1	ZINC000425555121	420417683	/nfs/dbraw/zinc/41/76/83/420417683.db2.gz	XKISTDSHLXGQEI-SECBINFHSA-N	1	1	313.321	1.579	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@H](c4nnc[nH]4)C3)nc2c1	ZINC000425555121	420417685	/nfs/dbraw/zinc/41/76/85/420417685.db2.gz	XKISTDSHLXGQEI-SECBINFHSA-N	1	1	313.321	1.579	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)[C@@H](C)O1	ZINC000446082133	230231742	/nfs/dbraw/zinc/23/17/42/230231742.db2.gz	OPSKCYWUFPYRPF-COMQUAJESA-N	1	1	324.377	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)[C@@H](C)O1	ZINC000446082133	230231746	/nfs/dbraw/zinc/23/17/46/230231746.db2.gz	OPSKCYWUFPYRPF-COMQUAJESA-N	1	1	324.377	1.832	20	5		DDBDMO
COc1cccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000438786477	420465785	/nfs/dbraw/zinc/46/57/85/420465785.db2.gz	YMHPKXXFIWLTHO-CQSZACIVSA-N	1	1	320.349	1.293	20	5		DDBDMO
CCN1CC[NH+](CC(C)(C)Nc2ccc([N+](=O)[O-])cn2)CC1	ZINC000450921190	420561632	/nfs/dbraw/zinc/56/16/32/420561632.db2.gz	FITABUYSZGRFSX-UHFFFAOYSA-N	1	1	307.398	1.818	20	5		DDBDMO
CCC[C@@H]1C[NH2+]CCN1S(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000440863778	420615911	/nfs/dbraw/zinc/61/59/11/420615911.db2.gz	VMFGLLXWTIUWPC-SECBINFHSA-N	1	1	319.408	1.419	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000452069544	420620945	/nfs/dbraw/zinc/62/09/45/420620945.db2.gz	QCBAGQNWARKFBT-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000452069544	420620949	/nfs/dbraw/zinc/62/09/49/420620949.db2.gz	QCBAGQNWARKFBT-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
COc1ccc(OCCN2C[C@H](C[NH3+])C[C@H]2C)c([N+](=O)[O-])c1	ZINC000442762635	420709618	/nfs/dbraw/zinc/70/96/18/420709618.db2.gz	CHMFMQNCAHBPMN-NEPJUHHUSA-N	1	1	309.366	1.651	20	5		DDBDMO
C[C@H](C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1)C(=O)OC(C)(C)C	ZINC000459803598	420878054	/nfs/dbraw/zinc/87/80/54/420878054.db2.gz	JYQDBDVVDOSTBT-LLVKDONJSA-N	1	1	312.370	1.701	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CN1CCCCC1	ZINC000449095511	420948458	/nfs/dbraw/zinc/94/84/58/420948458.db2.gz	ZBGKHKQLOLBYHY-GDBMZVCRSA-N	1	1	321.421	1.962	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2[C@H]2CCCOC2)cc1	ZINC000449430238	421011246	/nfs/dbraw/zinc/01/12/46/421011246.db2.gz	BVOPQTGUJLKBIW-IMJJTQAJSA-N	1	1	306.362	1.957	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-]	ZINC000456071884	421096270	/nfs/dbraw/zinc/09/62/70/421096270.db2.gz	TXGGSLWQMBYWCT-HNNXBMFYSA-N	1	1	319.365	1.199	20	5		DDBDMO
CC(C)[C@@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000488012768	421063246	/nfs/dbraw/zinc/06/32/46/421063246.db2.gz	UYKPOJNDOMZEAV-HNNXBMFYSA-N	1	1	320.393	1.466	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nccc2c1cccc2[N+](=O)[O-]	ZINC000450334042	421184715	/nfs/dbraw/zinc/18/47/15/421184715.db2.gz	HNSWZBZZPPIRDK-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450334042	421184721	/nfs/dbraw/zinc/18/47/21/421184721.db2.gz	HNSWZBZZPPIRDK-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450334042	421184725	/nfs/dbraw/zinc/18/47/25/421184725.db2.gz	HNSWZBZZPPIRDK-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
Nc1ncccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000450569989	421210903	/nfs/dbraw/zinc/21/09/03/421210903.db2.gz	OSNOIKFLBHOKLI-GFCCVEGCSA-N	1	1	314.349	1.653	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])nc1	ZINC000450483682	421202503	/nfs/dbraw/zinc/20/25/03/421202503.db2.gz	JWZOTTMKVKLWLF-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](C3CC3)C2)n1	ZINC000561143776	421308047	/nfs/dbraw/zinc/30/80/47/421308047.db2.gz	HVASKMYVXCWKIE-JTQLQIEISA-N	1	1	320.349	1.673	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000525670435	421293875	/nfs/dbraw/zinc/29/38/75/421293875.db2.gz	SRLYMIRLCGSBTC-AWEZNQCLSA-N	1	1	305.378	1.984	20	5		DDBDMO
C[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCC[C@H](C)C1	ZINC000548058509	421394547	/nfs/dbraw/zinc/39/45/47/421394547.db2.gz	RIADYHQBPWQEQU-WDEREUQCSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])cn1C)[N@H+]1CCC[C@H](C)C1	ZINC000518772204	421667324	/nfs/dbraw/zinc/66/73/24/421667324.db2.gz	ZYNLXLMVKZXSSG-NWDGAFQWSA-N	1	1	308.382	1.784	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H](N3CCOCC3)C2)cc1	ZINC000584239710	422293287	/nfs/dbraw/zinc/29/32/87/422293287.db2.gz	JPPKYBMCJRXAON-MRXNPFEDSA-N	1	1	305.378	1.891	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000314967611	271013460	/nfs/dbraw/zinc/01/34/60/271013460.db2.gz	VTBKJEQTIOQRJM-NSHDSACASA-N	1	1	306.366	1.836	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@]2(CCCOC2)C1	ZINC000341577007	271126030	/nfs/dbraw/zinc/12/60/30/271126030.db2.gz	MGTIZMYRDGTDPE-MRXNPFEDSA-N	1	1	321.377	1.649	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408145509	274332804	/nfs/dbraw/zinc/33/28/04/274332804.db2.gz	SQIVLRNPNWHDPA-SECBINFHSA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408145509	274332807	/nfs/dbraw/zinc/33/28/07/274332807.db2.gz	SQIVLRNPNWHDPA-SECBINFHSA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2C(N)=O)C[N@H+]1C1CC1	ZINC000133535796	274395084	/nfs/dbraw/zinc/39/50/84/274395084.db2.gz	DVHHENDGNCALHP-RKDXNWHRSA-N	1	1	305.338	1.126	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000264724731	277134595	/nfs/dbraw/zinc/13/45/95/277134595.db2.gz	YIZGJJHDQTZMRV-JTQLQIEISA-N	1	1	321.333	1.048	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000292307932	277159501	/nfs/dbraw/zinc/15/95/01/277159501.db2.gz	NDSGJJRGPBQLAQ-MRXNPFEDSA-N	1	1	319.361	1.528	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000364037512	300337323	/nfs/dbraw/zinc/33/73/23/300337323.db2.gz	AUDMSVYTBQDMMM-OLZOCXBDSA-N	1	1	321.381	1.233	20	5		DDBDMO
COCC[C@H]1CCCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000364151087	300350721	/nfs/dbraw/zinc/35/07/21/300350721.db2.gz	QEMYKPZMODIEJV-CQSZACIVSA-N	1	1	323.393	1.895	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000364452438	300398885	/nfs/dbraw/zinc/39/88/85/300398885.db2.gz	FFKIFNHVHFXAQD-LLVKDONJSA-N	1	1	318.377	1.924	20	5		DDBDMO
Cc1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973692	301114560	/nfs/dbraw/zinc/11/45/60/301114560.db2.gz	KZIZBVIZJKFZQW-KCQAQPDRSA-N	1	1	303.362	1.989	20	5		DDBDMO
Cc1ccc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1[N+](=O)[O-]	ZINC000368973692	301114561	/nfs/dbraw/zinc/11/45/61/301114561.db2.gz	KZIZBVIZJKFZQW-KCQAQPDRSA-N	1	1	303.362	1.989	20	5		DDBDMO
Cc1nn(C)c(N2CCC[C@@H](c3[nH+]ccn3C)C2)c1[N+](=O)[O-]	ZINC000369361437	301172290	/nfs/dbraw/zinc/17/22/90/301172290.db2.gz	DOOUWPZYEHTIDV-LLVKDONJSA-N	1	1	304.354	1.754	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3F)[C@@H]2C1	ZINC000376729425	302093426	/nfs/dbraw/zinc/09/34/26/302093426.db2.gz	PXEDNAJFFKGDME-ZWNOBZJWSA-N	1	1	307.325	1.900	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CC(N)=O)C1	ZINC000377609306	302198171	/nfs/dbraw/zinc/19/81/71/302198171.db2.gz	YAMCTOPAPXSLHG-NSHDSACASA-N	1	1	307.350	1.691	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000377651845	302203893	/nfs/dbraw/zinc/20/38/93/302203893.db2.gz	KGAWZKZZVPQTKD-JKSUJKDBSA-N	1	1	308.378	1.969	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000531970539	303268189	/nfs/dbraw/zinc/26/81/89/303268189.db2.gz	CRTUHCUNKJGXHM-DZGCQCFKSA-N	1	1	306.410	1.800	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000362080130	307013164	/nfs/dbraw/zinc/01/31/64/307013164.db2.gz	JVAFAVVYXFCJES-GFCCVEGCSA-N	1	1	306.366	1.917	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)[nH]n1	ZINC000363366753	307026660	/nfs/dbraw/zinc/02/66/60/307026660.db2.gz	JRRSYQMPHPLBTH-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)n[nH]1	ZINC000363366753	307026661	/nfs/dbraw/zinc/02/66/61/307026661.db2.gz	JRRSYQMPHPLBTH-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n[nH]1	ZINC000363366753	307026662	/nfs/dbraw/zinc/02/66/62/307026662.db2.gz	JRRSYQMPHPLBTH-LBPRGKRZSA-N	1	1	304.354	1.702	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000368813320	307110393	/nfs/dbraw/zinc/11/03/93/307110393.db2.gz	FLKNFBMWDIWPML-UJAVWCLSSA-N	1	1	303.362	1.624	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000368813320	307110394	/nfs/dbraw/zinc/11/03/94/307110394.db2.gz	FLKNFBMWDIWPML-UJAVWCLSSA-N	1	1	303.362	1.624	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](O)C2(CC2)C1	ZINC000373514604	307189726	/nfs/dbraw/zinc/18/97/26/307189726.db2.gz	UYZVHVCRXBTXFZ-GXFFZTMASA-N	1	1	305.334	1.379	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](O)C2(CC2)C1	ZINC000373514604	307189727	/nfs/dbraw/zinc/18/97/27/307189727.db2.gz	UYZVHVCRXBTXFZ-GXFFZTMASA-N	1	1	305.334	1.379	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@](O)(C3CC3)C2)c1	ZINC000373907805	307198046	/nfs/dbraw/zinc/19/80/46/307198046.db2.gz	GQMQEIDHNYGMMN-ZBFHGGJFSA-N	1	1	322.361	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@](O)(c3ccc(F)cc3)C2)n1	ZINC000375965525	307236406	/nfs/dbraw/zinc/23/64/06/307236406.db2.gz	YBOCJQKLDCDFIX-OAHLLOKOSA-N	1	1	320.324	1.524	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3ncc([N+](=O)[O-])cc3C2)C1	ZINC000565959803	308039442	/nfs/dbraw/zinc/03/94/42/308039442.db2.gz	TUVSDFDDUUNSQC-NSHDSACASA-N	1	1	304.350	1.216	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000571204617	308192454	/nfs/dbraw/zinc/19/24/54/308192454.db2.gz	NSGUFUCALMVFLC-DOMZBBRYSA-N	1	1	319.361	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000571204617	308192455	/nfs/dbraw/zinc/19/24/55/308192455.db2.gz	NSGUFUCALMVFLC-DOMZBBRYSA-N	1	1	319.361	1.953	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000576610776	308327315	/nfs/dbraw/zinc/32/73/15/308327315.db2.gz	PPCGYPSVCCBADJ-NSHDSACASA-N	1	1	309.370	1.275	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(CN3CC[N@H+]4CCC[C@H]4C3)nc2c1	ZINC000576883446	308346651	/nfs/dbraw/zinc/34/66/51/308346651.db2.gz	WUYLIBULGGRKFA-LBPRGKRZSA-N	1	1	301.350	1.751	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000582676590	337121057	/nfs/dbraw/zinc/12/10/57/337121057.db2.gz	ZSRNMHXSLDRRIA-SNVBAGLBSA-N	1	1	317.349	1.429	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000584435353	337325578	/nfs/dbraw/zinc/32/55/78/337325578.db2.gz	CYYVTTDOWYKKIZ-CYBMUJFWSA-N	1	1	321.377	1.762	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488807091	484220164	/nfs/dbraw/zinc/22/01/64/484220164.db2.gz	OFNZCSBCJPLCLI-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488807091	484220171	/nfs/dbraw/zinc/22/01/71/484220171.db2.gz	OFNZCSBCJPLCLI-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
COC(=O)C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000136808270	500787578	/nfs/dbraw/zinc/78/75/78/500787578.db2.gz	NULWSPSWONPSNB-AWEZNQCLSA-N	1	1	308.334	1.513	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000305762765	534031612	/nfs/dbraw/zinc/03/16/12/534031612.db2.gz	NDMHONBHJREZFC-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000305816307	534108967	/nfs/dbraw/zinc/10/89/67/534108967.db2.gz	ADQQDBQSJZQXCX-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@@H+]1CCO	ZINC000416994083	534355303	/nfs/dbraw/zinc/35/53/03/534355303.db2.gz	JIJLEUREDYTDBI-NEPJUHHUSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1CCO	ZINC000416994083	534355308	/nfs/dbraw/zinc/35/53/08/534355308.db2.gz	JIJLEUREDYTDBI-NEPJUHHUSA-N	1	1	322.365	1.514	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000459602184	528036576	/nfs/dbraw/zinc/03/65/76/528036576.db2.gz	YUJKAKQQBIEKMZ-UHFFFAOYSA-N	1	1	305.338	1.475	20	5		DDBDMO
CCOc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000419007326	528314636	/nfs/dbraw/zinc/31/46/36/528314636.db2.gz	RKITYCALSFULKG-STQMWFEESA-N	1	1	323.393	1.885	20	5		DDBDMO
CC(C)[C@@H](O)C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000292873489	528626747	/nfs/dbraw/zinc/62/67/47/528626747.db2.gz	HVBRQFVAFYDCIO-HNNXBMFYSA-N	1	1	321.377	1.370	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000302625406	528823741	/nfs/dbraw/zinc/82/37/41/528823741.db2.gz	HXLLMTKJGBDZEB-UHFFFAOYSA-N	1	1	315.395	1.750	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC1	ZINC000736569966	598628119	/nfs/dbraw/zinc/62/81/19/598628119.db2.gz	LTRSPIFMSNMUKB-UHFFFAOYSA-N	1	1	317.353	1.307	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000736846696	598797533	/nfs/dbraw/zinc/79/75/33/598797533.db2.gz	ALQRNZIWPALNDW-SNVBAGLBSA-N	1	1	317.353	1.163	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000824992261	608554969	/nfs/dbraw/zinc/55/49/69/608554969.db2.gz	LDGWTFLUANGXPZ-VHSXEESVSA-N	1	1	317.353	1.304	20	5		DDBDMO
CCOCC[NH+]1CCN(Cn2nc(C)c([N+](=O)[O-])c2C)CC1	ZINC000111164270	696642431	/nfs/dbraw/zinc/64/24/31/696642431.db2.gz	FKRRDOUMVLMHIV-UHFFFAOYSA-N	1	1	311.386	1.020	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](c2ccccn2)C1	ZINC000799197736	700127945	/nfs/dbraw/zinc/12/79/45/700127945.db2.gz	HWWXMFINDHZMAN-CYBMUJFWSA-N	1	1	314.345	1.641	20	5		DDBDMO
C[N@H+](C[C@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000176096183	697401306	/nfs/dbraw/zinc/40/13/06/697401306.db2.gz	FQKUCBQOQHYENE-SNVBAGLBSA-N	1	1	307.306	1.429	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000176096183	697401307	/nfs/dbraw/zinc/40/13/07/697401307.db2.gz	FQKUCBQOQHYENE-SNVBAGLBSA-N	1	1	307.306	1.429	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594042	698124705	/nfs/dbraw/zinc/12/47/05/698124705.db2.gz	RZAKMXGHKGMOAD-CJNGLKHVSA-N	1	1	321.377	1.428	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000780868435	698566345	/nfs/dbraw/zinc/56/63/45/698566345.db2.gz	XFLZNWXWKOGPJT-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CN1CC[N@H+](C)C[C@H]1CNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000731947251	699542247	/nfs/dbraw/zinc/54/22/47/699542247.db2.gz	BOIQHLTZPRIKBG-CYBMUJFWSA-N	1	1	323.422	1.127	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000731947251	699542249	/nfs/dbraw/zinc/54/22/49/699542249.db2.gz	BOIQHLTZPRIKBG-CYBMUJFWSA-N	1	1	323.422	1.127	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1ccc([N+](=O)[O-])c2nonc21	ZINC000734484598	699652757	/nfs/dbraw/zinc/65/27/57/699652757.db2.gz	ARAGIMNWYGUZJJ-JTQLQIEISA-N	1	1	305.338	1.909	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@](C)(C(N)=O)C2)c2cc([N+](=O)[O-])ccc12	ZINC000794710633	699826576	/nfs/dbraw/zinc/82/65/76/699826576.db2.gz	HPMPSGBWVFMPDA-OAHLLOKOSA-N	1	1	317.349	1.408	20	5		DDBDMO
CN1CC[NH+](CCCNc2nc3ccccn3c2[N+](=O)[O-])CC1	ZINC000743287584	699905766	/nfs/dbraw/zinc/90/57/66/699905766.db2.gz	HLAFGWIFSXXPBN-UHFFFAOYSA-N	1	1	318.381	1.292	20	5		DDBDMO
COCCC[N@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000752791024	700388030	/nfs/dbraw/zinc/38/80/30/700388030.db2.gz	YOIYWDDOVGLFHU-UHFFFAOYSA-N	1	1	322.365	1.763	20	5		DDBDMO
COCCC[N@@H+](C)CN1CCN(c2ccccc2[N+](=O)[O-])C1=O	ZINC000752791024	700388035	/nfs/dbraw/zinc/38/80/35/700388035.db2.gz	YOIYWDDOVGLFHU-UHFFFAOYSA-N	1	1	322.365	1.763	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O	ZINC000768770144	701201375	/nfs/dbraw/zinc/20/13/75/701201375.db2.gz	SEHCUZDMDSHCMF-UFBFGSQYSA-N	1	1	313.741	1.499	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1O	ZINC000768770144	701201378	/nfs/dbraw/zinc/20/13/78/701201378.db2.gz	SEHCUZDMDSHCMF-UFBFGSQYSA-N	1	1	313.741	1.499	20	5		DDBDMO
C[C@@H]([NH2+]C(C)(C)CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccccc1	ZINC000839648743	701765856	/nfs/dbraw/zinc/76/58/56/701765856.db2.gz	RASSYBGZPSUVGH-MRVWCRGKSA-N	1	1	305.378	1.897	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839684628	701782579	/nfs/dbraw/zinc/78/25/79/701782579.db2.gz	YAFABQJYWLYJIZ-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839684628	701782584	/nfs/dbraw/zinc/78/25/84/701782584.db2.gz	YAFABQJYWLYJIZ-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839684628	701782591	/nfs/dbraw/zinc/78/25/91/701782591.db2.gz	YAFABQJYWLYJIZ-RBSFLKMASA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CC[C@]2(CCOC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000867956012	701852958	/nfs/dbraw/zinc/85/29/58/701852958.db2.gz	JRGPGFAYQNYDMO-CVEARBPZSA-N	1	1	319.361	1.408	20	5		DDBDMO
C[C@H]1CC[N@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982282	701889352	/nfs/dbraw/zinc/88/93/52/701889352.db2.gz	CDAARUKHQXQVKT-NHYWBVRUSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[C@H]1CC[N@@H+](CN2C(=O)C[C@@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982282	701889357	/nfs/dbraw/zinc/88/93/57/701889357.db2.gz	CDAARUKHQXQVKT-NHYWBVRUSA-N	1	1	305.334	1.831	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2C[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000816648796	702135751	/nfs/dbraw/zinc/13/57/51/702135751.db2.gz	PKBBDSZNQRQBQE-MNOVXSKESA-N	1	1	308.334	1.987	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000816648796	702135752	/nfs/dbraw/zinc/13/57/52/702135752.db2.gz	PKBBDSZNQRQBQE-MNOVXSKESA-N	1	1	308.334	1.987	20	5		DDBDMO
C[C@@H]([NH3+])[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843365766	702867101	/nfs/dbraw/zinc/86/71/01/702867101.db2.gz	RPCIXLZEMSHCPG-GHMZBOCLSA-N	1	1	324.356	1.732	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000846920834	703351932	/nfs/dbraw/zinc/35/19/32/703351932.db2.gz	OHDNONXBUJAWFG-KGLIPLIRSA-N	1	1	307.350	1.181	20	5		DDBDMO
CON1CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000846971038	703359121	/nfs/dbraw/zinc/35/91/21/703359121.db2.gz	JAJIWQPXISBBBR-UHFFFAOYSA-N	1	1	308.338	1.102	20	5		DDBDMO
C[N@H+]1CC[C@@H](CCOC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000847829081	703474501	/nfs/dbraw/zinc/47/45/01/703474501.db2.gz	WGCFVLPKXWUWTN-JTQLQIEISA-N	1	1	322.317	1.822	20	5		DDBDMO
COc1ccnc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1F	ZINC000849331216	703635927	/nfs/dbraw/zinc/63/59/27/703635927.db2.gz	NHBJMXQVNVFNQA-CYBMUJFWSA-N	1	1	321.308	1.961	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000852695531	704101636	/nfs/dbraw/zinc/10/16/36/704101636.db2.gz	AKLUASHTLRPSKU-YUTCNCBUSA-N	1	1	308.334	1.512	20	5		DDBDMO
CCc1nc(C[NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])co1	ZINC000819357656	704112621	/nfs/dbraw/zinc/11/26/21/704112621.db2.gz	URTXGBIYNDZPHM-GFCCVEGCSA-N	1	1	321.333	1.675	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@H]4COC[C@@H]4C3)c2c1	ZINC000853585907	704276023	/nfs/dbraw/zinc/27/60/23/704276023.db2.gz	KVEJXANPJLIGQZ-STQMWFEESA-N	1	1	302.334	1.870	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ncn(C[N@@H+]3CCC4(COC4)C3)n2)c1	ZINC000853598259	704281934	/nfs/dbraw/zinc/28/19/34/704281934.db2.gz	QADJDNJYLHFGBV-UHFFFAOYSA-N	1	1	315.333	1.533	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC4(COC4)C3)n2)c1	ZINC000853598259	704281935	/nfs/dbraw/zinc/28/19/35/704281935.db2.gz	QADJDNJYLHFGBV-UHFFFAOYSA-N	1	1	315.333	1.533	20	5		DDBDMO
Cc1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000853965077	704341380	/nfs/dbraw/zinc/34/13/80/704341380.db2.gz	DLYYIRYQHBVFKB-AWEZNQCLSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000853966234	704341837	/nfs/dbraw/zinc/34/18/37/704341837.db2.gz	QKCVPHRRPMETOK-OAHLLOKOSA-N	1	1	305.378	1.939	20	5		DDBDMO
O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1ccccc1[N+](=O)[O-]	ZINC000821587770	704425229	/nfs/dbraw/zinc/42/52/29/704425229.db2.gz	LSTJTGRJTJTNMT-TXEJJXNPSA-N	1	1	306.318	1.615	20	5		DDBDMO
C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](C)[NH+]1CCOCC1	ZINC000823130188	705148261	/nfs/dbraw/zinc/14/82/61/705148261.db2.gz	VRWYNQLYUVLKFJ-VXGBXAGGSA-N	1	1	301.387	1.047	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000860436376	705186430	/nfs/dbraw/zinc/18/64/30/705186430.db2.gz	DGNSGVBNYVACOW-UHFFFAOYSA-N	1	1	300.318	1.685	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823945267	705343380	/nfs/dbraw/zinc/34/33/80/705343380.db2.gz	NHOQYHUHKBRMLT-UHFFFAOYSA-N	1	1	318.337	1.894	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000823994247	705351617	/nfs/dbraw/zinc/35/16/17/705351617.db2.gz	ORGMDZKJXOJPSI-LBPRGKRZSA-N	1	1	319.365	1.783	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825471956	705677308	/nfs/dbraw/zinc/67/73/08/705677308.db2.gz	FVZGOJPTJOZFHC-DOMZBBRYSA-N	1	1	321.377	1.475	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825615411	705703390	/nfs/dbraw/zinc/70/33/90/705703390.db2.gz	VOVQYDSIGGGLGZ-BXUZGUMPSA-N	1	1	309.366	1.475	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000862788447	705798110	/nfs/dbraw/zinc/79/81/10/705798110.db2.gz	CVSGDGAAHYKAMU-LLVKDONJSA-N	1	1	306.366	1.639	20	5		DDBDMO
CN(C)CC[NH+]1CCC(Nc2ccnc(F)c2[N+](=O)[O-])CC1	ZINC000881802836	707371143	/nfs/dbraw/zinc/37/11/43/707371143.db2.gz	UIWINAGEQKIXMM-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c([N+](=O)[O-])c1	ZINC000829010298	706272739	/nfs/dbraw/zinc/27/27/39/706272739.db2.gz	QSNWXBXOLLZBGI-TXEJJXNPSA-N	1	1	322.321	1.778	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000880144960	706890818	/nfs/dbraw/zinc/89/08/18/706890818.db2.gz	KTKRTJQWOXDMGX-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000880144960	706890822	/nfs/dbraw/zinc/89/08/22/706890822.db2.gz	KTKRTJQWOXDMGX-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000832359071	706897067	/nfs/dbraw/zinc/89/70/67/706897067.db2.gz	BTCDHDOMXOUJHS-BXUZGUMPSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000832359071	706897070	/nfs/dbraw/zinc/89/70/70/706897070.db2.gz	BTCDHDOMXOUJHS-BXUZGUMPSA-N	1	1	307.350	1.181	20	5		DDBDMO
COCC1([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCC1	ZINC000880187367	706905451	/nfs/dbraw/zinc/90/54/51/706905451.db2.gz	JUIIYNANDAUWEL-CQSZACIVSA-N	1	1	324.377	1.835	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000880428828	706972473	/nfs/dbraw/zinc/97/24/73/706972473.db2.gz	SLXGGNNUNXYSAF-GJZGRUSLSA-N	1	1	310.350	1.709	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2COC[C@@H]21	ZINC000832779266	706981877	/nfs/dbraw/zinc/98/18/77/706981877.db2.gz	XRTXKDJKJWBEET-ZNMIVQPWSA-N	1	1	306.362	1.985	20	5		DDBDMO
C[C@@H](NC[C@@H]1C[N@@H+](C)CCN1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036705	707284381	/nfs/dbraw/zinc/28/43/81/707284381.db2.gz	VKXWGKMFSIKDOI-VXGBXAGGSA-N	1	1	310.373	1.630	20	5		DDBDMO
[NH3+]C[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@@H]1C(F)(F)F	ZINC000872149837	707303445	/nfs/dbraw/zinc/30/34/45/707303445.db2.gz	RDVSDIJLSMKBSJ-KOLCDFICSA-N	1	1	319.283	1.869	20	5		DDBDMO
CC1(C)[C@H]2[C@H](CCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1O	ZINC000872259607	707352617	/nfs/dbraw/zinc/35/26/17/707352617.db2.gz	YMOHCHLOSOFCAR-CFVMTHIKSA-N	1	1	321.377	1.238	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000872266959	707356183	/nfs/dbraw/zinc/35/61/83/707356183.db2.gz	IUNSXZFYRPVYQN-CABCVRRESA-N	1	1	321.377	1.571	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCc1ccc(OC)c([N+](=O)[O-])c1	ZINC000883170360	707946631	/nfs/dbraw/zinc/94/66/31/707946631.db2.gz	RSHCSJCGJJDBDX-LBPRGKRZSA-N	1	1	322.365	1.497	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000883468558	708009939	/nfs/dbraw/zinc/00/99/39/708009939.db2.gz	WHFFAAJYPHVNAU-ZDUSSCGKSA-N	1	1	306.366	1.531	20	5		DDBDMO
Nc1ccc(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897219936	708258031	/nfs/dbraw/zinc/25/80/31/708258031.db2.gz	QIXSAFORLSYVGA-QWHCGFSZSA-N	1	1	306.366	1.212	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897221369	708259315	/nfs/dbraw/zinc/25/93/15/708259315.db2.gz	MBDSGDKSQTZXHM-CHWSQXEVSA-N	1	1	323.397	1.155	20	5		DDBDMO
COc1cc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221298	708259516	/nfs/dbraw/zinc/25/95/16/708259516.db2.gz	KYGCWZGFLOFPIZ-ZIAGYGMSSA-N	1	1	321.377	1.639	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000886596151	708788006	/nfs/dbraw/zinc/78/80/06/708788006.db2.gz	XTEOVYIALDRROZ-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000886596151	708788008	/nfs/dbraw/zinc/78/80/08/708788008.db2.gz	XTEOVYIALDRROZ-LLVKDONJSA-N	1	1	309.370	1.131	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000900267539	709512464	/nfs/dbraw/zinc/51/24/64/709512464.db2.gz	HQYHBQJVYCXDMH-VZJVUDMVSA-N	1	1	307.350	1.227	20	5		DDBDMO
CC[N@@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000910283417	709864487	/nfs/dbraw/zinc/86/44/87/709864487.db2.gz	ZHRKATIYLLXRTA-NSHDSACASA-N	1	1	307.350	1.857	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000910283417	709864489	/nfs/dbraw/zinc/86/44/89/709864489.db2.gz	ZHRKATIYLLXRTA-NSHDSACASA-N	1	1	307.350	1.857	20	5		DDBDMO
COc1c(O)ccc(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000891941324	710333950	/nfs/dbraw/zinc/33/39/50/710333950.db2.gz	WGEXUYHLQFHFFF-ZDUSSCGKSA-N	1	1	321.377	1.978	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000892418317	710434118	/nfs/dbraw/zinc/43/41/18/710434118.db2.gz	OSNFMOFLKVKIJN-GFCCVEGCSA-N	1	1	306.366	1.736	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)CC[N@H+]1C	ZINC000928438601	713195910	/nfs/dbraw/zinc/19/59/10/713195910.db2.gz	GIDSEGYKKFEHRN-JOYOIKCWSA-N	1	1	324.356	1.622	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC(C)([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000913397270	713208099	/nfs/dbraw/zinc/20/80/99/713208099.db2.gz	BIFRGUYAMVGVJV-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](C(C)(C)O)C2)c1[N+](=O)[O-]	ZINC000895952778	711654592	/nfs/dbraw/zinc/65/45/92/711654592.db2.gz	JIYDAUGFZBETCU-NSHDSACASA-N	1	1	310.350	1.902	20	5		DDBDMO
CC1(C)[C@@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CS1(=O)=O	ZINC000895977496	711659208	/nfs/dbraw/zinc/65/92/08/711659208.db2.gz	GIHFVBYCDHPOSM-IYNGYCSASA-N	1	1	310.375	1.773	20	5		DDBDMO
C[C@@H](NC(=O)C1CN(C)CC[N@@H+](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000907220865	712515734	/nfs/dbraw/zinc/51/57/34/712515734.db2.gz	LOQINPUUOFGZEF-GFCCVEGCSA-N	1	1	320.393	1.265	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000914325478	713378843	/nfs/dbraw/zinc/37/88/43/713378843.db2.gz	LECWURGBXPVETF-RISCZKNCSA-N	1	1	306.366	1.529	20	5		DDBDMO
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[NH+]2CCCC2)C1=O	ZINC000915790430	713431426	/nfs/dbraw/zinc/43/14/26/713431426.db2.gz	XCIQXLWTAXVTCZ-HNNXBMFYSA-N	1	1	318.333	1.415	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1	ZINC000930544326	713862955	/nfs/dbraw/zinc/86/29/55/713862955.db2.gz	FZPHLQURULSURK-NWDGAFQWSA-N	1	1	323.397	1.336	20	5		DDBDMO
CN(C)[C@@H]1[C@H]2C[N@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000931281563	714056220	/nfs/dbraw/zinc/05/62/20/714056220.db2.gz	UHXCQFNOWNRQFW-FOLVSLTJSA-N	1	1	318.377	1.415	20	5		DDBDMO
CN(C)[C@@H]1[C@H]2C[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000931281563	714056223	/nfs/dbraw/zinc/05/62/23/714056223.db2.gz	UHXCQFNOWNRQFW-FOLVSLTJSA-N	1	1	318.377	1.415	20	5		DDBDMO
C[C@@H]1[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000922556758	714087799	/nfs/dbraw/zinc/08/77/99/714087799.db2.gz	JKTKCGRYKMGLSF-ZYHUDNBSSA-N	1	1	307.350	1.548	20	5		DDBDMO
C[C@@H]1[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000922556758	714087803	/nfs/dbraw/zinc/08/78/03/714087803.db2.gz	JKTKCGRYKMGLSF-ZYHUDNBSSA-N	1	1	307.350	1.548	20	5		DDBDMO
COc1cc(CN[C@@H]2CC[N@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557337	714087981	/nfs/dbraw/zinc/08/79/81/714087981.db2.gz	OEOVQLIWOIYUAL-CMPLNLGQSA-N	1	1	309.366	1.794	20	5		DDBDMO
COc1cc(CN[C@@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])cc1OC	ZINC000922557337	714087984	/nfs/dbraw/zinc/08/79/84/714087984.db2.gz	OEOVQLIWOIYUAL-CMPLNLGQSA-N	1	1	309.366	1.794	20	5		DDBDMO
Cn1ccc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000932136161	714268593	/nfs/dbraw/zinc/26/85/93/714268593.db2.gz	OXPIYTLEJBWOGQ-GFCCVEGCSA-N	1	1	304.354	1.404	20	5		DDBDMO
Cn1nccc1[C@@H]1CCC[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000932267314	714295957	/nfs/dbraw/zinc/29/59/57/714295957.db2.gz	OBTGHXZFZOPXMA-AWEZNQCLSA-N	1	1	317.349	1.327	20	5		DDBDMO
Cn1nccc1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000932267314	714295959	/nfs/dbraw/zinc/29/59/59/714295959.db2.gz	OBTGHXZFZOPXMA-AWEZNQCLSA-N	1	1	317.349	1.327	20	5		DDBDMO
COc1cc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)ccc1[N+](=O)[O-]	ZINC000923294844	714300493	/nfs/dbraw/zinc/30/04/93/714300493.db2.gz	OUCRWJOKNJXYRL-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1	ZINC000923298889	714302076	/nfs/dbraw/zinc/30/20/76/714302076.db2.gz	LWSSVLNWJJHFPX-NEPJUHHUSA-N	1	1	319.361	1.912	20	5		DDBDMO
CC(C)(CCc1noc([C@@H]2C[N@H+]3CCC[C@@H]3CO2)n1)[N+](=O)[O-]	ZINC000924079308	714522097	/nfs/dbraw/zinc/52/20/97/714522097.db2.gz	UPRLWAYAHFVBOW-MNOVXSKESA-N	1	1	310.354	1.593	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C[C@H]2C1	ZINC000935693903	715118398	/nfs/dbraw/zinc/11/83/98/715118398.db2.gz	DRRDRDRBMWDWKK-LQKXBSAESA-N	1	1	315.373	1.718	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CC3)C[C@H]2CC1	ZINC000946589388	718844184	/nfs/dbraw/zinc/84/41/84/718844184.db2.gz	WUGBQCNAAVGODS-LXTVHRRPSA-N	1	1	307.394	1.232	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@@H+](CC3CC3)C[C@H]2CC1	ZINC000946589388	718844187	/nfs/dbraw/zinc/84/41/87/718844187.db2.gz	WUGBQCNAAVGODS-LXTVHRRPSA-N	1	1	307.394	1.232	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC[C@H]2C[N@H+](CC3CC3)C[C@H]2CC1	ZINC000946589388	718844192	/nfs/dbraw/zinc/84/41/92/718844192.db2.gz	WUGBQCNAAVGODS-LXTVHRRPSA-N	1	1	307.394	1.232	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@H]2[C@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932527	721853911	/nfs/dbraw/zinc/85/39/11/721853911.db2.gz	YQVAGGKZVBCUMK-OLZOCXBDSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@H]2[C@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932527	721853912	/nfs/dbraw/zinc/85/39/12/721853912.db2.gz	YQVAGGKZVBCUMK-OLZOCXBDSA-N	1	1	305.382	1.204	20	5		DDBDMO
CC(C)=CC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035704653	751790981	/nfs/dbraw/zinc/79/09/81/751790981.db2.gz	VROPVRKBJBLKPI-ZIAGYGMSSA-N	1	1	307.394	1.542	20	5		DDBDMO
O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3nc(C(F)F)no3)C2)c1	ZINC001183219171	743798937	/nfs/dbraw/zinc/79/89/37/743798937.db2.gz	VOWWNVIKNIYAFL-UHFFFAOYSA-N	1	1	314.252	1.605	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC001129080696	751247151	/nfs/dbraw/zinc/24/71/51/751247151.db2.gz	VGECPZAUWXQULS-MIGQKNRLSA-N	1	1	315.373	1.861	20	5		DDBDMO
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169007214	762175092	/nfs/dbraw/zinc/17/50/92/762175092.db2.gz	LWUCKTKQSZHBRU-LXTVHRRPSA-N	1	1	317.389	1.713	20	5		DDBDMO
O=C(c1ccco1)N1CCC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169037072	762192571	/nfs/dbraw/zinc/19/25/71/762192571.db2.gz	IOZMOAPQUFWNIL-KBPBESRZSA-N	1	1	321.377	1.873	20	5		DDBDMO
COC[C@H]1Cn2nccc2C[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169026720	762203087	/nfs/dbraw/zinc/20/30/87/762203087.db2.gz	NLIUFLOZFOOPOV-MCIONIFRSA-N	1	1	308.382	1.407	20	5		DDBDMO
Cc1nonc1CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001156087860	761784333	/nfs/dbraw/zinc/78/43/33/761784333.db2.gz	NPIPAKWCMWLLTI-SNAWJCMRSA-N	1	1	304.310	1.826	20	5		DDBDMO
CCn1c([C@H](C)[N+](=O)[O-])nnc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC001121698900	782633066	/nfs/dbraw/zinc/63/30/66/782633066.db2.gz	LUVJVWAONGESML-QJPTWQEYSA-N	1	1	308.386	1.166	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1nc(C2CC2)nc(Cl)c1[N+](=O)[O-]	ZINC001170898489	771897890	/nfs/dbraw/zinc/89/78/90/771897890.db2.gz	OIEMRAQAFNCPPQ-ZETCQYMHSA-N	1	1	300.750	1.351	20	5		DDBDMO
COC(=O)[C@@H](Nc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2)C(F)(F)F	ZINC001171014270	772099848	/nfs/dbraw/zinc/09/98/48/772099848.db2.gz	CKYPIIAZIJOJHF-SNVBAGLBSA-N	1	1	319.239	1.714	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001136922228	772211366	/nfs/dbraw/zinc/21/13/66/772211366.db2.gz	AMYYMIPUZRVKFL-IINYFYTJSA-N	1	1	306.366	1.589	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCn3cnnc3C1)CC2	ZINC001172908076	776917790	/nfs/dbraw/zinc/91/77/90/776917790.db2.gz	KQVVXFMEMDNRJN-CQSZACIVSA-N	1	1	313.361	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCn3cnnc3C1)CC2	ZINC001172908076	776917793	/nfs/dbraw/zinc/91/77/93/776917793.db2.gz	KQVVXFMEMDNRJN-CQSZACIVSA-N	1	1	313.361	1.950	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](O)[C@](C)(CO)C1	ZINC001173222731	777055760	/nfs/dbraw/zinc/05/57/60/777055760.db2.gz	UZRGCJRGYOHNDL-KCXAZCMYSA-N	1	1	308.378	1.591	20	5		DDBDMO
CCn1nnc(C)c1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC001175323804	777751155	/nfs/dbraw/zinc/75/11/55/777751155.db2.gz	PUPMPLXFGWQXMQ-OAHLLOKOSA-N	1	1	319.365	1.512	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001116491570	780514998	/nfs/dbraw/zinc/51/49/98/780514998.db2.gz	UITGZBNXQJEUAI-RISCZKNCSA-N	1	1	307.350	1.216	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC001118921841	781273249	/nfs/dbraw/zinc/27/32/49/781273249.db2.gz	GPVGBVZAMLEKJT-CYBMUJFWSA-N	1	1	321.352	1.973	20	5		DDBDMO
O=C(NCC[N@@H+](CCc1cccs1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001267326317	837831304	/nfs/dbraw/zinc/83/13/04/837831304.db2.gz	UMAVRQSPQPUUNP-ZIAGYGMSSA-N	1	1	323.418	1.536	20	5		DDBDMO
O=C(NCC[N@H+](CCc1cccs1)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001267326317	837831320	/nfs/dbraw/zinc/83/13/20/837831320.db2.gz	UMAVRQSPQPUUNP-ZIAGYGMSSA-N	1	1	323.418	1.536	20	5		DDBDMO
O=C(NCC[N@@H+](CCc1cccs1)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001267326317	837831332	/nfs/dbraw/zinc/83/13/32/837831332.db2.gz	UMAVRQSPQPUUNP-ZIAGYGMSSA-N	1	1	323.418	1.536	20	5		DDBDMO
CC(C)(F)C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001267673388	838620539	/nfs/dbraw/zinc/62/05/39/838620539.db2.gz	GBLDWZSDAHYWQQ-UHFFFAOYSA-N	1	1	309.341	1.891	20	5		DDBDMO
CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cnon1	ZINC001268252952	839897978	/nfs/dbraw/zinc/89/79/78/839897978.db2.gz	YOMIPLDCYNVKFF-UHFFFAOYSA-N	1	1	319.321	1.182	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1cnon1	ZINC001268252952	839897982	/nfs/dbraw/zinc/89/79/82/839897982.db2.gz	YOMIPLDCYNVKFF-UHFFFAOYSA-N	1	1	319.321	1.182	20	5		DDBDMO
Cc1noc([C@]23COC[C@H]2C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C3)n1	ZINC001169020000	850518416	/nfs/dbraw/zinc/51/84/16/850518416.db2.gz	HMMQDZCPHPEFHA-SFDCQRBFSA-N	1	1	322.365	1.023	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001137138892	851723750	/nfs/dbraw/zinc/72/37/50/851723750.db2.gz	RWKBVRRAPIHCRY-UHFFFAOYSA-N	1	1	303.750	1.433	20	5		DDBDMO
CN(CCC[NH2+]CCc1cccs1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001276002752	854127709	/nfs/dbraw/zinc/12/77/09/854127709.db2.gz	YBTRGOMLDBVATR-CHWSQXEVSA-N	1	1	311.407	1.394	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[NH+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC001123428075	859232260	/nfs/dbraw/zinc/23/22/60/859232260.db2.gz	VCPZRFXRJJVPSH-UHFFFAOYSA-N	1	1	320.349	1.915	20	5		DDBDMO
COC(=O)c1ccnc(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC001157265913	863694794	/nfs/dbraw/zinc/69/47/94/863694794.db2.gz	LIBVLZJHMNBHNH-ZYHUDNBSSA-N	1	1	320.349	1.307	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc(CF)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761615	864110665	/nfs/dbraw/zinc/11/06/65/864110665.db2.gz	ULCRSZUBDJNGCT-ZIAGYGMSSA-N	1	1	309.341	1.417	20	5		DDBDMO
COc1cc(NCCCN2CC[NH+](C)CC2)cc([N+](=O)[O-])c1C	ZINC001161708574	866920973	/nfs/dbraw/zinc/92/09/73/866920973.db2.gz	NSQIYSPFZGARHB-UHFFFAOYSA-N	1	1	322.409	1.961	20	5		DDBDMO
Cc1nc(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)ncc1[N+](=O)[O-]	ZINC001324416543	867267532	/nfs/dbraw/zinc/26/75/32/867267532.db2.gz	FZCCCNPWJYPGLN-LBPRGKRZSA-N	1	1	320.397	1.274	20	5		DDBDMO
Cc1nc(N[C@H]2CCN(C3CC[NH+](C)CC3)C2)ncc1[N+](=O)[O-]	ZINC001324416543	867267540	/nfs/dbraw/zinc/26/75/40/867267540.db2.gz	FZCCCNPWJYPGLN-LBPRGKRZSA-N	1	1	320.397	1.274	20	5		DDBDMO
Cc1nc(NCC[C@H]2CC[NH2+]CC2(F)F)ncc1[N+](=O)[O-]	ZINC001162815862	867849594	/nfs/dbraw/zinc/84/95/94/867849594.db2.gz	ZVBRBJBCGNGIDZ-SECBINFHSA-N	1	1	301.297	1.740	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC001335116698	868075429	/nfs/dbraw/zinc/07/54/29/868075429.db2.gz	JMWMXWUYEKKRKK-STQMWFEESA-N	1	1	309.341	1.769	20	5		DDBDMO
O=[N+]([O-])c1cc(CO)c(NCc2c[nH+]c3n2CCC3)cc1F	ZINC001164146296	868971849	/nfs/dbraw/zinc/97/18/49/868971849.db2.gz	SQEOKJAXULRJIR-UHFFFAOYSA-N	1	1	306.297	1.981	20	5		DDBDMO
C[N@@H+](C1CN(c2cc(Cl)cc([N+](=O)[O-])n2)C1)[C@@H]1CCOC1	ZINC001165203845	869424756	/nfs/dbraw/zinc/42/47/56/869424756.db2.gz	JDYGINPHFZQFQL-SNVBAGLBSA-N	1	1	312.757	1.553	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1ncc(F)cc1[N+](=O)[O-])CC2	ZINC001166031371	869809074	/nfs/dbraw/zinc/80/90/74/869809074.db2.gz	CMBRVJXEMLXRRW-UHFFFAOYSA-N	1	1	323.328	1.763	20	5		DDBDMO
C[N@@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cc2Br)C1	ZINC001226343566	882369537	/nfs/dbraw/zinc/36/95/37/882369537.db2.gz	ZSZJKPZHMQHVCL-MRVPVSSYSA-N	1	1	302.128	1.835	20	5		DDBDMO
C[N@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cc2Br)C1	ZINC001226343566	882369557	/nfs/dbraw/zinc/36/95/57/882369557.db2.gz	ZSZJKPZHMQHVCL-MRVPVSSYSA-N	1	1	302.128	1.835	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNc2nn(C)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC001306922207	871380973	/nfs/dbraw/zinc/38/09/73/871380973.db2.gz	IJQSSDRFHYEKGK-PHIMTYICSA-N	1	1	311.386	1.628	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2nn(C)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC001306922207	871380980	/nfs/dbraw/zinc/38/09/80/871380980.db2.gz	IJQSSDRFHYEKGK-PHIMTYICSA-N	1	1	311.386	1.628	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CCC[N@@H+](CC)CC1	ZINC001340884319	871409634	/nfs/dbraw/zinc/40/96/34/871409634.db2.gz	LBVUVJGDQRAQDR-UHFFFAOYSA-N	1	1	310.402	1.039	20	5		DDBDMO
CC(C)(C)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCO1	ZINC001308169387	871477485	/nfs/dbraw/zinc/47/74/85/871477485.db2.gz	XQDKCRYCKLZLQH-AWEZNQCLSA-N	1	1	323.393	1.894	20	5		DDBDMO
CC(C)CC[N@@H+](C)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001317872200	871610241	/nfs/dbraw/zinc/61/02/41/871610241.db2.gz	LNSAXAIOALDSAJ-HUUCEWRRSA-N	1	1	311.426	1.868	20	5		DDBDMO
CC(C)CC[N@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001317872200	871610261	/nfs/dbraw/zinc/61/02/61/871610261.db2.gz	LNSAXAIOALDSAJ-HUUCEWRRSA-N	1	1	311.426	1.868	20	5		DDBDMO
CC(C)CC[N@@H+](C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001317872200	871610274	/nfs/dbraw/zinc/61/02/74/871610274.db2.gz	LNSAXAIOALDSAJ-HUUCEWRRSA-N	1	1	311.426	1.868	20	5		DDBDMO
CN1CCC[C@@H](C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC001353289335	877233809	/nfs/dbraw/zinc/23/38/09/877233809.db2.gz	XTBBAZJKTSVQNZ-ZFWWWQNUSA-N	1	1	323.393	1.266	20	5		DDBDMO
COc1ccc(NC(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)c([N+](=O)[O-])c1	ZINC001219572161	878343832	/nfs/dbraw/zinc/34/38/32/878343832.db2.gz	DZABFLAZQBXZLL-YGRLFVJLSA-N	1	1	320.349	1.771	20	5		DDBDMO
C[NH+](C)C1(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)CCOCC1	ZINC001356594702	879119007	/nfs/dbraw/zinc/11/90/07/879119007.db2.gz	DPLDQXJOBMFSMP-HNNXBMFYSA-N	1	1	323.393	1.329	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254478457	896455838	/nfs/dbraw/zinc/45/58/38/896455838.db2.gz	DRYXWWGIJLCEDK-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
CNC(=O)C[N@@H+](C)C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254474970	896457110	/nfs/dbraw/zinc/45/71/10/896457110.db2.gz	WZECBCMCCKZCBZ-UHFFFAOYSA-N	1	1	306.366	1.241	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CC(N2CCOCC2)C1	ZINC001254558484	896500968	/nfs/dbraw/zinc/50/09/68/896500968.db2.gz	BNHZQHUPRIVVOT-ZDUSSCGKSA-N	1	1	305.378	1.542	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+]([C@@H](C)Cc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC001254558374	896501238	/nfs/dbraw/zinc/50/12/38/896501238.db2.gz	FUOYAEFTABCYJB-MUYACECFSA-N	1	1	304.346	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CCN3CCOC[C@@H]3C1)C2	ZINC001254593128	896520936	/nfs/dbraw/zinc/52/09/36/896520936.db2.gz	ISWKNAHUSOXPGB-HOTGVXAUSA-N	1	1	303.362	1.078	20	5		DDBDMO
O=C1NCC[C@@]12CC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254594365	896522676	/nfs/dbraw/zinc/52/26/76/896522676.db2.gz	QIINQQHGKCDKHJ-HOCLYGCPSA-N	1	1	301.346	1.274	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)c1	ZINC001262826141	900387801	/nfs/dbraw/zinc/38/78/01/900387801.db2.gz	CTNNKWSMTICKHI-IACUBPJLSA-N	1	1	303.362	1.973	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000452093836	231299546	/nfs/dbraw/zinc/29/95/46/231299546.db2.gz	JHBLFBMSSKEWGM-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000452093836	231299550	/nfs/dbraw/zinc/29/95/50/231299550.db2.gz	JHBLFBMSSKEWGM-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CCCO)C1	ZINC000452133110	231315869	/nfs/dbraw/zinc/31/58/69/231315869.db2.gz	RNMQEQXCAAPJPH-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000614934636	362084961	/nfs/dbraw/zinc/08/49/61/362084961.db2.gz	AVLKBCQZAONQOU-SNVBAGLBSA-N	1	1	308.338	1.819	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2ncccc2F)c1	ZINC000563704687	303971849	/nfs/dbraw/zinc/97/18/49/303971849.db2.gz	ASLCXXANTGXRMN-GFCCVEGCSA-N	1	1	321.308	1.658	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])[C@H]2C1	ZINC000272768230	210172785	/nfs/dbraw/zinc/17/27/85/210172785.db2.gz	WYWNPNRHLXLBQG-MFKMUULPSA-N	1	1	305.338	1.548	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCC[C@H]1O	ZINC000305358543	529984341	/nfs/dbraw/zinc/98/43/41/529984341.db2.gz	SOPUEKVHUQRGKX-TZMCWYRMSA-N	1	1	307.350	1.287	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[NH+](CCO)CC1	ZINC000289935668	282351068	/nfs/dbraw/zinc/35/10/68/282351068.db2.gz	WSKUUJVFTQVNRJ-UHFFFAOYSA-N	1	1	322.365	1.299	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000459478464	530060379	/nfs/dbraw/zinc/06/03/79/530060379.db2.gz	IROMDBQKDQRXBC-LLVKDONJSA-N	1	1	307.354	1.265	20	5		DDBDMO
CCn1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000616786190	362818874	/nfs/dbraw/zinc/81/88/74/362818874.db2.gz	NXBYJUKGJFPNBT-AWEZNQCLSA-N	1	1	307.354	1.106	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@H](C)[NH2+][C@@H](C)C1	ZINC000070076795	190855843	/nfs/dbraw/zinc/85/58/43/190855843.db2.gz	QNYMVCFDOJRHAQ-UWVGGRQHSA-N	1	1	313.379	1.274	20	5		DDBDMO
C[C@H](CCO)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272563999	209978205	/nfs/dbraw/zinc/97/82/05/209978205.db2.gz	UQLKYNDKOSPJNU-RISCZKNCSA-N	1	1	304.350	1.778	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])c(F)c1)NCC[N@@H+]1CC=CCC1	ZINC000279943607	215257879	/nfs/dbraw/zinc/25/78/79/215257879.db2.gz	HUHUWTDMMBKHJX-UHFFFAOYSA-N	1	1	323.324	1.491	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682389	186096769	/nfs/dbraw/zinc/09/67/69/186096769.db2.gz	PXQXDRABJSXNJL-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682389	186096770	/nfs/dbraw/zinc/09/67/70/186096770.db2.gz	PXQXDRABJSXNJL-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1CCc2n[nH]nc2C1	ZINC000617546955	363170943	/nfs/dbraw/zinc/17/09/43/363170943.db2.gz	AOWMKNMGSJJMRE-UHFFFAOYSA-N	1	1	303.322	1.670	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000046056445	352434976	/nfs/dbraw/zinc/43/49/76/352434976.db2.gz	ANWLTYKWKRXSLN-AWEZNQCLSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000066053538	352976231	/nfs/dbraw/zinc/97/62/31/352976231.db2.gz	VGZAYJPVIQYCMZ-UHFFFAOYSA-N	1	1	316.361	1.760	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+](CCO)CC2CC2)c2c(c1)COCO2	ZINC000064516218	352939789	/nfs/dbraw/zinc/93/97/89/352939789.db2.gz	VYJHPABFAJSWCP-UHFFFAOYSA-N	1	1	308.334	1.666	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CCC[C@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000067374577	353046014	/nfs/dbraw/zinc/04/60/14/353046014.db2.gz	DMYDJBKDOQKKMM-UONOGXRCSA-N	1	1	305.334	1.157	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC[C@H](O)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000067374577	353046019	/nfs/dbraw/zinc/04/60/19/353046019.db2.gz	DMYDJBKDOQKKMM-UONOGXRCSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000331908271	234263037	/nfs/dbraw/zinc/26/30/37/234263037.db2.gz	ALQZSRQGYVHPQL-UWVGGRQHSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000331908271	234263040	/nfs/dbraw/zinc/26/30/40/234263040.db2.gz	ALQZSRQGYVHPQL-UWVGGRQHSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000067412506	353047518	/nfs/dbraw/zinc/04/75/18/353047518.db2.gz	SANZDKMMPVOXTM-CQSZACIVSA-N	1	1	321.377	1.822	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000069046351	353142468	/nfs/dbraw/zinc/14/24/68/353142468.db2.gz	GWURMKJEMIRIDW-ZDUSSCGKSA-N	1	1	323.397	1.418	20	5		DDBDMO
COCC[N@@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])s1	ZINC000069530358	353166142	/nfs/dbraw/zinc/16/61/42/353166142.db2.gz	PWUPQLIXZYUGKU-JTQLQIEISA-N	1	1	313.379	1.497	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])s1	ZINC000069530358	353166145	/nfs/dbraw/zinc/16/61/45/353166145.db2.gz	PWUPQLIXZYUGKU-JTQLQIEISA-N	1	1	313.379	1.497	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@H+](C)CC[C@@H](C)O)cccc1[N+](=O)[O-]	ZINC000072713607	353210859	/nfs/dbraw/zinc/21/08/59/353210859.db2.gz	FZJDZVBFMYRHMB-ZYHUDNBSSA-N	1	1	309.366	1.933	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)CC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000074106279	353292529	/nfs/dbraw/zinc/29/25/29/353292529.db2.gz	YFQHWOFVDHBDHI-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000174186076	198302799	/nfs/dbraw/zinc/30/27/99/198302799.db2.gz	TYGHSUTZQLRCKA-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)ncc1[N+](=O)[O-]	ZINC000074746520	353328544	/nfs/dbraw/zinc/32/85/44/353328544.db2.gz	JNNIOAJXXZYKNQ-GFCCVEGCSA-N	1	1	321.381	1.298	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+](CC)CCC)c1[N+](=O)[O-]	ZINC000174642610	198363136	/nfs/dbraw/zinc/36/31/36/198363136.db2.gz	AUROHECQQDJLRP-UHFFFAOYSA-N	1	1	311.386	1.732	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H](C(F)(F)F)C2)c1	ZINC000174657025	198366737	/nfs/dbraw/zinc/36/67/37/198366737.db2.gz	AQCXSAHEEAAVIC-GXSJLCMTSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[N@@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@H](c2ccccc2)C1	ZINC000076267384	353409452	/nfs/dbraw/zinc/40/94/52/353409452.db2.gz	BIXTXNHPBQSVDV-ZDUSSCGKSA-N	1	1	314.349	1.460	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)[C@H](c2ccccc2)C1	ZINC000076267384	353409457	/nfs/dbraw/zinc/40/94/57/353409457.db2.gz	BIXTXNHPBQSVDV-ZDUSSCGKSA-N	1	1	314.349	1.460	20	5		DDBDMO
COC(=O)C[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090524758	353795101	/nfs/dbraw/zinc/79/51/01/353795101.db2.gz	CNGDYGUXHPAYFH-GFCCVEGCSA-N	1	1	323.349	1.174	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000093333664	353895782	/nfs/dbraw/zinc/89/57/82/353895782.db2.gz	NDMHONBHJREZFC-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
CCc1nn(C)c(N[C@H]2CCC[N@@H+](CCOC)C2)c1[N+](=O)[O-]	ZINC000094156438	353911611	/nfs/dbraw/zinc/91/16/11/353911611.db2.gz	MQUVWEQQMSKBNE-NSHDSACASA-N	1	1	311.386	1.413	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000108307524	353950004	/nfs/dbraw/zinc/95/00/04/353950004.db2.gz	FXEWKQXZKNJNNV-ZDUSSCGKSA-N	1	1	318.377	1.607	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1NC1CCN(C2CC[NH+](C)CC2)CC1	ZINC000139798467	354131456	/nfs/dbraw/zinc/13/14/56/354131456.db2.gz	XJGNAWANDAUAML-UHFFFAOYSA-N	1	1	322.413	1.299	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CC2)CC1	ZINC000149240344	354172128	/nfs/dbraw/zinc/17/21/28/354172128.db2.gz	FMRJKIIQLVIOCC-UHFFFAOYSA-N	1	1	303.362	1.834	20	5		DDBDMO
Cc1c(NC(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154978977	354210307	/nfs/dbraw/zinc/21/03/07/354210307.db2.gz	RGENMQFYFUQVRX-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1c(NC(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000154978977	354210309	/nfs/dbraw/zinc/21/03/09/354210309.db2.gz	RGENMQFYFUQVRX-RISCZKNCSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[N@@H+](C[C@H](O)C1CC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000305708926	354470737	/nfs/dbraw/zinc/47/07/37/354470737.db2.gz	FJOOCMTZJGLBQH-GJZGRUSLSA-N	1	1	319.361	1.403	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@](O)(C(F)(F)F)C1	ZINC000314926009	354489500	/nfs/dbraw/zinc/48/95/00/354489500.db2.gz	WKBSHWMINIVAMZ-JTQLQIEISA-N	1	1	308.260	1.099	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC[C@@](O)(C(F)(F)F)C1	ZINC000314926009	354489502	/nfs/dbraw/zinc/48/95/02/354489502.db2.gz	WKBSHWMINIVAMZ-JTQLQIEISA-N	1	1	308.260	1.099	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[NH+](CCCF)CC2)cc1[N+](=O)[O-]	ZINC000402692162	354669256	/nfs/dbraw/zinc/66/92/56/354669256.db2.gz	LQNZPHARPDBOEO-UHFFFAOYSA-N	1	1	324.356	1.754	20	5		DDBDMO
CCOc1cc(N2CCO[C@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000585783574	354842182	/nfs/dbraw/zinc/84/21/82/354842182.db2.gz	BDAHJNKVCRXLMR-CABCVRRESA-N	1	1	321.377	1.903	20	5		DDBDMO
C[C@@H](Nc1cc(N)c([N+](=O)[O-])c(CO)c1)[C@@H](C)[NH+]1CCOCC1	ZINC000587882049	354886409	/nfs/dbraw/zinc/88/64/09/354886409.db2.gz	RVBINPWAZUTNER-GHMZBOCLSA-N	1	1	324.381	1.190	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3c(F)cccc3[N+](=O)[O-])CC2)C1	ZINC000587979574	354888974	/nfs/dbraw/zinc/88/89/74/354888974.db2.gz	LTMAFOJHUCCGMG-CYBMUJFWSA-N	1	1	322.384	1.950	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588861874	354944508	/nfs/dbraw/zinc/94/45/08/354944508.db2.gz	VTYRTBXSUPIVGC-RYUDHWBXSA-N	1	1	323.324	1.015	20	5		DDBDMO
COc1cc(C[N@@H+](C)C[C@H](O)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000589198181	354972860	/nfs/dbraw/zinc/97/28/60/354972860.db2.gz	PNVPPHVINKQKKL-ZDUSSCGKSA-N	1	1	310.350	1.815	20	5		DDBDMO
CC[N@H+]1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000589497767	354997124	/nfs/dbraw/zinc/99/71/24/354997124.db2.gz	APWFZJLGSMQYJC-GFCCVEGCSA-N	1	1	321.377	1.907	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000589941442	355033805	/nfs/dbraw/zinc/03/38/05/355033805.db2.gz	INYUWYGNPWEOTJ-TVQRCGJNSA-N	1	1	308.313	1.902	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590441579	355095578	/nfs/dbraw/zinc/09/55/78/355095578.db2.gz	DAKPKNWYHNDAFA-FZMZJTMJSA-N	1	1	304.350	1.413	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000346452227	283106243	/nfs/dbraw/zinc/10/62/43/283106243.db2.gz	KFSVKKFTGXZOSB-CYBMUJFWSA-N	1	1	305.334	1.280	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000346452227	283106247	/nfs/dbraw/zinc/10/62/47/283106247.db2.gz	KFSVKKFTGXZOSB-CYBMUJFWSA-N	1	1	305.334	1.280	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc(CC)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592830452	355705998	/nfs/dbraw/zinc/70/59/98/355705998.db2.gz	FEGSWKWHMNSGHK-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(CC)c1[N+](=O)[O-])[C@@H]1CC[N@H+](C)C1	ZINC000592830452	355706001	/nfs/dbraw/zinc/70/60/01/355706001.db2.gz	FEGSWKWHMNSGHK-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(CC)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000592830452	355706004	/nfs/dbraw/zinc/70/60/04/355706004.db2.gz	FEGSWKWHMNSGHK-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000593017112	355771123	/nfs/dbraw/zinc/77/11/23/355771123.db2.gz	DRUQDWUFQOVUPM-GXTWGEPZSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN1CCC[C@@H]1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000593017112	355771128	/nfs/dbraw/zinc/77/11/28/355771128.db2.gz	DRUQDWUFQOVUPM-GXTWGEPZSA-N	1	1	305.382	1.570	20	5		DDBDMO
CN1CCC[C@@H]1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000593017112	355771132	/nfs/dbraw/zinc/77/11/32/355771132.db2.gz	DRUQDWUFQOVUPM-GXTWGEPZSA-N	1	1	305.382	1.570	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000593032354	355775398	/nfs/dbraw/zinc/77/53/98/355775398.db2.gz	YVZCVTSPRQAEBC-CQSZACIVSA-N	1	1	321.377	1.907	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000593187606	355820099	/nfs/dbraw/zinc/82/00/99/355820099.db2.gz	MKHPHXODYNUZKI-USWWRNFRSA-N	1	1	306.366	1.851	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1[C@H](C)C[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC000593188344	355820769	/nfs/dbraw/zinc/82/07/69/355820769.db2.gz	DHWAWRGMLVUYSP-WOPDTQHZSA-N	1	1	323.397	1.429	20	5		DDBDMO
CC(C)c1ccc(CN2CC([N@H+]3CC[C@@H](O)C3)C2)cc1[N+](=O)[O-]	ZINC000593679043	355964849	/nfs/dbraw/zinc/96/48/49/355964849.db2.gz	ABDOTPJSFNPJTG-OAHLLOKOSA-N	1	1	319.405	1.969	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH+]2CC3(CC3(F)F)C2)c1	ZINC000594570238	356252416	/nfs/dbraw/zinc/25/24/16/356252416.db2.gz	IPBODRLWVUFJQN-NSHDSACASA-N	1	1	314.288	1.676	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC2CC[NH+]([C@H]3CCOC3)CC2)cc1	ZINC000594502526	356238642	/nfs/dbraw/zinc/23/86/42/356238642.db2.gz	KIIUTQHOMRAUKZ-INIZCTEOSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@@H]1CC[C@@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CS1(=O)=O	ZINC000594973893	356366893	/nfs/dbraw/zinc/36/68/93/356366893.db2.gz	GGCMOLCDQFDRBM-PSASIEDQSA-N	1	1	304.393	1.712	20	5		DDBDMO
C[C@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CS1(=O)=O	ZINC000594976959	356367002	/nfs/dbraw/zinc/36/70/02/356367002.db2.gz	RGECIYWDELVJQY-GXSJLCMTSA-N	1	1	316.354	1.789	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H](C)C(=O)NC	ZINC000081539396	192286480	/nfs/dbraw/zinc/28/64/80/192286480.db2.gz	AHEBHBMDOCVIHC-NSHDSACASA-N	1	1	309.366	1.807	20	5		DDBDMO
CCCNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])nc2)CC1	ZINC000358763359	299246027	/nfs/dbraw/zinc/24/60/27/299246027.db2.gz	VSWIRWRQPVJUCC-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1	ZINC000595607887	356574654	/nfs/dbraw/zinc/57/46/54/356574654.db2.gz	LKGUGIQROIRKRL-LLVKDONJSA-N	1	1	305.313	1.848	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](Cn2ccnn2)C1	ZINC000595608366	356574987	/nfs/dbraw/zinc/57/49/87/356574987.db2.gz	OJXSQDBYFBBZJM-LBPRGKRZSA-N	1	1	317.349	1.717	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1CCO	ZINC000595695903	356611902	/nfs/dbraw/zinc/61/19/02/356611902.db2.gz	JBFUFRFUZJUKGA-BXUZGUMPSA-N	1	1	321.377	1.677	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000595744231	356632495	/nfs/dbraw/zinc/63/24/95/356632495.db2.gz	UUBOYUKBTWJOIP-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595765009	356643405	/nfs/dbraw/zinc/64/34/05/356643405.db2.gz	GBQVTPNZQZGZDI-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829824	356668072	/nfs/dbraw/zinc/66/80/72/356668072.db2.gz	ILBFDPUHCPWWIL-NEPJUHHUSA-N	1	1	305.334	1.502	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]2COC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595829824	356668076	/nfs/dbraw/zinc/66/80/76/356668076.db2.gz	ILBFDPUHCPWWIL-NEPJUHHUSA-N	1	1	305.334	1.502	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@H]3CNCCO3)CC2)cc1	ZINC000595886666	356692000	/nfs/dbraw/zinc/69/20/00/356692000.db2.gz	XXCBFFJEUDUMQH-MRXNPFEDSA-N	1	1	321.377	1.426	20	5		DDBDMO
CN1CC[NH+](CCCNc2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000596063113	356758054	/nfs/dbraw/zinc/75/80/54/356758054.db2.gz	SEXXPNVIZGEKPG-UHFFFAOYSA-N	1	1	313.789	1.115	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000596231172	356825422	/nfs/dbraw/zinc/82/54/22/356825422.db2.gz	GVEOVAVXAURPEH-UHFFFAOYSA-N	1	1	313.361	1.893	20	5		DDBDMO
CCC[N@H+]1CC[C@H](Nc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000596517346	356903148	/nfs/dbraw/zinc/90/31/48/356903148.db2.gz	NQNOLCCVRDPQSX-NSHDSACASA-N	1	1	308.338	1.673	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597858576	357360841	/nfs/dbraw/zinc/36/08/41/357360841.db2.gz	NMNLIYCAWSXPGD-VIFPVBQESA-N	1	1	309.370	1.483	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1CO	ZINC000598645105	357667868	/nfs/dbraw/zinc/66/78/68/357667868.db2.gz	DOKXKCKRNLTKSL-RISCZKNCSA-N	1	1	322.361	1.912	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)Cn1c[nH+]cc1C	ZINC000599120493	357821130	/nfs/dbraw/zinc/82/11/30/357821130.db2.gz	DODGTWWHXMZMQD-UHFFFAOYSA-N	1	1	304.306	1.425	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000599564075	357974545	/nfs/dbraw/zinc/97/45/45/357974545.db2.gz	QCSUDTGDOJMBRO-ABAIWWIYSA-N	1	1	308.334	1.920	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)COC1	ZINC000599574056	357980335	/nfs/dbraw/zinc/98/03/35/357980335.db2.gz	NDXJBNHZDCHPBR-ZDUSSCGKSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1C[C@@H](O)C1	ZINC000599656518	358010569	/nfs/dbraw/zinc/01/05/69/358010569.db2.gz	WVKJTTZAQPJSNC-XQQFMLRXSA-N	1	1	310.350	1.037	20	5		DDBDMO
CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C1CC[NH+](C)CC1	ZINC000599986770	358096629	/nfs/dbraw/zinc/09/66/29/358096629.db2.gz	ZPKOJTWTBCTXOO-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000600315511	358194309	/nfs/dbraw/zinc/19/43/09/358194309.db2.gz	ULSKKJRMNYOBSY-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000601125505	358412374	/nfs/dbraw/zinc/41/23/74/358412374.db2.gz	NOIFZAXJHDYEJY-JTQLQIEISA-N	1	1	311.313	1.184	20	5		DDBDMO
C[S@@](=O)C1(CNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000601160334	358427144	/nfs/dbraw/zinc/42/71/44/358427144.db2.gz	UNWURSKBYYOARL-OAQYLSRUSA-N	1	1	305.359	1.888	20	5		DDBDMO
CC(C)NC(=O)[C@@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601177114	358435549	/nfs/dbraw/zinc/43/55/49/358435549.db2.gz	TYFXKBRMPKZHQX-SNVBAGLBSA-N	1	1	302.334	1.890	20	5		DDBDMO
Cc1cc(S(=O)(=O)NCC[N@H+](C)C(C)C)c([N+](=O)[O-])s1	ZINC000601400205	358536107	/nfs/dbraw/zinc/53/61/07/358536107.db2.gz	WHPWPSNTHUPPFT-UHFFFAOYSA-N	1	1	321.424	1.583	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C	ZINC000185484107	199857639	/nfs/dbraw/zinc/85/76/39/199857639.db2.gz	KIFLCEUNJCVUPF-UHFFFAOYSA-N	1	1	324.381	1.647	20	5		DDBDMO
Cn1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)c([N+](=O)[O-])n1	ZINC000602484126	359009815	/nfs/dbraw/zinc/00/98/15/359009815.db2.gz	HPIFYHOSWNSOLR-DOMZBBRYSA-N	1	1	319.409	1.777	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCOCC2(CCOCC2)C1	ZINC000602807884	359204483	/nfs/dbraw/zinc/20/44/83/359204483.db2.gz	XBPSVEMIRYUSCC-UHFFFAOYSA-N	1	1	324.381	1.229	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C)[C@@H](C(C)(C)C)C1	ZINC000602873306	359256937	/nfs/dbraw/zinc/25/69/37/359256937.db2.gz	IVTBKGYKECRNED-CYBMUJFWSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCN(C)[C@@H](C(C)(C)C)C1	ZINC000602873306	359256940	/nfs/dbraw/zinc/25/69/40/359256940.db2.gz	IVTBKGYKECRNED-CYBMUJFWSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCN(C)[C@@H](C(C)(C)C)C1	ZINC000602873306	359256942	/nfs/dbraw/zinc/25/69/42/359256942.db2.gz	IVTBKGYKECRNED-CYBMUJFWSA-N	1	1	309.414	1.762	20	5		DDBDMO
COC(=O)C[N@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCCCC1	ZINC000602883193	359266137	/nfs/dbraw/zinc/26/61/37/359266137.db2.gz	OGUCWSSLAICWNA-UHFFFAOYSA-N	1	1	324.381	1.907	20	5		DDBDMO
COC(=O)C[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C1CCCCC1	ZINC000602883193	359266140	/nfs/dbraw/zinc/26/61/40/359266140.db2.gz	OGUCWSSLAICWNA-UHFFFAOYSA-N	1	1	324.381	1.907	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602963067	359326074	/nfs/dbraw/zinc/32/60/74/359326074.db2.gz	SUXQZCXHFSPJPB-GDBMZVCRSA-N	1	1	307.394	1.876	20	5		DDBDMO
CCN(CC)C(=O)C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000602965908	359329514	/nfs/dbraw/zinc/32/95/14/359329514.db2.gz	QURBLKYQBGXJIO-HNNXBMFYSA-N	1	1	309.366	1.260	20	5		DDBDMO
C[C@@H]1CC[NH2+]C[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000186766411	200005965	/nfs/dbraw/zinc/00/59/65/200005965.db2.gz	HFBXFUUYFWPKBJ-PRHODGIISA-N	1	1	303.322	1.199	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C	ZINC000603396371	359613947	/nfs/dbraw/zinc/61/39/47/359613947.db2.gz	ICBVGDJBWUUVAI-GHMZBOCLSA-N	1	1	309.370	1.240	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C(C)C)C2)n1	ZINC000281072516	216061232	/nfs/dbraw/zinc/06/12/32/216061232.db2.gz	AQDHWBWORIBIPL-JTQLQIEISA-N	1	1	308.338	1.671	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000604532824	359761934	/nfs/dbraw/zinc/76/19/34/359761934.db2.gz	NPZHTUREJKGCAC-GFCCVEGCSA-N	1	1	307.350	1.550	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000604532824	359761938	/nfs/dbraw/zinc/76/19/38/359761938.db2.gz	NPZHTUREJKGCAC-GFCCVEGCSA-N	1	1	307.350	1.550	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000281208478	216154012	/nfs/dbraw/zinc/15/40/12/216154012.db2.gz	SHYKSTFTRNIZQO-HNNXBMFYSA-N	1	1	307.350	1.432	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000609478983	360311239	/nfs/dbraw/zinc/31/12/39/360311239.db2.gz	AHTAGLBHKYBWAI-LLVKDONJSA-N	1	1	321.381	1.485	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000610239877	360395446	/nfs/dbraw/zinc/39/54/46/360395446.db2.gz	AQMAGFYUVPQLAH-CQSZACIVSA-N	1	1	321.377	1.364	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000611084577	360617666	/nfs/dbraw/zinc/61/76/66/360617666.db2.gz	FMRQNGCXOFELML-NSHDSACASA-N	1	1	306.366	1.485	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCO1	ZINC000611268275	360683817	/nfs/dbraw/zinc/68/38/17/360683817.db2.gz	IXBHJWJURXARLK-NSHDSACASA-N	1	1	308.334	1.977	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CCCO1	ZINC000611268275	360683818	/nfs/dbraw/zinc/68/38/18/360683818.db2.gz	IXBHJWJURXARLK-NSHDSACASA-N	1	1	308.334	1.977	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)n1	ZINC000611335230	360700733	/nfs/dbraw/zinc/70/07/33/360700733.db2.gz	HHVCQTBMGOXSFW-GFCCVEGCSA-N	1	1	321.381	1.132	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@@H](C(F)F)C1	ZINC000612110344	360923383	/nfs/dbraw/zinc/92/33/83/360923383.db2.gz	DLVXILPDBGJFGS-MNOVXSKESA-N	1	1	316.304	1.922	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1C	ZINC000619537148	364052583	/nfs/dbraw/zinc/05/25/83/364052583.db2.gz	ZGUXZJMKMIUAGR-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](O)CC1	ZINC000293061536	223377235	/nfs/dbraw/zinc/37/72/35/223377235.db2.gz	IMNDROKKUWQIEM-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](O)CC1	ZINC000293061536	223377237	/nfs/dbraw/zinc/37/72/37/223377237.db2.gz	IMNDROKKUWQIEM-BXUZGUMPSA-N	1	1	307.350	1.769	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C)n2)[C@H](C)C1	ZINC000271751374	209182403	/nfs/dbraw/zinc/18/24/03/209182403.db2.gz	YSDDPTQTPYYISZ-LLVKDONJSA-N	1	1	322.365	1.372	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+](CCO)CCCO)c1	ZINC000093324206	193231373	/nfs/dbraw/zinc/23/13/73/193231373.db2.gz	LENFWJROVOMOLZ-UHFFFAOYSA-N	1	1	320.292	1.373	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+](CCO)CCCO)c1	ZINC000093324206	193231374	/nfs/dbraw/zinc/23/13/74/193231374.db2.gz	LENFWJROVOMOLZ-UHFFFAOYSA-N	1	1	320.292	1.373	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000264676932	204071111	/nfs/dbraw/zinc/07/11/11/204071111.db2.gz	VXTIUBJNHBKXFC-UHFFFAOYSA-N	1	1	310.373	1.808	20	5		DDBDMO
Cc1cc(C(=O)NCC[NH+]2CCSCC2)c(N)c([N+](=O)[O-])c1	ZINC000264892697	204244344	/nfs/dbraw/zinc/24/43/44/204244344.db2.gz	XOBNZMPZWDSVJR-UHFFFAOYSA-N	1	1	324.406	1.264	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCOCC1	ZINC000267558130	206143840	/nfs/dbraw/zinc/14/38/40/206143840.db2.gz	ABJBLEFODYHPGX-WBMJQRKESA-N	1	1	323.368	1.886	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]1N1CCOCC1	ZINC000267558130	206143843	/nfs/dbraw/zinc/14/38/43/206143843.db2.gz	ABJBLEFODYHPGX-WBMJQRKESA-N	1	1	323.368	1.886	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)cc[nH+]1	ZINC000359632475	299503364	/nfs/dbraw/zinc/50/33/64/299503364.db2.gz	JRDAHNSIFJQOAG-UHFFFAOYSA-N	1	1	303.278	1.409	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCCC[C@@H]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000109785743	194284818	/nfs/dbraw/zinc/28/48/18/194284818.db2.gz	KFCHWULQBIENQJ-CQSZACIVSA-N	1	1	321.377	1.795	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCC[C@@H]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000109785743	194284821	/nfs/dbraw/zinc/28/48/21/194284821.db2.gz	KFCHWULQBIENQJ-CQSZACIVSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939991	251290431	/nfs/dbraw/zinc/29/04/31/251290431.db2.gz	XTJUVCLSYINTFS-SKDRFNHKSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939991	251290435	/nfs/dbraw/zinc/29/04/35/251290435.db2.gz	XTJUVCLSYINTFS-SKDRFNHKSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341009063	251333733	/nfs/dbraw/zinc/33/37/33/251333733.db2.gz	AHJGRHFAVIKMMT-AAEUAGOBSA-N	1	1	306.366	1.877	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000341024818	251345253	/nfs/dbraw/zinc/34/52/53/251345253.db2.gz	HZPCLTBPOYNTOT-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000408199440	285079829	/nfs/dbraw/zinc/07/98/29/285079829.db2.gz	SDWBDZIYOLXBMJ-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000408199440	285079831	/nfs/dbraw/zinc/07/98/31/285079831.db2.gz	SDWBDZIYOLXBMJ-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCCCO1	ZINC000272969443	210352427	/nfs/dbraw/zinc/35/24/27/210352427.db2.gz	BETPXVWPUCPMJR-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@H](CC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000352541498	285127787	/nfs/dbraw/zinc/12/77/87/285127787.db2.gz	YNGFMXZCKXMYHB-LLVKDONJSA-N	1	1	307.350	1.691	20	5		DDBDMO
COC[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCO1	ZINC000434790405	533094094	/nfs/dbraw/zinc/09/40/94/533094094.db2.gz	UJXFIFFABINDMG-KBPBESRZSA-N	1	1	320.349	1.755	20	5		DDBDMO
CC(C)(C)OC(=O)[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000156764825	197138626	/nfs/dbraw/zinc/13/86/26/197138626.db2.gz	DMQOJWQXFFRMFD-LBPRGKRZSA-N	1	1	324.381	1.845	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@@H+](CC)C2)c1[N+](=O)[O-]	ZINC000156765701	197139171	/nfs/dbraw/zinc/13/91/71/197139171.db2.gz	QLIJATHJUDVXAK-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CCC[C@@H]1O	ZINC000352687913	285228301	/nfs/dbraw/zinc/22/83/01/285228301.db2.gz	ACFUCHFWQHXUSX-OLZOCXBDSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[NH+](C)C1CN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000294791866	224224817	/nfs/dbraw/zinc/22/48/17/224224817.db2.gz	BKNXRPFMRNHPKN-UHFFFAOYSA-N	1	1	305.334	1.330	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000352798022	285307736	/nfs/dbraw/zinc/30/77/36/285307736.db2.gz	WYQUJYBNQKUMCP-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000352869379	285348170	/nfs/dbraw/zinc/34/81/70/285348170.db2.gz	WJXRSTUEQCBWKN-QWRGUYRKSA-N	1	1	323.397	1.629	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1F	ZINC000294869977	533539039	/nfs/dbraw/zinc/53/90/39/533539039.db2.gz	BVXZDLKSWYBXOS-SECBINFHSA-N	1	1	311.313	1.567	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000266575922	407567261	/nfs/dbraw/zinc/56/72/61/407567261.db2.gz	LWRSROHMIWCUHC-HNNXBMFYSA-N	1	1	304.350	1.593	20	5		DDBDMO
Cc1cn2cc(Nc3ncc([N+](=O)[O-])cc3C(N)=O)ccc2[nH+]1	ZINC000361055393	299796198	/nfs/dbraw/zinc/79/61/98/299796198.db2.gz	VZPJQHIQHAMLDL-UHFFFAOYSA-N	1	1	312.289	1.788	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCO[C@H](C)C1	ZINC000026342659	406903860	/nfs/dbraw/zinc/90/38/60/406903860.db2.gz	UPLSZAHTRKBUEP-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C)C1	ZINC000026342659	406903863	/nfs/dbraw/zinc/90/38/63/406903863.db2.gz	UPLSZAHTRKBUEP-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2cccs2)C2CC2)c1	ZINC000075597178	406935620	/nfs/dbraw/zinc/93/56/20/406935620.db2.gz	VWJMOCYLQUUBMO-ZDUSSCGKSA-N	1	1	322.390	1.878	20	5		DDBDMO
COCCC[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000066378931	407249842	/nfs/dbraw/zinc/24/98/42/407249842.db2.gz	AFLMERJJNPMARK-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
COCCC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000066378931	407249844	/nfs/dbraw/zinc/24/98/44/407249844.db2.gz	AFLMERJJNPMARK-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCn1cccn1	ZINC000111283337	407406112	/nfs/dbraw/zinc/40/61/12/407406112.db2.gz	IQVSQHUFMPZHEC-LBPRGKRZSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCn1cccn1	ZINC000111283337	407406113	/nfs/dbraw/zinc/40/61/13/407406113.db2.gz	IQVSQHUFMPZHEC-LBPRGKRZSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@@H](O)C1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000111288404	407407096	/nfs/dbraw/zinc/40/70/96/407407096.db2.gz	JGUVVFHTYITGOD-GFCCVEGCSA-N	1	1	321.377	1.650	20	5		DDBDMO
NC(=O)N1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000111688620	407414859	/nfs/dbraw/zinc/41/48/59/407414859.db2.gz	ABXYLKAWRDLILG-UHFFFAOYSA-N	1	1	308.338	1.060	20	5		DDBDMO
COC[C@@H]1CC[N@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000265821213	407470904	/nfs/dbraw/zinc/47/09/04/407470904.db2.gz	RZKBQDHNBMYEHP-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000265821213	407470910	/nfs/dbraw/zinc/47/09/10/407470910.db2.gz	RZKBQDHNBMYEHP-LLVKDONJSA-N	1	1	323.349	1.510	20	5		DDBDMO
O=C(CCCC[NH+]1CCOCC1)NCc1ccccc1[N+](=O)[O-]	ZINC000170694564	407477675	/nfs/dbraw/zinc/47/76/75/407477675.db2.gz	XBZDKYWSSCNJPT-UHFFFAOYSA-N	1	1	321.377	1.714	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]1CCOC1	ZINC000178757917	407586327	/nfs/dbraw/zinc/58/63/27/407586327.db2.gz	MEWPYDQYFFDQGS-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1CCOC1	ZINC000178775970	407598454	/nfs/dbraw/zinc/59/84/54/407598454.db2.gz	ZJFCKPPYVIDVQI-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[NH+](C)[C@H]1CCN(c2sc(S(C)(=O)=O)cc2[N+](=O)[O-])C1	ZINC000271374038	407658833	/nfs/dbraw/zinc/65/88/33/407658833.db2.gz	ZNGXKDNRJLKGBM-QMMMGPOBSA-N	1	1	319.408	1.200	20	5		DDBDMO
CN1CC[NH+](CCCNc2nc3sccn3c2[N+](=O)[O-])CC1	ZINC000266658229	407594600	/nfs/dbraw/zinc/59/46/00/407594600.db2.gz	ZREFVZBEXLVYGQ-UHFFFAOYSA-N	1	1	324.410	1.353	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)[N@@H+](C)CC(C)(C)O)cccc1[N+](=O)[O-]	ZINC000267150787	407767866	/nfs/dbraw/zinc/76/78/66/407767866.db2.gz	MMVJBPXZXMBNKS-LLVKDONJSA-N	1	1	309.366	1.933	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C[C@@H](C)O)CC1	ZINC000186784800	407768981	/nfs/dbraw/zinc/76/89/81/407768981.db2.gz	KJGZWYMISLWOAC-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc(NC(=O)C(=O)NCC[N@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000118123667	407900490	/nfs/dbraw/zinc/90/04/90/407900490.db2.gz	LCAUKPIPKYGUSF-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
C[C@H](NC(=O)CNc1ccccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000273060357	408037514	/nfs/dbraw/zinc/03/75/14/408037514.db2.gz	YJKRMQOLEQXAJS-LBPRGKRZSA-N	1	1	318.377	1.773	20	5		DDBDMO
C[C@@H](CCO)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000272563994	407985646	/nfs/dbraw/zinc/98/56/46/407985646.db2.gz	UQLKYNDKOSPJNU-FZMZJTMJSA-N	1	1	304.350	1.778	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000189679182	408076866	/nfs/dbraw/zinc/07/68/66/408076866.db2.gz	ANMSTFJXXAVZQI-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCOC1	ZINC000245897457	408089872	/nfs/dbraw/zinc/08/98/72/408089872.db2.gz	FCPBRGCAHFHRQX-DZGCQCFKSA-N	1	1	324.377	1.693	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000246253242	408194668	/nfs/dbraw/zinc/19/46/68/408194668.db2.gz	TXNAAEADHMYQQJ-WDEREUQCSA-N	1	1	322.365	1.236	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CCn1cc([N+](=O)[O-])nc1C)C1CC1	ZINC000263771657	408249186	/nfs/dbraw/zinc/24/91/86/408249186.db2.gz	SVOJBFXAWVGCKE-UHFFFAOYSA-N	1	1	309.370	1.090	20	5		DDBDMO
Cn1cccc1[C@@H]1CCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000246465375	408264355	/nfs/dbraw/zinc/26/43/55/408264355.db2.gz	AKJYTKNBPAHZKU-HIFRSBDPSA-N	1	1	319.365	1.328	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000190335279	408223075	/nfs/dbraw/zinc/22/30/75/408223075.db2.gz	XTJXPORVIIWHPV-CORIIIEPSA-N	1	1	310.350	1.037	20	5		DDBDMO
CCCN1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000269381642	408289149	/nfs/dbraw/zinc/28/91/49/408289149.db2.gz	JQBCVPZCXDZGJA-UHFFFAOYSA-N	1	1	309.370	1.609	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])CC1	ZINC000269381642	408289155	/nfs/dbraw/zinc/28/91/55/408289155.db2.gz	JQBCVPZCXDZGJA-UHFFFAOYSA-N	1	1	309.370	1.609	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000274231994	408334917	/nfs/dbraw/zinc/33/49/17/408334917.db2.gz	DZKLVZRVGDPJBX-SECBINFHSA-N	1	1	312.297	1.737	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1	ZINC000274231994	408334920	/nfs/dbraw/zinc/33/49/20/408334920.db2.gz	DZKLVZRVGDPJBX-SECBINFHSA-N	1	1	312.297	1.737	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183197113	408349409	/nfs/dbraw/zinc/34/94/09/408349409.db2.gz	MVDYXJUNXOXCFN-NEPJUHHUSA-N	1	1	310.350	1.685	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000264063692	408358574	/nfs/dbraw/zinc/35/85/74/408358574.db2.gz	ABFQRJLITPWJCP-NSHDSACASA-N	1	1	315.395	1.603	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000158853233	408364444	/nfs/dbraw/zinc/36/44/44/408364444.db2.gz	PRPHRYSDOXCDLX-YPMHNXCESA-N	1	1	323.397	1.371	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000274417843	408396175	/nfs/dbraw/zinc/39/61/75/408396175.db2.gz	IFRIZGKRLSRQMH-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCn1cc([N+](=O)[O-])cn1)C1CCCC1	ZINC000264192237	408396437	/nfs/dbraw/zinc/39/64/37/408396437.db2.gz	PAAUCYVEZVFKEM-UHFFFAOYSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000183952266	408517838	/nfs/dbraw/zinc/51/78/38/408517838.db2.gz	JCDCBLURZXKSJR-VMPITWQZSA-N	1	1	307.350	1.038	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2ccncc2)c1	ZINC000270544552	408573090	/nfs/dbraw/zinc/57/30/90/408573090.db2.gz	MBWJOXNFVCFQGS-GJZGRUSLSA-N	1	1	317.349	1.384	20	5		DDBDMO
COC[C@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000265211757	408580894	/nfs/dbraw/zinc/58/08/94/408580894.db2.gz	VOUIKPXEVMITEM-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1	ZINC000160922440	408539755	/nfs/dbraw/zinc/53/97/55/408539755.db2.gz	DIAVOYFGDXIBKY-NSHDSACASA-N	1	1	303.322	1.351	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000270840119	408701022	/nfs/dbraw/zinc/70/10/22/408701022.db2.gz	DXEKGTVXRFHTLQ-UXIGCNINSA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@H]21	ZINC000164563870	408801067	/nfs/dbraw/zinc/80/10/67/408801067.db2.gz	DWCUXHPOLMRTLQ-QWHCGFSZSA-N	1	1	321.381	1.042	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@H]1O	ZINC000249585229	408746694	/nfs/dbraw/zinc/74/66/94/408746694.db2.gz	SRJKWAIKGGPKBG-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@H]1O	ZINC000249585229	408746700	/nfs/dbraw/zinc/74/67/00/408746700.db2.gz	SRJKWAIKGGPKBG-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@]1(O)CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000177984597	408749165	/nfs/dbraw/zinc/74/91/65/408749165.db2.gz	FFSCZOLLSZKKHY-HIFRSBDPSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[C@]1(O)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000177984597	408749171	/nfs/dbraw/zinc/74/91/71/408749171.db2.gz	FFSCZOLLSZKKHY-HIFRSBDPSA-N	1	1	305.334	1.157	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001165	408754335	/nfs/dbraw/zinc/75/43/35/408754335.db2.gz	BQXDVDZVXPOLJA-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001165	408754340	/nfs/dbraw/zinc/75/43/40/408754340.db2.gz	BQXDVDZVXPOLJA-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001165	408754345	/nfs/dbraw/zinc/75/43/45/408754345.db2.gz	BQXDVDZVXPOLJA-CMPLNLGQSA-N	1	1	321.381	1.437	20	5		DDBDMO
C[C@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000250112834	408774900	/nfs/dbraw/zinc/77/49/00/408774900.db2.gz	MTEDCFXTRIGYGB-GXTWGEPZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC(C)(C)O1	ZINC000250112834	408774903	/nfs/dbraw/zinc/77/49/03/408774903.db2.gz	MTEDCFXTRIGYGB-GXTWGEPZSA-N	1	1	324.377	1.834	20	5		DDBDMO
CCOCCOCC[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000276286601	408829795	/nfs/dbraw/zinc/82/97/95/408829795.db2.gz	SJYWHWKXDLEOQW-HNNXBMFYSA-N	1	1	312.366	1.613	20	5		DDBDMO
C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@H]1CCC[N@H+](C2CCC2)C1	ZINC000285746217	408855961	/nfs/dbraw/zinc/85/59/61/408855961.db2.gz	HJXCSRZJABAVCB-QWRGUYRKSA-N	1	1	321.381	1.701	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(N)c2F)[C@@H](C)C1	ZINC000281611740	408896646	/nfs/dbraw/zinc/89/66/46/408896646.db2.gz	ZEULRBKZEWHTSF-VHSXEESVSA-N	1	1	312.345	1.207	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000291730413	408914734	/nfs/dbraw/zinc/91/47/34/408914734.db2.gz	JNQUXPVYRWGIOO-GJZGRUSLSA-N	1	1	324.377	1.834	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+]3CCCC[C@@H]23)n1	ZINC000286253073	408949199	/nfs/dbraw/zinc/94/91/99/408949199.db2.gz	IVIYAXOHVIJSHQ-JQWIXIFHSA-N	1	1	320.349	1.815	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@H](c3n[nH]c(=O)o3)C2)cccc1[N+](=O)[O-]	ZINC000284241257	409302369	/nfs/dbraw/zinc/30/23/69/409302369.db2.gz	KWWRTCCLNNLOMS-LBPRGKRZSA-N	1	1	318.333	1.959	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@H](c3n[nH]c(=O)o3)C2)cccc1[N+](=O)[O-]	ZINC000284241257	409302371	/nfs/dbraw/zinc/30/23/71/409302371.db2.gz	KWWRTCCLNNLOMS-LBPRGKRZSA-N	1	1	318.333	1.959	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCNC(=O)CC1	ZINC000295258415	409400848	/nfs/dbraw/zinc/40/08/48/409400848.db2.gz	GSGCMKLCKNPLOF-CQSZACIVSA-N	1	1	305.378	1.985	20	5		DDBDMO
COc1cc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000347017737	164097409	/nfs/dbraw/zinc/09/74/09/164097409.db2.gz	UVAAOQWECWAIQV-ZDUSSCGKSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H]1C[N@@H+]2CCCC[C@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056016	164211203	/nfs/dbraw/zinc/21/12/03/164211203.db2.gz	ZXDBQFPOGNWTQW-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@H]2CN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000408056016	164211206	/nfs/dbraw/zinc/21/12/06/164211206.db2.gz	ZXDBQFPOGNWTQW-MNOVXSKESA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000408093168	164225739	/nfs/dbraw/zinc/22/57/39/164225739.db2.gz	UZTNZWOQJBBREC-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1O	ZINC000408093168	164225741	/nfs/dbraw/zinc/22/57/41/164225741.db2.gz	UZTNZWOQJBBREC-QMTHXVAHSA-N	1	1	308.334	1.664	20	5		DDBDMO
COC(=O)C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2)C1	ZINC000353902836	409550010	/nfs/dbraw/zinc/55/00/10/409550010.db2.gz	YCGFOYIBJPRNGK-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
COC(=O)C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2)C1	ZINC000353902836	409550014	/nfs/dbraw/zinc/55/00/14/409550014.db2.gz	YCGFOYIBJPRNGK-GFCCVEGCSA-N	1	1	307.350	1.892	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000342406694	409603275	/nfs/dbraw/zinc/60/32/75/409603275.db2.gz	HWYPSNYELUMMQM-LLVKDONJSA-N	1	1	306.366	1.472	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CCO1	ZINC000345051013	409608527	/nfs/dbraw/zinc/60/85/27/409608527.db2.gz	JFTCDUUAMAJHTE-LLVKDONJSA-N	1	1	322.365	1.248	20	5		DDBDMO
CC(C)C[C@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000305052866	409662033	/nfs/dbraw/zinc/66/20/33/409662033.db2.gz	NHUSBRMWLRWMLF-HIFRSBDPSA-N	1	1	310.398	1.910	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@H]1CCSC1	ZINC000331640584	409724655	/nfs/dbraw/zinc/72/46/55/409724655.db2.gz	JZAXIMZWXDFGNH-NSHDSACASA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@H]1CCSC1	ZINC000331640584	409724666	/nfs/dbraw/zinc/72/46/66/409724666.db2.gz	JZAXIMZWXDFGNH-NSHDSACASA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@@H]1CCSC1	ZINC000331640581	409725025	/nfs/dbraw/zinc/72/50/25/409725025.db2.gz	JZAXIMZWXDFGNH-LLVKDONJSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2c1cccc2[N+](=O)[O-])[C@@H]1CCSC1	ZINC000331640581	409725035	/nfs/dbraw/zinc/72/50/35/409725035.db2.gz	JZAXIMZWXDFGNH-LLVKDONJSA-N	1	1	321.402	1.921	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CCC(Cc3[nH]cc[nH+]3)CC2)n1	ZINC000332092923	409874342	/nfs/dbraw/zinc/87/43/42/409874342.db2.gz	MQDHJJQGPLUVLB-UHFFFAOYSA-N	1	1	318.337	1.146	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229642	409998683	/nfs/dbraw/zinc/99/86/83/409998683.db2.gz	PNOCBPXJUQZSFQ-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000332229642	409998689	/nfs/dbraw/zinc/99/86/89/409998689.db2.gz	PNOCBPXJUQZSFQ-IINYFYTJSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CCN1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298020340	410081583	/nfs/dbraw/zinc/08/15/83/410081583.db2.gz	DOYBNTLUUZDOFT-CQSZACIVSA-N	1	1	319.409	1.596	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@@H](CO)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000298081893	410105038	/nfs/dbraw/zinc/10/50/38/410105038.db2.gz	MROYJSYQACDBJA-GFCCVEGCSA-N	1	1	319.361	1.188	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@@H](CO)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000298081893	410105042	/nfs/dbraw/zinc/10/50/42/410105042.db2.gz	MROYJSYQACDBJA-GFCCVEGCSA-N	1	1	319.361	1.188	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000332599264	410189242	/nfs/dbraw/zinc/18/92/42/410189242.db2.gz	IPGFPMLUOVHJEM-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@@H+]1C	ZINC000332599264	410189250	/nfs/dbraw/zinc/18/92/50/410189250.db2.gz	IPGFPMLUOVHJEM-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000332683016	410209090	/nfs/dbraw/zinc/20/90/90/410209090.db2.gz	KCXWUEQKTVRBGN-NSHDSACASA-N	1	1	309.370	1.132	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000351774805	410222832	/nfs/dbraw/zinc/22/28/32/410222832.db2.gz	NXSDZXPXNLWHRK-SWHYSGLUSA-N	1	1	305.334	1.013	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000351774805	410222840	/nfs/dbraw/zinc/22/28/40/410222840.db2.gz	NXSDZXPXNLWHRK-SWHYSGLUSA-N	1	1	305.334	1.013	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000298688434	410346072	/nfs/dbraw/zinc/34/60/72/410346072.db2.gz	AOOIBJJFZCCCIH-JTQLQIEISA-N	1	1	324.333	1.702	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H]1C	ZINC000346997050	410300438	/nfs/dbraw/zinc/30/04/38/410300438.db2.gz	CBNQOEATZXNIOC-PWSUYJOCSA-N	1	1	308.334	1.987	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@@H](NC(=O)NC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000355098129	410314594	/nfs/dbraw/zinc/31/45/94/410314594.db2.gz	KZDRNIFZVIARTB-CQSZACIVSA-N	1	1	318.377	1.939	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H](NC(=O)NC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000355098129	410314601	/nfs/dbraw/zinc/31/46/01/410314601.db2.gz	KZDRNIFZVIARTB-CQSZACIVSA-N	1	1	318.377	1.939	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])[nH]1	ZINC000299147080	410544667	/nfs/dbraw/zinc/54/46/67/410544667.db2.gz	ZSHWDCYCWSRVJJ-UHFFFAOYSA-N	1	1	323.397	1.021	20	5		DDBDMO
CN(CCN(C)C1CC[NH+](C)CC1)C(=O)c1ccc([N+](=O)[O-])[nH]1	ZINC000299147080	410544673	/nfs/dbraw/zinc/54/46/73/410544673.db2.gz	ZSHWDCYCWSRVJJ-UHFFFAOYSA-N	1	1	323.397	1.021	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1ncc([N+](=O)[O-])c(N)n1	ZINC000301141884	410663810	/nfs/dbraw/zinc/66/38/10/410663810.db2.gz	CDPZOKCWRGVHBW-AXFHLTTASA-N	1	1	308.386	1.745	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000359385943	410633616	/nfs/dbraw/zinc/63/36/16/410633616.db2.gz	CUOHBQWGIWPHAY-UHFFFAOYSA-N	1	1	315.276	1.632	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]2c2ccccc2)c1	ZINC000353046448	410755872	/nfs/dbraw/zinc/75/58/72/410755872.db2.gz	AROHVGADWQJTLB-CABCVRRESA-N	1	1	302.334	1.599	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000330569426	410785593	/nfs/dbraw/zinc/78/55/93/410785593.db2.gz	MCUIDYLCPHOQLE-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000330577758	410794358	/nfs/dbraw/zinc/79/43/58/410794358.db2.gz	HBNUTEZEANYGQL-STQMWFEESA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301947444	410836778	/nfs/dbraw/zinc/83/67/78/410836778.db2.gz	YALMSGCNRAFHPW-LLVKDONJSA-N	1	1	304.354	1.924	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCC[C@H](C)C1	ZINC000356150101	410864421	/nfs/dbraw/zinc/86/44/21/410864421.db2.gz	HTHWUJYCCXUDRA-QWRGUYRKSA-N	1	1	309.370	1.179	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)C[C@H]1C	ZINC000330671870	410865318	/nfs/dbraw/zinc/86/53/18/410865318.db2.gz	NHCSOZBDFQKIHE-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C)C[C@H]1C	ZINC000330671870	410865321	/nfs/dbraw/zinc/86/53/21/410865321.db2.gz	NHCSOZBDFQKIHE-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)C[C@H]1C	ZINC000330671870	410865327	/nfs/dbraw/zinc/86/53/27/410865327.db2.gz	NHCSOZBDFQKIHE-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c([C@H](C)NC[C@H]2C[N@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673531	410865415	/nfs/dbraw/zinc/86/54/15/410865415.db2.gz	HKGPOMFCILMVPH-KBPBESRZSA-N	1	1	306.410	1.800	20	5		DDBDMO
Cc1c([C@H](C)NC[C@H]2C[N@@H+](C)CCN2C)cccc1[N+](=O)[O-]	ZINC000330673531	410865419	/nfs/dbraw/zinc/86/54/19/410865419.db2.gz	HKGPOMFCILMVPH-KBPBESRZSA-N	1	1	306.410	1.800	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3cc4nc[nH]c(=O)c4cc3[N+](=O)[O-])C[C@H]2C1	ZINC000302861666	410878344	/nfs/dbraw/zinc/87/83/44/410878344.db2.gz	QEYBIHYRXWNBIQ-AOOOYVTPSA-N	1	1	315.333	1.241	20	5		DDBDMO
Cc1nc(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000301863269	410816805	/nfs/dbraw/zinc/81/68/05/410816805.db2.gz	LVJXVQPFSQPTJQ-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1nc(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)ccc1[N+](=O)[O-]	ZINC000301863269	410816809	/nfs/dbraw/zinc/81/68/09/410816809.db2.gz	LVJXVQPFSQPTJQ-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000348288523	410899480	/nfs/dbraw/zinc/89/94/80/410899480.db2.gz	WMCXNNYDUBSTDS-DVVUODLYSA-N	1	1	322.287	1.425	20	5		DDBDMO
COC(=O)c1cc(C)nc(NC[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000341841960	411069344	/nfs/dbraw/zinc/06/93/44/411069344.db2.gz	KOBXYTPCJJNQJE-JTQLQIEISA-N	1	1	308.338	1.591	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331250739	411041619	/nfs/dbraw/zinc/04/16/19/411041619.db2.gz	ZYWNFEGAXGSVJG-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000331250739	411041624	/nfs/dbraw/zinc/04/16/24/411041624.db2.gz	ZYWNFEGAXGSVJG-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000331250739	411041627	/nfs/dbraw/zinc/04/16/27/411041627.db2.gz	ZYWNFEGAXGSVJG-JTQLQIEISA-N	1	1	309.370	1.608	20	5		DDBDMO
Cc1nc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC000296283258	225725591	/nfs/dbraw/zinc/72/55/91/225725591.db2.gz	HJTWFIQALTXGRP-ZDUSSCGKSA-N	1	1	322.413	1.377	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@H]3CC[C@@H](C2)O3)c1	ZINC000374105751	418488443	/nfs/dbraw/zinc/48/84/43/418488443.db2.gz	JQSHJFVQGHMBTL-YUELXQCFSA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1	ZINC000374105751	418488444	/nfs/dbraw/zinc/48/84/44/418488444.db2.gz	JQSHJFVQGHMBTL-YUELXQCFSA-N	1	1	308.334	1.198	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CC[NH2+]C(C)(C)C1	ZINC000212603614	418558772	/nfs/dbraw/zinc/55/87/72/418558772.db2.gz	QIXITADINJRLCN-UHFFFAOYSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290503786	418576795	/nfs/dbraw/zinc/57/67/95/418576795.db2.gz	AXQHYAFKWSJAAU-UHFFFAOYSA-N	1	1	318.337	1.486	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ncc([N+](=O)[O-])s3)CC2)C1	ZINC000375590781	418658547	/nfs/dbraw/zinc/65/85/47/418658547.db2.gz	JJSTYWYIFIFHHD-LLVKDONJSA-N	1	1	311.411	1.268	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000408092755	418787081	/nfs/dbraw/zinc/78/70/81/418787081.db2.gz	ZRAIIPQQDYTWGJ-VHSXEESVSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000408092755	418787083	/nfs/dbraw/zinc/78/70/83/418787083.db2.gz	ZRAIIPQQDYTWGJ-VHSXEESVSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000408092755	418787085	/nfs/dbraw/zinc/78/70/85/418787085.db2.gz	ZRAIIPQQDYTWGJ-VHSXEESVSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC1(C)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000420929040	419363310	/nfs/dbraw/zinc/36/33/10/419363310.db2.gz	CWIWUFXIQKVODG-AWEZNQCLSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000420929040	419363315	/nfs/dbraw/zinc/36/33/15/419363315.db2.gz	CWIWUFXIQKVODG-AWEZNQCLSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1CCO	ZINC000426266024	419424890	/nfs/dbraw/zinc/42/48/90/419424890.db2.gz	INNOIXYUSGPGHF-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1CCO	ZINC000426266024	419424897	/nfs/dbraw/zinc/42/48/97/419424897.db2.gz	INNOIXYUSGPGHF-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1nn(Cc2ccc(C[NH+]3CCOCC3)cc2)cc1[N+](=O)[O-]	ZINC000421219746	419524563	/nfs/dbraw/zinc/52/45/63/419524563.db2.gz	VOUOTLXVGHXGGW-UHFFFAOYSA-N	1	1	316.361	1.980	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)n1	ZINC000434443313	229297382	/nfs/dbraw/zinc/29/73/82/229297382.db2.gz	XGGZHUUAPBJYJS-LBPRGKRZSA-N	1	1	321.381	1.558	20	5		DDBDMO
Cn1cc(CN2CC[C@@H](C[NH3+])C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000435393499	229381491	/nfs/dbraw/zinc/38/14/91/229381491.db2.gz	GEMMPRQJSGIZDN-LBPRGKRZSA-N	1	1	315.377	1.776	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)NCC(F)(F)C[NH3+])c1	ZINC000423556269	420079082	/nfs/dbraw/zinc/07/90/82/420079082.db2.gz	YVGLLRPCUHGNOD-UHFFFAOYSA-N	1	1	303.265	1.317	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[C@H]([NH3+])[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000430955629	420221235	/nfs/dbraw/zinc/22/12/35/420221235.db2.gz	MCHQAZPYKWFYPB-YPMHNXCESA-N	1	1	320.393	1.901	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H](C)[C@H](C[NH3+])C2)c1[N+](=O)[O-]	ZINC000424015912	420307126	/nfs/dbraw/zinc/30/71/26/420307126.db2.gz	NIMYRURNZZBLPF-VHSXEESVSA-N	1	1	309.370	1.327	20	5		DDBDMO
Cn1cc[nH+]c1CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O	ZINC000302649962	230331079	/nfs/dbraw/zinc/33/10/79/230331079.db2.gz	MUZUWMZAQPTJKT-UHFFFAOYSA-N	1	1	324.362	1.386	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000457120165	420621529	/nfs/dbraw/zinc/62/15/29/420621529.db2.gz	NTUJWDPMLKJMSV-NSHDSACASA-N	1	1	324.356	1.871	20	5		DDBDMO
CCOc1cc(C[NH+]2C[C@@H](OC)[C@H](OC)C2)ccc1[N+](=O)[O-]	ZINC000493703037	420919190	/nfs/dbraw/zinc/91/91/90/420919190.db2.gz	BQMYTUPANALLHT-HUUCEWRRSA-N	1	1	310.350	1.839	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1(C[NH3+])CCC1	ZINC000449682319	421057808	/nfs/dbraw/zinc/05/78/08/421057808.db2.gz	XJKWJLVZNFRXCX-UHFFFAOYSA-N	1	1	303.322	1.425	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)CC1	ZINC000455577584	421038953	/nfs/dbraw/zinc/03/89/53/421038953.db2.gz	UAURTXZQHMAWGG-UHFFFAOYSA-N	1	1	307.354	1.199	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456052319	421093757	/nfs/dbraw/zinc/09/37/57/421093757.db2.gz	PQLIQUMKUCDTIF-LLVKDONJSA-N	1	1	323.397	1.882	20	5		DDBDMO
CC[C@H]1CN(CC)CCN1C(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC000456390742	421157889	/nfs/dbraw/zinc/15/78/89/421157889.db2.gz	VTXHCIGWVYRGLD-NSHDSACASA-N	1	1	307.350	1.857	20	5		DDBDMO
CC[C@@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)C[C@@H]1[NH+]1CCOCC1	ZINC000450388647	421191332	/nfs/dbraw/zinc/19/13/32/421191332.db2.gz	IKMBISLBKFSKEU-OCCSQVGLSA-N	1	1	321.381	1.240	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CCC[N@H+]1CCCO	ZINC000450601296	421216245	/nfs/dbraw/zinc/21/62/45/421216245.db2.gz	YITFPXLKQQLBSD-LBPRGKRZSA-N	1	1	311.386	1.378	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H]1CCCC[N@H+]1CCO	ZINC000450612630	421217137	/nfs/dbraw/zinc/21/71/37/421217137.db2.gz	KFLJYXPBXLZHQT-LBPRGKRZSA-N	1	1	311.386	1.378	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCSc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000565243505	421596911	/nfs/dbraw/zinc/59/69/11/421596911.db2.gz	YWSBREKYFUVBDA-AOOOYVTPSA-N	1	1	311.411	2.037	20	5		DDBDMO
CCN1C[C@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000517173116	421598286	/nfs/dbraw/zinc/59/82/86/421598286.db2.gz	QGODVACJGFNOSE-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[NH+]1C[C@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000517173116	421598289	/nfs/dbraw/zinc/59/82/89/421598289.db2.gz	QGODVACJGFNOSE-QWRGUYRKSA-N	1	1	323.397	1.996	20	5		DDBDMO
CN1CCC[C@@H]([NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)C1=O	ZINC000558442029	421806866	/nfs/dbraw/zinc/80/68/66/421806866.db2.gz	JNUBDDSWTMBTNH-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[C@H](C(=O)NCC[N@H+]1CCCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000557569726	421777767	/nfs/dbraw/zinc/77/77/67/421777767.db2.gz	PXNRGHCNOLJQSY-ZDUSSCGKSA-N	1	1	321.377	1.537	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000557919931	421794425	/nfs/dbraw/zinc/79/44/25/421794425.db2.gz	KDRTVCNRCTYFNG-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1cccnc1	ZINC000573566206	421982004	/nfs/dbraw/zinc/98/20/04/421982004.db2.gz	ZJCFUUYAVFNERA-AWEZNQCLSA-N	1	1	315.333	1.115	20	5		DDBDMO
CNc1nccc(C(=O)NCCC[N@@H+](C)CC(C)C)c1[N+](=O)[O-]	ZINC000594370679	422346587	/nfs/dbraw/zinc/34/65/87/422346587.db2.gz	ANFRCXDNEFCAKK-UHFFFAOYSA-N	1	1	323.397	1.739	20	5		DDBDMO
Nc1nc(N[C@H]2CC[N@H+](C3CCCCC3)C2)ncc1[N+](=O)[O-]	ZINC000596477881	422378433	/nfs/dbraw/zinc/37/84/33/422378433.db2.gz	LHRHJCLTCLUAOX-JTQLQIEISA-N	1	1	306.370	1.786	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1ncnc2ccc([N+](=O)[O-])cc21	ZINC000611705620	422478524	/nfs/dbraw/zinc/47/85/24/422478524.db2.gz	GDRZGRZZTQTLJF-UHFFFAOYSA-N	1	1	319.365	1.918	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000345328973	272220454	/nfs/dbraw/zinc/22/04/54/272220454.db2.gz	VEJKXJXFHXAEQJ-NEPJUHHUSA-N	1	1	306.366	1.606	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000129809035	273507977	/nfs/dbraw/zinc/50/79/77/273507977.db2.gz	HZNDYWCAPINFJJ-UHFFFAOYSA-N	1	1	314.773	1.536	20	5		DDBDMO
CCC[C@]1(CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000277653833	276053718	/nfs/dbraw/zinc/05/37/18/276053718.db2.gz	DFIYREIQWVKNCT-MRXNPFEDSA-N	1	1	321.377	1.821	20	5		DDBDMO
CCOc1cccc(N2CC[N@H+](CCO)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000302469439	276381252	/nfs/dbraw/zinc/38/12/52/276381252.db2.gz	VSWIUUJGSGUBCR-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
CCOc1cccc(N2CC[N@@H+](CCO)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000302469439	276381253	/nfs/dbraw/zinc/38/12/53/276381253.db2.gz	VSWIUUJGSGUBCR-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C2)C1	ZINC000292664757	277072624	/nfs/dbraw/zinc/07/26/24/277072624.db2.gz	CSDOWAYRXXZSDI-MRXNPFEDSA-N	1	1	318.377	1.616	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@@H]1CCO	ZINC000426230006	280375790	/nfs/dbraw/zinc/37/57/90/280375790.db2.gz	JTHPGXCFCIDNLL-OLZOCXBDSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933165	281029860	/nfs/dbraw/zinc/02/98/60/281029860.db2.gz	DLNGUECRMIZDCE-OLZOCXBDSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933165	281029861	/nfs/dbraw/zinc/02/98/61/281029861.db2.gz	DLNGUECRMIZDCE-OLZOCXBDSA-N	1	1	321.377	1.650	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000129139195	281333753	/nfs/dbraw/zinc/33/37/53/281333753.db2.gz	WNHBZFAARYJDML-CYBMUJFWSA-N	1	1	318.377	1.878	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2C[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000362072583	300000640	/nfs/dbraw/zinc/00/06/40/300000640.db2.gz	OVIGEHNKKJIUOL-QWRGUYRKSA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2C[C@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000362072583	300000642	/nfs/dbraw/zinc/00/06/42/300000642.db2.gz	OVIGEHNKKJIUOL-QWRGUYRKSA-N	1	1	323.349	1.102	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H]3COCC[C@H]32)c([N+](=O)[O-])c1	ZINC000362454462	300067739	/nfs/dbraw/zinc/06/77/39/300067739.db2.gz	QNQJGKAMIONJMU-UONOGXRCSA-N	1	1	319.361	1.695	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363304922	300247943	/nfs/dbraw/zinc/24/79/43/300247943.db2.gz	MBOLJWVVDLJXAC-KFWWJZLASA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363304922	300247947	/nfs/dbraw/zinc/24/79/47/300247947.db2.gz	MBOLJWVVDLJXAC-KFWWJZLASA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363304922	300247950	/nfs/dbraw/zinc/24/79/50/300247950.db2.gz	MBOLJWVVDLJXAC-KFWWJZLASA-N	1	1	303.362	1.432	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@@H]21	ZINC000364300795	300372210	/nfs/dbraw/zinc/37/22/10/300372210.db2.gz	GURFOZRAFNSNMS-UWVGGRQHSA-N	1	1	307.379	1.834	20	5		DDBDMO
CC[C@H](C(N)=O)[N@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000364366515	300385080	/nfs/dbraw/zinc/38/50/80/300385080.db2.gz	PTMPKUPGHFICHV-CYBMUJFWSA-N	1	1	318.377	1.838	20	5		DDBDMO
CC[C@H](C(N)=O)[N@@H+]1CC=C(c2cc(C)c(N)c([N+](=O)[O-])c2)CC1	ZINC000364366515	300385081	/nfs/dbraw/zinc/38/50/81/300385081.db2.gz	PTMPKUPGHFICHV-CYBMUJFWSA-N	1	1	318.377	1.838	20	5		DDBDMO
C[C@H](c1cnccn1)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422062	301024791	/nfs/dbraw/zinc/02/47/91/301024791.db2.gz	KGZPAKLKQORXRQ-NEPJUHHUSA-N	1	1	302.338	1.979	20	5		DDBDMO
C[C@H](c1cnccn1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422062	301024792	/nfs/dbraw/zinc/02/47/92/301024792.db2.gz	KGZPAKLKQORXRQ-NEPJUHHUSA-N	1	1	302.338	1.979	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000368458388	301032542	/nfs/dbraw/zinc/03/25/42/301032542.db2.gz	OBFDXTDCDNPENG-HNNXBMFYSA-N	1	1	321.377	1.363	20	5		DDBDMO
Cc1cc(C2=CC[N@H+]([C@H](C)C(N)=O)CC2)cc([N+](=O)[O-])c1N	ZINC000369906050	301237383	/nfs/dbraw/zinc/23/73/83/301237383.db2.gz	KTKJTXYZGRQJPL-SNVBAGLBSA-N	1	1	304.350	1.448	20	5		DDBDMO
Cc1cc(C2=CC[N@@H+]([C@H](C)C(N)=O)CC2)cc([N+](=O)[O-])c1N	ZINC000369906050	301237386	/nfs/dbraw/zinc/23/73/86/301237386.db2.gz	KTKJTXYZGRQJPL-SNVBAGLBSA-N	1	1	304.350	1.448	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@H]2C1	ZINC000370044616	301264626	/nfs/dbraw/zinc/26/46/26/301264626.db2.gz	FQRNQKQOVVRJCI-AGIUHOORSA-N	1	1	305.382	1.244	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000375994949	302021146	/nfs/dbraw/zinc/02/11/46/302021146.db2.gz	OJLALPCUDGNNMF-SCRDCRAPSA-N	1	1	308.382	1.844	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)n1	ZINC000377791130	302233960	/nfs/dbraw/zinc/23/39/60/302233960.db2.gz	ZDLPFZIAUNBWFZ-JSGCOSHPSA-N	1	1	306.366	1.825	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000378310175	302310559	/nfs/dbraw/zinc/31/05/59/302310559.db2.gz	UHKFMKLURDJEOO-VXGBXAGGSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@@H+]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000378310175	302310561	/nfs/dbraw/zinc/31/05/61/302310561.db2.gz	UHKFMKLURDJEOO-VXGBXAGGSA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000378310175	302310563	/nfs/dbraw/zinc/31/05/63/302310563.db2.gz	UHKFMKLURDJEOO-VXGBXAGGSA-N	1	1	315.333	1.146	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000547735057	303550220	/nfs/dbraw/zinc/55/02/20/303550220.db2.gz	JJBUCUSCVSLOMJ-UHFFFAOYSA-N	1	1	307.335	1.342	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]12	ZINC000366316044	307070648	/nfs/dbraw/zinc/07/06/48/307070648.db2.gz	TXZBQYXNATVWHL-QWRGUYRKSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C[C@H]12	ZINC000366316044	307070649	/nfs/dbraw/zinc/07/06/49/307070649.db2.gz	TXZBQYXNATVWHL-QWRGUYRKSA-N	1	1	323.736	1.343	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000371511975	307151939	/nfs/dbraw/zinc/15/19/39/307151939.db2.gz	ULRSRLPAANYTGF-OLZOCXBDSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)O1	ZINC000372614290	307172444	/nfs/dbraw/zinc/17/24/44/307172444.db2.gz	SOSIMKCGHGWBOV-OAHLLOKOSA-N	1	1	305.334	1.712	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000372864756	307175217	/nfs/dbraw/zinc/17/52/17/307175217.db2.gz	ABGHAJZUPPGXLZ-CYBMUJFWSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279338	307204964	/nfs/dbraw/zinc/20/49/64/307204964.db2.gz	VGJHKYJTWGZXBS-ZMSDIMECSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000374279338	307204965	/nfs/dbraw/zinc/20/49/65/307204965.db2.gz	VGJHKYJTWGZXBS-ZMSDIMECSA-N	1	1	317.389	1.680	20	5		DDBDMO
C[C@]1(CNC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000374279338	307204966	/nfs/dbraw/zinc/20/49/66/307204966.db2.gz	VGJHKYJTWGZXBS-ZMSDIMECSA-N	1	1	317.389	1.680	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC[C@@]12CCOC2)c1ccc([N+](=O)[O-])cc1	ZINC000375325472	307222355	/nfs/dbraw/zinc/22/23/55/307222355.db2.gz	DTIBIHWCLOOEBR-INIZCTEOSA-N	1	1	319.361	1.813	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@]12CCOC2)c1ccc([N+](=O)[O-])cc1	ZINC000375325472	307222356	/nfs/dbraw/zinc/22/23/56/307222356.db2.gz	DTIBIHWCLOOEBR-INIZCTEOSA-N	1	1	319.361	1.813	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000376642894	307251198	/nfs/dbraw/zinc/25/11/98/307251198.db2.gz	MLLUEUZLLUSESB-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@H]1CC[N@H+](C)[C@H]1c1ccccc1	ZINC000377645106	307275498	/nfs/dbraw/zinc/27/54/98/307275498.db2.gz	BNGGDEYZRINVDP-ZFWWWQNUSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1	ZINC000377645106	307275499	/nfs/dbraw/zinc/27/54/99/307275499.db2.gz	BNGGDEYZRINVDP-ZFWWWQNUSA-N	1	1	315.377	1.863	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C[C@@H]21	ZINC000378474488	307288797	/nfs/dbraw/zinc/28/87/97/307288797.db2.gz	RBEOYIPRHRRNOW-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1ocnc1C[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000571158756	308191608	/nfs/dbraw/zinc/19/16/08/308191608.db2.gz	VIQWTQVTIACHAT-LBPRGKRZSA-N	1	1	307.306	1.421	20	5		DDBDMO
C[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1CC(C)(C)O	ZINC000576088863	308287862	/nfs/dbraw/zinc/28/78/62/308287862.db2.gz	LTTWPFKJJDZCOQ-JTQLQIEISA-N	1	1	312.345	1.410	20	5		DDBDMO
C[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1CC(C)(C)O	ZINC000576088863	308287864	/nfs/dbraw/zinc/28/78/64/308287864.db2.gz	LTTWPFKJJDZCOQ-JTQLQIEISA-N	1	1	312.345	1.410	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1[C@@H]2CC[C@H]1CC[N@H+](C)C2	ZINC000577200406	308370399	/nfs/dbraw/zinc/37/03/99/308370399.db2.gz	NULOOMZWIQREJO-NWDGAFQWSA-N	1	1	304.350	1.607	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000584308594	332236440	/nfs/dbraw/zinc/23/64/40/332236440.db2.gz	OXUGFTWVLFOXSY-QWRGUYRKSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000584308594	332236441	/nfs/dbraw/zinc/23/64/41/332236441.db2.gz	OXUGFTWVLFOXSY-QWRGUYRKSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC[C@H](C)OC[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361705	332353758	/nfs/dbraw/zinc/35/37/58/332353758.db2.gz	PNXLTCHCCYVXKF-GXTWGEPZSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@H](C)OC[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361705	332353759	/nfs/dbraw/zinc/35/37/59/332353759.db2.gz	PNXLTCHCCYVXKF-GXTWGEPZSA-N	1	1	324.377	1.365	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCC[C@H]1C	ZINC000487986706	484212873	/nfs/dbraw/zinc/21/28/73/484212873.db2.gz	JZFOEXLZWYEGIN-UKRRQHHQSA-N	1	1	323.393	1.894	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H]2CCN3CCO[C@H]2C3)ccc1[N+](=O)[O-]	ZINC000451136257	533795371	/nfs/dbraw/zinc/79/53/71/533795371.db2.gz	FIZQDMPEAORWIN-CJNGLKHVSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[C@H](C)CC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000443349072	533823789	/nfs/dbraw/zinc/82/37/89/533823789.db2.gz	SYPVCIUBNNRCJE-BZPMIXESSA-N	1	1	309.366	1.238	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H]([C@H](C)[NH3+])C2)c1[N+](=O)[O-]	ZINC000156444525	521327063	/nfs/dbraw/zinc/32/70/63/521327063.db2.gz	COPPJLYFHGEBFH-VHSXEESVSA-N	1	1	309.370	1.470	20	5		DDBDMO
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1C[N@H+](C)CCO1	ZINC000154777562	525680649	/nfs/dbraw/zinc/68/06/49/525680649.db2.gz	SFYBMKYSJITJPQ-GZMMTYOYSA-N	1	1	300.746	1.774	20	5		DDBDMO
C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1C[N@@H+](C)CCO1	ZINC000154777562	525680656	/nfs/dbraw/zinc/68/06/56/525680656.db2.gz	SFYBMKYSJITJPQ-GZMMTYOYSA-N	1	1	300.746	1.774	20	5		DDBDMO
CCCCOCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000459493357	528589913	/nfs/dbraw/zinc/58/99/13/528589913.db2.gz	HCULNWOHTQUENI-UHFFFAOYSA-N	1	1	308.382	1.929	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000330973386	528743267	/nfs/dbraw/zinc/74/32/67/528743267.db2.gz	KUFMPEPZBBQCFZ-HNNXBMFYSA-N	1	1	320.393	1.805	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1	ZINC000457722491	528984242	/nfs/dbraw/zinc/98/42/42/528984242.db2.gz	OBZOECAJEKKJDG-UHFFFAOYSA-N	1	1	313.304	1.624	20	5		DDBDMO
CCC[C@@H](O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000296670098	529026373	/nfs/dbraw/zinc/02/63/73/529026373.db2.gz	GSORQUTXKARZSE-CYBMUJFWSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000452123215	529076570	/nfs/dbraw/zinc/07/65/70/529076570.db2.gz	VIKUPPZXNZFQNA-ZDUSSCGKSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000746882332	700043484	/nfs/dbraw/zinc/04/34/84/700043484.db2.gz	LQOUHRLHVGCPGK-SNVBAGLBSA-N	1	1	323.324	1.466	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@@H+]1C	ZINC000748345186	700111083	/nfs/dbraw/zinc/11/10/83/700111083.db2.gz	KYAVWBOMQFXHPK-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@H+]1C	ZINC000748345186	700111084	/nfs/dbraw/zinc/11/10/84/700111084.db2.gz	KYAVWBOMQFXHPK-SNVBAGLBSA-N	1	1	321.333	1.142	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000151275371	696882941	/nfs/dbraw/zinc/88/29/41/696882941.db2.gz	FIWIVKNPXQQTGJ-AWEZNQCLSA-N	1	1	306.366	1.589	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2CC(F)(F)C2)CC1	ZINC000981137921	697015454	/nfs/dbraw/zinc/01/54/54/697015454.db2.gz	HVXNXMFVBJUPJH-VXGBXAGGSA-N	1	1	317.336	1.231	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2CC(F)(F)C2)CC1	ZINC000981137921	697015457	/nfs/dbraw/zinc/01/54/57/697015457.db2.gz	HVXNXMFVBJUPJH-VXGBXAGGSA-N	1	1	317.336	1.231	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2CC(F)(F)C2)CC1	ZINC000981137921	697015460	/nfs/dbraw/zinc/01/54/60/697015460.db2.gz	HVXNXMFVBJUPJH-VXGBXAGGSA-N	1	1	317.336	1.231	20	5		DDBDMO
CC(C)C(=O)N1CCC([N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000985274511	697478596	/nfs/dbraw/zinc/47/85/96/697478596.db2.gz	NYFSJSQPYCSDID-UHFFFAOYSA-N	1	1	323.397	1.407	20	5		DDBDMO
CC(C)C(=O)N1CCC([N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000985274511	697478598	/nfs/dbraw/zinc/47/85/98/697478598.db2.gz	NYFSJSQPYCSDID-UHFFFAOYSA-N	1	1	323.397	1.407	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]1C	ZINC000775100186	697962884	/nfs/dbraw/zinc/96/28/84/697962884.db2.gz	BMGVMDGDFXPSAY-CABZTGNLSA-N	1	1	323.305	1.886	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H]1C	ZINC000775100186	697962886	/nfs/dbraw/zinc/96/28/86/697962886.db2.gz	BMGVMDGDFXPSAY-CABZTGNLSA-N	1	1	323.305	1.886	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000775775780	698031098	/nfs/dbraw/zinc/03/10/98/698031098.db2.gz	BDQWSCRYANIKJU-CQSZACIVSA-N	1	1	316.317	1.182	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCCO[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000749954640	700194385	/nfs/dbraw/zinc/19/43/85/700194385.db2.gz	LRXCLRFJXGNWKN-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@H+]2CCCO[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000749954640	700194386	/nfs/dbraw/zinc/19/43/86/700194386.db2.gz	LRXCLRFJXGNWKN-JTQLQIEISA-N	1	1	305.338	1.716	20	5		DDBDMO
CCOC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776271805	698090270	/nfs/dbraw/zinc/09/02/70/698090270.db2.gz	HKHOOXMNMGWFGO-HIFRSBDPSA-N	1	1	322.361	1.903	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776580559	698120701	/nfs/dbraw/zinc/12/07/01/698120701.db2.gz	WJWWKQOYHIPELB-XJKSGUPXSA-N	1	1	321.377	1.476	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+](CCO)Cc2cccnc2)cc1	ZINC000776586270	698122005	/nfs/dbraw/zinc/12/20/05/698122005.db2.gz	LVOIGBONQSZNGK-MRXNPFEDSA-N	1	1	317.345	1.518	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)OCCC[NH+]2CCOCC2)c1	ZINC000750890768	700255206	/nfs/dbraw/zinc/25/52/06/700255206.db2.gz	NQUMCYBBXDPLEV-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000594375436	699216155	/nfs/dbraw/zinc/21/61/55/699216155.db2.gz	OOAVKQLIFASVJF-AOOOYVTPSA-N	1	1	308.338	1.250	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)O[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000788114521	699279714	/nfs/dbraw/zinc/27/97/14/699279714.db2.gz	FCOOEUVZPJXXTJ-YPMHNXCESA-N	1	1	308.338	1.351	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H](C)[NH+]1CCOCC1	ZINC000729469399	699479552	/nfs/dbraw/zinc/47/95/52/699479552.db2.gz	GINYIKKKAWDNCV-NEPJUHHUSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CCn1cc([N+](=O)[O-])cn1	ZINC000796117456	699913575	/nfs/dbraw/zinc/91/35/75/699913575.db2.gz	ZYYTZSLCJBXFNB-UHFFFAOYSA-N	1	1	319.321	1.874	20	5		DDBDMO
C[C@@H](NC(=O)CC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000751348956	700281754	/nfs/dbraw/zinc/28/17/54/700281754.db2.gz	CNVLATHEVWCLCI-GFCCVEGCSA-N	1	1	307.350	1.494	20	5		DDBDMO
C[C@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000761082512	700841877	/nfs/dbraw/zinc/84/18/77/700841877.db2.gz	QDLZHEHGUXUWGT-LBPRGKRZSA-N	1	1	306.366	1.194	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@@H+]1C	ZINC000761096186	700843072	/nfs/dbraw/zinc/84/30/72/700843072.db2.gz	ZPAVYKYHYHAZJS-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C	ZINC000761096186	700843074	/nfs/dbraw/zinc/84/30/74/700843074.db2.gz	ZPAVYKYHYHAZJS-JTQLQIEISA-N	1	1	302.334	1.852	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000770739795	701292837	/nfs/dbraw/zinc/29/28/37/701292837.db2.gz	MFGNFBCSIRNLQU-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](C)N1CC[NH+](C)CC1	ZINC000807960070	701492238	/nfs/dbraw/zinc/49/22/38/701492238.db2.gz	LFYHIUYDTDJUIK-GFCCVEGCSA-N	1	1	320.393	1.845	20	5		DDBDMO
CC[NH+](CC)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1	ZINC000839516035	701721930	/nfs/dbraw/zinc/72/19/30/701721930.db2.gz	DSUHNNGXBXSMSM-BZUAXINKSA-N	1	1	319.405	1.721	20	5		DDBDMO
C[C@H](NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576036	701898482	/nfs/dbraw/zinc/89/84/82/701898482.db2.gz	HKIVUIJNQFUYRK-YUTCNCBUSA-N	1	1	320.393	1.691	20	5		DDBDMO
C[C@H]([NH2+]C[C@H]1CN2CCC[C@@H]2CO1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000815576036	701898487	/nfs/dbraw/zinc/89/84/87/701898487.db2.gz	HKIVUIJNQFUYRK-YUTCNCBUSA-N	1	1	320.393	1.691	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2[C@@H](O)c2ccccc2)c1	ZINC000879245409	706627398	/nfs/dbraw/zinc/62/73/98/706627398.db2.gz	XLWALMHTLCZDBB-HOTGVXAUSA-N	1	1	316.361	1.989	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@H]21	ZINC000866206770	706648622	/nfs/dbraw/zinc/64/86/22/706648622.db2.gz	NAYJROBUMLTZJL-VXGBXAGGSA-N	1	1	304.350	1.224	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@H]21	ZINC000866210230	706649640	/nfs/dbraw/zinc/64/96/40/706649640.db2.gz	ZTVKBWRTQQZKTQ-IINYFYTJSA-N	1	1	306.366	1.200	20	5		DDBDMO
CC(C)(CCc1noc([C@@H]2CCn3cc[nH+]c3C2)n1)[N+](=O)[O-]	ZINC000812815100	702246558	/nfs/dbraw/zinc/24/65/58/702246558.db2.gz	YLDLBZJUVLMXJI-SNVBAGLBSA-N	1	1	305.338	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](n3cccn3)C2)cc1	ZINC000812876674	702257030	/nfs/dbraw/zinc/25/70/30/702257030.db2.gz	OGRVMWVDKNDWRN-HUUCEWRRSA-N	1	1	302.334	1.772	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C[C@H]1CCC[N@H+]1C	ZINC000817131723	702281501	/nfs/dbraw/zinc/28/15/01/702281501.db2.gz	MGMGJLOLNOMNHO-GFCCVEGCSA-N	1	1	306.366	1.485	20	5		DDBDMO
CO[C@H]1CC[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481551	703555498	/nfs/dbraw/zinc/55/54/98/703555498.db2.gz	ZZZVOGHIYCQCMF-LSDHHAIUSA-N	1	1	319.361	1.589	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000848481551	703555499	/nfs/dbraw/zinc/55/54/99/703555499.db2.gz	ZZZVOGHIYCQCMF-LSDHHAIUSA-N	1	1	319.361	1.589	20	5		DDBDMO
COCC[N@H+](CCC(=O)OC)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000851771943	703851437	/nfs/dbraw/zinc/85/14/37/703851437.db2.gz	SKCFNRHGUBJQCG-UHFFFAOYSA-N	1	1	314.313	1.745	20	5		DDBDMO
COCC[N@@H+](CCC(=O)OC)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000851771943	703851441	/nfs/dbraw/zinc/85/14/41/703851441.db2.gz	SKCFNRHGUBJQCG-UHFFFAOYSA-N	1	1	314.313	1.745	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000869896384	703872778	/nfs/dbraw/zinc/87/27/78/703872778.db2.gz	AUKKURNOMAVRTG-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
CC(C)(C)n1ncnc1C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819290197	704101777	/nfs/dbraw/zinc/10/17/77/704101777.db2.gz	WFGGTCQURHSWQT-ZDUSSCGKSA-N	1	1	319.365	1.765	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CCC1(C)C	ZINC000871155862	704233303	/nfs/dbraw/zinc/23/33/03/704233303.db2.gz	FORGVGZLJAIJBD-UHFFFAOYSA-N	1	1	308.338	1.252	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000855286451	704477423	/nfs/dbraw/zinc/47/74/23/704477423.db2.gz	RRSZOPWPJBLCJX-SNVBAGLBSA-N	1	1	306.366	1.780	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1[C@H](C)CC[C@@H]1CO	ZINC000880438692	706976825	/nfs/dbraw/zinc/97/68/25/706976825.db2.gz	SRXMXBVLTIBYFF-VXGBXAGGSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1[C@H](C)CC[C@@H]1CO	ZINC000880438692	706976826	/nfs/dbraw/zinc/97/68/26/706976826.db2.gz	SRXMXBVLTIBYFF-VXGBXAGGSA-N	1	1	307.350	1.687	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000860159524	705118053	/nfs/dbraw/zinc/11/80/53/705118053.db2.gz	LDZCWDCOPXDWSD-ZYHUDNBSSA-N	1	1	322.317	1.087	20	5		DDBDMO
CCn1nc(C)c(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)n1	ZINC000823789345	705317912	/nfs/dbraw/zinc/31/79/12/705317912.db2.gz	KYNYOXZRKFZRFN-UHFFFAOYSA-N	1	1	305.338	1.683	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825098961	705599472	/nfs/dbraw/zinc/59/94/72/705599472.db2.gz	RAHWASLORUWKMO-SWLSCSKDSA-N	1	1	321.377	1.476	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825471958	705677298	/nfs/dbraw/zinc/67/72/98/705677298.db2.gz	FVZGOJPTJOZFHC-IUODEOHRSA-N	1	1	321.377	1.475	20	5		DDBDMO
C[C@@H](CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000825664407	705710686	/nfs/dbraw/zinc/71/06/86/705710686.db2.gz	FAAVRXXHNGPZMH-IINYFYTJSA-N	1	1	307.350	1.227	20	5		DDBDMO
C/C(=C\C(=O)NCC[N@H+]1CC[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000863319833	705900372	/nfs/dbraw/zinc/90/03/72/705900372.db2.gz	PIANAICXVPDSEJ-HBIYDYFMSA-N	1	1	319.361	1.181	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000827459526	706006771	/nfs/dbraw/zinc/00/67/71/706006771.db2.gz	LMLBUQVYBVEQGL-ZDUSSCGKSA-N	1	1	321.381	1.233	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000877578126	706147780	/nfs/dbraw/zinc/14/77/80/706147780.db2.gz	VOMMXSQYVWFCGR-ZFWWWQNUSA-N	1	1	319.361	1.301	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000877578126	706147783	/nfs/dbraw/zinc/14/77/83/706147783.db2.gz	VOMMXSQYVWFCGR-ZFWWWQNUSA-N	1	1	319.361	1.301	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@](O)(c3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000877653514	706171061	/nfs/dbraw/zinc/17/10/61/706171061.db2.gz	LNAZGLBVRFOZPA-MRXNPFEDSA-N	1	1	316.361	1.812	20	5		DDBDMO
O=[N+]([O-])c1ccc(-n2cc(CCC[NH+]3CCOCC3)nn2)cc1	ZINC000864621606	706215579	/nfs/dbraw/zinc/21/55/79/706215579.db2.gz	ROVPXPMVEOFOEQ-UHFFFAOYSA-N	1	1	317.349	1.440	20	5		DDBDMO
COCC1([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCC1	ZINC000880186513	706904843	/nfs/dbraw/zinc/90/48/43/706904843.db2.gz	ZXIGUZWCODHUPZ-CYBMUJFWSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3Cl)C[C@H]2C1	ZINC000834657131	707099307	/nfs/dbraw/zinc/09/93/07/707099307.db2.gz	SFHPRAKURUIQRT-AOOOYVTPSA-N	1	1	309.753	1.882	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C[C@@H]1C	ZINC000872632729	707524173	/nfs/dbraw/zinc/52/41/73/707524173.db2.gz	GRWJZDSACYWUTL-XPTSAGLGSA-N	1	1	310.354	1.497	20	5		DDBDMO
COC(=O)[C@@]1(C)C[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C[C@@H]1C	ZINC000872632729	707524177	/nfs/dbraw/zinc/52/41/77/707524177.db2.gz	GRWJZDSACYWUTL-XPTSAGLGSA-N	1	1	310.354	1.497	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000837187652	707593778	/nfs/dbraw/zinc/59/37/78/707593778.db2.gz	AWXNEKKIGZBJAS-GJZGRUSLSA-N	1	1	321.377	1.569	20	5		DDBDMO
Cc1c(C[NH2+]C[C@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873041912	707705524	/nfs/dbraw/zinc/70/55/24/707705524.db2.gz	CHPBNSMHIJFRJN-AWEZNQCLSA-N	1	1	320.437	1.876	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCc1ccc(C)c([N+](=O)[O-])c1	ZINC000883757263	708059869	/nfs/dbraw/zinc/05/98/69/708059869.db2.gz	HTHZVSQQRSSMER-ZDUSSCGKSA-N	1	1	306.366	1.797	20	5		DDBDMO
CNC(=O)C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1	ZINC000886184188	708711720	/nfs/dbraw/zinc/71/17/20/708711720.db2.gz	WGRNZBPTTZMRDT-AWEZNQCLSA-N	1	1	314.345	1.957	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C	ZINC000928438656	713195935	/nfs/dbraw/zinc/19/59/35/713195935.db2.gz	GVYAKOOSOLDLNT-GXFFZTMASA-N	1	1	314.345	1.965	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928435438	713194429	/nfs/dbraw/zinc/19/44/29/713194429.db2.gz	GOTSLOXNZUWBCY-JOYOIKCWSA-N	1	1	313.304	1.895	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000928444672	713199093	/nfs/dbraw/zinc/19/90/93/713199093.db2.gz	LQNYSNGWTNEZQQ-NWDGAFQWSA-N	1	1	307.350	1.573	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000902635600	710830800	/nfs/dbraw/zinc/83/08/00/710830800.db2.gz	AWYHMDWWNQMIRW-QWHCGFSZSA-N	1	1	305.338	1.715	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328396	711485657	/nfs/dbraw/zinc/48/56/57/711485657.db2.gz	FZUADFQDTPVDTO-GWCFXTLKSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328396	711485660	/nfs/dbraw/zinc/48/56/60/711485660.db2.gz	FZUADFQDTPVDTO-GWCFXTLKSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000895366286	711495150	/nfs/dbraw/zinc/49/51/50/711495150.db2.gz	JUWFSMBVTQUBSG-MSRIBSCDSA-N	1	1	310.350	1.758	20	5		DDBDMO
CN(C)c1cc[nH+]c(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000905524618	712064438	/nfs/dbraw/zinc/06/44/38/712064438.db2.gz	KFIUFXKJNNRSSA-INIZCTEOSA-N	1	1	316.361	1.879	20	5		DDBDMO
CCO[C@H](C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)CN(C)C	ZINC000905577778	712084195	/nfs/dbraw/zinc/08/41/95/712084195.db2.gz	BOORPHKLJLUQNL-HUUCEWRRSA-N	1	1	311.382	1.185	20	5		DDBDMO
CCO[C@@H](C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)CN(C)C	ZINC000905577779	712084230	/nfs/dbraw/zinc/08/42/30/712084230.db2.gz	BOORPHKLJLUQNL-LSDHHAIUSA-N	1	1	311.382	1.185	20	5		DDBDMO
C[C@@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807202	713303469	/nfs/dbraw/zinc/30/34/69/713303469.db2.gz	XTCOLYBPDLLWJQ-JRPNMDOOSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@@H](NC(=O)[C@@]1(C)C[C@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807202	713303471	/nfs/dbraw/zinc/30/34/71/713303471.db2.gz	XTCOLYBPDLLWJQ-JRPNMDOOSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1Cn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O	ZINC000917357463	713494636	/nfs/dbraw/zinc/49/46/36/713494636.db2.gz	UNAVSQRCYGLLOI-GFCCVEGCSA-N	1	1	304.306	1.506	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000930619792	713878968	/nfs/dbraw/zinc/87/89/68/713878968.db2.gz	HWKXEYHQRBSTKL-LBPRGKRZSA-N	1	1	321.381	1.606	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000930619792	713878971	/nfs/dbraw/zinc/87/89/71/713878971.db2.gz	HWKXEYHQRBSTKL-LBPRGKRZSA-N	1	1	321.381	1.606	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCn2cc[nH+]c21	ZINC000931524710	714119398	/nfs/dbraw/zinc/11/93/98/714119398.db2.gz	UTDYTCMRSGLPDL-SNVBAGLBSA-N	1	1	301.306	1.639	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](Cc3nccs3)C2)c([N+](=O)[O-])n1	ZINC000934329822	714796621	/nfs/dbraw/zinc/79/66/21/714796621.db2.gz	UGRYKKDACKQZFH-SNVBAGLBSA-N	1	1	307.379	1.849	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000935169252	714994206	/nfs/dbraw/zinc/99/42/06/714994206.db2.gz	YWZQJRPKMBNCBK-GHMZBOCLSA-N	1	1	309.370	1.041	20	5		DDBDMO
O=[N+]([O-])c1cnc(Cl)nc1N1CC2(C1)CC[N@@H+](CC1CC1)C2	ZINC001164767099	721279251	/nfs/dbraw/zinc/27/92/51/721279251.db2.gz	GCXVJELVTRAMMS-UHFFFAOYSA-N	1	1	323.784	1.960	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCc3ccccn3)CC2)n1	ZINC001165054396	722009788	/nfs/dbraw/zinc/00/97/88/722009788.db2.gz	XFLIDDLVAPCCNC-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)Cc1cccc(C(N)=O)c1	ZINC001167147676	732765335	/nfs/dbraw/zinc/76/53/35/732765335.db2.gz	ZIMDTOJTIOTRLE-UHFFFAOYSA-N	1	1	317.349	1.331	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ncc(F)c2cc([N+](=O)[O-])ccc21	ZINC001167354749	733280946	/nfs/dbraw/zinc/28/09/46/733280946.db2.gz	CUWAMSLMIUDRDU-UHFFFAOYSA-N	1	1	314.280	1.406	20	5		DDBDMO
Cc1cc(F)ccc1C[NH2+][C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001022063718	734368141	/nfs/dbraw/zinc/36/81/41/734368141.db2.gz	ISUPNFGMBCKZDE-LXTVHRRPSA-N	1	1	321.352	1.536	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cs1	ZINC001022063532	734368705	/nfs/dbraw/zinc/36/87/05/734368705.db2.gz	CYNDEXLUGBYMKT-YVECIDJPSA-N	1	1	309.391	1.459	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)[nH]1	ZINC001195213836	746550969	/nfs/dbraw/zinc/55/09/69/746550969.db2.gz	JPODTERDZCKYOA-LLVKDONJSA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n1	ZINC001195213836	746550970	/nfs/dbraw/zinc/55/09/70/746550970.db2.gz	JPODTERDZCKYOA-LLVKDONJSA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n1	ZINC001195213836	746550973	/nfs/dbraw/zinc/55/09/73/746550973.db2.gz	JPODTERDZCKYOA-LLVKDONJSA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n[nH]1	ZINC001195213836	746550976	/nfs/dbraw/zinc/55/09/76/746550976.db2.gz	JPODTERDZCKYOA-LLVKDONJSA-N	1	1	305.342	1.016	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])C2)n[nH]1	ZINC001195213836	746550977	/nfs/dbraw/zinc/55/09/77/746550977.db2.gz	JPODTERDZCKYOA-LLVKDONJSA-N	1	1	305.342	1.016	20	5		DDBDMO
O=C1OCC[C@@]12CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2	ZINC001198810552	747619562	/nfs/dbraw/zinc/61/95/62/747619562.db2.gz	MIHWBCPFLRBZEH-OAHLLOKOSA-N	1	1	306.318	1.613	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034642985	750624583	/nfs/dbraw/zinc/62/45/83/750624583.db2.gz	INHJPJLSHDCIOF-KLHDSHLOSA-N	1	1	317.389	1.869	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011994	762178924	/nfs/dbraw/zinc/17/89/24/762178924.db2.gz	OMIMZTMCAYEEAZ-RCWTZXSCSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](F)C2)C1	ZINC001169011994	762178927	/nfs/dbraw/zinc/17/89/27/762178927.db2.gz	OMIMZTMCAYEEAZ-RCWTZXSCSA-N	1	1	314.279	1.769	20	5		DDBDMO
COc1cnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169054635	762210226	/nfs/dbraw/zinc/21/02/26/762210226.db2.gz	NBNGEQKJJFLVTF-JHJVBQTASA-N	1	1	322.365	1.384	20	5		DDBDMO
CCC(CC)C[NH+]1CCC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001001399857	754281610	/nfs/dbraw/zinc/28/16/10/754281610.db2.gz	NTSJCDYGKFQHSP-HUUCEWRRSA-N	1	1	311.426	1.916	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccc2c([N+](=O)[O-])c[nH]c2n1	ZINC001170339522	766272944	/nfs/dbraw/zinc/27/29/44/766272944.db2.gz	CQFGALNCFWYAFP-UHFFFAOYSA-N	1	1	302.294	1.172	20	5		DDBDMO
CN1CCN(C(=[NH2+])Nc2cnc3ccc([N+](=O)[O-])cc3n2)CC1	ZINC001157915099	767283844	/nfs/dbraw/zinc/28/38/44/767283844.db2.gz	PCZCANGOVBAKLU-UHFFFAOYSA-N	1	1	315.337	1.132	20	5		DDBDMO
O=C(C1CC1)N1C[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC001048636853	769604980	/nfs/dbraw/zinc/60/49/80/769604980.db2.gz	XDLBZRLQNRABDD-GASCZTMLSA-N	1	1	315.373	1.895	20	5		DDBDMO
Nc1c(Cl)cc(C(=O)NCC[NH+]2CC=CC2)cc1[N+](=O)[O-]	ZINC001136908916	772208102	/nfs/dbraw/zinc/20/81/02/772208102.db2.gz	KKUCDNZXTJKIKZ-UHFFFAOYSA-N	1	1	310.741	1.432	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001093952396	775260522	/nfs/dbraw/zinc/26/05/22/775260522.db2.gz	AACHZQBOIOGXHL-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
C[N@@H+](CCNC(=O)C1=COCCO1)Cc1ccc([N+](=O)[O-])cc1	ZINC001266252880	835990412	/nfs/dbraw/zinc/99/04/12/835990412.db2.gz	DTXBRHDAQWGWMW-UHFFFAOYSA-N	1	1	321.333	1.031	20	5		DDBDMO
CN(CC[NH2+]C/C=C\c1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267371838	837933840	/nfs/dbraw/zinc/93/38/40/837933840.db2.gz	XBMHNGDKYFJHJK-OVUXIIJLSA-N	1	1	303.362	1.413	20	5		DDBDMO
CN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC001326489241	861403711	/nfs/dbraw/zinc/40/37/11/861403711.db2.gz	PLPNIQUVRHFISD-KGLIPLIRSA-N	1	1	307.350	1.181	20	5		DDBDMO
Cc1nc([N+](=O)[O-])c(-c2noc([C@@H]([NH3+])CC(F)F)n2)n1C	ZINC001326513953	861419853	/nfs/dbraw/zinc/41/98/53/861419853.db2.gz	ZMOBLICSYHSALC-YFKPBYRVSA-N	1	1	302.241	1.342	20	5		DDBDMO
Cc1[nH+]ccn1-c1ncccc1NC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC001141841037	860955740	/nfs/dbraw/zinc/95/57/40/860955740.db2.gz	LECFEHGHKRPJJM-UHFFFAOYSA-N	1	1	313.277	1.459	20	5		DDBDMO
COc1cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)ccc1[N+](=O)[O-]	ZINC001225436621	881832458	/nfs/dbraw/zinc/83/24/58/881832458.db2.gz	XBQHPSRJVMFSDL-JBCWJZNQSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)ccc1[N+](=O)[O-]	ZINC001225436621	881832479	/nfs/dbraw/zinc/83/24/79/881832479.db2.gz	XBQHPSRJVMFSDL-JBCWJZNQSA-N	1	1	306.318	1.786	20	5		DDBDMO
C[N@@H+]1CCc2c(NCCn3ccnn3)ccc([N+](=O)[O-])c2C1	ZINC001161930820	867108736	/nfs/dbraw/zinc/10/87/36/867108736.db2.gz	AIYHUUFUDYDEKS-UHFFFAOYSA-N	1	1	302.338	1.286	20	5		DDBDMO
C[N@H+]1CCc2c(NCCn3ccnn3)ccc([N+](=O)[O-])c2C1	ZINC001161930820	867108744	/nfs/dbraw/zinc/10/87/44/867108744.db2.gz	AIYHUUFUDYDEKS-UHFFFAOYSA-N	1	1	302.338	1.286	20	5		DDBDMO
CO[C@@H]1CN(c2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C[C@@H]1F	ZINC001164129664	868962304	/nfs/dbraw/zinc/96/23/04/868962304.db2.gz	KXELLSYGLKSPJJ-SOHMCZBRSA-N	1	1	310.329	1.695	20	5		DDBDMO
CC(=O)c1cc(N[C@@H](C)[C@@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727479	869112079	/nfs/dbraw/zinc/11/20/79/869112079.db2.gz	WLMFEQYQKCLRNX-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc(N[C@@H](C)[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727479	869112083	/nfs/dbraw/zinc/11/20/83/869112083.db2.gz	WLMFEQYQKCLRNX-ZBEGNZNMSA-N	1	1	320.393	1.844	20	5		DDBDMO
COc1nc(NCC[C@@H]2CCC[N@@H+](C)C2)nc(C)c1[N+](=O)[O-]	ZINC001165261936	869477037	/nfs/dbraw/zinc/47/70/37/869477037.db2.gz	TVCQPBZZCNHDJN-NSHDSACASA-N	1	1	309.370	1.846	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC001337533172	869528116	/nfs/dbraw/zinc/52/81/16/869528116.db2.gz	AWCYICGDJKFHPU-GFCCVEGCSA-N	1	1	309.341	1.877	20	5		DDBDMO
C[C@@H](O)[C@@H](CO)[NH2+]Cc1c(Br)cccc1[N+](=O)[O-]	ZINC001308432902	871498066	/nfs/dbraw/zinc/49/80/66/871498066.db2.gz	DDSDQHTWXHBJBX-GMSGAONNSA-N	1	1	319.155	1.189	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1C[C@@H](CO)[C@H](CCO)C1	ZINC001308982660	871544763	/nfs/dbraw/zinc/54/47/63/871544763.db2.gz	FVLIVSWWJKWIIW-KGLIPLIRSA-N	1	1	308.378	1.634	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCC[NH+]1CC=CC1	ZINC001318711990	872222242	/nfs/dbraw/zinc/22/22/42/872222242.db2.gz	CCUKMKTXTVTBLU-UHFFFAOYSA-N	1	1	304.350	1.262	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCCC[N@H+]1CCCO[C@@H](C)C1	ZINC001343018565	872470546	/nfs/dbraw/zinc/47/05/46/872470546.db2.gz	ABXKYYLTUQNBLD-LBPRGKRZSA-N	1	1	324.381	1.911	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC001348969843	874902557	/nfs/dbraw/zinc/90/25/57/874902557.db2.gz	JICKUAJEBJEVGG-XHDPSFHLSA-N	1	1	318.377	1.803	20	5		DDBDMO
O=[N+]([O-])CC[NH2+]C[C@@](O)(c1ccc(Cl)cc1)C(F)(F)F	ZINC001356585817	879114794	/nfs/dbraw/zinc/11/47/94/879114794.db2.gz	WALIVZXAQOIBNB-SNVBAGLBSA-N	1	1	312.675	1.956	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1OCC[N@@H+]1CC[C@@H](OC)C1	ZINC001229060009	883796012	/nfs/dbraw/zinc/79/60/12/883796012.db2.gz	ZBRXIAXKFMISPL-GFCCVEGCSA-N	1	1	324.333	1.481	20	5		DDBDMO
[NH3+][C@@H](CCCCO)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001249307601	893923135	/nfs/dbraw/zinc/92/31/35/893923135.db2.gz	SBUFWGZFTDASPH-QMMMGPOBSA-N	1	1	311.273	1.341	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2nncn2CC1	ZINC001254553496	896499382	/nfs/dbraw/zinc/49/93/82/896499382.db2.gz	WDLGOACBEBESKM-GFCCVEGCSA-N	1	1	301.350	1.676	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2ccc3ncc([N+](=O)[O-])n3n2)C1	ZINC001261648132	899681452	/nfs/dbraw/zinc/68/14/52/899681452.db2.gz	TUPDZMXDQNFETK-LLVKDONJSA-N	1	1	304.354	1.781	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC001262653900	900286230	/nfs/dbraw/zinc/28/62/30/900286230.db2.gz	SNFWAPWLJSKNBW-CYBMUJFWSA-N	1	1	307.350	1.574	20	5		DDBDMO
C/C=C(\C)C(=O)NCCC[N@@H+](CC)Cc1c([N+](=O)[O-])ncn1C	ZINC001265107157	901568300	/nfs/dbraw/zinc/56/83/00/901568300.db2.gz	BIFOCBCTIFDWSH-LFYBBSHMSA-N	1	1	323.397	1.623	20	5		DDBDMO
C/C=C(\C)C(=O)NCCC[N@H+](CC)Cc1c([N+](=O)[O-])ncn1C	ZINC001265107157	901568310	/nfs/dbraw/zinc/56/83/10/901568310.db2.gz	BIFOCBCTIFDWSH-LFYBBSHMSA-N	1	1	323.397	1.623	20	5		DDBDMO
CC[C@H](CO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000295836663	529381922	/nfs/dbraw/zinc/38/19/22/529381922.db2.gz	ZCRZEJZWPHYQBH-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000305770778	231048540	/nfs/dbraw/zinc/04/85/40/231048540.db2.gz	XYLPSRHELDHNNT-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](C)[C@@H](O)C1	ZINC000305770778	231048544	/nfs/dbraw/zinc/04/85/44/231048544.db2.gz	XYLPSRHELDHNNT-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000451935506	231240718	/nfs/dbraw/zinc/24/07/18/231240718.db2.gz	WEYLLFFOUADFER-OAHLLOKOSA-N	1	1	310.350	1.304	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000452114907	231307812	/nfs/dbraw/zinc/30/78/12/231307812.db2.gz	AZEPGPYCJNQKSG-SNVBAGLBSA-N	1	1	315.320	1.371	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000452114907	231307815	/nfs/dbraw/zinc/30/78/15/231307815.db2.gz	AZEPGPYCJNQKSG-SNVBAGLBSA-N	1	1	315.320	1.371	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1CCC[N@@H+]1CCCO	ZINC000452345773	231354179	/nfs/dbraw/zinc/35/41/79/231354179.db2.gz	FTSXFBRLCFOOHM-CQSZACIVSA-N	1	1	321.377	1.100	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000495209544	529573477	/nfs/dbraw/zinc/57/34/77/529573477.db2.gz	BCNULLOPQBLBQU-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)C(C)(C)C1	ZINC000614895499	362067247	/nfs/dbraw/zinc/06/72/47/362067247.db2.gz	VJYSAKRXWLVWMY-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000614895499	362067253	/nfs/dbraw/zinc/06/72/53/362067253.db2.gz	VJYSAKRXWLVWMY-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](O)CC1	ZINC000293025974	282361317	/nfs/dbraw/zinc/36/13/17/282361317.db2.gz	FVSVUIIQRSXRBT-CHWSQXEVSA-N	1	1	310.350	1.181	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000330779573	232061705	/nfs/dbraw/zinc/06/17/05/232061705.db2.gz	CUWMQZNQUFAXIX-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000330779573	232061709	/nfs/dbraw/zinc/06/17/09/232061709.db2.gz	CUWMQZNQUFAXIX-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCOC1CC([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000287000831	219263419	/nfs/dbraw/zinc/26/34/19/219263419.db2.gz	QBKCTQBSSWMQDW-BBBYJDLNSA-N	1	1	324.377	1.834	20	5		DDBDMO
CN(C)CC(C)(C)[NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000459544710	233295982	/nfs/dbraw/zinc/29/59/82/233295982.db2.gz	FFNWCAJRBSHDBS-UHFFFAOYSA-N	1	1	320.393	1.414	20	5		DDBDMO
CNC(=O)OC[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000287101214	219314531	/nfs/dbraw/zinc/31/45/31/219314531.db2.gz	XTVTYGGCSSRBAB-LLVKDONJSA-N	1	1	311.342	1.002	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000155768471	186111627	/nfs/dbraw/zinc/11/16/27/186111627.db2.gz	KCTHFDRRDGIYLI-NEPJUHHUSA-N	1	1	321.381	1.193	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851823	186193654	/nfs/dbraw/zinc/19/36/54/186193654.db2.gz	DOSKMLLLVZWTPP-BXUZGUMPSA-N	1	1	307.350	1.411	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851823	186193656	/nfs/dbraw/zinc/19/36/56/186193656.db2.gz	DOSKMLLLVZWTPP-BXUZGUMPSA-N	1	1	307.350	1.411	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000181868085	186213170	/nfs/dbraw/zinc/21/31/70/186213170.db2.gz	NAHURKVYNLBLOG-MELADBBJSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000181868085	186213172	/nfs/dbraw/zinc/21/31/72/186213172.db2.gz	NAHURKVYNLBLOG-MELADBBJSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000172019062	198026584	/nfs/dbraw/zinc/02/65/84/198026584.db2.gz	HDOZLZZBZCRNJF-UHFFFAOYSA-N	1	1	301.368	1.133	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](Cc3ccc(O)cc3)CC2)nc1	ZINC000601258133	358467161	/nfs/dbraw/zinc/46/71/61/358467161.db2.gz	YHRBOZNLMDNOFF-UHFFFAOYSA-N	1	1	315.333	1.413	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000032429832	352279577	/nfs/dbraw/zinc/27/95/77/352279577.db2.gz	JTKQKUSGKNJMLF-UPJWGTAASA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000032429832	352279581	/nfs/dbraw/zinc/27/95/81/352279581.db2.gz	JTKQKUSGKNJMLF-UPJWGTAASA-N	1	1	321.377	1.822	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCCn2cc[nH+]c2C)c1	ZINC000052153917	352601606	/nfs/dbraw/zinc/60/16/06/352601606.db2.gz	ULEBRCPYHSUSGA-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2cccc(F)c2[N+](=O)[O-])CC1	ZINC000057138226	352800346	/nfs/dbraw/zinc/80/03/46/352800346.db2.gz	JDSAIDURVJTVTL-UHFFFAOYSA-N	1	1	310.329	1.356	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ccncc2[N+](=O)[O-])CC1	ZINC000060380151	352869840	/nfs/dbraw/zinc/86/98/40/352869840.db2.gz	MMESHNQJVOFVTO-ZDUSSCGKSA-N	1	1	307.398	1.675	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)C1CC1	ZINC000066631300	353008910	/nfs/dbraw/zinc/00/89/10/353008910.db2.gz	WJGLSPVBSYFTFO-UHFFFAOYSA-N	1	1	321.333	1.190	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000067633736	353058982	/nfs/dbraw/zinc/05/89/82/353058982.db2.gz	YYXMFCRXDFEDBW-ZDUSSCGKSA-N	1	1	321.377	1.820	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1	ZINC000067795914	353067595	/nfs/dbraw/zinc/06/75/95/353067595.db2.gz	NGZCCQJLIFHMAS-UKRRQHHQSA-N	1	1	319.361	1.960	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000068468055	353113342	/nfs/dbraw/zinc/11/33/42/353113342.db2.gz	JGSLDYQFMWJVID-UHFFFAOYSA-N	1	1	304.350	1.617	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000068211117	353096175	/nfs/dbraw/zinc/09/61/75/353096175.db2.gz	VKEZKUZPFPNOCX-CHWSQXEVSA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1	ZINC000068226859	353097510	/nfs/dbraw/zinc/09/75/10/353097510.db2.gz	KVLSOTTXTCJKNJ-NWDGAFQWSA-N	1	1	323.397	1.336	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000069502710	353164452	/nfs/dbraw/zinc/16/44/52/353164452.db2.gz	XIQBPKSNGCSNLQ-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CC=CCC1	ZINC000491989714	234352769	/nfs/dbraw/zinc/35/27/69/234352769.db2.gz	HTOPRPAXZVCTES-BQYQJAHWSA-N	1	1	301.346	1.986	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2cccc([N+](=O)[O-])c2)n1C	ZINC000074095315	353290507	/nfs/dbraw/zinc/29/05/07/353290507.db2.gz	GOTVASHBRDYRSC-UHFFFAOYSA-N	1	1	303.322	1.324	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000075783738	353379589	/nfs/dbraw/zinc/37/95/89/353379589.db2.gz	HIAOAKKLAKTIJL-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000075783738	353379591	/nfs/dbraw/zinc/37/95/91/353379591.db2.gz	HIAOAKKLAKTIJL-SNVBAGLBSA-N	1	1	306.322	1.848	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000079554573	353567621	/nfs/dbraw/zinc/56/76/21/353567621.db2.gz	JIUGHIHINDJBTI-MIGQKNRLSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000079554573	353567622	/nfs/dbraw/zinc/56/76/22/353567622.db2.gz	JIUGHIHINDJBTI-MIGQKNRLSA-N	1	1	317.389	1.821	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000079554573	353567625	/nfs/dbraw/zinc/56/76/25/353567625.db2.gz	JIUGHIHINDJBTI-MIGQKNRLSA-N	1	1	317.389	1.821	20	5		DDBDMO
CC(C)[N@@H+](CCO)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000085860271	353737761	/nfs/dbraw/zinc/73/77/61/353737761.db2.gz	SRIKZIXRRRNPGZ-UHFFFAOYSA-N	1	1	323.349	1.596	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000092642227	353865113	/nfs/dbraw/zinc/86/51/13/353865113.db2.gz	LFLQMISBZFBRNX-CYBMUJFWSA-N	1	1	320.393	1.903	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c1	ZINC000153631638	354200156	/nfs/dbraw/zinc/20/01/56/354200156.db2.gz	RWDOWLRFFWZHFZ-MGPQQGTHSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H](O)C1CC1	ZINC000305268298	354469929	/nfs/dbraw/zinc/46/99/29/354469929.db2.gz	ZIFYFSVNYIZTMC-AWEZNQCLSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H](O)C1CC1	ZINC000305268298	354469932	/nfs/dbraw/zinc/46/99/32/354469932.db2.gz	ZIFYFSVNYIZTMC-AWEZNQCLSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[N@@H+]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000318517203	354516742	/nfs/dbraw/zinc/51/67/42/354516742.db2.gz	YZOLNESOQJCECP-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CC[N@H+]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1C	ZINC000318517203	354516746	/nfs/dbraw/zinc/51/67/46/354516746.db2.gz	YZOLNESOQJCECP-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)COc1cc(C)c([N+](=O)[O-])cc1F	ZINC000319560817	354522492	/nfs/dbraw/zinc/52/24/92/354522492.db2.gz	PEGUEGSAJUBZRW-LLVKDONJSA-N	1	1	316.329	1.360	20	5		DDBDMO
CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2c[nH]nc2[N+](=O)[O-])CC1	ZINC000588687366	354929608	/nfs/dbraw/zinc/92/96/08/354929608.db2.gz	ROUBWJGPKKMEOJ-UHFFFAOYSA-N	1	1	321.381	1.726	20	5		DDBDMO
Cc1c(C(=O)N2CC[C@@H]([N@H+]3CC[C@H](O)C3)C2)cccc1[N+](=O)[O-]	ZINC000588860602	354943729	/nfs/dbraw/zinc/94/37/29/354943729.db2.gz	JYQOATUSLJYVOG-OLZOCXBDSA-N	1	1	319.361	1.184	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1O	ZINC000589505438	354997673	/nfs/dbraw/zinc/99/76/73/354997673.db2.gz	IHHOEQQDYYBZGI-IINYFYTJSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]([C@H](C)O)C2)c1	ZINC000589510627	354998247	/nfs/dbraw/zinc/99/82/47/354998247.db2.gz	BIRNOFJFECCVKQ-AAEUAGOBSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c[nH]nc1[N+](=O)[O-]	ZINC000589528901	355000195	/nfs/dbraw/zinc/00/01/95/355000195.db2.gz	PIRJBWZSHDOVNU-LLVKDONJSA-N	1	1	317.349	1.568	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590011102	355040574	/nfs/dbraw/zinc/04/05/74/355040574.db2.gz	HUKWCDIBACTPPT-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@H]2CC[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590011102	355040578	/nfs/dbraw/zinc/04/05/78/355040578.db2.gz	HUKWCDIBACTPPT-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000590011102	355040581	/nfs/dbraw/zinc/04/05/81/355040581.db2.gz	HUKWCDIBACTPPT-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H](O)CC1)OCCO2	ZINC000590381866	355079092	/nfs/dbraw/zinc/07/90/92/355079092.db2.gz	OSQVCEHSIGIYMR-GFCCVEGCSA-N	1	1	308.334	1.713	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@H](O)CC1)OCCO2	ZINC000590381866	355079093	/nfs/dbraw/zinc/07/90/93/355079093.db2.gz	OSQVCEHSIGIYMR-GFCCVEGCSA-N	1	1	308.334	1.713	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1CCOC1	ZINC000494957217	235107349	/nfs/dbraw/zinc/10/73/49/235107349.db2.gz	NSWXHYMFZIQFRE-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
CCOc1cc(C[NH2+][C@@H](CO)c2cnn(C)c2)ccc1[N+](=O)[O-]	ZINC000276972653	213210893	/nfs/dbraw/zinc/21/08/93/213210893.db2.gz	XCIOIAAABVLIRZ-ZDUSSCGKSA-N	1	1	320.349	1.550	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)[C@@H]2C1	ZINC000590442265	355096854	/nfs/dbraw/zinc/09/68/54/355096854.db2.gz	FCGFGKYRIZNOIE-JOYOIKCWSA-N	1	1	319.317	1.100	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-]	ZINC000591464147	355317024	/nfs/dbraw/zinc/31/70/24/355317024.db2.gz	AVSXBHWGDRRQFX-JTQLQIEISA-N	1	1	317.349	1.774	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]1C[C@H](F)C[NH2+]1	ZINC000591281844	355277707	/nfs/dbraw/zinc/27/77/07/355277707.db2.gz	OOSVPOFGYQWBHW-MDZLAQPJSA-N	1	1	324.356	1.602	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC[C@@H]2C2CCC2)c1	ZINC000592198752	355534191	/nfs/dbraw/zinc/53/41/91/355534191.db2.gz	RUQZTPIGHVQUAO-HUUCEWRRSA-N	1	1	308.382	1.807	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593573234	355930398	/nfs/dbraw/zinc/93/03/98/355930398.db2.gz	VWKNNMAZCWBHRY-GHMZBOCLSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000593744193	355983615	/nfs/dbraw/zinc/98/36/15/355983615.db2.gz	OYEHHHVRNWBVSO-SWLSCSKDSA-N	1	1	321.352	1.829	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594108050	356114843	/nfs/dbraw/zinc/11/48/43/356114843.db2.gz	PHOHVBGMMQJNRU-UTUOFQBUSA-N	1	1	324.381	1.161	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])n1C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000594108050	356114847	/nfs/dbraw/zinc/11/48/47/356114847.db2.gz	PHOHVBGMMQJNRU-UTUOFQBUSA-N	1	1	324.381	1.161	20	5		DDBDMO
CC(C)Oc1nc(N2CC[NH+](C[C@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000594548773	356248113	/nfs/dbraw/zinc/24/81/13/356248113.db2.gz	CRNJSSQLLXJVRS-LBPRGKRZSA-N	1	1	324.381	1.280	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000595524098	356532605	/nfs/dbraw/zinc/53/26/05/356532605.db2.gz	XMKQZMOYYHEVIY-CQSZACIVSA-N	1	1	320.393	1.921	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595637588	356587367	/nfs/dbraw/zinc/58/73/67/356587367.db2.gz	RPIBVILQPKMBSR-FRRDWIJNSA-N	1	1	319.361	1.626	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595637588	356587370	/nfs/dbraw/zinc/58/73/70/356587370.db2.gz	RPIBVILQPKMBSR-FRRDWIJNSA-N	1	1	319.361	1.626	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1	ZINC000595864531	356683419	/nfs/dbraw/zinc/68/34/19/356683419.db2.gz	BQCZIXPAKAMREY-MRXNPFEDSA-N	1	1	305.378	1.626	20	5		DDBDMO
Cc1cc(N2CCC[C@@H]([NH+]3CCOCC3)C2)ncc1[N+](=O)[O-]	ZINC000596246143	356831328	/nfs/dbraw/zinc/83/13/28/356831328.db2.gz	CBBDSUIALNLTMU-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[C@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000596299261	356849708	/nfs/dbraw/zinc/84/97/08/356849708.db2.gz	QZMAKEQLQYTNOS-MXWKQRLJSA-N	1	1	310.354	1.605	20	5		DDBDMO
C[C@H](CNc1cc[nH]c(=O)c1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000596299261	356849712	/nfs/dbraw/zinc/84/97/12/356849712.db2.gz	QZMAKEQLQYTNOS-MXWKQRLJSA-N	1	1	310.354	1.605	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000596308682	356852465	/nfs/dbraw/zinc/85/24/65/356852465.db2.gz	KNBSOLIQKJBBNJ-SECBINFHSA-N	1	1	307.354	1.373	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596537535	356910305	/nfs/dbraw/zinc/91/03/05/356910305.db2.gz	HIVYXBZFNYIVTN-CQSZACIVSA-N	1	1	305.378	1.939	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000596539248	356911027	/nfs/dbraw/zinc/91/10/27/356911027.db2.gz	NPVSFEOAZCDAIQ-CYBMUJFWSA-N	1	1	323.397	1.155	20	5		DDBDMO
CCN(C(=O)NCCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000596517248	356903308	/nfs/dbraw/zinc/90/33/08/356903308.db2.gz	FYLUBQKUVKETCW-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1ccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1[N+](=O)[O-]	ZINC000597237409	357105854	/nfs/dbraw/zinc/10/58/54/357105854.db2.gz	ZWZVAIHQTSAOTD-INIZCTEOSA-N	1	1	319.405	1.934	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-]	ZINC000597857360	357360202	/nfs/dbraw/zinc/36/02/02/357360202.db2.gz	FIXJGGLNFKHZMK-JTQLQIEISA-N	1	1	323.397	1.873	20	5		DDBDMO
CCN(C(=O)c1ccc([N+](=O)[O-])cc1OC)[C@@H]1CC[N@@H+](C)C1	ZINC000597943988	357393043	/nfs/dbraw/zinc/39/30/43/357393043.db2.gz	BMJVVPBLGFJEHV-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000598342279	357545906	/nfs/dbraw/zinc/54/59/06/357545906.db2.gz	LMTQFWSEDHHXSP-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000598342230	357546021	/nfs/dbraw/zinc/54/60/21/357546021.db2.gz	KVKWQOOGZHPOQW-ZDUSSCGKSA-N	1	1	321.377	1.746	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000598590881	357643872	/nfs/dbraw/zinc/64/38/72/357643872.db2.gz	RSDGKCQKFHOFTH-GHMZBOCLSA-N	1	1	320.349	1.815	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000598590888	357644613	/nfs/dbraw/zinc/64/46/13/357644613.db2.gz	RSDGKCQKFHOFTH-WDEREUQCSA-N	1	1	320.349	1.815	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CCc3[nH]cnc3C2)c1[N+](=O)[O-]	ZINC000598626350	357659867	/nfs/dbraw/zinc/65/98/67/357659867.db2.gz	AYLBBXZCFJNSEZ-MRVPVSSYSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c1[N+](=O)[O-]	ZINC000598626350	357659872	/nfs/dbraw/zinc/65/98/72/357659872.db2.gz	AYLBBXZCFJNSEZ-MRVPVSSYSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c1[N+](=O)[O-]	ZINC000598626350	357659877	/nfs/dbraw/zinc/65/98/77/357659877.db2.gz	AYLBBXZCFJNSEZ-MRVPVSSYSA-N	1	1	317.305	1.469	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598647152	357669416	/nfs/dbraw/zinc/66/94/16/357669416.db2.gz	CEBZUTZWMUNWBW-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598647152	357669419	/nfs/dbraw/zinc/66/94/19/357669419.db2.gz	CEBZUTZWMUNWBW-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1CO	ZINC000598676817	357682901	/nfs/dbraw/zinc/68/29/01/357682901.db2.gz	LMTMAKYFQWZUEG-YPMHNXCESA-N	1	1	322.361	1.816	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNCC[N@@H+]1CC[C@@H](O)C1	ZINC000599007192	357790999	/nfs/dbraw/zinc/79/09/99/357790999.db2.gz	BXZMAWXQLYMNFF-CQSZACIVSA-N	1	1	309.366	1.150	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNCC[N@H+]1CC[C@@H](O)C1	ZINC000599007192	357791004	/nfs/dbraw/zinc/79/10/04/357791004.db2.gz	BXZMAWXQLYMNFF-CQSZACIVSA-N	1	1	309.366	1.150	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+]1CCCNCc1ccccc1[N+](=O)[O-]	ZINC000598991028	357785397	/nfs/dbraw/zinc/78/53/97/357785397.db2.gz	SPBBCNRTJAZUPZ-AWEZNQCLSA-N	1	1	306.366	1.024	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1CCCNCc1ccccc1[N+](=O)[O-]	ZINC000598991028	357785399	/nfs/dbraw/zinc/78/53/99/357785399.db2.gz	SPBBCNRTJAZUPZ-AWEZNQCLSA-N	1	1	306.366	1.024	20	5		DDBDMO
Cc1c(C[N@@H+]2C[C@](C)(CO)[C@](C)(CO)C2)cccc1[N+](=O)[O-]	ZINC000599624664	357997382	/nfs/dbraw/zinc/99/73/82/357997382.db2.gz	ULQVRUOGFGNTLH-IYBDPMFKSA-N	1	1	308.378	1.716	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000599561855	357973786	/nfs/dbraw/zinc/97/37/86/357973786.db2.gz	CUBPXRDFHKVQSW-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@]1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000599561855	357973788	/nfs/dbraw/zinc/97/37/88/357973788.db2.gz	CUBPXRDFHKVQSW-HNNXBMFYSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000599561706	357974161	/nfs/dbraw/zinc/97/41/61/357974161.db2.gz	CEXOHBDOXKIJEC-OAHLLOKOSA-N	1	1	324.333	1.238	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)n1	ZINC000600229968	358163763	/nfs/dbraw/zinc/16/37/63/358163763.db2.gz	MFWIODXSOJTAKM-GFCCVEGCSA-N	1	1	321.381	1.465	20	5		DDBDMO
CC(C)[C@H]1CNCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000600715091	358292913	/nfs/dbraw/zinc/29/29/13/358292913.db2.gz	RILSLGAYESUCLY-OAHLLOKOSA-N	1	1	320.393	1.853	20	5		DDBDMO
CC(C)[C@H]1CNCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000600715091	358292916	/nfs/dbraw/zinc/29/29/16/358292916.db2.gz	RILSLGAYESUCLY-OAHLLOKOSA-N	1	1	320.393	1.853	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCC(n2ccc([N+](=O)[O-])n2)CC1)C1CCC1	ZINC000600825038	358326946	/nfs/dbraw/zinc/32/69/46/358326946.db2.gz	GGBYEFFSRWIOOU-UHFFFAOYSA-N	1	1	321.381	1.439	20	5		DDBDMO
CC(C)N1C[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000601110524	358405619	/nfs/dbraw/zinc/40/56/19/358405619.db2.gz	DIDMRINHMCZAGE-LLVKDONJSA-N	1	1	314.345	1.986	20	5		DDBDMO
COc1cc(F)cc(OC)c1C[NH2+]CCn1cc([N+](=O)[O-])cn1	ZINC000601111385	358406151	/nfs/dbraw/zinc/40/61/51/358406151.db2.gz	PLGTWCCUNIKHFY-UHFFFAOYSA-N	1	1	324.312	1.737	20	5		DDBDMO
C[C@](CO)([NH2+]Cc1cnn2c1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000601149519	358422337	/nfs/dbraw/zinc/42/23/37/358422337.db2.gz	NMIVWTITCLUKTM-MRXNPFEDSA-N	1	1	316.361	1.735	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H](CO)C1	ZINC000601979256	358763988	/nfs/dbraw/zinc/76/39/88/358763988.db2.gz	BTZODQJXCPWCPW-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)[C@H](CO)C1	ZINC000601979256	358763994	/nfs/dbraw/zinc/76/39/94/358763994.db2.gz	BTZODQJXCPWCPW-JTQLQIEISA-N	1	1	319.283	1.726	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)c([N+](=O)[O-])n1	ZINC000602783335	359188731	/nfs/dbraw/zinc/18/87/31/359188731.db2.gz	LIRXCQJRRXFUQV-AWEZNQCLSA-N	1	1	323.397	1.015	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)c([N+](=O)[O-])n1	ZINC000602783335	359188734	/nfs/dbraw/zinc/18/87/34/359188734.db2.gz	LIRXCQJRRXFUQV-AWEZNQCLSA-N	1	1	323.397	1.015	20	5		DDBDMO
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@H]3C[N@H+]2CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602829543	359221050	/nfs/dbraw/zinc/22/10/50/359221050.db2.gz	LKQKWCGMQAZJOW-JQPXUNLUSA-N	1	1	306.366	1.455	20	5		DDBDMO
COc1ccc([C@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C2CC2)cn1	ZINC000602919856	359294643	/nfs/dbraw/zinc/29/46/43/359294643.db2.gz	XOVOYCAYBWCFOS-CQSZACIVSA-N	1	1	317.349	1.973	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000618467678	363642384	/nfs/dbraw/zinc/64/23/84/363642384.db2.gz	PFKXCJSWCJEBBJ-YPMHNXCESA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000618467678	363642388	/nfs/dbraw/zinc/64/23/88/363642388.db2.gz	PFKXCJSWCJEBBJ-YPMHNXCESA-N	1	1	307.350	1.352	20	5		DDBDMO
C[N@@H+](Cc1ccns1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000602885558	359269304	/nfs/dbraw/zinc/26/93/04/359269304.db2.gz	YBYSVTKHFDTYLI-NSHDSACASA-N	1	1	323.374	1.923	20	5		DDBDMO
C[N@H+](Cc1ccns1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000602885558	359269306	/nfs/dbraw/zinc/26/93/06/359269306.db2.gz	YBYSVTKHFDTYLI-NSHDSACASA-N	1	1	323.374	1.923	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC1(CO)CC1	ZINC000186812388	200014977	/nfs/dbraw/zinc/01/49/77/200014977.db2.gz	IIMCDOIMXJUBDL-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(CO)CC1	ZINC000186812388	200014979	/nfs/dbraw/zinc/01/49/79/200014979.db2.gz	IIMCDOIMXJUBDL-NSHDSACASA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000186840403	200020165	/nfs/dbraw/zinc/02/01/65/200020165.db2.gz	GCCXAOHJLOSNEO-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@H](C(F)F)C2)c1	ZINC000611180228	360652006	/nfs/dbraw/zinc/65/20/06/360652006.db2.gz	VGILWVDWTVSJCA-JQWIXIFHSA-N	1	1	316.304	1.922	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1CCC[C@@H]1O	ZINC000611285736	360689544	/nfs/dbraw/zinc/68/95/44/360689544.db2.gz	KBFKHTJTMBTQGS-FZMZJTMJSA-N	1	1	322.361	1.959	20	5		DDBDMO
CCOC(=O)C[C@@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000611237166	360672311	/nfs/dbraw/zinc/67/23/11/360672311.db2.gz	CLFXXMMMSKZBMO-CQSZACIVSA-N	1	1	322.361	1.873	20	5		DDBDMO
CCOC(=O)C[C@@H](O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000611237166	360672317	/nfs/dbraw/zinc/67/23/17/360672317.db2.gz	CLFXXMMMSKZBMO-CQSZACIVSA-N	1	1	322.361	1.873	20	5		DDBDMO
CNc1c(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613234989	361342201	/nfs/dbraw/zinc/34/22/01/361342201.db2.gz	LBZPWBGKJCSWPO-GWCFXTLKSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC000613234989	361342207	/nfs/dbraw/zinc/34/22/07/361342207.db2.gz	LBZPWBGKJCSWPO-GWCFXTLKSA-N	1	1	322.365	1.085	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CNc2ccnn2C1	ZINC000619265363	363953356	/nfs/dbraw/zinc/95/33/56/363953356.db2.gz	QBTOUDLFZQLZEA-GFCCVEGCSA-N	1	1	301.350	1.965	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000619566997	364063673	/nfs/dbraw/zinc/06/36/73/364063673.db2.gz	GUILFSCCCUILBY-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)s1	ZINC000619694484	364117734	/nfs/dbraw/zinc/11/77/34/364117734.db2.gz	QIICHKIHGZRFAQ-LLVKDONJSA-N	1	1	312.395	1.742	20	5		DDBDMO
Cc1sc(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)cc1[N+](=O)[O-]	ZINC000619873567	364170364	/nfs/dbraw/zinc/17/03/64/364170364.db2.gz	NSZWGEBRGQAXOW-LLVKDONJSA-N	1	1	324.406	1.084	20	5		DDBDMO
C[C@@H](c1ccccn1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000091704437	193094965	/nfs/dbraw/zinc/09/49/65/193094965.db2.gz	QTHUBOOFELLQSQ-LBPRGKRZSA-N	1	1	302.334	1.845	20	5		DDBDMO
CC[NH2+][C@H](C)CNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000359308056	299407070	/nfs/dbraw/zinc/40/70/70/299407070.db2.gz	NWVDDZFROPBYRU-MRVPVSSYSA-N	1	1	305.331	1.010	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)C[N@H+]1CCC(C)(C)C1	ZINC000566439084	304156593	/nfs/dbraw/zinc/15/65/93/304156593.db2.gz	CBCOQNOSUUOYBP-UHFFFAOYSA-N	1	1	321.377	1.952	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000284795941	218180963	/nfs/dbraw/zinc/18/09/63/218180963.db2.gz	OGZBJKJROSBOJF-UKRRQHHQSA-N	1	1	319.361	1.837	20	5		DDBDMO
CCOc1cccc(NC[C@@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000273864023	211124324	/nfs/dbraw/zinc/12/43/24/211124324.db2.gz	MXSPDKIUZDTJIL-GFCCVEGCSA-N	1	1	308.382	1.651	20	5		DDBDMO
CC(C)(C)[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(N)=O	ZINC000106445327	194214060	/nfs/dbraw/zinc/21/40/60/194214060.db2.gz	GWLIHQZNSKYFRZ-GFCCVEGCSA-N	1	1	308.338	1.023	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC000106395457	194206215	/nfs/dbraw/zinc/20/62/15/194206215.db2.gz	ZGRTVWQGVNSQFK-HNNXBMFYSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938470	251290447	/nfs/dbraw/zinc/29/04/47/251290447.db2.gz	WHOZVUHOZSRWBW-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938470	251290450	/nfs/dbraw/zinc/29/04/50/251290450.db2.gz	WHOZVUHOZSRWBW-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000341024822	251344327	/nfs/dbraw/zinc/34/43/27/251344327.db2.gz	HZPCLTBPOYNTOT-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000341058939	251360888	/nfs/dbraw/zinc/36/08/88/251360888.db2.gz	LQGPPCVYYBMZBX-BETUJISGSA-N	1	1	323.397	1.561	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cccc(OC)c2[N+](=O)[O-])C1	ZINC000444177171	532981907	/nfs/dbraw/zinc/98/19/07/532981907.db2.gz	SUPXTHZWJJHNNE-LLVKDONJSA-N	1	1	323.349	1.054	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000119856485	195050276	/nfs/dbraw/zinc/05/02/76/195050276.db2.gz	LZDSXWDIFKBHCT-CHWSQXEVSA-N	1	1	312.391	1.772	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000158224408	197255429	/nfs/dbraw/zinc/25/54/29/197255429.db2.gz	NEVZBIZSDICJLY-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+](CCO)CCOCC(F)(F)F	ZINC000264838690	285160298	/nfs/dbraw/zinc/16/02/98/285160298.db2.gz	JOZIEXPCKVELQL-UHFFFAOYSA-N	1	1	322.283	1.968	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@@H+](CCO)CCOCC(F)(F)F	ZINC000264838690	285160299	/nfs/dbraw/zinc/16/02/99/285160299.db2.gz	JOZIEXPCKVELQL-UHFFFAOYSA-N	1	1	322.283	1.968	20	5		DDBDMO
C[C@@H](NC(=O)N1CC[NH2+]C[C@@](C)(F)C1)c1cccc([N+](=O)[O-])c1	ZINC000417140701	533126738	/nfs/dbraw/zinc/12/67/38/533126738.db2.gz	QJVVFHKGURGKJK-IAQYHMDHSA-N	1	1	324.356	1.999	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@@H]1O	ZINC000352657092	285201403	/nfs/dbraw/zinc/20/14/03/285201403.db2.gz	FAMUJIGAQJNBMP-OBJOEFQTSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000352802449	285311394	/nfs/dbraw/zinc/31/13/94/285311394.db2.gz	DVDCZMFZFCWYNN-XHDPSFHLSA-N	1	1	321.352	1.829	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1[C@@H]2CC[C@H]1CN(C)C(=O)C2	ZINC000451857259	533221358	/nfs/dbraw/zinc/22/13/58/533221358.db2.gz	GSQYVHHZMZLFKP-OCCSQVGLSA-N	1	1	319.361	1.799	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000352869378	285348135	/nfs/dbraw/zinc/34/81/35/285348135.db2.gz	WJXRSTUEQCBWKN-MNOVXSKESA-N	1	1	323.397	1.629	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)NCC(F)(F)C[NH3+])c1C	ZINC000186987871	292292021	/nfs/dbraw/zinc/29/20/21/292292021.db2.gz	SYXHLYCXPONBGU-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@@H+]1CCCC[C@@H]1C	ZINC000068203271	406622726	/nfs/dbraw/zinc/62/27/26/406622726.db2.gz	JITQFLYFCGNLKI-NSHDSACASA-N	1	1	309.370	1.090	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000123324177	407325675	/nfs/dbraw/zinc/32/56/75/407325675.db2.gz	QWGILHCXAKEIEZ-OLZOCXBDSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H]1CCCO1	ZINC000102770667	407326761	/nfs/dbraw/zinc/32/67/61/407326761.db2.gz	LMVWOVDOTBGQNP-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@H]1CCCO1	ZINC000102770667	407326762	/nfs/dbraw/zinc/32/67/62/407326762.db2.gz	LMVWOVDOTBGQNP-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000123693577	407336726	/nfs/dbraw/zinc/33/67/26/407336726.db2.gz	CZCUEHLJPYJDFA-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000124632619	407365230	/nfs/dbraw/zinc/36/52/30/407365230.db2.gz	SKFHYYDRQXYOON-ZBFHGGJFSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@]1(O)CCC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000124632619	407365232	/nfs/dbraw/zinc/36/52/32/407365232.db2.gz	SKFHYYDRQXYOON-ZBFHGGJFSA-N	1	1	319.361	1.547	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CCCC2)C1)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000106919703	407367172	/nfs/dbraw/zinc/36/71/72/407367172.db2.gz	NZRYZTRRNRLLFA-JTQLQIEISA-N	1	1	320.349	1.442	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000108566547	407388367	/nfs/dbraw/zinc/38/83/67/407388367.db2.gz	WZPLDULUABCJAH-ZDUSSCGKSA-N	1	1	306.366	1.736	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000126076328	407404320	/nfs/dbraw/zinc/40/43/20/407404320.db2.gz	APOAICAWROZQPP-LBPRGKRZSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCn1cccn1	ZINC000111283443	407406001	/nfs/dbraw/zinc/40/60/01/407406001.db2.gz	NRFSZCOKPYTLLE-LBPRGKRZSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CCn1cccn1	ZINC000111283443	407406003	/nfs/dbraw/zinc/40/60/03/407406003.db2.gz	NRFSZCOKPYTLLE-LBPRGKRZSA-N	1	1	317.349	1.750	20	5		DDBDMO
C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)CC1CCC1	ZINC000111298430	407406606	/nfs/dbraw/zinc/40/66/06/407406606.db2.gz	MRULXESARJJRCC-UHFFFAOYSA-N	1	1	321.333	1.994	20	5		DDBDMO
C[C@H](CNS(=O)(=O)c1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000185758387	407495082	/nfs/dbraw/zinc/49/50/82/407495082.db2.gz	BZQBKAUBQQRVSM-SNVBAGLBSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc([S@](C)=O)cc1	ZINC000178420513	407450824	/nfs/dbraw/zinc/45/08/24/407450824.db2.gz	ONSTYBKVSHSKLK-QFIPXVFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc([S@](C)=O)cc1	ZINC000178420513	407450830	/nfs/dbraw/zinc/45/08/30/407450830.db2.gz	ONSTYBKVSHSKLK-QFIPXVFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc([S@@](C)=O)cc1	ZINC000178420655	407451715	/nfs/dbraw/zinc/45/17/15/407451715.db2.gz	ZUKPCIWKCMUJBS-JOCHJYFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc([S@@](C)=O)cc1	ZINC000178420655	407451719	/nfs/dbraw/zinc/45/17/19/407451719.db2.gz	ZUKPCIWKCMUJBS-JOCHJYFZSA-N	1	1	322.390	1.661	20	5		DDBDMO
O=[N+]([O-])c1cccc(S(=O)(=O)N2CC[C@H]([NH+]3CC=CC3)C2)c1	ZINC000185848059	407521229	/nfs/dbraw/zinc/52/12/29/407521229.db2.gz	GQCSALYLVKYGRH-ZDUSSCGKSA-N	1	1	323.374	1.230	20	5		DDBDMO
C[C@@H]1C[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC[NH2+]1	ZINC000261783987	407614715	/nfs/dbraw/zinc/61/47/15/407614715.db2.gz	XCTOCCKWCFBMTC-BDAKNGLRSA-N	1	1	317.342	1.153	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CC1(O)CCCC1)c1ccc([N+](=O)[O-])cc1	ZINC000152254712	407594532	/nfs/dbraw/zinc/59/45/32/407594532.db2.gz	ZWZFIIGCSBJJBU-UHFFFAOYSA-N	1	1	321.377	1.795	20	5		DDBDMO
NC(=O)NC(=O)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000153276868	407792412	/nfs/dbraw/zinc/79/24/12/407792412.db2.gz	QBZOEIAQIWFSBQ-UHFFFAOYSA-N	1	1	306.322	1.144	20	5		DDBDMO
COc1cc(CNC[C@H]2CCC[N@@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000237277851	407808916	/nfs/dbraw/zinc/80/89/16/407808916.db2.gz	CUPRTEHPFSMQJY-GFCCVEGCSA-N	1	1	309.366	1.796	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@]2(CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000153648145	407870121	/nfs/dbraw/zinc/87/01/21/407870121.db2.gz	XOTSCVSROKCCNE-OAHLLOKOSA-N	1	1	305.334	1.646	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@]2(CCOC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000153648145	407870127	/nfs/dbraw/zinc/87/01/27/407870127.db2.gz	XOTSCVSROKCCNE-OAHLLOKOSA-N	1	1	305.334	1.646	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC[N@H+](C)C(C)C	ZINC000118123670	407899639	/nfs/dbraw/zinc/89/96/39/407899639.db2.gz	LIKNQBDRJXYMEC-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
COC(=O)C1(O)CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000272427237	407915469	/nfs/dbraw/zinc/91/54/69/407915469.db2.gz	HFQIADABIDBYKZ-GFCCVEGCSA-N	1	1	322.361	1.964	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@H](CO)C1	ZINC000182171069	408085342	/nfs/dbraw/zinc/08/53/42/408085342.db2.gz	TYTJKUCFSCMHCS-QWHCGFSZSA-N	1	1	310.350	1.039	20	5		DDBDMO
Cc1c(C(=O)N2CC[NH+](C[C@H](C)O)CC2)cccc1[N+](=O)[O-]	ZINC000189713267	408086556	/nfs/dbraw/zinc/08/65/56/408086556.db2.gz	OBTGSCHUJMOFPV-NSHDSACASA-N	1	1	307.350	1.042	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000189721503	408089788	/nfs/dbraw/zinc/08/97/88/408089788.db2.gz	IKEGWUIPIRWDDO-CABCVRRESA-N	1	1	310.350	1.366	20	5		DDBDMO
COCCO[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000189732386	408092653	/nfs/dbraw/zinc/09/26/53/408092653.db2.gz	NVKKFGSPSKVGRQ-GFCCVEGCSA-N	1	1	321.333	1.973	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000189732386	408092661	/nfs/dbraw/zinc/09/26/61/408092661.db2.gz	NVKKFGSPSKVGRQ-GFCCVEGCSA-N	1	1	321.333	1.973	20	5		DDBDMO
Cc1c(C(=O)NC[C@@H](C)C[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000150730739	408195299	/nfs/dbraw/zinc/19/52/99/408195299.db2.gz	ZNRRSTOBAHHDFX-GFCCVEGCSA-N	1	1	321.377	1.601	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000263666827	408198154	/nfs/dbraw/zinc/19/81/54/408198154.db2.gz	LCJKLHUCUXTDBR-GHMZBOCLSA-N	1	1	323.397	1.731	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@H]1CO)c1ccccc1[N+](=O)[O-]	ZINC000269428248	408305905	/nfs/dbraw/zinc/30/59/05/408305905.db2.gz	QKWQTGVMNADCKH-ZDUSSCGKSA-N	1	1	321.377	1.562	20	5		DDBDMO
Cc1csc(N2CC[NH+](CCn3ccc([N+](=O)[O-])n3)CC2)n1	ZINC000176208247	408310009	/nfs/dbraw/zinc/31/00/09/408310009.db2.gz	ZKESKMGSOWRJIX-UHFFFAOYSA-N	1	1	322.394	1.378	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCOCC23CCC3)c1	ZINC000135498986	162105226	/nfs/dbraw/zinc/10/52/26/162105226.db2.gz	PNEOLDSKLKZQJO-AWEZNQCLSA-N	1	1	322.361	1.589	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCOCC23CCC3)c1	ZINC000135498986	162105230	/nfs/dbraw/zinc/10/52/30/162105230.db2.gz	PNEOLDSKLKZQJO-AWEZNQCLSA-N	1	1	322.361	1.589	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269549196	408351481	/nfs/dbraw/zinc/35/14/81/408351481.db2.gz	XJARPNMCFVNIPB-WDEREUQCSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269549196	408351485	/nfs/dbraw/zinc/35/14/85/408351485.db2.gz	XJARPNMCFVNIPB-WDEREUQCSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269549196	408351490	/nfs/dbraw/zinc/35/14/90/408351490.db2.gz	XJARPNMCFVNIPB-WDEREUQCSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C[C@H](C)O	ZINC000247040213	408392089	/nfs/dbraw/zinc/39/20/89/408392089.db2.gz	XWXODMWXNBECOU-STQMWFEESA-N	1	1	321.377	1.512	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000247040213	408392096	/nfs/dbraw/zinc/39/20/96/408392096.db2.gz	XWXODMWXNBECOU-STQMWFEESA-N	1	1	321.377	1.512	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000274433779	408403715	/nfs/dbraw/zinc/40/37/15/408403715.db2.gz	GHVURZFCBMBNIY-LLVKDONJSA-N	1	1	324.356	1.919	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)C2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000264283251	408424874	/nfs/dbraw/zinc/42/48/74/408424874.db2.gz	ODQWXRKRYZSGNU-UHFFFAOYSA-N	1	1	309.370	1.571	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000177052907	408508298	/nfs/dbraw/zinc/50/82/98/408508298.db2.gz	MAQJNIZZMIJFJP-DGCLKSJQSA-N	1	1	303.362	1.879	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000177205431	408552992	/nfs/dbraw/zinc/55/29/92/408552992.db2.gz	YFHHWYWDYAIPOT-GHMZBOCLSA-N	1	1	319.361	1.958	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(Cc2csc([N+](=O)[O-])c2)CC1	ZINC000265198930	408578773	/nfs/dbraw/zinc/57/87/73/408578773.db2.gz	JEBNNRWFDGWNSB-UHFFFAOYSA-N	1	1	313.423	1.935	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1	ZINC000185144622	408768789	/nfs/dbraw/zinc/76/87/89/408768789.db2.gz	VJKLRYLQCFULDH-JTQLQIEISA-N	1	1	311.313	1.783	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCO1	ZINC000185144622	408768796	/nfs/dbraw/zinc/76/87/96/408768796.db2.gz	VJKLRYLQCFULDH-JTQLQIEISA-N	1	1	311.313	1.783	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])n[nH]2)[nH+]c1	ZINC000285950785	408894863	/nfs/dbraw/zinc/89/48/63/408894863.db2.gz	DXLHCENZHBWZSI-UHFFFAOYSA-N	1	1	304.310	1.253	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000291600426	408892304	/nfs/dbraw/zinc/89/23/04/408892304.db2.gz	RUBQYWQEKKJCKN-SNVBAGLBSA-N	1	1	311.386	1.487	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1csc([N+](=O)[O-])c1	ZINC000189460033	163101955	/nfs/dbraw/zinc/10/19/55/163101955.db2.gz	ZXSDTJMDVLHYGU-LLVKDONJSA-N	1	1	313.423	1.933	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000291760809	408918968	/nfs/dbraw/zinc/91/89/68/408918968.db2.gz	DBJYPZZBHZZQDY-SNVBAGLBSA-N	1	1	324.337	1.962	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000286319415	408963526	/nfs/dbraw/zinc/96/35/26/408963526.db2.gz	KVCZYQYXKRHEBW-LLVKDONJSA-N	1	1	306.366	1.485	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000292149898	408990591	/nfs/dbraw/zinc/99/05/91/408990591.db2.gz	VEYBTMWOQQVHLM-SECBINFHSA-N	1	1	312.345	1.775	20	5		DDBDMO
CC[N@H+](CCOCCO)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000282129558	408996837	/nfs/dbraw/zinc/99/68/37/408996837.db2.gz	REJQFUIJNXJTBQ-UHFFFAOYSA-N	1	1	316.329	1.573	20	5		DDBDMO
CC[N@@H+](CCOCCO)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000282129558	408996840	/nfs/dbraw/zinc/99/68/40/408996840.db2.gz	REJQFUIJNXJTBQ-UHFFFAOYSA-N	1	1	316.329	1.573	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000293373628	409099718	/nfs/dbraw/zinc/09/97/18/409099718.db2.gz	JIIXDRMVULFSSF-XQQFMLRXSA-N	1	1	320.393	1.946	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1	ZINC000293791947	409181824	/nfs/dbraw/zinc/18/18/24/409181824.db2.gz	CQKCUUSBRLHYSW-WDEREUQCSA-N	1	1	309.322	1.123	20	5		DDBDMO
C[C@H](NCCC[NH+]1CCC(O)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000283891232	409234875	/nfs/dbraw/zinc/23/48/75/409234875.db2.gz	COVNKIMKJCWNJM-LBPRGKRZSA-N	1	1	322.409	1.674	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CC=CCC1	ZINC000280365856	409300383	/nfs/dbraw/zinc/30/03/83/409300383.db2.gz	YKUNJKUMHLZLGQ-UHFFFAOYSA-N	1	1	303.362	1.906	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[N@H+](C[C@H](C)O)C[C@H]1C	ZINC000284269185	409307805	/nfs/dbraw/zinc/30/78/05/409307805.db2.gz	GUUBLVWFPPMXQL-KGLIPLIRSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280507070	409334043	/nfs/dbraw/zinc/33/40/43/409334043.db2.gz	NINIUUHUPPEYNQ-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@]2(CCOC2)O1	ZINC000280507070	409334048	/nfs/dbraw/zinc/33/40/48/409334048.db2.gz	NINIUUHUPPEYNQ-BBRMVZONSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]([N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C(C)(C)O	ZINC000295142834	409342970	/nfs/dbraw/zinc/34/29/70/409342970.db2.gz	LDWJYJVEMNUJLV-NSHDSACASA-N	1	1	321.377	1.575	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+](C2CC2)C1	ZINC000295255411	409399541	/nfs/dbraw/zinc/39/95/41/409399541.db2.gz	FNNBPGDCEZCLCJ-NSHDSACASA-N	1	1	318.377	1.733	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@](C)(F)C1	ZINC000295175248	409356639	/nfs/dbraw/zinc/35/66/39/409356639.db2.gz	GTZUTAXWDQSJNY-OAHLLOKOSA-N	1	1	324.356	1.434	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1NC	ZINC000317055390	164025504	/nfs/dbraw/zinc/02/55/04/164025504.db2.gz	HPAACSPRULOOBT-LLVKDONJSA-N	1	1	306.366	1.851	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000408056060	164211301	/nfs/dbraw/zinc/21/13/01/164211301.db2.gz	CIYUCHIIYSYRMJ-KGLIPLIRSA-N	1	1	323.324	1.279	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000356835183	409647066	/nfs/dbraw/zinc/64/70/66/409647066.db2.gz	CILRDVXOIWPNKM-GHMZBOCLSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000356835183	409647073	/nfs/dbraw/zinc/64/70/73/409647073.db2.gz	CILRDVXOIWPNKM-GHMZBOCLSA-N	1	1	309.370	1.077	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC000356979643	409763884	/nfs/dbraw/zinc/76/38/84/409763884.db2.gz	DMPQLUPTUSTFHT-QWHCGFSZSA-N	1	1	320.393	1.866	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)[C@H](C)[C@H]1C	ZINC000356979641	409764904	/nfs/dbraw/zinc/76/49/04/409764904.db2.gz	DMPQLUPTUSTFHT-CHWSQXEVSA-N	1	1	320.393	1.866	20	5		DDBDMO
CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(C)C1=O	ZINC000338332325	409916636	/nfs/dbraw/zinc/91/66/36/409916636.db2.gz	KEZCUWPAAFYHPL-CQSZACIVSA-N	1	1	319.361	1.607	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000354580873	409948426	/nfs/dbraw/zinc/94/84/26/409948426.db2.gz	DCVPVFAROQESSF-NEPJUHHUSA-N	1	1	319.361	1.960	20	5		DDBDMO
CCC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1CCOC	ZINC000346560370	410018411	/nfs/dbraw/zinc/01/84/11/410018411.db2.gz	BBGQMSJMAUJAKR-LBPRGKRZSA-N	1	1	324.381	1.496	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332593735	410185974	/nfs/dbraw/zinc/18/59/74/410185974.db2.gz	KDVLQYKCKWKIBC-GFCCVEGCSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@@H]1COCCN1CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332593735	410185980	/nfs/dbraw/zinc/18/59/80/410185980.db2.gz	KDVLQYKCKWKIBC-GFCCVEGCSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](CO)C1	ZINC000298626048	410318577	/nfs/dbraw/zinc/31/85/77/410318577.db2.gz	DGODCZSNIXGGQS-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@H](CO)C1	ZINC000298626048	410318583	/nfs/dbraw/zinc/31/85/83/410318583.db2.gz	DGODCZSNIXGGQS-NWDGAFQWSA-N	1	1	307.350	1.626	20	5		DDBDMO
Cn1c(C(=O)NCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-]	ZINC000347406526	410527858	/nfs/dbraw/zinc/52/78/58/410527858.db2.gz	JIVHYPKQILZKDV-UHFFFAOYSA-N	1	1	316.361	1.795	20	5		DDBDMO
COC1CC([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000352209575	410548275	/nfs/dbraw/zinc/54/82/75/410548275.db2.gz	CARKFRSAMJYRSB-OTTFEQOBSA-N	1	1	310.350	1.444	20	5		DDBDMO
CCCCNC(=O)C1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000355661441	410629370	/nfs/dbraw/zinc/62/93/70/410629370.db2.gz	PGDGEYPLUCKJCB-UHFFFAOYSA-N	1	1	323.397	1.457	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000343719440	410647193	/nfs/dbraw/zinc/64/71/93/410647193.db2.gz	CZLLPQJUQRXBKB-RDBSUJKOSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343719440	410647197	/nfs/dbraw/zinc/64/71/97/410647197.db2.gz	CZLLPQJUQRXBKB-RDBSUJKOSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343719440	410647202	/nfs/dbraw/zinc/64/72/02/410647202.db2.gz	CZLLPQJUQRXBKB-RDBSUJKOSA-N	1	1	323.393	1.359	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000337375109	410744913	/nfs/dbraw/zinc/74/49/13/410744913.db2.gz	ZVPPBUKJRAWFPF-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N[C@@H]1CCC[N@H+](C(C)C)C1	ZINC000347936530	410801264	/nfs/dbraw/zinc/80/12/64/410801264.db2.gz	CUWZULOLKDWPIQ-GFCCVEGCSA-N	1	1	309.370	1.089	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@H](O)C(F)(F)F)n1	ZINC000340205519	410750206	/nfs/dbraw/zinc/75/02/06/410750206.db2.gz	YLPRUAYYCKUGKA-KOLCDFICSA-N	1	1	322.287	1.569	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCCC[C@@H]1C	ZINC000356149519	410864008	/nfs/dbraw/zinc/86/40/08/410864008.db2.gz	HCCQAEIFKJKYQX-QWRGUYRKSA-N	1	1	309.370	1.321	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](C)C1	ZINC000356284387	410943724	/nfs/dbraw/zinc/94/37/24/410943724.db2.gz	PBYBKJYFDVZRCO-NWDGAFQWSA-N	1	1	308.382	1.736	20	5		DDBDMO
C[C@H](O)CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1	ZINC000353520550	411045631	/nfs/dbraw/zinc/04/56/31/411045631.db2.gz	PMLJMNZEVFRHLV-SMDDNHRTSA-N	1	1	304.350	1.778	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1(C)C	ZINC000580210928	422903667	/nfs/dbraw/zinc/90/36/67/422903667.db2.gz	IMNOFRLFMOZLPF-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1(C)C	ZINC000580210928	422903668	/nfs/dbraw/zinc/90/36/68/422903668.db2.gz	IMNOFRLFMOZLPF-UHFFFAOYSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC(C)C[C@H]([NH3+])c1noc(Cn2ccc(=O)c([N+](=O)[O-])c2)n1	ZINC000580311096	422914962	/nfs/dbraw/zinc/91/49/62/422914962.db2.gz	WGHXKINEJMPINA-VIFPVBQESA-N	1	1	307.310	1.234	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC3(CC[NH2+]3)CC2)c1[N+](=O)[O-]	ZINC000580773525	422952824	/nfs/dbraw/zinc/95/28/24/422952824.db2.gz	OILYNJQBZSLPET-UHFFFAOYSA-N	1	1	307.354	1.239	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373929380	418474083	/nfs/dbraw/zinc/47/40/83/418474083.db2.gz	OJIZHBWNPJVSBB-JSGCOSHPSA-N	1	1	319.361	1.717	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@H]1c1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000361027803	418568902	/nfs/dbraw/zinc/56/89/02/418568902.db2.gz	ZUFJEMGAWFFTDD-WCBMZHEXSA-N	1	1	303.322	1.892	20	5		DDBDMO
C[C@@H]1c2ccccc2C[N@@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000361044806	418572707	/nfs/dbraw/zinc/57/27/07/418572707.db2.gz	JPOHSSPNVXSZEB-RISCZKNCSA-N	1	1	302.334	1.729	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000360954385	418553195	/nfs/dbraw/zinc/55/31/95/418553195.db2.gz	MMZGEIXVVCUSKK-MNOVXSKESA-N	1	1	318.377	1.992	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000360997251	418562299	/nfs/dbraw/zinc/56/22/99/418562299.db2.gz	FUHRKIWPZCWMME-CABCVRRESA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000189309483	222042327	/nfs/dbraw/zinc/04/23/27/222042327.db2.gz	PAIVTQZEVCATCD-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000189309483	222042330	/nfs/dbraw/zinc/04/23/30/222042330.db2.gz	PAIVTQZEVCATCD-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[C@@H](Nc1nccc(C(N)=O)c1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000291035609	222089061	/nfs/dbraw/zinc/08/90/61/222089061.db2.gz	ZHDAHUICKLLSCK-SECBINFHSA-N	1	1	305.338	1.151	20	5		DDBDMO
C[C@@H]1CCOCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000374992226	418585219	/nfs/dbraw/zinc/58/52/19/418585219.db2.gz	WLEHDDKDNVWDMB-TZMCWYRMSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@@H]1c1cc[nH]n1	ZINC000367559642	418610431	/nfs/dbraw/zinc/61/04/31/418610431.db2.gz	OCFRMXDERPVTSW-CYBMUJFWSA-N	1	1	303.322	1.317	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1cc[nH]n1	ZINC000367559642	418610435	/nfs/dbraw/zinc/61/04/35/418610435.db2.gz	OCFRMXDERPVTSW-CYBMUJFWSA-N	1	1	303.322	1.317	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000367840266	418644842	/nfs/dbraw/zinc/64/48/42/418644842.db2.gz	PVIMJAQEIRQQGS-ITGUQSILSA-N	1	1	319.361	1.402	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1	ZINC000358056815	418653237	/nfs/dbraw/zinc/65/32/37/418653237.db2.gz	BQPBHOINOVFAMS-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
COc1cc(C[N@@H+](CCO)[C@H]2CCO[C@H]2C)ccc1[N+](=O)[O-]	ZINC000361585427	418685507	/nfs/dbraw/zinc/68/55/07/418685507.db2.gz	IIPOHVDRKVSNAG-AAEUAGOBSA-N	1	1	310.350	1.575	20	5		DDBDMO
Cn1ccnc1[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000365651416	418888741	/nfs/dbraw/zinc/88/87/41/418888741.db2.gz	VYDNMSQSNIDZPW-GFCCVEGCSA-N	1	1	304.354	1.404	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000365668953	418892579	/nfs/dbraw/zinc/89/25/79/418892579.db2.gz	FRJSIHHGNJGEEN-CHWSQXEVSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N[C@H]3CC[N@H+]4CCC[C@H]4C3)nn21	ZINC000372703426	418893745	/nfs/dbraw/zinc/89/37/45/418893745.db2.gz	IDOIEHMCTDHWSJ-QWRGUYRKSA-N	1	1	302.338	1.676	20	5		DDBDMO
Cc1ccnc(N[C@H]2CC[N@@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000372957581	418916581	/nfs/dbraw/zinc/91/65/81/418916581.db2.gz	ZUEOVVYAFGBGQL-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1ccnc(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000372957581	418916583	/nfs/dbraw/zinc/91/65/83/418916583.db2.gz	ZUEOVVYAFGBGQL-ZDUSSCGKSA-N	1	1	319.409	1.879	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000420948117	419377862	/nfs/dbraw/zinc/37/78/62/419377862.db2.gz	VJWNIIKPZQWSPE-IPYPFGDCSA-N	1	1	324.377	1.285	20	5		DDBDMO
CN(Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@H]1CCC[N@H+]1C	ZINC000420991712	419430173	/nfs/dbraw/zinc/43/01/73/419430173.db2.gz	ALMKDELMWJXZSQ-GFCCVEGCSA-N	1	1	303.366	1.997	20	5		DDBDMO
C[C@H](NC(=O)N1CC[NH2+]C[C@@](C)(F)C1)c1ccc([N+](=O)[O-])cc1	ZINC000418228603	419631833	/nfs/dbraw/zinc/63/18/33/419631833.db2.gz	FAZSUIHYJXBKST-XHDPSFHLSA-N	1	1	324.356	1.999	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000412050900	419593790	/nfs/dbraw/zinc/59/37/90/419593790.db2.gz	ZZRYPORAAGHOSH-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000412050900	419593795	/nfs/dbraw/zinc/59/37/95/419593795.db2.gz	ZZRYPORAAGHOSH-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1cc(OCC(=O)N(C)C[C@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000421711529	419698502	/nfs/dbraw/zinc/69/85/02/419698502.db2.gz	OOGHTXGXFTZLEY-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@H]([NH3+])C1CC1	ZINC000414885052	419858862	/nfs/dbraw/zinc/85/88/62/419858862.db2.gz	FZHOVYGFGKOITK-YGRLFVJLSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H](N)C1CC1	ZINC000414885052	419858867	/nfs/dbraw/zinc/85/88/67/419858867.db2.gz	FZHOVYGFGKOITK-YGRLFVJLSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H]1CC[C@@H]([N@@H+](CCO)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000429794230	420049392	/nfs/dbraw/zinc/04/93/92/420049392.db2.gz	WTQKGLWUFBGJIV-BXUZGUMPSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[NH2+]C[C@H]1CCCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000430641445	420167645	/nfs/dbraw/zinc/16/76/45/420167645.db2.gz	TVZAUVRXCKMVEW-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000416301901	420318392	/nfs/dbraw/zinc/31/83/92/420318392.db2.gz	VWAAVNSGLKYPQA-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000416301901	420318397	/nfs/dbraw/zinc/31/83/97/420318397.db2.gz	VWAAVNSGLKYPQA-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H]1CC[N@H+](C)C1	ZINC000416498111	420395311	/nfs/dbraw/zinc/39/53/11/420395311.db2.gz	WLEZEPWPBOQXRX-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000457025253	420591733	/nfs/dbraw/zinc/59/17/33/420591733.db2.gz	OKNJMQKQTVJGIY-LLVKDONJSA-N	1	1	301.306	1.105	20	5		DDBDMO
CC(C)(C[NH+]1CCCC1)NC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000457053948	420598981	/nfs/dbraw/zinc/59/89/81/420598981.db2.gz	PPRXAOZXEWRCLV-UHFFFAOYSA-N	1	1	307.350	1.905	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C[C@@H]21	ZINC000453026065	420704500	/nfs/dbraw/zinc/70/45/00/420704500.db2.gz	FJMMGNAWSFQIOB-PELKAZGASA-N	1	1	308.313	1.092	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H](C[NH3+])C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000442762637	420709941	/nfs/dbraw/zinc/70/99/41/420709941.db2.gz	CHMFMQNCAHBPMN-NWDGAFQWSA-N	1	1	309.366	1.651	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000454352939	420845363	/nfs/dbraw/zinc/84/53/63/420845363.db2.gz	HVMWGTVISQUOGT-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000454352939	420845368	/nfs/dbraw/zinc/84/53/68/420845368.db2.gz	HVMWGTVISQUOGT-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
Cc1nc(CC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000447604757	420785485	/nfs/dbraw/zinc/78/54/85/420785485.db2.gz	CTRCRBOHDFFANU-RYUDHWBXSA-N	1	1	319.369	1.534	20	5		DDBDMO
Cc1nnc(CC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)[nH]1	ZINC000447604757	420785486	/nfs/dbraw/zinc/78/54/86/420785486.db2.gz	CTRCRBOHDFFANU-RYUDHWBXSA-N	1	1	319.369	1.534	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000455183207	420978961	/nfs/dbraw/zinc/97/89/61/420978961.db2.gz	PAMTXLWHZCCQHK-LLVKDONJSA-N	1	1	321.381	1.493	20	5		DDBDMO
CC(C)[C@H]1CN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000487048854	420999705	/nfs/dbraw/zinc/99/97/05/420999705.db2.gz	QYMHPALAQVKSDE-CQSZACIVSA-N	1	1	306.366	1.470	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000456167615	421111715	/nfs/dbraw/zinc/11/17/15/421111715.db2.gz	NHDIOSKPWYIHHD-WCQYABFASA-N	1	1	319.361	1.770	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000456375104	421153803	/nfs/dbraw/zinc/15/38/03/421153803.db2.gz	JSICMMKFDVJTLI-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000456375104	421153807	/nfs/dbraw/zinc/15/38/07/421153807.db2.gz	JSICMMKFDVJTLI-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(c3ncc([N+](=O)[O-])c(C)n3)CC2)c1	ZINC000450392138	421192066	/nfs/dbraw/zinc/19/20/66/421192066.db2.gz	NWWWIQQLIYCMFC-UHFFFAOYSA-N	1	1	314.349	1.723	20	5		DDBDMO
C[C@@H](O)CC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000450574385	421211403	/nfs/dbraw/zinc/21/14/03/421211403.db2.gz	ZUAGWTORMXWLOG-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C)C(C)(C)C1	ZINC000550657230	421521703	/nfs/dbraw/zinc/52/17/03/421521703.db2.gz	NUPLIUBDDAHHOH-GFCCVEGCSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000516382878	421542462	/nfs/dbraw/zinc/54/24/62/421542462.db2.gz	MXEAFSRGTQFWER-LBPRGKRZSA-N	1	1	308.382	1.928	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1ccnc1-c1ccc([N+](=O)[O-])cc1	ZINC000570292981	421636044	/nfs/dbraw/zinc/63/60/44/421636044.db2.gz	GZPGWFYIPMQSNN-AWEZNQCLSA-N	1	1	304.350	1.771	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000518313423	421646999	/nfs/dbraw/zinc/64/69/99/421646999.db2.gz	AVAQGOUMYAXZHL-ZDUSSCGKSA-N	1	1	322.365	1.367	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000520366852	421747277	/nfs/dbraw/zinc/74/72/77/421747277.db2.gz	IUZCQOXOYSTCJD-RYUDHWBXSA-N	1	1	308.382	1.784	20	5		DDBDMO
COC(=O)CCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000522537968	421824548	/nfs/dbraw/zinc/82/45/48/421824548.db2.gz	PBGLBPCQIQHLMW-UHFFFAOYSA-N	1	1	308.338	1.065	20	5		DDBDMO
NC(=O)c1cccc(N2CC[N@H+]3CCCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000341739955	271194551	/nfs/dbraw/zinc/19/45/51/271194551.db2.gz	BWQPDMXJZYATOW-NSHDSACASA-N	1	1	304.350	1.368	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343451718	271776856	/nfs/dbraw/zinc/77/68/56/271776856.db2.gz	OLEBVOQRUXOEFW-CHWSQXEVSA-N	1	1	321.377	1.963	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964282	272377095	/nfs/dbraw/zinc/37/70/95/272377095.db2.gz	QGPUQGUHNXXJDB-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964282	272377097	/nfs/dbraw/zinc/37/70/97/272377097.db2.gz	QGPUQGUHNXXJDB-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964282	272377100	/nfs/dbraw/zinc/37/71/00/272377100.db2.gz	QGPUQGUHNXXJDB-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000345964282	272377102	/nfs/dbraw/zinc/37/71/02/272377102.db2.gz	QGPUQGUHNXXJDB-WDEREUQCSA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C[C@@H](C)C1	ZINC000346244108	272440986	/nfs/dbraw/zinc/44/09/86/272440986.db2.gz	UNJPEFOYRLLDEA-SDDRHHMPSA-N	1	1	321.381	1.131	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)nc1	ZINC000274025806	275041224	/nfs/dbraw/zinc/04/12/24/275041224.db2.gz	WMZDQTWLXRGZIE-BXUZGUMPSA-N	1	1	303.366	1.838	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269549189	276040378	/nfs/dbraw/zinc/04/03/78/276040378.db2.gz	XJARPNMCFVNIPB-MNOVXSKESA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269549189	276040379	/nfs/dbraw/zinc/04/03/79/276040379.db2.gz	XJARPNMCFVNIPB-MNOVXSKESA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269549189	276040383	/nfs/dbraw/zinc/04/03/83/276040383.db2.gz	XJARPNMCFVNIPB-MNOVXSKESA-N	1	1	323.397	1.854	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3ncc(Cl)cc3[N+](=O)[O-])C[C@H]21	ZINC000285012787	277121760	/nfs/dbraw/zinc/12/17/60/277121760.db2.gz	MKUFLZVNNGCLAT-VXGBXAGGSA-N	1	1	312.757	1.553	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N2CC([NH+](C)C)C2)c1C	ZINC000272063949	278745080	/nfs/dbraw/zinc/74/50/80/278745080.db2.gz	DCQXXJVVJKRTEA-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000279763104	279316836	/nfs/dbraw/zinc/31/68/36/279316836.db2.gz	RSTWUHWVSBAOHP-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000107891504	279395266	/nfs/dbraw/zinc/39/52/66/279395266.db2.gz	ZXMACUPJXSDIOK-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000285678573	290267559	/nfs/dbraw/zinc/26/75/59/290267559.db2.gz	HNJACADYCCCHNG-QKCSRTOESA-N	1	1	304.350	1.754	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2[C@@H](C1)NC(=O)N2C	ZINC000285678573	290267562	/nfs/dbraw/zinc/26/75/62/290267562.db2.gz	HNJACADYCCCHNG-QKCSRTOESA-N	1	1	304.350	1.754	20	5		DDBDMO
C[C@@H]1C[C@@H](C)[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000354205238	298362930	/nfs/dbraw/zinc/36/29/30/298362930.db2.gz	QVVHZJYVJUNCGR-NXEZZACHSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[C@@H]1C[C@@H](C)[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000354205238	298362934	/nfs/dbraw/zinc/36/29/34/298362934.db2.gz	QVVHZJYVJUNCGR-NXEZZACHSA-N	1	1	321.333	1.992	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CC[C@@H](C)C1	ZINC000362153848	300017816	/nfs/dbraw/zinc/01/78/16/300017816.db2.gz	GIWMKFKJKPWSKO-ZIAGYGMSSA-N	1	1	323.393	1.894	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c([N+](=O)[O-])cc1F	ZINC000362193323	300025969	/nfs/dbraw/zinc/02/59/69/300025969.db2.gz	YOVXSKKYDKNBIL-PXWWUCIGSA-N	1	1	310.325	1.945	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000362905826	300175301	/nfs/dbraw/zinc/17/53/01/300175301.db2.gz	JRZIVCSYBGNOEG-CQSZACIVSA-N	1	1	319.361	1.670	20	5		DDBDMO
NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000368964175	301111335	/nfs/dbraw/zinc/11/13/35/301111335.db2.gz	NDCQJJJAVVZLIA-JMSVASOKSA-N	1	1	319.361	1.559	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1C[C@@H]2C[N@H+]3CCCC[C@@H]3[C@@H]2C1	ZINC000370044618	301264465	/nfs/dbraw/zinc/26/44/65/301264465.db2.gz	FQRNQKQOVVRJCI-JHJVBQTASA-N	1	1	305.382	1.244	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@](O)(C2CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000370081695	301272483	/nfs/dbraw/zinc/27/24/83/301272483.db2.gz	KAANNVZMXXCATI-INIZCTEOSA-N	1	1	319.361	1.770	20	5		DDBDMO
CC1(C)CN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)O1	ZINC000496747726	302619850	/nfs/dbraw/zinc/61/98/50/302619850.db2.gz	GIBNGDZHXILFKS-UHFFFAOYSA-N	1	1	323.353	1.617	20	5		DDBDMO
CCOC(=O)CCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000524000225	302902453	/nfs/dbraw/zinc/90/24/53/302902453.db2.gz	SUUTWQCRDBVVKH-UHFFFAOYSA-N	1	1	322.365	1.455	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H](C[N@@H+](C)CC2CC2)C1	ZINC000530819580	303214062	/nfs/dbraw/zinc/21/40/62/303214062.db2.gz	WOBPIFUDQADKAG-CYBMUJFWSA-N	1	1	320.393	1.737	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CCC[N@H+]2C)C1	ZINC000531726633	303253316	/nfs/dbraw/zinc/25/33/16/303253316.db2.gz	QXIZQSMBMSFAAQ-YPMHNXCESA-N	1	1	306.366	1.490	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)c1ccco1	ZINC000531887978	303264032	/nfs/dbraw/zinc/26/40/32/303264032.db2.gz	PSWVLFGVKFEDDW-LBPRGKRZSA-N	1	1	304.306	1.616	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21	ZINC000535043459	303341869	/nfs/dbraw/zinc/34/18/69/303341869.db2.gz	YIWLGLPOPPXZOG-GFCCVEGCSA-N	1	1	315.333	1.245	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21	ZINC000535043459	303341870	/nfs/dbraw/zinc/34/18/70/303341870.db2.gz	YIWLGLPOPPXZOG-GFCCVEGCSA-N	1	1	315.333	1.245	20	5		DDBDMO
O=C1OCC[C@@H]1CC[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369004145	307114250	/nfs/dbraw/zinc/11/42/50/307114250.db2.gz	YNPZAOVNUMJLEU-RYUDHWBXSA-N	1	1	308.338	1.381	20	5		DDBDMO
COC(=O)[C@]12CCC[C@@H]1C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000374695378	307211786	/nfs/dbraw/zinc/21/17/86/307211786.db2.gz	FNIMJXROSTXSGG-RISCZKNCSA-N	1	1	308.338	1.066	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]3CC[N@H+](C)[C@@H]3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000376663592	307252379	/nfs/dbraw/zinc/25/23/79/307252379.db2.gz	LJGVZJBHDXMSEJ-CMPLNLGQSA-N	1	1	320.349	1.170	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488375	307289280	/nfs/dbraw/zinc/28/92/80/307289280.db2.gz	AUPCEZWOSJWTOI-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000378488375	307289281	/nfs/dbraw/zinc/28/92/81/307289281.db2.gz	AUPCEZWOSJWTOI-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488375	307289282	/nfs/dbraw/zinc/28/92/82/307289282.db2.gz	AUPCEZWOSJWTOI-LCGIIJARSA-N	1	1	317.389	1.678	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2CC[N@H+](C)C[C@H]21	ZINC000378490001	307289533	/nfs/dbraw/zinc/28/95/33/307289533.db2.gz	CEJKPQKVTXHWNH-SMDDNHRTSA-N	1	1	304.350	1.464	20	5		DDBDMO
Cn1cc([C@@H](CO)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cn1	ZINC000518397986	307442053	/nfs/dbraw/zinc/44/20/53/307442053.db2.gz	SLWUCSNKDYYQIM-UONOGXRCSA-N	1	1	302.334	1.639	20	5		DDBDMO
COc1cc(CN2CCN(c3[nH]cc[nH+]3)CC2)ccc1[N+](=O)[O-]	ZINC000564666073	308002635	/nfs/dbraw/zinc/00/26/35/308002635.db2.gz	MDPOLYZDKWLXMZ-UHFFFAOYSA-N	1	1	317.349	1.649	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)n1	ZINC000576686347	308331894	/nfs/dbraw/zinc/33/18/94/308331894.db2.gz	KZOPGTSBJZXLKC-KOLCDFICSA-N	1	1	307.354	1.024	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CCC[N@H+](CCO)CC1)CCCC2	ZINC000576866468	308345257	/nfs/dbraw/zinc/34/52/57/308345257.db2.gz	AHVMFWSVDYZIBV-UHFFFAOYSA-N	1	1	320.393	1.373	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNc2c([N+](=O)[O-])ncn2C)C[C@H](C)O1	ZINC000443951542	534463189	/nfs/dbraw/zinc/46/31/89/534463189.db2.gz	KETYGTSUHUEGKC-TXEJJXNPSA-N	1	1	311.386	1.630	20	5		DDBDMO
CN(c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000736859243	599120073	/nfs/dbraw/zinc/12/00/73/599120073.db2.gz	XVELZNCXMDJXKQ-NSHDSACASA-N	1	1	317.353	1.305	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000824860824	608196997	/nfs/dbraw/zinc/19/69/97/608196997.db2.gz	YAPUCZCGSRQXSM-NXEZZACHSA-N	1	1	317.353	1.304	20	5		DDBDMO
CN([C@@H]1CCC[N@H+](C)C1)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119852970	696686795	/nfs/dbraw/zinc/68/67/95/696686795.db2.gz	CQMMIGWDIMHIJL-SECBINFHSA-N	1	1	319.408	1.371	20	5		DDBDMO
CN([C@@H]1CCC[N@@H+](C)C1)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000119852970	696686797	/nfs/dbraw/zinc/68/67/97/696686797.db2.gz	CQMMIGWDIMHIJL-SECBINFHSA-N	1	1	319.408	1.371	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985430771	697510193	/nfs/dbraw/zinc/51/01/93/697510193.db2.gz	JMLIINFTJNQVEF-HZPDHXFCSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[N@H+](Cc1ccccc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985430771	697510194	/nfs/dbraw/zinc/51/01/94/697510194.db2.gz	JMLIINFTJNQVEF-HZPDHXFCSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985430771	697510195	/nfs/dbraw/zinc/51/01/95/697510195.db2.gz	JMLIINFTJNQVEF-HZPDHXFCSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1nn(C[N@H+]2CCOCC[C@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000774650752	697907344	/nfs/dbraw/zinc/90/73/44/697907344.db2.gz	RQFIMQUUVBCDFL-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCOCC[C@H]2C)c2ncc([N+](=O)[O-])cc12	ZINC000774650752	697907346	/nfs/dbraw/zinc/90/73/46/697907346.db2.gz	RQFIMQUUVBCDFL-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278230	698091408	/nfs/dbraw/zinc/09/14/08/698091408.db2.gz	SMJWRJHCEFZQDU-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278230	698091412	/nfs/dbraw/zinc/09/14/12/698091412.db2.gz	SMJWRJHCEFZQDU-BBRMVZONSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=C1CC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CCN1	ZINC000777957845	698233465	/nfs/dbraw/zinc/23/34/65/698233465.db2.gz	XOEANXZNTVRTIE-UHFFFAOYSA-N	1	1	315.333	1.238	20	5		DDBDMO
O=C1CC[N@@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CCN1	ZINC000777957845	698233468	/nfs/dbraw/zinc/23/34/68/698233468.db2.gz	XOEANXZNTVRTIE-UHFFFAOYSA-N	1	1	315.333	1.238	20	5		DDBDMO
CC1(C)CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1CCO	ZINC000781960992	698666212	/nfs/dbraw/zinc/66/62/12/698666212.db2.gz	PKLFSXRWKGWKOU-OAHLLOKOSA-N	1	1	323.393	1.017	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1cc([N+](=O)[O-])ccc1F	ZINC000750884072	700254595	/nfs/dbraw/zinc/25/45/95/700254595.db2.gz	UVPTUEMQWJTTLD-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
CC[N@H+](CCO)CCNCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000783676537	698867322	/nfs/dbraw/zinc/86/73/22/698867322.db2.gz	MMNWYALGBGNURJ-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
CC[N@@H+](CCO)CCNCc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000783676537	698867329	/nfs/dbraw/zinc/86/73/29/698867329.db2.gz	MMNWYALGBGNURJ-UHFFFAOYSA-N	1	1	301.774	1.652	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1C	ZINC000787326590	699206074	/nfs/dbraw/zinc/20/60/74/699206074.db2.gz	IMCGWWXDCBCSOX-HONMWMINSA-N	1	1	308.334	1.512	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000789773060	699407560	/nfs/dbraw/zinc/40/75/60/699407560.db2.gz	OFDHXLDMPNYZQZ-HNNXBMFYSA-N	1	1	322.361	1.790	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])[C@H](CO)c1cccc(Br)c1	ZINC000791053799	699609001	/nfs/dbraw/zinc/60/90/01/699609001.db2.gz	HGOTYGRQKUDKOW-LLVKDONJSA-N	1	1	303.156	1.691	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])[C@H](CO)c1cccc(Br)c1	ZINC000791053799	699609002	/nfs/dbraw/zinc/60/90/02/699609002.db2.gz	HGOTYGRQKUDKOW-LLVKDONJSA-N	1	1	303.156	1.691	20	5		DDBDMO
Nc1ccc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-]	ZINC000791258858	699618078	/nfs/dbraw/zinc/61/80/78/699618078.db2.gz	LQPJBDUBCAIAIB-YPMHNXCESA-N	1	1	322.340	1.435	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@@H]2C1	ZINC000793928520	699787302	/nfs/dbraw/zinc/78/73/02/699787302.db2.gz	IXUPORXTHOGQON-ZJUUUORDSA-N	1	1	322.340	1.340	20	5		DDBDMO
COc1c(C(=O)NCC[N@H+]2CCC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000795270998	699855057	/nfs/dbraw/zinc/85/50/57/699855057.db2.gz	PNFDDHCXADJCES-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000795675620	699883302	/nfs/dbraw/zinc/88/33/02/699883302.db2.gz	SBAOJWIVBCGDMP-OKILXGFUSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1	ZINC000795675620	699883305	/nfs/dbraw/zinc/88/33/05/699883305.db2.gz	SBAOJWIVBCGDMP-OKILXGFUSA-N	1	1	317.349	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](OC(F)F)C2)cc1	ZINC000801991312	700362537	/nfs/dbraw/zinc/36/25/37/700362537.db2.gz	MKCVARHXJWWXSL-RYUDHWBXSA-N	1	1	302.277	1.942	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCC[N@H+]1CCC[C@@H]1C	ZINC000756519255	700625186	/nfs/dbraw/zinc/62/51/86/700625186.db2.gz	HVNLLUPRCPSXLW-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000763113693	700926227	/nfs/dbraw/zinc/92/62/27/700926227.db2.gz	FFVYQBHEGSHCOP-UHFFFAOYSA-N	1	1	304.306	1.929	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])CCOC1	ZINC000767028536	701078866	/nfs/dbraw/zinc/07/88/66/701078866.db2.gz	BXKNVMPHQKGIJS-AWEZNQCLSA-N	1	1	312.297	1.546	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000840093264	701965471	/nfs/dbraw/zinc/96/54/71/701965471.db2.gz	IZTDFTPIHRKOCW-NSHDSACASA-N	1	1	320.349	1.486	20	5		DDBDMO
COc1cc(Cc2noc(C[NH2+]C3CC3)n2)ccc1[N+](=O)[O-]	ZINC000843191948	702838394	/nfs/dbraw/zinc/83/83/94/702838394.db2.gz	OZGJNPISWSOIDW-UHFFFAOYSA-N	1	1	304.306	1.829	20	5		DDBDMO
CN(CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC([NH3+])C1	ZINC000843387545	702871693	/nfs/dbraw/zinc/87/16/93/702871693.db2.gz	LONSILGMJICNSV-UHFFFAOYSA-N	1	1	310.329	1.484	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1C[C@H]2[C@@H](C1)C2(F)F	ZINC000844459227	703034318	/nfs/dbraw/zinc/03/43/18/703034318.db2.gz	QVQLWFUHUVBVCS-GARJFASQSA-N	1	1	314.288	1.531	20	5		DDBDMO
C[C@@H]1[C@H](COC(=O)COc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000845814040	703205449	/nfs/dbraw/zinc/20/54/49/703205449.db2.gz	JPQQQIAVWZFJDJ-NEPJUHHUSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000820272083	704250590	/nfs/dbraw/zinc/25/05/90/704250590.db2.gz	JGIOFBOYOXQOLY-HNKHHVNMSA-N	1	1	315.373	1.861	20	5		DDBDMO
CON(C)C(=O)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000858322794	704694744	/nfs/dbraw/zinc/69/47/44/704694744.db2.gz	JQXIINJQGOIPJP-MRVPVSSYSA-N	1	1	301.730	1.746	20	5		DDBDMO
Cc1nn(C[N@H+](C)[C@H]2C[C@@H](C(N)=O)C2)c2cc([N+](=O)[O-])ccc12	ZINC000863322991	705901586	/nfs/dbraw/zinc/90/15/86/705901586.db2.gz	XOQGAPUDXCKDFJ-KLPPZKSPSA-N	1	1	317.349	1.406	20	5		DDBDMO
CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1C(=O)NCC[NH+]1CCC1	ZINC000827573385	706029107	/nfs/dbraw/zinc/02/91/07/706029107.db2.gz	JWARYXDCCNAYRA-UHFFFAOYSA-N	1	1	324.312	1.128	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000828987425	706269205	/nfs/dbraw/zinc/26/92/05/706269205.db2.gz	CRJMZNDUCJHDBH-IINYFYTJSA-N	1	1	304.350	1.095	20	5		DDBDMO
C[C@H](NCC(=O)NC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000878356469	706368556	/nfs/dbraw/zinc/36/85/56/706368556.db2.gz	VLRJETXXMLVHAX-LBPRGKRZSA-N	1	1	320.393	1.456	20	5		DDBDMO
Cn1ncc(CCCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)n1	ZINC000865832957	706538987	/nfs/dbraw/zinc/53/89/87/706538987.db2.gz	TZEWOVLIUWUNAR-UHFFFAOYSA-N	1	1	312.333	1.738	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000880138962	706888350	/nfs/dbraw/zinc/88/83/50/706888350.db2.gz	JGQOKTFDKRDWDK-OCCSQVGLSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H](NC[C@@H]1CCC[N@@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851560	707138730	/nfs/dbraw/zinc/13/87/30/707138730.db2.gz	ZNSKQJCHWGVXDI-OCCSQVGLSA-N	1	1	322.409	1.674	20	5		DDBDMO
C[C@@H](NC[C@@H]1CCC[N@H+]1CCCO)c1ccc(N)c([N+](=O)[O-])c1	ZINC000834851560	707138731	/nfs/dbraw/zinc/13/87/31/707138731.db2.gz	ZNSKQJCHWGVXDI-OCCSQVGLSA-N	1	1	322.409	1.674	20	5		DDBDMO
CC[NH+](CC)Cc1cn(C[C@H](O)c2ccc([N+](=O)[O-])cc2)nn1	ZINC000881399372	707235670	/nfs/dbraw/zinc/23/56/70/707235670.db2.gz	XNCCVRIBAOCALP-HNNXBMFYSA-N	1	1	319.365	1.762	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](O)c1ccnn1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000927127089	712945056	/nfs/dbraw/zinc/94/50/56/712945056.db2.gz	QWQSNJOQHJYYDB-NOZJJQNGSA-N	1	1	308.313	1.852	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccnc(F)c3[N+](=O)[O-])CC2)C1	ZINC000881985494	707455036	/nfs/dbraw/zinc/45/50/36/707455036.db2.gz	NRVAJDSPWWLDDP-GFCCVEGCSA-N	1	1	323.372	1.345	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N1C[C@@H]2CCC[N@@H+]2C[C@@H]1CO	ZINC000872757400	707586761	/nfs/dbraw/zinc/58/67/61/707586761.db2.gz	BCNCIRJOIGEMCE-WDEREUQCSA-N	1	1	312.757	1.289	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2c1ccc([N+](=O)[O-])c2nonc21	ZINC000872780113	707596708	/nfs/dbraw/zinc/59/67/08/707596708.db2.gz	JPCLUSJEILYYIA-UWVGGRQHSA-N	1	1	303.322	1.804	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])c(OC)c1	ZINC000882484462	707655319	/nfs/dbraw/zinc/65/53/19/707655319.db2.gz	DCSSWWHBBJYKOF-NSHDSACASA-N	1	1	323.349	1.193	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ncnc4ccc([N+](=O)[O-])cc43)C[C@]2(C)C1	ZINC000896914509	708181636	/nfs/dbraw/zinc/18/16/36/708181636.db2.gz	JHXFCMACJIBNBU-BZNIZROVSA-N	1	1	313.361	1.926	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ncc(Br)cc1[N+](=O)[O-]	ZINC000884824770	708388279	/nfs/dbraw/zinc/38/82/79/708388279.db2.gz	MZPMTSMUDGRHEK-UHFFFAOYSA-N	1	1	319.159	1.088	20	5		DDBDMO
CN1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000897854964	708470636	/nfs/dbraw/zinc/47/06/36/708470636.db2.gz	QGYPUWYMLCGSMU-FNORWQNLSA-N	1	1	318.421	1.787	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+](CCF)C1	ZINC000898494038	708657240	/nfs/dbraw/zinc/65/72/40/708657240.db2.gz	DICHUNDBUQJFSY-ZDUSSCGKSA-N	1	1	309.341	1.687	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@@H+](CCF)C1	ZINC000898494038	708657241	/nfs/dbraw/zinc/65/72/41/708657241.db2.gz	DICHUNDBUQJFSY-ZDUSSCGKSA-N	1	1	309.341	1.687	20	5		DDBDMO
C[C@](O)(C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)C(F)F	ZINC000885949103	708669216	/nfs/dbraw/zinc/66/92/16/708669216.db2.gz	OIIMENURJOJQNY-AWEZNQCLSA-N	1	1	315.320	1.733	20	5		DDBDMO
COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1cccnc1[N+](=O)[O-])CC2	ZINC000886315210	708741198	/nfs/dbraw/zinc/74/11/98/708741198.db2.gz	AUXGOXGKUVOUAQ-DOMZBBRYSA-N	1	1	305.334	1.907	20	5		DDBDMO
C[C@H](CNC(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000887399070	709036587	/nfs/dbraw/zinc/03/65/87/709036587.db2.gz	MBGMKGZHPLNGQO-XHBSWPGZSA-N	1	1	321.377	1.270	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCC3)C2)c1[N+](=O)[O-]	ZINC000912916750	713123194	/nfs/dbraw/zinc/12/31/94/713123194.db2.gz	RLZFVEFAVHALHZ-SNVBAGLBSA-N	1	1	307.354	1.191	20	5		DDBDMO
CCOCC[NH+]1CCN(c2ncc([N+](=O)[O-])cc2OC)CC1	ZINC000892355992	710423280	/nfs/dbraw/zinc/42/32/80/710423280.db2.gz	ZBKVYCQSRLOIRD-UHFFFAOYSA-N	1	1	310.354	1.157	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC000893936009	710892099	/nfs/dbraw/zinc/89/20/99/710892099.db2.gz	TYNZPZWGTDGQJQ-SFYZADRCSA-N	1	1	319.287	1.487	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCC[N@@H+]2CCC3(C2)OCCO3)c1	ZINC000895253708	711467441	/nfs/dbraw/zinc/46/74/41/711467441.db2.gz	KGUBSTGDJKFDTP-UHFFFAOYSA-N	1	1	307.350	1.764	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCC[N@H+]2CCC3(C2)OCCO3)c1	ZINC000895253708	711467443	/nfs/dbraw/zinc/46/74/43/711467443.db2.gz	KGUBSTGDJKFDTP-UHFFFAOYSA-N	1	1	307.350	1.764	20	5		DDBDMO
C[C@H]1[C@@H](Nc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C	ZINC000895735269	711590452	/nfs/dbraw/zinc/59/04/52/711590452.db2.gz	CBRDJOPBCDHFMI-BQBZGAKWSA-N	1	1	307.276	1.852	20	5		DDBDMO
C[C@H]1[C@@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC[N@H+]1C	ZINC000895735149	711590496	/nfs/dbraw/zinc/59/04/96/711590496.db2.gz	VFKUYKZQOAFIRI-HZMBPMFUSA-N	1	1	318.377	1.992	20	5		DDBDMO
CN(C)c1cc[nH+]c(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000905526212	712065419	/nfs/dbraw/zinc/06/54/19/712065419.db2.gz	UQWYWQSHSRCKLT-MRXNPFEDSA-N	1	1	316.361	1.879	20	5		DDBDMO
O=C(Nc1ccc(Cl)cn1)C1CC[NH+](CC[N+](=O)[O-])CC1	ZINC000929887997	713713376	/nfs/dbraw/zinc/71/33/76/713713376.db2.gz	OENUWXJPZGEMNM-UHFFFAOYSA-N	1	1	312.757	1.662	20	5		DDBDMO
COc1ccc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)cc1[N+](=O)[O-]	ZINC000923312296	714307429	/nfs/dbraw/zinc/30/74/29/714307429.db2.gz	DJVZJGAIECRGOF-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
CN(C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[NH2+]CC1	ZINC000923336030	714319581	/nfs/dbraw/zinc/31/95/81/714319581.db2.gz	UAYDNAZLCAQQLT-UKRRQHHQSA-N	1	1	323.393	1.408	20	5		DDBDMO
CN(C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[NH2+]CC1	ZINC000923336028	714319617	/nfs/dbraw/zinc/31/96/17/714319617.db2.gz	UAYDNAZLCAQQLT-HIFRSBDPSA-N	1	1	323.393	1.408	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933229977	714542613	/nfs/dbraw/zinc/54/26/13/714542613.db2.gz	QVGVFUVUDKIYSE-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933229977	714542616	/nfs/dbraw/zinc/54/26/16/714542616.db2.gz	QVGVFUVUDKIYSE-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(C)CC[N@@H+](C)CC1	ZINC000933998617	714719287	/nfs/dbraw/zinc/71/92/87/714719287.db2.gz	LLKPLCJPAWZCIO-CQSZACIVSA-N	1	1	306.410	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000934257581	714776900	/nfs/dbraw/zinc/77/69/00/714776900.db2.gz	AMTVHBOVCKWFIH-HZPDHXFCSA-N	1	1	323.368	1.765	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)n1	ZINC001164631365	719254004	/nfs/dbraw/zinc/25/40/04/719254004.db2.gz	DODQEMVSIJWTFV-RKDXNWHRSA-N	1	1	322.369	1.180	20	5		DDBDMO
CC(=O)Nc1nc(C)c([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)C[C@H]2C)n1	ZINC001164631365	719254015	/nfs/dbraw/zinc/25/40/15/719254015.db2.gz	DODQEMVSIJWTFV-RKDXNWHRSA-N	1	1	322.369	1.180	20	5		DDBDMO
CC(C)[C@](C)(Nc1ccc([N+](=O)[O-])c2c1CC[N@H+](C)C2)C(N)=O	ZINC001167419217	733433798	/nfs/dbraw/zinc/43/37/98/733433798.db2.gz	SWEZQIPITIXQMJ-INIZCTEOSA-N	1	1	320.393	1.895	20	5		DDBDMO
CC(C)[C@](C)(Nc1ccc([N+](=O)[O-])c2c1CC[N@@H+](C)C2)C(N)=O	ZINC001167419217	733433802	/nfs/dbraw/zinc/43/38/02/733433802.db2.gz	SWEZQIPITIXQMJ-INIZCTEOSA-N	1	1	320.393	1.895	20	5		DDBDMO
CC(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC001025685015	736820055	/nfs/dbraw/zinc/82/00/55/736820055.db2.gz	JQFZMZLUYCSMBH-FICVDOATSA-N	1	1	303.362	1.797	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC001198883810	747646012	/nfs/dbraw/zinc/64/60/12/747646012.db2.gz	VJIJPXFAFVAJBI-OAHLLOKOSA-N	1	1	320.393	1.584	20	5		DDBDMO
CCC(CC)C[N@@H+]1CC=C(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001000673137	762077343	/nfs/dbraw/zinc/07/73/43/762077343.db2.gz	FGDZSXUSAPQNCM-HUUCEWRRSA-N	1	1	309.410	1.836	20	5		DDBDMO
CCC(CC)C[N@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001000673137	762077353	/nfs/dbraw/zinc/07/73/53/762077353.db2.gz	FGDZSXUSAPQNCM-HUUCEWRRSA-N	1	1	309.410	1.836	20	5		DDBDMO
CCC(CC)C[N@@H+]1CC=C(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001000673137	762077363	/nfs/dbraw/zinc/07/73/63/762077363.db2.gz	FGDZSXUSAPQNCM-HUUCEWRRSA-N	1	1	309.410	1.836	20	5		DDBDMO
COc1ccccc1C1([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)COC1	ZINC001168994064	762167862	/nfs/dbraw/zinc/16/78/62/762167862.db2.gz	OLFLAOADKUUQCA-CHWSQXEVSA-N	1	1	306.362	1.956	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2C[C@@H](OCC3CC3)[C@H]3COC[C@H]32)C1	ZINC001169030129	762186403	/nfs/dbraw/zinc/18/64/03/762186403.db2.gz	WUHQBOWUUZHXRJ-IBEHDNSVSA-N	1	1	310.394	1.558	20	5		DDBDMO
CCn1ncc2c1[C@H](COC)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2	ZINC001169025073	762201867	/nfs/dbraw/zinc/20/18/67/762201867.db2.gz	XNEIHPOAOMUOIM-VHDGCEQUSA-N	1	1	322.409	1.894	20	5		DDBDMO
O=C1[C@H]2C[N@@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C[C@H]2CN1CC1CC1	ZINC001169025221	762203349	/nfs/dbraw/zinc/20/33/49/762203349.db2.gz	YDZUWGPWPFHOBM-XQLPTFJDSA-N	1	1	307.394	1.232	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170329524	766255037	/nfs/dbraw/zinc/25/50/37/766255037.db2.gz	QMUMVGLMRRPMBG-GWCFXTLKSA-N	1	1	307.350	1.484	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170329524	766255039	/nfs/dbraw/zinc/25/50/39/766255039.db2.gz	QMUMVGLMRRPMBG-GWCFXTLKSA-N	1	1	307.350	1.484	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ncc([N+](=O)[O-])cc1C	ZINC001094517123	775973198	/nfs/dbraw/zinc/97/31/98/775973198.db2.gz	DUFRUZMNRWDNCM-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907531	776918472	/nfs/dbraw/zinc/91/84/72/776918472.db2.gz	GXQVGZYIALVFLJ-BXUZGUMPSA-N	1	1	303.362	1.663	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(=O)N1	ZINC001172907531	776918481	/nfs/dbraw/zinc/91/84/81/776918481.db2.gz	GXQVGZYIALVFLJ-BXUZGUMPSA-N	1	1	303.362	1.663	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2C[C@H](O)[C@@H](C)C2)c1F	ZINC001173181329	777035503	/nfs/dbraw/zinc/03/55/03/777035503.db2.gz	OQGPBRHMPRPQTN-CWSCBRNRSA-N	1	1	312.341	1.986	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+]Cc2ccnn2-c2ccncc2)c1	ZINC001178064320	778846483	/nfs/dbraw/zinc/84/64/83/778846483.db2.gz	CNFKZYDYXYIPEH-UHFFFAOYSA-N	1	1	313.321	1.162	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC001118921842	781273502	/nfs/dbraw/zinc/27/35/02/781273502.db2.gz	GPVGBVZAMLEKJT-ZDUSSCGKSA-N	1	1	321.352	1.973	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC001119344398	781413015	/nfs/dbraw/zinc/41/30/15/781413015.db2.gz	LIBNWZQUPGSACE-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC001119344398	781413021	/nfs/dbraw/zinc/41/30/21/781413021.db2.gz	LIBNWZQUPGSACE-ZDUSSCGKSA-N	1	1	313.379	1.108	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]CCCCC(F)(F)F)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001266682823	836660646	/nfs/dbraw/zinc/66/06/46/836660646.db2.gz	AVOBBQDYOSOPAK-LMLFDSFASA-N	1	1	323.315	1.621	20	5		DDBDMO
Cc1ccnc(NCC2(N(C)C)CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC001156177015	862776294	/nfs/dbraw/zinc/77/62/94/862776294.db2.gz	YFCKLBIRXUSGTG-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)cc1[N+](=O)[O-]	ZINC001124088472	859572023	/nfs/dbraw/zinc/57/20/23/859572023.db2.gz	UWTJSHZIGRYCQP-MGPQQGTHSA-N	1	1	303.362	1.973	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H](OCCC[NH+]1CCOCC1)C2	ZINC001224864249	881563673	/nfs/dbraw/zinc/56/36/73/881563673.db2.gz	GDZNPDNJIZQHGG-INIZCTEOSA-N	1	1	306.362	1.801	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ncc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@H]21	ZINC001157266668	863696078	/nfs/dbraw/zinc/69/60/78/863696078.db2.gz	VXJIZHOIWLFAHZ-JOYOIKCWSA-N	1	1	307.310	1.428	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC001160152452	865702652	/nfs/dbraw/zinc/70/26/52/865702652.db2.gz	BISZCSGSGMJCQC-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])c(NCC[NH+]2CCC(F)(F)CC2)n1	ZINC001160748897	866097285	/nfs/dbraw/zinc/09/72/85/866097285.db2.gz	DZTVTNODFKWVFZ-UHFFFAOYSA-N	1	1	301.297	1.836	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1CCC[C@H](CF)C1)c1cccc([N+](=O)[O-])c1	ZINC001333216283	866527414	/nfs/dbraw/zinc/52/74/14/866527414.db2.gz	UUNXPZIEIZNOLN-ABAIWWIYSA-N	1	1	309.341	1.977	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@@H](C)[C@@H]1C	ZINC001320547819	866817947	/nfs/dbraw/zinc/81/79/47/866817947.db2.gz	LHTGXXIPCBPPHO-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@@H](C)[C@@H]1C	ZINC001320547819	866817959	/nfs/dbraw/zinc/81/79/59/866817959.db2.gz	LHTGXXIPCBPPHO-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
Cc1nc(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)ncc1[N+](=O)[O-]	ZINC001324416541	867266722	/nfs/dbraw/zinc/26/67/22/867266722.db2.gz	FZCCCNPWJYPGLN-GFCCVEGCSA-N	1	1	320.397	1.274	20	5		DDBDMO
Cc1nc(N[C@@H]2CCN(C3CC[NH+](C)CC3)C2)ncc1[N+](=O)[O-]	ZINC001324416541	867266734	/nfs/dbraw/zinc/26/67/34/867266734.db2.gz	FZCCCNPWJYPGLN-GFCCVEGCSA-N	1	1	320.397	1.274	20	5		DDBDMO
O=[N+]([O-])c1c2nonc2ccc1N1CC[NH+]([C@@H]2CCOC2)CC1	ZINC001335518729	868357447	/nfs/dbraw/zinc/35/74/47/868357447.db2.gz	GKWNPUYWEHLQHO-SNVBAGLBSA-N	1	1	319.321	1.042	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CC[C@@H](O)[C@@H](F)CC2)ncc1[N+](=O)[O-]	ZINC001164237332	869045415	/nfs/dbraw/zinc/04/54/15/869045415.db2.gz	JHXOLOBMZRCXDI-CZOIOIDKSA-N	1	1	324.356	1.821	20	5		DDBDMO
O=[N+]([O-])c1ccsc1NC[C@@]1(CO)COC[C@@H]2CCC[N@@H+]21	ZINC001336869268	869191043	/nfs/dbraw/zinc/19/10/43/869191043.db2.gz	SIYYZOGAQPWPEN-GXFFZTMASA-N	1	1	313.379	1.294	20	5		DDBDMO
O=[N+]([O-])c1ccsc1NC[C@@]1(CO)COC[C@@H]2CCC[N@H+]21	ZINC001336869268	869191047	/nfs/dbraw/zinc/19/10/47/869191047.db2.gz	SIYYZOGAQPWPEN-GXFFZTMASA-N	1	1	313.379	1.294	20	5		DDBDMO
CN(CCNC(=O)CC[NH+](C)C)Cc1ccc([N+](=O)[O-])cc1	ZINC001317459282	871350533	/nfs/dbraw/zinc/35/05/33/871350533.db2.gz	LYOGDZGFPBKEQU-UHFFFAOYSA-N	1	1	308.382	1.095	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])n1	ZINC001307717548	871451966	/nfs/dbraw/zinc/45/19/66/871451966.db2.gz	UKSOGPVVQRLGDV-UHFFFAOYSA-N	1	1	319.321	1.911	20	5		DDBDMO
Cn1cc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c([N+](=O)[O-])n1	ZINC001307717548	871451950	/nfs/dbraw/zinc/45/19/50/871451950.db2.gz	UKSOGPVVQRLGDV-UHFFFAOYSA-N	1	1	319.321	1.911	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@H](c3ncccn3)C2)cc1	ZINC001308111073	871470891	/nfs/dbraw/zinc/47/08/91/871470891.db2.gz	BMDWUSCEEIVSQE-UKRRQHHQSA-N	1	1	314.345	1.908	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)[C@@H]1C[N@H+](C)CCN1C	ZINC001308948983	871536416	/nfs/dbraw/zinc/53/64/16/871536416.db2.gz	UWLVGWGTOVMINN-PBHICJAKSA-N	1	1	320.437	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC001308948983	871536437	/nfs/dbraw/zinc/53/64/37/871536437.db2.gz	UWLVGWGTOVMINN-PBHICJAKSA-N	1	1	320.437	1.936	20	5		DDBDMO
CCC[N@H+]1CCCC[C@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC001318910737	872340391	/nfs/dbraw/zinc/34/03/91/872340391.db2.gz	PGJCBERXCQFKIC-ZDUSSCGKSA-N	1	1	310.354	1.599	20	5		DDBDMO
CN1CCC[C@H](C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC001353289332	877232907	/nfs/dbraw/zinc/23/29/07/877232907.db2.gz	XTBBAZJKTSVQNZ-UKRRQHHQSA-N	1	1	323.393	1.266	20	5		DDBDMO
C[N@H+]1CCC[C@@H](Oc2cc(N3CCOCC3)ccc2[N+](=O)[O-])C1	ZINC001234359573	887905054	/nfs/dbraw/zinc/90/50/54/887905054.db2.gz	HPPAAPYADBUSIH-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
CC[C@](N)(CO)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001254469386	896456716	/nfs/dbraw/zinc/45/67/16/896456716.db2.gz	LTHVKZOGYBALLJ-OAHLLOKOSA-N	1	1	308.382	1.211	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@@H+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]21	ZINC001254602788	896526775	/nfs/dbraw/zinc/52/67/75/896526775.db2.gz	IXOHNAJWGJBWEP-BYNSBNAKSA-N	1	1	302.330	1.413	20	5		DDBDMO
CCN1C[C@@H]2C[N@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1	ZINC001254610652	896530033	/nfs/dbraw/zinc/53/00/33/896530033.db2.gz	MGUOIRDTPNIZHY-HLLBOEOZSA-N	1	1	301.390	1.946	20	5		DDBDMO
CCN1C[C@@H]2C[N@@H+]([C@@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@@H]2C1	ZINC001254610652	896530045	/nfs/dbraw/zinc/53/00/45/896530045.db2.gz	MGUOIRDTPNIZHY-HLLBOEOZSA-N	1	1	301.390	1.946	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001261930466	899833497	/nfs/dbraw/zinc/83/34/97/899833497.db2.gz	FOGSMMGTFHWSNE-CQSZACIVSA-N	1	1	304.350	1.714	20	5		DDBDMO
CCCCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001282965071	906349676	/nfs/dbraw/zinc/34/96/76/906349676.db2.gz	OJTUXWJPKUIHNT-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCCCC[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001282965071	906349688	/nfs/dbraw/zinc/34/96/88/906349688.db2.gz	OJTUXWJPKUIHNT-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCCCC[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001282965071	906349700	/nfs/dbraw/zinc/34/97/00/906349700.db2.gz	OJTUXWJPKUIHNT-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
COC[C@@H](C)OC[C@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000278513726	214202787	/nfs/dbraw/zinc/20/27/87/214202787.db2.gz	FJLDQMLXMSZKAJ-TZMCWYRMSA-N	1	1	312.366	1.439	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000451741336	529388633	/nfs/dbraw/zinc/38/86/33/529388633.db2.gz	OFSZVRMVGBKRGG-CYBMUJFWSA-N	1	1	308.382	1.173	20	5		DDBDMO
C[C@@]12C[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C[C@H]1[C@@H]1C=C[C@H]2C1	ZINC000451378526	231081311	/nfs/dbraw/zinc/08/13/11/231081311.db2.gz	YCSRAVJDXLUOAI-MLEONAHRSA-N	1	1	318.377	1.296	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000451248531	529481386	/nfs/dbraw/zinc/48/13/86/529481386.db2.gz	DEGIQWNYCRFFRP-XNRPHZJLSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000495197628	529576674	/nfs/dbraw/zinc/57/66/74/529576674.db2.gz	YJPOVWAXXCQHNF-GDBMZVCRSA-N	1	1	319.361	1.547	20	5		DDBDMO
CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000614895437	362067097	/nfs/dbraw/zinc/06/70/97/362067097.db2.gz	TZHIKFAALUVYAZ-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC1(C)CN(C(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000614895437	362067102	/nfs/dbraw/zinc/06/71/02/362067102.db2.gz	TZHIKFAALUVYAZ-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC(C)CO[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090552305	185303025	/nfs/dbraw/zinc/30/30/25/185303025.db2.gz	ZWIAVYVWMGIOGR-CQSZACIVSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC1(C)CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000615140538	362170177	/nfs/dbraw/zinc/17/01/77/362170177.db2.gz	VUUORYIRWNUDOA-ALCCZGGFSA-N	1	1	319.405	1.997	20	5		DDBDMO
Cc1ccc(CN2CC[N@@H+](CCO)C(C)(C)C2)cc1[N+](=O)[O-]	ZINC000615140433	362170315	/nfs/dbraw/zinc/17/03/15/362170315.db2.gz	JXVUGBFZUWARTD-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000458222728	530054692	/nfs/dbraw/zinc/05/46/92/530054692.db2.gz	QMTTYOJKTGTPRR-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
COc1cc(CNCC[N@H+]2CC=CCC2)c([N+](=O)[O-])cc1OC	ZINC000279621659	215012466	/nfs/dbraw/zinc/01/24/66/215012466.db2.gz	AWEZEBZBFZDKJR-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
COc1cc(CNCC[N@@H+]2CC=CCC2)c([N+](=O)[O-])cc1OC	ZINC000279621659	215012468	/nfs/dbraw/zinc/01/24/68/215012468.db2.gz	AWEZEBZBFZDKJR-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000272635809	210037556	/nfs/dbraw/zinc/03/75/56/210037556.db2.gz	NRQJBUXITCRVNH-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H]([C@@H](C)O)C1	ZINC000272609432	210008368	/nfs/dbraw/zinc/00/83/68/210008368.db2.gz	SDKVKSJVSJUMLD-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)NCC[N@@H+]1CC=CCC1	ZINC000280039348	215331756	/nfs/dbraw/zinc/33/17/56/215331756.db2.gz	WPJFDDBWKVSGHD-UHFFFAOYSA-N	1	1	318.377	1.698	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000617285159	363037786	/nfs/dbraw/zinc/03/77/86/363037786.db2.gz	CTDNZDZQJPMGQV-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000617285159	363037790	/nfs/dbraw/zinc/03/77/90/363037790.db2.gz	CTDNZDZQJPMGQV-YGRLFVJLSA-N	1	1	323.349	1.052	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489329047	233936885	/nfs/dbraw/zinc/93/68/85/233936885.db2.gz	NNAFKHSEWHBWFH-LLVKDONJSA-N	1	1	309.370	1.049	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C1CCC1	ZINC000072722142	191221882	/nfs/dbraw/zinc/22/18/82/191221882.db2.gz	IQAQJEOHZAIZCE-UHFFFAOYSA-N	1	1	307.306	1.746	20	5		DDBDMO
C[C@@H](CNC(=O)CN(C)c1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000173035840	198179700	/nfs/dbraw/zinc/17/97/00/198179700.db2.gz	DCMLURFGFIHLTE-LBPRGKRZSA-N	1	1	320.393	1.630	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000057553460	352820478	/nfs/dbraw/zinc/82/04/78/352820478.db2.gz	BAWATORFZUOABX-LLVKDONJSA-N	1	1	305.334	1.327	20	5		DDBDMO
C[C@@H](CNC(=O)CCNc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000057713379	352826186	/nfs/dbraw/zinc/82/61/86/352826186.db2.gz	UXFKKSOWYPLXEK-LBPRGKRZSA-N	1	1	320.393	1.996	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000069397355	353160177	/nfs/dbraw/zinc/16/01/77/353160177.db2.gz	XHXSNAHXZAJCCI-LBPRGKRZSA-N	1	1	319.361	1.499	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000174530686	198348146	/nfs/dbraw/zinc/34/81/46/198348146.db2.gz	DVLPVZRDZMXOQH-SNVBAGLBSA-N	1	1	324.356	1.730	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000089265340	353763478	/nfs/dbraw/zinc/76/34/78/353763478.db2.gz	CEKLYPUVAVSBFH-NSHDSACASA-N	1	1	308.338	1.063	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000089265340	353763481	/nfs/dbraw/zinc/76/34/81/353763481.db2.gz	CEKLYPUVAVSBFH-NSHDSACASA-N	1	1	308.338	1.063	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CCc3n[nH]cc3C2)c2c(c1)COCO2	ZINC000125803979	354048081	/nfs/dbraw/zinc/04/80/81/354048081.db2.gz	YBBMVQDVDZAQKY-UHFFFAOYSA-N	1	1	316.317	1.743	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CCc3n[nH]cc3C2)c2c(c1)COCO2	ZINC000125803979	354048084	/nfs/dbraw/zinc/04/80/84/354048084.db2.gz	YBBMVQDVDZAQKY-UHFFFAOYSA-N	1	1	316.317	1.743	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305730646	354471272	/nfs/dbraw/zinc/47/12/72/354471272.db2.gz	KIYQMCRENGQLKC-QMTHXVAHSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)COc1ccc([N+](=O)[O-])c2ncccc12	ZINC000320555841	354528002	/nfs/dbraw/zinc/52/80/02/354528002.db2.gz	KMCGRARFCWNMID-LLVKDONJSA-N	1	1	305.334	1.834	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1NCC[NH+]1CCC(O)CC1	ZINC000321755470	354533385	/nfs/dbraw/zinc/53/33/85/354533385.db2.gz	NCBALNALQFZBOR-UHFFFAOYSA-N	1	1	300.746	1.512	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000315940043	354498264	/nfs/dbraw/zinc/49/82/64/354498264.db2.gz	YOSOYYFXRYHQLI-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000315940043	354498268	/nfs/dbraw/zinc/49/82/68/354498268.db2.gz	YOSOYYFXRYHQLI-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CCc1nn(C)c(NCCCN2CCC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000588815893	354938737	/nfs/dbraw/zinc/93/87/37/354938737.db2.gz	FKGYGWWUNIIJCZ-UHFFFAOYSA-N	1	1	324.429	1.330	20	5		DDBDMO
CCc1nn(C)c(NCCC[N@@H+]2CCCN(C)CC2)c1[N+](=O)[O-]	ZINC000588815893	354938739	/nfs/dbraw/zinc/93/87/39/354938739.db2.gz	FKGYGWWUNIIJCZ-UHFFFAOYSA-N	1	1	324.429	1.330	20	5		DDBDMO
CCc1nn(C)c(NCCC[N@H+]2CCCN(C)CC2)c1[N+](=O)[O-]	ZINC000588815893	354938742	/nfs/dbraw/zinc/93/87/42/354938742.db2.gz	FKGYGWWUNIIJCZ-UHFFFAOYSA-N	1	1	324.429	1.330	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CCc2cccc([N+](=O)[O-])c2)C1	ZINC000590047003	355043293	/nfs/dbraw/zinc/04/32/93/355043293.db2.gz	SCONKIOSKQMRRM-ZFWWWQNUSA-N	1	1	303.362	1.690	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC(C[NH+]2CCOCC2)C1	ZINC000590392011	355083977	/nfs/dbraw/zinc/08/39/77/355083977.db2.gz	KGHDCHYACBDGPD-UHFFFAOYSA-N	1	1	311.363	1.061	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1F	ZINC000590631952	355134657	/nfs/dbraw/zinc/13/46/57/355134657.db2.gz	LCDCKRZXBDGCBG-VIFPVBQESA-N	1	1	311.313	1.567	20	5		DDBDMO
CC1(C)C[NH2+]CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000591678341	355359886	/nfs/dbraw/zinc/35/98/86/355359886.db2.gz	PHKNQBMIQIPHRU-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)CC2(C)C)c1	ZINC000593020624	355771630	/nfs/dbraw/zinc/77/16/30/355771630.db2.gz	NOFLHHYOOWLCRJ-UHFFFAOYSA-N	1	1	321.377	1.907	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000593061322	355783739	/nfs/dbraw/zinc/78/37/39/355783739.db2.gz	IOOPWKWXSNSPQH-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000593061322	355783740	/nfs/dbraw/zinc/78/37/40/355783740.db2.gz	IOOPWKWXSNSPQH-BFHYXJOUSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)Cc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000593454271	355889392	/nfs/dbraw/zinc/88/93/92/355889392.db2.gz	HCVOQSPUFQHIRA-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC[N@H+]4C[C@H](O)C[C@H]4C3)c2c1	ZINC000594603877	356262731	/nfs/dbraw/zinc/26/27/31/356262731.db2.gz	OJBQRGQCELYUBO-UONOGXRCSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=C1NCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000594964184	356365066	/nfs/dbraw/zinc/36/50/66/356365066.db2.gz	PLPJWGAOTIBTGQ-LBPRGKRZSA-N	1	1	301.302	1.833	20	5		DDBDMO
CO[C@@H](C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@H]1CCOC1	ZINC000595423138	356486195	/nfs/dbraw/zinc/48/61/95/356486195.db2.gz	JNELLYZVTAEFPK-NHYWBVRUSA-N	1	1	307.350	1.399	20	5		DDBDMO
CO[C@@H](C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1)[C@H]1CCOC1	ZINC000595423138	356486198	/nfs/dbraw/zinc/48/61/98/356486198.db2.gz	JNELLYZVTAEFPK-NHYWBVRUSA-N	1	1	307.350	1.399	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCSC3(CCOCC3)C2)c1[N+](=O)[O-]	ZINC000595440635	356493635	/nfs/dbraw/zinc/49/36/35/356493635.db2.gz	PWIGADWWTOTUMM-UHFFFAOYSA-N	1	1	313.379	1.989	20	5		DDBDMO
Cc1noc(C[N@H+]2CCSC3(CCOCC3)C2)c1[N+](=O)[O-]	ZINC000595440635	356493637	/nfs/dbraw/zinc/49/36/37/356493637.db2.gz	PWIGADWWTOTUMM-UHFFFAOYSA-N	1	1	313.379	1.989	20	5		DDBDMO
C[C@H](CO)[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000595679779	356607878	/nfs/dbraw/zinc/60/78/78/356607878.db2.gz	YCZWQXSMSAQCKQ-BXUZGUMPSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@H]1C[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H](C)C1O	ZINC000595744664	356632624	/nfs/dbraw/zinc/63/26/24/356632624.db2.gz	LKPRLBYLASVLSC-RYUDHWBXSA-N	1	1	321.377	1.506	20	5		DDBDMO
CCOc1cc(C[N@@H+](C)C[C@@H]2COCCO2)ccc1[N+](=O)[O-]	ZINC000595736582	356628095	/nfs/dbraw/zinc/62/80/95/356628095.db2.gz	MSGBRJPSGQBOEQ-CYBMUJFWSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000595771469	356645944	/nfs/dbraw/zinc/64/59/44/356645944.db2.gz	PJEUYFDCULYJAL-OSAQELSMSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595759873	356641156	/nfs/dbraw/zinc/64/11/56/356641156.db2.gz	QLCVJRQXWFAFMZ-MLGOLLRUSA-N	1	1	319.361	1.892	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@H]3COC[C@@]3(C)C2)c1	ZINC000595761077	356641899	/nfs/dbraw/zinc/64/18/99/356641899.db2.gz	WNUKVDSDRIPXAG-XJKSGUPXSA-N	1	1	320.345	1.850	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000595801188	356656747	/nfs/dbraw/zinc/65/67/47/356656747.db2.gz	FHEWYVADZLWAJG-MRXNPFEDSA-N	1	1	322.361	1.791	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000595801188	356656750	/nfs/dbraw/zinc/65/67/50/356656750.db2.gz	FHEWYVADZLWAJG-MRXNPFEDSA-N	1	1	322.361	1.791	20	5		DDBDMO
O=[N+]([O-])c1ccc(CCN2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1	ZINC000595867569	356684896	/nfs/dbraw/zinc/68/48/96/356684896.db2.gz	OUZSTERCCBGRBX-KRWDZBQOSA-N	1	1	319.405	1.668	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CC[N@H+]3CCCC[C@@H]23)ccc1[N+](=O)[O-]	ZINC000596074493	356762565	/nfs/dbraw/zinc/76/25/65/356762565.db2.gz	AZGODRKAXQHARE-JSGCOSHPSA-N	1	1	304.350	1.732	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596094037	356769641	/nfs/dbraw/zinc/76/96/41/356769641.db2.gz	HFGMNVJPRANCOI-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596163185	356797871	/nfs/dbraw/zinc/79/78/71/356797871.db2.gz	QDQGZGPQBRBEEW-ZANVPECISA-N	1	1	304.350	1.588	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](Nc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000596336605	356860037	/nfs/dbraw/zinc/86/00/37/356860037.db2.gz	QOKRCLBIWHKDKU-VIFPVBQESA-N	1	1	307.354	1.373	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597854858	357358935	/nfs/dbraw/zinc/35/89/35/357358935.db2.gz	NQTVKNAOBPXMIY-SNVBAGLBSA-N	1	1	309.370	1.477	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])s1	ZINC000599131109	357824301	/nfs/dbraw/zinc/82/43/01/357824301.db2.gz	QQWIWSVQZIOATN-NSHDSACASA-N	1	1	312.395	1.716	20	5		DDBDMO
C[C@]1(CO)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@]1(C)CO	ZINC000599622315	357995711	/nfs/dbraw/zinc/99/57/11/357995711.db2.gz	DRZNZHUGNUTMJB-IYBDPMFKSA-N	1	1	324.377	1.286	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[C@@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601136389	358416784	/nfs/dbraw/zinc/41/67/84/358416784.db2.gz	QNCCGBFQAOPMAV-RISCZKNCSA-N	1	1	314.345	1.892	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1cn(C)nc1[N+](=O)[O-])Cc1ccccc1	ZINC000602451258	358985110	/nfs/dbraw/zinc/98/51/10/358985110.db2.gz	FEMLDTARSXEHAW-GFCCVEGCSA-N	1	1	304.350	1.711	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])Cc1ccccc1	ZINC000602451258	358985113	/nfs/dbraw/zinc/98/51/13/358985113.db2.gz	FEMLDTARSXEHAW-GFCCVEGCSA-N	1	1	304.350	1.711	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCS[C@H]2COCC[C@H]21	ZINC000602784992	359190524	/nfs/dbraw/zinc/19/05/24/359190524.db2.gz	QVMXZSIOTLZBTR-NEPJUHHUSA-N	1	1	312.395	1.306	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C[C@H]1CCC(=O)N1)C(C)C	ZINC000602845300	359233139	/nfs/dbraw/zinc/23/31/39/359233139.db2.gz	HKBGJMGJFCJPDG-GFCCVEGCSA-N	1	1	309.370	1.089	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@H]2C1	ZINC000602796889	359198664	/nfs/dbraw/zinc/19/86/64/359198664.db2.gz	UFYWZRMHBVPWPM-HZSPNIEDSA-N	1	1	324.381	1.368	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@H]2C1	ZINC000602796889	359198667	/nfs/dbraw/zinc/19/86/67/359198667.db2.gz	UFYWZRMHBVPWPM-HZSPNIEDSA-N	1	1	324.381	1.368	20	5		DDBDMO
C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC000602798992	359200579	/nfs/dbraw/zinc/20/05/79/359200579.db2.gz	IGPDPLNUQWHZPD-VIFPVBQESA-N	1	1	304.306	1.908	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817623	359213358	/nfs/dbraw/zinc/21/33/58/359213358.db2.gz	USJQETZMWDBZPX-SCRDCRAPSA-N	1	1	322.365	1.373	20	5		DDBDMO
COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602817623	359213362	/nfs/dbraw/zinc/21/33/62/359213362.db2.gz	USJQETZMWDBZPX-SCRDCRAPSA-N	1	1	322.365	1.373	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](C(C)(C)CO)CC1	ZINC000618469133	363642702	/nfs/dbraw/zinc/64/27/02/363642702.db2.gz	YYEPSWVREGCNOQ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@@H+](Cc1ccns1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000602885556	359269229	/nfs/dbraw/zinc/26/92/29/359269229.db2.gz	YBYSVTKHFDTYLI-LLVKDONJSA-N	1	1	323.374	1.923	20	5		DDBDMO
C[N@H+](Cc1ccns1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000602885556	359269231	/nfs/dbraw/zinc/26/92/31/359269231.db2.gz	YBYSVTKHFDTYLI-LLVKDONJSA-N	1	1	323.374	1.923	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@H](OC)C[C@@]1(C)CO	ZINC000602965138	359329253	/nfs/dbraw/zinc/32/92/53/359329253.db2.gz	ZRSBCKOQALTQTI-HIFRSBDPSA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[N@H+]1[C@H](C)CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000603142248	359431553	/nfs/dbraw/zinc/43/15/53/359431553.db2.gz	IMWXRXRXELXWSI-AOOOYVTPSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000603142248	359431558	/nfs/dbraw/zinc/43/15/58/359431558.db2.gz	IMWXRXRXELXWSI-AOOOYVTPSA-N	1	1	309.370	1.191	20	5		DDBDMO
COC(=O)c1cc(C(=O)N[C@H]2CCC[N@@H+](C)C2)cc([N+](=O)[O-])c1	ZINC000604198013	359725460	/nfs/dbraw/zinc/72/54/60/359725460.db2.gz	DHWMFJWOTHPDPI-LBPRGKRZSA-N	1	1	321.333	1.205	20	5		DDBDMO
C[N@H+]1CCCN(CCCNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000609619802	360336434	/nfs/dbraw/zinc/33/64/34/360336434.db2.gz	DAQRZQKBWBHAQR-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CN1CCC[N@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000609619802	360336436	/nfs/dbraw/zinc/33/64/36/360336436.db2.gz	DAQRZQKBWBHAQR-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CN1CCC[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000609619802	360336441	/nfs/dbraw/zinc/33/64/41/360336441.db2.gz	DAQRZQKBWBHAQR-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)C[C@H]1C	ZINC000610125851	360384134	/nfs/dbraw/zinc/38/41/34/360384134.db2.gz	VDAQHTFAUZCQMM-VXGBXAGGSA-N	1	1	308.382	1.878	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cn2C)C[C@H]1C	ZINC000610125848	360384276	/nfs/dbraw/zinc/38/42/76/360384276.db2.gz	VDAQHTFAUZCQMM-NEPJUHHUSA-N	1	1	308.382	1.878	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000610615795	360481980	/nfs/dbraw/zinc/48/19/80/360481980.db2.gz	XWBUQSZIOYXDOZ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000610615795	360481983	/nfs/dbraw/zinc/48/19/83/360481983.db2.gz	XWBUQSZIOYXDOZ-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000611087918	360618200	/nfs/dbraw/zinc/61/82/00/360618200.db2.gz	RYKHECUUQJXHHJ-NSHDSACASA-N	1	1	309.370	1.042	20	5		DDBDMO
CC[N@H+]1CCN([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611092299	360621530	/nfs/dbraw/zinc/62/15/30/360621530.db2.gz	ODQPXSBFMFBKHQ-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1cc(C[N@H+](CCCO)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000611271622	360686084	/nfs/dbraw/zinc/68/60/84/360686084.db2.gz	VMIRNHGULZITFZ-UHFFFAOYSA-N	1	1	310.350	1.959	20	5		DDBDMO
COc1cc(C[N@@H+](CCCO)C2CC2)c([N+](=O)[O-])cc1OC	ZINC000611271622	360686087	/nfs/dbraw/zinc/68/60/87/360686087.db2.gz	VMIRNHGULZITFZ-UHFFFAOYSA-N	1	1	310.350	1.959	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611276732	360687770	/nfs/dbraw/zinc/68/77/70/360687770.db2.gz	FRILYLBRAXHRDM-SNVBAGLBSA-N	1	1	323.349	1.180	20	5		DDBDMO
C[C@@H](C[N@@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])c(N)n1	ZINC000271813581	209236650	/nfs/dbraw/zinc/23/66/50/209236650.db2.gz	MKEXWSMFUKTXEF-NSHDSACASA-N	1	1	316.365	1.899	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000566115246	304119932	/nfs/dbraw/zinc/11/99/32/304119932.db2.gz	IHSSANDHDBUBME-HZSPNIEDSA-N	1	1	323.393	1.407	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1cn[nH]c1	ZINC000275149964	212151235	/nfs/dbraw/zinc/15/12/35/212151235.db2.gz	GKQYIRLXADGVMP-VIFPVBQESA-N	1	1	319.321	1.616	20	5		DDBDMO
CCOCCNC(=O)C[N@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282560755	217090248	/nfs/dbraw/zinc/09/02/48/217090248.db2.gz	YKKLUFHSKJHINZ-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CCOCCNC(=O)C[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000282560755	217090251	/nfs/dbraw/zinc/09/02/51/217090251.db2.gz	YKKLUFHSKJHINZ-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)NCCF	ZINC000282748580	217223662	/nfs/dbraw/zinc/22/36/62/217223662.db2.gz	SFSWCXSIPQCDFM-MRVPVSSYSA-N	1	1	303.721	1.812	20	5		DDBDMO
CC[NH+](CC)C[C@@H]1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C1	ZINC000266309775	205256628	/nfs/dbraw/zinc/25/66/28/205256628.db2.gz	NUHYABMXWZGRFH-NSHDSACASA-N	1	1	309.370	1.430	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1[C@@H]1CCCO1	ZINC000284669831	218124977	/nfs/dbraw/zinc/12/49/77/218124977.db2.gz	GUTZNXJURBHRSG-KGLIPLIRSA-N	1	1	307.350	1.400	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000284794154	218181677	/nfs/dbraw/zinc/18/16/77/218181677.db2.gz	OERPLHXNHHGJDD-LBPRGKRZSA-N	1	1	309.370	1.172	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCO[C@]3(CCCOC3)C2)c1	ZINC000285354062	218393401	/nfs/dbraw/zinc/39/34/01/218393401.db2.gz	PVNISZSBGHKUIP-MRXNPFEDSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCO[C@]3(CCCOC3)C2)c1	ZINC000285354062	218393403	/nfs/dbraw/zinc/39/34/03/218393403.db2.gz	PVNISZSBGHKUIP-MRXNPFEDSA-N	1	1	322.361	1.855	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938471	251290558	/nfs/dbraw/zinc/29/05/58/251290558.db2.gz	WHOZVUHOZSRWBW-CABZTGNLSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000340938471	251290563	/nfs/dbraw/zinc/29/05/63/251290563.db2.gz	WHOZVUHOZSRWBW-CABZTGNLSA-N	1	1	304.306	1.600	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](O)C[C@@H]1C	ZINC000340925919	251281757	/nfs/dbraw/zinc/28/17/57/251281757.db2.gz	IVVXCMIYBPCONN-AAEUAGOBSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000158195248	197252706	/nfs/dbraw/zinc/25/27/06/197252706.db2.gz	SMEVHXHHWFRYLQ-UHFFFAOYSA-N	1	1	320.393	1.585	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NCCC[NH+]1CCN(C)CC1	ZINC000063703188	184286639	/nfs/dbraw/zinc/28/66/39/184286639.db2.gz	MBBKRGVCKLUKRU-UHFFFAOYSA-N	1	1	320.393	1.271	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000066137775	184392238	/nfs/dbraw/zinc/39/22/38/184392238.db2.gz	NYNBOBGREXTQHP-SNVBAGLBSA-N	1	1	324.337	1.963	20	5		DDBDMO
CC[N@H+](CCO)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000120008957	195079641	/nfs/dbraw/zinc/07/96/41/195079641.db2.gz	XQMIFWATMIDKPB-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CCO)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000120008957	195079643	/nfs/dbraw/zinc/07/96/43/195079643.db2.gz	XQMIFWATMIDKPB-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
O=C(NCCCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CSC[NH2+]1	ZINC000159142884	197330231	/nfs/dbraw/zinc/33/02/31/197330231.db2.gz	MYRJNEJWYAIQFY-ZDUSSCGKSA-N	1	1	309.391	1.696	20	5		DDBDMO
CO[C@H](C)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293061605	533084900	/nfs/dbraw/zinc/08/49/00/533084900.db2.gz	IMYHSKDZNPZETD-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+](C1CC1)C1COC1	ZINC000295536801	285164675	/nfs/dbraw/zinc/16/46/75/285164675.db2.gz	VXCNETRKAAHLQA-ZDUSSCGKSA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+](C1CC1)C1COC1	ZINC000295536801	285164676	/nfs/dbraw/zinc/16/46/76/285164676.db2.gz	VXCNETRKAAHLQA-ZDUSSCGKSA-N	1	1	308.334	1.198	20	5		DDBDMO
NC(=O)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000157220032	197171084	/nfs/dbraw/zinc/17/10/84/197171084.db2.gz	GZFLZUFREGUDQS-QMMMGPOBSA-N	1	1	315.276	1.503	20	5		DDBDMO
NC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000157220032	197171085	/nfs/dbraw/zinc/17/10/85/197171085.db2.gz	GZFLZUFREGUDQS-QMMMGPOBSA-N	1	1	315.276	1.503	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000289482743	221009067	/nfs/dbraw/zinc/00/90/67/221009067.db2.gz	IKSMEBMMOAPEGN-LLVKDONJSA-N	1	1	315.395	1.602	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](c2nc(=O)[nH][nH]2)C1	ZINC000289487165	221011669	/nfs/dbraw/zinc/01/16/69/221011669.db2.gz	SGSYDSXLJWGPLF-GHMZBOCLSA-N	1	1	317.349	1.947	20	5		DDBDMO
C[C@@H](O)CC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000451083863	533614750	/nfs/dbraw/zinc/61/47/50/533614750.db2.gz	WWDULYIXZDBMHK-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000331053721	286176825	/nfs/dbraw/zinc/17/68/25/286176825.db2.gz	JNVHOMPLGILSJB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000331053721	286176826	/nfs/dbraw/zinc/17/68/26/286176826.db2.gz	JNVHOMPLGILSJB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@H](NC(=O)CN1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000076410424	406968251	/nfs/dbraw/zinc/96/82/51/406968251.db2.gz	CARPVRNFORYGRH-LBPRGKRZSA-N	1	1	306.366	1.019	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNS(=O)(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000078572714	407034882	/nfs/dbraw/zinc/03/48/82/407034882.db2.gz	GGEGAQUAOXFEJY-NSHDSACASA-N	1	1	313.379	1.215	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000090465491	407168634	/nfs/dbraw/zinc/16/86/34/407168634.db2.gz	DLHBHDLOSCFXCP-GHMZBOCLSA-N	1	1	309.322	1.171	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000090465491	407168637	/nfs/dbraw/zinc/16/86/37/407168637.db2.gz	DLHBHDLOSCFXCP-GHMZBOCLSA-N	1	1	309.322	1.171	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCOC1	ZINC000107696091	407378230	/nfs/dbraw/zinc/37/82/30/407378230.db2.gz	FCPBRGCAHFHRQX-ZFWWWQNUSA-N	1	1	324.377	1.693	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000126131745	407406359	/nfs/dbraw/zinc/40/63/59/407406359.db2.gz	IZKUHTCNYOHYDS-SNVBAGLBSA-N	1	1	307.325	1.948	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000270968054	407443440	/nfs/dbraw/zinc/44/34/40/407443440.db2.gz	VTLDDFAQAVVHFE-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000112990257	407454300	/nfs/dbraw/zinc/45/43/00/407454300.db2.gz	DMANGPMUGFJYPN-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000270999656	407460366	/nfs/dbraw/zinc/46/03/66/407460366.db2.gz	YSKBSBUVENXMOG-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000270999656	407460372	/nfs/dbraw/zinc/46/03/72/407460372.db2.gz	YSKBSBUVENXMOG-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCCO1	ZINC000221691251	407551246	/nfs/dbraw/zinc/55/12/46/407551246.db2.gz	KGURSSPIIOIYIP-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000266221134	407533172	/nfs/dbraw/zinc/53/31/72/407533172.db2.gz	QNWSYLWHHSNBDB-NSHDSACASA-N	1	1	324.337	1.396	20	5		DDBDMO
CC[N@H+](CCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000266877782	407659585	/nfs/dbraw/zinc/65/95/85/407659585.db2.gz	VADVYLXLBYCYAN-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CC[N@@H+](CCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000266877782	407659588	/nfs/dbraw/zinc/65/95/88/407659588.db2.gz	VADVYLXLBYCYAN-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[C@@H](NC(=O)[C@H](C)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000171261801	407641889	/nfs/dbraw/zinc/64/18/89/407641889.db2.gz	HEPBRGGFCJMTPT-OLZOCXBDSA-N	1	1	320.393	1.408	20	5		DDBDMO
CC[C@@H](c1ccncc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000130150762	407657835	/nfs/dbraw/zinc/65/78/35/407657835.db2.gz	PWTOXOXDNXDGBV-GJZGRUSLSA-N	1	1	319.365	1.630	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000115443175	407679447	/nfs/dbraw/zinc/67/94/47/407679447.db2.gz	RURYAUDFKKENFS-SNVBAGLBSA-N	1	1	324.356	1.730	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000268233459	407961692	/nfs/dbraw/zinc/96/16/92/407961692.db2.gz	SPFXCJDDDMBGAL-BXUZGUMPSA-N	1	1	318.377	1.606	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2ccc(F)cc2[N+](=O)[O-])n1C	ZINC000268153690	407916525	/nfs/dbraw/zinc/91/65/25/407916525.db2.gz	NBMOGHIYOFXDFR-UHFFFAOYSA-N	1	1	321.312	1.463	20	5		DDBDMO
C[NH+]1CCC(CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000272601268	408002468	/nfs/dbraw/zinc/00/24/68/408002468.db2.gz	XKWQMJOJBZCOCD-UHFFFAOYSA-N	1	1	307.350	1.762	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000245837972	408075751	/nfs/dbraw/zinc/07/57/51/408075751.db2.gz	AWTGRDSSMQMUJK-TUAOUCFPSA-N	1	1	323.397	1.425	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182242461	408104963	/nfs/dbraw/zinc/10/49/63/408104963.db2.gz	LTJHUTQBLAQSHH-IHRRRGAJSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246258558	408193833	/nfs/dbraw/zinc/19/38/33/408193833.db2.gz	KNVDZKVPTDSYKV-BPLDGKMQSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@H]1C[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000273317012	408148501	/nfs/dbraw/zinc/14/85/01/408148501.db2.gz	JPNBVBLOKNNHTG-TXEJJXNPSA-N	1	1	312.391	1.956	20	5		DDBDMO
C[C@H]1C[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000273317012	408148509	/nfs/dbraw/zinc/14/85/09/408148509.db2.gz	JPNBVBLOKNNHTG-TXEJJXNPSA-N	1	1	312.391	1.956	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@H+](C)C(C)C	ZINC000155565941	408180006	/nfs/dbraw/zinc/18/00/06/408180006.db2.gz	PDZJSLYYKMVWFO-UHFFFAOYSA-N	1	1	315.395	1.522	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000155572442	408180443	/nfs/dbraw/zinc/18/04/43/408180443.db2.gz	BDXZXWQBZSNVKF-UHFFFAOYSA-N	1	1	301.368	1.213	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000246747668	408330496	/nfs/dbraw/zinc/33/04/96/408330496.db2.gz	NNIFFYSRNKUJNV-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000246747668	408330499	/nfs/dbraw/zinc/33/04/99/408330499.db2.gz	NNIFFYSRNKUJNV-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)CC1	ZINC000263834435	408278535	/nfs/dbraw/zinc/27/85/35/408278535.db2.gz	ZPXLBEYTPDFFDU-UHFFFAOYSA-N	1	1	323.397	1.352	20	5		DDBDMO
CCOC(=O)N[C@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176210067	408310454	/nfs/dbraw/zinc/31/04/54/408310454.db2.gz	DWWOYMJFJLXUSE-NSHDSACASA-N	1	1	311.342	1.002	20	5		DDBDMO
CCOC(=O)N[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176210067	408310458	/nfs/dbraw/zinc/31/04/58/408310458.db2.gz	DWWOYMJFJLXUSE-NSHDSACASA-N	1	1	311.342	1.002	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000183196599	408349266	/nfs/dbraw/zinc/34/92/66/408349266.db2.gz	QYLOCRBARMMPDC-TUAOUCFPSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1ccnc(N2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)c1	ZINC000166122655	162165036	/nfs/dbraw/zinc/16/50/36/162165036.db2.gz	QOVGUFRSPUSFNY-UHFFFAOYSA-N	1	1	316.365	1.317	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000246940338	408373585	/nfs/dbraw/zinc/37/35/85/408373585.db2.gz	ZZXFMGHAUDDOJS-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000246940338	408373591	/nfs/dbraw/zinc/37/35/91/408373591.db2.gz	ZZXFMGHAUDDOJS-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000183592269	408449030	/nfs/dbraw/zinc/44/90/30/408449030.db2.gz	RINZVZWMBSSBTM-LLVKDONJSA-N	1	1	307.354	1.843	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000247320466	408449976	/nfs/dbraw/zinc/44/99/76/408449976.db2.gz	SIUOQMCXZLWAGP-AAEUAGOBSA-N	1	1	318.377	1.733	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000247080550	408403520	/nfs/dbraw/zinc/40/35/20/408403520.db2.gz	HAKDHCBKAAFMLC-STQMWFEESA-N	1	1	307.394	1.790	20	5		DDBDMO
CCN1CC[NH+]([C@H]2CCN(c3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000264422583	408484580	/nfs/dbraw/zinc/48/45/80/408484580.db2.gz	RJGMASGNSVJNIF-INIZCTEOSA-N	1	1	304.394	1.811	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000183965032	408519053	/nfs/dbraw/zinc/51/90/53/408519053.db2.gz	XKVHFTNAWOIOLE-UHFFFAOYSA-N	1	1	315.757	1.292	20	5		DDBDMO
CC1(O)CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000177329158	408581392	/nfs/dbraw/zinc/58/13/92/408581392.db2.gz	ZQDVGZBSUZPBKP-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](CO)c1ccccc1	ZINC000270563180	408581809	/nfs/dbraw/zinc/58/18/09/408581809.db2.gz	KWJGGVPOJBTJMF-HNNXBMFYSA-N	1	1	317.345	1.422	20	5		DDBDMO
C[C@@H](c1cccnc1)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680741	408634514	/nfs/dbraw/zinc/63/45/14/408634514.db2.gz	UPNOSDPQCLECKZ-SMDDNHRTSA-N	1	1	305.338	1.240	20	5		DDBDMO
CC[C@H](NC(=O)[C@@H]1C[N@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796376	408715656	/nfs/dbraw/zinc/71/56/56/408715656.db2.gz	QNEJPXFNMUPRQG-KBPBESRZSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[C@H](NC(=O)[C@@H]1C[N@@H+](C)CCO1)c1cccc([N+](=O)[O-])c1	ZINC000177796376	408715663	/nfs/dbraw/zinc/71/56/63/408715663.db2.gz	QNEJPXFNMUPRQG-KBPBESRZSA-N	1	1	307.350	1.493	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000276309845	408832773	/nfs/dbraw/zinc/83/27/73/408832773.db2.gz	OFYNUDMOKQMMHB-UONOGXRCSA-N	1	1	304.350	1.534	20	5		DDBDMO
[NH3+]CC[C@@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000286040056	408912023	/nfs/dbraw/zinc/91/20/23/408912023.db2.gz	KSSZUPUVLPFLGP-JTQLQIEISA-N	1	1	317.349	1.815	20	5		DDBDMO
COC(=O)c1cnc(NCC[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000276603370	408891674	/nfs/dbraw/zinc/89/16/74/408891674.db2.gz	RKWAURUKTXANDU-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@H](C)C[NH+](C)C[C@H]1C	ZINC000277362791	408926408	/nfs/dbraw/zinc/92/64/08/408926408.db2.gz	CKBMXQOAIOQJFW-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000193657935	163264979	/nfs/dbraw/zinc/26/49/79/163264979.db2.gz	NDTFFGFFWRVIDZ-BETUJISGSA-N	1	1	318.377	1.335	20	5		DDBDMO
COCC[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1C	ZINC000277487377	408950190	/nfs/dbraw/zinc/95/01/90/408950190.db2.gz	DETFXUZMTITVRP-LLVKDONJSA-N	1	1	319.365	1.628	20	5		DDBDMO
CSCc1cnc(C[NH2+]CCn2cc([N+](=O)[O-])cn2)s1	ZINC000293216744	409068910	/nfs/dbraw/zinc/06/89/10/409068910.db2.gz	JSAFIGMBEGZYSI-UHFFFAOYSA-N	1	1	313.408	1.901	20	5		DDBDMO
COCCO[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000278037450	409055662	/nfs/dbraw/zinc/05/56/62/409055662.db2.gz	BZOGZTXUHWQUBM-GDBMZVCRSA-N	1	1	324.377	1.441	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C[C@H](O)Cc1ccccc1	ZINC000293143696	409057889	/nfs/dbraw/zinc/05/78/89/409057889.db2.gz	BFNMQSCVKOOZNC-CQSZACIVSA-N	1	1	304.350	1.327	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C2)C1	ZINC000293654771	409155075	/nfs/dbraw/zinc/15/50/75/409155075.db2.gz	HGFICTNQUPDVLU-OAHLLOKOSA-N	1	1	322.340	1.484	20	5		DDBDMO
C[NH2+]CCC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000261757449	163697859	/nfs/dbraw/zinc/69/78/59/163697859.db2.gz	PNTSSAWUWIVIJO-UHFFFAOYSA-N	1	1	320.393	1.515	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294090762	409238532	/nfs/dbraw/zinc/23/85/32/409238532.db2.gz	KFYKXYSNIQXZJU-HNNXBMFYSA-N	1	1	321.381	1.195	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280316344	409290996	/nfs/dbraw/zinc/29/09/96/409290996.db2.gz	QAGXKCHPBMMAFW-HNNXBMFYSA-N	1	1	307.350	1.691	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573620	409363408	/nfs/dbraw/zinc/36/34/08/409363408.db2.gz	VRLHBEPQIHYMIO-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573620	409363414	/nfs/dbraw/zinc/36/34/14/409363414.db2.gz	VRLHBEPQIHYMIO-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])C[C@@H]21	ZINC000284899859	409369815	/nfs/dbraw/zinc/36/98/15/409369815.db2.gz	HOWHDNOUOACTJY-VHSXEESVSA-N	1	1	323.378	1.213	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H]2OCC[N@@H+](C)[C@@H]2C1	ZINC000408028982	164202539	/nfs/dbraw/zinc/20/25/39/164202539.db2.gz	VMODWNOVYOAALR-VXGBXAGGSA-N	1	1	309.370	1.029	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356725579	409552766	/nfs/dbraw/zinc/55/27/66/409552766.db2.gz	DVPQKZWTEPMYTC-LBPRGKRZSA-N	1	1	323.397	1.426	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000356835256	409647868	/nfs/dbraw/zinc/64/78/68/409647868.db2.gz	BLKAMKFRESEIQY-VXGBXAGGSA-N	1	1	307.350	1.525	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](Nc2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000342558957	409722553	/nfs/dbraw/zinc/72/25/53/409722553.db2.gz	DSUYZFLCFPZAEQ-GXFFZTMASA-N	1	1	306.366	1.834	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000354406678	409834156	/nfs/dbraw/zinc/83/41/56/409834156.db2.gz	VZSMNDUYQDIFAZ-GXSJLCMTSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000354406678	409834164	/nfs/dbraw/zinc/83/41/64/409834164.db2.gz	VZSMNDUYQDIFAZ-GXSJLCMTSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000354406678	409834170	/nfs/dbraw/zinc/83/41/70/409834170.db2.gz	VZSMNDUYQDIFAZ-GXSJLCMTSA-N	1	1	309.370	1.571	20	5		DDBDMO
C[C@@H]1C[N@H+](C(C)(C)CNc2ccncc2[N+](=O)[O-])C[C@H](C)O1	ZINC000357035898	409804633	/nfs/dbraw/zinc/80/46/33/409804633.db2.gz	JHWWBMXGEAYWCK-TXEJJXNPSA-N	1	1	308.382	1.711	20	5		DDBDMO
C[C@@H]1C[N@@H+](C(C)(C)CNc2ccncc2[N+](=O)[O-])C[C@H](C)O1	ZINC000357035898	409804646	/nfs/dbraw/zinc/80/46/46/409804646.db2.gz	JHWWBMXGEAYWCK-TXEJJXNPSA-N	1	1	308.382	1.711	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1C	ZINC000297242190	409872052	/nfs/dbraw/zinc/87/20/52/409872052.db2.gz	UVHLGAGTDJOVFB-UHFFFAOYSA-N	1	1	315.337	1.883	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CCC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000357682295	410184864	/nfs/dbraw/zinc/18/48/64/410184864.db2.gz	KERITXAMEGWMQK-GXSJLCMTSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357686994	410185516	/nfs/dbraw/zinc/18/55/16/410185516.db2.gz	QVSATNMAJPZSLJ-LLVKDONJSA-N	1	1	321.381	1.621	20	5		DDBDMO
CN(C(=O)COc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000347015013	410316225	/nfs/dbraw/zinc/31/62/25/410316225.db2.gz	UZWCWBRYIQEHCE-ZDUSSCGKSA-N	1	1	319.361	1.669	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c1	ZINC000351996693	410400405	/nfs/dbraw/zinc/40/04/05/410400405.db2.gz	PHPCKWJNSDOLKD-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)c(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c1	ZINC000351996693	410400411	/nfs/dbraw/zinc/40/04/11/410400411.db2.gz	PHPCKWJNSDOLKD-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCOC1	ZINC000299246226	410580431	/nfs/dbraw/zinc/58/04/31/410580431.db2.gz	KLLWCTKJRBVDIQ-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H]1CCCOC1	ZINC000352195737	410538672	/nfs/dbraw/zinc/53/86/72/410538672.db2.gz	TWDUIFNLKKUHEL-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H]1CCCOC1	ZINC000352195737	410538677	/nfs/dbraw/zinc/53/86/77/410538677.db2.gz	TWDUIFNLKKUHEL-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600205	410815624	/nfs/dbraw/zinc/81/56/24/410815624.db2.gz	FQIZJXFWBXMKHV-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600205	410815629	/nfs/dbraw/zinc/81/56/29/410815629.db2.gz	FQIZJXFWBXMKHV-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600205	410815637	/nfs/dbraw/zinc/81/56/37/410815637.db2.gz	FQIZJXFWBXMKHV-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600205	410815642	/nfs/dbraw/zinc/81/56/42/410815642.db2.gz	FQIZJXFWBXMKHV-ZJUUUORDSA-N	1	1	309.370	1.435	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301953349	410836346	/nfs/dbraw/zinc/83/63/46/410836346.db2.gz	CRRGJRRINQBJNB-LLVKDONJSA-N	1	1	304.354	1.924	20	5		DDBDMO
CC[N@H+]1CCCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000302117852	410839906	/nfs/dbraw/zinc/83/99/06/410839906.db2.gz	WUYBNHUOARYGID-UHFFFAOYSA-N	1	1	307.350	1.913	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000330675665	410869197	/nfs/dbraw/zinc/86/91/97/410869197.db2.gz	SOFMGYCPAIBAKL-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@@H]4C3)nc2c1	ZINC000344041288	410914285	/nfs/dbraw/zinc/91/42/85/410914285.db2.gz	IEIFVKSIBZPONF-NDMJEZRESA-N	1	1	303.318	1.939	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](CN3CCOCC3)C2)cs1	ZINC000129480178	196052254	/nfs/dbraw/zinc/05/22/54/196052254.db2.gz	NAXQNTKGOAVSGW-GFCCVEGCSA-N	1	1	311.407	1.810	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](CN3CCOCC3)C2)cs1	ZINC000129480178	196052256	/nfs/dbraw/zinc/05/22/56/196052256.db2.gz	NAXQNTKGOAVSGW-GFCCVEGCSA-N	1	1	311.407	1.810	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H]4[C@H](CO)[C@H]4C3)co2)cc1	ZINC000366434650	418472163	/nfs/dbraw/zinc/47/21/63/418472163.db2.gz	LCEPZOZURYAACR-FICVDOATSA-N	1	1	315.329	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@H]4[C@H](CO)[C@H]4C3)co2)cc1	ZINC000366434650	418472164	/nfs/dbraw/zinc/47/21/64/418472164.db2.gz	LCEPZOZURYAACR-FICVDOATSA-N	1	1	315.329	1.920	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000366907709	418535210	/nfs/dbraw/zinc/53/52/10/418535210.db2.gz	BEPIGPRCFAWMFM-GFCCVEGCSA-N	1	1	311.357	1.622	20	5		DDBDMO
CO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000360997254	418562355	/nfs/dbraw/zinc/56/23/55/418562355.db2.gz	FUHRKIWPZCWMME-HUUCEWRRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)n1	ZINC000191633122	222106443	/nfs/dbraw/zinc/10/64/43/222106443.db2.gz	TWCQAYSQYPHLMQ-GHMZBOCLSA-N	1	1	309.370	1.366	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000361414271	418648189	/nfs/dbraw/zinc/64/81/89/418648189.db2.gz	ILSFYHKNTIMSRU-RISCZKNCSA-N	1	1	310.350	1.180	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@](C)(C(N)=O)C1	ZINC000361569344	418680558	/nfs/dbraw/zinc/68/05/58/418680558.db2.gz	YDMYTSPGMMIUQO-HNNXBMFYSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000361569344	418680560	/nfs/dbraw/zinc/68/05/60/418680560.db2.gz	YDMYTSPGMMIUQO-HNNXBMFYSA-N	1	1	320.349	1.039	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H]1CO	ZINC000361658075	418697474	/nfs/dbraw/zinc/69/74/74/418697474.db2.gz	XEWVWXRPWDWGSL-GWCFXTLKSA-N	1	1	308.334	1.522	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000364621815	418794296	/nfs/dbraw/zinc/79/42/96/418794296.db2.gz	FBMXTYVBVSNCEX-PRULPYPASA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000364621815	418794297	/nfs/dbraw/zinc/79/42/97/418794297.db2.gz	FBMXTYVBVSNCEX-PRULPYPASA-N	1	1	309.391	1.522	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[C@@H]1c1cccs1	ZINC000364621815	418794301	/nfs/dbraw/zinc/79/43/01/418794301.db2.gz	FBMXTYVBVSNCEX-PRULPYPASA-N	1	1	309.391	1.522	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000372943699	418914817	/nfs/dbraw/zinc/91/48/17/418914817.db2.gz	CFPNLPUTFBOTBO-KGLIPLIRSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)C1	ZINC000411555766	419343054	/nfs/dbraw/zinc/34/30/54/419343054.db2.gz	WWYXCQOXYWRKAI-BYCMXARLSA-N	1	1	303.362	1.766	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000425044551	228353734	/nfs/dbraw/zinc/35/37/34/228353734.db2.gz	HZDWIOIERJUIHX-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC	ZINC000425974229	419376221	/nfs/dbraw/zinc/37/62/21/419376221.db2.gz	LGIUCRBQQWZHIJ-WDEREUQCSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C/C=C\c1ccccc1[N+](=O)[O-]	ZINC000418109210	419539067	/nfs/dbraw/zinc/53/90/67/419539067.db2.gz	HXOVKGSHVRNCKP-JFOCPDPESA-N	1	1	319.405	1.995	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000421709142	419692387	/nfs/dbraw/zinc/69/23/87/419692387.db2.gz	CRKWUVXYONEQRB-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
Cc1c(CC(=O)N(C)C[C@@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC000421711535	419699844	/nfs/dbraw/zinc/69/98/44/419699844.db2.gz	OPCJFYNAAXPLTL-AWEZNQCLSA-N	1	1	305.378	1.998	20	5		DDBDMO
CNc1nc(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000422032230	419817870	/nfs/dbraw/zinc/81/78/70/419817870.db2.gz	FCOASEBGMXDZJM-JTQLQIEISA-N	1	1	307.354	1.198	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](c2nnc[nH]2)C1	ZINC000425553547	420417910	/nfs/dbraw/zinc/41/79/10/420417910.db2.gz	UQQXAYIVEFIZGK-NSHDSACASA-N	1	1	303.322	1.711	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459511919	420834638	/nfs/dbraw/zinc/83/46/38/420834638.db2.gz	YMOXRNOFXYZTSN-UGFHNGPFSA-N	1	1	319.361	1.554	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000459511919	420834639	/nfs/dbraw/zinc/83/46/39/420834639.db2.gz	YMOXRNOFXYZTSN-UGFHNGPFSA-N	1	1	319.361	1.554	20	5		DDBDMO
CCOC[C@H]1CCCC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000459706770	420852300	/nfs/dbraw/zinc/85/23/00/420852300.db2.gz	JEAHJLPCSPMOSU-TZMCWYRMSA-N	1	1	312.370	1.043	20	5		DDBDMO
COc1ccc(C[N@H+]2[C@@H]3CC[C@H]2CN(C)C(=O)C3)cc1[N+](=O)[O-]	ZINC000449652296	421045936	/nfs/dbraw/zinc/04/59/36/421045936.db2.gz	XZBJLXYLXYDYJZ-OLZOCXBDSA-N	1	1	319.361	1.799	20	5		DDBDMO
COc1ccc(C[N@@H+]2[C@@H]3CC[C@H]2CN(C)C(=O)C3)cc1[N+](=O)[O-]	ZINC000449652296	421045938	/nfs/dbraw/zinc/04/59/38/421045938.db2.gz	XZBJLXYLXYDYJZ-OLZOCXBDSA-N	1	1	319.361	1.799	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CNC[C@@H]1CCC[N@@H+]1CCCO	ZINC000449388183	421002110	/nfs/dbraw/zinc/00/21/10/421002110.db2.gz	OKTJBKFWSJBDPO-INIZCTEOSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CNC[C@@H]1CCC[N@H+]1CCCO	ZINC000449388183	421002111	/nfs/dbraw/zinc/00/21/11/421002111.db2.gz	OKTJBKFWSJBDPO-INIZCTEOSA-N	1	1	307.394	1.840	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000449696251	421061744	/nfs/dbraw/zinc/06/17/44/421061744.db2.gz	KCALNIBYFNQFIW-HNNXBMFYSA-N	1	1	310.350	1.434	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450442791	421198410	/nfs/dbraw/zinc/19/84/10/421198410.db2.gz	YOSLQIFGEUMMFE-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548386066	421431352	/nfs/dbraw/zinc/43/13/52/421431352.db2.gz	YGYPHONTTFSNJH-GHMZBOCLSA-N	1	1	321.381	1.422	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000563053546	421446605	/nfs/dbraw/zinc/44/66/05/421446605.db2.gz	ZAPJSTGAPBZCPQ-LLVKDONJSA-N	1	1	313.379	1.140	20	5		DDBDMO
CCc1ccc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000563053546	421446608	/nfs/dbraw/zinc/44/66/08/421446608.db2.gz	ZAPJSTGAPBZCPQ-LLVKDONJSA-N	1	1	313.379	1.140	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000553556999	421620895	/nfs/dbraw/zinc/62/08/95/421620895.db2.gz	QQTHRDVLZRLAFE-LBPRGKRZSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000531630389	421639755	/nfs/dbraw/zinc/63/97/55/421639755.db2.gz	POOIWYJSKHMULE-UHFFFAOYSA-N	1	1	306.366	1.936	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000554599989	421654203	/nfs/dbraw/zinc/65/42/03/421654203.db2.gz	PUMHFNUTXAJVQW-NSHDSACASA-N	1	1	309.370	1.275	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC[C@H](O)C[N@@H+](C)C1CC1	ZINC000574982697	422227897	/nfs/dbraw/zinc/22/78/97/422227897.db2.gz	HVIOKZCMDZKOCE-AWEZNQCLSA-N	1	1	309.366	1.148	20	5		DDBDMO
NC1(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)CCOCC1	ZINC000600712337	422412334	/nfs/dbraw/zinc/41/23/34/422412334.db2.gz	WWNDUXYYXMNSHK-STQMWFEESA-N	1	1	323.397	1.373	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000108562518	270966947	/nfs/dbraw/zinc/96/69/47/270966947.db2.gz	UQLZLLIEQYMZGI-CQSZACIVSA-N	1	1	320.393	1.778	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000345913770	272363388	/nfs/dbraw/zinc/36/33/88/272363388.db2.gz	WANITMJPBZLHSB-WDEREUQCSA-N	1	1	309.370	1.041	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000345995707	272385259	/nfs/dbraw/zinc/38/52/59/272385259.db2.gz	UKJCQTJZEKFKLP-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C	ZINC000346185030	272435017	/nfs/dbraw/zinc/43/50/17/272435017.db2.gz	GNBHNVMYNZQDTE-CHWSQXEVSA-N	1	1	308.382	1.171	20	5		DDBDMO
CC(=O)c1ccc(N2CC[NH+](CC(C)(C)O)CC2)c([N+](=O)[O-])c1	ZINC000301202234	273496427	/nfs/dbraw/zinc/49/64/27/273496427.db2.gz	WYABLOZBLSPULM-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1	ZINC000276597980	274271961	/nfs/dbraw/zinc/27/19/61/274271961.db2.gz	KEWIEPNPZRIBAO-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000278773940	275033597	/nfs/dbraw/zinc/03/35/97/275033597.db2.gz	VDLDPPNDANTFIS-UHFFFAOYSA-N	1	1	308.729	1.693	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000266464781	281194108	/nfs/dbraw/zinc/19/41/08/281194108.db2.gz	ANTVJYIWWLQXLU-WDEREUQCSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464781	281194109	/nfs/dbraw/zinc/19/41/09/281194109.db2.gz	ANTVJYIWWLQXLU-WDEREUQCSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000266464781	281194111	/nfs/dbraw/zinc/19/41/11/281194111.db2.gz	ANTVJYIWWLQXLU-WDEREUQCSA-N	1	1	307.354	1.325	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000354201872	298361410	/nfs/dbraw/zinc/36/14/10/298361410.db2.gz	YTBFUOYMUASTKP-NSHDSACASA-N	1	1	309.370	1.558	20	5		DDBDMO
C[C@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000362931671	300181650	/nfs/dbraw/zinc/18/16/50/300181650.db2.gz	RWJLHNYEROKIGY-NHYWBVRUSA-N	1	1	303.362	1.677	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000364454396	300399376	/nfs/dbraw/zinc/39/93/76/300399376.db2.gz	KPTBXFIEPGQNKN-ARFHVFGLSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000364454396	300399379	/nfs/dbraw/zinc/39/93/79/300399379.db2.gz	KPTBXFIEPGQNKN-ARFHVFGLSA-N	1	1	317.389	1.823	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000364454396	300399382	/nfs/dbraw/zinc/39/93/82/300399382.db2.gz	KPTBXFIEPGQNKN-ARFHVFGLSA-N	1	1	317.389	1.823	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@@H]2CC[N@H+](C)[C@H]2C1	ZINC000368595230	301061543	/nfs/dbraw/zinc/06/15/43/301061543.db2.gz	SIERBSLNASWEIP-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
Cc1nc(N2CCC[N@@H+](CCN(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000370531471	301358063	/nfs/dbraw/zinc/35/80/63/301358063.db2.gz	PPPXQZFSDKHVFD-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
Cc1nc(N2CCC[N@H+](CCN(C)C)CC2)ccc1[N+](=O)[O-]	ZINC000370531471	301358065	/nfs/dbraw/zinc/35/80/65/301358065.db2.gz	PPPXQZFSDKHVFD-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1	ZINC000375987996	302019738	/nfs/dbraw/zinc/01/97/38/302019738.db2.gz	YRXKEIXKGWPANK-OAHLLOKOSA-N	1	1	321.377	1.316	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1	ZINC000375987996	302019740	/nfs/dbraw/zinc/01/97/40/302019740.db2.gz	YRXKEIXKGWPANK-OAHLLOKOSA-N	1	1	321.377	1.316	20	5		DDBDMO
COCC(C)(C)[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000429274588	302387725	/nfs/dbraw/zinc/38/77/25/302387725.db2.gz	SUHPMQZQQOBGRC-ZDUSSCGKSA-N	1	1	312.366	1.691	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCC[C@@H](C)C1	ZINC000532134267	303276211	/nfs/dbraw/zinc/27/62/11/303276211.db2.gz	VLVVJCLGMXDMNM-VXGBXAGGSA-N	1	1	306.366	1.840	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000538709535	303389159	/nfs/dbraw/zinc/38/91/59/303389159.db2.gz	LQYMPADZIKMSRL-JTQLQIEISA-N	1	1	321.333	1.395	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H]([C@@H]2CCOC2)C1	ZINC000367142503	307087063	/nfs/dbraw/zinc/08/70/63/307087063.db2.gz	XKUSYUFGUVJORP-QWHCGFSZSA-N	1	1	307.350	1.115	20	5		DDBDMO
O=C1OCC[C@H]1CC[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369004143	307114347	/nfs/dbraw/zinc/11/43/47/307114347.db2.gz	YNPZAOVNUMJLEU-NEPJUHHUSA-N	1	1	308.338	1.381	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1	ZINC000374050601	307200933	/nfs/dbraw/zinc/20/09/33/307200933.db2.gz	LAKQLEVAURMBGN-OAHLLOKOSA-N	1	1	319.361	1.593	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)N2CCc3c2cccc3[N+](=O)[O-])C1	ZINC000374050601	307200934	/nfs/dbraw/zinc/20/09/34/307200934.db2.gz	LAKQLEVAURMBGN-OAHLLOKOSA-N	1	1	319.361	1.593	20	5		DDBDMO
C[C@H]1COCC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327761	307205861	/nfs/dbraw/zinc/20/58/61/307205861.db2.gz	IORIEYDAQSQEDX-DOMZBBRYSA-N	1	1	319.361	1.668	20	5		DDBDMO
C[C@H]1COCC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000374327761	307205862	/nfs/dbraw/zinc/20/58/62/307205862.db2.gz	IORIEYDAQSQEDX-DOMZBBRYSA-N	1	1	319.361	1.668	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@@H]2C[N@@H+]2CCC[C@@H]2CO)s1	ZINC000374490955	307209100	/nfs/dbraw/zinc/20/91/00/307209100.db2.gz	XWLYQRBPCMUFOL-GHMZBOCLSA-N	1	1	312.395	1.477	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488376	307289235	/nfs/dbraw/zinc/28/92/35/307289235.db2.gz	AUPCEZWOSJWTOI-XZDPQHSOSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000378488376	307289236	/nfs/dbraw/zinc/28/92/36/307289236.db2.gz	AUPCEZWOSJWTOI-XZDPQHSOSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000378488376	307289237	/nfs/dbraw/zinc/28/92/37/307289237.db2.gz	AUPCEZWOSJWTOI-XZDPQHSOSA-N	1	1	317.389	1.678	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CC[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000582530249	337105471	/nfs/dbraw/zinc/10/54/71/337105471.db2.gz	MEGHEPXOYKGIJW-SNVBAGLBSA-N	1	1	307.354	1.103	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)CC1	ZINC000582540756	337106855	/nfs/dbraw/zinc/10/68/55/337106855.db2.gz	DEXFVEHDGNOSAL-UHFFFAOYSA-N	1	1	324.381	1.116	20	5		DDBDMO
CN(C)c1[nH+]cc(CN2CCc3c(cccc3[N+](=O)[O-])C2)n1C	ZINC000583259354	337292564	/nfs/dbraw/zinc/29/25/64/337292564.db2.gz	PNKIKKCFFYFSCA-UHFFFAOYSA-N	1	1	315.377	1.953	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H](n3cncn3)C2)c1	ZINC000372370479	483933260	/nfs/dbraw/zinc/93/32/60/483933260.db2.gz	UBSAKUIZRVSRHK-ZIAGYGMSSA-N	1	1	303.322	1.167	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCCC[N@H+]2CCO)c1	ZINC000452391875	534318049	/nfs/dbraw/zinc/31/80/49/534318049.db2.gz	QQDXVDVQXUWGKZ-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccnc1	ZINC000182887136	525519929	/nfs/dbraw/zinc/51/99/29/525519929.db2.gz	WQJWQCDDPWROEW-SNVBAGLBSA-N	1	1	300.318	1.940	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1COC1	ZINC000451284266	528399859	/nfs/dbraw/zinc/39/98/59/528399859.db2.gz	IIMLKDYLIUGITB-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
CCOCC[C@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000444657233	528870088	/nfs/dbraw/zinc/87/00/88/528870088.db2.gz	KBVXXSFWOBKWDQ-OCCSQVGLSA-N	1	1	324.381	1.264	20	5		DDBDMO
CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000330930554	529098899	/nfs/dbraw/zinc/09/88/99/529098899.db2.gz	PRPHRYSDOXCDLX-WCQYABFASA-N	1	1	323.397	1.371	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000797415229	700008394	/nfs/dbraw/zinc/00/83/94/700008394.db2.gz	SSYYQQVFUSXVGU-OAHLLOKOSA-N	1	1	317.349	1.360	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCS(=O)(=O)C1	ZINC000050443031	696231951	/nfs/dbraw/zinc/23/19/51/696231951.db2.gz	YBPCQTAXAQTDND-JTQLQIEISA-N	1	1	304.755	1.525	20	5		DDBDMO
CCOC(=O)CC[C@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000154869945	696938479	/nfs/dbraw/zinc/93/84/79/696938479.db2.gz	IYYQVUFEOAUZJA-GFCCVEGCSA-N	1	1	310.354	1.804	20	5		DDBDMO
CCOC(=O)CC[C@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000154869945	696938482	/nfs/dbraw/zinc/93/84/82/696938482.db2.gz	IYYQVUFEOAUZJA-GFCCVEGCSA-N	1	1	310.354	1.804	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@@H](n4cncn4)C3)c2c1	ZINC000776778466	698139337	/nfs/dbraw/zinc/13/93/37/698139337.db2.gz	UUCIZJMBQGTZFD-CYBMUJFWSA-N	1	1	313.321	1.441	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@@H](n4cncn4)C3)c2c1	ZINC000776778466	698139339	/nfs/dbraw/zinc/13/93/39/698139339.db2.gz	UUCIZJMBQGTZFD-CYBMUJFWSA-N	1	1	313.321	1.441	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637351	699820677	/nfs/dbraw/zinc/82/06/77/699820677.db2.gz	WINGXHOGAYGTTE-GHMZBOCLSA-N	1	1	321.333	1.696	20	5		DDBDMO
C[C@@H](O)C[C@H]1CCC[N@H+]1Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794637351	699820680	/nfs/dbraw/zinc/82/06/80/699820680.db2.gz	WINGXHOGAYGTTE-GHMZBOCLSA-N	1	1	321.333	1.696	20	5		DDBDMO
CC[N@@H+](CCc1ccccn1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000744389666	699947530	/nfs/dbraw/zinc/94/75/30/699947530.db2.gz	JYSBOQMZANVFFS-HNNXBMFYSA-N	1	1	319.365	1.112	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000801552130	700320012	/nfs/dbraw/zinc/32/00/12/700320012.db2.gz	ZJUTUNPUVVKBJF-GFCCVEGCSA-N	1	1	300.330	1.952	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000801552130	700320016	/nfs/dbraw/zinc/32/00/16/700320016.db2.gz	ZJUTUNPUVVKBJF-GFCCVEGCSA-N	1	1	300.330	1.952	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758285998	700696616	/nfs/dbraw/zinc/69/66/16/700696616.db2.gz	RBFCQABBVYGADP-MNOVXSKESA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](C)[C@H](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000758285998	700696618	/nfs/dbraw/zinc/69/66/18/700696618.db2.gz	RBFCQABBVYGADP-MNOVXSKESA-N	1	1	309.341	2.000	20	5		DDBDMO
Cc1c(NC(=O)CCN2CC[N@@H+](C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761074561	700838927	/nfs/dbraw/zinc/83/89/27/700838927.db2.gz	CRUHNLGPUIYJJU-LBPRGKRZSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCN(C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761074561	700838930	/nfs/dbraw/zinc/83/89/30/700838930.db2.gz	CRUHNLGPUIYJJU-LBPRGKRZSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCN(C)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000761074561	700838933	/nfs/dbraw/zinc/83/89/33/700838933.db2.gz	CRUHNLGPUIYJJU-LBPRGKRZSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000804381102	701184332	/nfs/dbraw/zinc/18/43/32/701184332.db2.gz	KDKFQEMZKZUGIB-SNVBAGLBSA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000804381102	701184335	/nfs/dbraw/zinc/18/43/35/701184335.db2.gz	KDKFQEMZKZUGIB-SNVBAGLBSA-N	1	1	322.321	1.669	20	5		DDBDMO
C[C@@H]1OCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000867970144	701862952	/nfs/dbraw/zinc/86/29/52/701862952.db2.gz	WWQQIXYKRLNUPJ-PGUXBMHVSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[C@@H]1CN(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C(=O)[C@H]1C	ZINC000840058942	701944330	/nfs/dbraw/zinc/94/43/30/701944330.db2.gz	YINZDZRBVSSARF-NEPJUHHUSA-N	1	1	321.381	1.500	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1	ZINC000812331406	702156024	/nfs/dbraw/zinc/15/60/24/702156024.db2.gz	GEWCUHIOLPLCAS-OLZOCXBDSA-N	1	1	303.362	1.927	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@@H](CO)[C@H]2CO)ccc1[N+](=O)[O-]	ZINC000879364958	706662724	/nfs/dbraw/zinc/66/27/24/706662724.db2.gz	ZJJFBQJMNYSSEN-DZGCQCFKSA-N	1	1	324.377	1.559	20	5		DDBDMO
C[C@@H]1CN(Cc2cc(F)ccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1CCO	ZINC000842160835	702678280	/nfs/dbraw/zinc/67/82/80/702678280.db2.gz	AJMTWPHLFCHMIR-NEPJUHHUSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])CC1	ZINC000845483308	703162799	/nfs/dbraw/zinc/16/27/99/703162799.db2.gz	LUFDYIOJIROUFJ-VIFPVBQESA-N	1	1	317.748	1.890	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000852462034	704054075	/nfs/dbraw/zinc/05/40/75/704054075.db2.gz	DVBMLBUWUZIDOQ-OAGGEKHMSA-N	1	1	306.362	1.987	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000820272081	704250325	/nfs/dbraw/zinc/25/03/25/704250325.db2.gz	JGIOFBOYOXQOLY-ARLBYUKCSA-N	1	1	315.373	1.861	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](Cn1ncc3cc([N+](=O)[O-])ccc31)C2	ZINC000853565545	704271959	/nfs/dbraw/zinc/27/19/59/704271959.db2.gz	HBZNGGOPEKKTDR-WFASDCNBSA-N	1	1	302.334	1.870	20	5		DDBDMO
O=[N+]([O-])c1c(F)cccc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000853966061	704341815	/nfs/dbraw/zinc/34/18/15/704341815.db2.gz	OJKQAYIGDGTFDD-LBPRGKRZSA-N	1	1	309.341	1.769	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)c1	ZINC000859888455	705030792	/nfs/dbraw/zinc/03/07/92/705030792.db2.gz	CTVTWRWJGBRGTR-CQHMPISHSA-N	1	1	324.402	1.614	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825378901	705657914	/nfs/dbraw/zinc/65/79/14/705657914.db2.gz	IXCDWRQYSZWIDU-BXUZGUMPSA-N	1	1	307.350	1.086	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)N[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000825516808	705685162	/nfs/dbraw/zinc/68/51/62/705685162.db2.gz	BZNKDTUXRGIELF-JTQLQIEISA-N	1	1	324.356	1.624	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000862794086	705799645	/nfs/dbraw/zinc/79/96/45/705799645.db2.gz	WHCSEKRSFCUHTG-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ncc(C)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000826632670	705830584	/nfs/dbraw/zinc/83/05/84/705830584.db2.gz	KJCIIHZLGNBSCP-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321189	705974767	/nfs/dbraw/zinc/97/47/67/705974767.db2.gz	USKDPSJOXSECDK-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321189	705974769	/nfs/dbraw/zinc/97/47/69/705974769.db2.gz	USKDPSJOXSECDK-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827321189	705974771	/nfs/dbraw/zinc/97/47/71/705974771.db2.gz	USKDPSJOXSECDK-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H](O)[C@@H](O)C3)o2)cc1	ZINC000877748900	706198021	/nfs/dbraw/zinc/19/80/21/706198021.db2.gz	MAMJUNYPHFAXLM-CABCVRRESA-N	1	1	318.329	1.782	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)C[C@@H]21	ZINC000828987849	706269242	/nfs/dbraw/zinc/26/92/42/706269242.db2.gz	MILATVXCDXSPJQ-ABAIWWIYSA-N	1	1	316.361	1.620	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000879963213	706836515	/nfs/dbraw/zinc/83/65/15/706836515.db2.gz	HFZJRASPROHBAM-GFCCVEGCSA-N	1	1	309.366	1.239	20	5		DDBDMO
CC(C)C[C@@H](C(N)=O)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000880588428	707029361	/nfs/dbraw/zinc/02/93/61/707029361.db2.gz	VKFNAUSSHQMVJX-AWEZNQCLSA-N	1	1	309.366	1.805	20	5		DDBDMO
CN1CCCC[C@H]([N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265670	707355387	/nfs/dbraw/zinc/35/53/87/707355387.db2.gz	VALIDUBPBXBUIY-LSDHHAIUSA-N	1	1	321.377	1.571	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265670	707355388	/nfs/dbraw/zinc/35/53/88/707355388.db2.gz	VALIDUBPBXBUIY-LSDHHAIUSA-N	1	1	321.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(CO)(CO)CC3)c2c1	ZINC000872677273	707554561	/nfs/dbraw/zinc/55/45/61/707554561.db2.gz	LJMJTNDYWOBXTQ-UHFFFAOYSA-N	1	1	317.345	1.714	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000882545525	707689935	/nfs/dbraw/zinc/68/99/35/707689935.db2.gz	IRGPGBGCLFYQDU-NWDGAFQWSA-N	1	1	305.334	1.053	20	5		DDBDMO
C[N@@H+](CCNc1c(F)cccc1[N+](=O)[O-])CCOCCO	ZINC000882951865	707867817	/nfs/dbraw/zinc/86/78/17/707867817.db2.gz	YLMGDUATTKSAOJ-UHFFFAOYSA-N	1	1	301.318	1.087	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000897220528	708258647	/nfs/dbraw/zinc/25/86/47/708258647.db2.gz	XCDXIFYUDIIXLQ-HUUCEWRRSA-N	1	1	309.341	1.769	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c1	ZINC000897221125	708259320	/nfs/dbraw/zinc/25/93/20/708259320.db2.gz	HMEGXJYBBURCKT-QWHCGFSZSA-N	1	1	306.366	1.212	20	5		DDBDMO
Cc1ccc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897222600	708259990	/nfs/dbraw/zinc/25/99/90/708259990.db2.gz	WCXCMIPNHGEWCN-KGLIPLIRSA-N	1	1	305.378	1.939	20	5		DDBDMO
COc1nn(C)cc1C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000898027900	708522353	/nfs/dbraw/zinc/52/23/53/708522353.db2.gz	CQOJXDQZFIMCEK-UHFFFAOYSA-N	1	1	306.322	1.635	20	5		DDBDMO
CN(C)C(=O)CC1CC[NH+](Cc2cccnc2[N+](=O)[O-])CC1	ZINC000886120604	708701803	/nfs/dbraw/zinc/70/18/03/708701803.db2.gz	JFMATFGDRACTNE-UHFFFAOYSA-N	1	1	306.366	1.680	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1cccnc1[N+](=O)[O-]	ZINC000886157758	708707619	/nfs/dbraw/zinc/70/76/19/708707619.db2.gz	KFGJKHKYDKQAQJ-LBPRGKRZSA-N	1	1	308.382	1.267	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000912612519	713050270	/nfs/dbraw/zinc/05/02/70/713050270.db2.gz	RTHOHRHENVZOGH-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@@H](c3ncccn3)C2)c([N+](=O)[O-])n1	ZINC000886690625	708814999	/nfs/dbraw/zinc/81/49/99/708814999.db2.gz	ZCZLNZFXNWVCCP-LLVKDONJSA-N	1	1	302.338	1.498	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](c3ncccn3)C2)c([N+](=O)[O-])n1	ZINC000886690625	708815001	/nfs/dbraw/zinc/81/50/01/708815001.db2.gz	ZCZLNZFXNWVCCP-LLVKDONJSA-N	1	1	302.338	1.498	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)ccc1[N+](=O)[O-]	ZINC000887934705	709170642	/nfs/dbraw/zinc/17/06/42/709170642.db2.gz	RIIMWUNMHUKSCD-BLLLJJGKSA-N	1	1	319.361	1.627	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000900267537	709512662	/nfs/dbraw/zinc/51/26/62/709512662.db2.gz	HQYHBQJVYCXDMH-PSOPSSQASA-N	1	1	307.350	1.227	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000890082150	709740447	/nfs/dbraw/zinc/74/04/47/709740447.db2.gz	RSEFMSSHZXYRCB-UHFFFAOYSA-N	1	1	321.377	1.822	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@H](c2[nH+]ccn2C)C1	ZINC000892984676	710536664	/nfs/dbraw/zinc/53/66/64/710536664.db2.gz	FIRKGUYRMJMOEG-SNVBAGLBSA-N	1	1	303.322	1.726	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000928453737	713204239	/nfs/dbraw/zinc/20/42/39/713204239.db2.gz	PVXJLFAKZKTQIB-GXSJLCMTSA-N	1	1	321.333	1.188	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000928455746	713204389	/nfs/dbraw/zinc/20/43/89/713204389.db2.gz	UMMYINBGMWZOOQ-MFKMUULPSA-N	1	1	306.366	1.483	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000902418425	710747554	/nfs/dbraw/zinc/74/75/54/710747554.db2.gz	LQZSZYHCRBKKEE-LBPRGKRZSA-N	1	1	318.333	1.787	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000902418425	710747557	/nfs/dbraw/zinc/74/75/57/710747557.db2.gz	LQZSZYHCRBKKEE-LBPRGKRZSA-N	1	1	318.333	1.787	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000913537190	713249009	/nfs/dbraw/zinc/24/90/09/713249009.db2.gz	BEDZHJBYPGYZFT-TXEJJXNPSA-N	1	1	314.345	1.995	20	5		DDBDMO
O=c1[nH]ccc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c1[N+](=O)[O-]	ZINC000895570436	711545587	/nfs/dbraw/zinc/54/55/87/711545587.db2.gz	SYKVXOBFCDZVIF-ONGXEEELSA-N	1	1	310.379	1.687	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000895709031	711584831	/nfs/dbraw/zinc/58/48/31/711584831.db2.gz	XWXIMQXMKJXXKP-VOKGJARPSA-N	1	1	306.318	1.218	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000895709031	711584834	/nfs/dbraw/zinc/58/48/34/711584834.db2.gz	XWXIMQXMKJXXKP-VOKGJARPSA-N	1	1	306.318	1.218	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNc1ccc([N+](=O)[O-])cc1N1CCOC1=O	ZINC000895772278	711602453	/nfs/dbraw/zinc/60/24/53/711602453.db2.gz	ZYXTUVJTQIPHRH-LLVKDONJSA-N	1	1	306.322	1.667	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCO1	ZINC000905740082	712135682	/nfs/dbraw/zinc/13/56/82/712135682.db2.gz	QOKGLQJXUDJCHC-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCO1	ZINC000905740082	712135683	/nfs/dbraw/zinc/13/56/83/712135683.db2.gz	QOKGLQJXUDJCHC-GFCCVEGCSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000930916134	713958165	/nfs/dbraw/zinc/95/81/65/713958165.db2.gz	NJSYFAHHVAZXLF-LALPHHSUSA-N	1	1	321.377	1.948	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCOc1cc(C)ccc1[N+](=O)[O-]	ZINC000922164753	713980141	/nfs/dbraw/zinc/98/01/41/713980141.db2.gz	RHRWMDDCHAYKRJ-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCn2cc[nH+]c21	ZINC000931521725	714118468	/nfs/dbraw/zinc/11/84/68/714118468.db2.gz	OCZYFJPWNFYPKC-NSHDSACASA-N	1	1	304.306	1.051	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CC[C@H]3[C@@H]2CCC[N@@H+]3CCO)c1	ZINC000934255650	714776424	/nfs/dbraw/zinc/77/64/24/714776424.db2.gz	UYKMPXXWQJCOLF-HOTGVXAUSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@H]2CCC[N@@H+]3CCO)c(F)c1	ZINC000934257579	714777097	/nfs/dbraw/zinc/77/70/97/714777097.db2.gz	AMTVHBOVCKWFIH-CVEARBPZSA-N	1	1	323.368	1.765	20	5		DDBDMO
Cc1cc(Cl)c([N+](=O)[O-])c(N2C[C@@H]3[C@H](C2)OCC[N@@H+]3C)n1	ZINC001164664954	719386261	/nfs/dbraw/zinc/38/62/61/719386261.db2.gz	DCKYTSDPZIORCL-MNOVXSKESA-N	1	1	312.757	1.471	20	5		DDBDMO
COc1ccc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001022064128	734369156	/nfs/dbraw/zinc/36/91/56/734369156.db2.gz	XKHQPPYEWWEVAF-AYRXBEOTSA-N	1	1	319.361	1.097	20	5		DDBDMO
Cc1cc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)oc1C	ZINC001125696986	735254298	/nfs/dbraw/zinc/25/42/98/735254298.db2.gz	XSWFNJQWJRHRHL-UHFFFAOYSA-N	1	1	321.337	1.058	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000197045253	751357401	/nfs/dbraw/zinc/35/74/01/751357401.db2.gz	ZFTLUCAFHTWABO-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC(C)(F)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC001025649149	736808624	/nfs/dbraw/zinc/80/86/24/736808624.db2.gz	DHQPXSWVYUFBJS-IMRBUKKESA-N	1	1	321.352	1.889	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1	ZINC001029305295	740551358	/nfs/dbraw/zinc/55/13/58/740551358.db2.gz	WZNXKQQAYMIZCN-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCCC1	ZINC001029305295	740551361	/nfs/dbraw/zinc/55/13/61/740551361.db2.gz	WZNXKQQAYMIZCN-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCCC1	ZINC001029305295	740551365	/nfs/dbraw/zinc/55/13/65/740551365.db2.gz	WZNXKQQAYMIZCN-LXTVHRRPSA-N	1	1	307.394	1.517	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(C2CC2)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936687	742843354	/nfs/dbraw/zinc/84/33/54/742843354.db2.gz	QNVWCHKUDWDVRO-HUUCEWRRSA-N	1	1	303.362	1.435	20	5		DDBDMO
O=C(NCC1C[NH+](CCC2CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031662271	747336353	/nfs/dbraw/zinc/33/63/53/747336353.db2.gz	ZWCNLFKCGHSZQU-HUUCEWRRSA-N	1	1	309.410	1.670	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2ccccn2)CC1	ZINC000997767614	751267447	/nfs/dbraw/zinc/26/74/47/751267447.db2.gz	IODYWHMTNPTDJB-HUUCEWRRSA-N	1	1	318.377	1.075	20	5		DDBDMO
CC(C)NC(=O)N[C@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169052515	762208018	/nfs/dbraw/zinc/20/80/18/762208018.db2.gz	GSFVCUQYRVUDRY-MELADBBJSA-N	1	1	312.414	1.604	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)sn1	ZINC001086363087	761493072	/nfs/dbraw/zinc/49/30/72/761493072.db2.gz	AVCAZONRFHSKGR-FPQZTECRSA-N	1	1	324.406	1.101	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](CC1CCC1)CC2	ZINC001050516691	763694158	/nfs/dbraw/zinc/69/41/58/763694158.db2.gz	GSWDXHAFCHASRI-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2C[C@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328985	766253656	/nfs/dbraw/zinc/25/36/56/766253656.db2.gz	MRXPYYZXZXWRNB-RTXFEEFZSA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2C[C@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328985	766253664	/nfs/dbraw/zinc/25/36/64/766253664.db2.gz	MRXPYYZXZXWRNB-RTXFEEFZSA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@@H](CO)[C@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334308	766256431	/nfs/dbraw/zinc/25/64/31/766256431.db2.gz	CAJBUYDAPHSDCN-DETPVDSQSA-N	1	1	324.377	1.210	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](CO)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC001170334310	766256510	/nfs/dbraw/zinc/25/65/10/766256510.db2.gz	CAJBUYDAPHSDCN-GHJWDPDVSA-N	1	1	324.377	1.210	20	5		DDBDMO
CCOC(=O)C1=C(Nc2ncc([N+](=O)[O-])cc2OC)CC[NH2+]C1	ZINC001170513689	767729737	/nfs/dbraw/zinc/72/97/37/767729737.db2.gz	VRFXCNAOYHIKMA-UHFFFAOYSA-N	1	1	322.321	1.221	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC001133015245	769406791	/nfs/dbraw/zinc/40/67/91/769406791.db2.gz	YGRAFQXCQHWJFD-JTQLQIEISA-N	1	1	322.321	1.635	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC001133015245	769406800	/nfs/dbraw/zinc/40/68/00/769406800.db2.gz	YGRAFQXCQHWJFD-JTQLQIEISA-N	1	1	322.321	1.635	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCN(C)c1ccccc1[N+](=O)[O-]	ZINC001100240565	772012457	/nfs/dbraw/zinc/01/24/57/772012457.db2.gz	ABQTVBGWWLLYRL-UHFFFAOYSA-N	1	1	317.349	1.352	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N(C)CCNc1ncccc1[N+](=O)[O-]	ZINC001101634892	777331559	/nfs/dbraw/zinc/33/15/59/777331559.db2.gz	SFRKAHZKKLYBHB-UHFFFAOYSA-N	1	1	318.337	1.065	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC001116230210	780486896	/nfs/dbraw/zinc/48/68/96/780486896.db2.gz	URPUVMHRCBKOMS-MNOVXSKESA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1nc(N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)ncc1[N+](=O)[O-]	ZINC001119342777	781413510	/nfs/dbraw/zinc/41/35/10/781413510.db2.gz	LAYZBZHCMZPXDL-NSHDSACASA-N	1	1	321.381	1.383	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ncc([N+](=O)[O-])c3ccccc32)C1	ZINC001119413170	781442492	/nfs/dbraw/zinc/44/24/92/781442492.db2.gz	PBJHAYAPGGBKSI-HNNXBMFYSA-N	1	1	302.334	1.622	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)cc1	ZINC001267326084	837830787	/nfs/dbraw/zinc/83/07/87/837830787.db2.gz	PDVRSBMTLXLLPH-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
Cc1ccc(C[N@H+](CCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)cc1	ZINC001267326084	837830799	/nfs/dbraw/zinc/83/07/99/837830799.db2.gz	PDVRSBMTLXLLPH-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)cc1	ZINC001267326084	837830812	/nfs/dbraw/zinc/83/08/12/837830812.db2.gz	PDVRSBMTLXLLPH-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C)CC1(C)C	ZINC001156591812	863169575	/nfs/dbraw/zinc/16/95/75/863169575.db2.gz	ZGPLBJDQPAXIET-CYBMUJFWSA-N	1	1	306.366	1.707	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H]2[C@H](C1)CCC[N@H+]2C	ZINC001157259092	863689241	/nfs/dbraw/zinc/68/92/41/863689241.db2.gz	CQCIZUODGUGMID-GWCFXTLKSA-N	1	1	320.349	1.307	20	5		DDBDMO
CSc1ccc(C(=O)N2CC([NH2+]C3COC3)C2)cc1[N+](=O)[O-]	ZINC001157594558	863963971	/nfs/dbraw/zinc/96/39/71/863963971.db2.gz	KFKGPCNHVJHMCA-UHFFFAOYSA-N	1	1	323.374	1.130	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@@H+](C(C)C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC001158494593	864688841	/nfs/dbraw/zinc/68/88/41/864688841.db2.gz	KUCSDRPBTUZJES-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H]1CCC[N@H+]2C	ZINC001332401691	865813964	/nfs/dbraw/zinc/81/39/64/865813964.db2.gz	KHYRDRSRDPNIIW-HUUCEWRRSA-N	1	1	318.377	1.945	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[N@@H+]2CCC[C@H]2C1	ZINC001319941421	866394466	/nfs/dbraw/zinc/39/44/66/866394466.db2.gz	CFOQXEUBDQZACI-LBPRGKRZSA-N	1	1	305.334	1.611	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@H]2C1	ZINC001319941421	866394468	/nfs/dbraw/zinc/39/44/68/866394468.db2.gz	CFOQXEUBDQZACI-LBPRGKRZSA-N	1	1	305.334	1.611	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](C3CCC3)C2)n1	ZINC001161183198	866429867	/nfs/dbraw/zinc/42/98/67/866429867.db2.gz	QMNIDFUKPFFITJ-JTQLQIEISA-N	1	1	320.349	1.815	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC001335422074	868286451	/nfs/dbraw/zinc/28/64/51/868286451.db2.gz	QPNBIYDLVCBQAI-DZGCQCFKSA-N	1	1	318.377	1.483	20	5		DDBDMO
COc1nc(NCC[C@H]2CCC[N@@H+](C)C2)nc(C)c1[N+](=O)[O-]	ZINC001165261935	869475010	/nfs/dbraw/zinc/47/50/10/869475010.db2.gz	TVCQPBZZCNHDJN-LLVKDONJSA-N	1	1	309.370	1.846	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC001226294324	882332267	/nfs/dbraw/zinc/33/22/67/882332267.db2.gz	HOUIHUNQXMIEEB-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC001226294324	882332282	/nfs/dbraw/zinc/33/22/82/882332282.db2.gz	HOUIHUNQXMIEEB-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
COc1cccc(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC001338084766	869791334	/nfs/dbraw/zinc/79/13/34/869791334.db2.gz	SFRITYOSQOMIAC-WCQYABFASA-N	1	1	308.382	1.650	20	5		DDBDMO
Cc1[nH]c(CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)c(C)[nH+]1	ZINC001303890899	871164351	/nfs/dbraw/zinc/16/43/51/871164351.db2.gz	BNIXCWRXNGYAFC-UHFFFAOYSA-N	1	1	318.289	1.593	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001304002277	871177527	/nfs/dbraw/zinc/17/75/27/871177527.db2.gz	OTCHIDZTELYPJE-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001304002277	871177541	/nfs/dbraw/zinc/17/75/41/871177541.db2.gz	OTCHIDZTELYPJE-ZDUSSCGKSA-N	1	1	320.393	1.979	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC001340735209	871317126	/nfs/dbraw/zinc/31/71/26/871317126.db2.gz	JWSUNMMMAIWADB-QMTHXVAHSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC001340735209	871317157	/nfs/dbraw/zinc/31/71/57/871317157.db2.gz	JWSUNMMMAIWADB-QMTHXVAHSA-N	1	1	322.365	1.085	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCC(C)(C)CC1	ZINC001317448733	871337282	/nfs/dbraw/zinc/33/72/82/871337282.db2.gz	YPWLKNWJPGGGJI-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(C)(C)CC1	ZINC001317448733	871337304	/nfs/dbraw/zinc/33/73/04/871337304.db2.gz	YPWLKNWJPGGGJI-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(C)(C)CC1	ZINC001317448733	871337329	/nfs/dbraw/zinc/33/73/29/871337329.db2.gz	YPWLKNWJPGGGJI-ZIAGYGMSSA-N	1	1	311.426	1.916	20	5		DDBDMO
CCNC(=O)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)C	ZINC001205966971	871964444	/nfs/dbraw/zinc/96/44/44/871964444.db2.gz	GQYNCMNEJCYJDG-AWEZNQCLSA-N	1	1	320.349	1.986	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCC(N)=O)CC1	ZINC001319044039	872411561	/nfs/dbraw/zinc/41/15/61/872411561.db2.gz	OPDDAWLFUGWJPX-UHFFFAOYSA-N	1	1	323.349	1.070	20	5		DDBDMO
O=C([C@H]1[NH2+]CCc2occc21)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001353395010	877296671	/nfs/dbraw/zinc/29/66/71/877296671.db2.gz	WMJWTPDOMJESDI-HNNXBMFYSA-N	1	1	313.313	1.917	20	5		DDBDMO
CC(=O)Nc1cc(O[C@@H]2CC[N@@H+](C)C2)c(C(C)=O)cc1[N+](=O)[O-]	ZINC001229128985	883838047	/nfs/dbraw/zinc/83/80/47/883838047.db2.gz	GTYUDQKWDPQRGL-LLVKDONJSA-N	1	1	321.333	1.839	20	5		DDBDMO
CC(=O)Nc1cc(O[C@@H]2CC[N@H+](C)C2)c(C(C)=O)cc1[N+](=O)[O-]	ZINC001229128985	883838064	/nfs/dbraw/zinc/83/80/64/883838064.db2.gz	GTYUDQKWDPQRGL-LLVKDONJSA-N	1	1	321.333	1.839	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)C1	ZINC001233708756	887243995	/nfs/dbraw/zinc/24/39/95/887243995.db2.gz	ZTLAALKDTIWGBS-LLVKDONJSA-N	1	1	311.294	1.603	20	5		DDBDMO
CCCOCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001235137572	888431705	/nfs/dbraw/zinc/43/17/05/888431705.db2.gz	OOSMUQMEGIJWSF-UHFFFAOYSA-N	1	1	323.393	1.960	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CC(N3CC[C@H](F)C3)C1)C2	ZINC001254603504	896528561	/nfs/dbraw/zinc/52/85/61/896528561.db2.gz	NVMOEQDMTCQGRQ-ZFWWWQNUSA-N	1	1	305.353	1.790	20	5		DDBDMO
CN(C)C[C@@]12C[C@@H]1C[N@@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254608191	896530373	/nfs/dbraw/zinc/53/03/73/896530373.db2.gz	PGQNOMMONJWUSZ-DJIMGWMZSA-N	1	1	301.390	1.946	20	5		DDBDMO
CN(C)C[C@@]12C[C@@H]1C[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254608191	896530385	/nfs/dbraw/zinc/53/03/85/896530385.db2.gz	PGQNOMMONJWUSZ-DJIMGWMZSA-N	1	1	301.390	1.946	20	5		DDBDMO
Cc1c(C(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)cccc1[N+](=O)[O-]	ZINC001263980534	900854347	/nfs/dbraw/zinc/85/43/47/900854347.db2.gz	YCHIWWFHESJOCV-KWCYVHTRSA-N	1	1	303.362	1.973	20	5		DDBDMO
O=C(NCCC[N@@H+](Cc1cncs1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266135795	903004860	/nfs/dbraw/zinc/00/48/60/903004860.db2.gz	XWRGONRSUIDZRA-CHWSQXEVSA-N	1	1	324.406	1.279	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305762032	231043904	/nfs/dbraw/zinc/04/39/04/231043904.db2.gz	MLEXKCSERCMKIA-WBIUFABUSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305762032	231043907	/nfs/dbraw/zinc/04/39/07/231043907.db2.gz	MLEXKCSERCMKIA-WBIUFABUSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O	ZINC000451334531	231070753	/nfs/dbraw/zinc/07/07/53/231070753.db2.gz	BVFUGYKBVKEADN-SCRDCRAPSA-N	1	1	308.382	1.844	20	5		DDBDMO
C[N@@H+](CCCCCO)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000278728459	214359493	/nfs/dbraw/zinc/35/94/93/214359493.db2.gz	AQCOEQJYWBOFAF-CQSZACIVSA-N	1	1	312.366	1.429	20	5		DDBDMO
COC[C@@]1(CO)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000451924396	231233988	/nfs/dbraw/zinc/23/39/88/231233988.db2.gz	DOHMEUJJUVRXDI-HNNXBMFYSA-N	1	1	310.350	1.434	20	5		DDBDMO
C[C@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C(N)=O)C1	ZINC000249585272	282177931	/nfs/dbraw/zinc/17/79/31/282177931.db2.gz	SSHADDZWKUMIAL-SMDDNHRTSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@@H](C(N)=O)C1	ZINC000249585272	282177932	/nfs/dbraw/zinc/17/79/32/282177932.db2.gz	SSHADDZWKUMIAL-SMDDNHRTSA-N	1	1	307.350	1.559	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000451261676	529480600	/nfs/dbraw/zinc/48/06/00/529480600.db2.gz	WDGFJIVZOJCWDU-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000279281724	214761895	/nfs/dbraw/zinc/76/18/95/214761895.db2.gz	WWTQROIHFVCQPC-QWHCGFSZSA-N	1	1	322.340	1.673	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+](CCO)C3CCOCC3)nc2c1	ZINC000614923170	362080344	/nfs/dbraw/zinc/08/03/44/362080344.db2.gz	MALCLZRAOGYPSQ-UHFFFAOYSA-N	1	1	321.333	1.709	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413244220	529801106	/nfs/dbraw/zinc/80/11/06/529801106.db2.gz	ZFBPQJSEUZTPPB-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
CCOC1CC([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000286721963	219129579	/nfs/dbraw/zinc/12/95/79/219129579.db2.gz	GIBLGZJIRVTOHA-ROKHWSDSSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3nc4sccn4c3[N+](=O)[O-])C2)C1	ZINC000292391682	282355493	/nfs/dbraw/zinc/35/54/93/282355493.db2.gz	UBIXIYLJJPBOGV-ZDUSSCGKSA-N	1	1	307.379	1.836	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000358357921	299129840	/nfs/dbraw/zinc/12/98/40/299129840.db2.gz	SGASAAWLOGLQLG-NSHDSACASA-N	1	1	311.386	1.336	20	5		DDBDMO
O=C(NCCNc1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@H+]1C1CC1	ZINC000279646286	215029992	/nfs/dbraw/zinc/02/99/92/215029992.db2.gz	BEEXUOKDORHDDC-HNNXBMFYSA-N	1	1	318.377	1.750	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)n1	ZINC000191828457	186260180	/nfs/dbraw/zinc/26/01/80/186260180.db2.gz	GTCNCVSDGGZSTE-LBPRGKRZSA-N	1	1	323.397	1.758	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000043346618	352365924	/nfs/dbraw/zinc/36/59/24/352365924.db2.gz	NRDFZMGRESHPTJ-UHFFFAOYSA-N	1	1	324.381	1.993	20	5		DDBDMO
O=C(NCC1([NH+]2CCCCC2)CCCCC1)[C@H]1CC1[N+](=O)[O-]	ZINC000047295364	352489447	/nfs/dbraw/zinc/48/94/47/352489447.db2.gz	BQBZVMXICACNEW-KBPBESRZSA-N	1	1	309.410	1.957	20	5		DDBDMO
Cc1[nH+]ccn1CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000047668829	352507414	/nfs/dbraw/zinc/50/74/14/352507414.db2.gz	JNUHKPGCRAUDOV-UHFFFAOYSA-N	1	1	324.362	1.468	20	5		DDBDMO
Cc1cccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC000053506612	352659515	/nfs/dbraw/zinc/65/95/15/352659515.db2.gz	DXIBHCWGSSQEQO-CVEARBPZSA-N	1	1	317.389	1.741	20	5		DDBDMO
CC(C)[C@H](CNC(=O)c1cc([N+](=O)[O-])c[nH]1)[NH+]1CCOCC1	ZINC000055473091	352735114	/nfs/dbraw/zinc/73/51/14/352735114.db2.gz	XEDKJTQTXJAQAS-ZDUSSCGKSA-N	1	1	310.354	1.010	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000173711137	198243047	/nfs/dbraw/zinc/24/30/47/198243047.db2.gz	ASJDOCCJCMMNCH-CYBMUJFWSA-N	1	1	320.393	1.489	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000174331972	198320911	/nfs/dbraw/zinc/32/09/11/198320911.db2.gz	SIZUWVKBBFPGAA-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000074741736	353327755	/nfs/dbraw/zinc/32/77/55/353327755.db2.gz	AFSOFAUEUNBHOT-ZDUSSCGKSA-N	1	1	321.425	1.984	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccccn3)CC2)c1	ZINC000174807831	198387953	/nfs/dbraw/zinc/38/79/53/198387953.db2.gz	GXBRESUHRTYOJO-UHFFFAOYSA-N	1	1	302.338	1.009	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(c2ccc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000089265339	353763725	/nfs/dbraw/zinc/76/37/25/353763725.db2.gz	CEKLYPUVAVSBFH-LLVKDONJSA-N	1	1	308.338	1.063	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000089265339	353763728	/nfs/dbraw/zinc/76/37/28/353763728.db2.gz	CEKLYPUVAVSBFH-LLVKDONJSA-N	1	1	308.338	1.063	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@H](O)C1CC1	ZINC000156606839	354220635	/nfs/dbraw/zinc/22/06/35/354220635.db2.gz	PNDOJNKNPZWOPM-ZDUSSCGKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H](O)C1CC1	ZINC000156606839	354220638	/nfs/dbraw/zinc/22/06/38/354220638.db2.gz	PNDOJNKNPZWOPM-ZDUSSCGKSA-N	1	1	323.349	1.245	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CC1	ZINC000587571045	354883070	/nfs/dbraw/zinc/88/30/70/354883070.db2.gz	CDDSLFMXVCPECU-UHFFFAOYSA-N	1	1	322.409	1.980	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1	ZINC000346297768	283062594	/nfs/dbraw/zinc/06/25/94/283062594.db2.gz	PJGCKEOKZKFGMJ-HNNXBMFYSA-N	1	1	307.325	1.902	20	5		DDBDMO
CCCC[N@@H+](CCO)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589494425	354996130	/nfs/dbraw/zinc/99/61/30/354996130.db2.gz	KBCNFLJEDOIVMW-UHFFFAOYSA-N	1	1	310.350	1.976	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)[C@H]2C1	ZINC000590442268	355096397	/nfs/dbraw/zinc/09/63/97/355096397.db2.gz	FCGFGKYRIZNOIE-SKDRFNHKSA-N	1	1	319.317	1.100	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056163	355239773	/nfs/dbraw/zinc/23/97/73/355239773.db2.gz	CXRWCONQMQRKHM-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](O)[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056163	355239774	/nfs/dbraw/zinc/23/97/74/355239774.db2.gz	CXRWCONQMQRKHM-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C1CC[C@H]2C[N@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000346452230	283106267	/nfs/dbraw/zinc/10/62/67/283106267.db2.gz	KFSVKKFTGXZOSB-ZDUSSCGKSA-N	1	1	305.334	1.280	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000346452230	283106271	/nfs/dbraw/zinc/10/62/71/283106271.db2.gz	KFSVKKFTGXZOSB-ZDUSSCGKSA-N	1	1	305.334	1.280	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@H](C)CCO	ZINC000593108187	355800986	/nfs/dbraw/zinc/80/09/86/355800986.db2.gz	URBKETARKJQCOP-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H](C)CCO	ZINC000593108187	355800989	/nfs/dbraw/zinc/80/09/89/355800989.db2.gz	URBKETARKJQCOP-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC([N@@H+]2CC[C@@H](O)C2)C1	ZINC000593502977	355905490	/nfs/dbraw/zinc/90/54/90/355905490.db2.gz	GURWTBXPGXXLOR-CYBMUJFWSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593502977	355905491	/nfs/dbraw/zinc/90/54/91/355905491.db2.gz	GURWTBXPGXXLOR-CYBMUJFWSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC([N@H+]4CC[C@@H](O)C4)C3)ccc2c1	ZINC000593506727	355907441	/nfs/dbraw/zinc/90/74/41/355907441.db2.gz	AAJOCGYGBCHEFH-CQSZACIVSA-N	1	1	314.345	1.398	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593573237	355930538	/nfs/dbraw/zinc/93/05/38/355930538.db2.gz	VWKNNMAZCWBHRY-QWRGUYRKSA-N	1	1	309.341	1.827	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595766573	356643641	/nfs/dbraw/zinc/64/36/41/356643641.db2.gz	PTLZZEXXRHWWMI-ZWNOBZJWSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595766573	356643644	/nfs/dbraw/zinc/64/36/44/356643644.db2.gz	PTLZZEXXRHWWMI-ZWNOBZJWSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755614	356636900	/nfs/dbraw/zinc/63/69/00/356636900.db2.gz	BJOQBJIHWVLDEH-ZUZCIYMTSA-N	1	1	302.334	1.939	20	5		DDBDMO
C[C@@]12COC[C@@H]1C[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755614	356636904	/nfs/dbraw/zinc/63/69/04/356636904.db2.gz	BJOQBJIHWVLDEH-ZUZCIYMTSA-N	1	1	302.334	1.939	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000618237911	363537589	/nfs/dbraw/zinc/53/75/89/363537589.db2.gz	CHPPZNQIDYMNAY-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])C[C@@H]1C	ZINC000618237911	363537590	/nfs/dbraw/zinc/53/75/90/363537590.db2.gz	CHPPZNQIDYMNAY-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@H]2C[C@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595808563	356659684	/nfs/dbraw/zinc/65/96/84/356659684.db2.gz	DAXFMQWRJDWYMS-STQMWFEESA-N	1	1	301.346	1.826	20	5		DDBDMO
O=C(C[N@H+]1CC[C@H]2C[C@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595808563	356659685	/nfs/dbraw/zinc/65/96/85/356659685.db2.gz	DAXFMQWRJDWYMS-STQMWFEESA-N	1	1	301.346	1.826	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC3(COC3)C2)c1	ZINC000595833483	356670549	/nfs/dbraw/zinc/67/05/49/356670549.db2.gz	KRFPOMGYSWCCQN-UHFFFAOYSA-N	1	1	306.318	1.604	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC3(COC3)C2)c1	ZINC000595833483	356670551	/nfs/dbraw/zinc/67/05/51/356670551.db2.gz	KRFPOMGYSWCCQN-UHFFFAOYSA-N	1	1	306.318	1.604	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1	ZINC000595826597	356665905	/nfs/dbraw/zinc/66/59/05/356665905.db2.gz	AWPAMPVMNJOSFM-KCQAQPDRSA-N	1	1	322.361	1.303	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000595828453	356667131	/nfs/dbraw/zinc/66/71/31/356667131.db2.gz	FASTVKPTQAMWQI-QWHCGFSZSA-N	1	1	305.334	1.162	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1c(Cl)cncc1[N+](=O)[O-]	ZINC000596140327	356788837	/nfs/dbraw/zinc/78/88/37/356788837.db2.gz	GJLZFGCBCDSKFC-UHFFFAOYSA-N	1	1	302.762	1.445	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)n1	ZINC000596537543	356910313	/nfs/dbraw/zinc/91/03/13/356910313.db2.gz	HLZGFFADSCEVTG-CQSZACIVSA-N	1	1	320.393	1.642	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597854985	357359117	/nfs/dbraw/zinc/35/91/17/357359117.db2.gz	OKXKFGMGCKTLCM-GFCCVEGCSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1[nH+]ccn1CCn1nc(-c2ccc([N+](=O)[O-])cc2)oc1=O	ZINC000347762302	283274931	/nfs/dbraw/zinc/27/49/31/283274931.db2.gz	ZREGDQJXWJZNBQ-UHFFFAOYSA-N	1	1	315.289	1.617	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1CO	ZINC000598648473	357669184	/nfs/dbraw/zinc/66/91/84/357669184.db2.gz	RYJWXIMRZIMVHH-GHMZBOCLSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1CO	ZINC000598648473	357669189	/nfs/dbraw/zinc/66/91/89/357669189.db2.gz	RYJWXIMRZIMVHH-GHMZBOCLSA-N	1	1	304.350	1.921	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000598648773	357669867	/nfs/dbraw/zinc/66/98/67/357669867.db2.gz	HGEAZGKGYOHXAO-OLZOCXBDSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@H]1CO	ZINC000598648773	357669870	/nfs/dbraw/zinc/66/98/70/357669870.db2.gz	HGEAZGKGYOHXAO-OLZOCXBDSA-N	1	1	321.377	1.508	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC2CC2)C1)c1c[nH]nc1[N+](=O)[O-]	ZINC000598559782	357632058	/nfs/dbraw/zinc/63/20/58/357632058.db2.gz	ZJOCTPWOESIWRB-NSHDSACASA-N	1	1	307.354	1.170	20	5		DDBDMO
C[C@H]1CC[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[NH2+]1	ZINC000599104015	357816672	/nfs/dbraw/zinc/81/66/72/357816672.db2.gz	KWXRKXMUODMBIB-DTWKUNHWSA-N	1	1	317.342	1.153	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@@H+]2CC[C@@H](O)C2)ccc2cnccc21	ZINC000599175416	357840058	/nfs/dbraw/zinc/84/00/58/357840058.db2.gz	ATFBQXVQPDLBNZ-GFCCVEGCSA-N	1	1	302.334	1.622	20	5		DDBDMO
Cn1cc(CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)nn1	ZINC000599311723	357888062	/nfs/dbraw/zinc/88/80/62/357888062.db2.gz	JXSJARQMDRGRTN-UHFFFAOYSA-N	1	1	301.350	1.930	20	5		DDBDMO
CC(C)(C)CNC(=O)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000599396627	357922056	/nfs/dbraw/zinc/92/20/56/357922056.db2.gz	SLSBKOFZOMOCKX-UHFFFAOYSA-N	1	1	323.397	1.591	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC(F)(F)CC1	ZINC000599551760	357971333	/nfs/dbraw/zinc/97/13/33/357971333.db2.gz	AYUNRAURXIBCBY-UHFFFAOYSA-N	1	1	301.293	1.878	20	5		DDBDMO
O=c1ccc([C@@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000599642454	358003834	/nfs/dbraw/zinc/00/38/34/358003834.db2.gz	UPNUXWDPYZCZRK-NSHDSACASA-N	1	1	304.310	1.124	20	5		DDBDMO
O=c1ccc([C@@H]2CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000599642454	358003836	/nfs/dbraw/zinc/00/38/36/358003836.db2.gz	UPNUXWDPYZCZRK-NSHDSACASA-N	1	1	304.310	1.124	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@H]2CCC[C@@H]21	ZINC000599659044	358012694	/nfs/dbraw/zinc/01/26/94/358012694.db2.gz	OAXNDBFFFKBLNB-MCIONIFRSA-N	1	1	322.365	1.455	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000600316296	358194922	/nfs/dbraw/zinc/19/49/22/358194922.db2.gz	ZEGKZKQJOWBFFO-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000600469596	358232338	/nfs/dbraw/zinc/23/23/38/358232338.db2.gz	CQUWBUNZCMNDQL-CYBMUJFWSA-N	1	1	321.381	1.315	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@H](CO)C3CCOCC3)c2c1	ZINC000601158689	358427204	/nfs/dbraw/zinc/42/72/04/358427204.db2.gz	AUHZAMZIQLKVJI-MRXNPFEDSA-N	1	1	317.345	1.764	20	5		DDBDMO
C[N@@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@H](CO)C1	ZINC000601979248	358764061	/nfs/dbraw/zinc/76/40/61/358764061.db2.gz	BODVGRNJWAMGAQ-LBPRGKRZSA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@H](CO)C1	ZINC000601979248	358764063	/nfs/dbraw/zinc/76/40/63/358764063.db2.gz	BODVGRNJWAMGAQ-LBPRGKRZSA-N	1	1	302.334	1.256	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000602545509	359037314	/nfs/dbraw/zinc/03/73/14/359037314.db2.gz	DOGLWDAISKYDCI-LLVKDONJSA-N	1	1	320.349	1.546	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000602545509	359037318	/nfs/dbraw/zinc/03/73/18/359037318.db2.gz	DOGLWDAISKYDCI-LLVKDONJSA-N	1	1	320.349	1.546	20	5		DDBDMO
C[C@]12C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@@]1(C)C(=O)NC2=O	ZINC000602723838	359150261	/nfs/dbraw/zinc/15/02/61/359150261.db2.gz	HPZGOCSCMMDSBB-IYBDPMFKSA-N	1	1	317.345	1.122	20	5		DDBDMO
CCC(=O)N[C@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602770895	359178073	/nfs/dbraw/zinc/17/80/73/359178073.db2.gz	ZQTXUZYMLRJDHL-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](C(=O)NC(C)C)C1	ZINC000602904260	359283947	/nfs/dbraw/zinc/28/39/47/359283947.db2.gz	VRUXAUOCZMLZIR-ZDUSSCGKSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000602960196	359322940	/nfs/dbraw/zinc/32/29/40/359322940.db2.gz	KKSFRMKPBKXQSU-NSHDSACASA-N	1	1	307.354	1.278	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)n1	ZINC000603144132	359433099	/nfs/dbraw/zinc/43/30/99/359433099.db2.gz	WLSCCRRUEASLDW-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)n1	ZINC000603144132	359433103	/nfs/dbraw/zinc/43/31/03/359433103.db2.gz	WLSCCRRUEASLDW-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@H]1C(C)(C)C	ZINC000603144151	359433602	/nfs/dbraw/zinc/43/36/02/359433602.db2.gz	WZWWQRVIGVBATK-ZDUSSCGKSA-N	1	1	306.366	1.792	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C[C@H]1C(C)(C)C	ZINC000603144151	359433605	/nfs/dbraw/zinc/43/36/05/359433605.db2.gz	WZWWQRVIGVBATK-ZDUSSCGKSA-N	1	1	306.366	1.792	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000603403026	359618566	/nfs/dbraw/zinc/61/85/66/359618566.db2.gz	QRWIAHMHTSLZBM-LLVKDONJSA-N	1	1	322.365	1.385	20	5		DDBDMO
Cn1cc(CN2CCC[C@H]([C@H]3C[C@H]([NH3+])CCO3)C2)c([N+](=O)[O-])n1	ZINC000603431401	359636034	/nfs/dbraw/zinc/63/60/34/359636034.db2.gz	WTRWYUQXPPVKMW-IACUBPJLSA-N	1	1	323.397	1.047	20	5		DDBDMO
CC[C@@]1(CO)CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000187592627	200132362	/nfs/dbraw/zinc/13/23/62/200132362.db2.gz	FZHXHBZMTOXQAF-MRXNPFEDSA-N	1	1	321.377	1.678	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)nc1	ZINC000610489100	360449552	/nfs/dbraw/zinc/44/95/52/360449552.db2.gz	AYZDOHUFMDZDOW-AWEZNQCLSA-N	1	1	306.366	1.681	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000610900769	360568124	/nfs/dbraw/zinc/56/81/24/360568124.db2.gz	KOCOVPYYJXNYGU-RNCFNFMXSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000610900769	360568130	/nfs/dbraw/zinc/56/81/30/360568130.db2.gz	KOCOVPYYJXNYGU-RNCFNFMXSA-N	1	1	311.313	1.183	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CC(c3nc4ccccc4[nH]3)C2)n1	ZINC000610844766	360551340	/nfs/dbraw/zinc/55/13/40/360551340.db2.gz	VTNOXJLAQYQMQW-UHFFFAOYSA-N	1	1	312.333	1.767	20	5		DDBDMO
C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000359029747	299311481	/nfs/dbraw/zinc/31/14/81/299311481.db2.gz	SOWIHTXJBXYJCS-RYUDHWBXSA-N	1	1	321.381	1.796	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCCO1	ZINC000611253852	360680991	/nfs/dbraw/zinc/68/09/91/360680991.db2.gz	XNSYMTMFXAMKRQ-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@H]1CCCO1	ZINC000611253852	360680995	/nfs/dbraw/zinc/68/09/95/360680995.db2.gz	XNSYMTMFXAMKRQ-GFCCVEGCSA-N	1	1	308.334	1.977	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611271425	360685298	/nfs/dbraw/zinc/68/52/98/360685298.db2.gz	GJZJSTUQHPOAAH-LLVKDONJSA-N	1	1	308.334	1.834	20	5		DDBDMO
CC(C)[NH2+][C@@H]1CCCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000611555697	360757559	/nfs/dbraw/zinc/75/75/59/360757559.db2.gz	URFYBBXRJVYCFJ-GFCCVEGCSA-N	1	1	307.350	1.903	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC(C)(C)O)c1ccc([N+](=O)[O-])cc1	ZINC000611560960	360760311	/nfs/dbraw/zinc/76/03/11/360760311.db2.gz	VLLQXUPYMMJTGS-CYBMUJFWSA-N	1	1	304.350	1.778	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611561474	360760791	/nfs/dbraw/zinc/76/07/91/360760791.db2.gz	JKYVDYALLWVJPW-WDEREUQCSA-N	1	1	308.334	1.569	20	5		DDBDMO
CCO[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000612030392	360894632	/nfs/dbraw/zinc/89/46/32/360894632.db2.gz	UMSDEWJTKNQMKR-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCN(C)c2cc(N)ccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000193539728	201070625	/nfs/dbraw/zinc/07/06/25/201070625.db2.gz	GLHFCXKHPPJZSA-TXEJJXNPSA-N	1	1	308.382	1.722	20	5		DDBDMO
C[C@@H]1C[N@H+](CCN(C)c2cc(N)ccc2[N+](=O)[O-])C[C@H](C)O1	ZINC000193539728	201070628	/nfs/dbraw/zinc/07/06/28/201070628.db2.gz	GLHFCXKHPPJZSA-TXEJJXNPSA-N	1	1	308.382	1.722	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000193625051	201090486	/nfs/dbraw/zinc/09/04/86/201090486.db2.gz	PJAFRRFBIPBKPI-OKILXGFUSA-N	1	1	305.378	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](n3cc(CO)nn3)C2)cc1	ZINC000292916558	223308007	/nfs/dbraw/zinc/30/80/07/223308007.db2.gz	HXIFUZHPBRIBDE-OAHLLOKOSA-N	1	1	317.349	1.516	20	5		DDBDMO
Cc1c(C[N@@H+]2CCc3n[nH]c(=O)cc3C2)cccc1[N+](=O)[O-]	ZINC000275013219	212073407	/nfs/dbraw/zinc/07/34/07/212073407.db2.gz	RSBSEKUAVZVLFT-UHFFFAOYSA-N	1	1	300.318	1.545	20	5		DDBDMO
Cc1c(C[N@H+]2CCc3n[nH]c(=O)cc3C2)cccc1[N+](=O)[O-]	ZINC000275013219	212073408	/nfs/dbraw/zinc/07/34/08/212073408.db2.gz	RSBSEKUAVZVLFT-UHFFFAOYSA-N	1	1	300.318	1.545	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)Cn1cccn1	ZINC000282557775	217087395	/nfs/dbraw/zinc/08/73/95/217087395.db2.gz	YACNZTLJNMTOCI-OAHLLOKOSA-N	1	1	304.350	1.327	20	5		DDBDMO
Cc1cnc(NC2CC[NH+](CC(=O)N(C)C)CC2)c([N+](=O)[O-])c1	ZINC000266230571	205202714	/nfs/dbraw/zinc/20/27/14/205202714.db2.gz	UGGAGOMEDGPVDP-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000128618517	248282416	/nfs/dbraw/zinc/28/24/16/248282416.db2.gz	NEWDSKQJKAIIQK-UHFFFAOYSA-N	1	1	303.362	1.834	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000340407407	251051898	/nfs/dbraw/zinc/05/18/98/251051898.db2.gz	KSMBDZAHCOCBFD-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](C)O)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340792999	251214952	/nfs/dbraw/zinc/21/49/52/251214952.db2.gz	RSKKZYYRHIROAK-TZMCWYRMSA-N	1	1	312.366	1.426	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NCC[N@@H+]1[C@H](C)CCC[C@@H]1C	ZINC000341062319	251362407	/nfs/dbraw/zinc/36/24/07/251362407.db2.gz	PTDMHUDCRINCOH-TXEJJXNPSA-N	1	1	323.397	1.479	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000352404118	285027907	/nfs/dbraw/zinc/02/79/07/285027907.db2.gz	CGCLMCGKIYZDIR-JQWIXIFHSA-N	1	1	307.350	1.689	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)c1csc([N+](=O)[O-])c1	ZINC000288744058	220385421	/nfs/dbraw/zinc/38/54/21/220385421.db2.gz	PPLXEHOWDKCPIE-UHFFFAOYSA-N	1	1	314.411	1.270	20	5		DDBDMO
CN(CCCNC(=O)c1csc([N+](=O)[O-])c1)CC[NH+](C)C	ZINC000288744058	220385425	/nfs/dbraw/zinc/38/54/25/220385425.db2.gz	PPLXEHOWDKCPIE-UHFFFAOYSA-N	1	1	314.411	1.270	20	5		DDBDMO
CCC[C@]1(CO)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000288754319	220393996	/nfs/dbraw/zinc/39/39/96/220393996.db2.gz	IGOBWFDBXGGZND-HNNXBMFYSA-N	1	1	309.366	1.241	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000157558919	197197273	/nfs/dbraw/zinc/19/72/73/197197273.db2.gz	TUGRHVFTBLTSOW-UHFFFAOYSA-N	1	1	309.366	1.678	20	5		DDBDMO
C[C@H](CCO)[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353517110	285780187	/nfs/dbraw/zinc/78/01/87/285780187.db2.gz	HWKBFRDCOHXWKP-BXUZGUMPSA-N	1	1	304.350	1.778	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000569121936	304337870	/nfs/dbraw/zinc/33/78/70/304337870.db2.gz	APGVJMOLRVBMGB-LLVKDONJSA-N	1	1	314.292	1.316	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@@H]3OCC[N@@H+](C)[C@H]3C2)c1	ZINC000284896884	286382930	/nfs/dbraw/zinc/38/29/30/286382930.db2.gz	HHRAINCVHLNRLZ-GJZGRUSLSA-N	1	1	307.350	1.513	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000069744287	406765012	/nfs/dbraw/zinc/76/50/12/406765012.db2.gz	OGPPXIYQBQUKMQ-GFCCVEGCSA-N	1	1	323.349	1.372	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1ccccc1	ZINC000081573399	407077574	/nfs/dbraw/zinc/07/75/74/407077574.db2.gz	GWEXASAPDQAIKV-KCXAZCMYSA-N	1	1	316.361	1.845	20	5		DDBDMO
CCC[N@H+]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000090548986	407169203	/nfs/dbraw/zinc/16/92/03/407169203.db2.gz	GRABVJZIMWMDMU-UHFFFAOYSA-N	1	1	308.382	1.174	20	5		DDBDMO
CC[NH+]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000057827652	407217341	/nfs/dbraw/zinc/21/73/41/407217341.db2.gz	VQAJYDJGFIBBBR-UHFFFAOYSA-N	1	1	317.349	1.782	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@@H]1CCCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000107694963	407377895	/nfs/dbraw/zinc/37/78/95/407377895.db2.gz	DUOFPMUULPFVTK-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCOCC[N@H+](CC)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000107680446	407378533	/nfs/dbraw/zinc/37/85/33/407378533.db2.gz	IGDNSSBUYJVEOZ-UHFFFAOYSA-N	1	1	309.366	1.916	20	5		DDBDMO
CCOCC[N@@H+](CC)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000107680446	407378535	/nfs/dbraw/zinc/37/85/35/407378535.db2.gz	IGDNSSBUYJVEOZ-UHFFFAOYSA-N	1	1	309.366	1.916	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccncc2)C2CC2)c1	ZINC000124861086	407372010	/nfs/dbraw/zinc/37/20/10/407372010.db2.gz	BAPWVLVMJVBGOC-OAHLLOKOSA-N	1	1	317.349	1.212	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1	ZINC000107894127	407381045	/nfs/dbraw/zinc/38/10/45/407381045.db2.gz	YKPMVPRUJSFGPU-LBPRGKRZSA-N	1	1	320.393	1.732	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)c1[nH]nc(CCC)c1[N+](=O)[O-]	ZINC000112401144	407428137	/nfs/dbraw/zinc/42/81/37/407428137.db2.gz	QQZHLJPQQFKRNZ-UHFFFAOYSA-N	1	1	311.386	1.732	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000185592444	407457732	/nfs/dbraw/zinc/45/77/32/407457732.db2.gz	BBHFTWPBBIMRIZ-LLVKDONJSA-N	1	1	321.381	1.422	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@@H]2C1	ZINC000178632977	407520603	/nfs/dbraw/zinc/52/06/03/407520603.db2.gz	OTVMHRMIFUDWKR-QWHCGFSZSA-N	1	1	318.377	1.702	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000266709482	407608872	/nfs/dbraw/zinc/60/88/72/407608872.db2.gz	DFPSPAYLUUVTHR-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000266709482	407608879	/nfs/dbraw/zinc/60/88/79/407608879.db2.gz	DFPSPAYLUUVTHR-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000171199289	407628628	/nfs/dbraw/zinc/62/86/28/407628628.db2.gz	WPBRHQNSJOCWDS-GFCCVEGCSA-N	1	1	324.381	1.533	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000186755908	407766033	/nfs/dbraw/zinc/76/60/33/407766033.db2.gz	HKYPRQOCVOWYLG-LLVKDONJSA-N	1	1	321.381	1.566	20	5		DDBDMO
CC[C@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CCN1CC(F)F	ZINC000153332337	407802703	/nfs/dbraw/zinc/80/27/03/407802703.db2.gz	BJVRMUCRGCVZOH-NSHDSACASA-N	1	1	317.340	1.453	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CCN1CC(F)F	ZINC000153332337	407802708	/nfs/dbraw/zinc/80/27/08/407802708.db2.gz	BJVRMUCRGCVZOH-NSHDSACASA-N	1	1	317.340	1.453	20	5		DDBDMO
CN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000153721150	407888037	/nfs/dbraw/zinc/88/80/37/407888037.db2.gz	CGXSTGQGPRJLKX-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](C(N)=O)C1	ZINC000187394393	407851127	/nfs/dbraw/zinc/85/11/27/407851127.db2.gz	VDXXBHKNNKMMFG-AAEUAGOBSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@H](C(N)=O)C1	ZINC000187394393	407851132	/nfs/dbraw/zinc/85/11/32/407851132.db2.gz	VDXXBHKNNKMMFG-AAEUAGOBSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000268158911	407920319	/nfs/dbraw/zinc/92/03/19/407920319.db2.gz	HNJFNEJZLORCAO-UFBFGSQYSA-N	1	1	322.340	1.529	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1[nH]ncc1[N+](=O)[O-]	ZINC000245638994	408032308	/nfs/dbraw/zinc/03/23/08/408032308.db2.gz	ARJHYFJUWAIJNK-AXFHLTTASA-N	1	1	309.370	1.414	20	5		DDBDMO
C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000245638994	408032316	/nfs/dbraw/zinc/03/23/16/408032316.db2.gz	ARJHYFJUWAIJNK-AXFHLTTASA-N	1	1	309.370	1.414	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000245638994	408032321	/nfs/dbraw/zinc/03/23/21/408032321.db2.gz	ARJHYFJUWAIJNK-AXFHLTTASA-N	1	1	309.370	1.414	20	5		DDBDMO
C[C@H](NC(=O)c1c(N)cccc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272738697	408012331	/nfs/dbraw/zinc/01/23/31/408012331.db2.gz	CLEHEUDGEADIMX-JTQLQIEISA-N	1	1	304.350	1.557	20	5		DDBDMO
CC[C@]1(CO)CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000189682945	408080116	/nfs/dbraw/zinc/08/01/16/408080116.db2.gz	INNOPVBTPTZUAO-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000189682945	408080120	/nfs/dbraw/zinc/08/01/20/408080120.db2.gz	INNOPVBTPTZUAO-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000155525853	408176946	/nfs/dbraw/zinc/17/69/46/408176946.db2.gz	SUENZZMPOSULBG-UKRRQHHQSA-N	1	1	319.361	1.695	20	5		DDBDMO
CCOCCC[N@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000273572936	408251304	/nfs/dbraw/zinc/25/13/04/408251304.db2.gz	DMZVKHCBNHDWEH-GXTWGEPZSA-N	1	1	323.397	1.934	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000190364282	408228450	/nfs/dbraw/zinc/22/84/50/408228450.db2.gz	NHKDPQYNPIALBG-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@@H]1CO	ZINC000190364282	408228460	/nfs/dbraw/zinc/22/84/60/408228460.db2.gz	NHKDPQYNPIALBG-RISCZKNCSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269333257	408274531	/nfs/dbraw/zinc/27/45/31/408274531.db2.gz	AUCGKSRMPUCEEX-WDEREUQCSA-N	1	1	323.397	1.900	20	5		DDBDMO
O=[N+]([O-])c1cnn(CCN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000134916888	162090625	/nfs/dbraw/zinc/09/06/25/162090625.db2.gz	KSAGSJCWHRTRND-CZUORRHYSA-N	1	1	319.409	1.740	20	5		DDBDMO
Cc1nc(N[C@@H](C)CCN2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000274526599	408437306	/nfs/dbraw/zinc/43/73/06/408437306.db2.gz	XUQOYQFZNHZADF-LBPRGKRZSA-N	1	1	307.398	1.736	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)n1	ZINC000191789296	408493137	/nfs/dbraw/zinc/49/31/37/408493137.db2.gz	NABKWVDFGJGSJG-GFCCVEGCSA-N	1	1	323.397	1.661	20	5		DDBDMO
CCC[C@H]1C[N@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248070142	408530357	/nfs/dbraw/zinc/53/03/57/408530357.db2.gz	QFYKMKQBPCUQHZ-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000248070142	408530361	/nfs/dbraw/zinc/53/03/61/408530361.db2.gz	QFYKMKQBPCUQHZ-ZBFHGGJFSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000248344809	408550876	/nfs/dbraw/zinc/55/08/76/408550876.db2.gz	MASKDINFEUFIKL-BONVTDFDSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@](C)(O)C2)c([N+](=O)[O-])c1	ZINC000248344809	408550879	/nfs/dbraw/zinc/55/08/79/408550879.db2.gz	MASKDINFEUFIKL-BONVTDFDSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc(N2CC[NH+](CCCO)CC2)c(F)cc1[N+](=O)[O-]	ZINC000270577916	408587956	/nfs/dbraw/zinc/58/79/56/408587956.db2.gz	RDFPWTRJOCYWLR-UHFFFAOYSA-N	1	1	313.329	1.247	20	5		DDBDMO
CC(C)OC(=O)C[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000184453465	408620512	/nfs/dbraw/zinc/62/05/12/408620512.db2.gz	XTUUMZBHAFCUBC-CYBMUJFWSA-N	1	1	324.381	1.845	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000193246965	408704890	/nfs/dbraw/zinc/70/48/90/408704890.db2.gz	PMOPKSVWCQBKJE-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000249733598	408760469	/nfs/dbraw/zinc/76/04/69/408760469.db2.gz	CLDIVELLORBZQE-MNOVXSKESA-N	1	1	323.397	1.487	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCC[N@H+](C)CC	ZINC000290825381	408839042	/nfs/dbraw/zinc/83/90/42/408839042.db2.gz	PBCZREVIBVJNAO-UHFFFAOYSA-N	1	1	322.365	1.164	20	5		DDBDMO
CO[C@@H](C)C[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000285747579	408855446	/nfs/dbraw/zinc/85/54/46/408855446.db2.gz	QRRGCOODICEDML-NSHDSACASA-N	1	1	307.350	1.451	20	5		DDBDMO
CO[C@@H](C)C[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000285747579	408855449	/nfs/dbraw/zinc/85/54/49/408855449.db2.gz	QRRGCOODICEDML-NSHDSACASA-N	1	1	307.350	1.451	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1	ZINC000285767963	408859875	/nfs/dbraw/zinc/85/98/75/408859875.db2.gz	ZWVCYQSYRKDWIE-NSHDSACASA-N	1	1	322.287	1.571	20	5		DDBDMO
O=C1C[C@H]2CC[C@@H](C1)[N@@H+]2C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000276583946	408887836	/nfs/dbraw/zinc/88/78/36/408887836.db2.gz	PAMMEWDSICUION-MBNYWOFBSA-N	1	1	320.345	1.530	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)c1	ZINC000291749670	408916480	/nfs/dbraw/zinc/91/64/80/408916480.db2.gz	KLEZNGPASRVKMM-DGCLKSJQSA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC(F)(F)[C@@H](CO)C2)c1	ZINC000291749670	408916483	/nfs/dbraw/zinc/91/64/83/408916483.db2.gz	KLEZNGPASRVKMM-DGCLKSJQSA-N	1	1	316.304	1.578	20	5		DDBDMO
Cc1nc(N2C[C@@H]([NH+]3CCOCC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000286175876	408937321	/nfs/dbraw/zinc/93/73/21/408937321.db2.gz	ADLRXUBZKVNDQH-AAEUAGOBSA-N	1	1	306.366	1.598	20	5		DDBDMO
Cc1cc(N2CC[C@@H]3OCC[N@H+](C)[C@@H]3C2)c(F)cc1[N+](=O)[O-]	ZINC000292336545	409026892	/nfs/dbraw/zinc/02/68/92/409026892.db2.gz	BCPJIDISWIIAHN-CABCVRRESA-N	1	1	309.341	1.952	20	5		DDBDMO
C[C@@H]([NH2+]CCCN1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293248249	409075132	/nfs/dbraw/zinc/07/51/32/409075132.db2.gz	BKFAUHWOPHATJM-CYBMUJFWSA-N	1	1	321.425	1.465	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000283084308	409084218	/nfs/dbraw/zinc/08/42/18/409084218.db2.gz	KXSMVAUZRHYZNT-GFCCVEGCSA-N	1	1	307.325	1.931	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000283084308	409084223	/nfs/dbraw/zinc/08/42/23/409084223.db2.gz	KXSMVAUZRHYZNT-GFCCVEGCSA-N	1	1	307.325	1.931	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1nc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000287785752	409093683	/nfs/dbraw/zinc/09/36/83/409093683.db2.gz	IPUBHGGBBWSBHR-JTQLQIEISA-N	1	1	310.354	1.919	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](C)CO	ZINC000293346125	409093887	/nfs/dbraw/zinc/09/38/87/409093887.db2.gz	HJPCPPQVOSMFDW-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(Cc3csc([N+](=O)[O-])c3)[C@H]2C1	ZINC000293351445	409096987	/nfs/dbraw/zinc/09/69/87/409096987.db2.gz	TWECKCWIRXRMQP-QWHCGFSZSA-N	1	1	311.407	1.951	20	5		DDBDMO
Cc1nc(N(C)CCC[N@H+](C)CCN(C)C)ccc1[N+](=O)[O-]	ZINC000288870837	409190453	/nfs/dbraw/zinc/19/04/53/409190453.db2.gz	LKKWDJRPZQGPON-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1nc(N(C)CCCN(C)CC[NH+](C)C)ccc1[N+](=O)[O-]	ZINC000288870837	409190454	/nfs/dbraw/zinc/19/04/54/409190454.db2.gz	LKKWDJRPZQGPON-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000294082090	409237927	/nfs/dbraw/zinc/23/79/27/409237927.db2.gz	JTDZTCLQKWGBDA-AWEZNQCLSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294082090	409237929	/nfs/dbraw/zinc/23/79/29/409237929.db2.gz	JTDZTCLQKWGBDA-AWEZNQCLSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@@]3(C2)CCC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000294082090	409237930	/nfs/dbraw/zinc/23/79/30/409237930.db2.gz	JTDZTCLQKWGBDA-AWEZNQCLSA-N	1	1	307.354	1.184	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294155094	409251127	/nfs/dbraw/zinc/25/11/27/409251127.db2.gz	NRNGRPJOVWPALH-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@]3(C2)CCC[N@H+](C)C3)c1[N+](=O)[O-]	ZINC000294155094	409251129	/nfs/dbraw/zinc/25/11/29/409251129.db2.gz	NRNGRPJOVWPALH-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294155094	409251132	/nfs/dbraw/zinc/25/11/32/409251132.db2.gz	NRNGRPJOVWPALH-OAHLLOKOSA-N	1	1	321.381	1.438	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000280305931	409289121	/nfs/dbraw/zinc/28/91/21/409289121.db2.gz	SMSLDJNCYQDORX-UHFFFAOYSA-N	1	1	305.334	1.352	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1[nH]ncc1[N+](=O)[O-]	ZINC000280622554	409384919	/nfs/dbraw/zinc/38/49/19/409384919.db2.gz	BRZZPLZYEKNZRP-LBPRGKRZSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000280622554	409384923	/nfs/dbraw/zinc/38/49/23/409384923.db2.gz	BRZZPLZYEKNZRP-LBPRGKRZSA-N	1	1	321.381	1.845	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1C1CCCCC1)c1n[nH]cc1[N+](=O)[O-]	ZINC000280622554	409384929	/nfs/dbraw/zinc/38/49/29/409384929.db2.gz	BRZZPLZYEKNZRP-LBPRGKRZSA-N	1	1	321.381	1.845	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3nccc(C(N)=O)c3[N+](=O)[O-])CC[C@H]21	ZINC000290497380	409423979	/nfs/dbraw/zinc/42/39/79/409423979.db2.gz	ALVTTYSONHAHAQ-ZYHUDNBSSA-N	1	1	319.365	1.009	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000321888211	164046288	/nfs/dbraw/zinc/04/62/88/164046288.db2.gz	RMGHKINCVIRRAP-NWDGAFQWSA-N	1	1	318.377	1.993	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000347020223	164098236	/nfs/dbraw/zinc/09/82/36/164098236.db2.gz	SXRZVVPNQMEPHY-GFCCVEGCSA-N	1	1	319.361	1.912	20	5		DDBDMO
CS[C@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296233486	409473986	/nfs/dbraw/zinc/47/39/86/409473986.db2.gz	KTIWJEMKZCPREF-RYUDHWBXSA-N	1	1	312.391	1.772	20	5		DDBDMO
CC(C)(C(=O)N1CC[N@@H+]2CCCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000407986610	164189264	/nfs/dbraw/zinc/18/92/64/164189264.db2.gz	MNFBCDKIQIMNTC-GFCCVEGCSA-N	1	1	321.381	1.223	20	5		DDBDMO
CC(C)(C(=O)N1CC[N@H+]2CCCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000407986610	164189266	/nfs/dbraw/zinc/18/92/66/164189266.db2.gz	MNFBCDKIQIMNTC-GFCCVEGCSA-N	1	1	321.381	1.223	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H](C)[N@H+]1C	ZINC000408168195	164249369	/nfs/dbraw/zinc/24/93/69/164249369.db2.gz	HOYDEXGSAMQLHL-PHIMTYICSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1CN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H](C)[N@@H+]1C	ZINC000408168195	164249370	/nfs/dbraw/zinc/24/93/70/164249370.db2.gz	HOYDEXGSAMQLHL-PHIMTYICSA-N	1	1	309.370	1.077	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CCC2(CCC[N@H+]2C)CC1	ZINC000408222166	164265671	/nfs/dbraw/zinc/26/56/71/164265671.db2.gz	OXMFFGRYWHJAMN-UHFFFAOYSA-N	1	1	307.354	1.029	20	5		DDBDMO
CNC(=O)N[C@@H]1CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000344919660	409553542	/nfs/dbraw/zinc/55/35/42/409553542.db2.gz	CXBYFKRAGPWNFT-DIECRNLCSA-N	1	1	304.350	1.611	20	5		DDBDMO
CNC(=O)N[C@@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000344919660	409553548	/nfs/dbraw/zinc/55/35/48/409553548.db2.gz	CXBYFKRAGPWNFT-DIECRNLCSA-N	1	1	304.350	1.611	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000342452880	409643304	/nfs/dbraw/zinc/64/33/04/409643304.db2.gz	QPLOYVQMBSLFLY-AAEUAGOBSA-N	1	1	319.361	1.573	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@H]2C1	ZINC000296854703	409671426	/nfs/dbraw/zinc/67/14/26/409671426.db2.gz	UMCMRHATTRNQIO-KBPBESRZSA-N	1	1	317.349	1.380	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000357041240	409810985	/nfs/dbraw/zinc/81/09/85/409810985.db2.gz	QMAHKHJNKVKHEN-GHMZBOCLSA-N	1	1	306.366	1.218	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CCC[N@@H+](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000342835810	409939665	/nfs/dbraw/zinc/93/96/65/409939665.db2.gz	QOPXAQBAOVVKHY-ZYHUDNBSSA-N	1	1	322.365	1.979	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357392604	410011086	/nfs/dbraw/zinc/01/10/86/410011086.db2.gz	OAOIUFQQRAXKPC-QWHCGFSZSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1cn2cc(Nc3nccc(C(N)=O)c3[N+](=O)[O-])ccc2[nH+]1	ZINC000357513043	410074708	/nfs/dbraw/zinc/07/47/08/410074708.db2.gz	NAERCOMQSCFNJP-UHFFFAOYSA-N	1	1	312.289	1.788	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1C	ZINC000346691742	410087020	/nfs/dbraw/zinc/08/70/20/410087020.db2.gz	WAZSXXSPSZRMFJ-CABZTGNLSA-N	1	1	321.333	1.077	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@H](O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000355043809	410263362	/nfs/dbraw/zinc/26/33/62/410263362.db2.gz	SNXIWNUJOQSTQZ-ZYHUDNBSSA-N	1	1	324.333	1.102	20	5		DDBDMO
C[C@@]12CCC[N@H+]1C[C@@H](c1noc(-c3cc([N+](=O)[O-])c[nH]3)n1)OC2	ZINC000347332774	410479961	/nfs/dbraw/zinc/47/99/61/410479961.db2.gz	IGYRQWBFOHNGPN-FZMZJTMJSA-N	1	1	319.321	1.899	20	5		DDBDMO
COCC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1	ZINC000352033289	410431906	/nfs/dbraw/zinc/43/19/06/410431906.db2.gz	RWKMGLCIIVPODY-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
COCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1	ZINC000352033289	410431914	/nfs/dbraw/zinc/43/19/14/410431914.db2.gz	RWKMGLCIIVPODY-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000343564098	410535269	/nfs/dbraw/zinc/53/52/69/410535269.db2.gz	GYRQCJLANSYZLP-LLVKDONJSA-N	1	1	308.338	1.300	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)[N@H+](C)C1	ZINC000330514257	410741630	/nfs/dbraw/zinc/74/16/30/410741630.db2.gz	DLYDTRVTTYFQOA-BPNCWPANSA-N	1	1	307.350	1.491	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)[N@@H+](C)C1	ZINC000330514257	410741638	/nfs/dbraw/zinc/74/16/38/410741638.db2.gz	DLYDTRVTTYFQOA-BPNCWPANSA-N	1	1	307.350	1.491	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CC[NH+](C)C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000347889536	410779047	/nfs/dbraw/zinc/77/90/47/410779047.db2.gz	FYLSQLSAXYRSAB-UHFFFAOYSA-N	1	1	323.397	1.963	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2[C@H](O)C(F)(F)F)n1	ZINC000340205521	410750105	/nfs/dbraw/zinc/75/01/05/410750105.db2.gz	YLPRUAYYCKUGKA-ONGXEEELSA-N	1	1	322.287	1.569	20	5		DDBDMO
C[NH+](C)CC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000348048124	410824740	/nfs/dbraw/zinc/82/47/40/410824740.db2.gz	PESDBRPNROHUHC-UHFFFAOYSA-N	1	1	320.393	1.467	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356099560	410831878	/nfs/dbraw/zinc/83/18/78/410831878.db2.gz	QSVFZZLZOCYGIV-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000301958724	410835281	/nfs/dbraw/zinc/83/52/81/410835281.db2.gz	LQJSMYGJTCKFMK-OAHLLOKOSA-N	1	1	318.377	1.513	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000341068136	410880000	/nfs/dbraw/zinc/88/00/00/410880000.db2.gz	YCTMWNUAEPMJRT-TXEJJXNPSA-N	1	1	309.370	1.170	20	5		DDBDMO
CC[NH+](CC)CC1CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1	ZINC000330603310	410817754	/nfs/dbraw/zinc/81/77/54/410817754.db2.gz	JYAQETSJLUHGAA-UHFFFAOYSA-N	1	1	323.397	1.820	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NCC[N@H+]1CCCC(C)(C)C1	ZINC000331296762	411064738	/nfs/dbraw/zinc/06/47/38/411064738.db2.gz	OGVFEFXQMKQDMS-UHFFFAOYSA-N	1	1	309.370	1.180	20	5		DDBDMO
Cc1cnc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000353708080	411114981	/nfs/dbraw/zinc/11/49/81/411114981.db2.gz	HTQGJFWWHRYJAD-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1cnc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000353708080	411114984	/nfs/dbraw/zinc/11/49/84/411114984.db2.gz	HTQGJFWWHRYJAD-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
C[C@H]1C[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000360651165	418483714	/nfs/dbraw/zinc/48/37/14/418483714.db2.gz	FWWZAXQQUKBHDW-QWRGUYRKSA-N	1	1	313.379	1.356	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@](CO)(c2ccccc2)C1	ZINC000368259873	418711953	/nfs/dbraw/zinc/71/19/53/418711953.db2.gz	GTDCVJGUNWEDSF-MRXNPFEDSA-N	1	1	316.361	1.464	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@](CO)(c2ccccc2)C1	ZINC000368259873	418711955	/nfs/dbraw/zinc/71/19/55/418711955.db2.gz	GTDCVJGUNWEDSF-MRXNPFEDSA-N	1	1	316.361	1.464	20	5		DDBDMO
NC(=O)C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000367988737	418669964	/nfs/dbraw/zinc/66/99/64/418669964.db2.gz	MPJPSEHGSDMWMW-LLVKDONJSA-N	1	1	320.349	1.121	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000386438225	418740342	/nfs/dbraw/zinc/74/03/42/418740342.db2.gz	PIWDYMCHBBJYFG-MRVPVSSYSA-N	1	1	321.175	1.255	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000362058659	418746686	/nfs/dbraw/zinc/74/66/86/418746686.db2.gz	DLHBHDLOSCFXCP-WDEREUQCSA-N	1	1	309.322	1.171	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000362058659	418746688	/nfs/dbraw/zinc/74/66/88/418746688.db2.gz	DLHBHDLOSCFXCP-WDEREUQCSA-N	1	1	309.322	1.171	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@H]21	ZINC000371559693	418800324	/nfs/dbraw/zinc/80/03/24/418800324.db2.gz	AHDIACKQTAIOBH-ZWNOBZJWSA-N	1	1	304.350	1.343	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000365055775	418834649	/nfs/dbraw/zinc/83/46/49/418834649.db2.gz	WJBLFOZWVNJZTE-VXGBXAGGSA-N	1	1	320.349	1.815	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000364932853	418825305	/nfs/dbraw/zinc/82/53/05/418825305.db2.gz	KRYWPAUYNHKPAH-ZDUSSCGKSA-N	1	1	321.377	1.052	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000365587279	418878675	/nfs/dbraw/zinc/87/86/75/418878675.db2.gz	KLXZKYVHNKTIBK-HRCADAONSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000365587279	418878678	/nfs/dbraw/zinc/87/86/78/418878678.db2.gz	KLXZKYVHNKTIBK-HRCADAONSA-N	1	1	317.389	1.680	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000365587279	418878679	/nfs/dbraw/zinc/87/86/79/418878679.db2.gz	KLXZKYVHNKTIBK-HRCADAONSA-N	1	1	317.389	1.680	20	5		DDBDMO
CCCCNC(=O)CC[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000411476440	418908197	/nfs/dbraw/zinc/90/81/97/418908197.db2.gz	GPSBJMFKQNQQQO-UHFFFAOYSA-N	1	1	306.366	1.654	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@H](CO)C1	ZINC000420933225	419367172	/nfs/dbraw/zinc/36/71/72/419367172.db2.gz	FYGHRIPISSZYKS-AGIUHOORSA-N	1	1	321.377	1.872	20	5		DDBDMO
Cc1cn(Cc2cccc(C[NH+]3CCOCC3)c2)nc1[N+](=O)[O-]	ZINC000421215398	419526800	/nfs/dbraw/zinc/52/68/00/419526800.db2.gz	ODPYZGOJSXZTNW-UHFFFAOYSA-N	1	1	316.361	1.980	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2C[C@@H](O)C[C@@H]2c2ccccc2)c1	ZINC000411938083	419511013	/nfs/dbraw/zinc/51/10/13/419511013.db2.gz	JOCWHSLPFUPVNQ-LSDHHAIUSA-N	1	1	302.334	1.599	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](C(=O)N(C)C)C1	ZINC000411943424	419513696	/nfs/dbraw/zinc/51/36/96/419513696.db2.gz	QOZXWQUDZGHPBC-LLVKDONJSA-N	1	1	307.350	1.514	20	5		DDBDMO
COc1c(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC000421711926	419696979	/nfs/dbraw/zinc/69/69/79/419696979.db2.gz	PKHYHDPDUDAWGP-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CNc1nc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000422032233	419818637	/nfs/dbraw/zinc/81/86/37/419818637.db2.gz	FCOASEBGMXDZJM-SNVBAGLBSA-N	1	1	307.354	1.198	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000430280255	420102350	/nfs/dbraw/zinc/10/23/50/420102350.db2.gz	VPRBDNVJBDZSLS-HNNXBMFYSA-N	1	1	307.350	1.561	20	5		DDBDMO
C[NH2+]C[C@@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000430605189	420156386	/nfs/dbraw/zinc/15/63/86/420156386.db2.gz	QARJNIVNTDMAAJ-ZDUSSCGKSA-N	1	1	320.393	1.855	20	5		DDBDMO
Cc1cccc(NC[C@@](C)(O)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000302523194	230285415	/nfs/dbraw/zinc/28/54/15/230285415.db2.gz	YSGDEQRMLQARBS-OAHLLOKOSA-N	1	1	309.366	1.398	20	5		DDBDMO
COC[C@H](C)OC[C@H](O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315460	230362879	/nfs/dbraw/zinc/36/28/79/230362879.db2.gz	QPCFGKMJVSJFRL-BLLLJJGKSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@H](C)OC[C@H](O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000447315460	230362880	/nfs/dbraw/zinc/36/28/80/230362880.db2.gz	QPCFGKMJVSJFRL-BLLLJJGKSA-N	1	1	324.377	1.365	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000452123214	420623281	/nfs/dbraw/zinc/62/32/81/420623281.db2.gz	VIKUPPZXNZFQNA-CYBMUJFWSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C\c3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000493134898	420765153	/nfs/dbraw/zinc/76/51/53/420765153.db2.gz	WAAYCDOUBMNUSO-QEAXDZPNSA-N	1	1	301.346	1.771	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000493157645	420772384	/nfs/dbraw/zinc/77/23/84/420772384.db2.gz	OLPNVXGBMRMFLU-DKIZZRPMSA-N	1	1	301.346	1.771	20	5		DDBDMO
O=C1[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)C[C@@H]2CCCCN12	ZINC000453628717	420738888	/nfs/dbraw/zinc/73/88/88/420738888.db2.gz	NOBLTICRJVPHLS-FZMZJTMJSA-N	1	1	307.325	1.977	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCC2)[C@@H]2COC[C@@H]21	ZINC000459657314	420841498	/nfs/dbraw/zinc/84/14/98/420841498.db2.gz	FQDQOCPPLVNBHD-KGLIPLIRSA-N	1	1	319.361	1.257	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@](C)(F)C1	ZINC000449569785	421029517	/nfs/dbraw/zinc/02/95/17/421029517.db2.gz	DLBAHKQRQLJEMH-AWEZNQCLSA-N	1	1	311.313	1.377	20	5		DDBDMO
CN(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000523435962	421238863	/nfs/dbraw/zinc/23/88/63/421238863.db2.gz	ZALUSHDFXLQAMH-OAHLLOKOSA-N	1	1	318.377	1.973	20	5		DDBDMO
CC(C)[N@H+](Cc1ccccn1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000525782933	421300962	/nfs/dbraw/zinc/30/09/62/421300962.db2.gz	HBGSRULPXSNCLH-HNNXBMFYSA-N	1	1	319.365	1.458	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@H+](CCO)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641938	421441189	/nfs/dbraw/zinc/44/11/89/421441189.db2.gz	RHHHKVXYMYQRGN-QWHCGFSZSA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@@H](C(=O)N1CC[N@@H+](CCO)[C@@H](C)C1)c1cccc([N+](=O)[O-])c1	ZINC000514641938	421441190	/nfs/dbraw/zinc/44/11/90/421441190.db2.gz	RHHHKVXYMYQRGN-QWHCGFSZSA-N	1	1	321.377	1.223	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000548714449	421466408	/nfs/dbraw/zinc/46/64/08/421466408.db2.gz	JUGKHPHISIVVFY-NSHDSACASA-N	1	1	321.381	1.280	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CC[C@H](OC(F)F)C2)c([N+](=O)[O-])c1	ZINC000549412645	421500382	/nfs/dbraw/zinc/50/03/82/421500382.db2.gz	BCLLOMRKVLLYRI-JTQLQIEISA-N	1	1	315.276	1.507	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H](OC(F)F)C2)c([N+](=O)[O-])c1	ZINC000549412645	421500385	/nfs/dbraw/zinc/50/03/85/421500385.db2.gz	BCLLOMRKVLLYRI-JTQLQIEISA-N	1	1	315.276	1.507	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCN1CCCC1=O	ZINC000554558457	421650093	/nfs/dbraw/zinc/65/00/93/421650093.db2.gz	LBPQMGXATUSGFR-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[NH+]1CCN(CCCCNc2ncc([N+](=O)[O-])cc2F)CC1	ZINC000571144997	421691305	/nfs/dbraw/zinc/69/13/05/421691305.db2.gz	JJXIBHVZOUAIJZ-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000542778314	421828791	/nfs/dbraw/zinc/82/87/91/421828791.db2.gz	KUWDZIAQYYHDGQ-ZFWWWQNUSA-N	1	1	318.377	1.830	20	5		DDBDMO
C[C@@H](CN1CCN(C)CC1)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000572422985	421786818	/nfs/dbraw/zinc/78/68/18/421786818.db2.gz	NYKVOLPWCDIQIX-XJKSGUPXSA-N	1	1	318.421	1.808	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C(C)C)C2)n1	ZINC000584089903	422254380	/nfs/dbraw/zinc/25/43/80/422254380.db2.gz	VIGMWIAEKHPEGA-NSHDSACASA-N	1	1	309.370	1.271	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000576885956	422379250	/nfs/dbraw/zinc/37/92/50/422379250.db2.gz	MQGQAFACXBGIQV-NSHDSACASA-N	1	1	321.381	1.376	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCCC[C@@H]1C	ZINC000577294244	422384149	/nfs/dbraw/zinc/38/41/49/422384149.db2.gz	MGMOGRLPXSVXFO-QWRGUYRKSA-N	1	1	321.381	1.565	20	5		DDBDMO
Nc1nccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-]	ZINC000600469294	422411170	/nfs/dbraw/zinc/41/11/70/422411170.db2.gz	JCDYSLYCGFVORQ-NSHDSACASA-N	1	1	319.365	1.319	20	5		DDBDMO
Nc1ccc(N2CCN(c3ccsc3[N+](=O)[O-])CC2)c[nH+]1	ZINC000601108546	422417436	/nfs/dbraw/zinc/41/74/36/422417436.db2.gz	IPWQHOQMGBINBY-UHFFFAOYSA-N	1	1	305.363	1.960	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000342063026	271287885	/nfs/dbraw/zinc/28/78/85/271287885.db2.gz	NZHSYUOKIOTAQT-LLVKDONJSA-N	1	1	309.370	1.209	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000342063026	271287888	/nfs/dbraw/zinc/28/78/88/271287888.db2.gz	NZHSYUOKIOTAQT-LLVKDONJSA-N	1	1	309.370	1.209	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000342815370	271526331	/nfs/dbraw/zinc/52/63/31/271526331.db2.gz	PLXGENCFMHUOOB-UHFFFAOYSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC[N@@H+]1C[C@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1C	ZINC000345901809	272361749	/nfs/dbraw/zinc/36/17/49/272361749.db2.gz	HYEOVJBUCXZQFD-ZJUUUORDSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1C	ZINC000345901809	272361751	/nfs/dbraw/zinc/36/17/51/272361751.db2.gz	HYEOVJBUCXZQFD-ZJUUUORDSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000345916003	272364253	/nfs/dbraw/zinc/36/42/53/272364253.db2.gz	YZAZCAXIQRZOND-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)c1	ZINC000266326252	274118213	/nfs/dbraw/zinc/11/82/13/274118213.db2.gz	GGUIRBWWCXXQEK-RYUDHWBXSA-N	1	1	309.366	1.495	20	5		DDBDMO
O=[N+]([O-])c1c(N2CCC[N@H+](C3CC3)CC2)nc2sccn21	ZINC000057857711	275032707	/nfs/dbraw/zinc/03/27/07/275032707.db2.gz	ZTGSUYKSITVQNS-UHFFFAOYSA-N	1	1	307.379	1.979	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1	ZINC000119943293	277050369	/nfs/dbraw/zinc/05/03/69/277050369.db2.gz	LYYIFFHGIABHKR-UHFFFAOYSA-N	1	1	314.345	1.921	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3nccc(C(N)=O)c3[N+](=O)[O-])CC[C@@H]21	ZINC000290497377	277070720	/nfs/dbraw/zinc/07/07/20/277070720.db2.gz	ALVTTYSONHAHAQ-PWSUYJOCSA-N	1	1	319.365	1.009	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228306	277159253	/nfs/dbraw/zinc/15/92/53/277159253.db2.gz	OJZOZNGWYMZMKJ-NVXWUHKLSA-N	1	1	319.405	1.973	20	5		DDBDMO
CN1CC[C@@](O)(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228306	277159254	/nfs/dbraw/zinc/15/92/54/277159254.db2.gz	OJZOZNGWYMZMKJ-NVXWUHKLSA-N	1	1	319.405	1.973	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000279723159	278262962	/nfs/dbraw/zinc/26/29/62/278262962.db2.gz	MCQSLXKZMJXTSB-AWEZNQCLSA-N	1	1	323.393	1.626	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-]	ZINC000323707577	298261477	/nfs/dbraw/zinc/26/14/77/298261477.db2.gz	JYZZKQMROPUFIJ-MRXNPFEDSA-N	1	1	318.377	1.804	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1CO	ZINC000362100565	300005500	/nfs/dbraw/zinc/00/55/00/300005500.db2.gz	XSZMJBSKTGDBPE-ZYHUDNBSSA-N	1	1	318.333	1.705	20	5		DDBDMO
CC(C)OC(=O)CC[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000364324176	300376230	/nfs/dbraw/zinc/37/62/30/300376230.db2.gz	LIWRERDPRKHYBO-GFCCVEGCSA-N	1	1	310.354	1.770	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@@H]3CC[N@H+](C)[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000368587741	301059335	/nfs/dbraw/zinc/05/93/35/301059335.db2.gz	DRYJEIJFSCZHAM-XJKSGUPXSA-N	1	1	317.389	1.998	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[C@H]3OCC[N@H+](C)[C@H]3C2)n1	ZINC000408025351	301204913	/nfs/dbraw/zinc/20/49/13/301204913.db2.gz	BCEFJGYNIBODNU-QWHCGFSZSA-N	1	1	306.366	1.516	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H]3CCCCCC[C@@H]32)c1	ZINC000375852257	302004657	/nfs/dbraw/zinc/00/46/57/302004657.db2.gz	WLCXRYGDGQNBPW-YUELXQCFSA-N	1	1	308.382	1.807	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1	ZINC000375987995	302019853	/nfs/dbraw/zinc/01/98/53/302019853.db2.gz	YRXKEIXKGWPANK-HNNXBMFYSA-N	1	1	321.377	1.316	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N(C)CCc2ccccc2[N+](=O)[O-])C1	ZINC000375987995	302019855	/nfs/dbraw/zinc/01/98/55/302019855.db2.gz	YRXKEIXKGWPANK-HNNXBMFYSA-N	1	1	321.377	1.316	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641904	302360059	/nfs/dbraw/zinc/36/00/59/302360059.db2.gz	XMMALNVQKMATHG-NEPJUHHUSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000398641904	302360061	/nfs/dbraw/zinc/36/00/61/302360061.db2.gz	XMMALNVQKMATHG-NEPJUHHUSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1	ZINC000531726628	303253030	/nfs/dbraw/zinc/25/30/30/303253030.db2.gz	QXIZQSMBMSFAAQ-AAEUAGOBSA-N	1	1	306.366	1.490	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@H]1C	ZINC000532134480	303276355	/nfs/dbraw/zinc/27/63/55/303276355.db2.gz	ZCMFMQXNBZBRBK-VXGBXAGGSA-N	1	1	306.366	1.983	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367782057	307104083	/nfs/dbraw/zinc/10/40/83/307104083.db2.gz	TWPFKBLEHSRNIE-OLRMPSLUSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367782057	307104084	/nfs/dbraw/zinc/10/40/84/307104084.db2.gz	TWPFKBLEHSRNIE-OLRMPSLUSA-N	1	1	305.334	1.092	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](N3CCOCC3)C2)c1	ZINC000565174952	308023561	/nfs/dbraw/zinc/02/35/61/308023561.db2.gz	UPIYRRWJLWRCIX-MRXNPFEDSA-N	1	1	305.378	1.891	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000565233516	308026394	/nfs/dbraw/zinc/02/63/94/308026394.db2.gz	MXSWYMBAZHCRHD-ZDUSSCGKSA-N	1	1	319.365	1.554	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000576977164	308353782	/nfs/dbraw/zinc/35/37/82/308353782.db2.gz	HLWJITCVPDHQRI-LLVKDONJSA-N	1	1	302.290	1.370	20	5		DDBDMO
COC[C@@H](C)OC[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361708	332353644	/nfs/dbraw/zinc/35/36/44/332353644.db2.gz	PNXLTCHCCYVXKF-TZMCWYRMSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@@H](C)OC[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361708	332353645	/nfs/dbraw/zinc/35/36/45/332353645.db2.gz	PNXLTCHCCYVXKF-TZMCWYRMSA-N	1	1	324.377	1.365	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1	ZINC000451341753	534889321	/nfs/dbraw/zinc/88/93/21/534889321.db2.gz	LQYRKOANRNAYGL-ZNMIVQPWSA-N	1	1	308.382	1.807	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000459600193	528035079	/nfs/dbraw/zinc/03/50/79/528035079.db2.gz	SOVLTNBECCZATD-UHFFFAOYSA-N	1	1	322.365	1.346	20	5		DDBDMO
CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(=O)OC	ZINC000299373401	528400786	/nfs/dbraw/zinc/40/07/86/528400786.db2.gz	ZMKYMGCITSKFCW-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)CC(=O)OC	ZINC000299373401	528400789	/nfs/dbraw/zinc/40/07/89/528400789.db2.gz	ZMKYMGCITSKFCW-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC(C)[C@H]([NH3+])CN[C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803807	529068924	/nfs/dbraw/zinc/06/89/24/529068924.db2.gz	WVXWYEILVWPLLG-SMDDNHRTSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@H](N)C[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000414803807	529068928	/nfs/dbraw/zinc/06/89/28/529068928.db2.gz	WVXWYEILVWPLLG-SMDDNHRTSA-N	1	1	308.382	1.885	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)CC[N@H+]1C	ZINC000820664754	599588645	/nfs/dbraw/zinc/58/86/45/599588645.db2.gz	BQDHMOSQSCXTNL-NXEZZACHSA-N	1	1	317.353	1.670	20	5		DDBDMO
CCC[N@@H+](CC)CCNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000821094299	606715032	/nfs/dbraw/zinc/71/50/32/606715032.db2.gz	GDAULUBHJGEDEC-UHFFFAOYSA-N	1	1	320.357	1.314	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)[NH2+][C@H](C)C1	ZINC000070076982	696387220	/nfs/dbraw/zinc/38/72/20/696387220.db2.gz	DRSUPVCBPYVIJT-GHMZBOCLSA-N	1	1	313.379	1.274	20	5		DDBDMO
CON(C)C(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000799143227	700122467	/nfs/dbraw/zinc/12/24/67/700122467.db2.gz	KIQCFMYPUCGOGJ-UHFFFAOYSA-N	1	1	307.350	1.969	20	5		DDBDMO
O=C(CCN1C[C@@H]2C[NH2+]C[C@H]2C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782480617	698728196	/nfs/dbraw/zinc/72/81/96/698728196.db2.gz	BAGCJZICIGYUMC-QWRGUYRKSA-N	1	1	322.340	1.214	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C[C@@H]1O	ZINC000782524607	698734127	/nfs/dbraw/zinc/73/41/27/698734127.db2.gz	OMGPJTVWRLUXRF-RNCFNFMXSA-N	1	1	311.313	1.375	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@H]3C[C@@]3(CO)C1)OCCO2	ZINC000783735357	698871701	/nfs/dbraw/zinc/87/17/01/698871701.db2.gz	PQGSBTPKJAAICQ-ABAIWWIYSA-N	1	1	306.318	1.180	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1C[C@H]3C[C@@]3(CO)C1)OCCO2	ZINC000783735357	698871706	/nfs/dbraw/zinc/87/17/06/698871706.db2.gz	PQGSBTPKJAAICQ-ABAIWWIYSA-N	1	1	306.318	1.180	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000731455911	699529194	/nfs/dbraw/zinc/52/91/94/699529194.db2.gz	XGRXQMVBAAUZTA-OCCSQVGLSA-N	1	1	323.324	1.327	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000731947252	699542272	/nfs/dbraw/zinc/54/22/72/699542272.db2.gz	BOIQHLTZPRIKBG-ZDUSSCGKSA-N	1	1	323.422	1.127	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000731947252	699542273	/nfs/dbraw/zinc/54/22/73/699542273.db2.gz	BOIQHLTZPRIKBG-ZDUSSCGKSA-N	1	1	323.422	1.127	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000796556224	699938840	/nfs/dbraw/zinc/93/88/40/699938840.db2.gz	ODHIYUYCDFVFIL-KCXAZCMYSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C[C@]2(CCOC2)O1	ZINC000796556224	699938842	/nfs/dbraw/zinc/93/88/42/699938842.db2.gz	ODHIYUYCDFVFIL-KCXAZCMYSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[N@@H+](C)[C@H](C)C1	ZINC000761077383	700840758	/nfs/dbraw/zinc/84/07/58/700840758.db2.gz	RTSBDVIZGKKQQU-VXGBXAGGSA-N	1	1	306.366	1.558	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@@H+]1C	ZINC000766207791	701042427	/nfs/dbraw/zinc/04/24/27/701042427.db2.gz	ZUZCRICEWQCUFA-LLVKDONJSA-N	1	1	314.345	1.919	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC[N@H+]1C	ZINC000766207791	701042429	/nfs/dbraw/zinc/04/24/29/701042429.db2.gz	ZUZCRICEWQCUFA-LLVKDONJSA-N	1	1	314.345	1.919	20	5		DDBDMO
C[N@H+]1CCCN(c2ccc(NC(=O)[C@@H]3CC3[N+](=O)[O-])cc2)CC1	ZINC000839543359	701730965	/nfs/dbraw/zinc/73/09/65/701730965.db2.gz	JHVICWWDLNQHCX-HUUCEWRRSA-N	1	1	318.377	1.432	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H]1CCC(=O)N1	ZINC000839670015	701774539	/nfs/dbraw/zinc/77/45/39/701774539.db2.gz	REVCMAGDSHXZLG-UKRRQHHQSA-N	1	1	321.377	1.617	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000867982199	701872078	/nfs/dbraw/zinc/87/20/78/701872078.db2.gz	LXRYOIAYZOPOAF-XFJVYGCCSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000867985314	701874550	/nfs/dbraw/zinc/87/45/50/701874550.db2.gz	AFOVKEQDEZTNIQ-BFQNTYOBSA-N	1	1	321.377	1.795	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)c1	ZINC000812321484	702147332	/nfs/dbraw/zinc/14/73/32/702147332.db2.gz	DWQWIIJRFGEUKA-OLZOCXBDSA-N	1	1	303.362	1.927	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4ccccn4c3[N+](=O)[O-])CC[C@@H]21	ZINC000866206013	706648542	/nfs/dbraw/zinc/64/85/42/706648542.db2.gz	ICIDIQGBTCXJBY-NEPJUHHUSA-N	1	1	301.350	1.773	20	5		DDBDMO
CC1(C(=O)O[C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)COC1	ZINC000813173597	702307967	/nfs/dbraw/zinc/30/79/67/702307967.db2.gz	GQAHZQQZKNTRKH-AWEZNQCLSA-N	1	1	320.345	1.749	20	5		DDBDMO
CC1(C(=O)O[C@H]2CC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)COC1	ZINC000813173597	702307975	/nfs/dbraw/zinc/30/79/75/702307975.db2.gz	GQAHZQQZKNTRKH-AWEZNQCLSA-N	1	1	320.345	1.749	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNCCC[NH+]2CCC(O)CC2)c1	ZINC000843061136	702810462	/nfs/dbraw/zinc/81/04/62/702810462.db2.gz	AAJPSUNNQKQVQC-MRXNPFEDSA-N	1	1	323.393	1.065	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCC[C@H]1CC[N@H+](C)C1	ZINC000847827374	703473827	/nfs/dbraw/zinc/47/38/27/703473827.db2.gz	PFULRFHUMFBASK-GFCCVEGCSA-N	1	1	310.354	1.375	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCS(C)(=O)=O	ZINC000850431473	703730728	/nfs/dbraw/zinc/73/07/28/703730728.db2.gz	XMQNDPDTDMRSDN-VIFPVBQESA-N	1	1	302.352	1.299	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H]2CC[N@@H+](CC(C)(C)O)C2)c1[N+](=O)[O-]	ZINC000869784698	703852548	/nfs/dbraw/zinc/85/25/48/703852548.db2.gz	NBAAFPHGXIPWFC-LBPRGKRZSA-N	1	1	321.377	1.478	20	5		DDBDMO
O=C1OCCN1[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000852432693	704045478	/nfs/dbraw/zinc/04/54/78/704045478.db2.gz	NXNFLGZXRVLXBC-GFCCVEGCSA-N	1	1	321.333	1.500	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+][C@H]2CCn3ccnc32)c1	ZINC000819338134	704110175	/nfs/dbraw/zinc/11/01/75/704110175.db2.gz	WZPIWZSLBTVAJT-JSGCOSHPSA-N	1	1	318.333	1.266	20	5		DDBDMO
C[C@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000870789995	704133028	/nfs/dbraw/zinc/13/30/28/704133028.db2.gz	LXJYCTUEUGYULM-NEPJUHHUSA-N	1	1	310.354	1.597	20	5		DDBDMO
Cc1ccc(C[NH2+]C2CC[NH+](CC(=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000874047782	704926543	/nfs/dbraw/zinc/92/65/43/704926543.db2.gz	ASLRXUNMZJLBEW-UHFFFAOYSA-N	1	1	307.350	1.542	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H]1CCC[N@@H+]2C	ZINC000874848152	705201352	/nfs/dbraw/zinc/20/13/52/705201352.db2.gz	RUWYMZWEGNRLQP-ZIAGYGMSSA-N	1	1	304.350	1.607	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823968187	705347041	/nfs/dbraw/zinc/34/70/41/705347041.db2.gz	MNTNISDNQSXLPM-VHSXEESVSA-N	1	1	307.354	1.733	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000825338284	705649046	/nfs/dbraw/zinc/64/90/46/705649046.db2.gz	NXBXCIBCJIUHIL-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825379940	705658573	/nfs/dbraw/zinc/65/85/73/705658573.db2.gz	UECFAZGVPIEYPG-IAQYHMDHSA-N	1	1	319.361	1.229	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825830353	705735328	/nfs/dbraw/zinc/73/53/28/705735328.db2.gz	KNQHOVDEIUKUMP-HUUCEWRRSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000826970467	705902930	/nfs/dbraw/zinc/90/29/30/705902930.db2.gz	MPINPKCLVFHPEF-GMXABZIVSA-N	1	1	319.361	1.370	20	5		DDBDMO
COc1c(C(=O)N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827264786	705963257	/nfs/dbraw/zinc/96/32/57/705963257.db2.gz	DOTUQMFNNVMITF-WCQYABFASA-N	1	1	319.361	1.770	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000877330675	706066498	/nfs/dbraw/zinc/06/64/98/706066498.db2.gz	GDTRKUSFXUCAFD-CQSZACIVSA-N	1	1	305.378	1.728	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCN2CCOC[C@H]2C1	ZINC000877330675	706066499	/nfs/dbraw/zinc/06/64/99/706066499.db2.gz	GDTRKUSFXUCAFD-CQSZACIVSA-N	1	1	305.378	1.728	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)c1c(F)cccc1[N+](=O)[O-]	ZINC000865057861	706338086	/nfs/dbraw/zinc/33/80/86/706338086.db2.gz	FXDTVXVYTQFIDS-QWRGUYRKSA-N	1	1	323.324	1.327	20	5		DDBDMO
C[C@@H](NC[C@H]1C[N@@H+](C)CCN1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872036702	707284460	/nfs/dbraw/zinc/28/44/60/707284460.db2.gz	VKXWGKMFSIKDOI-NEPJUHHUSA-N	1	1	310.373	1.630	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271631	707359140	/nfs/dbraw/zinc/35/91/40/707359140.db2.gz	TUFFVRFWRTWCJL-QWHCGFSZSA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@H](C(F)F)CC2)cc1	ZINC000872271631	707359143	/nfs/dbraw/zinc/35/91/43/707359143.db2.gz	TUFFVRFWRTWCJL-QWHCGFSZSA-N	1	1	316.304	1.984	20	5		DDBDMO
C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ccnc(F)c1[N+](=O)[O-]	ZINC000882580879	707706976	/nfs/dbraw/zinc/70/69/76/707706976.db2.gz	JANBXEBDMOQICV-NSHDSACASA-N	1	1	313.377	1.813	20	5		DDBDMO
C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ccnc(F)c1[N+](=O)[O-]	ZINC000882580879	707706978	/nfs/dbraw/zinc/70/69/78/707706978.db2.gz	JANBXEBDMOQICV-NSHDSACASA-N	1	1	313.377	1.813	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+]CCO[C@H]3CCOC3)nc2c1	ZINC000897202162	708251613	/nfs/dbraw/zinc/25/16/13/708251613.db2.gz	QJQMYMRJUHBGAX-NSHDSACASA-N	1	1	307.306	1.631	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)c1	ZINC000897221630	708259563	/nfs/dbraw/zinc/25/95/63/708259563.db2.gz	NXPCAXCOMKJUPJ-UONOGXRCSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cc1ccc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897222597	708260097	/nfs/dbraw/zinc/26/00/97/708260097.db2.gz	WCXCMIPNHGEWCN-KBPBESRZSA-N	1	1	305.378	1.939	20	5		DDBDMO
CN(C)C(=O)C1([NH2+]Cc2cccnc2[N+](=O)[O-])CCCCC1	ZINC000886226521	708719484	/nfs/dbraw/zinc/71/94/84/708719484.db2.gz	NMNRTEBAYOTPKQ-UHFFFAOYSA-N	1	1	306.366	1.871	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+](CCN1CCOCC1)CC1CC1	ZINC000886284501	708735686	/nfs/dbraw/zinc/73/56/86/708735686.db2.gz	ZAOBRZFQSHUGLT-UHFFFAOYSA-N	1	1	320.393	1.534	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+](CCN1CCOCC1)CC1CC1	ZINC000886284501	708735689	/nfs/dbraw/zinc/73/56/89/708735689.db2.gz	ZAOBRZFQSHUGLT-UHFFFAOYSA-N	1	1	320.393	1.534	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c1	ZINC000886584516	708782659	/nfs/dbraw/zinc/78/26/59/708782659.db2.gz	QISFDSGASFYJDQ-YUDUHTQSSA-N	1	1	322.361	1.037	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C)CC[N@@H+](C)CC1	ZINC000888985091	709422116	/nfs/dbraw/zinc/42/21/16/709422116.db2.gz	KYACHMZITJADNU-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C)CC[N@H+](C)CC1	ZINC000888985091	709422118	/nfs/dbraw/zinc/42/21/18/709422118.db2.gz	KYACHMZITJADNU-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000900812299	709773657	/nfs/dbraw/zinc/77/36/57/709773657.db2.gz	UVXVWWDWHOUBEI-JSGCOSHPSA-N	1	1	320.393	1.267	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104023	713132173	/nfs/dbraw/zinc/13/21/73/713132173.db2.gz	STCAQWJFTNIOJO-ZIAGYGMSSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])cc1	ZINC000928104023	713132175	/nfs/dbraw/zinc/13/21/75/713132175.db2.gz	STCAQWJFTNIOJO-ZIAGYGMSSA-N	1	1	321.402	1.904	20	5		DDBDMO
COc1c(O)ccc(CN(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000891941322	710333897	/nfs/dbraw/zinc/33/38/97/710333897.db2.gz	WGEXUYHLQFHFFF-CYBMUJFWSA-N	1	1	321.377	1.978	20	5		DDBDMO
C[NH+]1C[C@]2(C)CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000913286020	713191809	/nfs/dbraw/zinc/19/18/09/713191809.db2.gz	XUXNZWFCZNPVIP-HZPDHXFCSA-N	1	1	319.361	1.714	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000928434470	713194334	/nfs/dbraw/zinc/19/43/34/713194334.db2.gz	DZEZKJQHPJYNKJ-SCZZXKLOSA-N	1	1	307.306	1.146	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637878	710833057	/nfs/dbraw/zinc/83/30/57/710833057.db2.gz	KTQAUNVEMMGILO-JSGCOSHPSA-N	1	1	317.349	1.920	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000902637878	710833060	/nfs/dbraw/zinc/83/30/60/710833060.db2.gz	KTQAUNVEMMGILO-JSGCOSHPSA-N	1	1	317.349	1.920	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12	ZINC000902906047	710953435	/nfs/dbraw/zinc/95/34/35/710953435.db2.gz	RKCDXWKPFIFWPG-YPMHNXCESA-N	1	1	324.406	1.243	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12	ZINC000902906047	710953440	/nfs/dbraw/zinc/95/34/40/710953440.db2.gz	RKCDXWKPFIFWPG-YPMHNXCESA-N	1	1	324.406	1.243	20	5		DDBDMO
C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H]1CO	ZINC000894885676	711308154	/nfs/dbraw/zinc/30/81/54/711308154.db2.gz	RRAWAJWPCHPJPC-SECBINFHSA-N	1	1	320.271	1.121	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@@H]1CO	ZINC000894885676	711308158	/nfs/dbraw/zinc/30/81/58/711308158.db2.gz	RRAWAJWPCHPJPC-SECBINFHSA-N	1	1	320.271	1.121	20	5		DDBDMO
COc1c(O)ccc(CN(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000894981423	711349435	/nfs/dbraw/zinc/34/94/35/711349435.db2.gz	IFUVBUPBGVTVQW-GFCCVEGCSA-N	1	1	309.366	1.835	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2c1nc2ccccn2c1[N+](=O)[O-]	ZINC000895192996	711449578	/nfs/dbraw/zinc/44/95/78/711449578.db2.gz	PIGWKFPJTLNSKR-NWDGAFQWSA-N	1	1	301.350	1.915	20	5		DDBDMO
CC[NH+]1CCN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929110710	713548486	/nfs/dbraw/zinc/54/84/86/713548486.db2.gz	FUTJHLCMZUGKHH-GJZGRUSLSA-N	1	1	303.362	1.862	20	5		DDBDMO
C[C@@H]1[C@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044510	713989626	/nfs/dbraw/zinc/98/96/26/713989626.db2.gz	NNODNCYMAIEMTG-IUODEOHRSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044510	713989627	/nfs/dbraw/zinc/98/96/27/713989627.db2.gz	NNODNCYMAIEMTG-IUODEOHRSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000931392357	714082863	/nfs/dbraw/zinc/08/28/63/714082863.db2.gz	WEZMIKMKOQYTPL-TXEJJXNPSA-N	1	1	301.350	1.750	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCn2cc[nH+]c21	ZINC000931523491	714119049	/nfs/dbraw/zinc/11/90/49/714119049.db2.gz	DBWQFNOLEDKQIB-JTQLQIEISA-N	1	1	301.306	1.639	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000931609186	714138116	/nfs/dbraw/zinc/13/81/16/714138116.db2.gz	DDQFAIYHSHJTTG-TVQRCGJNSA-N	1	1	308.313	1.902	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)C1	ZINC000931609187	714138143	/nfs/dbraw/zinc/13/81/43/714138143.db2.gz	DDQFAIYHSHJTTG-ZANVPECISA-N	1	1	308.313	1.902	20	5		DDBDMO
CCOc1cc(NC(=O)NC[C@@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000931903648	714209278	/nfs/dbraw/zinc/20/92/78/714209278.db2.gz	OYMVLNHVUGYSAL-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
C[C@]1([C@H]2CCC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)COC(=O)N1	ZINC000932016808	714235872	/nfs/dbraw/zinc/23/58/72/714235872.db2.gz	PLDAUXNTJOCUFG-SWLSCSKDSA-N	1	1	320.349	1.700	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCn2nc(C3CC3)cc2C1	ZINC000932602268	714365770	/nfs/dbraw/zinc/36/57/70/714365770.db2.gz	XHPJPKJHCABEJM-UHFFFAOYSA-N	1	1	316.365	1.689	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCn2nc(C3CC3)cc2C1	ZINC000932602268	714365771	/nfs/dbraw/zinc/36/57/71/714365771.db2.gz	XHPJPKJHCABEJM-UHFFFAOYSA-N	1	1	316.365	1.689	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CCN(C)CC[N@@H+](C)CC1	ZINC000933991422	714716447	/nfs/dbraw/zinc/71/64/47/714716447.db2.gz	DJBDZFVBRUJBOP-UHFFFAOYSA-N	1	1	322.409	1.283	20	5		DDBDMO
COc1ccc(CN2CCN(C)CC[N@@H+](C)CC2)cc1[N+](=O)[O-]	ZINC000933998608	714719410	/nfs/dbraw/zinc/71/94/10/714719410.db2.gz	LIMDIPCSNNSVGS-UHFFFAOYSA-N	1	1	322.409	1.283	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+](Cc2ccoc2)C2CC2)c1	ZINC000934003574	714720391	/nfs/dbraw/zinc/72/03/91/714720391.db2.gz	ATOMTWBNGFQMHM-CQSZACIVSA-N	1	1	306.322	1.410	20	5		DDBDMO
C/C(=C/C(=O)NCC[N@@H+](C)CCO)c1ccc([N+](=O)[O-])cc1	ZINC000924997444	714720895	/nfs/dbraw/zinc/72/08/95/714720895.db2.gz	HNMSCKKMOPZTJK-QXMHVHEDSA-N	1	1	307.350	1.038	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@H]1C	ZINC000935169259	714994039	/nfs/dbraw/zinc/99/40/39/714994039.db2.gz	YWZQJRPKMBNCBK-MNOVXSKESA-N	1	1	309.370	1.041	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[N@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC001164643042	719178182	/nfs/dbraw/zinc/17/81/82/719178182.db2.gz	YWMJDCJFZDVXNV-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c([N+](=O)[O-])c1	ZINC001164643042	719178185	/nfs/dbraw/zinc/17/81/85/719178185.db2.gz	YWMJDCJFZDVXNV-NXEZZACHSA-N	1	1	308.338	1.305	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923251	721848930	/nfs/dbraw/zinc/84/89/30/721848930.db2.gz	UNHOKRDCMBXEFW-KBPBESRZSA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cc([N+](=O)[O-])ccn1	ZINC001164923251	721848932	/nfs/dbraw/zinc/84/89/32/721848932.db2.gz	UNHOKRDCMBXEFW-KBPBESRZSA-N	1	1	305.382	1.204	20	5		DDBDMO
C[N@@H+]1CCc2c(NCC(C)(C)C(N)=O)ccc([N+](=O)[O-])c2C1	ZINC001167606282	734813135	/nfs/dbraw/zinc/81/31/35/734813135.db2.gz	TVDXFSATIBTMKI-UHFFFAOYSA-N	1	1	306.366	1.506	20	5		DDBDMO
C[N@H+]1CCc2c(NCC(C)(C)C(N)=O)ccc([N+](=O)[O-])c2C1	ZINC001167606282	734813139	/nfs/dbraw/zinc/81/31/39/734813139.db2.gz	TVDXFSATIBTMKI-UHFFFAOYSA-N	1	1	306.366	1.506	20	5		DDBDMO
COC(=O)CC1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC001182763372	743708912	/nfs/dbraw/zinc/70/89/12/743708912.db2.gz	DKZXEMZAYWCFBR-UHFFFAOYSA-N	1	1	305.290	1.921	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC001184065549	743956734	/nfs/dbraw/zinc/95/67/34/743956734.db2.gz	IOJPHULCHZTONT-LLVKDONJSA-N	1	1	324.333	1.694	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](Cc2ccc(O)c(OC)c2[N+](=O)[O-])C1	ZINC001184065549	743956736	/nfs/dbraw/zinc/95/67/36/743956736.db2.gz	IOJPHULCHZTONT-LLVKDONJSA-N	1	1	324.333	1.694	20	5		DDBDMO
CC(C)[N@H+](CCO)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001190485512	745223096	/nfs/dbraw/zinc/22/30/96/745223096.db2.gz	LHNKYHFREGNHHN-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
CC(C)[N@@H+](CCO)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001190485512	745223102	/nfs/dbraw/zinc/22/31/02/745223102.db2.gz	LHNKYHFREGNHHN-UHFFFAOYSA-N	1	1	306.322	1.848	20	5		DDBDMO
[NH3+]C1(c2cccnc2)CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001168992058	762165708	/nfs/dbraw/zinc/16/57/08/762165708.db2.gz	JFHAJNCAOBBSHF-HIFRSBDPSA-N	1	1	304.394	1.777	20	5		DDBDMO
O=C1c2ccccc2[C@@H]2C[N@@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CCN12	ZINC001169010277	762177939	/nfs/dbraw/zinc/17/79/39/762177939.db2.gz	CCIKQPDPOMNBPE-ZENOOKHLSA-N	1	1	315.373	1.945	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2cn(C)nc21	ZINC001169017562	762198223	/nfs/dbraw/zinc/19/82/23/762198223.db2.gz	AOKLOEYQEHEVGY-VHDGCEQUSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCC(=O)N1C[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1	ZINC001048632668	769597198	/nfs/dbraw/zinc/59/71/98/769597198.db2.gz	SFQOMSNOTFQSJE-OKILXGFUSA-N	1	1	303.362	1.895	20	5		DDBDMO
CCCC1(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001133458320	769860558	/nfs/dbraw/zinc/86/05/58/769860558.db2.gz	SEMHMNLHMCHTBE-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
Cc1ccc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1	ZINC001148855629	773617859	/nfs/dbraw/zinc/61/78/59/773617859.db2.gz	LUCQYABKHAAUDT-UHFFFAOYSA-N	1	1	317.349	1.156	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001093642076	774939635	/nfs/dbraw/zinc/93/96/35/774939635.db2.gz	JIUQTWJRTPECOZ-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1cccc(F)c1[N+](=O)[O-])C1CCC1	ZINC001094221807	775543856	/nfs/dbraw/zinc/54/38/56/775543856.db2.gz	RMKJDOXGUJZDIE-UHFFFAOYSA-N	1	1	324.356	1.746	20	5		DDBDMO
CC[N@H+](CCNC(=O)c1ccon1)Cc1ccccc1[N+](=O)[O-]	ZINC001267238566	837583097	/nfs/dbraw/zinc/58/30/97/837583097.db2.gz	OZJUUDGNJPBWIG-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccon1)Cc1ccccc1[N+](=O)[O-]	ZINC001267238566	837583100	/nfs/dbraw/zinc/58/31/00/837583100.db2.gz	OZJUUDGNJPBWIG-UHFFFAOYSA-N	1	1	318.333	1.835	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC(F)(F)C1	ZINC001266560589	836470232	/nfs/dbraw/zinc/47/02/32/836470232.db2.gz	SEPWDTQHMVUJMQ-VXGBXAGGSA-N	1	1	319.352	1.525	20	5		DDBDMO
CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC(F)(F)C1	ZINC001266560589	836470240	/nfs/dbraw/zinc/47/02/40/836470240.db2.gz	SEPWDTQHMVUJMQ-VXGBXAGGSA-N	1	1	319.352	1.525	20	5		DDBDMO
CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC(F)(F)C1	ZINC001266560589	836470243	/nfs/dbraw/zinc/47/02/43/836470243.db2.gz	SEPWDTQHMVUJMQ-VXGBXAGGSA-N	1	1	319.352	1.525	20	5		DDBDMO
CC(C)OCC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC001268703116	840691006	/nfs/dbraw/zinc/69/10/06/840691006.db2.gz	IZTOFFNDHMCWIF-UHFFFAOYSA-N	1	1	321.377	1.568	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1N	ZINC001150119812	862099318	/nfs/dbraw/zinc/09/93/18/862099318.db2.gz	LJLLJXDRMCAQIV-LKFCYVNXSA-N	1	1	304.350	1.390	20	5		DDBDMO
CC(C)[N@H+]1CCCN(c2nnc(C[N+](=O)[O-])n2CC2CC2)CC1	ZINC001123508018	859271528	/nfs/dbraw/zinc/27/15/28/859271528.db2.gz	USKSLRQDRCYWOA-UHFFFAOYSA-N	1	1	322.413	1.385	20	5		DDBDMO
CC(C)[C@]1(CO)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001325875294	860910525	/nfs/dbraw/zinc/91/05/25/860910525.db2.gz	UILNHUPTGUHFSQ-HZPDHXFCSA-N	1	1	308.378	1.969	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@H]2CCC[N@@H+](C)[C@@H]2C1	ZINC001157259095	863688636	/nfs/dbraw/zinc/68/86/36/863688636.db2.gz	CQCIZUODGUGMID-ZWNOBZJWSA-N	1	1	320.349	1.307	20	5		DDBDMO
CCN(c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1)C1CN(C)C1	ZINC001157456616	863831473	/nfs/dbraw/zinc/83/14/73/863831473.db2.gz	SABZBGQLVUQUOQ-VOTSOKGWSA-N	1	1	305.382	1.662	20	5		DDBDMO
C[N@@H+](CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC001330235317	864177800	/nfs/dbraw/zinc/17/78/00/864177800.db2.gz	BMXWAJUIZVQNJC-UHFFFAOYSA-N	1	1	304.350	1.714	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001154022541	864331081	/nfs/dbraw/zinc/33/10/81/864331081.db2.gz	LBJNKABUFLTMNJ-YUMQZZPRSA-N	1	1	313.745	1.280	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001330570310	864458059	/nfs/dbraw/zinc/45/80/59/864458059.db2.gz	AESZOOKKNROUAC-KYOSRNDESA-N	1	1	321.377	1.569	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(N2CC[N@H+]3CC[C@H]3C2)nn1	ZINC001158430068	864650673	/nfs/dbraw/zinc/65/06/73/864650673.db2.gz	AUENFEDYXJOSCL-LBPRGKRZSA-N	1	1	311.345	1.946	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@H](O)C(F)(F)F)ncc1[N+](=O)[O-]	ZINC001158542397	864715328	/nfs/dbraw/zinc/71/53/28/864715328.db2.gz	FTRNROLFUOUFEC-FSIBCCDJSA-N	1	1	320.271	1.857	20	5		DDBDMO
Cc1ccccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001277055341	881909987	/nfs/dbraw/zinc/90/99/87/881909987.db2.gz	ODZGVMHYYHEKSE-ZIAGYGMSSA-N	1	1	303.362	1.399	20	5		DDBDMO
COc1c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC001321043544	867257790	/nfs/dbraw/zinc/25/77/90/867257790.db2.gz	SSDMQDCDWKYZBJ-GFCCVEGCSA-N	1	1	319.361	1.914	20	5		DDBDMO
Cc1nn(CN2C[C@@H]3CC[C@H]([NH+](C)C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC001334748336	867809233	/nfs/dbraw/zinc/80/92/33/867809233.db2.gz	OSEVXSJYWMIWHO-MJBXVCDLSA-N	1	1	307.398	1.719	20	5		DDBDMO
COc1ncnc(NCC[C@@H]2CC[NH2+]CC2(F)F)c1[N+](=O)[O-]	ZINC001162810282	867843735	/nfs/dbraw/zinc/84/37/35/867843735.db2.gz	KEHSYCLPSYRFEC-QMMMGPOBSA-N	1	1	317.296	1.440	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N[C@H]1CCC[N@H+]2CCSC[C@@H]12	ZINC001336836577	869174137	/nfs/dbraw/zinc/17/41/37/869174137.db2.gz	IOTRVKKINRNRJA-AAEUAGOBSA-N	1	1	308.407	1.712	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2cncs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494232	869232722	/nfs/dbraw/zinc/23/27/22/869232722.db2.gz	AJEFGVZRZVQSPN-VXGBXAGGSA-N	1	1	324.406	1.184	20	5		DDBDMO
CC/C=C\CC[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494924	869233499	/nfs/dbraw/zinc/23/34/99/869233499.db2.gz	YNNIGXHLCIXAQW-JHZNUDOXSA-N	1	1	309.410	1.884	20	5		DDBDMO
COc1cc(C(=O)NC[C@H]2CCCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC001339266723	870430508	/nfs/dbraw/zinc/43/05/08/870430508.db2.gz	VXWKGQCZUCTSJX-GFCCVEGCSA-N	1	1	307.350	1.818	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)[C@H]1[NH2+]CCc2occc21	ZINC001339960906	870808330	/nfs/dbraw/zinc/80/83/30/870808330.db2.gz	WLEVZKUQYZPULH-AWEZNQCLSA-N	1	1	301.302	1.691	20	5		DDBDMO
Cc1[nH]c(Cn2nc(-c3ccc([N+](=O)[O-])cc3)oc2=O)c(C)[nH+]1	ZINC001307319287	871419527	/nfs/dbraw/zinc/41/95/27/871419527.db2.gz	CMZGXTTWYZFFEQ-UHFFFAOYSA-N	1	1	315.289	1.800	20	5		DDBDMO
COc1cccc(C[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001316823114	872116995	/nfs/dbraw/zinc/11/69/95/872116995.db2.gz	CNPVFBOWYNYNCZ-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
COc1cccc(C[N@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001316823114	872117000	/nfs/dbraw/zinc/11/70/00/872117000.db2.gz	CNPVFBOWYNYNCZ-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
COc1cccc(C[N@@H+](C)CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001316823114	872117004	/nfs/dbraw/zinc/11/70/04/872117004.db2.gz	CNPVFBOWYNYNCZ-HUUCEWRRSA-N	1	1	321.377	1.299	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC001344019077	872837201	/nfs/dbraw/zinc/83/72/01/872837201.db2.gz	RQJUTHHKTJLXGJ-PHIMTYICSA-N	1	1	304.350	1.270	20	5		DDBDMO
COCC[NH2+]Cc1nc(-c2cc(C)c([N+](=O)[O-])cc2C)no1	ZINC001345956551	873570934	/nfs/dbraw/zinc/57/09/34/873570934.db2.gz	DGDFVUWTBXUIHT-UHFFFAOYSA-N	1	1	306.322	1.998	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCC(N2CC[NH+](C)CC2)CC1	ZINC001351794317	876436254	/nfs/dbraw/zinc/43/62/54/876436254.db2.gz	MJVUHJWKMRCGBX-UHFFFAOYSA-N	1	1	319.409	1.514	20	5		DDBDMO
O=C([C@@H]1[NH2+]CCc2occc21)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001353395012	877297527	/nfs/dbraw/zinc/29/75/27/877297527.db2.gz	WMJWTPDOMJESDI-OAHLLOKOSA-N	1	1	313.313	1.917	20	5		DDBDMO
CC[N@H+]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)C(C)(C)C1	ZINC001472059018	877630728	/nfs/dbraw/zinc/63/07/28/877630728.db2.gz	RQPYGYMVEUITRT-ZDUSSCGKSA-N	1	1	306.366	1.637	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC001353895727	877635356	/nfs/dbraw/zinc/63/53/56/877635356.db2.gz	WHGZUBQHMLMDGQ-CYBMUJFWSA-N	1	1	321.377	1.746	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCc2ccc([N+](=O)[O-])cc2C(=O)OC)C1	ZINC001223449767	880966986	/nfs/dbraw/zinc/96/69/86/880966986.db2.gz	GTWKJWITLIWEKS-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NCCn1cc[nH+]c1C	ZINC001292410324	913665828	/nfs/dbraw/zinc/66/58/28/913665828.db2.gz	JATVRPCFNLXFCA-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
C[C@@H]1C[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H]1N	ZINC001246562396	892702106	/nfs/dbraw/zinc/70/21/06/892702106.db2.gz	MIHSBMROIOUPIG-MLGOLLRUSA-N	1	1	304.394	1.843	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H]1N	ZINC001246562396	892702112	/nfs/dbraw/zinc/70/21/12/892702112.db2.gz	MIHSBMROIOUPIG-MLGOLLRUSA-N	1	1	304.394	1.843	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC001262652333	900287089	/nfs/dbraw/zinc/28/70/89/900287089.db2.gz	CXAYTRVUFRXTPU-CYBMUJFWSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248453910	282084481	/nfs/dbraw/zinc/08/44/81/282084481.db2.gz	KDVUQCYUCGMXRW-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248453910	282084486	/nfs/dbraw/zinc/08/44/86/282084486.db2.gz	KDVUQCYUCGMXRW-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+]1C1CC1	ZINC000278503520	214196369	/nfs/dbraw/zinc/19/63/69/214196369.db2.gz	VVHBUINZYQHHKX-HNNXBMFYSA-N	1	1	303.362	1.880	20	5		DDBDMO
COCC[N@@H+](C)CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-]	ZINC000278524895	214211379	/nfs/dbraw/zinc/21/13/79/214211379.db2.gz	ZITUTPAGKKLXPV-UHFFFAOYSA-N	1	1	322.287	1.999	20	5		DDBDMO
COC[C@H](C)OC[C@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000278513716	214203325	/nfs/dbraw/zinc/20/33/25/214203325.db2.gz	FJLDQMLXMSZKAJ-GXTWGEPZSA-N	1	1	312.366	1.439	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000249499775	282161355	/nfs/dbraw/zinc/16/13/55/282161355.db2.gz	ICOIXYYZYNDWIM-KGLIPLIRSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000451263370	529481475	/nfs/dbraw/zinc/48/14/75/529481475.db2.gz	YUTPSTXYJUQYIG-HZSPNIEDSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)C[C@H](O)C1	ZINC000452072220	231291036	/nfs/dbraw/zinc/29/10/36/231291036.db2.gz	WIVAFEZXICPFTG-FZMZJTMJSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000331844452	529804433	/nfs/dbraw/zinc/80/44/33/529804433.db2.gz	UCVZSXPOONHHRC-SNVBAGLBSA-N	1	1	302.334	1.758	20	5		DDBDMO
CCc1ccc(C(=O)NC[C@@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000266883388	282303488	/nfs/dbraw/zinc/30/34/88/282303488.db2.gz	COYXFXMQPAGRHS-CQSZACIVSA-N	1	1	320.393	1.133	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000183357209	199579921	/nfs/dbraw/zinc/57/99/21/199579921.db2.gz	LOEFWJROOHZNNS-GFCCVEGCSA-N	1	1	313.379	1.027	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](NS(C)(=O)=O)C1	ZINC000183357209	199579923	/nfs/dbraw/zinc/57/99/23/199579923.db2.gz	LOEFWJROOHZNNS-GFCCVEGCSA-N	1	1	313.379	1.027	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000279757547	215121183	/nfs/dbraw/zinc/12/11/83/215121183.db2.gz	ACFCCODOJHHAJV-CMDGGOBGSA-N	1	1	301.346	1.986	20	5		DDBDMO
CC1(C)C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000279929631	215246705	/nfs/dbraw/zinc/24/67/05/215246705.db2.gz	WQMCUTCIVWBCPI-ZDUSSCGKSA-N	1	1	308.334	1.664	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1O	ZINC000279929631	215246709	/nfs/dbraw/zinc/24/67/09/215246709.db2.gz	WQMCUTCIVWBCPI-ZDUSSCGKSA-N	1	1	308.334	1.664	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CCOc1ccccc1[N+](=O)[O-])C1CC1	ZINC000171508888	186170220	/nfs/dbraw/zinc/17/02/20/186170220.db2.gz	FVIUJPJQOPTEOL-UHFFFAOYSA-N	1	1	321.377	1.964	20	5		DDBDMO
O=C(NCC[N@@H+]1CCc2ccccc2C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000045032676	352400227	/nfs/dbraw/zinc/40/02/27/352400227.db2.gz	HIRCZMIFNCUBQJ-UHFFFAOYSA-N	1	1	314.345	1.711	20	5		DDBDMO
O=C(NCC[N@H+]1CCc2ccccc2C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000045032676	352400231	/nfs/dbraw/zinc/40/02/31/352400231.db2.gz	HIRCZMIFNCUBQJ-UHFFFAOYSA-N	1	1	314.345	1.711	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000065675191	352958139	/nfs/dbraw/zinc/95/81/39/352958139.db2.gz	XOGZHPKFVRGPIG-NEPJUHHUSA-N	1	1	309.370	1.028	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000066924216	353026046	/nfs/dbraw/zinc/02/60/46/353026046.db2.gz	HRNLPCIZNZDHCC-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
C[N@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000066924216	353026047	/nfs/dbraw/zinc/02/60/47/353026047.db2.gz	HRNLPCIZNZDHCC-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000066924216	353026049	/nfs/dbraw/zinc/02/60/49/353026049.db2.gz	HRNLPCIZNZDHCC-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
C[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCC[C@H](C)C1	ZINC000068118528	353090040	/nfs/dbraw/zinc/09/00/40/353090040.db2.gz	HDUTYEPVCRTIJZ-STQMWFEESA-N	1	1	323.397	1.418	20	5		DDBDMO
O=[N+]([O-])c1ccccc1N1CC[NH+](CCN2CCOCC2)CC1	ZINC000070979103	353188445	/nfs/dbraw/zinc/18/84/45/353188445.db2.gz	FCDRAUCTMAFJTI-UHFFFAOYSA-N	1	1	320.393	1.049	20	5		DDBDMO
O=C1C[C@]2(CN1)CCC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2	ZINC000072829607	353218221	/nfs/dbraw/zinc/21/82/21/353218221.db2.gz	LPDRYUVCIAXNGD-INIZCTEOSA-N	1	1	319.361	1.576	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000174285688	198315868	/nfs/dbraw/zinc/31/58/68/198315868.db2.gz	IBVQYERAMSWKOL-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000174285688	198315869	/nfs/dbraw/zinc/31/58/69/198315869.db2.gz	IBVQYERAMSWKOL-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
Cc1cc(N2CCC[N@@H+](CCN(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000074747467	353328299	/nfs/dbraw/zinc/32/82/99/353328299.db2.gz	MZFYZXZMYOAFFP-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
Cc1cc(N2CCC[N@H+](CCN(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000074747467	353328301	/nfs/dbraw/zinc/32/83/01/353328301.db2.gz	MZFYZXZMYOAFFP-UHFFFAOYSA-N	1	1	307.398	1.372	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@@H](C)[NH+]1CCN(C)CC1	ZINC000080611189	353617999	/nfs/dbraw/zinc/61/79/99/353617999.db2.gz	IKWGTFMBAMGEAI-CYBMUJFWSA-N	1	1	322.409	1.789	20	5		DDBDMO
C[NH+]1CCC(N(Cc2ccccc2)C(=O)[C@H]2CC2[N+](=O)[O-])CC1	ZINC000084259674	353719250	/nfs/dbraw/zinc/71/92/50/353719250.db2.gz	CBXNSHIHRSKCQV-HOTGVXAUSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCN(c3[nH+]ccn3C)CC2)c1	ZINC000088724449	353757876	/nfs/dbraw/zinc/75/78/76/353757876.db2.gz	KUIUSGIBEZXXNG-UHFFFAOYSA-N	1	1	301.350	1.963	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000093332119	353895591	/nfs/dbraw/zinc/89/55/91/353895591.db2.gz	DZSQEQUULCUGQU-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000093332119	353895595	/nfs/dbraw/zinc/89/55/95/353895595.db2.gz	DZSQEQUULCUGQU-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000108299431	353949643	/nfs/dbraw/zinc/94/96/43/353949643.db2.gz	IZGNSAOMMZAHLV-CQSZACIVSA-N	1	1	303.362	1.738	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@@H](O)C1CC1	ZINC000305690722	354470667	/nfs/dbraw/zinc/47/06/67/354470667.db2.gz	BBWCUSVSXPPPPV-CQSZACIVSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@]3(CCOC3)C2)c1	ZINC000589503314	354998005	/nfs/dbraw/zinc/99/80/05/354998005.db2.gz	RFSQEXSHCSMIDI-MRXNPFEDSA-N	1	1	320.345	1.994	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC000590010375	355039027	/nfs/dbraw/zinc/03/90/27/355039027.db2.gz	CIDCVFWUCWCRRI-WFASDCNBSA-N	1	1	318.377	1.478	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[C@@H]2C[N@H+](C)C[C@H]21	ZINC000590010692	355040563	/nfs/dbraw/zinc/04/05/63/355040563.db2.gz	OTTZBKPGGDFLLC-TZMCWYRMSA-N	1	1	318.377	1.478	20	5		DDBDMO
COc1cc(CN2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])cc1F	ZINC000590011040	355040840	/nfs/dbraw/zinc/04/08/40/355040840.db2.gz	GHOUWWSSBDIVIL-YGRLFVJLSA-N	1	1	309.341	1.878	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC(C[NH+]2CCOCC2)C1	ZINC000590392243	355084104	/nfs/dbraw/zinc/08/41/04/355084104.db2.gz	KHCAXWNJJGGOTL-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000590554879	355112759	/nfs/dbraw/zinc/11/27/59/355112759.db2.gz	IZTLJYMCJUYPDG-LLVKDONJSA-N	1	1	323.349	1.513	20	5		DDBDMO
C[C@@H]1[C@@H]([NH+](C)C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000590566933	355115069	/nfs/dbraw/zinc/11/50/69/355115069.db2.gz	SVJYMRHYZUMJDY-RNCFNFMXSA-N	1	1	317.349	1.636	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N1CC(C[NH+]2CCOCC2)C1	ZINC000590567679	355115773	/nfs/dbraw/zinc/11/57/73/355115773.db2.gz	BIIRJGAQPWIRAM-UHFFFAOYSA-N	1	1	312.757	1.412	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@H]3COC[C@@H]32)c1	ZINC000590972411	355227276	/nfs/dbraw/zinc/22/72/76/355227276.db2.gz	QUANIECLBTVHRC-INWMFGNUSA-N	1	1	322.361	1.445	20	5		DDBDMO
C[N@H+]1CC[C@H](Cn2c(=O)onc2-c2cccc([N+](=O)[O-])c2)C1	ZINC000592349566	355564163	/nfs/dbraw/zinc/56/41/63/355564163.db2.gz	GKUGKDQXDGANSV-JTQLQIEISA-N	1	1	304.306	1.363	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000593071882	355787363	/nfs/dbraw/zinc/78/73/63/355787363.db2.gz	VMYXVCQUPFIUKS-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@@H](C)CCO)c([N+](=O)[O-])c1	ZINC000593107649	355800233	/nfs/dbraw/zinc/80/02/33/355800233.db2.gz	LZSFWKCNOSWICL-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@@H](C)CCO)c([N+](=O)[O-])c1	ZINC000593107649	355800234	/nfs/dbraw/zinc/80/02/34/355800234.db2.gz	LZSFWKCNOSWICL-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000593424997	355881714	/nfs/dbraw/zinc/88/17/14/355881714.db2.gz	WBYMSAQZRLSGQL-UHFFFAOYSA-N	1	1	307.325	1.583	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594575374	356253378	/nfs/dbraw/zinc/25/33/78/356253378.db2.gz	FJBRDEJNUGYGRL-LBPRGKRZSA-N	1	1	324.381	1.280	20	5		DDBDMO
CC(C)Oc1nc(N2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594575374	356253382	/nfs/dbraw/zinc/25/33/82/356253382.db2.gz	FJBRDEJNUGYGRL-LBPRGKRZSA-N	1	1	324.381	1.280	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCN(C)C1=O	ZINC000595011339	356372063	/nfs/dbraw/zinc/37/20/63/356372063.db2.gz	HDPFPLKKBLKDMO-MFKMUULPSA-N	1	1	307.350	1.875	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@@H](CN3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000595326048	356449858	/nfs/dbraw/zinc/44/98/58/356449858.db2.gz	ILYSOYQCKQPKEW-LBPRGKRZSA-N	1	1	310.354	1.045	20	5		DDBDMO
Cc1noc(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000595326048	356449862	/nfs/dbraw/zinc/44/98/62/356449862.db2.gz	ILYSOYQCKQPKEW-LBPRGKRZSA-N	1	1	310.354	1.045	20	5		DDBDMO
CC[N@H+]1CCCN(CCn2cc([N+](=O)[O-])ccc2=O)[C@H](C)C1	ZINC000595535541	356538221	/nfs/dbraw/zinc/53/82/21/356538221.db2.gz	HBYFIXNVSDTIEY-CYBMUJFWSA-N	1	1	308.382	1.173	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H]1COCCO1	ZINC000595744939	356632022	/nfs/dbraw/zinc/63/20/22/356632022.db2.gz	WJBFRGARQPGQTO-RISCZKNCSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1COCCO1	ZINC000595744939	356632026	/nfs/dbraw/zinc/63/20/26/356632026.db2.gz	WJBFRGARQPGQTO-RISCZKNCSA-N	1	1	323.349	1.269	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595762101	356641875	/nfs/dbraw/zinc/64/18/75/356641875.db2.gz	ZYDPHSWCRAVKSJ-MLGOLLRUSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595762101	356641876	/nfs/dbraw/zinc/64/18/76/356641876.db2.gz	ZYDPHSWCRAVKSJ-MLGOLLRUSA-N	1	1	319.361	1.810	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C[C@H]1C	ZINC000596176406	356803027	/nfs/dbraw/zinc/80/30/27/356803027.db2.gz	FVCYCRMVWFQOGI-GHMZBOCLSA-N	1	1	306.366	1.613	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596257506	356835028	/nfs/dbraw/zinc/83/50/28/356835028.db2.gz	PCUWOVRNECHJDS-NSHDSACASA-N	1	1	306.366	1.614	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000596499064	356898202	/nfs/dbraw/zinc/89/82/02/356898202.db2.gz	MDFIEPGTTUEJLM-GFCCVEGCSA-N	1	1	306.366	1.775	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2	ZINC000596514828	356902438	/nfs/dbraw/zinc/90/24/38/356902438.db2.gz	KDMGXFKYCPIBLJ-VXGBXAGGSA-N	1	1	321.381	1.384	20	5		DDBDMO
COc1cc(C(=O)NCC2=CC[N@@H+](C)CC2)cc([N+](=O)[O-])c1C	ZINC000276883442	213154150	/nfs/dbraw/zinc/15/41/50/213154150.db2.gz	SNWYRSFXPSTEKU-UHFFFAOYSA-N	1	1	319.361	1.904	20	5		DDBDMO
O=C(NCC12CCC[NH+]1CCC2)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597586652	357239871	/nfs/dbraw/zinc/23/98/71/357239871.db2.gz	FYBIAIXKVSJHPD-UHFFFAOYSA-N	1	1	305.334	1.659	20	5		DDBDMO
CCN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C)C1	ZINC000597944462	357394251	/nfs/dbraw/zinc/39/42/51/357394251.db2.gz	CYTDSSJHSUHBJI-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CCc3[nH]cnc3C2)c1[N+](=O)[O-]	ZINC000598626351	357660063	/nfs/dbraw/zinc/66/00/63/357660063.db2.gz	AYLBBXZCFJNSEZ-QMMMGPOBSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CCc3[nH+]c[nH]c3C2)c1[N+](=O)[O-]	ZINC000598626351	357660068	/nfs/dbraw/zinc/66/00/68/357660068.db2.gz	AYLBBXZCFJNSEZ-QMMMGPOBSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CCc3[nH]c[nH+]c3C2)c1[N+](=O)[O-]	ZINC000598626351	357660070	/nfs/dbraw/zinc/66/00/70/357660070.db2.gz	AYLBBXZCFJNSEZ-QMMMGPOBSA-N	1	1	317.305	1.469	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598648526	357668961	/nfs/dbraw/zinc/66/89/61/357668961.db2.gz	UCQWXYUOKGHQGN-HZSPNIEDSA-N	1	1	324.377	1.285	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC[N@H+](C2CCCC2)CC1	ZINC000179397625	199027830	/nfs/dbraw/zinc/02/78/30/199027830.db2.gz	AYUQMGYPONJATK-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
CNC(=O)CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000179413440	199031208	/nfs/dbraw/zinc/03/12/08/199031208.db2.gz	HJRQPNXGZBBQSK-UHFFFAOYSA-N	1	1	317.292	1.764	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000179413440	199031209	/nfs/dbraw/zinc/03/12/09/199031209.db2.gz	HJRQPNXGZBBQSK-UHFFFAOYSA-N	1	1	317.292	1.764	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@@H]2CCC[C@@H]21	ZINC000599661222	358013554	/nfs/dbraw/zinc/01/35/54/358013554.db2.gz	TVCUSCRLCKCBBO-JHJVBQTASA-N	1	1	322.365	1.455	20	5		DDBDMO
Cc1ccc(NC(=O)NCC[N@H+]2CC[C@H](O)C2)cc1[N+](=O)[O-]	ZINC000599695556	358029981	/nfs/dbraw/zinc/02/99/81/358029981.db2.gz	MWHITPZXABXGOX-LBPRGKRZSA-N	1	1	308.338	1.091	20	5		DDBDMO
O=C(NC1CC([NH+]2CCOCC2)C1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000600068471	358113934	/nfs/dbraw/zinc/11/39/34/358113934.db2.gz	DDZZTLWLYCQLQR-UHFFFAOYSA-N	1	1	323.324	1.327	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600313739	358192739	/nfs/dbraw/zinc/19/27/39/358192739.db2.gz	JOBPLGAMVBCFBV-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1ccc(CNC[C@@H]2COCC[NH2+]2)o1	ZINC000600677936	358280529	/nfs/dbraw/zinc/28/05/29/358280529.db2.gz	LQOPDIGPWLDLKA-GFCCVEGCSA-N	1	1	317.345	1.933	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ncc(F)cc3[N+](=O)[O-])CC2)C1	ZINC000601115800	358408429	/nfs/dbraw/zinc/40/84/29/358408429.db2.gz	CGYCLGUSIHKEKC-ZDUSSCGKSA-N	1	1	323.372	1.345	20	5		DDBDMO
CN1CCC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O	ZINC000601125893	358412223	/nfs/dbraw/zinc/41/22/23/358412223.db2.gz	RLLLUUVABYEBKU-CQSZACIVSA-N	1	1	300.318	1.598	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000601154583	358424815	/nfs/dbraw/zinc/42/48/15/358424815.db2.gz	PGOXPBSBVUDECJ-OCAPTIKFSA-N	1	1	319.287	1.345	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H]3CC[C@@H](CO)O3)c2c1	ZINC000601168272	358430489	/nfs/dbraw/zinc/43/04/89/358430489.db2.gz	UHMVJLLTPYCBKN-NEPJUHHUSA-N	1	1	303.318	1.517	20	5		DDBDMO
O=C1NCC[C@@H]1[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1	ZINC000602705410	359136037	/nfs/dbraw/zinc/13/60/37/359136037.db2.gz	LRWKURZKOMYJNY-ZETCQYMHSA-N	1	1	320.168	1.397	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@@H](O)Cc1ccccc1	ZINC000602840408	359229980	/nfs/dbraw/zinc/22/99/80/359229980.db2.gz	MWBQJCRIZMZUJH-HNNXBMFYSA-N	1	1	318.377	1.635	20	5		DDBDMO
CC[NH+]1CC[C@@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796232	359198033	/nfs/dbraw/zinc/19/80/33/359198033.db2.gz	WOHWKNOSUCWOKD-TZMCWYRMSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[NH+]1CC[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796232	359198038	/nfs/dbraw/zinc/19/80/38/359198038.db2.gz	WOHWKNOSUCWOKD-TZMCWYRMSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@@H]([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796232	359198042	/nfs/dbraw/zinc/19/80/42/359198042.db2.gz	WOHWKNOSUCWOKD-TZMCWYRMSA-N	1	1	309.414	1.762	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796232	359198047	/nfs/dbraw/zinc/19/80/47/359198047.db2.gz	WOHWKNOSUCWOKD-TZMCWYRMSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796232	359198049	/nfs/dbraw/zinc/19/80/49/359198049.db2.gz	WOHWKNOSUCWOKD-TZMCWYRMSA-N	1	1	309.414	1.762	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000602796232	359198055	/nfs/dbraw/zinc/19/80/55/359198055.db2.gz	WOHWKNOSUCWOKD-TZMCWYRMSA-N	1	1	309.414	1.762	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1	ZINC000602796886	359199170	/nfs/dbraw/zinc/19/91/70/359199170.db2.gz	ALCHBFJFLALGSF-KGLIPLIRSA-N	1	1	308.382	1.848	20	5		DDBDMO
CCN(C(=O)Nc1c(C)cncc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000602959758	359322989	/nfs/dbraw/zinc/32/29/89/359322989.db2.gz	FUJNKGFHRZJZBE-NSHDSACASA-N	1	1	307.354	1.278	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@](C)(CO)C1	ZINC000602964531	359327516	/nfs/dbraw/zinc/32/75/16/359327516.db2.gz	QZKMVBBUWMCDFW-HUUCEWRRSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C[C@H]1C(C)(C)C	ZINC000603144069	359433408	/nfs/dbraw/zinc/43/34/08/359433408.db2.gz	VQENQIOOQQLVDV-LBPRGKRZSA-N	1	1	322.365	1.498	20	5		DDBDMO
Cc1nn(C)c(N2CCC([N@@H+]3CCOC[C@H]3C)CC2)c1[N+](=O)[O-]	ZINC000603401244	359617593	/nfs/dbraw/zinc/61/75/93/359617593.db2.gz	KLAPQGZBMONJCR-LLVKDONJSA-N	1	1	323.397	1.326	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611092537	360621242	/nfs/dbraw/zinc/62/12/42/360621242.db2.gz	YCXOVAUXQWYFGX-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC1(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000611560748	360760170	/nfs/dbraw/zinc/76/01/70/360760170.db2.gz	MLOODOMKHJNHOU-CQSZACIVSA-N	1	1	316.361	1.780	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)C1	ZINC000281389961	216266784	/nfs/dbraw/zinc/26/67/84/216266784.db2.gz	GGBLTGDWLZNXDJ-QWRGUYRKSA-N	1	1	319.365	1.362	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NCC1=CC[N@@H+](C)CC1	ZINC000271894686	209302728	/nfs/dbraw/zinc/30/27/28/209302728.db2.gz	FMEDUKSZLQKOHW-UHFFFAOYSA-N	1	1	320.349	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCN2CCOC[C@H]2C1	ZINC000612589973	361075395	/nfs/dbraw/zinc/07/53/95/361075395.db2.gz	FLKNFBMWDIWPML-UYWPIULCSA-N	1	1	303.362	1.624	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCN2CCOC[C@H]2C1	ZINC000612589973	361075399	/nfs/dbraw/zinc/07/53/99/361075399.db2.gz	FLKNFBMWDIWPML-UYWPIULCSA-N	1	1	303.362	1.624	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccon1	ZINC000349242782	283880976	/nfs/dbraw/zinc/88/09/76/283880976.db2.gz	PBJQHWWUCIXUMH-WDEREUQCSA-N	1	1	307.306	1.673	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000264615139	204029583	/nfs/dbraw/zinc/02/95/83/204029583.db2.gz	QPCNBJVRHXMAHW-SECBINFHSA-N	1	1	307.354	1.094	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2cc([N+](=O)[O-])nc2C)[C@H](C)C1	ZINC000288260251	220048397	/nfs/dbraw/zinc/04/83/97/220048397.db2.gz	FMVSWVIRKSXUCF-LLVKDONJSA-N	1	1	309.370	1.042	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000267810299	206297774	/nfs/dbraw/zinc/29/77/74/206297774.db2.gz	MRRZCRWZOJDWOA-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(CCOc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000284481188	218044530	/nfs/dbraw/zinc/04/45/30/218044530.db2.gz	AWCVUDAWKDAUMK-ZBFHGGJFSA-N	1	1	321.377	1.379	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000338583385	250039301	/nfs/dbraw/zinc/03/93/01/250039301.db2.gz	ZFYFCMUPCNVMDP-NSHDSACASA-N	1	1	319.361	1.960	20	5		DDBDMO
CC[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1C[C@@H](C)O	ZINC000105827364	194138819	/nfs/dbraw/zinc/13/88/19/194138819.db2.gz	XGBSDKIGFSONRA-YPMHNXCESA-N	1	1	313.423	1.933	20	5		DDBDMO
COCC[N@H+](C)CCNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000061376323	184169592	/nfs/dbraw/zinc/16/95/92/184169592.db2.gz	RPKYHLDMUHVZLJ-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
COCC[N@@H+](C)CCNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000061376323	184169593	/nfs/dbraw/zinc/16/95/93/184169593.db2.gz	RPKYHLDMUHVZLJ-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
O=C(NCC[NH+]1CCCCCC1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269103308	207242035	/nfs/dbraw/zinc/24/20/35/207242035.db2.gz	AOFVNCPYCJUMOW-UHFFFAOYSA-N	1	1	307.350	1.906	20	5		DDBDMO
C[N@@H+]1CCO[C@H](CSc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC000567767240	304241116	/nfs/dbraw/zinc/24/11/16/304241116.db2.gz	GIZLLVPFCSXBSU-JTQLQIEISA-N	1	1	320.374	1.961	20	5		DDBDMO
C[N@H+]1CCO[C@H](CSc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC000567767240	304241119	/nfs/dbraw/zinc/24/11/19/304241119.db2.gz	GIZLLVPFCSXBSU-JTQLQIEISA-N	1	1	320.374	1.961	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000352417933	285037526	/nfs/dbraw/zinc/03/75/26/285037526.db2.gz	WHRRDHIYLSHZOJ-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](CCO)CC1CC1	ZINC000352458683	285063997	/nfs/dbraw/zinc/06/39/97/285063997.db2.gz	NSMWTTMUZFJJFM-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](O)C[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000156258867	197099605	/nfs/dbraw/zinc/09/96/05/197099605.db2.gz	JGSYEFRZOVFTPH-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000156258867	197099607	/nfs/dbraw/zinc/09/96/07/197099607.db2.gz	JGSYEFRZOVFTPH-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000156258737	197099684	/nfs/dbraw/zinc/09/96/84/197099684.db2.gz	VTKPJYOJPIIESW-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)C[C@H](C)O)c([N+](=O)[O-])c1	ZINC000156258737	197099687	/nfs/dbraw/zinc/09/96/87/197099687.db2.gz	VTKPJYOJPIIESW-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@H]1CCC[C@H]1O	ZINC000352687914	285228410	/nfs/dbraw/zinc/22/84/10/285228410.db2.gz	ACFUCHFWQHXUSX-QWHCGFSZSA-N	1	1	323.349	1.387	20	5		DDBDMO
C[N@@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCC[C@H]1O	ZINC000352692827	285232509	/nfs/dbraw/zinc/23/25/09/285232509.db2.gz	GZAWORRXVKCKKC-UONOGXRCSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H](O)C[N@H+](CCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000289802995	221237373	/nfs/dbraw/zinc/23/73/73/221237373.db2.gz	NBOSDIXLCXIIMJ-LLVKDONJSA-N	1	1	321.333	1.425	20	5		DDBDMO
C[C@@H](O)C[N@@H+](CCO)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000289802995	221237376	/nfs/dbraw/zinc/23/73/76/221237376.db2.gz	NBOSDIXLCXIIMJ-LLVKDONJSA-N	1	1	321.333	1.425	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1CC[N@H+](C)C(C)(C)C1	ZINC000569256644	304344332	/nfs/dbraw/zinc/34/43/32/304344332.db2.gz	QUDJAGVOSZKERB-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000052556121	407152358	/nfs/dbraw/zinc/15/23/58/407152358.db2.gz	HOLXGRGRZUYEFY-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000055209810	407198363	/nfs/dbraw/zinc/19/83/63/407198363.db2.gz	ATSBKNSUSSREGL-ZDUSSCGKSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000124500974	407359956	/nfs/dbraw/zinc/35/99/56/407359956.db2.gz	YZFCDLXBUMBENU-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H]1CCOC1	ZINC000106885830	407364933	/nfs/dbraw/zinc/36/49/33/407364933.db2.gz	NWNDGKZSCPNNEC-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1c(NC(=O)[C@@H](C)N2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000125691769	407395378	/nfs/dbraw/zinc/39/53/78/407395378.db2.gz	JWGRVHQASYQFNV-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000185725431	407487029	/nfs/dbraw/zinc/48/70/29/407487029.db2.gz	QZVOVBDFJQJIKV-CMPLNLGQSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000185725431	407487038	/nfs/dbraw/zinc/48/70/38/407487038.db2.gz	QZVOVBDFJQJIKV-CMPLNLGQSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000185725431	407487044	/nfs/dbraw/zinc/48/70/44/407487044.db2.gz	QZVOVBDFJQJIKV-CMPLNLGQSA-N	1	1	323.397	1.683	20	5		DDBDMO
CN(CCCN1CC[NH+](C)CC1)Cc1csc([N+](=O)[O-])c1	ZINC000266968360	407696386	/nfs/dbraw/zinc/69/63/86/407696386.db2.gz	YUPDUPBTEZEWTL-UHFFFAOYSA-N	1	1	312.439	1.726	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@H]23)cccc1[N+](=O)[O-]	ZINC000267248822	407806573	/nfs/dbraw/zinc/80/65/73/407806573.db2.gz	GFBSVEKXBJOHPB-NWDGAFQWSA-N	1	1	304.350	1.534	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)NCC(F)(F)C[NH3+]	ZINC000186993400	407807898	/nfs/dbraw/zinc/80/78/98/407807898.db2.gz	OVSJZTDOVMRASZ-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CCSC	ZINC000134211573	407892619	/nfs/dbraw/zinc/89/26/19/407892619.db2.gz	IMBJHIVFBBKIEM-UHFFFAOYSA-N	1	1	313.379	1.837	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CCSC	ZINC000134211573	407892623	/nfs/dbraw/zinc/89/26/23/407892623.db2.gz	IMBJHIVFBBKIEM-UHFFFAOYSA-N	1	1	313.379	1.837	20	5		DDBDMO
CC(C)[N@@H+]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000181184835	407962424	/nfs/dbraw/zinc/96/24/24/407962424.db2.gz	NXDVFILTVWYRNR-JQWIXIFHSA-N	1	1	306.366	1.636	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000268162935	407924033	/nfs/dbraw/zinc/92/40/33/407924033.db2.gz	ILSBHFSSDNCDSJ-GXFFZTMASA-N	1	1	319.361	1.816	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000190203318	408188838	/nfs/dbraw/zinc/18/88/38/408188838.db2.gz	MWCASBDHCSCZOB-UHFFFAOYSA-N	1	1	314.292	1.493	20	5		DDBDMO
C[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@H]1C[NH3+]	ZINC000156654908	408269709	/nfs/dbraw/zinc/26/97/09/408269709.db2.gz	FIMBZDGVSAXHPG-ZANVPECISA-N	1	1	317.349	1.671	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000273674899	408284233	/nfs/dbraw/zinc/28/42/33/408284233.db2.gz	YDVNYZKTOZYGDU-NSHDSACASA-N	1	1	313.379	1.167	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000246819612	408346964	/nfs/dbraw/zinc/34/69/64/408346964.db2.gz	RHBTUNGJJKYYNF-IUODEOHRSA-N	1	1	305.378	1.936	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000246844246	408354484	/nfs/dbraw/zinc/35/44/84/408354484.db2.gz	UMHLTFHMGWLTJB-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@H](C)O)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000246844246	408354490	/nfs/dbraw/zinc/35/44/90/408354490.db2.gz	UMHLTFHMGWLTJB-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000171654129	162233487	/nfs/dbraw/zinc/23/34/87/162233487.db2.gz	CTLVQBIUQQLGCY-UHFFFAOYSA-N	1	1	313.379	1.185	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+]1CC[C@](C)(O)C1	ZINC000248359153	408549709	/nfs/dbraw/zinc/54/97/09/408549709.db2.gz	RPJIKRUQQIEKCB-BMIGLBTASA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+]1CC[C@](C)(O)C1	ZINC000248359153	408549713	/nfs/dbraw/zinc/54/97/13/408549713.db2.gz	RPJIKRUQQIEKCB-BMIGLBTASA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1CC[C@](C)(O)C1	ZINC000248359154	408549933	/nfs/dbraw/zinc/54/99/33/408549933.db2.gz	RPJIKRUQQIEKCB-BONVTDFDSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1CC[C@](C)(O)C1	ZINC000248359154	408549942	/nfs/dbraw/zinc/54/99/42/408549942.db2.gz	RPJIKRUQQIEKCB-BONVTDFDSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000177213560	408552348	/nfs/dbraw/zinc/55/23/48/408552348.db2.gz	CNXGJJXMYGKGBZ-PWSUYJOCSA-N	1	1	321.381	1.231	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@@H](CO)C1	ZINC000248374766	408552707	/nfs/dbraw/zinc/55/27/07/408552707.db2.gz	TYTJKUCFSCMHCS-CHWSQXEVSA-N	1	1	310.350	1.039	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000248446234	408569147	/nfs/dbraw/zinc/56/91/47/408569147.db2.gz	WQRUBPNGLYTCSS-QWRGUYRKSA-N	1	1	321.381	1.422	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000248457538	408571379	/nfs/dbraw/zinc/57/13/79/408571379.db2.gz	MKFVNZSTJWOKKL-ZIAGYGMSSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC1(O)CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000177299519	408575674	/nfs/dbraw/zinc/57/56/74/408575674.db2.gz	BERRWWZETKAUEW-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000184857658	408704352	/nfs/dbraw/zinc/70/43/52/408704352.db2.gz	MHPIDPCBYKVJNI-LLVKDONJSA-N	1	1	321.381	1.518	20	5		DDBDMO
Cc1c(CN2CC[N@H+](C[C@@H](C)O)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000249492434	408731629	/nfs/dbraw/zinc/73/16/29/408731629.db2.gz	FNXHOTOTDUYEIS-CHWSQXEVSA-N	1	1	307.394	1.790	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000270947485	408753957	/nfs/dbraw/zinc/75/39/57/408753957.db2.gz	UNUWCRRTYYQEMK-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@](C)(C(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000280840870	408843821	/nfs/dbraw/zinc/84/38/21/408843821.db2.gz	XBCHDTHBKJUMRE-HNNXBMFYSA-N	1	1	307.350	1.691	20	5		DDBDMO
C[N@H+](CCCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000276390948	408848498	/nfs/dbraw/zinc/84/84/98/408848498.db2.gz	MWAAWDOGMQRQLC-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[N@@H+](CCCCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000276390948	408848500	/nfs/dbraw/zinc/84/85/00/408848500.db2.gz	MWAAWDOGMQRQLC-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000281830598	408936642	/nfs/dbraw/zinc/93/66/42/408936642.db2.gz	MHIOJKRSFYIXMS-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CCOc1ccc(NC(=O)C[N@@H+](C)CCCO)c([N+](=O)[O-])c1	ZINC000281830598	408936645	/nfs/dbraw/zinc/93/66/45/408936645.db2.gz	MHIOJKRSFYIXMS-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
CCSCC[C@@H](C)[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000245449878	163412328	/nfs/dbraw/zinc/41/23/28/163412328.db2.gz	OCPWBMFZPPXVSR-DGCLKSJQSA-N	1	1	316.427	1.616	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1c2ccccc2ncc1[N+](=O)[O-]	ZINC000292005913	408962020	/nfs/dbraw/zinc/96/20/20/408962020.db2.gz	RSKOLPSAYMEGEH-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])[nH]2)CCCO1	ZINC000277619722	408978610	/nfs/dbraw/zinc/97/86/10/408978610.db2.gz	QWGAUCABUBPVER-NSHDSACASA-N	1	1	310.354	1.154	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)n1	ZINC000287723360	409082411	/nfs/dbraw/zinc/08/24/11/409082411.db2.gz	FKUQSNPAWRNZQE-ZJUUUORDSA-N	1	1	320.349	1.814	20	5		DDBDMO
CC(=O)c1ccc(N2CCN(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1	ZINC000278700075	409086090	/nfs/dbraw/zinc/08/60/90/409086090.db2.gz	MVSSHPLXJQEMJG-UHFFFAOYSA-N	1	1	315.333	1.847	20	5		DDBDMO
C[C@@H]1CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@H](C)[N@@H+]1C	ZINC000293328650	409090365	/nfs/dbraw/zinc/09/03/65/409090365.db2.gz	GILIUFRVYZQEER-TXEJJXNPSA-N	1	1	321.377	1.986	20	5		DDBDMO
C[C@@H]1[C@H]([N@@H+](C)CCO)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000293709209	409165973	/nfs/dbraw/zinc/16/59/73/409165973.db2.gz	POKDAVJDBZUYIR-BXUZGUMPSA-N	1	1	307.350	1.122	20	5		DDBDMO
CNC(=O)c1ccc(NCC[N@@H+]2CC=CCC2)c([N+](=O)[O-])c1	ZINC000280174340	409263841	/nfs/dbraw/zinc/26/38/41/409263841.db2.gz	HMINFFINQMPSHD-UHFFFAOYSA-N	1	1	304.350	1.628	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000284195882	409294294	/nfs/dbraw/zinc/29/42/94/409294294.db2.gz	ZFXGDLQTEGTKKE-VHSXEESVSA-N	1	1	324.356	1.871	20	5		DDBDMO
O=C(CC[N@@H+](C1CC1)C1COC1)Nc1ccccc1[N+](=O)[O-]	ZINC000295563635	409349094	/nfs/dbraw/zinc/34/90/94/409349094.db2.gz	YBVZJFXUTTXPHE-UHFFFAOYSA-N	1	1	305.334	1.787	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)nc2sccn21	ZINC000316905081	164024704	/nfs/dbraw/zinc/02/47/04/164024704.db2.gz	XYHZFJRXEWLBRM-VHSXEESVSA-N	1	1	323.378	1.579	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N(C)C[C@H]2CCC[N@H+]2C)c1	ZINC000316971047	164025278	/nfs/dbraw/zinc/02/52/78/164025278.db2.gz	ZUTZPVUIULXIKP-GFCCVEGCSA-N	1	1	307.350	1.912	20	5		DDBDMO
COc1c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)cccc1[N+](=O)[O-]	ZINC000356745521	409567395	/nfs/dbraw/zinc/56/73/95/409567395.db2.gz	OJECNHLAZLKMMZ-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000296311650	409500036	/nfs/dbraw/zinc/50/00/36/409500036.db2.gz	OEVHPXSPBSAWDC-INIZCTEOSA-N	1	1	322.361	1.915	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)n1	ZINC000285594904	409502674	/nfs/dbraw/zinc/50/26/74/409502674.db2.gz	PGTGLWLFVMFPPE-NSHDSACASA-N	1	1	322.287	1.571	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356725561	409551726	/nfs/dbraw/zinc/55/17/26/409551726.db2.gz	DSTOOFZDYMHJKQ-NSHDSACASA-N	1	1	318.337	1.138	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1C1CCOCC1	ZINC000348947559	409602246	/nfs/dbraw/zinc/60/22/46/409602246.db2.gz	JLUPVZQASZAZAD-OAHLLOKOSA-N	1	1	321.377	1.648	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)[C@H](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000356793063	409612746	/nfs/dbraw/zinc/61/27/46/409612746.db2.gz	MFDVNPIRHISQSJ-GHMZBOCLSA-N	1	1	306.366	1.483	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000356843271	409654500	/nfs/dbraw/zinc/65/45/00/409654500.db2.gz	GIBLQKDZLQTATP-OLZOCXBDSA-N	1	1	320.393	1.582	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000356883934	409685849	/nfs/dbraw/zinc/68/58/49/409685849.db2.gz	QOZPOKXFFUTXNZ-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000356883934	409685854	/nfs/dbraw/zinc/68/58/54/409685854.db2.gz	QOZPOKXFFUTXNZ-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@]1(O)CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	ZINC000331651140	409735108	/nfs/dbraw/zinc/73/51/08/409735108.db2.gz	MAMWMEURASMNDR-OAHLLOKOSA-N	1	1	321.333	1.350	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CCOC[C@@H]2[C@H]2CCC[C@H]2O)cc1	ZINC000332024447	409812318	/nfs/dbraw/zinc/81/23/18/409812318.db2.gz	ZYTCQYXWZHDMCZ-BZUAXINKSA-N	1	1	306.362	1.957	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CCOC[C@@H]2[C@H]2CCC[C@H]2O)cc1	ZINC000332024447	409812326	/nfs/dbraw/zinc/81/23/26/409812326.db2.gz	ZYTCQYXWZHDMCZ-BZUAXINKSA-N	1	1	306.362	1.957	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000357052078	409818968	/nfs/dbraw/zinc/81/89/68/409818968.db2.gz	QXMANWCXANSZMM-GHMZBOCLSA-N	1	1	307.354	1.027	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])n[nH]2)C[C@@H](C)C1	ZINC000346229487	409871325	/nfs/dbraw/zinc/87/13/25/409871325.db2.gz	MBNUOODYTMMJMR-NHCYSSNCSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@@H]([NH3+])C[C@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000320233251	409903133	/nfs/dbraw/zinc/90/31/33/409903133.db2.gz	HQWCRHGZFNNQIQ-SFYZADRCSA-N	1	1	305.331	1.138	20	5		DDBDMO
C[C@H](CNc1nccc(C(N)=O)c1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000357308651	409967736	/nfs/dbraw/zinc/96/77/36/409967736.db2.gz	WQTOKLLVZUTBRL-GHMZBOCLSA-N	1	1	321.381	1.764	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000338475727	410015718	/nfs/dbraw/zinc/01/57/18/410015718.db2.gz	WZTCRNTXTAURJO-UHFFFAOYSA-N	1	1	323.397	1.646	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC3(CCC3)[C@H]2C2CC2)c1	ZINC000357457085	410051322	/nfs/dbraw/zinc/05/13/22/410051322.db2.gz	VAALKWLSJYAIDC-ZIAGYGMSSA-N	1	1	306.366	1.417	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000332394029	410121340	/nfs/dbraw/zinc/12/13/40/410121340.db2.gz	WGXIXJWZDAEUKU-CVEARBPZSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000351720127	410182579	/nfs/dbraw/zinc/18/25/79/410182579.db2.gz	MUSZUJHVEJGFRQ-UHFFFAOYSA-N	1	1	323.349	1.784	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)CC1(C)C	ZINC000346914587	410244608	/nfs/dbraw/zinc/24/46/08/410244608.db2.gz	YYIKSDXJAHEOLS-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)CC1(C)C	ZINC000346914587	410244613	/nfs/dbraw/zinc/24/46/13/410244613.db2.gz	YYIKSDXJAHEOLS-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@H]2c2cccnc2)c1	ZINC000346999106	410298902	/nfs/dbraw/zinc/29/89/02/410298902.db2.gz	PCXYUSDBCOKDFI-LSDHHAIUSA-N	1	1	317.349	1.384	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNC[C@]1(O)CC[N@@H+](C)C1	ZINC000358132109	410379058	/nfs/dbraw/zinc/37/90/58/410379058.db2.gz	GMFMLLZVKOZNFX-OAHLLOKOSA-N	1	1	309.366	1.150	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CCC[N@H+]1C	ZINC000343437286	410450898	/nfs/dbraw/zinc/45/08/98/410450898.db2.gz	KYKOCKJMZVDLRB-YGRLFVJLSA-N	1	1	309.341	1.875	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000299069154	410506042	/nfs/dbraw/zinc/50/60/42/410506042.db2.gz	OISGJUWUXRNRDP-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000352235566	410568602	/nfs/dbraw/zinc/56/86/02/410568602.db2.gz	XCLXGDKRLJPDCR-GFCCVEGCSA-N	1	1	319.361	1.452	20	5		DDBDMO
CCNC(=O)C[N@@H+]1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000299330840	410588157	/nfs/dbraw/zinc/58/81/57/410588157.db2.gz	JLYLPBPRXGPCKD-UHFFFAOYSA-N	1	1	306.366	1.243	20	5		DDBDMO
CCNC(=O)C[N@H+]1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000299330840	410588162	/nfs/dbraw/zinc/58/81/62/410588162.db2.gz	JLYLPBPRXGPCKD-UHFFFAOYSA-N	1	1	306.366	1.243	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)C[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243513	410670104	/nfs/dbraw/zinc/67/01/04/410670104.db2.gz	HGVHLLITUISMBA-VXGBXAGGSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337243513	410670107	/nfs/dbraw/zinc/67/01/07/410670107.db2.gz	HGVHLLITUISMBA-VXGBXAGGSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343719439	410648451	/nfs/dbraw/zinc/64/84/51/410648451.db2.gz	CZLLPQJUQRXBKB-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343719439	410648458	/nfs/dbraw/zinc/64/84/58/410648458.db2.gz	CZLLPQJUQRXBKB-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343719439	410648462	/nfs/dbraw/zinc/64/84/62/410648462.db2.gz	CZLLPQJUQRXBKB-MGPQQGTHSA-N	1	1	323.393	1.359	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600203	410814232	/nfs/dbraw/zinc/81/42/32/410814232.db2.gz	FQIZJXFWBXMKHV-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600203	410814240	/nfs/dbraw/zinc/81/42/40/410814240.db2.gz	FQIZJXFWBXMKHV-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600203	410814246	/nfs/dbraw/zinc/81/42/46/410814246.db2.gz	FQIZJXFWBXMKHV-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000330600203	410814249	/nfs/dbraw/zinc/81/42/49/410814249.db2.gz	FQIZJXFWBXMKHV-UWVGGRQHSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000348176451	410839206	/nfs/dbraw/zinc/83/92/06/410839206.db2.gz	SDCWTYFLOFKRBR-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000348176451	410839208	/nfs/dbraw/zinc/83/92/08/410839208.db2.gz	SDCWTYFLOFKRBR-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@]1(CO)CCOC1	ZINC000359816002	410897398	/nfs/dbraw/zinc/89/73/98/410897398.db2.gz	VOVBIKKUMUTBED-INIZCTEOSA-N	1	1	324.377	1.965	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@]1(CO)CCOC1	ZINC000359816002	410897403	/nfs/dbraw/zinc/89/74/03/410897403.db2.gz	VOVBIKKUMUTBED-INIZCTEOSA-N	1	1	324.377	1.965	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000353292748	410906622	/nfs/dbraw/zinc/90/66/22/410906622.db2.gz	GFRMXPJQHQLTJJ-NSHDSACASA-N	1	1	309.370	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3C[C@@H]4CC[C@H](O)[C@H]4C3)nc2c1	ZINC000344041285	410915065	/nfs/dbraw/zinc/91/50/65/410915065.db2.gz	IEIFVKSIBZPONF-GAFUQQFSSA-N	1	1	303.318	1.939	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1	ZINC000356286586	410943902	/nfs/dbraw/zinc/94/39/02/410943902.db2.gz	XKNBSOVRYRPQOQ-UHFFFAOYSA-N	1	1	317.349	1.916	20	5		DDBDMO
C[C@H](O)CC[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353528656	411049371	/nfs/dbraw/zinc/04/93/71/411049371.db2.gz	OLRUYFITWCWUOA-FZMZJTMJSA-N	1	1	304.350	1.778	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000341837822	411069464	/nfs/dbraw/zinc/06/94/64/411069464.db2.gz	GIUFMCKFBRFDNL-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc(OC)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000341837822	411069469	/nfs/dbraw/zinc/06/94/69/411069469.db2.gz	GIUFMCKFBRFDNL-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000134119722	196363228	/nfs/dbraw/zinc/36/32/28/196363228.db2.gz	IZJJGUPQFPVGAV-GFCCVEGCSA-N	1	1	307.350	1.293	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000419000360	226001551	/nfs/dbraw/zinc/00/15/51/226001551.db2.gz	OGAHVCDWMXBZHS-GHMZBOCLSA-N	1	1	319.365	1.362	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290903640	222007482	/nfs/dbraw/zinc/00/74/82/222007482.db2.gz	VMGPUQCFVKOXRS-SNVBAGLBSA-N	1	1	309.370	1.621	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)OC)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000291348788	222329888	/nfs/dbraw/zinc/32/98/88/222329888.db2.gz	XQHMJHLNLMXWPD-OCCSQVGLSA-N	1	1	312.366	1.691	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2C(=O)NC(=O)[C@H]2C1	ZINC000367836212	418642638	/nfs/dbraw/zinc/64/26/38/418642638.db2.gz	RTQOLCUZXMFHDJ-WQAKAFBOSA-N	1	1	303.318	1.250	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]1CCNc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000352645459	418645100	/nfs/dbraw/zinc/64/51/00/418645100.db2.gz	MDYRVWWCZQEJRK-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1CCNc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000352645459	418645102	/nfs/dbraw/zinc/64/51/02/418645102.db2.gz	MDYRVWWCZQEJRK-GFCCVEGCSA-N	1	1	316.361	2.276	20	5		DDBDMO
Cc1[nH+]ccn1-c1ccccc1CNc1ncc([N+](=O)[O-])cn1	ZINC000354501586	418647361	/nfs/dbraw/zinc/64/73/61/418647361.db2.gz	FCHBBDZIADUZHJ-UHFFFAOYSA-N	1	1	310.317	2.491	20	5		DDBDMO
Cc1ccc2c(c1)CC[N@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000361848649	418718191	/nfs/dbraw/zinc/71/81/91/418718191.db2.gz	AZLXRUAORUQNAY-INIZCTEOSA-N	1	1	316.361	1.519	20	5		DDBDMO
CC1CC[NH+](C2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000370938555	418752031	/nfs/dbraw/zinc/75/20/31/418752031.db2.gz	BFUBWUIXPRNQAS-CVSAEHQPSA-N	1	1	309.410	1.811	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCCNC1=O	ZINC000370997494	418756118	/nfs/dbraw/zinc/75/61/18/418756118.db2.gz	INPQNSPQKYHIRA-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCCCNC1=O	ZINC000370997494	418756119	/nfs/dbraw/zinc/75/61/19/418756119.db2.gz	INPQNSPQKYHIRA-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@H]3C2)c2ncccc12	ZINC000371801216	418817014	/nfs/dbraw/zinc/81/70/14/418817014.db2.gz	FKPXOFZUOZOMPO-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@H]3C2)c2ncccc12	ZINC000371801216	418817016	/nfs/dbraw/zinc/81/70/16/418817016.db2.gz	FKPXOFZUOZOMPO-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@@H]3C2)c2ccncc21	ZINC000364879250	418819983	/nfs/dbraw/zinc/81/99/83/418819983.db2.gz	CTEODIXXLXKUGK-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@@H]3C2)c2ccncc21	ZINC000364879250	418819984	/nfs/dbraw/zinc/81/99/84/418819984.db2.gz	CTEODIXXLXKUGK-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000372298892	418852421	/nfs/dbraw/zinc/85/24/21/418852421.db2.gz	STPWUEODGMSDLF-HNNXBMFYSA-N	1	1	312.329	1.906	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000372298892	418852423	/nfs/dbraw/zinc/85/24/23/418852423.db2.gz	STPWUEODGMSDLF-HNNXBMFYSA-N	1	1	312.329	1.906	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)NC	ZINC000411179045	418876623	/nfs/dbraw/zinc/87/66/23/418876623.db2.gz	BHUIFIVZWQEVEN-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
Cn1ccnc1[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000365633761	418886685	/nfs/dbraw/zinc/88/66/85/418886685.db2.gz	WIWGCESWCKCTOQ-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
Cn1ccnc1[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000365633761	418886686	/nfs/dbraw/zinc/88/66/86/418886686.db2.gz	WIWGCESWCKCTOQ-NSHDSACASA-N	1	1	304.354	1.441	20	5		DDBDMO
Cc1cc(C2=CC[N@H+](CC(=O)N(C)C)CC2)cc([N+](=O)[O-])c1N	ZINC000365887566	418919606	/nfs/dbraw/zinc/91/96/06/418919606.db2.gz	XDMSIVGZIHJJRW-UHFFFAOYSA-N	1	1	318.377	1.663	20	5		DDBDMO
Cc1cc(C2=CC[N@@H+](CC(=O)N(C)C)CC2)cc([N+](=O)[O-])c1N	ZINC000365887566	418919608	/nfs/dbraw/zinc/91/96/08/418919608.db2.gz	XDMSIVGZIHJJRW-UHFFFAOYSA-N	1	1	318.377	1.663	20	5		DDBDMO
CC1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H](CO)O1	ZINC000420944537	419372691	/nfs/dbraw/zinc/37/26/91/419372691.db2.gz	SIJNLJSTZADROP-AWEZNQCLSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C[C@@H](CO)O1	ZINC000420944537	419372697	/nfs/dbraw/zinc/37/26/97/419372697.db2.gz	SIJNLJSTZADROP-AWEZNQCLSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C[C@H]1CCC[N@H+]1C	ZINC000420998103	419433449	/nfs/dbraw/zinc/43/34/49/419433449.db2.gz	HWFKNEPOUXGRKW-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000411903816	419465205	/nfs/dbraw/zinc/46/52/05/419465205.db2.gz	KXVFUKPIOQBMPH-LSDHHAIUSA-N	1	1	321.377	1.393	20	5		DDBDMO
COC(=O)[C@H]1CN([C@H](C)c2cccc([N+](=O)[O-])c2)CC[N@@H+](C)C1	ZINC000411910619	419468700	/nfs/dbraw/zinc/46/87/00/419468700.db2.gz	SLBXIWUVPZYWHL-TZMCWYRMSA-N	1	1	321.377	1.692	20	5		DDBDMO
COC(=O)[C@]1(C)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000412065340	419616877	/nfs/dbraw/zinc/61/68/77/419616877.db2.gz	KRBCHJIJZFHECA-OAHLLOKOSA-N	1	1	323.349	1.032	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1CCC[N@H+]1C	ZINC000421704093	419689291	/nfs/dbraw/zinc/68/92/91/419689291.db2.gz	NTQRGJOYUJFVFY-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[NH2+]CCCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414861621	419848233	/nfs/dbraw/zinc/84/82/33/419848233.db2.gz	SIFZJKPEPIGLDN-UHFFFAOYSA-N	1	1	303.366	1.694	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000430237705	420094592	/nfs/dbraw/zinc/09/45/92/420094592.db2.gz	PKCYTMKOQBPCKU-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)NCC(F)(F)C[NH3+]	ZINC000415665441	420140372	/nfs/dbraw/zinc/14/03/72/420140372.db2.gz	VKIZWUZSVKBBCU-UHFFFAOYSA-N	1	1	318.280	1.709	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCSC[C@H]1CCO	ZINC000430220981	420091699	/nfs/dbraw/zinc/09/16/99/420091699.db2.gz	RFRZANMWEFCQRU-CYBMUJFWSA-N	1	1	312.391	1.903	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCSC[C@H]1CCO	ZINC000430220981	420091703	/nfs/dbraw/zinc/09/17/03/420091703.db2.gz	RFRZANMWEFCQRU-CYBMUJFWSA-N	1	1	312.391	1.903	20	5		DDBDMO
COC(=O)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000430214430	420092709	/nfs/dbraw/zinc/09/27/09/420092709.db2.gz	ZGBKONBPJSKQSO-UHFFFAOYSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CN	ZINC000420290197	420184044	/nfs/dbraw/zinc/18/40/44/420184044.db2.gz	LMSPBEDFMLCXRQ-WFASDCNBSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CN	ZINC000420290197	420184049	/nfs/dbraw/zinc/18/40/49/420184049.db2.gz	LMSPBEDFMLCXRQ-WFASDCNBSA-N	1	1	320.393	1.983	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@@H](C)CN	ZINC000420298269	420189809	/nfs/dbraw/zinc/18/98/09/420189809.db2.gz	ZUTYWVCRLGHROK-JTQLQIEISA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)CN	ZINC000420298269	420189814	/nfs/dbraw/zinc/18/98/14/420189814.db2.gz	ZUTYWVCRLGHROK-JTQLQIEISA-N	1	1	310.354	1.211	20	5		DDBDMO
C[C@@H](CNc1c(C(N)=O)cccc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000420591465	420325131	/nfs/dbraw/zinc/32/51/31/420325131.db2.gz	AERHAAXFAVQEIU-NSHDSACASA-N	1	1	322.365	1.074	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N[C@H]1CCn2cc[nH+]c2C1	ZINC000420614223	420332374	/nfs/dbraw/zinc/33/23/74/420332374.db2.gz	WKGNUKXTMAWMAZ-VIFPVBQESA-N	1	1	301.306	1.317	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000436009894	420301700	/nfs/dbraw/zinc/30/17/00/420301700.db2.gz	WQFWEDXBHYCHOU-NWDGAFQWSA-N	1	1	319.361	1.960	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444645142	230116334	/nfs/dbraw/zinc/11/63/34/230116334.db2.gz	XHHSFNPOCAMOQO-JTQLQIEISA-N	1	1	317.349	1.559	20	5		DDBDMO
NC(=O)C[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000444645142	230116339	/nfs/dbraw/zinc/11/63/39/230116339.db2.gz	XHHSFNPOCAMOQO-JTQLQIEISA-N	1	1	317.349	1.559	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000457117278	420622617	/nfs/dbraw/zinc/62/26/17/420622617.db2.gz	JLRHTFRETXVJKZ-GFCCVEGCSA-N	1	1	321.377	1.296	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000457117278	420622620	/nfs/dbraw/zinc/62/26/20/420622620.db2.gz	JLRHTFRETXVJKZ-GFCCVEGCSA-N	1	1	321.377	1.296	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000493442113	420851856	/nfs/dbraw/zinc/85/18/56/420851856.db2.gz	JANCTOQYPNFLPO-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000493442113	420851860	/nfs/dbraw/zinc/85/18/60/420851860.db2.gz	JANCTOQYPNFLPO-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@H](O)[C@@H](CO)C3)o2)cc1	ZINC000459718019	420855783	/nfs/dbraw/zinc/85/57/83/420855783.db2.gz	XHCSYBPJSKIOHS-DOMZBBRYSA-N	1	1	318.329	1.640	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000449723275	421068840	/nfs/dbraw/zinc/06/88/40/421068840.db2.gz	WZDVMUCEHCMDBS-ZIAGYGMSSA-N	1	1	324.333	1.355	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@@](O)(C4CC4)C3)nc2c1	ZINC000489268597	421142609	/nfs/dbraw/zinc/14/26/09/421142609.db2.gz	NELPWOSYIDGMKB-HNNXBMFYSA-N	1	1	302.334	1.818	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@](O)(C4CC4)C3)nc2c1	ZINC000489268597	421142612	/nfs/dbraw/zinc/14/26/12/421142612.db2.gz	NELPWOSYIDGMKB-HNNXBMFYSA-N	1	1	302.334	1.818	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccnc(N)c1[N+](=O)[O-])C1CCCCC1	ZINC000569740287	421628055	/nfs/dbraw/zinc/62/80/55/421628055.db2.gz	YNUOKNCOQOTOJF-UHFFFAOYSA-N	1	1	321.381	1.566	20	5		DDBDMO
CC(C)Oc1nc(NCCC[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC000571105991	421689976	/nfs/dbraw/zinc/68/99/76/421689976.db2.gz	SJRAFGOCOCMKNK-UHFFFAOYSA-N	1	1	324.381	1.911	20	5		DDBDMO
Cn1ccnc1[C@H]1C[NH2+]CCN1C(=O)c1ccccc1[N+](=O)[O-]	ZINC000571396120	421711734	/nfs/dbraw/zinc/71/17/34/421711734.db2.gz	FCYKVIXEEOATOX-CYBMUJFWSA-N	1	1	315.333	1.115	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@H](CO)COC(C)C)cc1[N+](=O)[O-]	ZINC000519853566	421734526	/nfs/dbraw/zinc/73/45/26/421734526.db2.gz	WJLXBRZFMPNRGO-CYBMUJFWSA-N	1	1	312.366	1.821	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000520065304	421738803	/nfs/dbraw/zinc/73/88/03/421738803.db2.gz	RKEMPGWJNQTONA-SNVBAGLBSA-N	1	1	307.354	1.231	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000521142595	421773746	/nfs/dbraw/zinc/77/37/46/421773746.db2.gz	XWPGWWDGYVLEHJ-UHFFFAOYSA-N	1	1	309.370	1.124	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000581056287	421891312	/nfs/dbraw/zinc/89/13/12/421891312.db2.gz	KPJHDKVUXOHWBG-AWEZNQCLSA-N	1	1	314.345	1.720	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1cc([N+](=O)[O-])nn1C	ZINC000574782459	422180463	/nfs/dbraw/zinc/18/04/63/422180463.db2.gz	ZNYIQFLKWVORDN-NSHDSACASA-N	1	1	309.370	1.275	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N2CC[NH+](C)CC2)c1	ZINC000299220895	278865210	/nfs/dbraw/zinc/86/52/10/278865210.db2.gz	LTOQEXUTGQTEDJ-UHFFFAOYSA-N	1	1	307.350	1.446	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2CC[N@H+](C)[C@H]2C1	ZINC000368595220	301061439	/nfs/dbraw/zinc/06/14/39/301061439.db2.gz	SIERBSLNASWEIP-OLZOCXBDSA-N	1	1	321.381	1.042	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000369144145	301136800	/nfs/dbraw/zinc/13/68/00/301136800.db2.gz	OFQGBABHUQSSKC-GHMZBOCLSA-N	1	1	321.381	1.627	20	5		DDBDMO
CCN1C(=O)[C@@H]2C[N@H+](Cc3ccccc3[N+](=O)[O-])CCN2C1=O	ZINC000369441276	301186303	/nfs/dbraw/zinc/18/63/03/301186303.db2.gz	TYMHFXJSGAZLFW-ZDUSSCGKSA-N	1	1	318.333	1.063	20	5		DDBDMO
CCN1C(=O)[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])CCN2C1=O	ZINC000369441276	301186306	/nfs/dbraw/zinc/18/63/06/301186306.db2.gz	TYMHFXJSGAZLFW-ZDUSSCGKSA-N	1	1	318.333	1.063	20	5		DDBDMO
Nc1ccc(N2CCC[N@H+](C3CCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000376170198	302044220	/nfs/dbraw/zinc/04/42/20/302044220.db2.gz	DWOOEABYWLEIKK-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1NCc1c[nH+]c2n1CCCC2	ZINC000376476208	302082280	/nfs/dbraw/zinc/08/22/80/302082280.db2.gz	YEVOBHPKTAATID-UHFFFAOYSA-N	1	1	316.321	1.234	20	5		DDBDMO
C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ncnn1C	ZINC000518758827	302829660	/nfs/dbraw/zinc/82/96/60/302829660.db2.gz	CTHHHBZDDYCSLR-JTQLQIEISA-N	1	1	318.337	1.403	20	5		DDBDMO
CC(C)(O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CCOCC1	ZINC000530938979	303221598	/nfs/dbraw/zinc/22/15/98/303221598.db2.gz	GXSDJMIAFCHQTK-UHFFFAOYSA-N	1	1	312.370	1.043	20	5		DDBDMO
Cc1nn(CCC(=O)Nc2cc(C)[nH+]cc2C)c(C)c1[N+](=O)[O-]	ZINC000536574596	303364629	/nfs/dbraw/zinc/36/46/29/303364629.db2.gz	HPOBSRANURRUEG-UHFFFAOYSA-N	1	1	317.349	1.871	20	5		DDBDMO
CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC000364485935	307046490	/nfs/dbraw/zinc/04/64/90/307046490.db2.gz	SKMBJLXENRHXNE-ZNMIVQPWSA-N	1	1	309.410	1.622	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000364905434	307053513	/nfs/dbraw/zinc/05/35/13/307053513.db2.gz	LVXJPPHNFUMHJX-JTQLQIEISA-N	1	1	319.365	1.319	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3CC[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1	ZINC000365018717	307056624	/nfs/dbraw/zinc/05/66/24/307056624.db2.gz	ORTLMWBXFZELFR-NHYWBVRUSA-N	1	1	318.377	1.485	20	5		DDBDMO
Cc1cc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000365182777	307060838	/nfs/dbraw/zinc/06/08/38/307060838.db2.gz	IQJICXBJMOYVQU-NWDGAFQWSA-N	1	1	318.377	1.842	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000366316042	307070526	/nfs/dbraw/zinc/07/05/26/307070526.db2.gz	TXZBQYXNATVWHL-GHMZBOCLSA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@@H]12	ZINC000366316042	307070527	/nfs/dbraw/zinc/07/05/27/307070527.db2.gz	TXZBQYXNATVWHL-GHMZBOCLSA-N	1	1	323.736	1.343	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367785152	307104313	/nfs/dbraw/zinc/10/43/13/307104313.db2.gz	WGLWHWVAZDVHBT-QQUHWDOBSA-N	1	1	305.334	1.092	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000367785152	307104314	/nfs/dbraw/zinc/10/43/14/307104314.db2.gz	WGLWHWVAZDVHBT-QQUHWDOBSA-N	1	1	305.334	1.092	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@@H](CO)C1	ZINC000374052569	307201004	/nfs/dbraw/zinc/20/10/04/307201004.db2.gz	VSRKLTILUHHPJM-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@@H](CO)C1	ZINC000374052569	307201005	/nfs/dbraw/zinc/20/10/05/307201005.db2.gz	VSRKLTILUHHPJM-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
O=C1OCCN1C[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000497296030	307389251	/nfs/dbraw/zinc/38/92/51/307389251.db2.gz	HKBZDPJBVIVITF-CYBMUJFWSA-N	1	1	305.334	1.869	20	5		DDBDMO
Cn1cc([C@@H]2C[N@@H+](CCn3ccc([N+](=O)[O-])n3)CC2(C)C)cn1	ZINC000573264018	308235022	/nfs/dbraw/zinc/23/50/22/308235022.db2.gz	QGWUQZYOUOGEFW-ZDUSSCGKSA-N	1	1	318.381	1.650	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCc3ccccc3[C@@H]2C[NH3+])c1[N+](=O)[O-]	ZINC000576400198	308311976	/nfs/dbraw/zinc/31/19/76/308311976.db2.gz	AJPVBOKXPZISKV-LBPRGKRZSA-N	1	1	315.333	1.325	20	5		DDBDMO
CC1(C)CC[N@@H+](CC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000577189169	308369274	/nfs/dbraw/zinc/36/92/74/308369274.db2.gz	QSOWZUPVCZQIGE-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000209700669	484136938	/nfs/dbraw/zinc/13/69/38/484136938.db2.gz	IGTGBAFALUPENP-FPLPWBNLSA-N	1	1	307.350	1.302	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000488728931	484215958	/nfs/dbraw/zinc/21/59/58/484215958.db2.gz	IVLIYSNHWQLVRT-BZPMIXESSA-N	1	1	310.350	1.037	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C[C@@H](O)C(F)(F)F)nc2c1	ZINC000563003298	484331246	/nfs/dbraw/zinc/33/12/46/484331246.db2.gz	QLQZBMUZSRWCRY-SECBINFHSA-N	1	1	304.228	1.484	20	5		DDBDMO
COC(=O)c1cccc(OC[C@@H](O)C[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000414163801	534280096	/nfs/dbraw/zinc/28/00/96/534280096.db2.gz	GOUIPMMWBHIYEH-NSHDSACASA-N	1	1	324.333	1.215	20	5		DDBDMO
NC(=O)NC(=O)CC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451544109	534382254	/nfs/dbraw/zinc/38/22/54/534382254.db2.gz	DSGSLGLXDQQQQS-GFCCVEGCSA-N	1	1	320.349	1.359	20	5		DDBDMO
[NH3+]C1CCN(CCCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000433140015	534567626	/nfs/dbraw/zinc/56/76/26/534567626.db2.gz	DNLHXFUCXPOMCB-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
CC(C)OC[C@@H](CO)[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000433266840	528010474	/nfs/dbraw/zinc/01/04/74/528010474.db2.gz	BRZGMOQSBOHKKF-CYBMUJFWSA-N	1	1	312.366	1.691	20	5		DDBDMO
CCOc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000419007324	528313823	/nfs/dbraw/zinc/31/38/23/528313823.db2.gz	RKITYCALSFULKG-QWHCGFSZSA-N	1	1	323.393	1.885	20	5		DDBDMO
CCN1CC[NH+](C[C@@H](C)CNc2ncc([N+](=O)[O-])c(C)n2)CC1	ZINC000294776215	529147002	/nfs/dbraw/zinc/14/70/02/529147002.db2.gz	ABILGWYCHUZBHU-LBPRGKRZSA-N	1	1	322.413	1.379	20	5		DDBDMO
CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000451261675	529339676	/nfs/dbraw/zinc/33/96/76/529339676.db2.gz	WDGFJIVZOJCWDU-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)[C@H](Nc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000821242873	606732198	/nfs/dbraw/zinc/73/21/98/606732198.db2.gz	XGIKUCLABASLQB-NOZJJQNGSA-N	1	1	317.353	1.527	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1C[C@H](C)[NH2+][C@@H](C)C1	ZINC000070076983	696387166	/nfs/dbraw/zinc/38/71/66/696387166.db2.gz	DRSUPVCBPYVIJT-QWRGUYRKSA-N	1	1	313.379	1.274	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000748349641	700112471	/nfs/dbraw/zinc/11/24/71/700112471.db2.gz	CJAOMKDADXXHOG-LLVKDONJSA-N	1	1	323.349	1.145	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000748349641	700112473	/nfs/dbraw/zinc/11/24/73/700112473.db2.gz	CJAOMKDADXXHOG-LLVKDONJSA-N	1	1	323.349	1.145	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCOC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1	ZINC000748487046	700121452	/nfs/dbraw/zinc/12/14/52/700121452.db2.gz	VQYUPMJHXWLPSM-LBPRGKRZSA-N	1	1	323.349	1.174	20	5		DDBDMO
Nc1cc([N+](=O)[O-])ccc1C(=O)OCCC[NH+]1CCOCC1	ZINC000748493863	700121655	/nfs/dbraw/zinc/12/16/55/700121655.db2.gz	XSUAPOJZAFNCEZ-UHFFFAOYSA-N	1	1	309.322	1.056	20	5		DDBDMO
O=C1CCc2cc([N+](=O)[O-])c(N3CC[NH+](C4CC4)CC3)cc2N1	ZINC000195190557	697734573	/nfs/dbraw/zinc/73/45/73/697734573.db2.gz	HSKQKGFEVONTIK-UHFFFAOYSA-N	1	1	316.361	1.764	20	5		DDBDMO
CC(C)C1(O)C[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000773893208	697820244	/nfs/dbraw/zinc/82/02/44/697820244.db2.gz	LUJJMKUMVUDPTI-UHFFFAOYSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@H+](C[C@H]1CCOC1)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000749965339	700195938	/nfs/dbraw/zinc/19/59/38/700195938.db2.gz	ZRJRCBQNGSUYPL-MRVPVSSYSA-N	1	1	319.159	1.480	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000749965339	700195939	/nfs/dbraw/zinc/19/59/39/700195939.db2.gz	ZRJRCBQNGSUYPL-MRVPVSSYSA-N	1	1	319.159	1.480	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCSC[C@H]2CCO)cc1	ZINC000776585906	698122100	/nfs/dbraw/zinc/12/21/00/698122100.db2.gz	CTBGIDVLTUBFEA-ZIAGYGMSSA-N	1	1	312.391	1.428	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cc[nH]n1	ZINC000782491820	698730013	/nfs/dbraw/zinc/73/00/13/698730013.db2.gz	KMOQENFSWATYEW-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cc[nH]n1	ZINC000782491820	698730015	/nfs/dbraw/zinc/73/00/15/698730015.db2.gz	KMOQENFSWATYEW-UHFFFAOYSA-N	1	1	321.312	1.918	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(CCC[NH2+]3)C2)c1[N+](=O)[O-]	ZINC000424023267	699147205	/nfs/dbraw/zinc/14/72/05/699147205.db2.gz	FJWPWKLCQBBFAB-CQSZACIVSA-N	1	1	307.354	1.239	20	5		DDBDMO
O=C(OCCn1cc([N+](=O)[O-])cn1)[C@@H]1CCC[N@H+]1C1CCCC1	ZINC000786878705	699176484	/nfs/dbraw/zinc/17/64/84/699176484.db2.gz	GIDXRNKAIZAUMU-AWEZNQCLSA-N	1	1	322.365	1.742	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H]1C	ZINC000787187634	699194811	/nfs/dbraw/zinc/19/48/11/699194811.db2.gz	TUFJOXFXHPPYAT-WDEREUQCSA-N	1	1	306.366	1.732	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H]1C	ZINC000787237361	699198985	/nfs/dbraw/zinc/19/89/85/699198985.db2.gz	FTZVOTUFUCVZTN-GXFFZTMASA-N	1	1	318.333	1.785	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)O[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000788114518	699279763	/nfs/dbraw/zinc/27/97/63/699279763.db2.gz	FCOOEUVZPJXXTJ-DGCLKSJQSA-N	1	1	308.338	1.351	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000791051366	699608903	/nfs/dbraw/zinc/60/89/03/699608903.db2.gz	BRDSXRDAQYMNHO-JTQLQIEISA-N	1	1	322.283	1.654	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000791051366	699608904	/nfs/dbraw/zinc/60/89/04/699608904.db2.gz	BRDSXRDAQYMNHO-JTQLQIEISA-N	1	1	322.283	1.654	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801854264	700346534	/nfs/dbraw/zinc/34/65/34/700346534.db2.gz	GBPGYDDJDXILGI-SNVBAGLBSA-N	1	1	324.356	1.776	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000753805062	700458418	/nfs/dbraw/zinc/45/84/18/700458418.db2.gz	KFRUZRHRPTZLMV-UHFFFAOYSA-N	1	1	319.365	1.668	20	5		DDBDMO
COCC1(O)CC[NH+](Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000758376978	700702010	/nfs/dbraw/zinc/70/20/10/700702010.db2.gz	QZSCOORSIJOTAB-UHFFFAOYSA-N	1	1	320.349	1.375	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](C(F)(F)F)C1	ZINC000761711011	700867748	/nfs/dbraw/zinc/86/77/48/700867748.db2.gz	IVKRFSOUHDXMDC-SECBINFHSA-N	1	1	305.256	1.641	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000762708805	700903610	/nfs/dbraw/zinc/90/36/10/700903610.db2.gz	ZRPIJBOXOWIZKD-UHFFFAOYSA-N	1	1	304.350	1.559	20	5		DDBDMO
Cc1nn(CN2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000840090641	701962825	/nfs/dbraw/zinc/96/28/25/701962825.db2.gz	RKYXGGRZUOMTEG-PHIMTYICSA-N	1	1	318.381	1.630	20	5		DDBDMO
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000840110641	701973785	/nfs/dbraw/zinc/97/37/85/701973785.db2.gz	SBEVOGBPGNSHKK-NWDGAFQWSA-N	1	1	315.333	1.030	20	5		DDBDMO
O=c1cccc2n1C[C@H]1C[C@@H]2C[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000840110641	701973787	/nfs/dbraw/zinc/97/37/87/701973787.db2.gz	SBEVOGBPGNSHKK-NWDGAFQWSA-N	1	1	315.333	1.030	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@](C)(CO)C1	ZINC000879261386	706633221	/nfs/dbraw/zinc/63/32/21/706633221.db2.gz	JMGVNWZFIXPNRL-RRFJBIMHSA-N	1	1	310.350	1.100	20	5		DDBDMO
Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000868366317	702089960	/nfs/dbraw/zinc/08/99/60/702089960.db2.gz	PSDWMCDHNRBYRK-CYBMUJFWSA-N	1	1	318.377	1.939	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3ccsc3[N+](=O)[O-])CC2)CC1	ZINC000866210742	706650131	/nfs/dbraw/zinc/65/01/31/706650131.db2.gz	BKZDGBNZVKVSDH-UHFFFAOYSA-N	1	1	310.423	1.873	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000817374757	702361582	/nfs/dbraw/zinc/36/15/82/702361582.db2.gz	VKXVOCPPFBBPFI-GFCCVEGCSA-N	1	1	320.349	1.486	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@]2(CCC[NH2+]2)C1	ZINC000818017219	702555154	/nfs/dbraw/zinc/55/51/54/702555154.db2.gz	XTTUQWFASWGBBG-HNNXBMFYSA-N	1	1	315.333	1.439	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1nc2ccccn2c1[N+](=O)[O-]	ZINC000842047202	702663475	/nfs/dbraw/zinc/66/34/75/702663475.db2.gz	MISZGXMZKAQFID-VXGBXAGGSA-N	1	1	319.365	1.134	20	5		DDBDMO
Cc1cc(N2CCC[C@H](OC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nc(C)[nH+]1	ZINC000842304157	702700311	/nfs/dbraw/zinc/70/03/11/702700311.db2.gz	VIOFRRQLALMYAT-YNEHKIRRSA-N	1	1	320.349	1.271	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000842832238	702781404	/nfs/dbraw/zinc/78/14/04/702781404.db2.gz	BLMGPPDXEBVNHH-GFCCVEGCSA-N	1	1	310.354	1.455	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c(C)c(F)ccc1[N+](=O)[O-]	ZINC000843858240	702934476	/nfs/dbraw/zinc/93/44/76/702934476.db2.gz	SZTHHRRIFOKOGG-UHFFFAOYSA-N	1	1	313.329	1.086	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000866540341	706724178	/nfs/dbraw/zinc/72/41/78/706724178.db2.gz	LYAKAWKTDUMUGS-HZMBPMFUSA-N	1	1	321.352	1.875	20	5		DDBDMO
O=C1N=NCN1C1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000846884579	703347037	/nfs/dbraw/zinc/34/70/37/703347037.db2.gz	DKZSEUDBYCKBDH-UHFFFAOYSA-N	1	1	321.312	1.868	20	5		DDBDMO
C[N@H+]1CC[C@@H](CCOC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000847823445	703473097	/nfs/dbraw/zinc/47/30/97/703473097.db2.gz	FFSYFYXGXQIOSY-LBPRGKRZSA-N	1	1	308.334	1.859	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000869777318	703848511	/nfs/dbraw/zinc/84/85/11/703848511.db2.gz	MNSHKQQCERWLLJ-LBPRGKRZSA-N	1	1	321.377	1.478	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1	ZINC000852313493	704007445	/nfs/dbraw/zinc/00/74/45/704007445.db2.gz	IHIBQZHFUCGHFS-DOMZBBRYSA-N	1	1	317.349	1.242	20	5		DDBDMO
C[C@@]12COC[C@]1(C)C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000852462033	704054147	/nfs/dbraw/zinc/05/41/47/704054147.db2.gz	DVBMLBUWUZIDOQ-HRCADAONSA-N	1	1	306.362	1.987	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCc3cn[nH]c3C2)c1	ZINC000819155072	704077587	/nfs/dbraw/zinc/07/75/87/704077587.db2.gz	OKXGSMGTSRQLQO-SWLSCSKDSA-N	1	1	302.334	1.498	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000852664839	704095968	/nfs/dbraw/zinc/09/59/68/704095968.db2.gz	DNQGDSFIORBDOF-VXGBXAGGSA-N	1	1	307.306	1.971	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1F	ZINC000852708127	704103285	/nfs/dbraw/zinc/10/32/85/704103285.db2.gz	RJDMDSLDLQJSJW-AWEZNQCLSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1	ZINC000819643545	704155698	/nfs/dbraw/zinc/15/56/98/704155698.db2.gz	XYRSOQXDLCWRTH-ZJIFWQFVSA-N	1	1	315.373	1.385	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H]2C1	ZINC000819643545	704155701	/nfs/dbraw/zinc/15/57/01/704155701.db2.gz	XYRSOQXDLCWRTH-ZJIFWQFVSA-N	1	1	315.373	1.385	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@@H]2CC[N@@H+](Cc3ccccc3)[C@@H]2C1	ZINC000819643545	704155703	/nfs/dbraw/zinc/15/57/03/704155703.db2.gz	XYRSOQXDLCWRTH-ZJIFWQFVSA-N	1	1	315.373	1.385	20	5		DDBDMO
CC[C@@H]1CN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000870885058	704157125	/nfs/dbraw/zinc/15/71/25/704157125.db2.gz	AGLRRNHDFYEVGA-XFJVYGCCSA-N	1	1	321.377	1.795	20	5		DDBDMO
COc1cc(N2CC[NH+]([C@@H]3CCOC3)CC2)c([N+](=O)[O-])cc1C	ZINC000853451249	704241580	/nfs/dbraw/zinc/24/15/80/704241580.db2.gz	DMFVDIKZEJMHAE-CYBMUJFWSA-N	1	1	321.377	1.823	20	5		DDBDMO
CN(c1ccccc1)[C@@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000853585517	704276067	/nfs/dbraw/zinc/27/60/67/704276067.db2.gz	QHZQGIOCMHCEEW-CQSZACIVSA-N	1	1	301.350	1.960	20	5		DDBDMO
CN(c1ccccc1)[C@@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000853585517	704276069	/nfs/dbraw/zinc/27/60/69/704276069.db2.gz	QHZQGIOCMHCEEW-CQSZACIVSA-N	1	1	301.350	1.960	20	5		DDBDMO
Cc1ccc(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000821587788	704425453	/nfs/dbraw/zinc/42/54/53/704425453.db2.gz	MNDACIDMNLDEDH-OKILXGFUSA-N	1	1	320.345	1.923	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000856280689	704521360	/nfs/dbraw/zinc/52/13/60/704521360.db2.gz	BJOAFUMAGSEIPC-UHFFFAOYSA-N	1	1	309.370	1.422	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1COC(=O)Cn1c[nH+]cc1C	ZINC000859947467	705049793	/nfs/dbraw/zinc/04/97/93/705049793.db2.gz	GHORVGHKYBQVIO-UHFFFAOYSA-N	1	1	305.290	1.852	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1C[N@H+](C)CCN1C	ZINC000874457157	705074278	/nfs/dbraw/zinc/07/42/78/705074278.db2.gz	HVVDXIASOJPFGI-CYBMUJFWSA-N	1	1	320.393	1.187	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860160101	705118071	/nfs/dbraw/zinc/11/80/71/705118071.db2.gz	LCSMLUJYNVFPIH-GIPNMCIBSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000860160101	705118075	/nfs/dbraw/zinc/11/80/75/705118075.db2.gz	LCSMLUJYNVFPIH-GIPNMCIBSA-N	1	1	319.317	1.027	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3[C@H]2CCC[N@H+]3C)ccc1[N+](=O)[O-]	ZINC000874840447	705195990	/nfs/dbraw/zinc/19/59/90/705195990.db2.gz	OBJVCMICRZAPKI-CHWSQXEVSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000874846917	705201467	/nfs/dbraw/zinc/20/14/67/705201467.db2.gz	LNBKUOHJJLRLNO-LSDHHAIUSA-N	1	1	319.361	1.669	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000874851035	705204147	/nfs/dbraw/zinc/20/41/47/705204147.db2.gz	ZCGGRJPAIMYLEC-OLZOCXBDSA-N	1	1	319.361	1.669	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000861343132	705434936	/nfs/dbraw/zinc/43/49/36/705434936.db2.gz	YYEATNIWWZEMQO-XHDPSFHLSA-N	1	1	323.349	1.443	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000893877407	710870691	/nfs/dbraw/zinc/87/06/91/710870691.db2.gz	WRCHCWUTQHRLMY-UKRRQHHQSA-N	1	1	318.377	1.483	20	5		DDBDMO
O=C(OCC[NH+]1CCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000861385548	705452239	/nfs/dbraw/zinc/45/22/39/705452239.db2.gz	WBUYKCGHKPPAGE-UHFFFAOYSA-N	1	1	317.305	1.038	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000861718167	705549471	/nfs/dbraw/zinc/54/94/71/705549471.db2.gz	WMWSWAOTWQTABW-NEPJUHHUSA-N	1	1	323.324	1.015	20	5		DDBDMO
CCOC(=O)Cc1ccc(N2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000825512489	705684940	/nfs/dbraw/zinc/68/49/40/705684940.db2.gz	GIPCQLCNOSXURV-UHFFFAOYSA-N	1	1	307.350	1.452	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@@H](O)C1)c1cccc([N+](=O)[O-])c1Cl	ZINC000863318921	705899847	/nfs/dbraw/zinc/89/98/47/705899847.db2.gz	XZCIVSFPVUVRSX-SECBINFHSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000827374766	705988830	/nfs/dbraw/zinc/98/88/30/705988830.db2.gz	PUIPHAFKSICHDQ-CHWSQXEVSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000828095281	706117267	/nfs/dbraw/zinc/11/72/67/706117267.db2.gz	LWXFGHNKNAAQTN-SLEUVZQESA-N	1	1	321.377	1.569	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])C[C@H]2C1=O	ZINC000877720289	706188658	/nfs/dbraw/zinc/18/86/58/706188658.db2.gz	NFRZRGFBHAZIHK-KMUUFKDPSA-N	1	1	315.329	1.155	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)[N@H+]1CCO	ZINC000829015543	706274093	/nfs/dbraw/zinc/27/40/93/706274093.db2.gz	LQAORRWDRNUISP-PHIMTYICSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000829015543	706274096	/nfs/dbraw/zinc/27/40/96/706274096.db2.gz	LQAORRWDRNUISP-PHIMTYICSA-N	1	1	324.337	1.394	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1cc(F)c([N+](=O)[O-])cc1CO	ZINC000865559729	706463568	/nfs/dbraw/zinc/46/35/68/706463568.db2.gz	YLIREBUMXSOGCQ-UHFFFAOYSA-N	1	1	315.345	1.606	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000880571072	707022124	/nfs/dbraw/zinc/02/21/24/707022124.db2.gz	KXKCEPFJURHGDW-UHFFFAOYSA-N	1	1	320.349	1.294	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000872779585	707597109	/nfs/dbraw/zinc/59/71/09/707597109.db2.gz	GTERTWXKJNRIIW-UONOGXRCSA-N	1	1	306.366	1.342	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1nc2ccccn2c1[N+](=O)[O-]	ZINC000872781394	707597408	/nfs/dbraw/zinc/59/74/08/707597408.db2.gz	SNOOOTIVEXZASB-VXGBXAGGSA-N	1	1	301.350	1.915	20	5		DDBDMO
Nc1ccc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897219934	708257833	/nfs/dbraw/zinc/25/78/33/708257833.db2.gz	QIXSAFORLSYVGA-CHWSQXEVSA-N	1	1	306.366	1.212	20	5		DDBDMO
Nc1c(F)c(N2CC[C@H]3[C@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221450	708259604	/nfs/dbraw/zinc/25/96/04/708259604.db2.gz	NBLFYSJHYRECOP-WDEREUQCSA-N	1	1	324.356	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N(C)CC[N@@H+](C)CCO)c1C	ZINC000912611253	713049582	/nfs/dbraw/zinc/04/95/82/713049582.db2.gz	AOESXHLMMSHHOI-UHFFFAOYSA-N	1	1	309.366	1.208	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@@H+](C)C[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739943	713080446	/nfs/dbraw/zinc/08/04/46/713080446.db2.gz	KSLCERPVUGYWPH-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\C(=O)N1CC[N@H+](C)C[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000912739943	713080448	/nfs/dbraw/zinc/08/04/48/713080448.db2.gz	KSLCERPVUGYWPH-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099387	713129970	/nfs/dbraw/zinc/12/99/70/713129970.db2.gz	JTYUCHPVIXRPDE-NXEZZACHSA-N	1	1	311.363	1.497	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1ccc([N+](=O)[O-])o1	ZINC000928099387	713129972	/nfs/dbraw/zinc/12/99/72/713129972.db2.gz	JTYUCHPVIXRPDE-NXEZZACHSA-N	1	1	311.363	1.497	20	5		DDBDMO
Cc1cc[nH+]c(N2CCN(c3c([N+](=O)[O-])cnn3C)CC2)c1	ZINC000892943905	710529557	/nfs/dbraw/zinc/52/95/57/710529557.db2.gz	ATRVCZWMAAYKCH-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@H](c2[nH+]ccn2C)C1	ZINC000892984675	710536681	/nfs/dbraw/zinc/53/66/81/710536681.db2.gz	FIRKGUYRMJMOEG-JTQLQIEISA-N	1	1	303.322	1.726	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000893266467	710583141	/nfs/dbraw/zinc/58/31/41/710583141.db2.gz	RDDPMBWBZVTTQQ-CYBMUJFWSA-N	1	1	320.393	1.778	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000928441882	713197266	/nfs/dbraw/zinc/19/72/66/713197266.db2.gz	PTMZBRMUWIOEHC-IINYFYTJSA-N	1	1	316.361	1.827	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1C	ZINC000928444787	713198971	/nfs/dbraw/zinc/19/89/71/713198971.db2.gz	MLGGHNJTRINTNB-MWLCHTKSSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@H+]1C	ZINC000928450126	713202320	/nfs/dbraw/zinc/20/23/20/713202320.db2.gz	SHNDEZSYVZZIEP-JOYOIKCWSA-N	1	1	321.333	1.188	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928452035	713202906	/nfs/dbraw/zinc/20/29/06/713202906.db2.gz	MNJPKXBZVBTAQL-IUODEOHRSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000895246338	711463831	/nfs/dbraw/zinc/46/38/31/711463831.db2.gz	NBFHJVGEASGMPJ-CMPLNLGQSA-N	1	1	310.402	1.166	20	5		DDBDMO
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895248479	711465274	/nfs/dbraw/zinc/46/52/74/711465274.db2.gz	LYUYYPNWFLNRFB-SKDRFNHKSA-N	1	1	313.789	1.689	20	5		DDBDMO
C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1C[N@@H+](C)CCN1C	ZINC000895249500	711465619	/nfs/dbraw/zinc/46/56/19/711465619.db2.gz	UVQBBJUJDQHKMM-TVQRCGJNSA-N	1	1	314.336	1.919	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@]23CC[N@@H+](C2)CCC3)cc1[N+](=O)[O-]	ZINC000895811140	711613244	/nfs/dbraw/zinc/61/32/44/711613244.db2.gz	DCVRJOXCJVCTIO-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
CC1(C)CC[N@H+](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000905678293	712115329	/nfs/dbraw/zinc/11/53/29/712115329.db2.gz	KEAUMOCPRVREJG-OAHLLOKOSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000905678293	712115330	/nfs/dbraw/zinc/11/53/30/712115330.db2.gz	KEAUMOCPRVREJG-OAHLLOKOSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3ccns3)CC2)cn1	ZINC000929171150	713560688	/nfs/dbraw/zinc/56/06/88/713560688.db2.gz	GRKOJUKFHQNHQV-UHFFFAOYSA-N	1	1	319.390	1.811	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000920599393	713682137	/nfs/dbraw/zinc/68/21/37/713682137.db2.gz	TUYFZWKSOOISLL-WCQYABFASA-N	1	1	306.366	1.529	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC[N+](=O)[O-])[C@H]1CNC(=O)OC(C)(C)C	ZINC000929778921	713688363	/nfs/dbraw/zinc/68/83/63/713688363.db2.gz	KSNRRSVNOIAULF-RYUDHWBXSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC[N+](=O)[O-])[C@H]1CNC(=O)OC(C)(C)C	ZINC000929778921	713688364	/nfs/dbraw/zinc/68/83/64/713688364.db2.gz	KSNRRSVNOIAULF-RYUDHWBXSA-N	1	1	301.387	1.888	20	5		DDBDMO
CCOC(=O)/C=C/C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985540	713728880	/nfs/dbraw/zinc/72/88/80/713728880.db2.gz	BUQSPQPDYJHYCX-PCAWENJQSA-N	1	1	320.349	1.595	20	5		DDBDMO
CCOC(=O)/C=C/C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929985540	713728884	/nfs/dbraw/zinc/72/88/84/713728884.db2.gz	BUQSPQPDYJHYCX-PCAWENJQSA-N	1	1	320.349	1.595	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000930361977	713813624	/nfs/dbraw/zinc/81/36/24/713813624.db2.gz	AWGXOEAAVUAMEK-BYCMXARLSA-N	1	1	303.362	1.766	20	5		DDBDMO
O=C(CN1CCn2cc[nH+]c21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000931522447	714118647	/nfs/dbraw/zinc/11/86/47/714118647.db2.gz	DLFNWMLVNZZDES-UHFFFAOYSA-N	1	1	313.317	1.201	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000931627344	714141783	/nfs/dbraw/zinc/14/17/83/714141783.db2.gz	NVLMIROGUDLLCA-LSDHHAIUSA-N	1	1	321.377	1.393	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000932105413	714260177	/nfs/dbraw/zinc/26/01/77/714260177.db2.gz	UXICHFLJEWKUET-KYOSRNDESA-N	1	1	322.361	1.759	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCO1	ZINC000932348344	714315572	/nfs/dbraw/zinc/31/55/72/714315572.db2.gz	MVJBYCKZTWJVDC-TZMCWYRMSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@@H](C3CCOCC3)C2)c1	ZINC000933079258	714513274	/nfs/dbraw/zinc/51/32/74/714513274.db2.gz	KTQLPTDYNHVNGW-CQSZACIVSA-N	1	1	308.382	1.930	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000933560411	714617252	/nfs/dbraw/zinc/61/72/52/714617252.db2.gz	UWINTAAYUBDXEA-UGFHNGPFSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000933560411	714617254	/nfs/dbraw/zinc/61/72/54/714617254.db2.gz	UWINTAAYUBDXEA-UGFHNGPFSA-N	1	1	303.362	1.861	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])N1CCN(C)CC[N@@H+](C)CC1	ZINC000933995524	714717706	/nfs/dbraw/zinc/71/77/06/714717706.db2.gz	DKHCHTIIZQWYNC-AWEZNQCLSA-N	1	1	306.410	1.835	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114484	714745251	/nfs/dbraw/zinc/74/52/51/714745251.db2.gz	JCDOJVLCJOUKJX-SOUVJXGZSA-N	1	1	319.361	1.809	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000934114484	714745252	/nfs/dbraw/zinc/74/52/52/714745252.db2.gz	JCDOJVLCJOUKJX-SOUVJXGZSA-N	1	1	319.361	1.809	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121653	714747827	/nfs/dbraw/zinc/74/78/27/714747827.db2.gz	NZZFCBHPBKAFSJ-ZIAGYGMSSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000934121653	714747829	/nfs/dbraw/zinc/74/78/29/714747829.db2.gz	NZZFCBHPBKAFSJ-ZIAGYGMSSA-N	1	1	307.350	1.951	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000935479318	715065754	/nfs/dbraw/zinc/06/57/54/715065754.db2.gz	SQXNEUMYGXWSBY-HUUCEWRRSA-N	1	1	303.362	1.907	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CCC1CCC1	ZINC001125380607	733087348	/nfs/dbraw/zinc/08/73/48/733087348.db2.gz	VYUCYAJUAGAFEG-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
Cc1sccc1C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001126838586	742350068	/nfs/dbraw/zinc/35/00/68/742350068.db2.gz	IFKBQVLIRYPMSF-UHFFFAOYSA-N	1	1	323.378	1.218	20	5		DDBDMO
Cc1nc(C(C)C)ccc1C[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936218	742830119	/nfs/dbraw/zinc/83/01/19/742830119.db2.gz	BFSZQGMNNXSLJQ-UKRRQHHQSA-N	1	1	320.393	1.384	20	5		DDBDMO
CC(C)(C)c1ccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001126936464	742840431	/nfs/dbraw/zinc/84/04/31/742840431.db2.gz	JKIMGDSGNOXSRB-HUUCEWRRSA-N	1	1	319.405	1.855	20	5		DDBDMO
CCOCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001194725301	746449706	/nfs/dbraw/zinc/44/97/06/746449706.db2.gz	CESQZIFPXNTVQD-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
CCOCC(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001194725301	746449709	/nfs/dbraw/zinc/44/97/09/746449709.db2.gz	CESQZIFPXNTVQD-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
C[N@@H+]1C[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001195642405	746663640	/nfs/dbraw/zinc/66/36/40/746663640.db2.gz	IQPRANDFWCDIOR-LBPRGKRZSA-N	1	1	313.379	1.213	20	5		DDBDMO
C[N@H+]1C[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001195642405	746663643	/nfs/dbraw/zinc/66/36/43/746663643.db2.gz	IQPRANDFWCDIOR-LBPRGKRZSA-N	1	1	313.379	1.213	20	5		DDBDMO
COCCCCC[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001195771184	746693529	/nfs/dbraw/zinc/69/35/29/746693529.db2.gz	ZGPINXVFONWPRL-ZIAGYGMSSA-N	1	1	313.398	1.003	20	5		DDBDMO
COCCCCC[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195771184	746693531	/nfs/dbraw/zinc/69/35/31/746693531.db2.gz	ZGPINXVFONWPRL-ZIAGYGMSSA-N	1	1	313.398	1.003	20	5		DDBDMO
COCCCCC[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195771184	746693533	/nfs/dbraw/zinc/69/35/33/746693533.db2.gz	ZGPINXVFONWPRL-ZIAGYGMSSA-N	1	1	313.398	1.003	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)c1ccc[nH]1	ZINC001031543930	746994995	/nfs/dbraw/zinc/99/49/95/746994995.db2.gz	OJDZSGQSFITPKU-UHFFFAOYSA-N	1	1	314.345	1.785	20	5		DDBDMO
Cc1cccc(C)c1C[NH+]1CC(CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001031662175	747336519	/nfs/dbraw/zinc/33/65/19/747336519.db2.gz	WAGJFBCNHFIDBK-GDBMZVCRSA-N	1	1	317.389	1.517	20	5		DDBDMO
O=C(NCC1C[NH+](CCCC2CCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001031662257	747336585	/nfs/dbraw/zinc/33/65/85/747336585.db2.gz	ZFFOATVHAJMJMM-HUUCEWRRSA-N	1	1	309.410	1.670	20	5		DDBDMO
CCC/C=C/CC[NH2+]C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001200471363	748265460	/nfs/dbraw/zinc/26/54/60/748265460.db2.gz	FPNNULGSUSBUSD-DPOFCPOHSA-N	1	1	309.410	1.979	20	5		DDBDMO
CN(C)c1cc(NC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)cc[nH+]1	ZINC001137170437	749377085	/nfs/dbraw/zinc/37/70/85/749377085.db2.gz	RAEZNGSVAIUNOU-AWEZNQCLSA-N	1	1	316.317	1.728	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CCC2CCCC2)CC1	ZINC000996440894	749574794	/nfs/dbraw/zinc/57/47/94/749574794.db2.gz	OJQNWRVWHWHYCW-HUUCEWRRSA-N	1	1	309.410	1.813	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007604	762175580	/nfs/dbraw/zinc/17/55/80/762175580.db2.gz	OMIMZTMCAYEEAZ-MMWGEVLESA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007604	762175583	/nfs/dbraw/zinc/17/55/83/762175583.db2.gz	OMIMZTMCAYEEAZ-MMWGEVLESA-N	1	1	314.279	1.769	20	5		DDBDMO
C[N@@H+](C1CN(C(=O)OC(C)(C)C)C1)[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169038237	762193473	/nfs/dbraw/zinc/19/34/73/762193473.db2.gz	XGUXSHACXFZCFQ-RYUDHWBXSA-N	1	1	313.398	1.983	20	5		DDBDMO
Cc1cnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169057630	762210945	/nfs/dbraw/zinc/21/09/45/762210945.db2.gz	WKJXUXIZWWHSSM-MGPQQGTHSA-N	1	1	306.366	1.684	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ncccc2[N+](=O)[O-])C1	ZINC001097189729	756978636	/nfs/dbraw/zinc/97/86/36/756978636.db2.gz	CNDZANFWLRWRHI-TXEJJXNPSA-N	1	1	321.381	1.389	20	5		DDBDMO
CCCC[NH+]1CCC(C2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC001000148480	761541630	/nfs/dbraw/zinc/54/16/30/761541630.db2.gz	FHUQCKIATFEOQS-ZIAGYGMSSA-N	1	1	309.410	1.813	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)c2cnc(N)c([N+](=O)[O-])c2)C1	ZINC001136225125	771917803	/nfs/dbraw/zinc/91/78/03/771917803.db2.gz	TTZJPQDVKCJUFA-SNVBAGLBSA-N	1	1	307.354	1.034	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094434479	775858619	/nfs/dbraw/zinc/85/86/19/775858619.db2.gz	JPPSYYIMSHBFSL-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCCNc1ccccc1[N+](=O)[O-]	ZINC001094456347	775894924	/nfs/dbraw/zinc/89/49/24/775894924.db2.gz	BLFBQDLZALFWEA-UHFFFAOYSA-N	1	1	308.382	1.853	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)CC[C@@H]2C1	ZINC001173234402	777065010	/nfs/dbraw/zinc/06/50/10/777065010.db2.gz	RCAZYNUBEFAXDT-IUODEOHRSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@](CO)([NH2+]Cc1cc(=O)c(O)co1)c1cccc([N+](=O)[O-])c1	ZINC001175322338	777751293	/nfs/dbraw/zinc/75/12/93/777751293.db2.gz	BEFKLGCAZLOPFZ-HNNXBMFYSA-N	1	1	320.301	1.251	20	5		DDBDMO
CC[N@@H+]1CC[C@@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC001119344397	781413563	/nfs/dbraw/zinc/41/35/63/781413563.db2.gz	LIBNWZQUPGSACE-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1	ZINC001119344397	781413565	/nfs/dbraw/zinc/41/35/65/781413565.db2.gz	LIBNWZQUPGSACE-CYBMUJFWSA-N	1	1	313.379	1.108	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1cccc(F)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001268237488	839874532	/nfs/dbraw/zinc/87/45/32/839874532.db2.gz	KDHAAGCRLQAEHW-ZIAGYGMSSA-N	1	1	309.341	1.381	20	5		DDBDMO
CN(CC[N@H+](C)Cc1cccc(F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268237488	839874546	/nfs/dbraw/zinc/87/45/46/839874546.db2.gz	KDHAAGCRLQAEHW-ZIAGYGMSSA-N	1	1	309.341	1.381	20	5		DDBDMO
CN(CC[N@@H+](C)Cc1cccc(F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001268237488	839874553	/nfs/dbraw/zinc/87/45/53/839874553.db2.gz	KDHAAGCRLQAEHW-ZIAGYGMSSA-N	1	1	309.341	1.381	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2ccsc2)CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001270743854	842864200	/nfs/dbraw/zinc/86/42/00/842864200.db2.gz	XFGVQLSUXFGOKM-CHWSQXEVSA-N	1	1	323.418	1.932	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCc1c[nH+]c2n1CCC2	ZINC001154937228	861584870	/nfs/dbraw/zinc/58/48/70/861584870.db2.gz	JLPYOWVXUHJMII-UHFFFAOYSA-N	1	1	316.317	1.676	20	5		DDBDMO
CCOC(=O)c1cc(-c2nnc(C[NH+](C)C)o2)cc([N+](=O)[O-])c1	ZINC001328432230	862970291	/nfs/dbraw/zinc/97/02/91/862970291.db2.gz	AAAJWBNHKDCYMM-UHFFFAOYSA-N	1	1	320.305	1.883	20	5		DDBDMO
CC(=O)NC1(CO)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001328509477	863015462	/nfs/dbraw/zinc/01/54/62/863015462.db2.gz	KBTWCNRRXIDLDJ-UHFFFAOYSA-N	1	1	307.350	1.058	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nnc(C[N+](=O)[O-])n2CC)C1	ZINC001121792138	858598583	/nfs/dbraw/zinc/59/85/83/858598583.db2.gz	RJXUXUHEOBNEKH-GFCCVEGCSA-N	1	1	310.402	1.243	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)OCC1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC001122962746	859030032	/nfs/dbraw/zinc/03/00/32/859030032.db2.gz	UTHOFHBWLYSEPG-YHWZYXNKSA-N	1	1	322.365	1.516	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H]2C[N@@H+]3CCN2C[C@@H]3C)cc1[N+](=O)[O-]	ZINC001123474148	859251042	/nfs/dbraw/zinc/25/10/42/859251042.db2.gz	YRWUPTCNQVKGHP-SMDDNHRTSA-N	1	1	304.350	1.230	20	5		DDBDMO
C[NH+]1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1	ZINC001332381214	865803163	/nfs/dbraw/zinc/80/31/63/865803163.db2.gz	NHLUSMSGSHGZRJ-UHFFFAOYSA-N	1	1	322.365	1.040	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC[N@H+]1CCC[C@@H]1C	ZINC001320704252	866964287	/nfs/dbraw/zinc/96/42/87/866964287.db2.gz	YLMDGTYJFGHKCM-NSHDSACASA-N	1	1	306.366	1.851	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N1C[C@H]2CC[N@@H+](C)[C@H]2C1	ZINC001163347007	868379075	/nfs/dbraw/zinc/37/90/75/868379075.db2.gz	QDCTYUNKSBJJPW-ABAIWWIYSA-N	1	1	319.361	1.830	20	5		DDBDMO
Cc1cccc(N2CCN(c3cc(N)c([N+](=O)[O-])cn3)CC2)[nH+]1	ZINC001163666818	868610173	/nfs/dbraw/zinc/61/01/73/868610173.db2.gz	VYTADOXYQDGTJJ-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
CC(=O)c1cc(N[C@H](C)[C@H]2C[N@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727476	869112593	/nfs/dbraw/zinc/11/25/93/869112593.db2.gz	WLMFEQYQKCLRNX-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
CC(=O)c1cc(N[C@H](C)[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001336727476	869112597	/nfs/dbraw/zinc/11/25/97/869112597.db2.gz	WLMFEQYQKCLRNX-BDJLRTHQSA-N	1	1	320.393	1.844	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC001165151425	869410798	/nfs/dbraw/zinc/41/07/98/869410798.db2.gz	QREOMDMSXVFIGE-PHIMTYICSA-N	1	1	320.349	1.164	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1ccc([N+](=O)[O-])c(N)n1)CC2	ZINC001166032259	869809419	/nfs/dbraw/zinc/80/94/19/869809419.db2.gz	BJEZPIJILZUKAP-UHFFFAOYSA-N	1	1	320.353	1.206	20	5		DDBDMO
CN(C)C1=[NH+]OC2(C1)CCN(c1ncc([N+](=O)[O-])cc1N)CC2	ZINC001166034714	869810708	/nfs/dbraw/zinc/81/07/08/869810708.db2.gz	JZKJYQKZLIEMFV-UHFFFAOYSA-N	1	1	320.353	1.206	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc(-c3c[nH]c([N+](=O)[O-])c3)n2C)C[C@@H]1C	ZINC001338461280	869991112	/nfs/dbraw/zinc/99/11/12/869991112.db2.gz	KXYDTMACCSGZMN-JTQLQIEISA-N	1	1	319.369	1.249	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ncnc3ccc([N+](=O)[O-])cc32)C1	ZINC001226441030	882433573	/nfs/dbraw/zinc/43/35/73/882433573.db2.gz	LEILDYOYRZYGGE-GFCCVEGCSA-N	1	1	318.333	1.638	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001303799178	871155867	/nfs/dbraw/zinc/15/58/67/871155867.db2.gz	DHFCYMBXQYIYGB-JOYOIKCWSA-N	1	1	311.769	2.000	20	5		DDBDMO
Cc1cccc(C)c1C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001316823041	871966546	/nfs/dbraw/zinc/96/65/46/871966546.db2.gz	BLIUDEXZMVFPLF-GDBMZVCRSA-N	1	1	319.405	1.907	20	5		DDBDMO
Cc1cccc(C)c1C[N@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001316823041	871966557	/nfs/dbraw/zinc/96/65/57/871966557.db2.gz	BLIUDEXZMVFPLF-GDBMZVCRSA-N	1	1	319.405	1.907	20	5		DDBDMO
Cc1cccc(C)c1C[N@@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001316823041	871966574	/nfs/dbraw/zinc/96/65/74/871966574.db2.gz	BLIUDEXZMVFPLF-GDBMZVCRSA-N	1	1	319.405	1.907	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1COC[C@@H]1C[N@H+](C)CCO1	ZINC001222777102	880692528	/nfs/dbraw/zinc/69/25/28/880692528.db2.gz	GHQHYWLFUSSXOR-NSHDSACASA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1COC[C@@H]1C[N@@H+](C)CCO1	ZINC001222777102	880692532	/nfs/dbraw/zinc/69/25/32/880692532.db2.gz	GHQHYWLFUSSXOR-NSHDSACASA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1c(COC[C@@H]2C[N@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC001223296153	880911922	/nfs/dbraw/zinc/91/19/22/880911922.db2.gz	YFHAKBRSCWWWCG-LBPRGKRZSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1c(COC[C@@H]2C[N@@H+](C)CCO2)cccc1[N+](=O)[O-]	ZINC001223296153	880911929	/nfs/dbraw/zinc/91/19/29/880911929.db2.gz	YFHAKBRSCWWWCG-LBPRGKRZSA-N	1	1	324.333	1.229	20	5		DDBDMO
O=[N+]([O-])c1c[nH]cc2nc(O[C@@H]3CCc4[nH+]ccn4C3)nc1-2	ZINC001230231517	884381818	/nfs/dbraw/zinc/38/18/18/884381818.db2.gz	MAXTXGGUPNGZBI-MRVPVSSYSA-N	1	1	300.278	1.456	20	5		DDBDMO
CC(=O)N1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254601096	896524859	/nfs/dbraw/zinc/52/48/59/896524859.db2.gz	ZGLCGSBFIFJSJL-MRXNPFEDSA-N	1	1	303.362	1.616	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cc([N+](=O)[O-])ccc3F)[C@H]2C1	ZINC001263980098	900854096	/nfs/dbraw/zinc/85/40/96/900854096.db2.gz	NEVFFFPZJIZKOD-DUFXMDAXSA-N	1	1	307.325	1.804	20	5		DDBDMO
Cc1cnc(N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000278651100	214303062	/nfs/dbraw/zinc/30/30/62/214303062.db2.gz	DONPPXDIJPIHRP-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000278714469	214347147	/nfs/dbraw/zinc/34/71/47/214347147.db2.gz	OWEDLDITSDGYJV-NSHDSACASA-N	1	1	319.365	1.281	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000278714469	214347152	/nfs/dbraw/zinc/34/71/52/214347152.db2.gz	OWEDLDITSDGYJV-NSHDSACASA-N	1	1	319.365	1.281	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@]3(CNC(=O)C3)C2)ccc1[N+](=O)[O-]	ZINC000278779445	214396493	/nfs/dbraw/zinc/39/64/93/214396493.db2.gz	DBNAGSRALJTOQX-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000451253359	529480550	/nfs/dbraw/zinc/48/05/50/529480550.db2.gz	JNZSTJUTPAXASJ-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CCCC[N@@H+]1CCO	ZINC000452390477	231375529	/nfs/dbraw/zinc/37/55/29/231375529.db2.gz	OFHNHNCEUUGBNP-HNNXBMFYSA-N	1	1	321.377	1.100	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250337	529577221	/nfs/dbraw/zinc/57/72/21/529577221.db2.gz	IXQRRSOSLGFNBW-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000495250337	529577225	/nfs/dbraw/zinc/57/72/25/529577225.db2.gz	IXQRRSOSLGFNBW-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCS1	ZINC000090551233	185302700	/nfs/dbraw/zinc/30/27/00/185302700.db2.gz	KJWXBHPLYSUPIB-ZDUSSCGKSA-N	1	1	311.407	1.830	20	5		DDBDMO
CC(C)CO[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000090552306	185303037	/nfs/dbraw/zinc/30/30/37/185303037.db2.gz	ZWIAVYVWMGIOGR-AWEZNQCLSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000181418558	199293938	/nfs/dbraw/zinc/29/39/38/199293938.db2.gz	ANODRUJPMIVBEZ-JTQLQIEISA-N	1	1	323.349	1.784	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000181606769	199326455	/nfs/dbraw/zinc/32/64/55/199326455.db2.gz	JPYXOAIKOIKUMK-LLVKDONJSA-N	1	1	321.333	1.538	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000458178851	530054666	/nfs/dbraw/zinc/05/46/66/530054666.db2.gz	XEUUUKAKUIFLAQ-ZDUSSCGKSA-N	1	1	305.378	1.985	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1nccc2ccc([N+](=O)[O-])cc21	ZINC000413149591	530071285	/nfs/dbraw/zinc/07/12/85/530071285.db2.gz	VAHCVMPHWOXKCH-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413149591	530071287	/nfs/dbraw/zinc/07/12/87/530071287.db2.gz	VAHCVMPHWOXKCH-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1	ZINC000413149591	530071288	/nfs/dbraw/zinc/07/12/88/530071288.db2.gz	VAHCVMPHWOXKCH-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC(C)(C)CO	ZINC000295159743	282363728	/nfs/dbraw/zinc/36/37/28/282363728.db2.gz	FCLYWGFYLMNPGR-UHFFFAOYSA-N	1	1	309.366	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC(C)(C)CO	ZINC000295159743	282363730	/nfs/dbraw/zinc/36/37/30/282363730.db2.gz	FCLYWGFYLMNPGR-UHFFFAOYSA-N	1	1	309.366	1.792	20	5		DDBDMO
O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@H+]1C1CC1	ZINC000279646289	215030072	/nfs/dbraw/zinc/03/00/72/215030072.db2.gz	BEEXUOKDORHDDC-OAHLLOKOSA-N	1	1	318.377	1.750	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682293	186097036	/nfs/dbraw/zinc/09/70/36/186097036.db2.gz	PXQXDRABJSXNJL-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000152682293	186097038	/nfs/dbraw/zinc/09/70/38/186097038.db2.gz	PXQXDRABJSXNJL-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=[N+]([O-])c1cc2c(ncnc2NCCC[NH+]2CCOCC2)s1	ZINC000287183240	219364530	/nfs/dbraw/zinc/36/45/30/219364530.db2.gz	ZQHAMIJECKHADV-UHFFFAOYSA-N	1	1	323.378	1.734	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000280086620	215364596	/nfs/dbraw/zinc/36/45/96/215364596.db2.gz	OETZZGNDABLOOQ-HOCLYGCPSA-N	1	1	324.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H](OCCO)C2)cc1	ZINC000172293478	198073264	/nfs/dbraw/zinc/07/32/64/198073264.db2.gz	SWXXYFDCEJVILC-MRXNPFEDSA-N	1	1	324.377	1.837	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000066149655	352980024	/nfs/dbraw/zinc/98/00/24/352980024.db2.gz	FUMGNXZAWJCOPP-LLVKDONJSA-N	1	1	311.386	1.373	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000173399895	198211341	/nfs/dbraw/zinc/21/13/41/198211341.db2.gz	VAEBQHUEWHQDFD-ZIAGYGMSSA-N	1	1	306.410	1.881	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000069139261	353148361	/nfs/dbraw/zinc/14/83/61/353148361.db2.gz	UTAAEWABFIKOIN-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
NS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000074288477	353304779	/nfs/dbraw/zinc/30/47/79/353304779.db2.gz	LXODERJXTFFJAO-GFCCVEGCSA-N	1	1	313.379	1.095	20	5		DDBDMO
COc1ccc([C@@H](CO)[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000174861038	198394061	/nfs/dbraw/zinc/39/40/61/198394061.db2.gz	WQNQAXAKUQLYRN-OAHLLOKOSA-N	1	1	320.349	1.465	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000078562777	353521687	/nfs/dbraw/zinc/52/16/87/353521687.db2.gz	OABDMTCCLHWNBH-LBPRGKRZSA-N	1	1	320.393	1.862	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H]([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000277096734	213290630	/nfs/dbraw/zinc/29/06/30/213290630.db2.gz	CBCKHUJKYUDRQN-LLVKDONJSA-N	1	1	323.397	1.827	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])CC1	ZINC000080160867	353594444	/nfs/dbraw/zinc/59/44/44/353594444.db2.gz	WILQFJRNQPMLST-UHFFFAOYSA-N	1	1	320.393	1.585	20	5		DDBDMO
CNC(=O)N1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000084714861	353727039	/nfs/dbraw/zinc/72/70/39/353727039.db2.gz	WLJPXDJOMDEFOM-UHFFFAOYSA-N	1	1	322.365	1.321	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000088700599	353757546	/nfs/dbraw/zinc/75/75/46/353757546.db2.gz	KYVKFLKQNFVXNQ-UHFFFAOYSA-N	1	1	306.366	1.526	20	5		DDBDMO
CCc1nn(C)c(N2CCC[C@H](c3[nH]cc[nH+]3)C2)c1[N+](=O)[O-]	ZINC000091480069	353828192	/nfs/dbraw/zinc/82/81/92/353828192.db2.gz	KMAQYRREEBPHQE-JTQLQIEISA-N	1	1	304.354	1.998	20	5		DDBDMO
COC1CCC([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000090549564	353795185	/nfs/dbraw/zinc/79/51/85/353795185.db2.gz	PHHWDKGAOKXELG-UHFFFAOYSA-N	1	1	309.366	1.646	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)C[C@@H](O)C1CC1	ZINC000156606961	354220268	/nfs/dbraw/zinc/22/02/68/354220268.db2.gz	PNDOJNKNPZWOPM-CYBMUJFWSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H](O)C1CC1	ZINC000156606961	354220273	/nfs/dbraw/zinc/22/02/73/354220273.db2.gz	PNDOJNKNPZWOPM-CYBMUJFWSA-N	1	1	323.349	1.245	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H](C)C1	ZINC000346178543	283014158	/nfs/dbraw/zinc/01/41/58/283014158.db2.gz	LLZLRWIMXJCWIV-SRVKXCTJSA-N	1	1	321.381	1.131	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)C[C@@H](O)C1CC1	ZINC000305233213	354469804	/nfs/dbraw/zinc/46/98/04/354469804.db2.gz	MQDMZYPZIPOCBJ-OAHLLOKOSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1ccc2nc(N3CC[N@H+]4C[C@H](O)C[C@H]4C3)ccc2c1	ZINC000405210732	354677108	/nfs/dbraw/zinc/67/71/08/354677108.db2.gz	HZTAWBQJAIABEO-UONOGXRCSA-N	1	1	314.345	1.398	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCO[C@H](C)C2)c1	ZINC000589497057	354996573	/nfs/dbraw/zinc/99/65/73/354996573.db2.gz	LKRJUTDYVNJRRT-LLVKDONJSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCCO[C@H](C)C2)c1	ZINC000589497057	354996576	/nfs/dbraw/zinc/99/65/76/354996576.db2.gz	LKRJUTDYVNJRRT-LLVKDONJSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[C@H]1[C@@H]([NH+](C)C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000590566935	355114914	/nfs/dbraw/zinc/11/49/14/355114914.db2.gz	SVJYMRHYZUMJDY-ZANVPECISA-N	1	1	317.349	1.636	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000590443437	355097546	/nfs/dbraw/zinc/09/75/46/355097546.db2.gz	IRCCTHOBQYUGRL-RISCZKNCSA-N	1	1	305.334	1.136	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21	ZINC000590446501	355099820	/nfs/dbraw/zinc/09/98/20/355099820.db2.gz	VZFCVKRQXNRXCN-GXFFZTMASA-N	1	1	305.334	1.380	20	5		DDBDMO
COCc1cc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)no1	ZINC000590957086	355222701	/nfs/dbraw/zinc/22/27/01/355222701.db2.gz	NSNLJXWPHWOYKF-UHFFFAOYSA-N	1	1	307.306	1.898	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+][C@H]2CCC[C@H]2F)cc1	ZINC000591767829	355381189	/nfs/dbraw/zinc/38/11/89/355381189.db2.gz	QIBDMLFAETUWFL-OLZOCXBDSA-N	1	1	316.354	1.849	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2C[C@@H](O)CC[C@@H]2C)c1	ZINC000593035332	355776596	/nfs/dbraw/zinc/77/65/96/355776596.db2.gz	SUBTUZVEOCSYGC-GWCFXTLKSA-N	1	1	308.334	1.727	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2C[C@@H](O)CC[C@@H]2C)c1	ZINC000593035332	355776600	/nfs/dbraw/zinc/77/66/00/355776600.db2.gz	SUBTUZVEOCSYGC-GWCFXTLKSA-N	1	1	308.334	1.727	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2C[C@@H]3C[C@H]2C[S@]3=O)cc1	ZINC000593103322	355799317	/nfs/dbraw/zinc/79/93/17/355799317.db2.gz	YTKLWFOTSNMACI-QENPMARHSA-N	1	1	310.375	1.569	20	5		DDBDMO
CCOc1cccc(N2CC([N@@H+]3CC[C@@H](O)C3)C2)c1[N+](=O)[O-]	ZINC000593505966	355907237	/nfs/dbraw/zinc/90/72/37/355907237.db2.gz	ZCPDGIZYOWZPOM-GFCCVEGCSA-N	1	1	307.350	1.249	20	5		DDBDMO
CCOc1cccc(N2CC([N@H+]3CC[C@@H](O)C3)C2)c1[N+](=O)[O-]	ZINC000593505966	355907239	/nfs/dbraw/zinc/90/72/39/355907239.db2.gz	ZCPDGIZYOWZPOM-GFCCVEGCSA-N	1	1	307.350	1.249	20	5		DDBDMO
[NH3+]C[C@@H]1C[N@H+](Cc2cc([O-])ccc2[N+](=O)[O-])CC12CCOCC2	ZINC000593727029	355977420	/nfs/dbraw/zinc/97/74/20/355977420.db2.gz	APWCMFNOQRIXEH-CYBMUJFWSA-N	1	1	321.377	1.488	20	5		DDBDMO
[NH3+]C[C@@H]1C[N@@H+](Cc2cc([O-])ccc2[N+](=O)[O-])CC12CCOCC2	ZINC000593727029	355977423	/nfs/dbraw/zinc/97/74/23/355977423.db2.gz	APWCMFNOQRIXEH-CYBMUJFWSA-N	1	1	321.377	1.488	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594025433	356093215	/nfs/dbraw/zinc/09/32/15/356093215.db2.gz	LFSIHTKIQZFGKR-VHDGCEQUSA-N	1	1	305.378	1.715	20	5		DDBDMO
C[C@H](O)C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000594064217	356103572	/nfs/dbraw/zinc/10/35/72/356103572.db2.gz	LMVISJBGXCYUIC-NSHDSACASA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@H](O)C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000594064217	356103576	/nfs/dbraw/zinc/10/35/76/356103576.db2.gz	LMVISJBGXCYUIC-NSHDSACASA-N	1	1	319.361	1.329	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594418566	356204156	/nfs/dbraw/zinc/20/41/56/356204156.db2.gz	KDZXQNSEIRHDJO-VXGBXAGGSA-N	1	1	321.381	1.627	20	5		DDBDMO
O=[N+]([O-])c1ccc(CNC2CC[NH+]([C@@H]3CCOC3)CC2)cc1	ZINC000594502527	356238137	/nfs/dbraw/zinc/23/81/37/356238137.db2.gz	KIIUTQHOMRAUKZ-MRXNPFEDSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[NH2+]C1CCN([C@@H]2CCOC2)CC1	ZINC000594501974	356238783	/nfs/dbraw/zinc/23/87/83/356238783.db2.gz	GNAVEBJPJOMEAZ-OAHLLOKOSA-N	1	1	305.378	1.938	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000081556137	192290570	/nfs/dbraw/zinc/29/05/70/192290570.db2.gz	FHHCUHKBWNXXPX-LLVKDONJSA-N	1	1	322.365	1.237	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)ccc1[N+](=O)[O-]	ZINC000595607971	356574711	/nfs/dbraw/zinc/57/47/11/356574711.db2.gz	MDYPAKFZKWAYHZ-CYBMUJFWSA-N	1	1	317.349	1.717	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595741353	356630210	/nfs/dbraw/zinc/63/02/10/356630210.db2.gz	MXSGOSBVTLBLFC-MFKMUULPSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595741353	356630212	/nfs/dbraw/zinc/63/02/12/356630212.db2.gz	MXSGOSBVTLBLFC-MFKMUULPSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c2c(c1)COCO2	ZINC000595830708	356667926	/nfs/dbraw/zinc/66/79/26/356667926.db2.gz	LGUJHLHFENSEBX-BXUZGUMPSA-N	1	1	320.345	1.930	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595877535	356688240	/nfs/dbraw/zinc/68/82/40/356688240.db2.gz	UYMUJAUPTGUPTE-MLGOLLRUSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595877535	356688242	/nfs/dbraw/zinc/68/82/42/356688242.db2.gz	UYMUJAUPTGUPTE-MLGOLLRUSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@H](CNc1c(Cl)cncc1[N+](=O)[O-])C[NH+]1CCOCC1	ZINC000596133309	356785498	/nfs/dbraw/zinc/78/54/98/356785498.db2.gz	HAVNBBFFPSPGMS-SNVBAGLBSA-N	1	1	314.773	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NCC23CC(C2)C[NH2+]3)n1	ZINC000596655751	356943893	/nfs/dbraw/zinc/94/38/93/356943893.db2.gz	YMPOMNMHHOOICJ-SBEAFCBVSA-N	1	1	305.382	1.617	20	5		DDBDMO
Cc1[nH+]cc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1C	ZINC000596989686	357034844	/nfs/dbraw/zinc/03/48/44/357034844.db2.gz	VENOFBQVGOAQQC-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC(C[NH+]3CCOCC3)C2)c1	ZINC000597682371	357283553	/nfs/dbraw/zinc/28/35/53/357283553.db2.gz	NWLLWZIRRZULOH-UHFFFAOYSA-N	1	1	319.361	1.307	20	5		DDBDMO
CCN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1	ZINC000598040928	357438096	/nfs/dbraw/zinc/43/80/96/357438096.db2.gz	JKFYCCIUYZAVBY-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000598599464	357648830	/nfs/dbraw/zinc/64/88/30/357648830.db2.gz	OIWMFSGPDNZREM-UWVGGRQHSA-N	1	1	308.338	1.671	20	5		DDBDMO
COc1nc(C)cc(C)c1C[N@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000598650257	357670050	/nfs/dbraw/zinc/67/00/50/357670050.db2.gz	UATGJQROTWOCHZ-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
COc1nc(C)cc(C)c1C[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000598650257	357670055	/nfs/dbraw/zinc/67/00/55/357670055.db2.gz	UATGJQROTWOCHZ-UHFFFAOYSA-N	1	1	319.365	1.944	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@@H+](CC3CC3)C2)n1	ZINC000598563068	357634361	/nfs/dbraw/zinc/63/43/61/357634361.db2.gz	ZXLLAWLYSUKOFZ-LBPRGKRZSA-N	1	1	321.381	1.180	20	5		DDBDMO
COc1cc(NCC[N@@H+]2CC[C@@H](O)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000599175503	357840272	/nfs/dbraw/zinc/84/02/72/357840272.db2.gz	DDYOGIJAIUPXRP-SECBINFHSA-N	1	1	315.757	1.735	20	5		DDBDMO
COc1cc(NCC[N@H+]2CC[C@@H](O)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000599175503	357840276	/nfs/dbraw/zinc/84/02/76/357840276.db2.gz	DDYOGIJAIUPXRP-SECBINFHSA-N	1	1	315.757	1.735	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC1(C)COC1	ZINC000599571635	357979141	/nfs/dbraw/zinc/97/91/41/357979141.db2.gz	OKMJQLAWSBIYKR-NSHDSACASA-N	1	1	307.350	1.890	20	5		DDBDMO
O=C(C[NH+](C1CC1)C1CC1)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000599594204	357986005	/nfs/dbraw/zinc/98/60/05/357986005.db2.gz	LRRBZSOOHRSKTA-UHFFFAOYSA-N	1	1	319.317	1.889	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000600835037	358329366	/nfs/dbraw/zinc/32/93/66/358329366.db2.gz	HAMIOUGPZSRLNE-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
COC(=O)CN(C)C(=O)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000348090771	283363460	/nfs/dbraw/zinc/36/34/60/283363460.db2.gz	YHOFYWXSOAVSNB-UHFFFAOYSA-N	1	1	323.349	1.048	20	5		DDBDMO
COc1ccc(CC(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000565581206	304077021	/nfs/dbraw/zinc/07/70/21/304077021.db2.gz	YCPYOZVSIZQUGU-GXTWGEPZSA-N	1	1	319.361	1.308	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000180931574	199228869	/nfs/dbraw/zinc/22/88/69/199228869.db2.gz	DDQMAYLUHYSTNI-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[N@@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@H]1C	ZINC000601134819	358416316	/nfs/dbraw/zinc/41/63/16/358416316.db2.gz	LXJVXQBCFXDYOB-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC[N@H+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@H]1C	ZINC000601134819	358416321	/nfs/dbraw/zinc/41/63/21/358416321.db2.gz	LXJVXQBCFXDYOB-MRVPVSSYSA-N	1	1	321.303	1.878	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601776273	358690551	/nfs/dbraw/zinc/69/05/51/358690551.db2.gz	IGBIWJSGGJZNGJ-OAHLLOKOSA-N	1	1	309.366	1.259	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3C[C@@H]4COC[C@@H]4C3)o2)cc1	ZINC000601974903	358760964	/nfs/dbraw/zinc/76/09/64/358760964.db2.gz	STUTTZCABTYDMW-TXEJJXNPSA-N	1	1	316.317	1.723	20	5		DDBDMO
C[N@H+](CCC(N)=O)Cc1cc(Br)c([N+](=O)[O-])s1	ZINC000602653703	359103171	/nfs/dbraw/zinc/10/31/71/359103171.db2.gz	IXXRFCUTUPVNIU-UHFFFAOYSA-N	1	1	322.184	1.726	20	5		DDBDMO
C[N@@H+](CCC(N)=O)Cc1cc(Br)c([N+](=O)[O-])s1	ZINC000602653703	359103175	/nfs/dbraw/zinc/10/31/75/359103175.db2.gz	IXXRFCUTUPVNIU-UHFFFAOYSA-N	1	1	322.184	1.726	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@H](CO)C1	ZINC000602931188	359300541	/nfs/dbraw/zinc/30/05/41/359300541.db2.gz	MJZOEUBALIEKHX-SNPRPXQTSA-N	1	1	324.377	1.427	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)n1	ZINC000603141670	359430162	/nfs/dbraw/zinc/43/01/62/359430162.db2.gz	HDDVXJUNRCGEPM-LBPRGKRZSA-N	1	1	323.397	1.614	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)n1	ZINC000603141670	359430165	/nfs/dbraw/zinc/43/01/65/359430165.db2.gz	HDDVXJUNRCGEPM-LBPRGKRZSA-N	1	1	323.397	1.614	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000186935309	200035070	/nfs/dbraw/zinc/03/50/70/200035070.db2.gz	CTDNJNKHJHUNAT-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000186935309	200035072	/nfs/dbraw/zinc/03/50/72/200035072.db2.gz	CTDNJNKHJHUNAT-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
Cc1cc(N2CCC([N@@H+]3CCOC[C@H]3C)CC2)ncc1[N+](=O)[O-]	ZINC000603400378	359616638	/nfs/dbraw/zinc/61/66/38/359616638.db2.gz	GZOMUBLASOXKNQ-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH+]1CCC(C)(CO)CC1	ZINC000186965925	200039882	/nfs/dbraw/zinc/03/98/82/200039882.db2.gz	BFJYEJUMUQSHHD-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc(OC)c(C)c([N+](=O)[O-])c2)C1	ZINC000189212025	200364855	/nfs/dbraw/zinc/36/48/55/200364855.db2.gz	OTPIPEORKNZCNY-LBPRGKRZSA-N	1	1	321.377	1.983	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000610446799	360438218	/nfs/dbraw/zinc/43/82/18/360438218.db2.gz	GNHGTMHZQSFTTF-UHFFFAOYSA-N	1	1	323.349	1.785	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000610580821	360476148	/nfs/dbraw/zinc/47/61/48/360476148.db2.gz	NJEMIZQZBXWWPK-VIFPVBQESA-N	1	1	304.306	1.433	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000610580821	360476150	/nfs/dbraw/zinc/47/61/50/360476150.db2.gz	NJEMIZQZBXWWPK-VIFPVBQESA-N	1	1	304.306	1.433	20	5		DDBDMO
O=C(C[N@@H+]1C[C@H]2CCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762619	360530943	/nfs/dbraw/zinc/53/09/43/360530943.db2.gz	GUAXHQIEJUSUCF-TZMCWYRMSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@H]2CCC[C@H]21)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000610762619	360530947	/nfs/dbraw/zinc/53/09/47/360530947.db2.gz	GUAXHQIEJUSUCF-TZMCWYRMSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000359028229	299310922	/nfs/dbraw/zinc/31/09/22/299310922.db2.gz	PJPJJKMDNPUGDK-VXGBXAGGSA-N	1	1	305.338	1.160	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611255648	360680688	/nfs/dbraw/zinc/68/06/88/360680688.db2.gz	XIYXXHDOTCYQHG-JTQLQIEISA-N	1	1	322.317	1.361	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611255648	360680691	/nfs/dbraw/zinc/68/06/91/360680691.db2.gz	XIYXXHDOTCYQHG-JTQLQIEISA-N	1	1	322.317	1.361	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@H](CCO)C1)OCCO2	ZINC000611268915	360683799	/nfs/dbraw/zinc/68/37/99/360683799.db2.gz	FAIQNSNPZRQYAD-LBPRGKRZSA-N	1	1	322.361	1.960	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@H]1O	ZINC000611287540	360689609	/nfs/dbraw/zinc/68/96/09/360689609.db2.gz	HFCOGYMXJSLJBM-MFKMUULPSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000611223065	360667325	/nfs/dbraw/zinc/66/73/25/360667325.db2.gz	QFCAMVJYTOTHEO-NSHDSACASA-N	1	1	314.345	1.967	20	5		DDBDMO
C[N@H+](Cc1cn[nH]c1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612108173	360921663	/nfs/dbraw/zinc/92/16/63/360921663.db2.gz	QKZYCFKIEDMEAN-LBPRGKRZSA-N	1	1	306.322	1.190	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000264595009	204016401	/nfs/dbraw/zinc/01/64/01/204016401.db2.gz	AYWYXVQJSNDVTL-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000266408993	205325724	/nfs/dbraw/zinc/32/57/24/205325724.db2.gz	ZFPQYZTZKJBFBI-YOGCLGLASA-N	1	1	321.381	1.382	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](NC(=O)NC2CC2)C1	ZINC000273764917	211038739	/nfs/dbraw/zinc/03/87/39/211038739.db2.gz	PSROXLNKMUHJPH-AWEZNQCLSA-N	1	1	318.377	1.939	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939983	251289478	/nfs/dbraw/zinc/28/94/78/251289478.db2.gz	XTJUVCLSYINTFS-CABZTGNLSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000340939983	251289483	/nfs/dbraw/zinc/28/94/83/251289483.db2.gz	XTJUVCLSYINTFS-CABZTGNLSA-N	1	1	304.306	1.600	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H]1CCC[N@H+](C(C)C)C1	ZINC000063711008	184286593	/nfs/dbraw/zinc/28/65/93/184286593.db2.gz	QSNWPMXPANBSSG-ZDUSSCGKSA-N	1	1	323.397	1.336	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC([NH2+]CC3CC3)CC2)c1[N+](=O)[O-]	ZINC000269189254	207309315	/nfs/dbraw/zinc/30/93/15/207309315.db2.gz	GZOLZZLGUOXHQZ-UHFFFAOYSA-N	1	1	307.354	1.231	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H](C)CC[NH+]1CCOCC1	ZINC000114374054	194651259	/nfs/dbraw/zinc/65/12/59/194651259.db2.gz	PYHMIDVSMXQSII-LLVKDONJSA-N	1	1	322.365	1.139	20	5		DDBDMO
CC(C)CO[C@@H]1CC[N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000120085523	195093715	/nfs/dbraw/zinc/09/37/15/195093715.db2.gz	XVTPQQOKTXGMFA-CQSZACIVSA-N	1	1	321.377	1.941	20	5		DDBDMO
CC(C)CO[C@@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000120085523	195093717	/nfs/dbraw/zinc/09/37/17/195093717.db2.gz	XVTPQQOKTXGMFA-CQSZACIVSA-N	1	1	321.377	1.941	20	5		DDBDMO
O=c1[nH]cnc2cc(N3CC[NH+](C4CC4)CC3)c([N+](=O)[O-])cc21	ZINC000301067230	285098553	/nfs/dbraw/zinc/09/85/53/285098553.db2.gz	DEMFBJSAEQUROG-UHFFFAOYSA-N	1	1	315.333	1.528	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)C1(C(N)=O)CCCC1	ZINC000120178157	195113276	/nfs/dbraw/zinc/11/32/76/195113276.db2.gz	ZIKLIVQIAPNKFI-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2ncc([N+](=O)[O-])cc2C)CC1	ZINC000413475027	533101766	/nfs/dbraw/zinc/10/17/66/533101766.db2.gz	NLQQEVQQHORBKD-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[C@@H]1O	ZINC000352657690	285201668	/nfs/dbraw/zinc/20/16/68/285201668.db2.gz	BYTRMFTTXVUSFK-KGLIPLIRSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000120691067	195218417	/nfs/dbraw/zinc/21/84/17/195218417.db2.gz	HMGIBVXCJZTOJJ-WFASDCNBSA-N	1	1	321.377	1.772	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000295101438	533218732	/nfs/dbraw/zinc/21/87/32/533218732.db2.gz	SVMBYHFEFPINML-ZDUSSCGKSA-N	1	1	314.363	1.668	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000295101438	533218738	/nfs/dbraw/zinc/21/87/38/533218738.db2.gz	SVMBYHFEFPINML-ZDUSSCGKSA-N	1	1	314.363	1.668	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000289812284	221243042	/nfs/dbraw/zinc/24/30/42/221243042.db2.gz	ZJMXQQGSIBPXFY-UHFFFAOYSA-N	1	1	305.342	1.169	20	5		DDBDMO
COCCCC[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000419385610	533251112	/nfs/dbraw/zinc/25/11/12/533251112.db2.gz	LDANYKXTWWVLLS-UHFFFAOYSA-N	1	1	321.377	1.842	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000579730210	422823716	/nfs/dbraw/zinc/82/37/16/422823716.db2.gz	LWADTVMDQFOPTC-SNVBAGLBSA-N	1	1	309.370	1.422	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)C(C)(C)C1	ZINC000569496849	304358657	/nfs/dbraw/zinc/35/86/57/304358657.db2.gz	WLKSHYCOQLOGQV-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@](O)(C(N)=O)C1	ZINC000286103529	292295026	/nfs/dbraw/zinc/29/50/26/292295026.db2.gz	IMKWPJREWIEHLL-ABAIWWIYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000570083596	304395024	/nfs/dbraw/zinc/39/50/24/304395024.db2.gz	GGINRTPZSPYELO-UHFFFAOYSA-N	1	1	322.365	1.173	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@@H]2CCC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000069220831	406692635	/nfs/dbraw/zinc/69/26/35/406692635.db2.gz	JPLWMAXQUJVQNB-JTQLQIEISA-N	1	1	309.370	1.485	20	5		DDBDMO
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)N1C[C@@H](C)[NH2+][C@@H](C)C1	ZINC000070076793	406808856	/nfs/dbraw/zinc/80/88/56/406808856.db2.gz	QNYMVCFDOJRHAQ-AOOOYVTPSA-N	1	1	313.379	1.274	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2	ZINC000073997594	406899290	/nfs/dbraw/zinc/89/92/90/406899290.db2.gz	JGWXCWQPPJAIJI-DZGCQCFKSA-N	1	1	303.362	1.832	20	5		DDBDMO
CN1CC[NH+](CCCNC(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000044355473	407022418	/nfs/dbraw/zinc/02/24/18/407022418.db2.gz	PRQNUENTEZRXSO-UHFFFAOYSA-N	1	1	312.395	1.024	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000052522634	407151602	/nfs/dbraw/zinc/15/16/02/407151602.db2.gz	BPSBCYFCVHBNSC-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
CC(C)[NH+]1CCN(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1	ZINC000102329203	407321544	/nfs/dbraw/zinc/32/15/44/407321544.db2.gz	SAFQJEKFQIFXKC-UHFFFAOYSA-N	1	1	309.370	1.079	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C[C@H](C)[NH2+]1	ZINC000123964011	407344228	/nfs/dbraw/zinc/34/42/28/407344228.db2.gz	FZGLJLNHCFQXAB-IUCAKERBSA-N	1	1	317.342	1.105	20	5		DDBDMO
COCC[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(C)o1	ZINC000125384276	407387601	/nfs/dbraw/zinc/38/76/01/407387601.db2.gz	GXWHGOOBJZNBOP-UHFFFAOYSA-N	1	1	308.338	1.841	20	5		DDBDMO
COCC[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccc(C)o1	ZINC000125384276	407387603	/nfs/dbraw/zinc/38/76/03/407387603.db2.gz	GXWHGOOBJZNBOP-UHFFFAOYSA-N	1	1	308.338	1.841	20	5		DDBDMO
C[C@@H](C[S@](C)=O)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159122	407407035	/nfs/dbraw/zinc/40/70/35/407407035.db2.gz	DBVNIYMGBRDROW-QZHJKPJSSA-N	1	1	300.380	1.327	20	5		DDBDMO
C[C@@H](C[S@](C)=O)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000126159122	407407037	/nfs/dbraw/zinc/40/70/37/407407037.db2.gz	DBVNIYMGBRDROW-QZHJKPJSSA-N	1	1	300.380	1.327	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000127418420	407435946	/nfs/dbraw/zinc/43/59/46/407435946.db2.gz	MGUPOCLOGORBCA-BXUZGUMPSA-N	1	1	320.393	1.979	20	5		DDBDMO
CC(C)c1ccc(CN2CC[NH+](CCO)CC2)cc1[N+](=O)[O-]	ZINC000127864140	407473645	/nfs/dbraw/zinc/47/36/45/407473645.db2.gz	HHONTAXJBODQQY-UHFFFAOYSA-N	1	1	307.394	1.828	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000270983942	407451673	/nfs/dbraw/zinc/45/16/73/407451673.db2.gz	XOXCUFLCPGPQHA-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000270983942	407451677	/nfs/dbraw/zinc/45/16/77/407451677.db2.gz	XOXCUFLCPGPQHA-JTNHKYCSSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC(C)CC[NH+]1CCC(CNC(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000152329956	407609562	/nfs/dbraw/zinc/60/95/62/407609562.db2.gz	IFUOQSATSWLQTJ-UHFFFAOYSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000171192861	407625021	/nfs/dbraw/zinc/62/50/21/407625021.db2.gz	XNCUOZIHKRVUMO-CQSZACIVSA-N	1	1	306.366	1.531	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](CCO)Cc2cccnc2)c1	ZINC000178867033	407633791	/nfs/dbraw/zinc/63/37/91/407633791.db2.gz	ROLYUIYRMNQTIA-INIZCTEOSA-N	1	1	317.345	1.518	20	5		DDBDMO
C[C@@H](O)C[C@@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000152879420	407708915	/nfs/dbraw/zinc/70/89/15/407708915.db2.gz	PTXFMOQIANTXKX-IPYPFGDCSA-N	1	1	324.377	1.570	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000272242306	407830662	/nfs/dbraw/zinc/83/06/62/407830662.db2.gz	XUHORKZOQHLCMZ-SNVBAGLBSA-N	1	1	309.370	1.429	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000268147748	407913343	/nfs/dbraw/zinc/91/33/43/407913343.db2.gz	FKWCDIKLEIEZFC-LKFCYVNXSA-N	1	1	307.325	1.946	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H]([C@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000272499373	407949954	/nfs/dbraw/zinc/94/99/54/407949954.db2.gz	DLLOUYOSBCQEPA-AVGNSLFASA-N	1	1	321.377	1.933	20	5		DDBDMO
C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000262768046	407922745	/nfs/dbraw/zinc/92/27/45/407922745.db2.gz	TVDXZADYHAEZKR-NOZJJQNGSA-N	1	1	317.349	1.813	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000118751820	407940236	/nfs/dbraw/zinc/94/02/36/407940236.db2.gz	FBKHIMUNNXASHQ-CQSZACIVSA-N	1	1	322.365	1.515	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000135532077	408028013	/nfs/dbraw/zinc/02/80/13/408028013.db2.gz	JASJCATXCOAPOF-LBPRGKRZSA-N	1	1	321.381	1.343	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024088	408023122	/nfs/dbraw/zinc/02/31/22/408023122.db2.gz	LNIAOFZVFUROPF-MJBXVCDLSA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1CO[C@@H](C)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000273024088	408023127	/nfs/dbraw/zinc/02/31/27/408023127.db2.gz	LNIAOFZVFUROPF-MJBXVCDLSA-N	1	1	324.377	1.834	20	5		DDBDMO
COC(=O)c1cc(NC(=O)C[N@@H+](C)C(C)C)cc([N+](=O)[O-])c1	ZINC000136150392	408082684	/nfs/dbraw/zinc/08/26/84/408082684.db2.gz	SBYKLVZMZVMNKY-UHFFFAOYSA-N	1	1	309.322	1.660	20	5		DDBDMO
CNC(=O)CCC[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000154969738	408109146	/nfs/dbraw/zinc/10/91/46/408109146.db2.gz	GCWGUSBXQIFJES-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000154969738	408109152	/nfs/dbraw/zinc/10/91/52/408109152.db2.gz	GCWGUSBXQIFJES-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]([NH+](CC)CC)C2)c1[N+](=O)[O-]	ZINC000175405472	408122345	/nfs/dbraw/zinc/12/23/45/408122345.db2.gz	WWVZXTYJWQYNKW-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCOCCC[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000273572937	408251874	/nfs/dbraw/zinc/25/18/74/408251874.db2.gz	DMZVKHCBNHDWEH-JSGCOSHPSA-N	1	1	323.397	1.934	20	5		DDBDMO
CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@@H]1CCC[N@@H+](C)C1	ZINC000151119976	408259959	/nfs/dbraw/zinc/25/99/59/408259959.db2.gz	SMVRCFPDQYRAEB-SNVBAGLBSA-N	1	1	310.329	1.482	20	5		DDBDMO
CCOC(=O)C[C@H](C)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O	ZINC000182625933	408208736	/nfs/dbraw/zinc/20/87/36/408208736.db2.gz	QOBRXDPWTZDNBD-NSHDSACASA-N	1	1	311.338	1.030	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(c3nccs3)CC2)n1	ZINC000176218172	408312939	/nfs/dbraw/zinc/31/29/39/408312939.db2.gz	IBUJBKGYHSDPRR-UHFFFAOYSA-N	1	1	322.394	1.460	20	5		DDBDMO
CN1CCO[C@@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000130962712	162000931	/nfs/dbraw/zinc/00/09/31/162000931.db2.gz	IXIQNULCYYRIOZ-JKSUJKDBSA-N	1	1	321.377	1.379	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000173466629	162341836	/nfs/dbraw/zinc/34/18/36/162341836.db2.gz	ARMXDQKYESMEPD-LBPRGKRZSA-N	1	1	302.338	1.410	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000274543562	408445631	/nfs/dbraw/zinc/44/56/31/408445631.db2.gz	UUUKGIOXRAHXEU-IINYFYTJSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000274417842	408397743	/nfs/dbraw/zinc/39/77/43/408397743.db2.gz	IFRIZGKRLSRQMH-LLVKDONJSA-N	1	1	306.366	1.591	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1C	ZINC000274660456	408485491	/nfs/dbraw/zinc/48/54/91/408485491.db2.gz	YSMGRNGSUQXUFB-MNOVXSKESA-N	1	1	306.366	1.732	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000264477037	408506138	/nfs/dbraw/zinc/50/61/38/408506138.db2.gz	HFHMAWUWEDMDIC-LBPRGKRZSA-N	1	1	323.349	1.054	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475396	408507159	/nfs/dbraw/zinc/50/71/59/408507159.db2.gz	YPJSBOZDQBIYQZ-DOMZBBRYSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000264475396	408507166	/nfs/dbraw/zinc/50/71/66/408507166.db2.gz	YPJSBOZDQBIYQZ-DOMZBBRYSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177131067	408528009	/nfs/dbraw/zinc/52/80/09/408528009.db2.gz	IPPDAVNWHXXDAH-YPMHNXCESA-N	1	1	303.362	1.879	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000161403773	408600518	/nfs/dbraw/zinc/60/05/18/408600518.db2.gz	MIJYZYZAUUQHTQ-GXSJLCMTSA-N	1	1	309.370	1.095	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000264622037	408543324	/nfs/dbraw/zinc/54/33/24/408543324.db2.gz	LKXWOEHDEDPEFO-UHFFFAOYSA-N	1	1	307.350	1.528	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000248691459	408616672	/nfs/dbraw/zinc/61/66/72/408616672.db2.gz	ZAJZBEXLTFMJHT-BONVTDFDSA-N	1	1	318.333	1.330	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000248691459	408616675	/nfs/dbraw/zinc/61/66/75/408616675.db2.gz	ZAJZBEXLTFMJHT-BONVTDFDSA-N	1	1	318.333	1.330	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](CC)CC3)c1[N+](=O)[O-]	ZINC000192688227	408632531	/nfs/dbraw/zinc/63/25/31/408632531.db2.gz	VINLCSHBZIEAMB-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](CC)CC3)c1[N+](=O)[O-]	ZINC000192688227	408632536	/nfs/dbraw/zinc/63/25/36/408632536.db2.gz	VINLCSHBZIEAMB-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](CC)CC3)c1[N+](=O)[O-]	ZINC000192688227	408632542	/nfs/dbraw/zinc/63/25/42/408632542.db2.gz	VINLCSHBZIEAMB-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCN(c3cc(N)ccc3[N+](=O)[O-])CC2)CCO1	ZINC000192782701	408646014	/nfs/dbraw/zinc/64/60/14/408646014.db2.gz	LIAJAQUQUVLQKS-GFCCVEGCSA-N	1	1	320.393	1.867	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H]1CO	ZINC000248958887	408666837	/nfs/dbraw/zinc/66/68/37/408666837.db2.gz	QPTVSRPXTLNHJM-QMTHXVAHSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H]1CO	ZINC000248958887	408666841	/nfs/dbraw/zinc/66/68/41/408666841.db2.gz	QPTVSRPXTLNHJM-QMTHXVAHSA-N	1	1	307.350	1.544	20	5		DDBDMO
Nc1nc(N2CCC[N@H+](C3CCCC3)CC2)ncc1[N+](=O)[O-]	ZINC000265553913	408693619	/nfs/dbraw/zinc/69/36/19/408693619.db2.gz	HPEKSBWOCKCLMA-UHFFFAOYSA-N	1	1	306.370	1.422	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000249142193	408700227	/nfs/dbraw/zinc/70/02/27/408700227.db2.gz	QZVOVBDFJQJIKV-ZYHUDNBSSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000249142193	408700234	/nfs/dbraw/zinc/70/02/34/408700234.db2.gz	QZVOVBDFJQJIKV-ZYHUDNBSSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000249142193	408700238	/nfs/dbraw/zinc/70/02/38/408700238.db2.gz	QZVOVBDFJQJIKV-ZYHUDNBSSA-N	1	1	323.397	1.683	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000270840121	408702690	/nfs/dbraw/zinc/70/26/90/408702690.db2.gz	DXEKGTVXRFHTLQ-ZLDLUXBVSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C[C@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000178347978	408809690	/nfs/dbraw/zinc/80/96/90/408809690.db2.gz	BIDBDBXQIXEQFI-GFCCVEGCSA-N	1	1	310.350	1.951	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000265756985	408772388	/nfs/dbraw/zinc/77/23/88/408772388.db2.gz	GITOOJMKOJQUNZ-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1	ZINC000191481362	163188290	/nfs/dbraw/zinc/18/82/90/163188290.db2.gz	GILBIRPHFOUZQG-UHFFFAOYSA-N	1	1	301.302	1.962	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000286174127	408936656	/nfs/dbraw/zinc/93/66/56/408936656.db2.gz	WXNUBHGNSABBKV-WMLDXEAASA-N	1	1	319.405	1.932	20	5		DDBDMO
C[C@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1	ZINC000286223742	408945155	/nfs/dbraw/zinc/94/51/55/408945155.db2.gz	YVIGNNKPZVQCDH-XJKSGUPXSA-N	1	1	305.378	1.890	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1(CO)CCC1	ZINC000292098068	408979675	/nfs/dbraw/zinc/97/96/75/408979675.db2.gz	HPRNTFJOPZGDSY-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3nonc32)[C@H](C)C1	ZINC000277791492	409012705	/nfs/dbraw/zinc/01/27/05/409012705.db2.gz	NJIXGLTXAXHXQR-NXEZZACHSA-N	1	1	321.337	1.022	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3ccc([N+](=O)[O-])c4nonc43)C2)C1	ZINC000292329193	409025648	/nfs/dbraw/zinc/02/56/48/409025648.db2.gz	PHPBHUSLAXTPQP-CQSZACIVSA-N	1	1	303.322	1.663	20	5		DDBDMO
CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(C)C1=O	ZINC000282349959	409038798	/nfs/dbraw/zinc/03/87/98/409038798.db2.gz	ANMHSDHKQXSCPT-CYBMUJFWSA-N	1	1	305.334	1.564	20	5		DDBDMO
CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(C)C1=O	ZINC000282349959	409038799	/nfs/dbraw/zinc/03/87/99/409038799.db2.gz	ANMHSDHKQXSCPT-CYBMUJFWSA-N	1	1	305.334	1.564	20	5		DDBDMO
C[N@H+](CCCS(C)(=O)=O)CCc1cccc([N+](=O)[O-])c1	ZINC000282402660	409048352	/nfs/dbraw/zinc/04/83/52/409048352.db2.gz	HUPKJSMQWYCBDR-UHFFFAOYSA-N	1	1	300.380	1.504	20	5		DDBDMO
C[N@@H+](CCCS(C)(=O)=O)CCc1cccc([N+](=O)[O-])c1	ZINC000282402660	409048355	/nfs/dbraw/zinc/04/83/55/409048355.db2.gz	HUPKJSMQWYCBDR-UHFFFAOYSA-N	1	1	300.380	1.504	20	5		DDBDMO
O=[N+]([O-])c1c(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)nc2sccn21	ZINC000316905083	164024573	/nfs/dbraw/zinc/02/45/73/164024573.db2.gz	XYHZFJRXEWLBRM-ZJUUUORDSA-N	1	1	323.378	1.579	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408069487	164216799	/nfs/dbraw/zinc/21/67/99/164216799.db2.gz	BVJUOJIYYHSDGS-GHMZBOCLSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000408069487	164216801	/nfs/dbraw/zinc/21/68/01/164216801.db2.gz	BVJUOJIYYHSDGS-GHMZBOCLSA-N	1	1	309.370	1.077	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408112161	164231942	/nfs/dbraw/zinc/23/19/42/164231942.db2.gz	IPURNLOLOVAOKJ-VIFPVBQESA-N	1	1	303.322	1.247	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408112161	164231943	/nfs/dbraw/zinc/23/19/43/164231943.db2.gz	IPURNLOLOVAOKJ-VIFPVBQESA-N	1	1	303.322	1.247	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)C(=O)c1ccccc1[N+](=O)[O-]	ZINC000290682248	409485576	/nfs/dbraw/zinc/48/55/76/409485576.db2.gz	QPGNKRGOFMJGHQ-UHFFFAOYSA-N	1	1	322.409	1.550	20	5		DDBDMO
CN(CCCN(C)C(=O)c1ccccc1[N+](=O)[O-])CC[NH+](C)C	ZINC000290682248	409485580	/nfs/dbraw/zinc/48/55/80/409485580.db2.gz	QPGNKRGOFMJGHQ-UHFFFAOYSA-N	1	1	322.409	1.550	20	5		DDBDMO
O=C1[C@@H]([NH+]2CCC(O)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304001329	409561638	/nfs/dbraw/zinc/56/16/38/409561638.db2.gz	RETLHZHUZUYZRJ-AWEZNQCLSA-N	1	1	305.334	1.157	20	5		DDBDMO
C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CC(C)(C)O	ZINC000304237606	409581813	/nfs/dbraw/zinc/58/18/13/409581813.db2.gz	QOBSBPLWXBPQDL-UHFFFAOYSA-N	1	1	323.349	1.596	20	5		DDBDMO
C[N@H+](Cc1ccc(F)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000304290952	409596899	/nfs/dbraw/zinc/59/68/99/409596899.db2.gz	GNVBVCABYHPNED-CQSZACIVSA-N	1	1	308.313	1.423	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000297169129	409837205	/nfs/dbraw/zinc/83/72/05/409837205.db2.gz	PKYXVPFMHMMACH-SNVBAGLBSA-N	1	1	305.338	1.604	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000354371979	409802119	/nfs/dbraw/zinc/80/21/19/409802119.db2.gz	LCBIOUGEKGJWLR-NSHDSACASA-N	1	1	306.366	1.639	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCc2cccnc2)CC1	ZINC000298059937	410095261	/nfs/dbraw/zinc/09/52/61/410095261.db2.gz	JZOCNWFJPZUPSM-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](CO)C1	ZINC000298085333	410105313	/nfs/dbraw/zinc/10/53/13/410105313.db2.gz	HDSOPHLPDZHQMR-CYBMUJFWSA-N	1	1	321.377	1.936	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000346729355	410116837	/nfs/dbraw/zinc/11/68/37/410116837.db2.gz	OGJSTBVDCUNGMH-MRXNPFEDSA-N	1	1	321.377	1.055	20	5		DDBDMO
CC(C)OCCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000298159931	410124327	/nfs/dbraw/zinc/12/43/27/410124327.db2.gz	SKBVIJYGZRHBTP-UHFFFAOYSA-N	1	1	308.382	1.927	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CC[NH+](C)CC1	ZINC000193143901	306726547	/nfs/dbraw/zinc/72/65/47/306726547.db2.gz	QMYDYYIBZOVPST-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
COc1c(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000332671546	410203520	/nfs/dbraw/zinc/20/35/20/410203520.db2.gz	ZQYJLPVWNKONAF-NWDGAFQWSA-N	1	1	319.361	1.912	20	5		DDBDMO
CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000347011820	410312434	/nfs/dbraw/zinc/31/24/34/410312434.db2.gz	MNMPLZRQMTYPPW-CQSZACIVSA-N	1	1	319.361	1.669	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000299109238	410526675	/nfs/dbraw/zinc/52/66/75/410526675.db2.gz	WHOKHPUMAZIVRA-OLZOCXBDSA-N	1	1	304.350	1.534	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000352228520	410561089	/nfs/dbraw/zinc/56/10/89/410561089.db2.gz	ZYXFCXVOVABRBI-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[C@@H]1C[C@@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000352952636	410699652	/nfs/dbraw/zinc/69/96/52/410699652.db2.gz	VXJVMUKNUPRGIM-MNOVXSKESA-N	1	1	313.379	1.356	20	5		DDBDMO
CC[C@]1(C)COCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762177	410678912	/nfs/dbraw/zinc/67/89/12/410678912.db2.gz	KUQLDNKEIYNLCT-XJKSGUPXSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)COCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762177	410678916	/nfs/dbraw/zinc/67/89/16/410678916.db2.gz	KUQLDNKEIYNLCT-XJKSGUPXSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)CC1(C)C	ZINC000330574539	410792436	/nfs/dbraw/zinc/79/24/36/410792436.db2.gz	POFNBKCZVTVQNH-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
COC(=O)c1cnc(NC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000302747397	410857379	/nfs/dbraw/zinc/85/73/79/410857379.db2.gz	GAVZRNVOLWPSLG-SNVBAGLBSA-N	1	1	308.338	1.530	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c1	ZINC000343995408	410876250	/nfs/dbraw/zinc/87/62/50/410876250.db2.gz	QISFDSGASFYJDQ-YOENINGUSA-N	1	1	322.361	1.037	20	5		DDBDMO
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC[NH+]1CCC1	ZINC000337621267	410902609	/nfs/dbraw/zinc/90/26/09/410902609.db2.gz	OSPRHTBGMRSZRW-NSHDSACASA-N	1	1	309.391	1.897	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000290970449	222037590	/nfs/dbraw/zinc/03/75/90/222037590.db2.gz	SXFBKXSPSVGPIY-GFCCVEGCSA-N	1	1	309.366	1.819	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]12	ZINC000368238174	418708875	/nfs/dbraw/zinc/70/88/75/418708875.db2.gz	BLLGAWVFIYEJSD-PWSUYJOCSA-N	1	1	309.753	1.816	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3Cl)CC[C@H]12	ZINC000368238174	418708878	/nfs/dbraw/zinc/70/88/78/418708878.db2.gz	BLLGAWVFIYEJSD-PWSUYJOCSA-N	1	1	309.753	1.816	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCOC1	ZINC000361587999	418687577	/nfs/dbraw/zinc/68/75/77/418687577.db2.gz	DBNGDFMBAXEBQE-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCOC1	ZINC000361587999	418687581	/nfs/dbraw/zinc/68/75/81/418687581.db2.gz	DBNGDFMBAXEBQE-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000408106102	418788822	/nfs/dbraw/zinc/78/88/22/418788822.db2.gz	XBISAYXQOTZOKR-VHSXEESVSA-N	1	1	317.349	1.772	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@]2(CCCCO2)C1	ZINC000364620491	418794810	/nfs/dbraw/zinc/79/48/10/418794810.db2.gz	TVUPZUQCDXLGGN-INIZCTEOSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[N@@H+]3CCOC[C@H]3C1)CCN2	ZINC000365544870	418874320	/nfs/dbraw/zinc/87/43/20/418874320.db2.gz	IJPJDSFDLITJKK-LLVKDONJSA-N	1	1	304.350	1.084	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1N1CC[N@H+]3CCOC[C@H]3C1)CCN2	ZINC000365544870	418874322	/nfs/dbraw/zinc/87/43/22/418874322.db2.gz	IJPJDSFDLITJKK-LLVKDONJSA-N	1	1	304.350	1.084	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCNC1=O	ZINC000411692355	419381654	/nfs/dbraw/zinc/38/16/54/419381654.db2.gz	JZVUSVAGNACHDM-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000412044204	419586276	/nfs/dbraw/zinc/58/62/76/419586276.db2.gz	WIVAFEZXICPFTG-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCC[N@@H+](C)[C@@H]1C	ZINC000427058710	419589517	/nfs/dbraw/zinc/58/95/17/419589517.db2.gz	FIPLTUINBOLBGI-MFKMUULPSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079256	419629441	/nfs/dbraw/zinc/62/94/41/419629441.db2.gz	LCOYBTLIODQPGN-OLZOCXBDSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000412079256	419629448	/nfs/dbraw/zinc/62/94/48/419629448.db2.gz	LCOYBTLIODQPGN-OLZOCXBDSA-N	1	1	321.377	1.650	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@H+](CC)C[C@@H]2C)n1	ZINC000427393466	419651630	/nfs/dbraw/zinc/65/16/30/419651630.db2.gz	ZZDSLKBDXISRBV-QWRGUYRKSA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@@H]2C)n1	ZINC000427393466	419651636	/nfs/dbraw/zinc/65/16/36/419651636.db2.gz	ZZDSLKBDXISRBV-QWRGUYRKSA-N	1	1	309.370	1.366	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000299263971	229015808	/nfs/dbraw/zinc/01/58/08/229015808.db2.gz	WMZWNTVRDGMPQO-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
C[C@@]12CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C[C@@H]1C2(F)F	ZINC000428736053	419922870	/nfs/dbraw/zinc/92/28/70/419922870.db2.gz	RQGYYOFJHXSQDJ-WCQYABFASA-N	1	1	313.304	1.734	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N(C1CC1)[C@@H]1CC[NH2+]C1	ZINC000435244260	229365906	/nfs/dbraw/zinc/36/59/06/229365906.db2.gz	CKYAVMRFGJEGPK-LLVKDONJSA-N	1	1	315.333	1.438	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000429881829	420056100	/nfs/dbraw/zinc/05/61/00/420056100.db2.gz	DMRUDBQORPFEMZ-LBPRGKRZSA-N	1	1	305.378	1.940	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1(CN)CCC1	ZINC000420325101	420210718	/nfs/dbraw/zinc/21/07/18/420210718.db2.gz	IAVIUVKRNWRKJV-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1(CN)CCC1	ZINC000420325101	420210724	/nfs/dbraw/zinc/21/07/24/420210724.db2.gz	IAVIUVKRNWRKJV-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)CN1CCOCC1	ZINC000434709119	420261317	/nfs/dbraw/zinc/26/13/17/420261317.db2.gz	FRKBWCINOMJVRJ-CYBMUJFWSA-N	1	1	323.393	1.756	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H](C)CN1CCOCC1	ZINC000434709119	420261322	/nfs/dbraw/zinc/26/13/22/420261322.db2.gz	FRKBWCINOMJVRJ-CYBMUJFWSA-N	1	1	323.393	1.756	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)nc2c1	ZINC000444689729	230121596	/nfs/dbraw/zinc/12/15/96/230121596.db2.gz	OQTYTQARUOFPNU-DRCTWCGVSA-N	1	1	302.334	1.674	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)nc2c1	ZINC000444689729	230121601	/nfs/dbraw/zinc/12/16/01/230121601.db2.gz	OQTYTQARUOFPNU-DRCTWCGVSA-N	1	1	302.334	1.674	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000454155782	420808249	/nfs/dbraw/zinc/80/82/49/420808249.db2.gz	XCDJSJUUHMQXQM-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc(NC(=O)N2CC[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000454155782	420808251	/nfs/dbraw/zinc/80/82/51/420808251.db2.gz	XCDJSJUUHMQXQM-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@H](O)[C@@H](CO)C3)o2)c1	ZINC000459694206	420849259	/nfs/dbraw/zinc/84/92/59/420849259.db2.gz	GDAOKEYKYPTNSD-DOMZBBRYSA-N	1	1	318.329	1.640	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000449697427	421061426	/nfs/dbraw/zinc/06/14/26/421061426.db2.gz	KWXHVWAKRHXNIT-GFCCVEGCSA-N	1	1	317.349	1.589	20	5		DDBDMO
CNc1nc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000455996174	421085995	/nfs/dbraw/zinc/08/59/95/421085995.db2.gz	OZMSABPLEXPVTN-ZWNOBZJWSA-N	1	1	319.365	1.198	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000488799334	421118404	/nfs/dbraw/zinc/11/84/04/421118404.db2.gz	KJQKZVIWGSCKEF-YPMHNXCESA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Cn1cc([N+](=O)[O-])nc1C	ZINC000456342926	421146186	/nfs/dbraw/zinc/14/61/86/421146186.db2.gz	GFBRLGPRYXDJKX-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCOCC[N@@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)C[C@H]1C	ZINC000450311680	421180519	/nfs/dbraw/zinc/18/05/19/421180519.db2.gz	IXYXKWABQIHZCK-LLVKDONJSA-N	1	1	309.370	1.240	20	5		DDBDMO
CCOCC[N@H+]1CCN(c2ncc([N+](=O)[O-])c(C)n2)C[C@H]1C	ZINC000450311680	421180521	/nfs/dbraw/zinc/18/05/21/421180521.db2.gz	IXYXKWABQIHZCK-LLVKDONJSA-N	1	1	309.370	1.240	20	5		DDBDMO
Cc1nc(N2CC[N@H+]([C@@H]3C[C@H]3C)C[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450539287	421207496	/nfs/dbraw/zinc/20/74/96/421207496.db2.gz	JMAMGXCROZNZDX-NQBHXWOUSA-N	1	1	305.382	1.860	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1C(F)F	ZINC000563530336	421518521	/nfs/dbraw/zinc/51/85/21/421518521.db2.gz	OXQFHDRSPGEQCR-JTQLQIEISA-N	1	1	315.276	1.283	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000563396122	421501894	/nfs/dbraw/zinc/50/18/94/421501894.db2.gz	VCABHULQHQWGSK-NSHDSACASA-N	1	1	323.397	1.882	20	5		DDBDMO
CN1C(=O)C[C@@H]([N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010348	421588437	/nfs/dbraw/zinc/58/84/37/421588437.db2.gz	JOZYWROWBHFUFA-TZMCWYRMSA-N	1	1	317.345	1.532	20	5		DDBDMO
CN1C(=O)C[C@@H]([N@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000517010348	421588438	/nfs/dbraw/zinc/58/84/38/421588438.db2.gz	JOZYWROWBHFUFA-TZMCWYRMSA-N	1	1	317.345	1.532	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1cccc(O)c1	ZINC000536377848	421717699	/nfs/dbraw/zinc/71/76/99/421717699.db2.gz	GYLFPDNENQKKSL-UHFFFAOYSA-N	1	1	303.318	1.594	20	5		DDBDMO
CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000556806916	421739858	/nfs/dbraw/zinc/73/98/58/421739858.db2.gz	MFFPTKUTXOTPBR-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000556806916	421739860	/nfs/dbraw/zinc/73/98/60/421739860.db2.gz	MFFPTKUTXOTPBR-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000537814635	421735877	/nfs/dbraw/zinc/73/58/77/421735877.db2.gz	FXYBWTMIMGMJGL-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000537814635	421735880	/nfs/dbraw/zinc/73/58/80/421735880.db2.gz	FXYBWTMIMGMJGL-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C1	ZINC000542652055	421826362	/nfs/dbraw/zinc/82/63/62/421826362.db2.gz	UXGAFUVQZIOMTL-LLVKDONJSA-N	1	1	323.397	1.903	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000592201828	422330140	/nfs/dbraw/zinc/33/01/40/422330140.db2.gz	WDTKQPMHNPKIDS-IJLUTSLNSA-N	1	1	308.334	1.512	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000597860961	422391916	/nfs/dbraw/zinc/39/19/16/422391916.db2.gz	QJOFBPKBEAYUJV-SECBINFHSA-N	1	1	307.354	1.175	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)C(C)(C)C	ZINC000578503620	422583002	/nfs/dbraw/zinc/58/30/02/422583002.db2.gz	BMOCHXFNLRIPFF-UHFFFAOYSA-N	1	1	309.322	1.992	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000341847523	271221426	/nfs/dbraw/zinc/22/14/26/271221426.db2.gz	XYORYLQZPCGIJR-SNVBAGLBSA-N	1	1	320.349	1.733	20	5		DDBDMO
COc1ccc(CN[C@@H](C2CC2)[C@@H]2C[NH2+]CCO2)cc1[N+](=O)[O-]	ZINC000422936393	533688360	/nfs/dbraw/zinc/68/83/60/533688360.db2.gz	BNIXBNRPQNYNGA-HOTGVXAUSA-N	1	1	321.377	1.460	20	5		DDBDMO
CC[N@@H+]1C[C@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964279	272376940	/nfs/dbraw/zinc/37/69/40/272376940.db2.gz	QGPUQGUHNXXJDB-MNOVXSKESA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964279	272376943	/nfs/dbraw/zinc/37/69/43/272376943.db2.gz	QGPUQGUHNXXJDB-MNOVXSKESA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1C[C@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964279	272376947	/nfs/dbraw/zinc/37/69/47/272376947.db2.gz	QGPUQGUHNXXJDB-MNOVXSKESA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@H]1C	ZINC000345964279	272376950	/nfs/dbraw/zinc/37/69/50/272376950.db2.gz	QGPUQGUHNXXJDB-MNOVXSKESA-N	1	1	323.397	1.996	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[NH+](C(C)C)CC2)n1	ZINC000280937188	274004309	/nfs/dbraw/zinc/00/43/09/274004309.db2.gz	IAPTZTDYLKNOJP-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[NH+](C)C[C@H]1C	ZINC000127272871	281269867	/nfs/dbraw/zinc/26/98/67/281269867.db2.gz	MEPPICMXHSDOKR-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290732642	290244386	/nfs/dbraw/zinc/24/43/86/290244386.db2.gz	GCQVBDUUNXUHKH-PWSUYJOCSA-N	1	1	319.365	1.009	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C1	ZINC000358062406	299061628	/nfs/dbraw/zinc/06/16/28/299061628.db2.gz	HTVXAXXVGZNKIE-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
COc1ccc(CNC(=O)[C@H]2C[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000362588268	300102854	/nfs/dbraw/zinc/10/28/54/300102854.db2.gz	KHXCRGXFWCFQNU-JQWIXIFHSA-N	1	1	307.350	1.417	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000362931670	300181452	/nfs/dbraw/zinc/18/14/52/300181452.db2.gz	RWJLHNYEROKIGY-IAQYHMDHSA-N	1	1	303.362	1.677	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)cccc1[N+](=O)[O-]	ZINC000363689697	300296173	/nfs/dbraw/zinc/29/61/73/300296173.db2.gz	GWNPRVCFQTYLCF-OLZOCXBDSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC000363699845	300298116	/nfs/dbraw/zinc/29/81/16/300298116.db2.gz	IZHDTXBHLAMCFQ-LBPRGKRZSA-N	1	1	305.334	1.611	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000364433728	300396440	/nfs/dbraw/zinc/39/64/40/300396440.db2.gz	VLOSITAVPPYYMG-LSDHHAIUSA-N	1	1	319.361	1.266	20	5		DDBDMO
C[C@@H](c1cnccn1)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422063	301024825	/nfs/dbraw/zinc/02/48/25/301024825.db2.gz	KGZPAKLKQORXRQ-NWDGAFQWSA-N	1	1	302.338	1.979	20	5		DDBDMO
C[C@@H](c1cnccn1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422063	301024829	/nfs/dbraw/zinc/02/48/29/301024829.db2.gz	KGZPAKLKQORXRQ-NWDGAFQWSA-N	1	1	302.338	1.979	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@H]21	ZINC000368596850	301061935	/nfs/dbraw/zinc/06/19/35/301061935.db2.gz	WFOKGLZMQIUMCF-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC[C@@H]21	ZINC000369981749	301251284	/nfs/dbraw/zinc/25/12/84/301251284.db2.gz	CYMBKKKSLFGHQJ-MFKMUULPSA-N	1	1	319.365	1.128	20	5		DDBDMO
O=C(NCc1c[nH+]c2n1CCCC2)c1ccc([N+](=O)[O-])cn1	ZINC000370261698	301304185	/nfs/dbraw/zinc/30/41/85/301304185.db2.gz	NQCGUFRXCMXIKD-UHFFFAOYSA-N	1	1	301.306	1.453	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@H]3CCCCCC[C@H]32)c1	ZINC000375852253	302004988	/nfs/dbraw/zinc/00/49/88/302004988.db2.gz	WLCXRYGDGQNBPW-BPLDGKMQSA-N	1	1	308.382	1.807	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CC[C@H]2C(=O)NC(=O)[C@H]2C1	ZINC000366304611	307070413	/nfs/dbraw/zinc/07/04/13/307070413.db2.gz	ANBYSSWQTDZQJO-SUHUHFCYSA-N	1	1	317.345	1.559	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000366630832	307077886	/nfs/dbraw/zinc/07/78/86/307077886.db2.gz	HLNCXLJEUMTGJN-OAHLLOKOSA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]1COCC2	ZINC000369542153	307123047	/nfs/dbraw/zinc/12/30/47/307123047.db2.gz	RRWUGKMGWBOVGW-XJKSGUPXSA-N	1	1	320.345	1.606	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000370886710	307139079	/nfs/dbraw/zinc/13/90/79/307139079.db2.gz	QKRPFBLTDWWPQJ-JTQLQIEISA-N	1	1	307.354	1.191	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000370886710	307139080	/nfs/dbraw/zinc/13/90/80/307139080.db2.gz	QKRPFBLTDWWPQJ-JTQLQIEISA-N	1	1	307.354	1.191	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000370886710	307139081	/nfs/dbraw/zinc/13/90/81/307139081.db2.gz	QKRPFBLTDWWPQJ-JTQLQIEISA-N	1	1	307.354	1.191	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NCc1c[nH+]c2n1CCCC2	ZINC000375300490	307221095	/nfs/dbraw/zinc/22/10/95/307221095.db2.gz	BBUSPVYQFAPTPM-UHFFFAOYSA-N	1	1	314.345	1.987	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000421021023	307300497	/nfs/dbraw/zinc/30/04/97/307300497.db2.gz	NVWXYBAYCGTULF-VXGBXAGGSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000570780247	308179433	/nfs/dbraw/zinc/17/94/33/308179433.db2.gz	NAJRSLZYSBVGRY-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC(C)O[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000570926353	308185924	/nfs/dbraw/zinc/18/59/24/308185924.db2.gz	WCOBEQBLAIYVCG-GOEBONIOSA-N	1	1	324.377	1.834	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CN[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168850	308264009	/nfs/dbraw/zinc/26/40/09/308264009.db2.gz	KUTFCXRCVTYYPU-WFASDCNBSA-N	1	1	311.382	1.185	20	5		DDBDMO
COCCN(C)C[C@@H](O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000574168850	308264010	/nfs/dbraw/zinc/26/40/10/308264010.db2.gz	KUTFCXRCVTYYPU-WFASDCNBSA-N	1	1	311.382	1.185	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000583892211	337384068	/nfs/dbraw/zinc/38/40/68/337384068.db2.gz	ZIFGKSKNRJFWGB-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000331908278	534250035	/nfs/dbraw/zinc/25/00/35/534250035.db2.gz	ALQZSRQGYVHPQL-VHSXEESVSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000331908278	534250040	/nfs/dbraw/zinc/25/00/40/534250040.db2.gz	ALQZSRQGYVHPQL-VHSXEESVSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000158198653	521612653	/nfs/dbraw/zinc/61/26/53/521612653.db2.gz	PUQWPKFCVMMZAB-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC1CCOCC1	ZINC000338375431	522946612	/nfs/dbraw/zinc/94/66/12/522946612.db2.gz	GDDHLLGFICRFAQ-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)NC1CCOCC1	ZINC000338375431	522946619	/nfs/dbraw/zinc/94/66/19/522946619.db2.gz	GDDHLLGFICRFAQ-UHFFFAOYSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1C[N@H+](C)CCO1	ZINC000154777671	525730562	/nfs/dbraw/zinc/73/05/62/525730562.db2.gz	SFYBMKYSJITJPQ-LDYMZIIASA-N	1	1	300.746	1.774	20	5		DDBDMO
C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1C[N@@H+](C)CCO1	ZINC000154777671	525730572	/nfs/dbraw/zinc/73/05/72/525730572.db2.gz	SFYBMKYSJITJPQ-LDYMZIIASA-N	1	1	300.746	1.774	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@]1(C)CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000459575334	526514550	/nfs/dbraw/zinc/51/45/50/526514550.db2.gz	FJAAWLOTPGMXLO-HNNXBMFYSA-N	1	1	324.381	1.845	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000299517422	528809333	/nfs/dbraw/zinc/80/93/33/528809333.db2.gz	XBGPPGBZCPRYEU-UHFFFAOYSA-N	1	1	320.393	1.584	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1c1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000824994183	608554941	/nfs/dbraw/zinc/55/49/41/608554941.db2.gz	UBYRWGVADQRACN-VHSXEESVSA-N	1	1	317.353	1.304	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000078231710	696448518	/nfs/dbraw/zinc/44/85/18/696448518.db2.gz	OTXCSKKCCUKYJX-LLVKDONJSA-N	1	1	322.321	1.717	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000748350066	700112381	/nfs/dbraw/zinc/11/23/81/700112381.db2.gz	NJFYHHMKNLRXBR-LLVKDONJSA-N	1	1	317.349	1.107	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000748350066	700112383	/nfs/dbraw/zinc/11/23/83/700112383.db2.gz	NJFYHHMKNLRXBR-LLVKDONJSA-N	1	1	317.349	1.107	20	5		DDBDMO
NC(=O)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CCCC1	ZINC000776581544	698120972	/nfs/dbraw/zinc/12/09/72/698120972.db2.gz	JRXZQWUDTBNCMZ-CQSZACIVSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@H]1CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1CCO	ZINC000777494324	698195614	/nfs/dbraw/zinc/19/56/14/698195614.db2.gz	GCKZRFHVWLNVDT-LLVKDONJSA-N	1	1	324.406	1.290	20	5		DDBDMO
C[C@@H]1CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000777494324	698195615	/nfs/dbraw/zinc/19/56/15/698195615.db2.gz	GCKZRFHVWLNVDT-LLVKDONJSA-N	1	1	324.406	1.290	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)[N@H+](C)C1	ZINC000452182672	699185752	/nfs/dbraw/zinc/18/57/52/699185752.db2.gz	IGNAKWAWHLDOFR-BPNCWPANSA-N	1	1	307.350	1.491	20	5		DDBDMO
CO[C@H]1C[C@@H](C(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)[N@@H+](C)C1	ZINC000452182672	699185753	/nfs/dbraw/zinc/18/57/53/699185753.db2.gz	IGNAKWAWHLDOFR-BPNCWPANSA-N	1	1	307.350	1.491	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C[C@H](CO)[C@H](CO)C2)ccc1Cl	ZINC000704788664	699238116	/nfs/dbraw/zinc/23/81/16/699238116.db2.gz	QXZUHMMOOWFMOL-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@H](CO)[C@H](CO)C2)ccc1Cl	ZINC000704788664	699238119	/nfs/dbraw/zinc/23/81/19/699238119.db2.gz	QXZUHMMOOWFMOL-PHIMTYICSA-N	1	1	300.742	1.281	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cn3ncc4cc([N+](=O)[O-])ccc43)C2)CN1	ZINC000788385349	699310505	/nfs/dbraw/zinc/31/05/05/699310505.db2.gz	YZLDFMJUXSNOPB-OAHLLOKOSA-N	1	1	315.333	1.114	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1nnnn1C1CC1	ZINC000790533071	699465514	/nfs/dbraw/zinc/46/55/14/699465514.db2.gz	JLZRTUIPDDUMDO-NOZJJQNGSA-N	1	1	318.337	1.300	20	5		DDBDMO
Nc1ccc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-]	ZINC000731018845	699520957	/nfs/dbraw/zinc/52/09/57/699520957.db2.gz	AWBWQIJAQSWFAQ-GFCCVEGCSA-N	1	1	304.350	1.391	20	5		DDBDMO
C[NH+]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])CC1	ZINC000791121124	699612169	/nfs/dbraw/zinc/61/21/69/699612169.db2.gz	IPZDZCABHMPFDS-UHFFFAOYSA-N	1	1	315.732	1.704	20	5		DDBDMO
COCCC[N@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000742146629	699861723	/nfs/dbraw/zinc/86/17/23/699861723.db2.gz	JHBWSCMFNUKICA-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
COCCC[N@@H+](C)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000742146629	699861725	/nfs/dbraw/zinc/86/17/25/699861725.db2.gz	JHBWSCMFNUKICA-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000742239462	699868876	/nfs/dbraw/zinc/86/88/76/699868876.db2.gz	NDZVPLKILFQDNT-SNVBAGLBSA-N	1	1	317.349	1.685	20	5		DDBDMO
NC(CC1CC1)=[NH+]OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000742365505	699875876	/nfs/dbraw/zinc/87/58/76/699875876.db2.gz	VTASGUVIVRNEFS-UHFFFAOYSA-N	1	1	318.333	1.782	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@]3(CCCOC3)C2)cc1	ZINC000796081346	699911018	/nfs/dbraw/zinc/91/10/18/699911018.db2.gz	TUNPYINNYUAFOV-JKSUJKDBSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@]3(CCCOC3)C2)cc1	ZINC000796081346	699911019	/nfs/dbraw/zinc/91/10/19/699911019.db2.gz	TUNPYINNYUAFOV-JKSUJKDBSA-N	1	1	322.361	1.510	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000762715297	700904189	/nfs/dbraw/zinc/90/41/89/700904189.db2.gz	BCVCMXSAFDSHKQ-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
COCCOCC[N@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000808236724	701510277	/nfs/dbraw/zinc/51/02/77/701510277.db2.gz	KYUGHTIQDWHXDP-UHFFFAOYSA-N	1	1	323.353	1.200	20	5		DDBDMO
COCCOCC[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000808236724	701510279	/nfs/dbraw/zinc/51/02/79/701510279.db2.gz	KYUGHTIQDWHXDP-UHFFFAOYSA-N	1	1	323.353	1.200	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839689950	701784930	/nfs/dbraw/zinc/78/49/30/701784930.db2.gz	BFFUIIZGLKHCMK-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839689950	701784934	/nfs/dbraw/zinc/78/49/34/701784934.db2.gz	BFFUIIZGLKHCMK-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839689950	701784938	/nfs/dbraw/zinc/78/49/38/701784938.db2.gz	BFFUIIZGLKHCMK-NUEKZKHPSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[C@@H](C)C[N@H+]1Cc1ccccc1	ZINC000839718433	701795870	/nfs/dbraw/zinc/79/58/70/701795870.db2.gz	POWFVVJUBHXFIP-OCVGTWLNSA-N	1	1	317.389	1.773	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[C@@H]2[C@H](CC[N@@H+]2C)C1	ZINC000879214395	706616757	/nfs/dbraw/zinc/61/67/57/706616757.db2.gz	QSVROAPUFFUICX-VXGBXAGGSA-N	1	1	319.365	1.278	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000812330340	702154983	/nfs/dbraw/zinc/15/49/83/702154983.db2.gz	BLGXZXDQXFDRNE-OLZOCXBDSA-N	1	1	319.361	1.384	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)CC[C@H]21	ZINC000866208677	706649220	/nfs/dbraw/zinc/64/92/20/706649220.db2.gz	KJNKXKOGPUMAFU-GXFFZTMASA-N	1	1	304.350	1.224	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1	ZINC000866210128	706649766	/nfs/dbraw/zinc/64/97/66/706649766.db2.gz	YFGYRTVUFHDXIL-STQMWFEESA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H](CN)C1CC1	ZINC000843386340	702871152	/nfs/dbraw/zinc/87/11/52/702871152.db2.gz	HFKYPGYFSSCQDQ-AWEZNQCLSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H](CN)C1CC1	ZINC000843386340	702871155	/nfs/dbraw/zinc/87/11/55/702871155.db2.gz	HFKYPGYFSSCQDQ-AWEZNQCLSA-N	1	1	324.356	1.732	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000846047713	703230718	/nfs/dbraw/zinc/23/07/18/703230718.db2.gz	QEQSDXJFSWPSTJ-WDEREUQCSA-N	1	1	300.742	1.830	20	5		DDBDMO
COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000846047713	703230719	/nfs/dbraw/zinc/23/07/19/703230719.db2.gz	QEQSDXJFSWPSTJ-WDEREUQCSA-N	1	1	300.742	1.830	20	5		DDBDMO
CC1(C)OC[C@@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)O1	ZINC000851717436	703836218	/nfs/dbraw/zinc/83/62/18/703836218.db2.gz	SFQASUDJUYKCRA-CYBMUJFWSA-N	1	1	322.365	1.263	20	5		DDBDMO
COCC[N@@H+](CCF)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000852481965	704058606	/nfs/dbraw/zinc/05/86/06/704058606.db2.gz	AJOMPCWCWQGXJM-UHFFFAOYSA-N	1	1	313.329	1.841	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000852710030	704103780	/nfs/dbraw/zinc/10/37/80/704103780.db2.gz	HZLQNZGOBIKNOA-OAHLLOKOSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c1	ZINC000853586440	704276448	/nfs/dbraw/zinc/27/64/48/704276448.db2.gz	RMQXRUCMLFGDFL-YPMHNXCESA-N	1	1	302.334	1.870	20	5		DDBDMO
O=C1CC[C@H](C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)O1	ZINC000821354874	704395806	/nfs/dbraw/zinc/39/58/06/704395806.db2.gz	LACXBCMCUHWBCU-CQSZACIVSA-N	1	1	305.334	1.422	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)CC1(O)CCC1)C2	ZINC000859208957	704821944	/nfs/dbraw/zinc/82/19/44/704821944.db2.gz	VABIJGZKLLMEAX-ZDUSSCGKSA-N	1	1	306.362	1.619	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)CC1(O)CCC1)C2	ZINC000859208957	704821951	/nfs/dbraw/zinc/82/19/51/704821951.db2.gz	VABIJGZKLLMEAX-ZDUSSCGKSA-N	1	1	306.362	1.619	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842041	705196975	/nfs/dbraw/zinc/19/69/75/705196975.db2.gz	ZNFYMKGSWSYDER-WDEREUQCSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874842041	705196977	/nfs/dbraw/zinc/19/69/77/705196977.db2.gz	ZNFYMKGSWSYDER-WDEREUQCSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874842041	705196978	/nfs/dbraw/zinc/19/69/78/705196978.db2.gz	ZNFYMKGSWSYDER-WDEREUQCSA-N	1	1	307.354	1.189	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000825682718	705713836	/nfs/dbraw/zinc/71/38/36/705713836.db2.gz	BHPMLWLCTXRDFF-CQSZACIVSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825777196	705729469	/nfs/dbraw/zinc/72/94/69/705729469.db2.gz	RFSZPCQOXBVXDG-BXUZGUMPSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825830354	705735144	/nfs/dbraw/zinc/73/51/44/705735144.db2.gz	KNQHOVDEIUKUMP-LSDHHAIUSA-N	1	1	321.377	1.619	20	5		DDBDMO
CCN1CCC[C@@H](C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C1	ZINC000876989400	705950159	/nfs/dbraw/zinc/95/01/59/705950159.db2.gz	XZAWGYNAPMGDJC-HSBZDZAISA-N	1	1	307.398	1.816	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)cccc1[N+](=O)[O-]	ZINC000827264788	705963294	/nfs/dbraw/zinc/96/32/94/705963294.db2.gz	DOTUQMFNNVMITF-YPMHNXCESA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827374769	705988879	/nfs/dbraw/zinc/98/88/79/705988879.db2.gz	PUIPHAFKSICHDQ-STQMWFEESA-N	1	1	319.361	1.526	20	5		DDBDMO
COc1ccc(C[NH+]2CCC(CO)(CO)CC2)cc1[N+](=O)[O-]	ZINC000877797614	706218712	/nfs/dbraw/zinc/21/87/12/706218712.db2.gz	MITGAXMARBMXEV-UHFFFAOYSA-N	1	1	310.350	1.170	20	5		DDBDMO
C[N@H+]1CC[C@H]1CN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000877875788	706230731	/nfs/dbraw/zinc/23/07/31/706230731.db2.gz	RQLYKLFSRBTRLW-SWLSCSKDSA-N	1	1	318.333	1.066	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCO[C@@]3(CCSC3)C2)cc1	ZINC000829261954	706311013	/nfs/dbraw/zinc/31/10/13/706311013.db2.gz	QRXDTIZWXNGNJY-GJZGRUSLSA-N	1	1	324.402	1.836	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCO[C@@]3(CCSC3)C2)cc1	ZINC000829261954	706311015	/nfs/dbraw/zinc/31/10/15/706311015.db2.gz	QRXDTIZWXNGNJY-GJZGRUSLSA-N	1	1	324.402	1.836	20	5		DDBDMO
CO[C@@H]1COCC[C@@H]1[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000880434020	706975309	/nfs/dbraw/zinc/97/53/09/706975309.db2.gz	VOMMNTDVPXIFIM-RRFJBIMHSA-N	1	1	310.350	1.364	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000835158557	707185240	/nfs/dbraw/zinc/18/52/40/707185240.db2.gz	HXYIFZXVUJOUEI-CYBMUJFWSA-N	1	1	316.398	1.722	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000882480313	707650531	/nfs/dbraw/zinc/65/05/31/707650531.db2.gz	PWFVRBAXXPUEMC-SNVBAGLBSA-N	1	1	321.333	1.190	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCc1cc([N+](=O)[O-])ccc1OC	ZINC000883167697	707945553	/nfs/dbraw/zinc/94/55/53/707945553.db2.gz	FPMWESZPAHYUEF-CYBMUJFWSA-N	1	1	322.365	1.497	20	5		DDBDMO
O=C(NC[C@H](c1ccccc1)[NH+]1CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839463373	708049333	/nfs/dbraw/zinc/04/93/33/708049333.db2.gz	OKRPWTBLJHUPAR-RBSFLKMASA-N	1	1	303.362	1.605	20	5		DDBDMO
Cc1nc(N2CC[C@@H]3[C@@H]2CCC[N@H+]3CCO)ccc1[N+](=O)[O-]	ZINC000897221120	708258711	/nfs/dbraw/zinc/25/87/11/708258711.db2.gz	HLOXKMMTJRIJSF-KGLIPLIRSA-N	1	1	306.366	1.334	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000897683208	708418752	/nfs/dbraw/zinc/41/87/52/708418752.db2.gz	ATSMIWYWIBSXOU-IAQYHMDHSA-N	1	1	316.361	1.808	20	5		DDBDMO
C[C@H]1CN(Cc2cccnc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000886160427	708707789	/nfs/dbraw/zinc/70/77/89/708707789.db2.gz	SVLJNRVOFCZLAZ-LBPRGKRZSA-N	1	1	308.382	1.267	20	5		DDBDMO
CC(C)(CCC(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)[N+](=O)[O-]	ZINC000928084741	713122347	/nfs/dbraw/zinc/12/23/47/713122347.db2.gz	XPRKLSFGLPZEPD-RYUDHWBXSA-N	1	1	315.439	1.518	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000910286366	709867100	/nfs/dbraw/zinc/86/71/00/709867100.db2.gz	GPTVXIKTWPKVDJ-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000910286366	709867104	/nfs/dbraw/zinc/86/71/04/709867104.db2.gz	GPTVXIKTWPKVDJ-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000910286366	709867106	/nfs/dbraw/zinc/86/71/06/709867106.db2.gz	GPTVXIKTWPKVDJ-SNVBAGLBSA-N	1	1	309.370	1.437	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CCC([N@@H+](C)CCCO)CC1	ZINC000892560326	710458446	/nfs/dbraw/zinc/45/84/46/710458446.db2.gz	GOZDEJAIQXPMQT-UHFFFAOYSA-N	1	1	324.381	1.281	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000928448990	713201557	/nfs/dbraw/zinc/20/15/57/713201557.db2.gz	DGOWJJVFLKARCK-SCZZXKLOSA-N	1	1	307.306	1.146	20	5		DDBDMO
CC1(C)[C@@H](NC(=O)c2ccc([N+](=O)[O-])o2)C[C@@H]1[NH+]1CCOCC1	ZINC000911837029	711023749	/nfs/dbraw/zinc/02/37/49/711023749.db2.gz	BTWMRJDQWWSYAD-RYUDHWBXSA-N	1	1	323.349	1.417	20	5		DDBDMO
CC1(C)[C@H]([NH+]2CCOCC2)C[C@@H]1NC(=O)c1ccc([N+](=O)[O-])o1	ZINC000911837028	711023943	/nfs/dbraw/zinc/02/39/43/711023943.db2.gz	BTWMRJDQWWSYAD-NWDGAFQWSA-N	1	1	323.349	1.417	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2CC[C@H](n3cccn3)C2)c1[N+](=O)[O-]	ZINC000894569437	711185638	/nfs/dbraw/zinc/18/56/38/711185638.db2.gz	VMEJAVXLURQNLX-LBPRGKRZSA-N	1	1	318.333	1.953	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](n3cccn3)C2)c1[N+](=O)[O-]	ZINC000894569437	711185643	/nfs/dbraw/zinc/18/56/43/711185643.db2.gz	VMEJAVXLURQNLX-LBPRGKRZSA-N	1	1	318.333	1.953	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H](C)C[C@H](CO)C2)c1[N+](=O)[O-]	ZINC000894973825	711346397	/nfs/dbraw/zinc/34/63/97/711346397.db2.gz	BECKRDUSKGUBBT-MNOVXSKESA-N	1	1	310.350	1.759	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c1[N+](=O)[O-]	ZINC000895386248	711500144	/nfs/dbraw/zinc/50/01/44/711500144.db2.gz	PIUCGUBEOSRVSC-IAQYHMDHSA-N	1	1	308.334	1.777	20	5		DDBDMO
CCN1CCC[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O	ZINC000895899323	711641091	/nfs/dbraw/zinc/64/10/91/711641091.db2.gz	LPBBCXJSIXXUGG-OAHLLOKOSA-N	1	1	314.345	1.988	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NCCO[C@@H]3CCOC3)c2c1	ZINC000896472530	711730463	/nfs/dbraw/zinc/73/04/63/711730463.db2.gz	BBLBMPBEIFFBCQ-GFCCVEGCSA-N	1	1	303.318	1.782	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH2+][C@H]2CNOC2)ccc1N1CCCCC1	ZINC000904425453	711856399	/nfs/dbraw/zinc/85/63/99/711856399.db2.gz	MULPJRQIEVQZFS-ZDUSSCGKSA-N	1	1	306.366	1.578	20	5		DDBDMO
O=C1[C@H]([NH2+]CC[N+](=O)[O-])CCCN1Cc1ccc(F)cc1F	ZINC000905229260	711975001	/nfs/dbraw/zinc/97/50/01/711975001.db2.gz	LTXNXPPUBDCHSR-CYBMUJFWSA-N	1	1	313.304	1.322	20	5		DDBDMO
CC1(C)CC[N@H+](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000905678289	712115305	/nfs/dbraw/zinc/11/53/05/712115305.db2.gz	KEAUMOCPRVREJG-HNNXBMFYSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000905678289	712115307	/nfs/dbraw/zinc/11/53/07/712115307.db2.gz	KEAUMOCPRVREJG-HNNXBMFYSA-N	1	1	307.394	1.950	20	5		DDBDMO
CC[NH+]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)CC1	ZINC000929110713	713548600	/nfs/dbraw/zinc/54/86/00/713548600.db2.gz	FUTJHLCMZUGKHH-LSDHHAIUSA-N	1	1	303.362	1.862	20	5		DDBDMO
COC(=O)/C=C(\C)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989015	713729907	/nfs/dbraw/zinc/72/99/07/713729907.db2.gz	POUJFPYDXUQZKY-YTRUQHMWSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C=C(\C)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000929989015	713729909	/nfs/dbraw/zinc/72/99/09/713729909.db2.gz	POUJFPYDXUQZKY-YTRUQHMWSA-N	1	1	320.349	1.595	20	5		DDBDMO
CC1CCN(C(=O)OC[C@@H]2CCCC[N@@H+]2CC[N+](=O)[O-])CC1	ZINC000930468079	713842363	/nfs/dbraw/zinc/84/23/63/713842363.db2.gz	WJPBJKLOJCWIRO-AWEZNQCLSA-N	1	1	313.398	1.986	20	5		DDBDMO
CC1CCN(C(=O)OC[C@@H]2CCCC[N@H+]2CC[N+](=O)[O-])CC1	ZINC000930468079	713842365	/nfs/dbraw/zinc/84/23/65/713842365.db2.gz	WJPBJKLOJCWIRO-AWEZNQCLSA-N	1	1	313.398	1.986	20	5		DDBDMO
C[C@@H]1CC[N@H+](CC[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000931024543	713985048	/nfs/dbraw/zinc/98/50/48/713985048.db2.gz	KWVDHXBWZHFPFW-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC[N+](=O)[O-])[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000931024543	713985049	/nfs/dbraw/zinc/98/50/49/713985049.db2.gz	KWVDHXBWZHFPFW-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
COc1cc(C[NH2+][C@H](C)C(OC)OC)c([N+](=O)[O-])cc1OC	ZINC000922311598	714017838	/nfs/dbraw/zinc/01/78/38/714017838.db2.gz	INTJEINOHWPCIN-SECBINFHSA-N	1	1	314.338	1.709	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)Cc2c[nH]nc21	ZINC000931459974	714102720	/nfs/dbraw/zinc/10/27/20/714102720.db2.gz	CPFNJDDRWVUTRU-YGRLFVJLSA-N	1	1	302.334	1.971	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000923312880	714308080	/nfs/dbraw/zinc/30/80/80/714308080.db2.gz	MMYONLCYFOYMMV-UONOGXRCSA-N	1	1	303.362	1.832	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2C[C@H](C3CC3)C[C@@H]2C2CC2)c1	ZINC000932892607	714431936	/nfs/dbraw/zinc/43/19/36/714431936.db2.gz	GLWLVFRKILCELN-VNQPRFMTSA-N	1	1	320.393	1.663	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115522	714745240	/nfs/dbraw/zinc/74/52/40/714745240.db2.gz	ATJKKNOKBRBEEN-HIFRSBDPSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000934115522	714745241	/nfs/dbraw/zinc/74/52/41/714745241.db2.gz	ATJKKNOKBRBEEN-HIFRSBDPSA-N	1	1	319.361	1.593	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000925317519	714807022	/nfs/dbraw/zinc/80/70/22/714807022.db2.gz	MCKAOCIKYMURRK-DGCLKSJQSA-N	1	1	306.366	1.829	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000935942630	715139328	/nfs/dbraw/zinc/13/93/28/715139328.db2.gz	QRQJRKWUFRBWCW-FUNVUKJBSA-N	1	1	321.381	1.183	20	5		DDBDMO
CN(C)CC[N@@H+]1CC[C@H]2[C@@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932529	721853772	/nfs/dbraw/zinc/85/37/72/721853772.db2.gz	YQVAGGKZVBCUMK-STQMWFEESA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(C)CC[N@H+]1CC[C@H]2[C@@H]1CCN2c1cccc([N+](=O)[O-])n1	ZINC001164932529	721853773	/nfs/dbraw/zinc/85/37/73/721853773.db2.gz	YQVAGGKZVBCUMK-STQMWFEESA-N	1	1	305.382	1.204	20	5		DDBDMO
CN(CCNC(=O)C[N@@H+](C)C1CCC1)c1ccc([N+](=O)[O-])cn1	ZINC001100386632	732305336	/nfs/dbraw/zinc/30/53/36/732305336.db2.gz	METMRJMYLMZWLD-UHFFFAOYSA-N	1	1	321.381	1.027	20	5		DDBDMO
C[C@@H](Nc1c2c(ccc1[N+](=O)[O-])NCC2)[C@@H]1C[N@@H+](C)CCN1C	ZINC001120960719	782258382	/nfs/dbraw/zinc/25/83/82/782258382.db2.gz	WTKRFGWXGPFIAZ-ABAIWWIYSA-N	1	1	319.409	1.609	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2CN(CC=C(Cl)Cl)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025776605	736853099	/nfs/dbraw/zinc/85/30/99/736853099.db2.gz	CIPRRKUVTHPSOF-DZEUPHNYSA-N	1	1	320.176	1.017	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1C[C@@H]2C[N@H+](C)CC[C@@H]2C1	ZINC001196790816	746963503	/nfs/dbraw/zinc/96/35/03/746963503.db2.gz	YTYUUFXSIZCLGM-OCCSQVGLSA-N	1	1	305.378	1.987	20	5		DDBDMO
O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCOCCO	ZINC001198943013	747656368	/nfs/dbraw/zinc/65/63/68/747656368.db2.gz	OLKHJKWTRPBTIL-UHFFFAOYSA-N	1	1	319.155	1.456	20	5		DDBDMO
COc1cc(NCC2(N(C)C)CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC001156181856	761935580	/nfs/dbraw/zinc/93/55/80/761935580.db2.gz	GRGABIOKVIQNNG-UHFFFAOYSA-N	1	1	323.397	1.436	20	5		DDBDMO
Cc1nocc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001034642888	750624632	/nfs/dbraw/zinc/62/46/32/750624632.db2.gz	HFZBRGXVBHZXLL-AAVRWANBSA-N	1	1	322.365	1.165	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)Cc2cnn(C)c21	ZINC001169018949	762199130	/nfs/dbraw/zinc/19/91/30/762199130.db2.gz	FROZHUPOLHAYDY-QEJZJMRPSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCOCc1ncn2c1C[N@@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169025767	762203466	/nfs/dbraw/zinc/20/34/66/762203466.db2.gz	UVKOYHBALNIAKV-QWHCGFSZSA-N	1	1	308.382	1.681	20	5		DDBDMO
CCOCc1ncn2c1C[N@H+]([C@@H]1CC[C@H](C[N+](=O)[O-])C1)CC2	ZINC001169025767	762203472	/nfs/dbraw/zinc/20/34/72/762203472.db2.gz	UVKOYHBALNIAKV-QWHCGFSZSA-N	1	1	308.382	1.681	20	5		DDBDMO
COc1ccc(C[C@@H](C)n2[nH]c(=O)nc2C[NH3+])c([N+](=O)[O-])c1	ZINC001170305833	766231435	/nfs/dbraw/zinc/23/14/35/766231435.db2.gz	QLNYXLUWMOQXIS-MRVPVSSYSA-N	1	1	307.310	1.163	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+](C)CC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC001170344926	766277333	/nfs/dbraw/zinc/27/73/33/766277333.db2.gz	FRPPPTBOEXJNFB-LLVKDONJSA-N	1	1	309.366	1.554	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+](C)CC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC001170344926	766277337	/nfs/dbraw/zinc/27/73/37/766277337.db2.gz	FRPPPTBOEXJNFB-LLVKDONJSA-N	1	1	309.366	1.554	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-])C1CCC1	ZINC001094221921	775543824	/nfs/dbraw/zinc/54/38/24/775543824.db2.gz	VCGFOWTYGSVCOO-UHFFFAOYSA-N	1	1	324.356	1.746	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1	ZINC001101756546	777478475	/nfs/dbraw/zinc/47/84/75/777478475.db2.gz	DBJUSJADNWMNRF-UHFFFAOYSA-N	1	1	308.382	1.807	20	5		DDBDMO
CC(=O)N(C)CC[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC001102409564	778120346	/nfs/dbraw/zinc/12/03/46/778120346.db2.gz	IEGXQDLNRKQCID-UHFFFAOYSA-N	1	1	320.393	1.504	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@]2(C)C1	ZINC001120065728	781744631	/nfs/dbraw/zinc/74/46/31/781744631.db2.gz	JQIMOFFLYBMDEG-BZNIZROVSA-N	1	1	302.378	1.951	20	5		DDBDMO
O=C(NC1(C[NH2+]Cc2ccns2)CCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001267838028	839059665	/nfs/dbraw/zinc/05/96/65/839059665.db2.gz	QVSVUEVZIJJWOA-VXGBXAGGSA-N	1	1	324.406	1.327	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C/CNC(=O)C=C1CCC1	ZINC001268527387	840388961	/nfs/dbraw/zinc/38/89/61/840388961.db2.gz	GDHHUILLPXKEKD-NSCUHMNNSA-N	1	1	319.365	1.201	20	5		DDBDMO
C[NH+](C)Cc1nnc(-c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)o1	ZINC001327305720	862046681	/nfs/dbraw/zinc/04/66/81/862046681.db2.gz	QMIMAEYWFBMOBG-UHFFFAOYSA-N	1	1	314.305	1.892	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC001224779575	881531883	/nfs/dbraw/zinc/53/18/83/881531883.db2.gz	WERGCTAXRLEFCE-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
CC/C=C(\C)C(=O)NCC1([NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001277013062	881658235	/nfs/dbraw/zinc/65/82/35/881658235.db2.gz	AVNBOXVVOVEORS-VZUCSPMQSA-N	1	1	321.381	1.423	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC2(CCC[N@H+]2C)CC1	ZINC001152578245	863442670	/nfs/dbraw/zinc/44/26/70/863442670.db2.gz	TZFHNVJSCIACQO-UHFFFAOYSA-N	1	1	306.366	1.634	20	5		DDBDMO
Cc1nc(Cl)c([N+](=O)[O-])c(N2C[C@H]3CCC[N@H+](C)[C@H]3C2)n1	ZINC001157260244	863688100	/nfs/dbraw/zinc/68/81/00/863688100.db2.gz	INIQPVVXJDNMCV-ZJUUUORDSA-N	1	1	311.773	1.877	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3cc([N+](=O)[O-])cc(Cl)[n+]3[O-])C[C@@H]21	ZINC001157271045	863700931	/nfs/dbraw/zinc/70/09/31/863700931.db2.gz	HGXSPGPUIWXBTK-KOLCDFICSA-N	1	1	312.757	1.412	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2ccc(N[C@@H]3CCC[N@@H+](C4COC4)C3)nc21	ZINC001157585494	863955695	/nfs/dbraw/zinc/95/56/95/863955695.db2.gz	LOWQEQVHPBAFTQ-SNVBAGLBSA-N	1	1	317.349	1.746	20	5		DDBDMO
O=[N+]([O-])c1c[nH]c2ccc(N[C@@H]3CCC[N@H+](C4COC4)C3)nc21	ZINC001157585494	863955703	/nfs/dbraw/zinc/95/57/03/863955703.db2.gz	LOWQEQVHPBAFTQ-SNVBAGLBSA-N	1	1	317.349	1.746	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2CO)cccc1[N+](=O)[O-]	ZINC001153776751	864091860	/nfs/dbraw/zinc/09/18/60/864091860.db2.gz	FYPRDQKXLMTDLM-QWHCGFSZSA-N	1	1	319.361	1.184	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC001153801749	864115117	/nfs/dbraw/zinc/11/51/17/864115117.db2.gz	BPWGHKOKJYZAMH-GFCCVEGCSA-N	1	1	323.397	1.515	20	5		DDBDMO
COc1cccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1C	ZINC001157767056	864117828	/nfs/dbraw/zinc/11/78/28/864117828.db2.gz	FVHFNANIPQURMU-ZIAGYGMSSA-N	1	1	321.377	1.265	20	5		DDBDMO
COc1cc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])ccc1C	ZINC001157767147	864118712	/nfs/dbraw/zinc/11/87/12/864118712.db2.gz	IDAVNEKYXMKFMF-ZIAGYGMSSA-N	1	1	321.377	1.265	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCC[N@@H+]1CCCC[C@H]1C	ZINC001333288960	866596299	/nfs/dbraw/zinc/59/62/99/866596299.db2.gz	JPHLFNGQKXMZQU-LLVKDONJSA-N	1	1	309.370	1.090	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2C3CCC2(CO)CC3)c2c(c1)COCO2	ZINC001333319080	866630905	/nfs/dbraw/zinc/63/09/05/866630905.db2.gz	OTKJOWKZSDPYIE-UHFFFAOYSA-N	1	1	320.345	1.951	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C3CCC2(CO)CC3)c2c(c1)COCO2	ZINC001333319080	866630909	/nfs/dbraw/zinc/63/09/09/866630909.db2.gz	OTKJOWKZSDPYIE-UHFFFAOYSA-N	1	1	320.345	1.951	20	5		DDBDMO
Cc1nn(C[N@H+]2C[C@@H]3COC[C@@]3(C)C2)c2ncc([N+](=O)[O-])cc12	ZINC001333721526	866964074	/nfs/dbraw/zinc/96/40/74/866964074.db2.gz	IKMANHXZMYLWKT-IAQYHMDHSA-N	1	1	317.349	1.574	20	5		DDBDMO
COc1ncnc(N[C@@H]2CC[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-]	ZINC001163361647	868395259	/nfs/dbraw/zinc/39/52/59/868395259.db2.gz	JYHWABWIEFKTKG-GHMZBOCLSA-N	1	1	309.370	1.924	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC001336523189	868991762	/nfs/dbraw/zinc/99/17/62/868991762.db2.gz	ZCZYNZZXEVCGGS-GFCCVEGCSA-N	1	1	315.333	1.115	20	5		DDBDMO
CC(C)(C)CC[NH2+]CC1(CCNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001164494452	869232026	/nfs/dbraw/zinc/23/20/26/869232026.db2.gz	KKQJKYSRGQNZQT-CHWSQXEVSA-N	1	1	311.426	1.964	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2CC[N@@H+](C(C)C)[C@H](C)C2)n1	ZINC001165199439	869422561	/nfs/dbraw/zinc/42/25/61/869422561.db2.gz	VLYNTGDRRGBMHN-SNVBAGLBSA-N	1	1	309.370	1.621	20	5		DDBDMO
CCC[N@H+]1CCCC[C@@H]1C(=O)OCCn1cc([N+](=O)[O-])cn1	ZINC001318910735	872341328	/nfs/dbraw/zinc/34/13/28/872341328.db2.gz	PGJCBERXCQFKIC-CYBMUJFWSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[NH+]1CCN(CCCO[C@@H](C[N+](=O)[O-])c2cccnc2)CC1	ZINC001206591220	872459693	/nfs/dbraw/zinc/45/96/93/872459693.db2.gz	RCUIEJWSOZTIAU-HNNXBMFYSA-N	1	1	308.382	1.054	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC001348969841	874901845	/nfs/dbraw/zinc/90/18/45/874901845.db2.gz	JICKUAJEBJEVGG-IAQYHMDHSA-N	1	1	318.377	1.803	20	5		DDBDMO
COc1cc2nc(=O)[nH]c(O[C@H](C)C[N+](C)(C)C)c2cc1OC	ZINC001227283394	882953628	/nfs/dbraw/zinc/95/36/28/882953628.db2.gz	VHCFLZWRGOKRFY-SNVBAGLBSA-O	1	1	322.385	1.826	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H](c1ccco1)[NH+](C)C	ZINC001350754893	875872244	/nfs/dbraw/zinc/87/22/44/875872244.db2.gz	XTVIXRFTWNABFF-LLVKDONJSA-N	1	1	321.337	1.112	20	5		DDBDMO
CC(C)(C(=O)NC[C@@]12CC[N@@H+](C1)CCC2)n1cc([N+](=O)[O-])cn1	ZINC001352412599	876734310	/nfs/dbraw/zinc/73/43/10/876734310.db2.gz	LBALBFXSMDPDLH-OAHLLOKOSA-N	1	1	321.381	1.129	20	5		DDBDMO
N[C@@H]1C[NH2+][C@H](C(=O)Nc2cc3cccnc3c3ncccc23)C1	ZINC001218980181	877851138	/nfs/dbraw/zinc/85/11/38/877851138.db2.gz	VQGCPAUGKASTMW-FZMZJTMJSA-N	1	1	307.357	1.411	20	5		DDBDMO
CC(C)[NH+]1CC(Oc2[nH]c(=O)nc3cc([N+](=O)[O-])ccc32)C1	ZINC001228242049	883403976	/nfs/dbraw/zinc/40/39/76/883403976.db2.gz	JRUHHLQWLDQNHA-UHFFFAOYSA-N	1	1	304.306	1.715	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2C[NH+]3CCC2CC3)cc1O	ZINC001228810887	883681518	/nfs/dbraw/zinc/68/15/18/883681518.db2.gz	LDEHIJHPAQYESL-CQSZACIVSA-N	1	1	322.317	1.560	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2n[nH]c(=O)c3ccc([N+](=O)[O-])cc32)C1	ZINC001229365922	883946511	/nfs/dbraw/zinc/94/65/11/883946511.db2.gz	YMVNPXQZWFWCEK-SNVBAGLBSA-N	1	1	304.306	1.717	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001252361529	895105226	/nfs/dbraw/zinc/10/52/26/895105226.db2.gz	KFZWYDSJHSPOCF-UHFFFAOYSA-N	1	1	315.333	1.825	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CC[C@H](F)[C@H](O)C3)CC2)cc1	ZINC001254476032	896455686	/nfs/dbraw/zinc/45/56/86/896455686.db2.gz	JRDYLFDMQZAHSL-JKSUJKDBSA-N	1	1	323.368	1.968	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)[C@@H](F)C3)CC2)cc1	ZINC001254474921	896456310	/nfs/dbraw/zinc/45/63/10/896456310.db2.gz	WNBLXZYSFVKJAQ-JKSUJKDBSA-N	1	1	323.368	1.968	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCN(C)CC1	ZINC001254532674	896489116	/nfs/dbraw/zinc/48/91/16/896489116.db2.gz	PYFOIEFYMXLTMU-AWEZNQCLSA-N	1	1	306.410	1.363	20	5		DDBDMO
C[C@]1(CO)CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC001254545136	896496360	/nfs/dbraw/zinc/49/63/60/896496360.db2.gz	JEBJSZLTNZEBCX-BBRMVZONSA-N	1	1	324.377	1.429	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@@H+]1CCO[C@@H]2C[C@H](CO)C[C@H]21	ZINC001254553472	896498593	/nfs/dbraw/zinc/49/85/93/896498593.db2.gz	VQMKCQCKIIQZBL-BQGCOEIASA-N	1	1	320.389	1.998	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CCO[C@@H]2C[C@H](CO)C[C@H]21	ZINC001254553472	896498603	/nfs/dbraw/zinc/49/86/03/896498603.db2.gz	VQMKCQCKIIQZBL-BQGCOEIASA-N	1	1	320.389	1.998	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H](N1CC[NH+]([C@@H]3CCOC3)CC1)C2	ZINC001254596771	896522969	/nfs/dbraw/zinc/52/29/69/896522969.db2.gz	GAYUFNYIZDIGGT-SJORKVTESA-N	1	1	317.389	1.469	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([NH+]1CCN([C@@H]3CCOC3)CC1)C2	ZINC001254596771	896522978	/nfs/dbraw/zinc/52/29/78/896522978.db2.gz	GAYUFNYIZDIGGT-SJORKVTESA-N	1	1	317.389	1.469	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12	ZINC001262725519	900337237	/nfs/dbraw/zinc/33/72/37/900337237.db2.gz	YWPUOKDYXNPLGK-WDBKCZKBSA-N	1	1	318.377	1.707	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)n1	ZINC000248664419	282097540	/nfs/dbraw/zinc/09/75/40/282097540.db2.gz	KYURIMWZMSHPGJ-MNOVXSKESA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)[C@H]1CO	ZINC000248994357	282125308	/nfs/dbraw/zinc/12/53/08/282125308.db2.gz	XTJXPORVIIWHPV-KYOSRNDESA-N	1	1	310.350	1.037	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000278585910	214256563	/nfs/dbraw/zinc/25/65/63/214256563.db2.gz	DBFURKAYUFEOTJ-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000278585910	214256565	/nfs/dbraw/zinc/25/65/65/214256565.db2.gz	DBFURKAYUFEOTJ-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@H+](CCO)C(C)(C)C2)c1	ZINC000614895493	362066618	/nfs/dbraw/zinc/06/66/18/362066618.db2.gz	VHTRKJAJOPONGN-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](CCO)C(C)(C)C2)c1	ZINC000614895493	362066624	/nfs/dbraw/zinc/06/66/24/362066624.db2.gz	VHTRKJAJOPONGN-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCn1cc([N+](=O)[O-])ccc1=O	ZINC000090552016	185302638	/nfs/dbraw/zinc/30/26/38/185302638.db2.gz	HNKXJZGFTYHNJB-KGLIPLIRSA-N	1	1	320.393	1.315	20	5		DDBDMO
Cc1nn(C)c(N2C[C@@H]3C[N@H+]4CCCC[C@@H]4[C@@H]3C2)c1[N+](=O)[O-]	ZINC000301324763	282272311	/nfs/dbraw/zinc/27/23/11/282272311.db2.gz	ACWCFPCQNVDJRL-YNEHKIRRSA-N	1	1	305.382	1.557	20	5		DDBDMO
CC1(C)COCC[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181576038	199321326	/nfs/dbraw/zinc/32/13/26/199321326.db2.gz	WXVBHIBUESYASM-GFCCVEGCSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)COCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181576038	199321327	/nfs/dbraw/zinc/32/13/27/199321327.db2.gz	WXVBHIBUESYASM-GFCCVEGCSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCC([C@@H](O)C(F)(F)F)CC2)c1	ZINC000161386368	290784151	/nfs/dbraw/zinc/78/41/51/290784151.db2.gz	ZWUPXOAPACAQTL-LLVKDONJSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@H+]1C1CC1	ZINC000272670740	210076695	/nfs/dbraw/zinc/07/66/95/210076695.db2.gz	KNLJKQDYOPFQJW-MWLCHTKSSA-N	1	1	305.334	1.655	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C[N@@H+]1C1CC1	ZINC000272670740	210076692	/nfs/dbraw/zinc/07/66/92/210076692.db2.gz	KNLJKQDYOPFQJW-MWLCHTKSSA-N	1	1	305.334	1.655	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000358466566	299162511	/nfs/dbraw/zinc/16/25/11/299162511.db2.gz	XROBKILXXXNTNF-HNNXBMFYSA-N	1	1	322.365	1.400	20	5		DDBDMO
C[C@]1(O)CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000280008697	215307182	/nfs/dbraw/zinc/30/71/82/215307182.db2.gz	JROQQGVIUDUXHW-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000280008697	215307184	/nfs/dbraw/zinc/30/71/84/215307184.db2.gz	JROQQGVIUDUXHW-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000152537146	186083423	/nfs/dbraw/zinc/08/34/23/186083423.db2.gz	DSVZRLHBDONWON-RMKNXTFCSA-N	1	1	321.377	1.693	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000042286702	352333223	/nfs/dbraw/zinc/33/32/23/352333223.db2.gz	WXFJIQWSDCGWCJ-RYUDHWBXSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000042286702	352333224	/nfs/dbraw/zinc/33/32/24/352333224.db2.gz	WXFJIQWSDCGWCJ-RYUDHWBXSA-N	1	1	307.350	1.687	20	5		DDBDMO
CNc1ccc(C(=O)NCCn2cc[nH+]c2C)cc1[N+](=O)[O-]	ZINC000052193059	352604727	/nfs/dbraw/zinc/60/47/27/352604727.db2.gz	ZJUATMRCXVGVPI-UHFFFAOYSA-N	1	1	303.322	1.571	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000173213437	198196522	/nfs/dbraw/zinc/19/65/22/198196522.db2.gz	RHBTUNGJJKYYNF-WFASDCNBSA-N	1	1	305.378	1.936	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@@H]3CO)n2)c1	ZINC000063512442	352914981	/nfs/dbraw/zinc/91/49/81/352914981.db2.gz	MJQQJTUNWYWOEC-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3CO)n2)c1	ZINC000063512442	352914985	/nfs/dbraw/zinc/91/49/85/352914985.db2.gz	MJQQJTUNWYWOEC-GFCCVEGCSA-N	1	1	304.306	1.602	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000063782732	352924650	/nfs/dbraw/zinc/92/46/50/352924650.db2.gz	UJVHJAQYLHQRJF-UHFFFAOYSA-N	1	1	312.345	1.776	20	5		DDBDMO
CC(=O)NC[C@@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000067413200	353047553	/nfs/dbraw/zinc/04/75/53/353047553.db2.gz	GDYCPJAYVACURP-AWEZNQCLSA-N	1	1	321.377	1.822	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000069485734	353162913	/nfs/dbraw/zinc/16/29/13/353162913.db2.gz	DCMQZXFWQYRQAG-GFCCVEGCSA-N	1	1	323.393	1.992	20	5		DDBDMO
CN(C)C(=O)[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000174833654	198391263	/nfs/dbraw/zinc/39/12/63/198391263.db2.gz	IWIMNWWRMSODNO-CQSZACIVSA-N	1	1	317.349	1.210	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](O)CN1CCOCC1	ZINC000083245272	353708753	/nfs/dbraw/zinc/70/87/53/353708753.db2.gz	ZKFPPDTWCDGLCT-KBPBESRZSA-N	1	1	323.393	1.281	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCO)CCN2CCOCC2)cc1[N+](=O)[O-]	ZINC000092186524	353845983	/nfs/dbraw/zinc/84/59/83/353845983.db2.gz	VMBXIZPQXBSGDA-UHFFFAOYSA-N	1	1	323.393	1.030	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[N@H+](C)CCO1	ZINC000157515270	354225104	/nfs/dbraw/zinc/22/51/04/354225104.db2.gz	GGKZTTCZVMWCFS-NOZJJQNGSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[N@@H+](C)CCO1	ZINC000157515270	354225105	/nfs/dbraw/zinc/22/51/05/354225105.db2.gz	GGKZTTCZVMWCFS-NOZJJQNGSA-N	1	1	311.313	1.183	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000157920905	354227575	/nfs/dbraw/zinc/22/75/75/354227575.db2.gz	PZQGPLAJVNMBNZ-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000157920905	354227577	/nfs/dbraw/zinc/22/75/77/354227577.db2.gz	PZQGPLAJVNMBNZ-IINYFYTJSA-N	1	1	323.349	1.052	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000322570961	354537392	/nfs/dbraw/zinc/53/73/92/354537392.db2.gz	FUMKGRKYHOUMSJ-QWHCGFSZSA-N	1	1	318.377	1.993	20	5		DDBDMO
C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@@H]1C[N@H+](C)CCO1	ZINC000588002843	354892276	/nfs/dbraw/zinc/89/22/76/354892276.db2.gz	VKCVGKITFHZQIL-WPRPVWTQSA-N	1	1	323.378	1.731	20	5		DDBDMO
C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000588002843	354892280	/nfs/dbraw/zinc/89/22/80/354892280.db2.gz	VKCVGKITFHZQIL-WPRPVWTQSA-N	1	1	323.378	1.731	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)C2)C1	ZINC000589879249	355028758	/nfs/dbraw/zinc/02/87/58/355028758.db2.gz	WLZNZBRYIADHQN-OAHLLOKOSA-N	1	1	306.366	1.201	20	5		DDBDMO
C[C@@H]1[C@H]([NH+](C)C)CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000590566928	355115162	/nfs/dbraw/zinc/11/51/62/355115162.db2.gz	SVJYMRHYZUMJDY-NOZJJQNGSA-N	1	1	317.349	1.636	20	5		DDBDMO
CCOc1cc(C[N@@H+](C[C@@H](C)O)[C@H](C)CO)ccc1[N+](=O)[O-]	ZINC000276972774	213211234	/nfs/dbraw/zinc/21/12/34/213211234.db2.gz	XFELUBQVIIKZMC-VXGBXAGGSA-N	1	1	312.366	1.557	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1	ZINC000590660003	355140139	/nfs/dbraw/zinc/14/01/39/355140139.db2.gz	YQQCVPQNYLDXDG-SWLSCSKDSA-N	1	1	319.361	1.517	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000590910316	355211129	/nfs/dbraw/zinc/21/11/29/355211129.db2.gz	IRSBBTIXWUIQNJ-UHFFFAOYSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@H]([NH3+])C1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000592423665	355578777	/nfs/dbraw/zinc/57/87/77/355578777.db2.gz	CVRXMBRFVQTQSM-NSHDSACASA-N	1	1	321.377	1.925	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H](CC)CO1	ZINC000593058261	355782500	/nfs/dbraw/zinc/78/25/00/355782500.db2.gz	KBGSRWKILUBZRK-TZMCWYRMSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@H](CC)CO1	ZINC000593058261	355782503	/nfs/dbraw/zinc/78/25/03/355782503.db2.gz	KBGSRWKILUBZRK-TZMCWYRMSA-N	1	1	309.366	1.646	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000593485965	355900140	/nfs/dbraw/zinc/90/01/40/355900140.db2.gz	DRZSJBMUUCYXHG-GXFFZTMASA-N	1	1	309.341	1.875	20	5		DDBDMO
CC1(C)[C@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000594003567	356084231	/nfs/dbraw/zinc/08/42/31/356084231.db2.gz	APOPJUAZDSBZJQ-NEPJUHHUSA-N	1	1	318.333	1.894	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCCC[C@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000594195392	356135774	/nfs/dbraw/zinc/13/57/74/356135774.db2.gz	GKRZYTBDVXILAL-GXTWGEPZSA-N	1	1	304.350	1.737	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@H]1COCCO1	ZINC000595744993	356632098	/nfs/dbraw/zinc/63/20/98/356632098.db2.gz	XQNZRENLMQTPJL-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)C[C@H]1COCCO1	ZINC000595744993	356632100	/nfs/dbraw/zinc/63/21/00/356632100.db2.gz	XQNZRENLMQTPJL-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000595754983	356637551	/nfs/dbraw/zinc/63/75/51/356637551.db2.gz	DOMQTFNESKNIKO-BJJXKVORSA-N	1	1	322.361	1.303	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595829061	356667003	/nfs/dbraw/zinc/66/70/03/356667003.db2.gz	GZIPKAKGGPCPEG-OLZOCXBDSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000595829061	356667005	/nfs/dbraw/zinc/66/70/05/356667005.db2.gz	GZIPKAKGGPCPEG-OLZOCXBDSA-N	1	1	319.361	1.810	20	5		DDBDMO
Cn1cc[nH+]c1[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596173926	356801642	/nfs/dbraw/zinc/80/16/42/356801642.db2.gz	CBCLDTXAPKKFDQ-SNVBAGLBSA-N	1	1	315.333	1.421	20	5		DDBDMO
CCC[C@H]1CN(c2ccc(N)c([N+](=O)[O-])n2)CC[N@H+]1CCOC	ZINC000596177476	356802978	/nfs/dbraw/zinc/80/29/78/356802978.db2.gz	LWRWWDDXJOWOTF-LBPRGKRZSA-N	1	1	323.397	1.509	20	5		DDBDMO
C[N@H+]1CCN(CCNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1(C)C	ZINC000596221892	356821160	/nfs/dbraw/zinc/82/11/60/356821160.db2.gz	GGZZDXJLLDVRST-UHFFFAOYSA-N	1	1	309.370	1.133	20	5		DDBDMO
C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1nncn1C	ZINC000358788525	299255295	/nfs/dbraw/zinc/25/52/95/299255295.db2.gz	FSTWMGBATNBYBF-JTQLQIEISA-N	1	1	318.337	1.403	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598512440	357611952	/nfs/dbraw/zinc/61/19/52/357611952.db2.gz	SQXHOCALEUJVLA-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])n[nH]1	ZINC000598512440	357611959	/nfs/dbraw/zinc/61/19/59/357611959.db2.gz	SQXHOCALEUJVLA-GFCCVEGCSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])[nH]1	ZINC000598559946	357632038	/nfs/dbraw/zinc/63/20/38/357632038.db2.gz	JLXRHSBADRQABS-GFCCVEGCSA-N	1	1	306.366	1.775	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+](CC2CC2)C1)c1ccc([N+](=O)[O-])cn1	ZINC000598560043	357632150	/nfs/dbraw/zinc/63/21/50/357632150.db2.gz	JYWDGXRPYVQGBJ-CYBMUJFWSA-N	1	1	318.377	1.842	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[NH2+][C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000598574512	357637982	/nfs/dbraw/zinc/63/79/82/357637982.db2.gz	RHDNQAHQALDEGK-NSHDSACASA-N	1	1	309.370	1.340	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CC[C@H](O)C1	ZINC000599780221	358056855	/nfs/dbraw/zinc/05/68/55/358056855.db2.gz	UEDOPZDXTLIDAL-LBPRGKRZSA-N	1	1	322.365	1.400	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1ccc([N+](=O)[O-])c([O-])c1)C2	ZINC000180104357	199117792	/nfs/dbraw/zinc/11/77/92/199117792.db2.gz	IVOMJZFPMLYDTF-NWDGAFQWSA-N	1	1	305.334	1.609	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C(C)(C)C(=O)NCC1CCCC1	ZINC000348082278	283358939	/nfs/dbraw/zinc/35/89/39/283358939.db2.gz	YGGDOVFQSOPOPK-UHFFFAOYSA-N	1	1	323.397	1.503	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1cc2cc([N+](=O)[O-])ccc2o1	ZINC000600809577	358320921	/nfs/dbraw/zinc/32/09/21/358320921.db2.gz	VIEDSHLOXWFURH-LBPRGKRZSA-N	1	1	319.317	1.137	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C[N@H+]1C1CC1	ZINC000180854361	199219044	/nfs/dbraw/zinc/21/90/44/199219044.db2.gz	XSNCBTBHPRGMNV-ZJUUUORDSA-N	1	1	304.350	1.532	20	5		DDBDMO
CCN1CC[NH+](CCCNc2ncc(F)cc2[N+](=O)[O-])CC1	ZINC000601104362	358403550	/nfs/dbraw/zinc/40/35/50/358403550.db2.gz	UHFDKTITOMXFSR-UHFFFAOYSA-N	1	1	311.361	1.568	20	5		DDBDMO
CC[C@H]1C(=O)NCCN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601125040	358412265	/nfs/dbraw/zinc/41/22/65/358412265.db2.gz	LYRDXDFJVRNLSU-ZDUSSCGKSA-N	1	1	300.318	1.858	20	5		DDBDMO
CNC(=O)[C@@H](C)CN(C)c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601124856	358412778	/nfs/dbraw/zinc/41/27/78/358412778.db2.gz	VFLTZTQVIUMGAE-JTQLQIEISA-N	1	1	302.334	1.961	20	5		DDBDMO
CCn1nccc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149879	358422540	/nfs/dbraw/zinc/42/25/40/358422540.db2.gz	RFXPYWKBAIITNJ-OAHLLOKOSA-N	1	1	304.350	1.809	20	5		DDBDMO
Cn1nnc2c1CC[C@H](Nc1cc[nH+]c3ccc([N+](=O)[O-])cc13)C2	ZINC000601186829	358439366	/nfs/dbraw/zinc/43/93/66/358439366.db2.gz	CBCVQADFACTVAP-JTQLQIEISA-N	1	1	324.344	1.663	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H]1CCCCN(C)C1=O	ZINC000601976240	358762712	/nfs/dbraw/zinc/76/27/12/358762712.db2.gz	OVXQFGDAQMUICC-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000276510831	212927781	/nfs/dbraw/zinc/92/77/81/212927781.db2.gz	DTXNBLDIJCIQQA-LLVKDONJSA-N	1	1	308.338	1.673	20	5		DDBDMO
CCCC(=O)NC[C@@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602452658	358985718	/nfs/dbraw/zinc/98/57/18/358985718.db2.gz	FKRLAIYQXOBXKT-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCCC(=O)NC[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602452658	358985720	/nfs/dbraw/zinc/98/57/20/358985720.db2.gz	FKRLAIYQXOBXKT-LBPRGKRZSA-N	1	1	323.397	1.457	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602665048	359111748	/nfs/dbraw/zinc/11/17/48/359111748.db2.gz	XVQUXWGLSJAHBF-NSHDSACASA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](C(=O)OC(C)(C)C)C2)c([N+](=O)[O-])n1	ZINC000602665048	359111753	/nfs/dbraw/zinc/11/17/53/359111753.db2.gz	XVQUXWGLSJAHBF-NSHDSACASA-N	1	1	324.381	1.882	20	5		DDBDMO
CO[C@@H](C[NH+]1CC(Oc2ccc([N+](=O)[O-])cc2)C1)[C@@H]1CCOC1	ZINC000602689100	359127327	/nfs/dbraw/zinc/12/73/27/359127327.db2.gz	QSPULLAVXWQNIN-WBMJQRKESA-N	1	1	322.361	1.709	20	5		DDBDMO
C[C@@H]1OCC[C@H]1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602792800	359195118	/nfs/dbraw/zinc/19/51/18/359195118.db2.gz	COOYBKKAGPOJKV-RWMBFGLXSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cn1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c([N+](=O)[O-])n1	ZINC000602837064	359227743	/nfs/dbraw/zinc/22/77/43/359227743.db2.gz	SSLCJSSRUCPKKP-MGPQQGTHSA-N	1	1	308.382	1.844	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@@]2(CCOC2)OC(C)(C)C1	ZINC000602822145	359216494	/nfs/dbraw/zinc/21/64/94/359216494.db2.gz	SBXDMTKMXLQUNQ-OAHLLOKOSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cn1cc(CN[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822938	359217502	/nfs/dbraw/zinc/21/75/02/359217502.db2.gz	HJXFEDOHUVNYHR-GJZGRUSLSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cn1cc(CN[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])n1	ZINC000602822938	359217504	/nfs/dbraw/zinc/21/75/04/359217504.db2.gz	HJXFEDOHUVNYHR-GJZGRUSLSA-N	1	1	315.377	1.863	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C)O[C@@]2(CCCOC2)C1	ZINC000602831143	359223363	/nfs/dbraw/zinc/22/33/63/359223363.db2.gz	ZCKKLFJEWGBIME-WFASDCNBSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](C)O[C@@]2(CCCOC2)C1	ZINC000602831143	359223368	/nfs/dbraw/zinc/22/33/68/359223368.db2.gz	ZCKKLFJEWGBIME-WFASDCNBSA-N	1	1	324.381	1.370	20	5		DDBDMO
CCCN(C(=O)Nc1c(C)cncc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000602961593	359325612	/nfs/dbraw/zinc/32/56/12/359325612.db2.gz	WJTKGAHDVBRHJL-LBPRGKRZSA-N	1	1	321.381	1.668	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H](OC)C[C@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964606	359327448	/nfs/dbraw/zinc/32/74/48/359327448.db2.gz	RWDUEEYRCIIWSC-SWLSCSKDSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1CCO	ZINC000187688124	200145070	/nfs/dbraw/zinc/14/50/70/200145070.db2.gz	LFKFMYYOLJLXNB-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C1	ZINC000604485749	359756458	/nfs/dbraw/zinc/75/64/58/359756458.db2.gz	WMMUBKBQKYMSTM-ZDUSSCGKSA-N	1	1	316.361	1.760	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000604198285	359724827	/nfs/dbraw/zinc/72/48/27/359724827.db2.gz	FLIZECBHDHLYLN-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
CC[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C[C@@H]1CCOC1	ZINC000609631761	360339203	/nfs/dbraw/zinc/33/92/03/360339203.db2.gz	VPCPNGQEWWRJNU-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)CC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000609584783	360329206	/nfs/dbraw/zinc/32/92/06/360329206.db2.gz	ITLHELYXWFRKQB-LBPRGKRZSA-N	1	1	321.377	1.699	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000610208766	360390653	/nfs/dbraw/zinc/39/06/53/360390653.db2.gz	KRPRCMCVDQXJMO-AAEUAGOBSA-N	1	1	321.377	1.745	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1OC	ZINC000610447494	360438432	/nfs/dbraw/zinc/43/84/32/360438432.db2.gz	ODZGYKRHHIDUPP-UHFFFAOYSA-N	1	1	320.349	1.941	20	5		DDBDMO
Cc1nccc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000610485030	360447688	/nfs/dbraw/zinc/44/76/88/360447688.db2.gz	ZTJODGNTFQBSTG-ZDUSSCGKSA-N	1	1	316.365	1.769	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCN(c2ccsc2[N+](=O)[O-])CC1	ZINC000610808456	360541926	/nfs/dbraw/zinc/54/19/26/360541926.db2.gz	SOCHJZGXYXZZBC-NSHDSACASA-N	1	1	324.406	1.399	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611087605	360618438	/nfs/dbraw/zinc/61/84/38/360618438.db2.gz	YAMJNRRRANMUFK-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H]1O	ZINC000611287541	360690424	/nfs/dbraw/zinc/69/04/24/360690424.db2.gz	HFCOGYMXJSLJBM-ZWNOBZJWSA-N	1	1	308.334	1.569	20	5		DDBDMO
C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@H+](C)CCO1	ZINC000611712051	360802396	/nfs/dbraw/zinc/80/23/96/360802396.db2.gz	UXOZEQZGEUHUMC-QMTHXVAHSA-N	1	1	317.349	1.669	20	5		DDBDMO
C[C@@H](Nc1ncnc2ccc([N+](=O)[O-])cc21)[C@H]1C[N@@H+](C)CCO1	ZINC000611712051	360802401	/nfs/dbraw/zinc/80/24/01/360802401.db2.gz	UXOZEQZGEUHUMC-QMTHXVAHSA-N	1	1	317.349	1.669	20	5		DDBDMO
COc1cc(C[NH2+][C@H]2C(=O)NCC[C@@H]2C)c([N+](=O)[O-])cc1F	ZINC000193651805	201096452	/nfs/dbraw/zinc/09/64/52/201096452.db2.gz	XMFHCHKRELALFN-ISVAXAHUSA-N	1	1	311.313	1.357	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000194761634	201283844	/nfs/dbraw/zinc/28/38/44/201283844.db2.gz	RBOHAOCLEWAHQY-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000194761634	201283847	/nfs/dbraw/zinc/28/38/47/201283847.db2.gz	RBOHAOCLEWAHQY-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619251944	363945359	/nfs/dbraw/zinc/94/53/59/363945359.db2.gz	CBQXYTQMULKXNZ-ZIAGYGMSSA-N	1	1	307.325	1.853	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@H]2C[NH2+]C[C@H]2C1	ZINC000359276123	299391233	/nfs/dbraw/zinc/39/12/33/299391233.db2.gz	CJSTXIZJDLWXAY-STQMWFEESA-N	1	1	318.377	1.383	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)Cc2cccc([N+](=O)[O-])c2)n1C	ZINC000359321075	299411952	/nfs/dbraw/zinc/41/19/52/299411952.db2.gz	VEWOQSJADBJXKT-UHFFFAOYSA-N	1	1	317.349	1.253	20	5		DDBDMO
C[C@@H](CC[NH+](C)C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000264953496	204299143	/nfs/dbraw/zinc/29/91/43/204299143.db2.gz	YJZHXZJBWHCDLV-VIFPVBQESA-N	1	1	305.338	1.541	20	5		DDBDMO
C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(=O)NCCF	ZINC000282748583	217223687	/nfs/dbraw/zinc/22/36/87/217223687.db2.gz	SFSWCXSIPQCDFM-QMMMGPOBSA-N	1	1	303.721	1.812	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCc2cc(F)ccc2C1	ZINC000091897333	248241405	/nfs/dbraw/zinc/24/14/05/248241405.db2.gz	PGTMTKHEDNTZBJ-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCc2cc(F)ccc2C1	ZINC000091897333	248241409	/nfs/dbraw/zinc/24/14/09/248241409.db2.gz	PGTMTKHEDNTZBJ-UHFFFAOYSA-N	1	1	317.320	1.954	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)NCC[NH+]2CCCCC2)cc1	ZINC000046034661	248197952	/nfs/dbraw/zinc/19/79/52/248197952.db2.gz	OAMGCNZRIAZICU-UHFFFAOYSA-N	1	1	313.379	1.359	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H]3OCCN(C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000284504883	218055590	/nfs/dbraw/zinc/05/55/90/218055590.db2.gz	XXKNHUTVJNGTLR-HZPDHXFCSA-N	1	1	305.378	1.808	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1cccc([N+](=O)[O-])c1)C(C)C	ZINC000338768807	250128965	/nfs/dbraw/zinc/12/89/65/250128965.db2.gz	XFPPAIRKPXUSDH-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000106393825	194205937	/nfs/dbraw/zinc/20/59/37/194205937.db2.gz	CFDKGQSRSXCDMX-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCS(=O)(=O)C1	ZINC000285212537	218335258	/nfs/dbraw/zinc/33/52/58/218335258.db2.gz	DRVAPGNZRLONCZ-LBPRGKRZSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCS(=O)(=O)C1	ZINC000285212537	218335260	/nfs/dbraw/zinc/33/52/60/218335260.db2.gz	DRVAPGNZRLONCZ-LBPRGKRZSA-N	1	1	312.391	1.504	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CC2=CCCOC2)CC1	ZINC000295868914	285165496	/nfs/dbraw/zinc/16/54/96/285165496.db2.gz	AHBSLKMIKAHUCC-UHFFFAOYSA-N	1	1	304.350	1.459	20	5		DDBDMO
COc1ccc(C[N@H+](C)CCNC(=O)C(C)C)cc1[N+](=O)[O-]	ZINC000157412352	197185506	/nfs/dbraw/zinc/18/55/06/197185506.db2.gz	SMNDWQXYGYLZIF-UHFFFAOYSA-N	1	1	309.366	1.807	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCNC(=O)C(C)C)cc1[N+](=O)[O-]	ZINC000157412352	197185509	/nfs/dbraw/zinc/18/55/09/197185509.db2.gz	SMNDWQXYGYLZIF-UHFFFAOYSA-N	1	1	309.366	1.807	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000444348970	533399766	/nfs/dbraw/zinc/39/97/66/533399766.db2.gz	CPIADANUQANLFB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000444348970	533399771	/nfs/dbraw/zinc/39/97/71/533399771.db2.gz	CPIADANUQANLFB-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c1[N+](=O)[O-]	ZINC000193248257	292086539	/nfs/dbraw/zinc/08/65/39/292086539.db2.gz	XCTHZPAETDCFRZ-LLVKDONJSA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@](O)(C(N)=O)C1	ZINC000286103538	292295904	/nfs/dbraw/zinc/29/59/04/292295904.db2.gz	IMKWPJREWIEHLL-NHYWBVRUSA-N	1	1	307.350	1.276	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)CC[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC000114368933	407563907	/nfs/dbraw/zinc/56/39/07/407563907.db2.gz	VFUMZELNBUVUIK-ZDUSSCGKSA-N	1	1	321.377	1.744	20	5		DDBDMO
Cc1ncsc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075719587	406940703	/nfs/dbraw/zinc/94/07/03/406940703.db2.gz	HOIOYHJYNOWGGM-NSHDSACASA-N	1	1	311.367	1.049	20	5		DDBDMO
C[C@H](CS(C)(=O)=O)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000084440157	407089168	/nfs/dbraw/zinc/08/91/68/407089168.db2.gz	QIVXXCWMVNOYLO-MRVPVSSYSA-N	1	1	306.771	1.771	20	5		DDBDMO
CC(C)NC(=O)C[N@@H+](C)CCCOc1ccc([N+](=O)[O-])cc1	ZINC000055899608	407208128	/nfs/dbraw/zinc/20/81/28/407208128.db2.gz	VCOQKVZTZVQKEN-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000102486964	407323746	/nfs/dbraw/zinc/32/37/46/407323746.db2.gz	IDMTWLYJRKIHBE-CYBMUJFWSA-N	1	1	323.397	1.399	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000067118875	407267396	/nfs/dbraw/zinc/26/73/96/407267396.db2.gz	CMEAPEWZXJZZIR-SECBINFHSA-N	1	1	321.424	1.665	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000125323952	407385516	/nfs/dbraw/zinc/38/55/16/407385516.db2.gz	ANQPYLWKAOELEE-LLVKDONJSA-N	1	1	309.370	1.132	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000107887208	407381114	/nfs/dbraw/zinc/38/11/14/407381114.db2.gz	QGOROFAZHSPSAT-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
CC[N@@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000107887208	407381116	/nfs/dbraw/zinc/38/11/16/407381116.db2.gz	QGOROFAZHSPSAT-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000107887208	407381118	/nfs/dbraw/zinc/38/11/18/407381118.db2.gz	QGOROFAZHSPSAT-SNVBAGLBSA-N	1	1	317.349	1.543	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000111265913	407403960	/nfs/dbraw/zinc/40/39/60/407403960.db2.gz	IMYRYRYBWOLBGF-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[N@@H+](C)CC1	ZINC000127236767	407432035	/nfs/dbraw/zinc/43/20/35/407432035.db2.gz	FTKBUCGKSJEOAN-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CCC[N@H+](C)CC1	ZINC000127236767	407432037	/nfs/dbraw/zinc/43/20/37/407432037.db2.gz	FTKBUCGKSJEOAN-UHFFFAOYSA-N	1	1	313.379	1.229	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000270968068	407443846	/nfs/dbraw/zinc/44/38/46/407443846.db2.gz	VTOGBQOVBXQCDG-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@@H](C)C1	ZINC000265947303	407522442	/nfs/dbraw/zinc/52/24/42/407522442.db2.gz	KAYVJKIEIKPNQH-JQWIXIFHSA-N	1	1	323.397	1.439	20	5		DDBDMO
COC(=O)C1(O)CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000271237102	407591772	/nfs/dbraw/zinc/59/17/72/407591772.db2.gz	FHIBRHNNWDVZCU-UHFFFAOYSA-N	1	1	308.334	1.403	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](CCO)c1ccccc1	ZINC000266940279	407683412	/nfs/dbraw/zinc/68/34/12/407683412.db2.gz	PRMMKQAQSFIAMS-HNNXBMFYSA-N	1	1	304.350	1.847	20	5		DDBDMO
CC(C)[C@H]([NH3+])CCN(C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000236623380	407734675	/nfs/dbraw/zinc/73/46/75/407734675.db2.gz	FSEFYYMFRVFYBL-GFCCVEGCSA-N	1	1	319.365	1.917	20	5		DDBDMO
Cn1cccc1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000179222553	407757806	/nfs/dbraw/zinc/75/78/06/407757806.db2.gz	PFXFMMLYMMWZSJ-HNNXBMFYSA-N	1	1	316.361	1.932	20	5		DDBDMO
C[C@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000187418276	407855171	/nfs/dbraw/zinc/85/51/71/407855171.db2.gz	NFEFQCMPAUSPEK-FZMZJTMJSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H](C(N)=O)C1	ZINC000187418276	407855177	/nfs/dbraw/zinc/85/51/77/407855177.db2.gz	NFEFQCMPAUSPEK-FZMZJTMJSA-N	1	1	307.350	1.559	20	5		DDBDMO
[NH3+]CCNS(=O)(=O)c1c(Cl)cc(Cl)cc1[N+](=O)[O-]	ZINC000237992222	407865979	/nfs/dbraw/zinc/86/59/79/407865979.db2.gz	XLBPEJDMJUBVFK-UHFFFAOYSA-N	1	1	314.150	1.139	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000134306172	407895590	/nfs/dbraw/zinc/89/55/90/407895590.db2.gz	QKULMJMVVSFIEQ-GFCCVEGCSA-N	1	1	307.325	1.948	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000272490068	407944552	/nfs/dbraw/zinc/94/45/52/407944552.db2.gz	HCWQBHSFQVGWCV-LBPRGKRZSA-N	1	1	319.361	1.858	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](C(N)=O)C1	ZINC000175068283	408043483	/nfs/dbraw/zinc/04/34/83/408043483.db2.gz	JYSINGWBFNHPAC-LLVKDONJSA-N	1	1	307.350	1.691	20	5		DDBDMO
Cc1nc(N2CCN(c3[nH+]ccn3C)CC2)ccc1[N+](=O)[O-]	ZINC000268533843	408085883	/nfs/dbraw/zinc/08/58/83/408085883.db2.gz	XXDHDBJTGRBZAH-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
C[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CC(C)(C)O	ZINC000189899942	408132579	/nfs/dbraw/zinc/13/25/79/408132579.db2.gz	WGMFJVXYLFZBGQ-CQSZACIVSA-N	1	1	321.421	1.914	20	5		DDBDMO
C[C@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190093435	408163307	/nfs/dbraw/zinc/16/33/07/408163307.db2.gz	CZQCZPOLZLBHOQ-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H](CO)O1	ZINC000190093435	408163313	/nfs/dbraw/zinc/16/33/13/408163313.db2.gz	CZQCZPOLZLBHOQ-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1CO	ZINC000190422679	408242473	/nfs/dbraw/zinc/24/24/73/408242473.db2.gz	AVQZUULGYJRHQY-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CCC(CC)[C@H](CNc1ncc([N+](=O)[O-])cn1)[NH+]1CCOCC1	ZINC000273644834	408275657	/nfs/dbraw/zinc/27/56/57/408275657.db2.gz	SVKXTEZOMOQCCI-AWEZNQCLSA-N	1	1	323.397	1.934	20	5		DDBDMO
CC[N@H+]1CCC[C@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000171100292	162206474	/nfs/dbraw/zinc/20/64/74/162206474.db2.gz	YDSBMTBOJSVGAL-ZDUSSCGKSA-N	1	1	323.397	1.399	20	5		DDBDMO
C[C@@H]1COC[C@@H](C)[NH+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247090689	408407453	/nfs/dbraw/zinc/40/74/53/408407453.db2.gz	UJCROWLDZBLADJ-YRGRVCCFSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000247285275	408444217	/nfs/dbraw/zinc/44/42/17/408444217.db2.gz	GDPPBWZYJCQJLZ-GXTWGEPZSA-N	1	1	320.393	1.805	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@H](O)C[C@H]3CO)co2)cc1	ZINC000248388055	408555350	/nfs/dbraw/zinc/55/53/50/408555350.db2.gz	CUGQWYKCQLVBAN-UONOGXRCSA-N	1	1	319.317	1.177	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3C[C@H](O)C[C@H]3CO)co2)cc1	ZINC000248388055	408555352	/nfs/dbraw/zinc/55/53/52/408555352.db2.gz	CUGQWYKCQLVBAN-UONOGXRCSA-N	1	1	319.317	1.177	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(C(=O)Nc3ccncc3[N+](=O)[O-])CC[C@H]21	ZINC000248406086	408560404	/nfs/dbraw/zinc/56/04/04/408560404.db2.gz	SAYDBMBTINCZTD-WCQYABFASA-N	1	1	319.365	1.938	20	5		DDBDMO
Nc1nc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)ncc1[N+](=O)[O-]	ZINC000161926268	408652936	/nfs/dbraw/zinc/65/29/36/408652936.db2.gz	OJQKNFJRHJVVPE-PWSUYJOCSA-N	1	1	318.381	1.420	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000162614503	408719373	/nfs/dbraw/zinc/71/93/73/408719373.db2.gz	VQSOVEMHNMHAQT-LLVKDONJSA-N	1	1	309.370	1.416	20	5		DDBDMO
CC(C)C[N@@H+]1CCC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000162614503	408719379	/nfs/dbraw/zinc/71/93/79/408719379.db2.gz	VQSOVEMHNMHAQT-LLVKDONJSA-N	1	1	309.370	1.416	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000162614503	408719388	/nfs/dbraw/zinc/71/93/88/408719388.db2.gz	VQSOVEMHNMHAQT-LLVKDONJSA-N	1	1	309.370	1.416	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000249545168	408738785	/nfs/dbraw/zinc/73/87/85/408738785.db2.gz	GAVVBQOOGJOHDK-KBPBESRZSA-N	1	1	307.394	1.963	20	5		DDBDMO
[NH3+][C@@H]1CC[C@H]2CN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)C[C@@H]12	ZINC000185130862	408765327	/nfs/dbraw/zinc/76/53/27/408765327.db2.gz	NBERQTNIEKNCIX-XXILOJSOSA-N	1	1	315.333	1.280	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCCC[C@H]2CCO)c1	ZINC000250046728	408773693	/nfs/dbraw/zinc/77/36/93/408773693.db2.gz	CXIGFPVFGCSJGP-ZFWWWQNUSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1ccc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000285628913	408832081	/nfs/dbraw/zinc/83/20/81/408832081.db2.gz	DWTWENZGNXLTMU-HUUCEWRRSA-N	1	1	319.361	1.448	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)CC[N@@H+](C)C1CC1	ZINC000277552488	408963721	/nfs/dbraw/zinc/96/37/21/408963721.db2.gz	JANSLHDXRLEDJL-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)c1	ZINC000277678350	408990341	/nfs/dbraw/zinc/99/03/41/408990341.db2.gz	GDMNTLCUGLZLNR-KOLCDFICSA-N	1	1	322.287	1.427	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CC)CCOCCO	ZINC000282133252	408997927	/nfs/dbraw/zinc/99/79/27/408997927.db2.gz	RLXMLHRBVPEBMY-UHFFFAOYSA-N	1	1	312.366	1.824	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)CCOCCO	ZINC000282133252	408997928	/nfs/dbraw/zinc/99/79/28/408997928.db2.gz	RLXMLHRBVPEBMY-UHFFFAOYSA-N	1	1	312.366	1.824	20	5		DDBDMO
O=C(CC[N@@H+]1CCCC[C@@H]1CO)Nc1ccccc1[N+](=O)[O-]	ZINC000282193598	409007990	/nfs/dbraw/zinc/00/79/90/409007990.db2.gz	BQTMJDQOCNJXHS-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](NC[C@@H]1C[N@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668333	409158303	/nfs/dbraw/zinc/15/83/03/409158303.db2.gz	JPMLFWIXVHELFN-WCQYABFASA-N	1	1	307.398	1.073	20	5		DDBDMO
C[C@H](NC[C@@H]1C[N@@H+](C)CCN1C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293668333	409158305	/nfs/dbraw/zinc/15/83/05/409158305.db2.gz	JPMLFWIXVHELFN-WCQYABFASA-N	1	1	307.398	1.073	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000279186470	409165937	/nfs/dbraw/zinc/16/59/37/409165937.db2.gz	JHOHQMYMDWVGGB-BETUJISGSA-N	1	1	317.389	1.892	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)C2)C1	ZINC000293807807	409183751	/nfs/dbraw/zinc/18/37/51/409183751.db2.gz	AMAJZJICWOGWFQ-HNNXBMFYSA-N	1	1	320.349	1.253	20	5		DDBDMO
C[N@@H+]1CC[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000293945826	409212002	/nfs/dbraw/zinc/21/20/02/409212002.db2.gz	RRSRQQMENMSJFB-OAHLLOKOSA-N	1	1	305.334	1.468	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1	ZINC000293945826	409212006	/nfs/dbraw/zinc/21/20/06/409212006.db2.gz	RRSRQQMENMSJFB-OAHLLOKOSA-N	1	1	305.334	1.468	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000295101436	409323574	/nfs/dbraw/zinc/32/35/74/409323574.db2.gz	SVMBYHFEFPINML-CYBMUJFWSA-N	1	1	314.363	1.668	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2csc([N+](=O)[O-])c2)C1	ZINC000295101436	409323580	/nfs/dbraw/zinc/32/35/80/409323580.db2.gz	SVMBYHFEFPINML-CYBMUJFWSA-N	1	1	314.363	1.668	20	5		DDBDMO
C[C@@]1(F)C[NH2+]CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000295221551	409383119	/nfs/dbraw/zinc/38/31/19/409383119.db2.gz	MSWMQAVOMITKRP-CQSZACIVSA-N	1	1	311.313	1.134	20	5		DDBDMO
C[C@H]([N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)O	ZINC000295223016	409383548	/nfs/dbraw/zinc/38/35/48/409383548.db2.gz	VVKRZAWYDIXMDI-NWDGAFQWSA-N	1	1	312.366	1.426	20	5		DDBDMO
CCc1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000304371957	409615989	/nfs/dbraw/zinc/61/59/89/409615989.db2.gz	WICHQQOBOBVPNV-INIZCTEOSA-N	1	1	318.377	1.847	20	5		DDBDMO
COC(=O)Cc1ccc(NC[C@@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000297192644	409845680	/nfs/dbraw/zinc/84/56/80/409845680.db2.gz	QTVQEBQRQBCNKP-LBPRGKRZSA-N	1	1	307.350	1.674	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000297122781	409813902	/nfs/dbraw/zinc/81/39/02/409813902.db2.gz	PFQBRPTXWCPHQF-UHFFFAOYSA-N	1	1	302.334	1.801	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)C[C@@H]1C	ZINC000357049851	409820413	/nfs/dbraw/zinc/82/04/13/409820413.db2.gz	HOLQMOAPOWWGLM-WDEREUQCSA-N	1	1	309.370	1.273	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000342695698	409820805	/nfs/dbraw/zinc/82/08/05/409820805.db2.gz	PTEULVODKBKSNJ-CYBMUJFWSA-N	1	1	310.350	1.445	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2CCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000297731374	409974664	/nfs/dbraw/zinc/97/46/64/409974664.db2.gz	CABWOBLFUNAHPE-LLVKDONJSA-N	1	1	323.349	1.389	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000354664326	410002135	/nfs/dbraw/zinc/00/21/35/410002135.db2.gz	QLWMGJWPHVGUCC-UWVGGRQHSA-N	1	1	309.370	1.619	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C	ZINC000298035778	410086139	/nfs/dbraw/zinc/08/61/39/410086139.db2.gz	GBDJBJURJHKAIN-UHFFFAOYSA-N	1	1	322.365	1.218	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@H](C)C1	ZINC000332351226	410086505	/nfs/dbraw/zinc/08/65/05/410086505.db2.gz	PJTGIVKPGZMIMR-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@H](C)C1	ZINC000332351226	410086510	/nfs/dbraw/zinc/08/65/10/410086510.db2.gz	PJTGIVKPGZMIMR-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H]1CC[C@@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)O1	ZINC000298036796	410088655	/nfs/dbraw/zinc/08/86/55/410088655.db2.gz	GVJWYPUQRMXLDV-STQMWFEESA-N	1	1	306.366	1.679	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000357539614	410091106	/nfs/dbraw/zinc/09/11/06/410091106.db2.gz	SPUCXKIPEOSMCA-LLVKDONJSA-N	1	1	321.381	1.479	20	5		DDBDMO
C[C@H]1CC[C@@H]([N@@H+](CCO)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000351635839	410125087	/nfs/dbraw/zinc/12/50/87/410125087.db2.gz	QKRIXZNWIIQUOB-QWHCGFSZSA-N	1	1	309.366	1.239	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CCC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000357682296	410186288	/nfs/dbraw/zinc/18/62/88/410186288.db2.gz	KERITXAMEGWMQK-KOLCDFICSA-N	1	1	308.338	1.671	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2C[C@@H](O)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000355043807	410262430	/nfs/dbraw/zinc/26/24/30/410262430.db2.gz	SNXIWNUJOQSTQZ-PWSUYJOCSA-N	1	1	324.333	1.102	20	5		DDBDMO
CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347010714	410308455	/nfs/dbraw/zinc/30/84/55/410308455.db2.gz	HIHHMBGAUOULKK-HNNXBMFYSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCCO1	ZINC000347187229	410378566	/nfs/dbraw/zinc/37/85/66/410378566.db2.gz	KVJMEMUEHODSKM-LLVKDONJSA-N	1	1	310.354	1.154	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)COc2cccc([N+](=O)[O-])c2)CCC[N@H+]1C	ZINC000343441164	410454796	/nfs/dbraw/zinc/45/47/96/410454796.db2.gz	BXNVMZSQHMQHPT-SMDDNHRTSA-N	1	1	307.350	1.573	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343451720	410463910	/nfs/dbraw/zinc/46/39/10/410463910.db2.gz	OLEBVOQRUXOEFW-OLZOCXBDSA-N	1	1	321.377	1.963	20	5		DDBDMO
C[C@@]12CCC[N@H+]1C[C@H](c1noc(-c3cc([N+](=O)[O-])c[nH]3)n1)OC2	ZINC000347332779	410479365	/nfs/dbraw/zinc/47/93/65/410479365.db2.gz	IGYRQWBFOHNGPN-RISCZKNCSA-N	1	1	319.321	1.899	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000347480431	410576291	/nfs/dbraw/zinc/57/62/91/410576291.db2.gz	RCPNUUPTIDFHAB-CHWSQXEVSA-N	1	1	312.366	1.427	20	5		DDBDMO
CCC[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2C(N)=O)CC1	ZINC000301256056	410688048	/nfs/dbraw/zinc/68/80/48/410688048.db2.gz	FOAVMABJQHIAHM-UHFFFAOYSA-N	1	1	307.354	1.011	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337478269	410814990	/nfs/dbraw/zinc/81/49/90/410814990.db2.gz	UFCUVYKRIREALX-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000331125792	410964244	/nfs/dbraw/zinc/96/42/44/410964244.db2.gz	HQRADMAHUDFHLH-HNNXBMFYSA-N	1	1	321.377	1.772	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CC3(O)CCCC3)C2)nc1	ZINC000331420066	411080290	/nfs/dbraw/zinc/08/02/90/411080290.db2.gz	KTPOLQGHQZDGFG-LBPRGKRZSA-N	1	1	306.366	1.781	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000331216406	411023411	/nfs/dbraw/zinc/02/34/11/411023411.db2.gz	VVYBLNLRTWBHDE-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@H]1C	ZINC000331216406	411023416	/nfs/dbraw/zinc/02/34/16/411023416.db2.gz	VVYBLNLRTWBHDE-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000134407463	196387338	/nfs/dbraw/zinc/38/73/38/196387338.db2.gz	BPWDJWDWVYRILD-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[C@H]([NH2+]Cc2ccccc2)C1	ZINC000361342569	418629834	/nfs/dbraw/zinc/62/98/34/418629834.db2.gz	NLRPSRQTIDVRPF-ZNMIVQPWSA-N	1	1	303.362	1.432	20	5		DDBDMO
CC(C)N(C)C(=O)[C@@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400322	418635394	/nfs/dbraw/zinc/63/53/94/418635394.db2.gz	BUPXGKJSNJVKFQ-OLZOCXBDSA-N	1	1	323.397	1.684	20	5		DDBDMO
CC(C)N(C)C(=O)[C@@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375400322	418635396	/nfs/dbraw/zinc/63/53/96/418635396.db2.gz	BUPXGKJSNJVKFQ-OLZOCXBDSA-N	1	1	323.397	1.684	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2ccc([N+](=O)[O-])n2C)[nH+]c1	ZINC000347129653	418638333	/nfs/dbraw/zinc/63/83/33/418638333.db2.gz	VZWAXRARZMNWMW-UHFFFAOYSA-N	1	1	317.349	1.869	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@@H+](CCO)CCOc1ccccc1[N+](=O)[O-]	ZINC000361586783	418687906	/nfs/dbraw/zinc/68/79/06/418687906.db2.gz	UJOCKURRZLRCRE-OLZOCXBDSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cn1c(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)ccc1[N+](=O)[O-]	ZINC000362054579	418745427	/nfs/dbraw/zinc/74/54/27/418745427.db2.gz	DLPUGEMOZJGPGX-CYBMUJFWSA-N	1	1	320.393	1.928	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCN(C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000408092752	418786861	/nfs/dbraw/zinc/78/68/61/418786861.db2.gz	ZRAIIPQQDYTWGJ-UWVGGRQHSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000408092752	418786862	/nfs/dbraw/zinc/78/68/62/418786862.db2.gz	ZRAIIPQQDYTWGJ-UWVGGRQHSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c1[N+](=O)[O-]	ZINC000408092752	418786864	/nfs/dbraw/zinc/78/68/64/418786864.db2.gz	ZRAIIPQQDYTWGJ-UWVGGRQHSA-N	1	1	309.370	1.606	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCN3CCOC[C@@H]3C2)cc1	ZINC000371827898	418820111	/nfs/dbraw/zinc/82/01/11/418820111.db2.gz	BCUJNUMRAKMFRF-HNNXBMFYSA-N	1	1	321.377	1.380	20	5		DDBDMO
C[N@H+]1CCCN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000411157156	418875186	/nfs/dbraw/zinc/87/51/86/418875186.db2.gz	PXZGOYHOVWKEFD-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000365839913	418915554	/nfs/dbraw/zinc/91/55/54/418915554.db2.gz	UBWWCQCCKPVOTO-MEDUHNTESA-N	1	1	319.361	1.769	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000411905765	419464897	/nfs/dbraw/zinc/46/48/97/419464897.db2.gz	CDPHQUFCFPNGCX-RYUDHWBXSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412042793	419581865	/nfs/dbraw/zinc/58/18/65/419581865.db2.gz	UMKDNEFYWOJEQQ-COPLHBTASA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000412042793	419581874	/nfs/dbraw/zinc/58/18/74/419581874.db2.gz	UMKDNEFYWOJEQQ-COPLHBTASA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1	ZINC000436338279	420321004	/nfs/dbraw/zinc/32/10/04/420321004.db2.gz	BRHJFFAQOSAFRF-NSHDSACASA-N	1	1	320.271	1.487	20	5		DDBDMO
CC1=CC[N@@H+](CCNc2c(C(N)=O)cccc2[N+](=O)[O-])CC1	ZINC000420610414	420330489	/nfs/dbraw/zinc/33/04/89/420330489.db2.gz	KALRYRJHWDIRPB-UHFFFAOYSA-N	1	1	304.350	1.758	20	5		DDBDMO
COc1cccc(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000436009896	420301169	/nfs/dbraw/zinc/30/11/69/420301169.db2.gz	WQFWEDXBHYCHOU-RYUDHWBXSA-N	1	1	319.361	1.960	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000450796662	420534429	/nfs/dbraw/zinc/53/44/29/420534429.db2.gz	VSRZMUQDTUYCGE-TXEJJXNPSA-N	1	1	309.370	1.395	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457080879	420606279	/nfs/dbraw/zinc/60/62/79/420606279.db2.gz	CMKPQCUFLJPDFI-LLVKDONJSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457080879	420606284	/nfs/dbraw/zinc/60/62/84/420606284.db2.gz	CMKPQCUFLJPDFI-LLVKDONJSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000457080879	420606288	/nfs/dbraw/zinc/60/62/88/420606288.db2.gz	CMKPQCUFLJPDFI-LLVKDONJSA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC1	ZINC000492693589	420631494	/nfs/dbraw/zinc/63/14/94/420631494.db2.gz	YZFLECDAPKBHBG-FWWRYZNZSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H](C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000452970832	420692088	/nfs/dbraw/zinc/69/20/88/420692088.db2.gz	GDMRKSNKBOJLPB-JRPNMDOOSA-N	1	1	321.352	2.000	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@@H](C3CC3)[C@@H]2C2CC2)c1	ZINC000453046872	420707887	/nfs/dbraw/zinc/70/78/87/420707887.db2.gz	YRHOZWOCLGIWTF-ILXRZTDVSA-N	1	1	306.366	1.273	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](CO)[C@@H]3CCCO3)nc2c1	ZINC000447902564	420812912	/nfs/dbraw/zinc/81/29/12/420812912.db2.gz	FKGKRJNAFDZGLW-RYUDHWBXSA-N	1	1	307.306	1.366	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000456346707	421146260	/nfs/dbraw/zinc/14/62/60/421146260.db2.gz	IZODHVMDSDDVTK-GFCCVEGCSA-N	1	1	306.366	1.855	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000456346707	421146262	/nfs/dbraw/zinc/14/62/62/421146262.db2.gz	IZODHVMDSDDVTK-GFCCVEGCSA-N	1	1	306.366	1.855	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CCC[N@H+]1CCCO	ZINC000450598114	421215594	/nfs/dbraw/zinc/21/55/94/421215594.db2.gz	PVHAEUPDKPHDDR-HNNXBMFYSA-N	1	1	323.393	2.000	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000546878070	421314559	/nfs/dbraw/zinc/31/45/59/421314559.db2.gz	BKQCDTDOSNFNRJ-NSHDSACASA-N	1	1	313.379	1.215	20	5		DDBDMO
COc1ccc(CC(=O)NCC[N@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000525291753	421284399	/nfs/dbraw/zinc/28/43/99/421284399.db2.gz	PWAZROBVYGLOJA-GFCCVEGCSA-N	1	1	321.377	1.604	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000525687617	421295827	/nfs/dbraw/zinc/29/58/27/421295827.db2.gz	KQTUUITZNGHMNM-UHFFFAOYSA-N	1	1	316.383	1.000	20	5		DDBDMO
COc1ccc(C[N@H+](C)CCN2CCCC2=O)cc1[N+](=O)[O-]	ZINC000549570800	421502393	/nfs/dbraw/zinc/50/23/93/421502393.db2.gz	DHJLSIPSCCFCHS-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCN2CCCC2=O)cc1[N+](=O)[O-]	ZINC000549570800	421502395	/nfs/dbraw/zinc/50/23/95/421502395.db2.gz	DHJLSIPSCCFCHS-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CN[C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418849	421506081	/nfs/dbraw/zinc/50/60/81/421506081.db2.gz	QINQVXDWMRYTBR-WFASDCNBSA-N	1	1	304.394	1.418	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CN[C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000563418849	421506082	/nfs/dbraw/zinc/50/60/82/421506082.db2.gz	QINQVXDWMRYTBR-WFASDCNBSA-N	1	1	304.394	1.418	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC1(C)C	ZINC000549743606	421506614	/nfs/dbraw/zinc/50/66/14/421506614.db2.gz	KILUMQLLWSXPAP-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000531634751	421641363	/nfs/dbraw/zinc/64/13/63/421641363.db2.gz	JOTPWECCMASVLG-RYUDHWBXSA-N	1	1	306.366	1.935	20	5		DDBDMO
O=C1NCC[C@@H]1CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000571893055	421750494	/nfs/dbraw/zinc/75/04/94/421750494.db2.gz	NQFDDMQGMSTPKE-LLVKDONJSA-N	1	1	305.334	1.315	20	5		DDBDMO
O=C1NCC[C@@H]1CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000571893055	421750495	/nfs/dbraw/zinc/75/04/95/421750495.db2.gz	NQFDDMQGMSTPKE-LLVKDONJSA-N	1	1	305.334	1.315	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000520766176	421761221	/nfs/dbraw/zinc/76/12/21/421761221.db2.gz	MPRKGDCUYGEORL-SECBINFHSA-N	1	1	319.317	1.290	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CCOCC1	ZINC000541349088	421791177	/nfs/dbraw/zinc/79/11/77/421791177.db2.gz	QHRWNWNTMHZFTP-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000557919986	421794891	/nfs/dbraw/zinc/79/48/91/421794891.db2.gz	LSUBYROQWPRWCX-GFCCVEGCSA-N	1	1	306.366	1.803	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000557919986	421794893	/nfs/dbraw/zinc/79/48/93/421794893.db2.gz	LSUBYROQWPRWCX-GFCCVEGCSA-N	1	1	306.366	1.803	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C2(CCCCC2)C1	ZINC000572977761	421890124	/nfs/dbraw/zinc/89/01/24/421890124.db2.gz	HMBZEIHYVAPDQV-UHFFFAOYSA-N	1	1	307.354	1.408	20	5		DDBDMO
Cc1nc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594591804	422351751	/nfs/dbraw/zinc/35/17/51/422351751.db2.gz	LGTFJSZVWXHBHU-SDDRHHMPSA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1nc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000594591804	422351756	/nfs/dbraw/zinc/35/17/56/422351756.db2.gz	LGTFJSZVWXHBHU-SDDRHHMPSA-N	1	1	308.382	2.208	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNc2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000596078371	422362469	/nfs/dbraw/zinc/36/24/69/422362469.db2.gz	UHDBSVTUHNALFY-TXEJJXNPSA-N	1	1	307.398	2.352	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@@H+]2CC[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000578480307	422578245	/nfs/dbraw/zinc/57/82/45/422578245.db2.gz	QGTYCKAIMVJGTO-GFCCVEGCSA-N	1	1	321.377	1.740	20	5		DDBDMO
C[C@@](O)(C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(F)(F)F	ZINC000578741026	422635899	/nfs/dbraw/zinc/63/58/99/422635899.db2.gz	BMMDREPXNWYHKL-LLVKDONJSA-N	1	1	318.255	1.874	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])s1	ZINC000345372494	272233517	/nfs/dbraw/zinc/23/35/17/272233517.db2.gz	RJUOOGFAXUSEFP-UHFFFAOYSA-N	1	1	314.411	1.270	20	5		DDBDMO
CN(CCCNC(=O)c1ccc([N+](=O)[O-])s1)CC[NH+](C)C	ZINC000345372494	272233520	/nfs/dbraw/zinc/23/35/20/272233520.db2.gz	RJUOOGFAXUSEFP-UHFFFAOYSA-N	1	1	314.411	1.270	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1C	ZINC000345901799	272361888	/nfs/dbraw/zinc/36/18/88/272361888.db2.gz	HYEOVJBUCXZQFD-NXEZZACHSA-N	1	1	309.370	1.191	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@H]1C	ZINC000345901799	272361889	/nfs/dbraw/zinc/36/18/89/272361889.db2.gz	HYEOVJBUCXZQFD-NXEZZACHSA-N	1	1	309.370	1.191	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[C@H](NC[C@@H]1C[NH2+]CCCO1)C1CC1	ZINC000423494111	275040126	/nfs/dbraw/zinc/04/01/26/275040126.db2.gz	RPTADJVHIPDEGC-HOTGVXAUSA-N	1	1	319.405	1.884	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@@H]3OCCN(C)[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000284699804	280225736	/nfs/dbraw/zinc/22/57/36/280225736.db2.gz	IJXQQJVAFCZVEJ-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+]C[C@@H]2C)c1C	ZINC000193360748	281015799	/nfs/dbraw/zinc/01/57/99/281015799.db2.gz	AOAOANVPDYIRRJ-JTQLQIEISA-N	1	1	313.379	1.194	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000101660549	281046216	/nfs/dbraw/zinc/04/62/16/281046216.db2.gz	VIDWCSGTIHSERX-UHFFFAOYSA-N	1	1	320.393	1.239	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@@H]1CCCCO1	ZINC000126038161	281224249	/nfs/dbraw/zinc/22/42/49/281224249.db2.gz	KGURSSPIIOIYIP-HOCLYGCPSA-N	1	1	324.377	1.835	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1	ZINC000170808197	298221909	/nfs/dbraw/zinc/22/19/09/298221909.db2.gz	ZWQSICPJOMLKJI-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000354021243	298341832	/nfs/dbraw/zinc/34/18/32/298341832.db2.gz	DDJMAAREGNVPKT-UHFFFAOYSA-N	1	1	317.349	1.462	20	5		DDBDMO
CCOC(=O)c1cc(C(=O)NCC[N@@H+](C)CC)cc([N+](=O)[O-])c1	ZINC000354027213	298343067	/nfs/dbraw/zinc/34/30/67/298343067.db2.gz	FVWINGBZIXPZPM-UHFFFAOYSA-N	1	1	323.349	1.453	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000363099274	300210595	/nfs/dbraw/zinc/21/05/95/300210595.db2.gz	FQVFTMVTMDHMAQ-QWHCGFSZSA-N	1	1	318.377	1.993	20	5		DDBDMO
CO[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000363651023	300292994	/nfs/dbraw/zinc/29/29/94/300292994.db2.gz	JNNXLBTWHYODGB-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ncc([N+](=O)[O-])s1	ZINC000369500096	301191403	/nfs/dbraw/zinc/19/14/03/301191403.db2.gz	JFXSERHBLDDAIU-JTQLQIEISA-N	1	1	312.395	1.741	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000533230222	303314225	/nfs/dbraw/zinc/31/42/25/303314225.db2.gz	YNSCCJALPQTSGY-SNVBAGLBSA-N	1	1	309.370	1.513	20	5		DDBDMO
C[N@@H+](CCNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000536010203	303353819	/nfs/dbraw/zinc/35/38/19/303353819.db2.gz	JMJSGJMGSUCERJ-UHFFFAOYSA-N	1	1	318.377	1.757	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000537272508	303372855	/nfs/dbraw/zinc/37/28/55/303372855.db2.gz	XIUHHEUPGOOVHQ-UHFFFAOYSA-N	1	1	304.350	1.656	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365115559	307059146	/nfs/dbraw/zinc/05/91/46/307059146.db2.gz	ZTSFIBGLJOAREM-BZNIZROVSA-N	1	1	319.361	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365115559	307059147	/nfs/dbraw/zinc/05/91/47/307059147.db2.gz	ZTSFIBGLJOAREM-BZNIZROVSA-N	1	1	319.361	1.769	20	5		DDBDMO
COC(=O)[C@]12CCC[C@@H]1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000376268386	307242053	/nfs/dbraw/zinc/24/20/53/307242053.db2.gz	VKHIKEGCHHZLGN-RISCZKNCSA-N	1	1	308.338	1.066	20	5		DDBDMO
CCN(C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301695	307242582	/nfs/dbraw/zinc/24/25/82/307242582.db2.gz	HTFUGVZZEAGRCO-XHSDSOJGSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000376301695	307242583	/nfs/dbraw/zinc/24/25/83/307242583.db2.gz	HTFUGVZZEAGRCO-XHSDSOJGSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301695	307242584	/nfs/dbraw/zinc/24/25/84/307242584.db2.gz	HTFUGVZZEAGRCO-XHSDSOJGSA-N	1	1	317.389	1.775	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000377553376	307272749	/nfs/dbraw/zinc/27/27/49/307272749.db2.gz	HTUALIWQXOAZLE-VIFPVBQESA-N	1	1	304.306	1.433	20	5		DDBDMO
C[C@@H]1CC[C@H](O)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000421021458	307300455	/nfs/dbraw/zinc/30/04/55/307300455.db2.gz	OBYSYWSVYKWLTO-AGIUHOORSA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CC3(CO)COC3)C2)cc1	ZINC000574129196	308261842	/nfs/dbraw/zinc/26/18/42/308261842.db2.gz	DCTQIXSBBOXCFO-AWEZNQCLSA-N	1	1	306.362	1.783	20	5		DDBDMO
O=C(c1c[nH]nc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1	ZINC000574140983	308262981	/nfs/dbraw/zinc/26/29/81/308262981.db2.gz	UXSJWIYNCUQMPY-LBPRGKRZSA-N	1	1	301.306	1.105	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000488727962	484215657	/nfs/dbraw/zinc/21/56/57/484215657.db2.gz	WZZVIZLGSRHLMJ-DGCLKSJQSA-N	1	1	319.361	1.187	20	5		DDBDMO
Cc1nn(C)c(N[C@H]2CC[N@@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000361680002	484522973	/nfs/dbraw/zinc/52/29/73/484522973.db2.gz	ASONWBOSDWKQJU-LBPRGKRZSA-N	1	1	322.413	1.217	20	5		DDBDMO
Cc1nn(C)c(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)c1[N+](=O)[O-]	ZINC000361680002	484522976	/nfs/dbraw/zinc/52/29/76/484522976.db2.gz	ASONWBOSDWKQJU-LBPRGKRZSA-N	1	1	322.413	1.217	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305766036	533899385	/nfs/dbraw/zinc/89/93/85/533899385.db2.gz	RFDFFFVWCCRSRD-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@H](CCCO)C2)c([N+](=O)[O-])c1	ZINC000452132181	534481094	/nfs/dbraw/zinc/48/10/94/534481094.db2.gz	QKFOHUREBNHZBC-NSHDSACASA-N	1	1	307.350	1.288	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444600644	528404712	/nfs/dbraw/zinc/40/47/12/528404712.db2.gz	CDPOKCOAXCUGLI-UHFFFAOYSA-N	1	1	306.322	1.856	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444600644	528404721	/nfs/dbraw/zinc/40/47/21/528404721.db2.gz	CDPOKCOAXCUGLI-UHFFFAOYSA-N	1	1	306.322	1.856	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000444169179	528514194	/nfs/dbraw/zinc/51/41/94/528514194.db2.gz	PADYPAHGUXEHEM-UHFFFAOYSA-N	1	1	315.395	1.603	20	5		DDBDMO
CC[N@@H+](CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)C1CC1	ZINC000736536113	598298581	/nfs/dbraw/zinc/29/85/81/598298581.db2.gz	CPKBYPJHYOFBAT-UHFFFAOYSA-N	1	1	317.353	1.671	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1nccc(-c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000821266424	607160893	/nfs/dbraw/zinc/16/08/93/607160893.db2.gz	CMFAQIRNQFHOPN-VIFPVBQESA-N	1	1	318.341	1.066	20	5		DDBDMO
COCCC[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000066371013	696351819	/nfs/dbraw/zinc/35/18/19/696351819.db2.gz	XCIXCEUPVCWWMS-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
C[N@H+](CCn1cccn1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000111169206	696642435	/nfs/dbraw/zinc/64/24/35/696642435.db2.gz	LMJNVCNNJMXLFA-UHFFFAOYSA-N	1	1	300.322	1.731	20	5		DDBDMO
C[N@@H+](CCn1cccn1)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000111169206	696642436	/nfs/dbraw/zinc/64/24/36/696642436.db2.gz	LMJNVCNNJMXLFA-UHFFFAOYSA-N	1	1	300.322	1.731	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000748348858	700112026	/nfs/dbraw/zinc/11/20/26/700112026.db2.gz	LGLJULVIDNMLQN-NSHDSACASA-N	1	1	307.350	1.308	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000748348858	700112027	/nfs/dbraw/zinc/11/20/27/700112027.db2.gz	LGLJULVIDNMLQN-NSHDSACASA-N	1	1	307.350	1.308	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC1(O)CCOCC1	ZINC000781966865	698667632	/nfs/dbraw/zinc/66/76/32/698667632.db2.gz	QBAGZWNZCPXVFM-CQSZACIVSA-N	1	1	310.350	1.102	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000801911956	700351875	/nfs/dbraw/zinc/35/18/75/700351875.db2.gz	WNCUUOLZMFWUOS-BDAKNGLRSA-N	1	1	310.329	1.529	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCCn2cc[nH+]c2C(C)C)n1	ZINC000756829282	700642944	/nfs/dbraw/zinc/64/29/44/700642944.db2.gz	JZLOGHWQLFHGHU-UHFFFAOYSA-N	1	1	320.353	1.561	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc(F)cc(C)c1[N+](=O)[O-]	ZINC000758476049	700707578	/nfs/dbraw/zinc/70/75/78/700707578.db2.gz	XUNFANOETFPWQG-UHFFFAOYSA-N	1	1	306.297	1.977	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000762817734	700908508	/nfs/dbraw/zinc/90/85/08/700908508.db2.gz	KAPANDQTRBKPAG-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCC1	ZINC000769751123	701254669	/nfs/dbraw/zinc/25/46/69/701254669.db2.gz	DUTHMOIRFWEPGL-UHFFFAOYSA-N	1	1	303.322	1.359	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2C[C@@H]3CC[C@H](O)C[C@@H]3C2)cc1	ZINC000839663796	701771837	/nfs/dbraw/zinc/77/18/37/701771837.db2.gz	JRWHDFDVFYUKGO-LQKXBSAESA-N	1	1	306.362	1.721	20	5		DDBDMO
COc1ccc([C@H](C[NH+](C)C)NC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC000839759862	701814170	/nfs/dbraw/zinc/81/41/70/701814170.db2.gz	DSWSKDCVFRFDCM-HZSPNIEDSA-N	1	1	307.350	1.079	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@](O)(C(F)F)C2)cc1	ZINC000831175544	706650380	/nfs/dbraw/zinc/65/03/80/706650380.db2.gz	LMYQXBGVAGAOLT-WCQYABFASA-N	1	1	302.277	1.330	20	5		DDBDMO
CN(CCN1CC[NH2+]CC1)Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000843052955	702809303	/nfs/dbraw/zinc/80/93/03/702809303.db2.gz	QGFMBRHGGQYSBQ-UHFFFAOYSA-N	1	1	312.801	1.585	20	5		DDBDMO
CON1CC[NH+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1	ZINC000846975861	703359797	/nfs/dbraw/zinc/35/97/97/703359797.db2.gz	DANDXLIGALDSNF-UHFFFAOYSA-N	1	1	322.365	1.411	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(C3(C)OCCO3)CC2)c1[N+](=O)[O-]	ZINC000851853496	703871445	/nfs/dbraw/zinc/87/14/45/703871445.db2.gz	JACHWQZQSKBRPJ-UHFFFAOYSA-N	1	1	311.338	1.866	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972942	704038879	/nfs/dbraw/zinc/03/88/79/704038879.db2.gz	PHWLLUZTRRYJAF-MLGOLLRUSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[N@@H+](C3CC3)C2)c1	ZINC000818972942	704038883	/nfs/dbraw/zinc/03/88/83/704038883.db2.gz	PHWLLUZTRRYJAF-MLGOLLRUSA-N	1	1	305.378	1.702	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[N@H+](C3CC3)C2)c1	ZINC000818972942	704038885	/nfs/dbraw/zinc/03/88/85/704038885.db2.gz	PHWLLUZTRRYJAF-MLGOLLRUSA-N	1	1	305.378	1.702	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCS1	ZINC000870881616	704155767	/nfs/dbraw/zinc/15/57/67/704155767.db2.gz	CUIAKVXXBIZNSV-QMTHXVAHSA-N	1	1	309.391	1.733	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](Cn1ncc3cc([N+](=O)[O-])ccc31)C2	ZINC000853565543	704271962	/nfs/dbraw/zinc/27/19/62/704271962.db2.gz	HBZNGGOPEKKTDR-IUODEOHRSA-N	1	1	302.334	1.870	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000853587965	704277543	/nfs/dbraw/zinc/27/75/43/704277543.db2.gz	OZXYYWZDBUJWDI-MNOVXSKESA-N	1	1	319.317	1.429	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC[C@@H]2COC[C@@H]2C1	ZINC000853587965	704277544	/nfs/dbraw/zinc/27/75/44/704277544.db2.gz	OZXYYWZDBUJWDI-MNOVXSKESA-N	1	1	319.317	1.429	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1	ZINC000853965042	704341515	/nfs/dbraw/zinc/34/15/15/704341515.db2.gz	CWTZKGAOCCEMDJ-ZDUSSCGKSA-N	1	1	306.366	1.212	20	5		DDBDMO
Cc1c(C(=O)O[C@H]2C[C@@H]([NH+]3CCOCC3)C2)cccc1[N+](=O)[O-]	ZINC000821587663	704425408	/nfs/dbraw/zinc/42/54/08/704425408.db2.gz	HIVMBIFKNKSXQR-BETUJISGSA-N	1	1	320.345	1.923	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000855165889	704471859	/nfs/dbraw/zinc/47/18/59/704471859.db2.gz	ZTRFKZQOFIPPEU-VIFPVBQESA-N	1	1	324.356	1.919	20	5		DDBDMO
CCON(CC)C(=O)C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000858219814	704680170	/nfs/dbraw/zinc/68/01/70/704680170.db2.gz	ZRKJFVIBXXLSKE-UHFFFAOYSA-N	1	1	311.338	1.493	20	5		DDBDMO
CC[C@@H]([NH3+])c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1	ZINC000823147099	705152938	/nfs/dbraw/zinc/15/29/38/705152938.db2.gz	VYLRDLJRRJJPAD-SNVBAGLBSA-N	1	1	322.321	1.996	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CC[C@H]2[C@@H]1CCC[N@@H+]2C	ZINC000874842458	705197706	/nfs/dbraw/zinc/19/77/06/705197706.db2.gz	HSLDRILZNQFZLX-STQMWFEESA-N	1	1	321.381	1.185	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@@H]21	ZINC000827278209	705967334	/nfs/dbraw/zinc/96/73/34/705967334.db2.gz	VDUYPHRLGNACGD-HZMBPMFUSA-N	1	1	304.350	1.343	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328920	705976402	/nfs/dbraw/zinc/97/64/02/705976402.db2.gz	FTMIGKANZPNMFK-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328920	705976403	/nfs/dbraw/zinc/97/64/03/705976403.db2.gz	FTMIGKANZPNMFK-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827328920	705976404	/nfs/dbraw/zinc/97/64/04/705976404.db2.gz	FTMIGKANZPNMFK-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000881846503	707391354	/nfs/dbraw/zinc/39/13/54/707391354.db2.gz	LNGNWQKKNJUSIN-CYBMUJFWSA-N	1	1	318.377	1.993	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH+]2[C@H](CO)CC[C@H]2CO)c1	ZINC000878883643	706524612	/nfs/dbraw/zinc/52/46/12/706524612.db2.gz	YXMGHAMKUVPTFX-RYUDHWBXSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](CC(C)(C)O)C2)c1	ZINC000865996190	706588395	/nfs/dbraw/zinc/58/83/95/706588395.db2.gz	CUYOVKSCOAIZKG-NSHDSACASA-N	1	1	309.366	1.861	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000879963214	706835964	/nfs/dbraw/zinc/83/59/64/706835964.db2.gz	HFZJRASPROHBAM-LBPRGKRZSA-N	1	1	309.366	1.239	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3nccs3)C2)c1	ZINC000880318446	706939311	/nfs/dbraw/zinc/93/93/11/706939311.db2.gz	ZEQFUSSTOJCZJY-PWSUYJOCSA-N	1	1	323.378	1.098	20	5		DDBDMO
NC(=O)C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000880392732	706962094	/nfs/dbraw/zinc/96/20/94/706962094.db2.gz	JHIGORMMVAWRII-UHFFFAOYSA-N	1	1	307.350	1.104	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ccc4ncc([N+](=O)[O-])n4n3)C[C@]2(C)C1	ZINC000896914717	708181699	/nfs/dbraw/zinc/18/16/99/708181699.db2.gz	QCMVRPJSZLQMFE-YGRLFVJLSA-N	1	1	302.338	1.025	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[C@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897219486	708257526	/nfs/dbraw/zinc/25/75/26/708257526.db2.gz	LDJGUJPJMUMFSS-STQMWFEESA-N	1	1	321.377	1.639	20	5		DDBDMO
Cn1cc(C[C@H]2CC[N@@H+](Cc3cccnc3[N+](=O)[O-])C2)cn1	ZINC000886030126	708684993	/nfs/dbraw/zinc/68/49/93/708684993.db2.gz	GWKBFGCEBCBNCQ-GFCCVEGCSA-N	1	1	301.350	1.788	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H](N2CCOCC2)C1	ZINC000886220301	708717723	/nfs/dbraw/zinc/71/77/23/708717723.db2.gz	GEFRBSDXYDCFIL-AWEZNQCLSA-N	1	1	306.366	1.286	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](N2CCOCC2)C1	ZINC000886220301	708717725	/nfs/dbraw/zinc/71/77/25/708717725.db2.gz	GEFRBSDXYDCFIL-AWEZNQCLSA-N	1	1	306.366	1.286	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000887926380	709166306	/nfs/dbraw/zinc/16/63/06/709166306.db2.gz	HDBPGZONABZLEY-MEDUHNTESA-N	1	1	319.361	1.627	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)C[C@]2(C)C1	ZINC000887932081	709169690	/nfs/dbraw/zinc/16/96/90/709169690.db2.gz	UNQKLGKNWUIXGJ-BMIGLBTASA-N	1	1	304.350	1.201	20	5		DDBDMO
CC(C)(CCC(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)[N+](=O)[O-]	ZINC000928084739	713122042	/nfs/dbraw/zinc/12/20/42/713122042.db2.gz	XPRKLSFGLPZEPD-NEPJUHHUSA-N	1	1	315.439	1.518	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1C	ZINC000928438952	713196528	/nfs/dbraw/zinc/19/65/28/713196528.db2.gz	VFZNLKJHLJPXBT-GHMZBOCLSA-N	1	1	307.350	1.816	20	5		DDBDMO
COc1c(O)ccc(CN2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000893668094	710769748	/nfs/dbraw/zinc/76/97/48/710769748.db2.gz	CXBDJEYSERJQBN-WDEREUQCSA-N	1	1	309.366	1.833	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)C1CN(C)CC[N@@H+](C)C1	ZINC000911502693	710826132	/nfs/dbraw/zinc/82/61/32/710826132.db2.gz	SWQIFPMBFBTQPK-UHFFFAOYSA-N	1	1	321.381	1.068	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000894395848	711101730	/nfs/dbraw/zinc/10/17/30/711101730.db2.gz	BZEASVCPSMRHBF-HIFRSBDPSA-N	1	1	318.377	1.749	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1[N+](=O)[O-]	ZINC000895444178	711513910	/nfs/dbraw/zinc/51/39/10/711513910.db2.gz	RFGFWHZJYRQKMC-VXGBXAGGSA-N	1	1	308.334	1.777	20	5		DDBDMO
C[C@@H]1[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737534	711590809	/nfs/dbraw/zinc/59/08/09/711590809.db2.gz	AZFLAUXCEGRXHF-MFKMUULPSA-N	1	1	318.377	1.992	20	5		DDBDMO
C[C@H]1[C@@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737532	711590918	/nfs/dbraw/zinc/59/09/18/711590918.db2.gz	AZFLAUXCEGRXHF-GWCFXTLKSA-N	1	1	318.377	1.992	20	5		DDBDMO
C[C@H]1[C@H](Nc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)CC[N@H+]1C	ZINC000895739553	711591815	/nfs/dbraw/zinc/59/18/15/711591815.db2.gz	GWAMZUUMLUEGIS-DTWKUNHWSA-N	1	1	306.322	1.430	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]2C1	ZINC000931435389	714096740	/nfs/dbraw/zinc/09/67/40/714096740.db2.gz	ACICZPARHJHDPL-YPMHNXCESA-N	1	1	320.349	1.887	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)CN1CCn2cc[nH+]c21	ZINC000931521724	714118348	/nfs/dbraw/zinc/11/83/48/714118348.db2.gz	OCZYFJPWNFYPKC-LLVKDONJSA-N	1	1	304.306	1.051	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000931721894	714168706	/nfs/dbraw/zinc/16/87/06/714168706.db2.gz	WPQWWTOELQBWDM-NUEKZKHPSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000923281343	714296437	/nfs/dbraw/zinc/29/64/37/714296437.db2.gz	PEZGXCBWOPZBDO-DZGCQCFKSA-N	1	1	303.362	1.832	20	5		DDBDMO
COc1ccccc1NC(=O)[C@H]1CCC[N@@H+](CC[N+](=O)[O-])C1	ZINC000932631791	714370406	/nfs/dbraw/zinc/37/04/06/714370406.db2.gz	IHOASLAQCSZGSF-LBPRGKRZSA-N	1	1	307.350	1.622	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933216259	714538890	/nfs/dbraw/zinc/53/88/90/714538890.db2.gz	GNXQRYJQEYQTHY-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933216259	714538892	/nfs/dbraw/zinc/53/88/92/714538892.db2.gz	GNXQRYJQEYQTHY-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
COC[C@@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000933326323	714562898	/nfs/dbraw/zinc/56/28/98/714562898.db2.gz	ADWJTAFKSDLMMV-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000933326323	714562900	/nfs/dbraw/zinc/56/29/00/714562900.db2.gz	ADWJTAFKSDLMMV-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C1(CNC(=O)OC(C)(C)C)CCOCC1	ZINC000933502069	714604834	/nfs/dbraw/zinc/60/48/34/714604834.db2.gz	KVZKKZLYTXSXAB-UHFFFAOYSA-N	1	1	317.386	1.269	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCO[C@@H]3COCC[C@@H]32)cc1	ZINC000933968242	714711125	/nfs/dbraw/zinc/71/11/25/714711125.db2.gz	JAPJXAUENBILAL-JKSUJKDBSA-N	1	1	322.361	1.853	20	5		DDBDMO
CN1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC[N@@H+](C)CC1	ZINC000933995142	714717607	/nfs/dbraw/zinc/71/76/07/714717607.db2.gz	AEDUVOXQWRMANH-UHFFFAOYSA-N	1	1	310.373	1.413	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H]2CC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000934121146	714747346	/nfs/dbraw/zinc/74/73/46/714747346.db2.gz	KOUPFODPQIFTKG-JSGCOSHPSA-N	1	1	323.349	1.651	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@H]2CC[C@@H]2OC)c([N+](=O)[O-])c1	ZINC000934121146	714747347	/nfs/dbraw/zinc/74/73/47/714747347.db2.gz	KOUPFODPQIFTKG-JSGCOSHPSA-N	1	1	323.349	1.651	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934258284	714777427	/nfs/dbraw/zinc/77/74/27/714777427.db2.gz	CMKGNSJLIGXJAX-HZPDHXFCSA-N	1	1	323.368	1.765	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)N(C)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000925345680	714822550	/nfs/dbraw/zinc/82/25/50/714822550.db2.gz	XRTKDYAZUDWVDN-WFASDCNBSA-N	1	1	320.393	1.871	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)c1	ZINC000934832313	714912824	/nfs/dbraw/zinc/91/28/24/714912824.db2.gz	AXMPUKYQDCYDRH-UONOGXRCSA-N	1	1	308.382	1.930	20	5		DDBDMO
CCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)CC1	ZINC000957550318	715950774	/nfs/dbraw/zinc/95/07/74/715950774.db2.gz	VGOHECLSDFASFE-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1=CCCCC1	ZINC001029304718	740550682	/nfs/dbraw/zinc/55/06/82/740550682.db2.gz	HHONPVXIBCACKI-QKPAOTATSA-N	1	1	319.405	1.827	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CC1=CCCCC1	ZINC001029304718	740550685	/nfs/dbraw/zinc/55/06/85/740550685.db2.gz	HHONPVXIBCACKI-QKPAOTATSA-N	1	1	319.405	1.827	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1=CCCCC1	ZINC001029304718	740550686	/nfs/dbraw/zinc/55/06/86/740550686.db2.gz	HHONPVXIBCACKI-QKPAOTATSA-N	1	1	319.405	1.827	20	5		DDBDMO
CC(C)c1ccccc1C[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126938940	742887428	/nfs/dbraw/zinc/88/74/28/742887428.db2.gz	OHDTVSGSULQTJZ-HUUCEWRRSA-N	1	1	305.378	1.681	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@H](CO)[C@@H](CCO)C2)ccc1[N+](=O)[O-]	ZINC001198755070	747599608	/nfs/dbraw/zinc/59/96/08/747599608.db2.gz	XGCAVCLQPDNHCO-UONOGXRCSA-N	1	1	324.377	1.416	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NC/C=C\CNc1ccc([N+](=O)[O-])cn1	ZINC001107234056	749664019	/nfs/dbraw/zinc/66/40/19/749664019.db2.gz	WMEJFWXVVRDHJO-PLNGDYQASA-N	1	1	321.381	1.414	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)no1	ZINC001034642330	750625026	/nfs/dbraw/zinc/62/50/26/750625026.db2.gz	AQSYICAJBARPTN-HBJVGIJOSA-N	1	1	322.365	1.165	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CCC3)C2)CC1	ZINC001035187208	751287784	/nfs/dbraw/zinc/28/77/84/751287784.db2.gz	QGFDBTDEIIFYOY-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CC3CCC3)C2)CC1	ZINC001035187208	751287789	/nfs/dbraw/zinc/28/77/89/751287789.db2.gz	QGFDBTDEIIFYOY-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CCC3)C2)CC1	ZINC001035187208	751287793	/nfs/dbraw/zinc/28/77/93/751287793.db2.gz	QGFDBTDEIIFYOY-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CCOC[C@](O)(C(F)(F)F)C2)C1	ZINC001169014419	762178976	/nfs/dbraw/zinc/17/89/76/762178976.db2.gz	ZLZOUOGVAZSCLT-MXWKQRLJSA-N	1	1	312.288	1.057	20	5		DDBDMO
Cc1ncccc1C[NH2+][C@H]1C[C@@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086083445	760943640	/nfs/dbraw/zinc/94/36/40/760943640.db2.gz	YYLKSSJLJARPOH-FAAHXZRKSA-N	1	1	318.377	1.040	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2C[C@@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328788	766253607	/nfs/dbraw/zinc/25/36/07/766253607.db2.gz	MRXPYYZXZXWRNB-DRZSPHRISA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2C[C@@H](F)C[C@H]2CO)c([N+](=O)[O-])c1	ZINC001170328788	766253613	/nfs/dbraw/zinc/25/36/13/766253613.db2.gz	MRXPYYZXZXWRNB-DRZSPHRISA-N	1	1	312.341	1.939	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CC[C@@H](NC(C)=O)C2)c([N+](=O)[O-])c1	ZINC001170354406	766260194	/nfs/dbraw/zinc/26/01/94/766260194.db2.gz	KUXFFEQXLMAXRJ-BXUZGUMPSA-N	1	1	321.377	1.745	20	5		DDBDMO
Cc1c(CC[NH3+])c(=O)[nH]n1-c1ccc2ncccc2c1[N+](=O)[O-]	ZINC001170342987	766275120	/nfs/dbraw/zinc/27/51/20/766275120.db2.gz	OAVPMOWSIOOPPQ-UHFFFAOYSA-N	1	1	313.317	1.844	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2C[C@H]3CN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])C[C@H]3C2)C1	ZINC001048814551	769933278	/nfs/dbraw/zinc/93/32/78/769933278.db2.gz	RMQMIBBCIHSOKL-LXTVHRRPSA-N	1	1	321.421	1.478	20	5		DDBDMO
CC1(C)CC(C[N@H+]2C[C@H]3CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@H]3C2)C1	ZINC001048814551	769933288	/nfs/dbraw/zinc/93/32/88/769933288.db2.gz	RMQMIBBCIHSOKL-LXTVHRRPSA-N	1	1	321.421	1.478	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2C[C@H]3CN(C(=O)[C@@H]4CC4[N+](=O)[O-])C[C@H]3C2)C1	ZINC001048814551	769933297	/nfs/dbraw/zinc/93/32/97/769933297.db2.gz	RMQMIBBCIHSOKL-LXTVHRRPSA-N	1	1	321.421	1.478	20	5		DDBDMO
CC[N@H+](C)CCC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001146718835	772926089	/nfs/dbraw/zinc/92/60/89/772926089.db2.gz	HGNNDRNLCYSWOU-UHFFFAOYSA-N	1	1	308.382	1.142	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNCc1ccccc1[N+](=O)[O-]	ZINC001146718835	772926091	/nfs/dbraw/zinc/92/60/91/772926091.db2.gz	HGNNDRNLCYSWOU-UHFFFAOYSA-N	1	1	308.382	1.142	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ccc([N+](=O)[O-])c(C)c1	ZINC001093840794	775125248	/nfs/dbraw/zinc/12/52/48/775125248.db2.gz	WWVFQDKQFXEXFF-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001094008753	775326286	/nfs/dbraw/zinc/32/62/86/775326286.db2.gz	WSZRYXHBMOJAJQ-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNc1ccc([N+](=O)[O-])cn1)CC(C)(C)C	ZINC001094141380	775525585	/nfs/dbraw/zinc/52/55/85/775525585.db2.gz	STVPTCMLJOKBPH-UHFFFAOYSA-N	1	1	323.397	1.496	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2CCOC2)CC1	ZINC001173224864	777059414	/nfs/dbraw/zinc/05/94/14/777059414.db2.gz	HLLUUNVAUXLRFI-WMLDXEAASA-N	1	1	319.405	1.932	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCC1(Nc2ncccc2[N+](=O)[O-])CC1	ZINC001110193774	778067563	/nfs/dbraw/zinc/06/75/63/778067563.db2.gz	XITSGDVAXPSAMF-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
Cc1n[nH]c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1C	ZINC001179353393	779341965	/nfs/dbraw/zinc/34/19/65/779341965.db2.gz	QPLQMPALFVGWAC-OAHLLOKOSA-N	1	1	304.350	1.932	20	5		DDBDMO
C[N@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1cccc([N+](=O)[O-])c1	ZINC001267208273	837536098	/nfs/dbraw/zinc/53/60/98/837536098.db2.gz	ZOHQXHAJCIQYTP-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1cccc([N+](=O)[O-])c1	ZINC001267208273	837536102	/nfs/dbraw/zinc/53/61/02/837536102.db2.gz	ZOHQXHAJCIQYTP-UHFFFAOYSA-N	1	1	320.324	1.924	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC001327616166	862320705	/nfs/dbraw/zinc/32/07/05/862320705.db2.gz	KNTJAEAFWZBBBN-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
O=C(NC1(C[NH2+]CC2CCC2)CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001276199910	854947363	/nfs/dbraw/zinc/94/73/63/854947363.db2.gz	HRSONECDQGWFLC-ZIAGYGMSSA-N	1	1	309.410	1.860	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)OCCOc1ccc([N+](=O)[O-])cc1	ZINC001224776861	881529612	/nfs/dbraw/zinc/52/96/12/881529612.db2.gz	GGONNRTXRQVWQA-CYBMUJFWSA-N	1	1	310.350	1.711	20	5		DDBDMO
Cc1ccccc1OCC[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157775681	864130752	/nfs/dbraw/zinc/13/07/52/864130752.db2.gz	WGLPGZYHLUEHNB-ZIAGYGMSSA-N	1	1	321.377	1.135	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@H+]2CC[C@@H]2C1	ZINC001158433928	864652665	/nfs/dbraw/zinc/65/26/65/864652665.db2.gz	PUWMYHJYRPSINR-SNVBAGLBSA-N	1	1	306.322	1.061	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCNC1=O	ZINC001320080722	866458072	/nfs/dbraw/zinc/45/80/72/866458072.db2.gz	LLIAVZGHETUNQD-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCNC1=O	ZINC001320080722	866458077	/nfs/dbraw/zinc/45/80/77/866458077.db2.gz	LLIAVZGHETUNQD-ZIAGYGMSSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c(C)c1	ZINC001323440668	866611824	/nfs/dbraw/zinc/61/18/24/866611824.db2.gz	BZOKKJXVMJXCHY-HUUCEWRRSA-N	1	1	317.389	1.707	20	5		DDBDMO
COc1ccc(NCCC[NH+]2CCN(C)CC2)nc1[N+](=O)[O-]	ZINC001161700495	866902136	/nfs/dbraw/zinc/90/21/36/866902136.db2.gz	FZKSKEFHXFKSBV-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC001322404725	868154794	/nfs/dbraw/zinc/15/47/94/868154794.db2.gz	BRJGBTJJKKOTEA-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCCC[C@@H]2CO)ncc1[N+](=O)[O-]	ZINC001163552210	868524792	/nfs/dbraw/zinc/52/47/92/868524792.db2.gz	BZABAXLTIXTERD-STMXVASLSA-N	1	1	306.366	1.873	20	5		DDBDMO
Cc1[nH]c(CNc2ccc([N+](=O)[O-])cc2S(C)(=O)=O)c(C)[nH+]1	ZINC001164181775	868998072	/nfs/dbraw/zinc/99/80/72/868998072.db2.gz	HNKUXRFHQWOXSL-UHFFFAOYSA-N	1	1	324.362	1.950	20	5		DDBDMO
C[N@@H+](C1CN(c2nccc(Cl)c2[N+](=O)[O-])C1)[C@@H]1CCOC1	ZINC001165204105	869426238	/nfs/dbraw/zinc/42/62/38/869426238.db2.gz	UDFUAOPTSRRWEJ-SECBINFHSA-N	1	1	312.757	1.553	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3nc4ccccn4c3[N+](=O)[O-])[C@H]2C1	ZINC001338161459	869841207	/nfs/dbraw/zinc/84/12/07/869841207.db2.gz	CNOLYLVQGTYZJV-SDDRHHMPSA-N	1	1	301.350	1.995	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)N2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001339085890	870337591	/nfs/dbraw/zinc/33/75/91/870337591.db2.gz	HMYUFMZTQLKAOI-INIZCTEOSA-N	1	1	319.361	1.284	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c(N)c1F)[C@H]1C[N@@H+](C)CCN1C	ZINC001348311187	874476311	/nfs/dbraw/zinc/47/63/11/874476311.db2.gz	GOTGLUQOPDFAET-BXKDBHETSA-N	1	1	311.361	1.362	20	5		DDBDMO
C[N@H+]1CC[C@@H](Oc2ccc(Br)nc2[N+](=O)[O-])C1	ZINC001227257546	882937353	/nfs/dbraw/zinc/93/73/53/882937353.db2.gz	GPUXVINVWWIVTI-SSDOTTSWSA-N	1	1	302.128	1.835	20	5		DDBDMO
NC(=O)c1cc(N2CCC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC001350441022	875691753	/nfs/dbraw/zinc/69/17/53/875691753.db2.gz	OYDUAHJYZYJKBT-GFCCVEGCSA-N	1	1	304.350	1.368	20	5		DDBDMO
CCCSc1nc(O[C@H]2C[NH2+]C[C@@H]2F)c([N+](=O)[O-])c(=O)[nH]1	ZINC001218020329	877374825	/nfs/dbraw/zinc/37/48/25/877374825.db2.gz	QBXFQMXUYGCWOW-BQBZGAKWSA-N	1	1	318.330	1.281	20	5		DDBDMO
CCOC(=O)c1ccc(CO[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001223963839	881164741	/nfs/dbraw/zinc/16/47/41/881164741.db2.gz	RFBXIBAZEWJWCG-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@H]1CC(=O)C2	ZINC001227744020	883153259	/nfs/dbraw/zinc/15/32/59/883153259.db2.gz	CRXUNZOJYMMNGX-CUOATXAZSA-N	1	1	316.317	1.654	20	5		DDBDMO
OC[C@@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)CC[C@H]1O	ZINC001232218313	886166378	/nfs/dbraw/zinc/16/63/78/886166378.db2.gz	FUPHJKIPJQJFDN-DOTOQJQBSA-N	1	1	323.396	1.958	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@@H+]3CC[C@@H](F)[C@@H](O)C3)CC2)cc1	ZINC001254476029	896456851	/nfs/dbraw/zinc/45/68/51/896456851.db2.gz	JRDYLFDMQZAHSL-CVEARBPZSA-N	1	1	323.368	1.968	20	5		DDBDMO
Cc1cc(N(C(N)=[NH2+])[C@H](C)Cc2ccccc2[N+](=O)[O-])[nH]n1	ZINC001254550853	896498959	/nfs/dbraw/zinc/49/89/59/896498959.db2.gz	SHNHGRZTBUZGMN-SNVBAGLBSA-N	1	1	302.338	1.957	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H](N2CCOCC2)C1	ZINC001254562873	896500630	/nfs/dbraw/zinc/50/06/30/896500630.db2.gz	QKPRWMRYZQAKBV-GDBMZVCRSA-N	1	1	319.405	1.932	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@@H](N3CCOCC3)C1)C2	ZINC001254601425	896525047	/nfs/dbraw/zinc/52/50/47/896525047.db2.gz	ZSBKLWOGNIYUIX-IAGOWNOFSA-N	1	1	317.389	1.469	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000495250808	529442476	/nfs/dbraw/zinc/44/24/76/529442476.db2.gz	JKFUQLFBXJVLEQ-ZFWWWQNUSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)c1ccc([N+](=O)[O-])cc1	ZINC000452347586	231356066	/nfs/dbraw/zinc/35/60/66/231356066.db2.gz	IYHRNZVZMMJIJJ-AWEZNQCLSA-N	1	1	307.350	1.171	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCCSCC1)c1ccc([N+](=O)[O-])cc1	ZINC000089985404	185274681	/nfs/dbraw/zinc/27/46/81/185274681.db2.gz	UTZYGJRMLTWTCR-UHFFFAOYSA-N	1	1	309.391	1.997	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCSCC1)c1ccc([N+](=O)[O-])cc1	ZINC000089985404	185274682	/nfs/dbraw/zinc/27/46/82/185274682.db2.gz	UTZYGJRMLTWTCR-UHFFFAOYSA-N	1	1	309.391	1.997	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)c1ncc([N+](=O)[O-])cn1	ZINC000286607748	219080753	/nfs/dbraw/zinc/08/07/53/219080753.db2.gz	SYPNLVOITRPWQY-UHFFFAOYSA-N	1	1	305.338	1.936	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3ncc([N+](=O)[O-])cc3C(N)=O)C2)C1	ZINC000292819013	530065616	/nfs/dbraw/zinc/06/56/16/530065616.db2.gz	OTCJIYDFULUHKX-HNNXBMFYSA-N	1	1	319.365	1.011	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)N1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000457813589	232135108	/nfs/dbraw/zinc/13/51/08/232135108.db2.gz	CIPBBVICQPCQAX-UHFFFAOYSA-N	1	1	316.317	1.521	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000279703197	215075148	/nfs/dbraw/zinc/07/51/48/215075148.db2.gz	JHOHREBVFUXREU-AWEZNQCLSA-N	1	1	323.393	1.626	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cccc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC000272616697	210016125	/nfs/dbraw/zinc/01/61/25/210016125.db2.gz	LHZIWVGJOXKKOY-ZWNOBZJWSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000272606285	210004375	/nfs/dbraw/zinc/00/43/75/210004375.db2.gz	JRFRMVBCCCPRSP-HIFRSBDPSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000280018160	215316064	/nfs/dbraw/zinc/31/60/64/215316064.db2.gz	KGJLCEAQBQMINA-CZUORRHYSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[NH+](C)Cc1cc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])ccc1F	ZINC000159628888	186131939	/nfs/dbraw/zinc/13/19/39/186131939.db2.gz	XUUYQKIJYSDYOX-UHFFFAOYSA-N	1	1	321.312	1.449	20	5		DDBDMO
CC(C)(O)C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000189946004	186253400	/nfs/dbraw/zinc/25/34/00/186253400.db2.gz	BSFBPXXAWMFSMN-CYBMUJFWSA-N	1	1	324.377	1.570	20	5		DDBDMO
CC[N@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000024670868	352191205	/nfs/dbraw/zinc/19/12/05/352191205.db2.gz	RHWWFSMIHABCNQ-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
CC[N@@H+](CCO)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000024670868	352191208	/nfs/dbraw/zinc/19/12/08/352191208.db2.gz	RHWWFSMIHABCNQ-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCO[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000026342662	352208121	/nfs/dbraw/zinc/20/81/21/352208121.db2.gz	PQFVCBKEVURODA-LLVKDONJSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCO[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000026342662	352208124	/nfs/dbraw/zinc/20/81/24/352208124.db2.gz	PQFVCBKEVURODA-LLVKDONJSA-N	1	1	307.350	1.953	20	5		DDBDMO
O=C(COc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000331719398	234041192	/nfs/dbraw/zinc/04/11/92/234041192.db2.gz	QXIRWGVNCCZTAQ-HUUCEWRRSA-N	1	1	319.361	1.717	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000072858394	191239908	/nfs/dbraw/zinc/23/99/08/191239908.db2.gz	BTYNGUTYUDSHKK-GFCCVEGCSA-N	1	1	320.393	1.467	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)NCCC[NH+]1CCOCC1	ZINC000061469755	352887299	/nfs/dbraw/zinc/88/72/99/352887299.db2.gz	SRPGXOWJNZOBNP-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
C[C@H](CNC(=O)COc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000068219491	353096859	/nfs/dbraw/zinc/09/68/59/353096859.db2.gz	VYWDVVUVJBBHSZ-LLVKDONJSA-N	1	1	307.350	1.573	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCc3ccccc3C2)c1	ZINC000173712840	198243615	/nfs/dbraw/zinc/24/36/15/198243615.db2.gz	YNZWNYLWNZFDAY-MRXNPFEDSA-N	1	1	316.361	1.601	20	5		DDBDMO
CCC[N@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000072953257	353227172	/nfs/dbraw/zinc/22/71/72/353227172.db2.gz	MKBUKFPVVMWQMA-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000072953257	353227176	/nfs/dbraw/zinc/22/71/76/353227176.db2.gz	MKBUKFPVVMWQMA-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000174313592	198318286	/nfs/dbraw/zinc/31/82/86/198318286.db2.gz	WJDZJRWWWCUWAE-NWDGAFQWSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1c(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000174313592	198318288	/nfs/dbraw/zinc/31/82/88/198318288.db2.gz	WJDZJRWWWCUWAE-NWDGAFQWSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1nn(C)c(N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074772863	353330382	/nfs/dbraw/zinc/33/03/82/353330382.db2.gz	DNZXIRVVONSORZ-CYBMUJFWSA-N	1	1	307.398	1.805	20	5		DDBDMO
Cc1cc(N2CC[NH+](C[C@@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC000074726073	353327025	/nfs/dbraw/zinc/32/70/25/353327025.db2.gz	BKXYGDOAIZAATQ-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174654226	198365312	/nfs/dbraw/zinc/36/53/12/198365312.db2.gz	CRGOYXDNJYOEHV-AWEZNQCLSA-N	1	1	320.349	1.163	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCc3sccc3C2)c1	ZINC000174702839	198371903	/nfs/dbraw/zinc/37/19/03/198371903.db2.gz	YROZFZDNIGTNTC-LBPRGKRZSA-N	1	1	308.363	1.272	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000076795581	353438588	/nfs/dbraw/zinc/43/85/88/353438588.db2.gz	WEFVZGCJHSKCQN-NSHDSACASA-N	1	1	308.386	1.891	20	5		DDBDMO
Cc1cnc(NCCCCN2CC[NH+](C)CC2)c([N+](=O)[O-])c1	ZINC000078630208	353526178	/nfs/dbraw/zinc/52/61/78/353526178.db2.gz	GJFXSKJOCZHPFC-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
CN(C(=O)C[NH+]1CCC(CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000079989949	353585938	/nfs/dbraw/zinc/58/59/38/353585938.db2.gz	RSGLHMVDOWFDGF-UHFFFAOYSA-N	1	1	307.350	1.262	20	5		DDBDMO
Cc1ccc(N2CCN(c3[nH+]ccn3C)CC2)c([N+](=O)[O-])c1	ZINC000080645018	353620278	/nfs/dbraw/zinc/62/02/78/353620278.db2.gz	MCSJPTJESAFTJZ-UHFFFAOYSA-N	1	1	301.350	1.963	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000093333333	353895811	/nfs/dbraw/zinc/89/58/11/353895811.db2.gz	RBIXKICKSSNGLK-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000093333333	353895812	/nfs/dbraw/zinc/89/58/12/353895812.db2.gz	RBIXKICKSSNGLK-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000617751301	363287507	/nfs/dbraw/zinc/28/75/07/363287507.db2.gz	FHMPGKJKYBEFSW-ZOWXZIJZSA-N	1	1	321.377	1.534	20	5		DDBDMO
C[C@@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000617751301	363287512	/nfs/dbraw/zinc/28/75/12/363287512.db2.gz	FHMPGKJKYBEFSW-ZOWXZIJZSA-N	1	1	321.377	1.534	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000144479486	354154700	/nfs/dbraw/zinc/15/47/00/354154700.db2.gz	UMISSTUGGPNSCQ-NSHDSACASA-N	1	1	305.334	1.327	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCCC[C@@H]2CO)c([N+](=O)[O-])c1	ZINC000317434369	354511426	/nfs/dbraw/zinc/51/14/26/354511426.db2.gz	WTINYFNJTKCINS-CYBMUJFWSA-N	1	1	307.350	1.431	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CCO)CC2CC2)c1	ZINC000589496924	354995954	/nfs/dbraw/zinc/99/59/54/354995954.db2.gz	YYDRNSGWMYLHES-UHFFFAOYSA-N	1	1	308.334	1.586	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H](C)N1CC[NH+](C)CC1	ZINC000590550119	355110833	/nfs/dbraw/zinc/11/08/33/355110833.db2.gz	MFVMWJNHCAXSDI-ZDUSSCGKSA-N	1	1	320.393	1.786	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000590763174	355171056	/nfs/dbraw/zinc/17/10/56/355171056.db2.gz	PFROAHRSGSYUOW-MRXNPFEDSA-N	1	1	324.377	1.695	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cncs3)CC2)cn1	ZINC000591010575	355231997	/nfs/dbraw/zinc/23/19/97/355231997.db2.gz	WGBRKLLOQGSQMH-UHFFFAOYSA-N	1	1	319.390	1.811	20	5		DDBDMO
CNC(=O)[C@@H]1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000591476896	355320606	/nfs/dbraw/zinc/32/06/06/355320606.db2.gz	CKFAUOOPONSBDA-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]([C@H]3CCC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256420	355548439	/nfs/dbraw/zinc/54/84/39/355548439.db2.gz	YYVKIUTXUBTMKW-NWDGAFQWSA-N	1	1	321.381	1.478	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000593067535	355785313	/nfs/dbraw/zinc/78/53/13/355785313.db2.gz	VLCKHGDNBKUVJI-ZIAGYGMSSA-N	1	1	323.349	1.005	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@@H](C)O)C1CC1	ZINC000594065079	356103910	/nfs/dbraw/zinc/10/39/10/356103910.db2.gz	ODPVUIZCYUKFTE-LLVKDONJSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C[C@@H](C)O)C1CC1	ZINC000594065079	356103915	/nfs/dbraw/zinc/10/39/15/356103915.db2.gz	ODPVUIZCYUKFTE-LLVKDONJSA-N	1	1	307.350	1.687	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000080259627	192017935	/nfs/dbraw/zinc/01/79/35/192017935.db2.gz	ZGMCQQUHYIFRMW-UHFFFAOYSA-N	1	1	308.382	1.487	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594596962	356260192	/nfs/dbraw/zinc/26/01/92/356260192.db2.gz	BPNWVDFWHOWSND-NEPJUHHUSA-N	1	1	319.365	1.518	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC[C@H]2c2ccc(F)cc2)c1	ZINC000594716035	356294497	/nfs/dbraw/zinc/29/44/97/356294497.db2.gz	GWZOXUPYWIFDGD-CABCVRRESA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]2c2ccc(F)cc2)c1	ZINC000594716035	356294500	/nfs/dbraw/zinc/29/45/00/356294500.db2.gz	GWZOXUPYWIFDGD-CABCVRRESA-N	1	1	320.324	1.738	20	5		DDBDMO
Cc1cc(=O)[nH]c(C(C)(C)[NH2+]CCn2cc([N+](=O)[O-])cn2)n1	ZINC000595517276	356528975	/nfs/dbraw/zinc/52/89/75/356528975.db2.gz	DLYDJPSKJIKIGW-UHFFFAOYSA-N	1	1	306.326	1.120	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](CO)Cc1ccccc1	ZINC000595599571	356570385	/nfs/dbraw/zinc/57/03/85/356570385.db2.gz	YRDQPWAHTHCERD-AWEZNQCLSA-N	1	1	304.350	1.327	20	5		DDBDMO
CC1(C)CN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC[N@H+]1CCO	ZINC000618164842	363484901	/nfs/dbraw/zinc/48/49/01/363484901.db2.gz	TXOAGKWREBHQPP-UHFFFAOYSA-N	1	1	320.393	1.456	20	5		DDBDMO
C[C@H](CO)[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595679070	356607527	/nfs/dbraw/zinc/60/75/27/356607527.db2.gz	UTICLVPURXOESR-TZMCWYRMSA-N	1	1	309.366	1.239	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@](CO)(OC)C1	ZINC000595664113	356599764	/nfs/dbraw/zinc/59/97/64/356599764.db2.gz	YCLGCQYOUHPQNV-INIZCTEOSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@](CO)(OC)C1	ZINC000595664113	356599766	/nfs/dbraw/zinc/59/97/66/356599766.db2.gz	YCLGCQYOUHPQNV-INIZCTEOSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)[C@H]1O	ZINC000595748319	356635212	/nfs/dbraw/zinc/63/52/12/356635212.db2.gz	FNDKNAFLWDZUBV-CQJJVWNLSA-N	1	1	324.377	1.283	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@H]3COC[C@@]3(C)C2)c([N+](=O)[O-])c1	ZINC000595762095	356641758	/nfs/dbraw/zinc/64/17/58/356641758.db2.gz	ZXPOWZPUZRFGGD-BLLLJJGKSA-N	1	1	322.361	1.951	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000596309345	356853462	/nfs/dbraw/zinc/85/34/62/356853462.db2.gz	ZEVKPZNTHLNVTE-NSHDSACASA-N	1	1	306.366	1.978	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000596539299	356911359	/nfs/dbraw/zinc/91/13/59/356911359.db2.gz	OFQBCFZZJYCIJV-LBPRGKRZSA-N	1	1	309.341	1.769	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+](C2CCCCC2)C1	ZINC000598220004	357497480	/nfs/dbraw/zinc/49/74/80/357497480.db2.gz	NFWKKIKPUQUAJA-NSHDSACASA-N	1	1	321.381	1.465	20	5		DDBDMO
CCC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CC)C(=O)OCC	ZINC000276824295	213116131	/nfs/dbraw/zinc/11/61/31/213116131.db2.gz	OUCPPYNTDWPOIQ-CYBMUJFWSA-N	1	1	312.370	1.845	20	5		DDBDMO
CCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CC)C(=O)OCC	ZINC000276824295	213116135	/nfs/dbraw/zinc/11/61/35/213116135.db2.gz	OUCPPYNTDWPOIQ-CYBMUJFWSA-N	1	1	312.370	1.845	20	5		DDBDMO
COC[C@@]1(C)C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000599693364	358028177	/nfs/dbraw/zinc/02/81/77/358028177.db2.gz	ORMBXVFZDGIUNL-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
COC[C@@]1(C)C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000599693364	358028179	/nfs/dbraw/zinc/02/81/79/358028179.db2.gz	ORMBXVFZDGIUNL-OAHLLOKOSA-N	1	1	310.350	1.711	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000599704805	358032799	/nfs/dbraw/zinc/03/27/99/358032799.db2.gz	UEEDGDSNYSOJJJ-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000600190538	358150952	/nfs/dbraw/zinc/15/09/52/358150952.db2.gz	GWZFWJLAYGPXME-GMNBZTITSA-N	1	1	320.345	1.872	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1	ZINC000600190538	358150955	/nfs/dbraw/zinc/15/09/55/358150955.db2.gz	GWZFWJLAYGPXME-GMNBZTITSA-N	1	1	320.345	1.872	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@@H]1CC[N@H+]1C1CCCCC1	ZINC000600229421	358163738	/nfs/dbraw/zinc/16/37/38/358163738.db2.gz	SCSQJYGMXOXABN-ZDUSSCGKSA-N	1	1	321.381	1.315	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600313738	358193117	/nfs/dbraw/zinc/19/31/17/358193117.db2.gz	JOBPLGAMVBCFBV-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
C[N@@H+](CC(=O)NCCOc1ccc([N+](=O)[O-])cc1)C1CCC1	ZINC000600816337	358323513	/nfs/dbraw/zinc/32/35/13/358323513.db2.gz	BLDBPJYPBJSKJF-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1Cn1cc(C[NH+]2CCCC2)nn1	ZINC000600974264	358364585	/nfs/dbraw/zinc/36/45/85/358364585.db2.gz	XULPFFATCAKFQO-UHFFFAOYSA-N	1	1	317.349	1.839	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](O)C3CCOCC3)c2c1	ZINC000601118108	358409608	/nfs/dbraw/zinc/40/96/08/358409608.db2.gz	HFCHNMMNBNSRCI-MRXNPFEDSA-N	1	1	317.345	1.764	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000601776162	358690798	/nfs/dbraw/zinc/69/07/98/358690798.db2.gz	HICOPDMTSNUAEB-LRDDRELGSA-N	1	1	321.377	1.260	20	5		DDBDMO
Cc1cc([N+](=O)[O-])nn1C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1	ZINC000601960862	358754407	/nfs/dbraw/zinc/75/44/07/358754407.db2.gz	WVFGYYWAYBPQCM-MRXNPFEDSA-N	1	1	316.361	1.737	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c([N+](=O)[O-])n1	ZINC000602664763	359110992	/nfs/dbraw/zinc/11/09/92/359110992.db2.gz	VEFRMBUKOUCIEN-NSHDSACASA-N	1	1	322.287	1.608	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c([N+](=O)[O-])n1	ZINC000602664763	359110993	/nfs/dbraw/zinc/11/09/93/359110993.db2.gz	VEFRMBUKOUCIEN-NSHDSACASA-N	1	1	322.287	1.608	20	5		DDBDMO
CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])C[C@H](O)C(F)(F)F	ZINC000602809676	359206498	/nfs/dbraw/zinc/20/64/98/359206498.db2.gz	CDWHCBBZWFMONB-VIFPVBQESA-N	1	1	310.276	1.345	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@@H](C)O[C@@]2(CCCOC2)C1	ZINC000602831135	359223650	/nfs/dbraw/zinc/22/36/50/359223650.db2.gz	ZCKKLFJEWGBIME-DOMZBBRYSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@@H](C)O[C@@]2(CCCOC2)C1	ZINC000602831135	359223656	/nfs/dbraw/zinc/22/36/56/359223656.db2.gz	ZCKKLFJEWGBIME-DOMZBBRYSA-N	1	1	324.381	1.370	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@@H](O)C[C@]1(C)CO	ZINC000602910446	359288844	/nfs/dbraw/zinc/28/88/44/359288844.db2.gz	YSPOIBZRKHUVFW-GOEBONIOSA-N	1	1	324.377	1.700	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](O)C[C@]1(C)CO	ZINC000602910446	359288847	/nfs/dbraw/zinc/28/88/47/359288847.db2.gz	YSPOIBZRKHUVFW-GOEBONIOSA-N	1	1	324.377	1.700	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1Cn1cc(C[NH+]2CCCC2)nn1	ZINC000603223226	359495258	/nfs/dbraw/zinc/49/52/58/359495258.db2.gz	FZYUBNOYRCSKDD-UHFFFAOYSA-N	1	1	305.313	1.970	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)CC1(CO)CC1	ZINC000186800296	200012937	/nfs/dbraw/zinc/01/29/37/200012937.db2.gz	XTYAMHLEKSOYHN-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(CO)CC1	ZINC000186800296	200012940	/nfs/dbraw/zinc/01/29/40/200012940.db2.gz	XTYAMHLEKSOYHN-LLVKDONJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000186935424	200034104	/nfs/dbraw/zinc/03/41/04/200034104.db2.gz	KVAYODZSJMPBNN-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000186935424	200034106	/nfs/dbraw/zinc/03/41/06/200034106.db2.gz	KVAYODZSJMPBNN-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000186963142	200039258	/nfs/dbraw/zinc/03/92/58/200039258.db2.gz	UGLQOHGLRDBMOI-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000604197975	359725839	/nfs/dbraw/zinc/72/58/39/359725839.db2.gz	CSELTQMFXFPEJI-SECBINFHSA-N	1	1	303.322	1.295	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000604278209	359731753	/nfs/dbraw/zinc/73/17/53/359731753.db2.gz	SMMSNAHAYKZONE-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@H](NS(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000604278209	359731754	/nfs/dbraw/zinc/73/17/54/359731754.db2.gz	SMMSNAHAYKZONE-LBPRGKRZSA-N	1	1	313.379	1.108	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000609919666	360364882	/nfs/dbraw/zinc/36/48/82/360364882.db2.gz	WWQNTAJVGAJIJP-CYBMUJFWSA-N	1	1	322.365	1.115	20	5		DDBDMO
CN(C(=O)C[N@H+](CCCO)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000610132897	360384887	/nfs/dbraw/zinc/38/48/87/360384887.db2.gz	AUOOJQPKLPKFQI-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
CN(C(=O)C[N@@H+](CCCO)C1CC1)c1ccc([N+](=O)[O-])cc1	ZINC000610132897	360384889	/nfs/dbraw/zinc/38/48/89/360384889.db2.gz	AUOOJQPKLPKFQI-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CCN1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000612469105	361032139	/nfs/dbraw/zinc/03/21/39/361032139.db2.gz	PBXQDVNMGDFQHZ-GASCZTMLSA-N	1	1	318.377	1.211	20	5		DDBDMO
O=[N+]([O-])c1cnc2c(c1)C[N@H+](CCN1C[C@H]3CC[C@@H](C1)O3)CC2	ZINC000612469105	361032140	/nfs/dbraw/zinc/03/21/40/361032140.db2.gz	PBXQDVNMGDFQHZ-GASCZTMLSA-N	1	1	318.377	1.211	20	5		DDBDMO
C[C@@H]1CCNC(=O)[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000193566984	201076754	/nfs/dbraw/zinc/07/67/54/201076754.db2.gz	CHLSMWBPIZPQFM-NOZJJQNGSA-N	1	1	321.333	1.076	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619254979	363946741	/nfs/dbraw/zinc/94/67/41/363946741.db2.gz	ROJGCUDFHWSZFV-ZFWWWQNUSA-N	1	1	321.352	1.782	20	5		DDBDMO
C[NH2+][C@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1cnn(C)c1	ZINC000261987858	203169050	/nfs/dbraw/zinc/16/90/50/203169050.db2.gz	KRSHZZHQFGVOSO-ZDUSSCGKSA-N	1	1	303.322	1.536	20	5		DDBDMO
Nc1c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)cc(F)cc1[N+](=O)[O-]	ZINC000264667577	204064709	/nfs/dbraw/zinc/06/47/09/204064709.db2.gz	VMABBIJFNMVYTN-VIFPVBQESA-N	1	1	322.340	1.530	20	5		DDBDMO
C[C@H](CC[NH+](C)C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000264953495	204298052	/nfs/dbraw/zinc/29/80/52/204298052.db2.gz	YJZHXZJBWHCDLV-SECBINFHSA-N	1	1	305.338	1.541	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000266111901	205106938	/nfs/dbraw/zinc/10/69/38/205106938.db2.gz	VGVKNXXJQLGLJW-GXSJLCMTSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000266111901	205106943	/nfs/dbraw/zinc/10/69/43/205106943.db2.gz	VGVKNXXJQLGLJW-GXSJLCMTSA-N	1	1	309.370	1.429	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000266111901	205106948	/nfs/dbraw/zinc/10/69/48/205106948.db2.gz	VGVKNXXJQLGLJW-GXSJLCMTSA-N	1	1	309.370	1.429	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H]3CC[C@@H]([NH3+])[C@H]3C2)c([N+](=O)[O-])c1	ZINC000351501986	284349065	/nfs/dbraw/zinc/34/90/65/284349065.db2.gz	YQKLZXUMUABKEY-FPMFFAJLSA-N	1	1	321.377	1.651	20	5		DDBDMO
CC(C)[N@H+](Cc1ccco1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266507268	205395932	/nfs/dbraw/zinc/39/59/32/205395932.db2.gz	CEPXAMRFKBBVKY-CYBMUJFWSA-N	1	1	308.338	1.656	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000023695499	182366770	/nfs/dbraw/zinc/36/67/70/182366770.db2.gz	CSZFSBICUWURTB-JTQLQIEISA-N	1	1	321.333	1.994	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1	ZINC000023695499	182366772	/nfs/dbraw/zinc/36/67/72/182366772.db2.gz	CSZFSBICUWURTB-JTQLQIEISA-N	1	1	321.333	1.994	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000102488862	248243190	/nfs/dbraw/zinc/24/31/90/248243190.db2.gz	JBLOXCFUHJLBRM-ZDUSSCGKSA-N	1	1	323.397	1.256	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCC[N@@H+](C)C2CCCC2)c1[N+](=O)[O-]	ZINC000104574578	194016193	/nfs/dbraw/zinc/01/61/93/194016193.db2.gz	ZHAZCGSHMIHWCI-UHFFFAOYSA-N	1	1	309.370	1.241	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000338677708	250087127	/nfs/dbraw/zinc/08/71/27/250087127.db2.gz	RFUPWIUWBBTOBS-GFCCVEGCSA-N	1	1	323.397	1.375	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000339226007	250351175	/nfs/dbraw/zinc/35/11/75/250351175.db2.gz	DLMMVQVNBYOBMI-LLVKDONJSA-N	1	1	321.333	1.418	20	5		DDBDMO
CC[N@@H+](C)Cc1cccc(CNC(=O)c2cc([N+](=O)[O-])n[nH]2)c1	ZINC000285035015	218264665	/nfs/dbraw/zinc/26/46/65/218264665.db2.gz	GHEMFMMXAAHJSR-UHFFFAOYSA-N	1	1	317.349	1.700	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000414215259	532996746	/nfs/dbraw/zinc/99/67/46/532996746.db2.gz	UJCRYSBAGVOQJB-NSHDSACASA-N	1	1	307.350	1.541	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1	ZINC000352417932	285037364	/nfs/dbraw/zinc/03/73/64/285037364.db2.gz	WHRRDHIYLSHZOJ-GFCCVEGCSA-N	1	1	308.334	1.988	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N1CC[NH2+]Cc2ccccc21	ZINC000567882396	304251195	/nfs/dbraw/zinc/25/11/95/304251195.db2.gz	WXIFSLTZKUBGPD-UHFFFAOYSA-N	1	1	301.306	1.078	20	5		DDBDMO
O=c1c([N+](=O)[O-])cc(Cl)cn1CC[N@@H+]1CCCOCC1	ZINC000412995067	224117410	/nfs/dbraw/zinc/11/74/10/224117410.db2.gz	BTXHXIYBJGMJMU-UHFFFAOYSA-N	1	1	301.730	1.132	20	5		DDBDMO
O=c1c([N+](=O)[O-])cc(Cl)cn1CC[N@H+]1CCCOCC1	ZINC000412995067	224117412	/nfs/dbraw/zinc/11/74/12/224117412.db2.gz	BTXHXIYBJGMJMU-UHFFFAOYSA-N	1	1	301.730	1.132	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCc3occc3C2)c1	ZINC000288708673	220361261	/nfs/dbraw/zinc/36/12/61/220361261.db2.gz	FEPOSAINMNUIKU-CYBMUJFWSA-N	1	1	306.322	1.194	20	5		DDBDMO
Cc1csc(N2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)n1	ZINC000157665454	197205918	/nfs/dbraw/zinc/20/59/18/197205918.db2.gz	DGKBGZUBEVNUJB-UHFFFAOYSA-N	1	1	322.394	1.378	20	5		DDBDMO
C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000155392132	197050802	/nfs/dbraw/zinc/05/08/02/197050802.db2.gz	OQRCQNIWMKXKQK-TXEJJXNPSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[NH+](C)C1CN(C(=O)c2cc(-c3ccc([N+](=O)[O-])cc3)[nH]n2)C1	ZINC000294867572	224275404	/nfs/dbraw/zinc/27/54/04/224275404.db2.gz	DNGFCECUJQHTRT-UHFFFAOYSA-N	1	1	315.333	1.371	20	5		DDBDMO
COC(=O)[C@@H]([NH2+]CCCNc1ccc([N+](=O)[O-])c(C)n1)C(C)C	ZINC000295033655	224391626	/nfs/dbraw/zinc/39/16/26/224391626.db2.gz	VWRDSYYLNSRYNB-AWEZNQCLSA-N	1	1	324.381	1.887	20	5		DDBDMO
CC[NH+](CC)CCCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000074441009	184985751	/nfs/dbraw/zinc/98/57/51/184985751.db2.gz	VLVIWMINYQKXOS-UHFFFAOYSA-N	1	1	319.365	1.933	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)n1	ZINC000292905829	292017873	/nfs/dbraw/zinc/01/78/73/292017873.db2.gz	XAWNGFFAPXEYSW-AOOOYVTPSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)n1	ZINC000292905829	292017874	/nfs/dbraw/zinc/01/78/74/292017874.db2.gz	XAWNGFFAPXEYSW-AOOOYVTPSA-N	1	1	308.338	1.305	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](CCO)[C@H]1CCO[C@@H]1C	ZINC000430248476	286249540	/nfs/dbraw/zinc/24/95/40/286249540.db2.gz	ZQKRBBPZMZWIOY-RISCZKNCSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)[C@H]1CCO[C@@H]1C	ZINC000430248476	286249541	/nfs/dbraw/zinc/24/95/41/286249541.db2.gz	ZQKRBBPZMZWIOY-RISCZKNCSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c1	ZINC000272937204	286381646	/nfs/dbraw/zinc/38/16/46/286381646.db2.gz	LOBTVBQDHRFCOK-LLVKDONJSA-N	1	1	319.361	1.984	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000073996775	406899957	/nfs/dbraw/zinc/89/99/57/406899957.db2.gz	AIALVDZDZFIRHF-GXTWGEPZSA-N	1	1	319.361	1.669	20	5		DDBDMO
CCOCCNC(=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000084680880	407093086	/nfs/dbraw/zinc/09/30/86/407093086.db2.gz	QHPIHTQGGUXDFI-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
CCOCCNC(=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000084680880	407093089	/nfs/dbraw/zinc/09/30/89/407093089.db2.gz	QHPIHTQGGUXDFI-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
Cc1n[nH]c(C)c1[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000091081657	407177363	/nfs/dbraw/zinc/17/73/63/407177363.db2.gz	JJCWLFCATOGALW-ZDUSSCGKSA-N	1	1	304.354	1.968	20	5		DDBDMO
C[C@@H]1C[NH2+]CCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000054371057	407183721	/nfs/dbraw/zinc/18/37/21/407183721.db2.gz	BWBFMPPQXFCXJI-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000124721029	407367927	/nfs/dbraw/zinc/36/79/27/407367927.db2.gz	XNRBTZVELILIHX-ZYHUDNBSSA-N	1	1	306.366	1.853	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000108562523	407388553	/nfs/dbraw/zinc/38/85/53/407388553.db2.gz	UQLZLLIEQYMZGI-AWEZNQCLSA-N	1	1	320.393	1.778	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000111276887	407405048	/nfs/dbraw/zinc/40/50/48/407405048.db2.gz	OVSZKHUTDFOXHO-AEGPPILISA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000111276887	407405049	/nfs/dbraw/zinc/40/50/49/407405049.db2.gz	OVSZKHUTDFOXHO-AEGPPILISA-N	1	1	324.377	1.834	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H](C)[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000126237109	407409284	/nfs/dbraw/zinc/40/92/84/407409284.db2.gz	UMQOGJQANOALJJ-QWRGUYRKSA-N	1	1	323.397	1.487	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270980687	407449209	/nfs/dbraw/zinc/44/92/09/407449209.db2.gz	XDCLSMQQAWQUCD-WDMOLILDSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000270980687	407449216	/nfs/dbraw/zinc/44/92/16/407449216.db2.gz	XDCLSMQQAWQUCD-WDMOLILDSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000170639935	407460871	/nfs/dbraw/zinc/46/08/71/407460871.db2.gz	VNZGNYLUFWGRDA-LLVKDONJSA-N	1	1	304.350	1.986	20	5		DDBDMO
C[C@@H]1c2ccccc2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266540028	407551943	/nfs/dbraw/zinc/55/19/43/407551943.db2.gz	PRXSKKMKVQBXKL-IUODEOHRSA-N	1	1	316.361	1.772	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000185910952	407535236	/nfs/dbraw/zinc/53/52/36/407535236.db2.gz	YGHSNHKDMOOOOU-OAHLLOKOSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@]1(C(N)=O)CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000185910952	407535244	/nfs/dbraw/zinc/53/52/44/407535244.db2.gz	YGHSNHKDMOOOOU-OAHLLOKOSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[NH+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[N@H+](C)C1	ZINC000178863962	407631248	/nfs/dbraw/zinc/63/12/48/407631248.db2.gz	DEWIOKVQXNOGIW-CJNGLKHVSA-N	1	1	307.394	1.902	20	5		DDBDMO
C[NH+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@@H]1CCC[N@@H+](C)C1	ZINC000178863962	407631253	/nfs/dbraw/zinc/63/12/53/407631253.db2.gz	DEWIOKVQXNOGIW-CJNGLKHVSA-N	1	1	307.394	1.902	20	5		DDBDMO
C[C@]1(CCCO)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000272064235	407761233	/nfs/dbraw/zinc/76/12/33/407761233.db2.gz	XIJWNPQMJFRSDG-OAHLLOKOSA-N	1	1	309.366	1.384	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CCCC[N@@H+]2CC)c1[N+](=O)[O-]	ZINC000171873521	407786927	/nfs/dbraw/zinc/78/69/27/407786927.db2.gz	RLYZYNHKVCBBRR-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C)C1	ZINC000153582400	407853637	/nfs/dbraw/zinc/85/36/37/407853637.db2.gz	AZTAFLKBERKPEJ-CYBMUJFWSA-N	1	1	307.350	1.526	20	5		DDBDMO
O=C(NC[C@H]1CCCC[NH2+]1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000237982967	407863474	/nfs/dbraw/zinc/86/34/74/407863474.db2.gz	ZDIRAEHYSPVJFD-SECBINFHSA-N	1	1	303.322	1.343	20	5		DDBDMO
C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)C[NH+]1CCOCC1	ZINC000134149271	407886970	/nfs/dbraw/zinc/88/69/70/407886970.db2.gz	XRAXVCYAXAUHLS-GFCCVEGCSA-N	1	1	307.350	1.293	20	5		DDBDMO
C[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@@H+]1CCO	ZINC000187739017	407887042	/nfs/dbraw/zinc/88/70/42/407887042.db2.gz	VJOLOCDLVIATQQ-NSHDSACASA-N	1	1	320.349	1.234	20	5		DDBDMO
C[C@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1CCO	ZINC000187739017	407887049	/nfs/dbraw/zinc/88/70/49/407887049.db2.gz	VJOLOCDLVIATQQ-NSHDSACASA-N	1	1	320.349	1.234	20	5		DDBDMO
C[N@@H+]1CC[C@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272493321	407948127	/nfs/dbraw/zinc/94/81/27/407948127.db2.gz	CPQSZZCAQHMBKT-IINYFYTJSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272493321	407948130	/nfs/dbraw/zinc/94/81/30/407948130.db2.gz	CPQSZZCAQHMBKT-IINYFYTJSA-N	1	1	305.334	1.467	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000245613600	408028397	/nfs/dbraw/zinc/02/83/97/408028397.db2.gz	LZDSXWDIFKBHCT-STQMWFEESA-N	1	1	312.391	1.772	20	5		DDBDMO
Cn1ncc2c1CCC[C@@H]2[N@@H+](C)CCn1cc([N+](=O)[O-])cn1	ZINC000135560722	408032152	/nfs/dbraw/zinc/03/21/52/408032152.db2.gz	WFJNOHUDNMQRMV-ZDUSSCGKSA-N	1	1	304.354	1.534	20	5		DDBDMO
CC[C@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000181545170	408012277	/nfs/dbraw/zinc/01/22/77/408012277.db2.gz	YJIAXYPPVILBFZ-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000181545170	408012286	/nfs/dbraw/zinc/01/22/86/408012286.db2.gz	YJIAXYPPVILBFZ-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000268505467	408074275	/nfs/dbraw/zinc/07/42/75/408074275.db2.gz	QYJCYZHVXLHHHI-GFCCVEGCSA-N	1	1	307.354	1.050	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3cccc([N+](=O)[O-])c3N)CC[C@@H]21	ZINC000154825454	408091533	/nfs/dbraw/zinc/09/15/33/408091533.db2.gz	OJFLDAZPXYRQNP-YPMHNXCESA-N	1	1	318.377	1.733	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccccc1[N+](=O)[O-]	ZINC000263646377	408188537	/nfs/dbraw/zinc/18/85/37/408188537.db2.gz	ASRWJJVSPZDJET-HNNXBMFYSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC(=O)N1CC[C@H](C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000156444273	408256116	/nfs/dbraw/zinc/25/61/16/408256116.db2.gz	TXDRQJJIRSCENJ-CQSZACIVSA-N	1	1	321.377	1.774	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000156455257	408260684	/nfs/dbraw/zinc/26/06/84/408260684.db2.gz	HQVGIXBUAWPYII-AWEZNQCLSA-N	1	1	321.377	1.774	20	5		DDBDMO
CCN1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])c(C)n3)C2)CC1	ZINC000150794233	408202252	/nfs/dbraw/zinc/20/22/52/408202252.db2.gz	PNSAVYVBXLQJAL-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
C[C@H](CNc1ccc([N+](=O)[O-])c2nonc21)[NH+]1CCN(C)CC1	ZINC000263919405	408314602	/nfs/dbraw/zinc/31/46/02/408314602.db2.gz	RWFDXSJZRRUXNN-SNVBAGLBSA-N	1	1	320.353	1.179	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000246838158	408351434	/nfs/dbraw/zinc/35/14/34/408351434.db2.gz	SUENZZMPOSULBG-ZFWWWQNUSA-N	1	1	319.361	1.695	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@H](C)C2)n1	ZINC000191783808	408491355	/nfs/dbraw/zinc/49/13/55/408491355.db2.gz	KHRLFCIDMYATHE-RYUDHWBXSA-N	1	1	323.397	1.661	20	5		DDBDMO
COCC[N@@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000264441945	408491749	/nfs/dbraw/zinc/49/17/49/408491749.db2.gz	BVXRPEOWIUYCRO-SNVBAGLBSA-N	1	1	313.379	1.415	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(C)s2)C1	ZINC000264441945	408491756	/nfs/dbraw/zinc/49/17/56/408491756.db2.gz	BVXRPEOWIUYCRO-SNVBAGLBSA-N	1	1	313.379	1.415	20	5		DDBDMO
CCc1ccc(C(=O)NCC[N@@H+](CC)CCO)cc1[N+](=O)[O-]	ZINC000183993202	408523884	/nfs/dbraw/zinc/52/38/84/408523884.db2.gz	GUWXAHQDVVQVRB-UHFFFAOYSA-N	1	1	309.366	1.201	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)c(N)c([N+](=O)[O-])c1	ZINC000192484770	408596610	/nfs/dbraw/zinc/59/66/10/408596610.db2.gz	LPNOFZMLSQZYAL-PHIMTYICSA-N	1	1	304.350	1.119	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+](CCO)C2CCC2)c1	ZINC000275801260	408682962	/nfs/dbraw/zinc/68/29/62/408682962.db2.gz	GFYKAQXAXLMCLJ-CQSZACIVSA-N	1	1	310.350	1.181	20	5		DDBDMO
COC[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccc(C)o1	ZINC000184771773	408685020	/nfs/dbraw/zinc/68/50/20/408685020.db2.gz	ISDCANOWHPUIML-CYBMUJFWSA-N	1	1	321.333	1.635	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000178193191	408785897	/nfs/dbraw/zinc/78/58/97/408785897.db2.gz	LUWSFCMYYCQSCS-NSHDSACASA-N	1	1	322.365	1.018	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000178193175	408786208	/nfs/dbraw/zinc/78/62/08/408786208.db2.gz	LUWSFCMYYCQSCS-LLVKDONJSA-N	1	1	322.365	1.018	20	5		DDBDMO
C[C@@H](C[S@@](C)=O)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000185105871	408759031	/nfs/dbraw/zinc/75/90/31/408759031.db2.gz	VCVIFEGTUZTYFE-PRWKNARSSA-N	1	1	300.380	1.672	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194058899	408760899	/nfs/dbraw/zinc/76/08/99/408760899.db2.gz	QSNILOWKNBHATI-VIFPVBQESA-N	1	1	310.310	1.317	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000194058899	408760903	/nfs/dbraw/zinc/76/09/03/408760903.db2.gz	QSNILOWKNBHATI-VIFPVBQESA-N	1	1	310.310	1.317	20	5		DDBDMO
COCCOCCOCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1	ZINC000276145256	408822928	/nfs/dbraw/zinc/82/29/28/408822928.db2.gz	FJVHOBXDAPQMMY-UHFFFAOYSA-N	1	1	312.366	1.706	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000276501250	408872114	/nfs/dbraw/zinc/87/21/14/408872114.db2.gz	JMWODCZBGYTLRB-OTYXRUKQSA-N	1	1	304.350	1.390	20	5		DDBDMO
COC(=O)[C@]1(C)C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000282261608	409021275	/nfs/dbraw/zinc/02/12/75/409021275.db2.gz	CVQMMJVAEOFLSY-DJSGYFEHSA-N	1	1	322.361	1.759	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CCCCCO)c1ccc([N+](=O)[O-])cc1	ZINC000278977720	409124641	/nfs/dbraw/zinc/12/46/41/409124641.db2.gz	YQMBYBNYJQOQNR-UHFFFAOYSA-N	1	1	309.366	1.652	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000293578268	409142131	/nfs/dbraw/zinc/14/21/31/409142131.db2.gz	AYPICKHIBXWTIC-JTQLQIEISA-N	1	1	321.381	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000293578268	409142133	/nfs/dbraw/zinc/14/21/33/409142133.db2.gz	AYPICKHIBXWTIC-JTQLQIEISA-N	1	1	321.381	1.573	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C3CCC3)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000293578268	409142135	/nfs/dbraw/zinc/14/21/35/409142135.db2.gz	AYPICKHIBXWTIC-JTQLQIEISA-N	1	1	321.381	1.573	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@@H]2CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000279273767	409183168	/nfs/dbraw/zinc/18/31/68/409183168.db2.gz	WOBVUHQGAKPONT-JTQLQIEISA-N	1	1	324.356	1.481	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNc1ncc([N+](=O)[O-])cc1Cl	ZINC000288820786	409183289	/nfs/dbraw/zinc/18/32/89/409183289.db2.gz	HLVJTCFDTCQWBH-UHFFFAOYSA-N	1	1	315.805	1.939	20	5		DDBDMO
CN(CCCNc1ncc([N+](=O)[O-])cc1Cl)CC[NH+](C)C	ZINC000288820786	409183292	/nfs/dbraw/zinc/18/32/92/409183292.db2.gz	HLVJTCFDTCQWBH-UHFFFAOYSA-N	1	1	315.805	1.939	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CCN(c2[nH+]ccn2C)CC1	ZINC000288817996	409183493	/nfs/dbraw/zinc/18/34/93/409183493.db2.gz	HYBNMXKYJJMJPX-UHFFFAOYSA-N	1	1	319.369	1.180	20	5		DDBDMO
CC1(C)C[C@@H](O)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000296047300	409411095	/nfs/dbraw/zinc/41/10/95/409411095.db2.gz	NMOJVCZPCHMFCC-ZDUSSCGKSA-N	1	1	321.377	1.677	20	5		DDBDMO
CC(C)[N@H+]1CCCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1	ZINC000290612819	409460760	/nfs/dbraw/zinc/46/07/60/409460760.db2.gz	KLFUJRXXLWXYOK-UHFFFAOYSA-N	1	1	307.354	1.009	20	5		DDBDMO
CNc1c(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000317037813	164024935	/nfs/dbraw/zinc/02/49/35/164024935.db2.gz	RKJBJWNUNWEVEP-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
CN1CC[NH+](CCCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000296220845	409467942	/nfs/dbraw/zinc/46/79/42/409467942.db2.gz	DEQUUASWYXFJAM-UHFFFAOYSA-N	1	1	318.381	1.521	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000408073606	164219241	/nfs/dbraw/zinc/21/92/41/164219241.db2.gz	QSZLWEPKKSPGMY-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000408073606	164219242	/nfs/dbraw/zinc/21/92/42/164219242.db2.gz	QSZLWEPKKSPGMY-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
CC[C@H]1CCCC[N@H+]1CCNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290674998	409484293	/nfs/dbraw/zinc/48/42/93/409484293.db2.gz	RPLPIDOWTDAVQR-NSHDSACASA-N	1	1	321.381	1.765	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H](C)C[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000356811742	409628069	/nfs/dbraw/zinc/62/80/69/409628069.db2.gz	PPHSXLWOGHBMEO-SNVBAGLBSA-N	1	1	311.386	1.729	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])nn2C)C[C@H]1C	ZINC000357049849	409819374	/nfs/dbraw/zinc/81/93/74/409819374.db2.gz	HOLQMOAPOWWGLM-MNOVXSKESA-N	1	1	309.370	1.273	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000346325883	409917948	/nfs/dbraw/zinc/91/79/48/409917948.db2.gz	RRRDAOYGYDFOES-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
C[C@@H]1CC[C@H](C)[N@@H+]1Cc1nc(-c2c([N+](=O)[O-])ncn2C)no1	ZINC000350911925	410013015	/nfs/dbraw/zinc/01/30/15/410013015.db2.gz	UZOVTCXTVZJMJV-DTORHVGOSA-N	1	1	306.326	1.751	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000342922040	410002328	/nfs/dbraw/zinc/00/23/28/410002328.db2.gz	UAOJLNKCOJYTTK-JTQLQIEISA-N	1	1	302.334	1.900	20	5		DDBDMO
CCNC(=O)[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C	ZINC000339325859	410096227	/nfs/dbraw/zinc/09/62/27/410096227.db2.gz	POHWZVSTPPTBOQ-CQSZACIVSA-N	1	1	322.365	1.284	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC1	ZINC000298074726	410102193	/nfs/dbraw/zinc/10/21/93/410102193.db2.gz	GVJKNODCEGJMIT-UHFFFAOYSA-N	1	1	302.334	1.854	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000346759146	410135514	/nfs/dbraw/zinc/13/55/14/410135514.db2.gz	APHFVAVIVLZCLM-NEPJUHHUSA-N	1	1	323.397	1.468	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@@H]1C	ZINC000346759152	410136489	/nfs/dbraw/zinc/13/64/89/410136489.db2.gz	APHFVAVIVLZCLM-NWDGAFQWSA-N	1	1	323.397	1.468	20	5		DDBDMO
C[C@@H]1C[NH+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H](C)N1C	ZINC000339618879	410333728	/nfs/dbraw/zinc/33/37/28/410333728.db2.gz	GNSGIIAPTLFDFG-NFAWXSAZSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[NH+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H](C)O1	ZINC000298840242	410422010	/nfs/dbraw/zinc/42/20/10/410422010.db2.gz	HKWJQPAIXSAQGC-GHMZBOCLSA-N	1	1	324.381	1.541	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298777818	410393230	/nfs/dbraw/zinc/39/32/30/410393230.db2.gz	DIIBZXMFQSDFJR-WDEREUQCSA-N	1	1	321.333	1.417	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000298777818	410393234	/nfs/dbraw/zinc/39/32/34/410393234.db2.gz	DIIBZXMFQSDFJR-WDEREUQCSA-N	1	1	321.333	1.417	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[C@H](C[N@@H+](C)CC2CC2)C1	ZINC000355335627	410451196	/nfs/dbraw/zinc/45/11/96/410451196.db2.gz	TYYMQOIXIOXHGC-CYBMUJFWSA-N	1	1	307.398	1.492	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCSC[C@H]1CCO	ZINC000347391510	410517224	/nfs/dbraw/zinc/51/72/24/410517224.db2.gz	PLKWOBLLBXTRQN-GFCCVEGCSA-N	1	1	312.391	1.773	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC000347469558	410568071	/nfs/dbraw/zinc/56/80/71/410568071.db2.gz	ZADUZMMJPMHGDP-NSHDSACASA-N	1	1	317.349	1.671	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000347480437	410577269	/nfs/dbraw/zinc/57/72/69/410577269.db2.gz	RCPNUUPTIDFHAB-QWHCGFSZSA-N	1	1	312.366	1.427	20	5		DDBDMO
O=C(NCCc1ccc([N+](=O)[O-])cc1)N[C@H]1CC[N@H+](C2CC2)C1	ZINC000359354891	410617294	/nfs/dbraw/zinc/61/72/94/410617294.db2.gz	VEYHAIPMODNPCT-ZDUSSCGKSA-N	1	1	318.377	1.673	20	5		DDBDMO
C[C@@H]1C[C@H](NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000352952631	410698513	/nfs/dbraw/zinc/69/85/13/410698513.db2.gz	VXJVMUKNUPRGIM-GHMZBOCLSA-N	1	1	313.379	1.356	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1	ZINC000343829906	410732030	/nfs/dbraw/zinc/73/20/30/410732030.db2.gz	NHUCSGXQWPTVRC-YGRLFVJLSA-N	1	1	319.361	1.816	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000330643408	410846280	/nfs/dbraw/zinc/84/62/80/410846280.db2.gz	DZSQEQUULCUGQU-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1O	ZINC000330643408	410846288	/nfs/dbraw/zinc/84/62/88/410846288.db2.gz	DZSQEQUULCUGQU-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000359783585	410877183	/nfs/dbraw/zinc/87/71/83/410877183.db2.gz	HVAGPFLYJSXNGN-NSHDSACASA-N	1	1	311.386	1.661	20	5		DDBDMO
CNS(=O)(=O)C[C@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000330604172	410821393	/nfs/dbraw/zinc/82/13/93/410821393.db2.gz	GSFFMSXKURGQQN-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
CNS(=O)(=O)C[C@H]1CCC[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000330604172	410821398	/nfs/dbraw/zinc/82/13/98/410821398.db2.gz	GSFFMSXKURGQQN-GFCCVEGCSA-N	1	1	313.379	1.108	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000348517846	410994161	/nfs/dbraw/zinc/99/41/61/410994161.db2.gz	YSFNXIDFZDVPPO-NSHDSACASA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000348517846	410994166	/nfs/dbraw/zinc/99/41/66/410994166.db2.gz	YSFNXIDFZDVPPO-NSHDSACASA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000348517846	410994171	/nfs/dbraw/zinc/99/41/71/410994171.db2.gz	YSFNXIDFZDVPPO-NSHDSACASA-N	1	1	321.381	1.579	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC1(O)CCC1	ZINC000353467881	411004891	/nfs/dbraw/zinc/00/48/91/411004891.db2.gz	NFCNGFORNMYMHA-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[NH+](CC2CC2)CC1	ZINC000344260585	411061341	/nfs/dbraw/zinc/06/13/41/411061341.db2.gz	VZQYOBPWPUAFNH-UHFFFAOYSA-N	1	1	307.325	1.902	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000331209644	411019260	/nfs/dbraw/zinc/01/92/60/411019260.db2.gz	GYYWYEUXBVELNF-UHFFFAOYSA-N	1	1	309.370	1.609	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC[C@H]2C)n1	ZINC000331209011	411021019	/nfs/dbraw/zinc/02/10/19/411021019.db2.gz	QBQFQONQAIEBOI-LLVKDONJSA-N	1	1	309.370	1.415	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)CCN1CC[NH+](C)CC1	ZINC000361012714	418565263	/nfs/dbraw/zinc/56/52/63/418565263.db2.gz	HCXGNKBEMNVJOI-GFCCVEGCSA-N	1	1	324.429	1.558	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC2(CCC[N@@H+]2C)CC1	ZINC000374857977	418570951	/nfs/dbraw/zinc/57/09/51/418570951.db2.gz	PQJWRYCZIGEZAY-UHFFFAOYSA-N	1	1	321.381	1.187	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3CCN(c4[nH]cc[nH+]4)CC3)nc2c1	ZINC000291020897	222077531	/nfs/dbraw/zinc/07/75/31/222077531.db2.gz	XPKWYBFWCBCBDH-UHFFFAOYSA-N	1	1	313.321	1.521	20	5		DDBDMO
Cc1c([C@@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cnn1C	ZINC000367320674	418584030	/nfs/dbraw/zinc/58/40/30/418584030.db2.gz	YIRCZSPTEPTPLU-AWEZNQCLSA-N	1	1	304.354	1.670	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000375038637	418592733	/nfs/dbraw/zinc/59/27/33/418592733.db2.gz	MAZJASZGVMQJJD-DOMZBBRYSA-N	1	1	319.361	1.526	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H](n3cccn3)C2)c1	ZINC000368269711	418713236	/nfs/dbraw/zinc/71/32/36/418713236.db2.gz	NADPGSWZQSMRDC-HUUCEWRRSA-N	1	1	302.334	1.772	20	5		DDBDMO
C[C@@](O)(C[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614010	418662728	/nfs/dbraw/zinc/66/27/28/418662728.db2.gz	SXPBEALEFKPULM-MWLCHTKSSA-N	1	1	322.287	1.742	20	5		DDBDMO
C[C@@](O)(C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1)C(F)(F)F	ZINC000375614010	418662731	/nfs/dbraw/zinc/66/27/31/418662731.db2.gz	SXPBEALEFKPULM-MWLCHTKSSA-N	1	1	322.287	1.742	20	5		DDBDMO
CC[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000361593754	418689450	/nfs/dbraw/zinc/68/94/50/418689450.db2.gz	HICVYHGTKJRNPY-KBPBESRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCOC1	ZINC000361593777	418689729	/nfs/dbraw/zinc/68/97/29/418689729.db2.gz	HMPDOPPHTOYDCD-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCOC1	ZINC000361593777	418689730	/nfs/dbraw/zinc/68/97/30/418689730.db2.gz	HMPDOPPHTOYDCD-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CNc1ccc(C(=O)NC[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000387573795	418743407	/nfs/dbraw/zinc/74/34/07/418743407.db2.gz	XOWQLLCTPICGLJ-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1c1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1	ZINC000408106101	418788863	/nfs/dbraw/zinc/78/88/63/418788863.db2.gz	XBISAYXQOTZOKR-UWVGGRQHSA-N	1	1	317.349	1.772	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCCC[C@@H](CO)C1	ZINC000371688061	418809185	/nfs/dbraw/zinc/80/91/85/418809185.db2.gz	CLWUJUQLBRZLQK-KGLIPLIRSA-N	1	1	324.377	1.429	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(CCC[C@H]3[NH3+])C2)c1[N+](=O)[O-]	ZINC000372788095	418902219	/nfs/dbraw/zinc/90/22/19/418902219.db2.gz	TXJCABZQDQUKNR-IAQYHMDHSA-N	1	1	321.381	1.614	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@@H]([C@H]3CCOC3)C2)c([N+](=O)[O-])c1	ZINC000372155909	418841067	/nfs/dbraw/zinc/84/10/67/418841067.db2.gz	HVBCRMVCOPUPMB-OCCSQVGLSA-N	1	1	319.361	1.552	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000411607708	419360711	/nfs/dbraw/zinc/36/07/11/419360711.db2.gz	DFUYVQOBKFOFGS-BXUZGUMPSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1O	ZINC000426213358	419406971	/nfs/dbraw/zinc/40/69/71/419406971.db2.gz	CDVMVPOUUDWCSP-GZBFAFLISA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420933435	419366346	/nfs/dbraw/zinc/36/63/46/419366346.db2.gz	FYGHRIPISSZYKS-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2C[C@H](O)C[C@@H]2c2ccccc2)n1	ZINC000411948343	419512784	/nfs/dbraw/zinc/51/27/84/419512784.db2.gz	PQNWEPGZLRNRRD-ZIAGYGMSSA-N	1	1	302.334	1.599	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](CO)[C@H]1C	ZINC000412067520	419613674	/nfs/dbraw/zinc/61/36/74/419613674.db2.gz	DTNIRYVEFAANPZ-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H](CO)[C@H]1C	ZINC000412067520	419613683	/nfs/dbraw/zinc/61/36/83/419613683.db2.gz	DTNIRYVEFAANPZ-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](O)[C@H](CO)C1	ZINC000412111126	419674592	/nfs/dbraw/zinc/67/45/92/419674592.db2.gz	VQTMZJJUJBKXEK-ZFWWWQNUSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](O)[C@H](CO)C1	ZINC000412111126	419674595	/nfs/dbraw/zinc/67/45/95/419674595.db2.gz	VQTMZJJUJBKXEK-ZFWWWQNUSA-N	1	1	324.377	1.557	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](CCO)C[C@@H]1C	ZINC000421902517	419763212	/nfs/dbraw/zinc/76/32/12/419763212.db2.gz	UXPSHEMLMVPKEY-ZDUSSCGKSA-N	1	1	321.377	1.350	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[N@H+](CCO)C[C@@H]1C	ZINC000421902517	419763216	/nfs/dbraw/zinc/76/32/16/419763216.db2.gz	UXPSHEMLMVPKEY-ZDUSSCGKSA-N	1	1	321.377	1.350	20	5		DDBDMO
CC(C)c1ccc([C@@H]([NH3+])CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1	ZINC000422797485	419967439	/nfs/dbraw/zinc/96/74/39/419967439.db2.gz	MVSSYNDIUSVOJJ-LBPRGKRZSA-N	1	1	317.349	1.871	20	5		DDBDMO
CN1CCNC[C@H]1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21	ZINC000423517859	420068900	/nfs/dbraw/zinc/06/89/00/420068900.db2.gz	OJFZKFMBVPZIDI-HOCLYGCPSA-N	1	1	304.394	1.465	20	5		DDBDMO
C[N@@H+](CCCNC(=O)C1CCC1)CCn1ccc([N+](=O)[O-])n1	ZINC000429555788	420025570	/nfs/dbraw/zinc/02/55/70/420025570.db2.gz	GBIOFBYZFOTNDL-UHFFFAOYSA-N	1	1	309.370	1.030	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000418996944	420041213	/nfs/dbraw/zinc/04/12/13/420041213.db2.gz	FSHWWNFVEOOGTB-UWVGGRQHSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000418996944	420041216	/nfs/dbraw/zinc/04/12/16/420041216.db2.gz	FSHWWNFVEOOGTB-UWVGGRQHSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H]1CN	ZINC000420283563	420181756	/nfs/dbraw/zinc/18/17/56/420181756.db2.gz	CDIYZEASHPRQLL-DOMZBBRYSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000420393351	420258443	/nfs/dbraw/zinc/25/84/43/420258443.db2.gz	XNMAKNRYYJFIOJ-UHFFFAOYSA-N	1	1	324.381	1.473	20	5		DDBDMO
Nc1c(F)c(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1[N+](=O)[O-]	ZINC000450796776	420534381	/nfs/dbraw/zinc/53/43/81/420534381.db2.gz	WKGKMKWBPNQOKA-AOOOYVTPSA-N	1	1	310.329	1.591	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n(C)n1	ZINC000417788194	420479347	/nfs/dbraw/zinc/47/93/47/420479347.db2.gz	IGRZCAMFQXNMPB-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n(C)n1	ZINC000417788194	420479349	/nfs/dbraw/zinc/47/93/49/420479349.db2.gz	IGRZCAMFQXNMPB-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@H](C)C[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452068828	420620617	/nfs/dbraw/zinc/62/06/17/420620617.db2.gz	PCPCWBCBKNHKGC-DGCLKSJQSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@H+](C(C)C)C1	ZINC000457132383	420626100	/nfs/dbraw/zinc/62/61/00/420626100.db2.gz	USURNMVGDSNVIK-GFCCVEGCSA-N	1	1	306.366	1.853	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000492817801	420673988	/nfs/dbraw/zinc/67/39/88/420673988.db2.gz	LLNQYFOMDZVNNI-ZDUSSCGKSA-N	1	1	323.393	1.492	20	5		DDBDMO
CNc1nc(C(=O)NCC[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000454728458	420915935	/nfs/dbraw/zinc/91/59/35/420915935.db2.gz	DOEWHNFFURFHCC-LLVKDONJSA-N	1	1	321.381	1.493	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@H](C)C[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000449764502	421077266	/nfs/dbraw/zinc/07/72/66/421077266.db2.gz	BQXCRFBHWDGTSZ-PWSUYJOCSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](C)C[C@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000449764502	421077269	/nfs/dbraw/zinc/07/72/69/421077269.db2.gz	BQXCRFBHWDGTSZ-PWSUYJOCSA-N	1	1	310.350	1.815	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@](O)(C2CC2)C1	ZINC000489254879	421141908	/nfs/dbraw/zinc/14/19/08/421141908.db2.gz	NQJAJOMLHFOROH-INIZCTEOSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000489254879	421141912	/nfs/dbraw/zinc/14/19/12/421141912.db2.gz	NQJAJOMLHFOROH-INIZCTEOSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@](O)(C2CC2)C1	ZINC000489254880	421142117	/nfs/dbraw/zinc/14/21/17/421142117.db2.gz	NQJAJOMLHFOROH-MRXNPFEDSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@](O)(C2CC2)C1	ZINC000489254880	421142120	/nfs/dbraw/zinc/14/21/20/421142120.db2.gz	NQJAJOMLHFOROH-MRXNPFEDSA-N	1	1	319.361	1.689	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CCCC[N@H+]1CCO	ZINC000450612628	421217246	/nfs/dbraw/zinc/21/72/46/421217246.db2.gz	KFLJYXPBXLZHQT-GFCCVEGCSA-N	1	1	311.386	1.378	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000549745029	421506936	/nfs/dbraw/zinc/50/69/36/421506936.db2.gz	XXYQDBSIATWGPU-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000549745029	421506938	/nfs/dbraw/zinc/50/69/38/421506938.db2.gz	XXYQDBSIATWGPU-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)Cn1cccn1)C2	ZINC000534514070	421692111	/nfs/dbraw/zinc/69/21/11/421692111.db2.gz	AGXLPAXBUDAQNE-CYBMUJFWSA-N	1	1	302.334	1.211	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)Cn1cccn1)C2	ZINC000534514070	421692114	/nfs/dbraw/zinc/69/21/14/421692114.db2.gz	AGXLPAXBUDAQNE-CYBMUJFWSA-N	1	1	302.334	1.211	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CC[C@@H]2OCC[C@@H]2C1	ZINC000571162312	421693015	/nfs/dbraw/zinc/69/30/15/421693015.db2.gz	PYFBGFASRWGYQX-NFAWXSAZSA-N	1	1	322.361	1.445	20	5		DDBDMO
CNc1ccc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000520371552	421748183	/nfs/dbraw/zinc/74/81/83/421748183.db2.gz	XGPMTTOAUPVEFC-ZDUSSCGKSA-N	1	1	318.377	1.945	20	5		DDBDMO
C[C@@H]1[C@H](O)CC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000590762141	422323309	/nfs/dbraw/zinc/32/33/09/422323309.db2.gz	GIADTGMAVFCUBS-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@@H]1[C@H](O)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000590762141	422323315	/nfs/dbraw/zinc/32/33/15/422323315.db2.gz	GIADTGMAVFCUBS-BXKDBHETSA-N	1	1	304.306	1.600	20	5		DDBDMO
CSCC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000342316404	271373617	/nfs/dbraw/zinc/37/36/17/271373617.db2.gz	WKKWKYGIILQALP-JTQLQIEISA-N	1	1	317.436	1.956	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269459873	276040250	/nfs/dbraw/zinc/04/02/50/276040250.db2.gz	HMPWLOGPXKTCJK-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CCC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000269459873	276040252	/nfs/dbraw/zinc/04/02/52/276040252.db2.gz	HMPWLOGPXKTCJK-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000269459873	276040254	/nfs/dbraw/zinc/04/02/54/276040254.db2.gz	HMPWLOGPXKTCJK-SNVBAGLBSA-N	1	1	309.370	1.608	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C[C@H](C)[NH2+]1	ZINC000123884187	281179562	/nfs/dbraw/zinc/17/95/62/281179562.db2.gz	WHKUGSHQZJVSAZ-OCAPTIKFSA-N	1	1	305.381	1.027	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(C)cc([N+](=O)[O-])c1	ZINC000170808195	298222232	/nfs/dbraw/zinc/22/22/32/298222232.db2.gz	ZWQSICPJOMLKJI-AWEZNQCLSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=C([C@@H]1C[C@@H]1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295549	300246633	/nfs/dbraw/zinc/24/66/33/300246633.db2.gz	HVUGFFZWCLUJPT-CABCVRRESA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CC2CCCCC2)CC1	ZINC000363295549	300246635	/nfs/dbraw/zinc/24/66/35/300246635.db2.gz	HVUGFFZWCLUJPT-CABCVRRESA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CC2CCCCC2)CC1	ZINC000363295549	300246636	/nfs/dbraw/zinc/24/66/36/300246636.db2.gz	HVUGFFZWCLUJPT-CABCVRRESA-N	1	1	309.410	1.766	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCOCC1	ZINC000363378561	300259889	/nfs/dbraw/zinc/25/98/89/300259889.db2.gz	ABYSBKQFAZKFRV-UHFFFAOYSA-N	1	1	307.350	1.954	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])s1	ZINC000363692485	300297194	/nfs/dbraw/zinc/29/71/94/300297194.db2.gz	MRNJLXFDICYABA-NXEZZACHSA-N	1	1	311.363	1.249	20	5		DDBDMO
CCn1cc(C[N@@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000364328014	300377182	/nfs/dbraw/zinc/37/71/82/300377182.db2.gz	LKJRSKVGBCUHFG-ZDUSSCGKSA-N	1	1	304.354	1.845	20	5		DDBDMO
CCn1cc(C[N@H+]2CCC[C@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000364328014	300377184	/nfs/dbraw/zinc/37/71/84/300377184.db2.gz	LKJRSKVGBCUHFG-ZDUSSCGKSA-N	1	1	304.354	1.845	20	5		DDBDMO
Cc1noc(C2C[NH+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000365576532	300537435	/nfs/dbraw/zinc/53/74/35/300537435.db2.gz	GYKBNUXNRRALMF-CYBMUJFWSA-N	1	1	304.306	1.419	20	5		DDBDMO
Cc1cc(N2CCC[N@@H+](CC(C)(C)O)CC2)ncc1[N+](=O)[O-]	ZINC000368720716	301080801	/nfs/dbraw/zinc/08/08/01/301080801.db2.gz	AJYNZTTUCZRSGP-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
NC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000368957647	301109947	/nfs/dbraw/zinc/10/99/47/301109947.db2.gz	FAFWREAWUAHILJ-UGFHNGPFSA-N	1	1	319.361	1.559	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019333	301120186	/nfs/dbraw/zinc/12/01/86/301120186.db2.gz	XLGWVRMUWQDWJT-ZIAGYGMSSA-N	1	1	323.397	1.149	20	5		DDBDMO
Cc1nc(C)n(C[C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)n1	ZINC000369996092	301254976	/nfs/dbraw/zinc/25/49/76/301254976.db2.gz	LQJCOBRTKQXBAW-CYBMUJFWSA-N	1	1	319.369	1.164	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079651	302140503	/nfs/dbraw/zinc/14/05/03/302140503.db2.gz	CVGROMQSKOONJR-BEAPCOKYSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000377079651	302140504	/nfs/dbraw/zinc/14/05/04/302140504.db2.gz	CVGROMQSKOONJR-BEAPCOKYSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000377079651	302140505	/nfs/dbraw/zinc/14/05/05/302140505.db2.gz	CVGROMQSKOONJR-BEAPCOKYSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[NH+](C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000377688093	302212344	/nfs/dbraw/zinc/21/23/44/302212344.db2.gz	IHMBXLLDENHMKW-XGUBFFRZSA-N	1	1	303.362	1.386	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000538714002	303390307	/nfs/dbraw/zinc/39/03/07/303390307.db2.gz	GFVUDZNREXXXAJ-IAQYHMDHSA-N	1	1	318.377	1.803	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1C(F)F	ZINC000562979038	303905429	/nfs/dbraw/zinc/90/54/29/303905429.db2.gz	BHFOEECAPOTELQ-JTQLQIEISA-N	1	1	303.240	1.413	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3CC[N@@H+](C)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000362254139	307015741	/nfs/dbraw/zinc/01/57/41/307015741.db2.gz	BOCBYPWNTBCYJH-ZYHUDNBSSA-N	1	1	321.381	1.437	20	5		DDBDMO
Cc1ncccc1O[C@@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000365274993	307063303	/nfs/dbraw/zinc/06/33/03/307063303.db2.gz	NMFBHCGXFVJEDS-CYBMUJFWSA-N	1	1	317.349	1.648	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000366630829	307077942	/nfs/dbraw/zinc/07/79/42/307077942.db2.gz	HLNCXLJEUMTGJN-HNNXBMFYSA-N	1	1	308.334	1.988	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@@H]2C1	ZINC000367253623	307089854	/nfs/dbraw/zinc/08/98/54/307089854.db2.gz	SQYSIDXJDYWSPB-YMTOWFKASA-N	1	1	322.340	1.482	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000370887021	307139036	/nfs/dbraw/zinc/13/90/36/307139036.db2.gz	SFTIZXPHFQAKTE-LLVKDONJSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000370887021	307139037	/nfs/dbraw/zinc/13/90/37/307139037.db2.gz	SFTIZXPHFQAKTE-LLVKDONJSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000370887021	307139038	/nfs/dbraw/zinc/13/90/38/307139038.db2.gz	SFTIZXPHFQAKTE-LLVKDONJSA-N	1	1	321.381	1.581	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000370886711	307139095	/nfs/dbraw/zinc/13/90/95/307139095.db2.gz	QKRPFBLTDWWPQJ-SNVBAGLBSA-N	1	1	307.354	1.191	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000370886711	307139096	/nfs/dbraw/zinc/13/90/96/307139096.db2.gz	QKRPFBLTDWWPQJ-SNVBAGLBSA-N	1	1	307.354	1.191	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000370886711	307139097	/nfs/dbraw/zinc/13/90/97/307139097.db2.gz	QKRPFBLTDWWPQJ-SNVBAGLBSA-N	1	1	307.354	1.191	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373938683	307198206	/nfs/dbraw/zinc/19/82/06/307198206.db2.gz	OGZYIQHHQBBERN-STQMWFEESA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000373972939	307198857	/nfs/dbraw/zinc/19/88/57/307198857.db2.gz	KXMQDAHWEVVUBZ-JYJNAYRXSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000373972939	307198858	/nfs/dbraw/zinc/19/88/58/307198858.db2.gz	KXMQDAHWEVVUBZ-JYJNAYRXSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000373972939	307198859	/nfs/dbraw/zinc/19/88/59/307198859.db2.gz	KXMQDAHWEVVUBZ-JYJNAYRXSA-N	1	1	317.389	1.332	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C[C@H]21	ZINC000378474491	307288737	/nfs/dbraw/zinc/28/87/37/307288737.db2.gz	RBEOYIPRHRRNOW-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000425059416	307301807	/nfs/dbraw/zinc/30/18/07/307301807.db2.gz	RPFRZOKBAZAKMR-IINYFYTJSA-N	1	1	307.325	1.900	20	5		DDBDMO
O=C1OCCN1C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000496535491	307349070	/nfs/dbraw/zinc/34/90/70/307349070.db2.gz	RQGCYNCKCDOOLW-CYBMUJFWSA-N	1	1	305.334	1.869	20	5		DDBDMO
CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000573705984	308249651	/nfs/dbraw/zinc/24/96/51/308249651.db2.gz	KWTPKWXLRUFQKN-LLVKDONJSA-N	1	1	322.365	1.642	20	5		DDBDMO
COc1cc(-c2nc(C[NH3+])no2)c([N+](=O)[O-])cc1OC(F)F	ZINC000582180934	325985184	/nfs/dbraw/zinc/98/51/84/325985184.db2.gz	XLEACMHXEGFUDN-UHFFFAOYSA-N	1	1	316.220	1.714	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488807092	484220194	/nfs/dbraw/zinc/22/01/94/484220194.db2.gz	OFNZCSBCJPLCLI-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488807092	484220200	/nfs/dbraw/zinc/22/02/00/484220200.db2.gz	OFNZCSBCJPLCLI-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595875514	490372037	/nfs/dbraw/zinc/37/20/37/490372037.db2.gz	QIPYMBLZMCVMNE-NHYWBVRUSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595875514	490372042	/nfs/dbraw/zinc/37/20/42/490372042.db2.gz	QIPYMBLZMCVMNE-NHYWBVRUSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595875162	490372560	/nfs/dbraw/zinc/37/25/60/490372560.db2.gz	PWFBSUPWRHBQGQ-IOASZLSFSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000330923166	534103772	/nfs/dbraw/zinc/10/37/72/534103772.db2.gz	SGBLICMNESKOFL-STQMWFEESA-N	1	1	320.393	1.630	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@]2(CCOC2)C1	ZINC000451893740	534321697	/nfs/dbraw/zinc/32/16/97/534321697.db2.gz	CEORIJNSUGDCLN-OAHLLOKOSA-N	1	1	307.350	1.259	20	5		DDBDMO
Cc1nc(NC2CC[NH+](CCN(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000296651355	534486339	/nfs/dbraw/zinc/48/63/39/534486339.db2.gz	XKFYBTBCUTYAKT-UHFFFAOYSA-N	1	1	308.386	1.131	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H](C)[C@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820892	521850688	/nfs/dbraw/zinc/85/06/88/521850688.db2.gz	VFVWBQRLPQETAJ-QMTHXVAHSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H](C)[C@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC000154820892	521850697	/nfs/dbraw/zinc/85/06/97/521850697.db2.gz	VFVWBQRLPQETAJ-QMTHXVAHSA-N	1	1	322.365	1.085	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NCC[N@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000101955417	696609438	/nfs/dbraw/zinc/60/94/38/696609438.db2.gz	QASXBBNQRLAQDU-UHFFFAOYSA-N	1	1	324.337	1.881	20	5		DDBDMO
C[C@H](C(=O)OCCn1cc([N+](=O)[O-])cn1)[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000748128314	700101103	/nfs/dbraw/zinc/10/11/03/700101103.db2.gz	DDXBBURXMYFOCY-GRYCIOLGSA-N	1	1	310.354	1.596	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000748349643	700112436	/nfs/dbraw/zinc/11/24/36/700112436.db2.gz	CJAOMKDADXXHOG-NSHDSACASA-N	1	1	323.349	1.145	20	5		DDBDMO
COc1cc(OCC(=O)N2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000748349643	700112438	/nfs/dbraw/zinc/11/24/38/700112438.db2.gz	CJAOMKDADXXHOG-NSHDSACASA-N	1	1	323.349	1.145	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@@H+]1C	ZINC000748345185	700111236	/nfs/dbraw/zinc/11/12/36/700111236.db2.gz	KYAVWBOMQFXHPK-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC[N@H+]1C	ZINC000748345185	700111238	/nfs/dbraw/zinc/11/12/38/700111238.db2.gz	KYAVWBOMQFXHPK-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000155591639	696950463	/nfs/dbraw/zinc/95/04/63/696950463.db2.gz	DIFXFPSRAUGFEX-NXEZZACHSA-N	1	1	322.321	1.668	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983653395	697286733	/nfs/dbraw/zinc/28/67/33/697286733.db2.gz	JBKVEAUQFBCPGF-KBUPBQIOSA-N	1	1	303.362	1.336	20	5		DDBDMO
Cc1nn(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)c(C)c1[N+](=O)[O-]	ZINC000164764615	697337247	/nfs/dbraw/zinc/33/72/47/697337247.db2.gz	MZAGRNWYCZOTBP-ZIAGYGMSSA-N	1	1	307.398	1.782	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@H](c3ccnn3C)C2)cc1[N+](=O)[O-]	ZINC000800860976	700250276	/nfs/dbraw/zinc/25/02/76/700250276.db2.gz	ZQMUQDIUVBNNEN-LBPRGKRZSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H](c3ccnn3C)C2)cc1[N+](=O)[O-]	ZINC000800860976	700250278	/nfs/dbraw/zinc/25/02/78/700250278.db2.gz	ZQMUQDIUVBNNEN-LBPRGKRZSA-N	1	1	304.354	1.670	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCNC(=O)C1	ZINC000726791703	699380795	/nfs/dbraw/zinc/38/07/95/699380795.db2.gz	GYLIYTNUCDHHFK-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCCNC(=O)C1	ZINC000726791703	699380797	/nfs/dbraw/zinc/38/07/97/699380797.db2.gz	GYLIYTNUCDHHFK-UHFFFAOYSA-N	1	1	320.349	1.054	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000791051367	699608942	/nfs/dbraw/zinc/60/89/42/699608942.db2.gz	BRDSXRDAQYMNHO-SNVBAGLBSA-N	1	1	322.283	1.654	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000791051367	699608944	/nfs/dbraw/zinc/60/89/44/699608944.db2.gz	BRDSXRDAQYMNHO-SNVBAGLBSA-N	1	1	322.283	1.654	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2nc3ccccn3c2[N+](=O)[O-])n1C	ZINC000733896058	699622674	/nfs/dbraw/zinc/62/26/74/699622674.db2.gz	ZKUBQYFMNITOPW-UHFFFAOYSA-N	1	1	315.337	1.654	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000794703009	699825358	/nfs/dbraw/zinc/82/53/58/699825358.db2.gz	HALLPESKZSNYEL-CQSZACIVSA-N	1	1	303.322	1.099	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2C[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000794990520	699840811	/nfs/dbraw/zinc/84/08/11/699840811.db2.gz	GCARJBNSZUSZRI-WDNDVIMCSA-N	1	1	306.318	1.324	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000801857541	700347373	/nfs/dbraw/zinc/34/73/73/700347373.db2.gz	FIPXPVRLJVALTE-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)C[C@H]1C	ZINC000754222771	700490044	/nfs/dbraw/zinc/49/00/44/700490044.db2.gz	DBFAIKMZGNGWIH-LLVKDONJSA-N	1	1	306.366	1.652	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2N)C[C@H]1C	ZINC000754222771	700490045	/nfs/dbraw/zinc/49/00/45/700490045.db2.gz	DBFAIKMZGNGWIH-LLVKDONJSA-N	1	1	306.366	1.652	20	5		DDBDMO
O=C(CCc1cccc([N+](=O)[O-])c1)OCCC[NH+]1CCOCC1	ZINC000756530647	700626024	/nfs/dbraw/zinc/62/60/24/700626024.db2.gz	YDUMSHPLMUGHKQ-UHFFFAOYSA-N	1	1	322.361	1.793	20	5		DDBDMO
COC(C)(C)C[N@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000758411786	700704647	/nfs/dbraw/zinc/70/46/47/700704647.db2.gz	IDWAOHZPWOSEFG-UHFFFAOYSA-N	1	1	321.175	1.868	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000758411786	700704648	/nfs/dbraw/zinc/70/46/48/700704648.db2.gz	IDWAOHZPWOSEFG-UHFFFAOYSA-N	1	1	321.175	1.868	20	5		DDBDMO
C[C@@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@@H+]1C	ZINC000761078332	700841010	/nfs/dbraw/zinc/84/10/10/700841010.db2.gz	BOPKJHNCSHYIBW-IUODEOHRSA-N	1	1	318.377	1.336	20	5		DDBDMO
C[C@@H]1CN([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+]1C	ZINC000761078332	700841013	/nfs/dbraw/zinc/84/10/13/700841013.db2.gz	BOPKJHNCSHYIBW-IUODEOHRSA-N	1	1	318.377	1.336	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2cc(OC)cc(F)c2[N+](=O)[O-])C1	ZINC000771200808	701313040	/nfs/dbraw/zinc/31/30/40/701313040.db2.gz	UAFKABBJIQVMAR-SNVBAGLBSA-N	1	1	313.329	1.875	20	5		DDBDMO
O=C(NCCC[N@H+]1CCc2ccccc2C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839517029	701721471	/nfs/dbraw/zinc/72/14/71/701721471.db2.gz	LYZKGOGAUXKYRL-HUUCEWRRSA-N	1	1	303.362	1.216	20	5		DDBDMO
O=C(NCCC[N@@H+]1CCc2ccccc2C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839517029	701721474	/nfs/dbraw/zinc/72/14/74/701721474.db2.gz	LYZKGOGAUXKYRL-HUUCEWRRSA-N	1	1	303.362	1.216	20	5		DDBDMO
O=C(NCCC[N@H+]1CCc2ccccc2C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839517029	701721480	/nfs/dbraw/zinc/72/14/80/701721480.db2.gz	LYZKGOGAUXKYRL-HUUCEWRRSA-N	1	1	303.362	1.216	20	5		DDBDMO
C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839568213	701739101	/nfs/dbraw/zinc/73/91/01/701739101.db2.gz	OBYUGTCXURKAEV-NMFUWQPSSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568213	701739106	/nfs/dbraw/zinc/73/91/06/701739106.db2.gz	OBYUGTCXURKAEV-NMFUWQPSSA-N	1	1	303.362	1.603	20	5		DDBDMO
C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839568213	701739111	/nfs/dbraw/zinc/73/91/11/701739111.db2.gz	OBYUGTCXURKAEV-NMFUWQPSSA-N	1	1	303.362	1.603	20	5		DDBDMO
Cc1nnc([C@@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)[nH]1	ZINC000839660905	701769848	/nfs/dbraw/zinc/76/98/48/701769848.db2.gz	ZLENMCAUWWDJEH-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660905	701769852	/nfs/dbraw/zinc/76/98/52/701769852.db2.gz	ZLENMCAUWWDJEH-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1n[nH]c([C@@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n1	ZINC000839660905	701769856	/nfs/dbraw/zinc/76/98/56/701769856.db2.gz	ZLENMCAUWWDJEH-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660905	701769859	/nfs/dbraw/zinc/76/98/59/701769859.db2.gz	ZLENMCAUWWDJEH-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
Cc1nc([C@@H]2CC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)n[nH]1	ZINC000839660905	701769862	/nfs/dbraw/zinc/76/98/62/701769862.db2.gz	ZLENMCAUWWDJEH-OCCSQVGLSA-N	1	1	317.349	1.544	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@](C)(CO)C1	ZINC000879261387	706633130	/nfs/dbraw/zinc/63/31/30/706633130.db2.gz	JMGVNWZFIXPNRL-SOUVJXGZSA-N	1	1	310.350	1.100	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCS(=O)(=O)C1CC1	ZINC000840963998	702294664	/nfs/dbraw/zinc/29/46/64/702294664.db2.gz	FHKCAGAZJWQYQK-UHFFFAOYSA-N	1	1	318.782	1.915	20	5		DDBDMO
C[N@H+](Cn1cc([N+](=O)[O-])cn1)C[C@@]1(O)CCc2ccccc21	ZINC000842623178	702744435	/nfs/dbraw/zinc/74/44/35/702744435.db2.gz	KMIDMSMANKTPJU-HNNXBMFYSA-N	1	1	302.334	1.515	20	5		DDBDMO
C[N@@H+](Cn1cc([N+](=O)[O-])cn1)C[C@@]1(O)CCc2ccccc21	ZINC000842623178	702744437	/nfs/dbraw/zinc/74/44/37/702744437.db2.gz	KMIDMSMANKTPJU-HNNXBMFYSA-N	1	1	302.334	1.515	20	5		DDBDMO
C[C@@H]1[C@H](COC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC[N@H+]1C	ZINC000845813596	703205311	/nfs/dbraw/zinc/20/53/11/703205311.db2.gz	FDJWZSVNXOTQFE-ZJUUUORDSA-N	1	1	322.317	1.821	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000852495721	704062166	/nfs/dbraw/zinc/06/21/66/704062166.db2.gz	MTMYJOHZMGXXQE-VHDGCEQUSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CCC1(C)C	ZINC000871149380	704230563	/nfs/dbraw/zinc/23/05/63/704230563.db2.gz	FHJTUMFTDHHJTA-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c2ncc([N+](=O)[O-])cc12	ZINC000853587163	704276764	/nfs/dbraw/zinc/27/67/64/704276764.db2.gz	FZHUKHOJHPWXHH-NEPJUHHUSA-N	1	1	317.349	1.574	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CC[N@@H+](C)C1	ZINC000855360483	704480773	/nfs/dbraw/zinc/48/07/73/704480773.db2.gz	LYIQVGCUCRLZCY-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000874834284	705191547	/nfs/dbraw/zinc/19/15/47/705191547.db2.gz	QUSLQUKNTWVUOJ-MNOVXSKESA-N	1	1	306.322	1.004	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC000827269759	705965014	/nfs/dbraw/zinc/96/50/14/705965014.db2.gz	ZUSKEJGTJNQOAH-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@@H+]1C	ZINC000828249364	706146390	/nfs/dbraw/zinc/14/63/90/706146390.db2.gz	ZZZUWWDCXBVOAY-UHIISALHSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000828249364	706146394	/nfs/dbraw/zinc/14/63/94/706146394.db2.gz	ZZZUWWDCXBVOAY-UHIISALHSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000829572829	706358717	/nfs/dbraw/zinc/35/87/17/706358717.db2.gz	ZLEONQWLJQGVDS-SNVBAGLBSA-N	1	1	310.310	1.006	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000829572829	706358719	/nfs/dbraw/zinc/35/87/19/706358719.db2.gz	ZLEONQWLJQGVDS-SNVBAGLBSA-N	1	1	310.310	1.006	20	5		DDBDMO
O=C1NCCCC[C@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865459688	706437329	/nfs/dbraw/zinc/43/73/29/706437329.db2.gz	JJGKXMRYFOZZMP-CQSZACIVSA-N	1	1	300.318	1.646	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430911	706973117	/nfs/dbraw/zinc/97/31/17/706973117.db2.gz	XJLQPXNPKBBGEA-KBPBESRZSA-N	1	1	323.349	1.269	20	5		DDBDMO
CO[C@H]1COCC[C@@H]1[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880430911	706973120	/nfs/dbraw/zinc/97/31/20/706973120.db2.gz	XJLQPXNPKBBGEA-KBPBESRZSA-N	1	1	323.349	1.269	20	5		DDBDMO
O=c1c([N+](=O)[O-])cc(Cl)cn1Cc1[nH+]ccn1CC(F)F	ZINC000871661478	707158410	/nfs/dbraw/zinc/15/84/10/707158410.db2.gz	PUJYPXPOSLPOTI-UHFFFAOYSA-N	1	1	318.667	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)c(Cl)c1	ZINC000872757710	707587141	/nfs/dbraw/zinc/58/71/41/707587141.db2.gz	GFBWMBQUWJNOAW-NWDGAFQWSA-N	1	1	311.769	1.894	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3[C@H]2CCC[N@H+]3C)c([N+](=O)[O-])c1	ZINC000872781604	707597622	/nfs/dbraw/zinc/59/76/22/707597622.db2.gz	VZKYNHHMICEPEL-CHWSQXEVSA-N	1	1	318.377	1.627	20	5		DDBDMO
CC[N@@H+]1CC[C@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000882489550	707660678	/nfs/dbraw/zinc/66/06/78/707660678.db2.gz	DBEQHIJKPLAMSB-LBPRGKRZSA-N	1	1	313.304	1.897	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000882489550	707660682	/nfs/dbraw/zinc/66/06/82/707660682.db2.gz	DBEQHIJKPLAMSB-LBPRGKRZSA-N	1	1	313.304	1.897	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000882490316	707661682	/nfs/dbraw/zinc/66/16/82/707661682.db2.gz	MQSYWVSMDNSSRF-NSHDSACASA-N	1	1	314.345	1.967	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@]2(C)C1	ZINC000896913202	708181136	/nfs/dbraw/zinc/18/11/36/708181136.db2.gz	OETNMDPWRYOBNO-BMIGLBTASA-N	1	1	301.350	1.859	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CSC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000886561816	708777730	/nfs/dbraw/zinc/77/77/30/708777730.db2.gz	JWGGMWPZLXMPOI-PHIMTYICSA-N	1	1	307.375	1.828	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CSC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000886561816	708777731	/nfs/dbraw/zinc/77/77/31/708777731.db2.gz	JWGGMWPZLXMPOI-PHIMTYICSA-N	1	1	307.375	1.828	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000886577974	708780274	/nfs/dbraw/zinc/78/02/74/708780274.db2.gz	DXYADTZBPRABOV-AZHAFVHUSA-N	1	1	319.361	1.625	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@H](c3ncccn3)C2)c([N+](=O)[O-])n1	ZINC000886690626	708814925	/nfs/dbraw/zinc/81/49/25/708814925.db2.gz	ZCZLNZFXNWVCCP-NSHDSACASA-N	1	1	302.338	1.498	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](c3ncccn3)C2)c([N+](=O)[O-])n1	ZINC000886690626	708814929	/nfs/dbraw/zinc/81/49/29/708814929.db2.gz	ZCZLNZFXNWVCCP-NSHDSACASA-N	1	1	302.338	1.498	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000910288546	709869112	/nfs/dbraw/zinc/86/91/12/709869112.db2.gz	WUEOVJAKWNMZIH-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)c1	ZINC000928459941	713206211	/nfs/dbraw/zinc/20/62/11/713206211.db2.gz	YJMPGQZVGIOOKA-STQMWFEESA-N	1	1	321.377	1.881	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000928559605	713226643	/nfs/dbraw/zinc/22/66/43/713226643.db2.gz	ZYDDPLYNRUCVLR-LBPRGKRZSA-N	1	1	302.334	1.439	20	5		DDBDMO
Cc1c(CNC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000894395713	711101957	/nfs/dbraw/zinc/10/19/57/711101957.db2.gz	HWUFSQNSRMBVCR-OKILXGFUSA-N	1	1	318.377	1.606	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+](CCCCCO)CC2)c(F)c1	ZINC000894965996	711342370	/nfs/dbraw/zinc/34/23/70/711342370.db2.gz	KBBGUQCVORLXPE-UHFFFAOYSA-N	1	1	312.345	1.414	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@H]2CC[N@@H+](C)[C@H]2C)c([N+](=O)[O-])c1	ZINC000895738495	711591375	/nfs/dbraw/zinc/59/13/75/711591375.db2.gz	WTPHQFJXUIMQHK-JQWIXIFHSA-N	1	1	307.350	1.815	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCOCC2)n1	ZINC000896524202	711738256	/nfs/dbraw/zinc/73/82/56/711738256.db2.gz	WDBLAOPBOQATSP-CYBMUJFWSA-N	1	1	306.366	1.963	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2CC[N@H+]2C2CCOCC2)c(F)c1	ZINC000896525751	711738628	/nfs/dbraw/zinc/73/86/28/711738628.db2.gz	OITVKBQLKOXQKD-NSHDSACASA-N	1	1	310.329	1.794	20	5		DDBDMO
C[C@@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807203	713303491	/nfs/dbraw/zinc/30/34/91/713303491.db2.gz	XTCOLYBPDLLWJQ-UEKVPHQBSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C)c1ccccc1[N+](=O)[O-]	ZINC000913807203	713303493	/nfs/dbraw/zinc/30/34/93/713303493.db2.gz	XTCOLYBPDLLWJQ-UEKVPHQBSA-N	1	1	307.350	1.227	20	5		DDBDMO
C[C@H](NC(=O)[C@@]1(C)C[C@@H](O)C[N@H+]1C)c1ccc([N+](=O)[O-])cc1	ZINC000908512385	712793331	/nfs/dbraw/zinc/79/33/31/712793331.db2.gz	LBZJLXMFZLQIGH-PSOPSSQASA-N	1	1	307.350	1.227	20	5		DDBDMO
COC1(OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C[C@H]1O	ZINC000931640970	714146822	/nfs/dbraw/zinc/14/68/22/714146822.db2.gz	UBUBFYYPTRPYKJ-CQSZACIVSA-N	1	1	310.350	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](C2OCCO2)C1	ZINC000932007806	714232754	/nfs/dbraw/zinc/23/27/54/714232754.db2.gz	KDPLKWUHWJBEPQ-LBPRGKRZSA-N	1	1	308.334	1.668	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000923299361	714302234	/nfs/dbraw/zinc/30/22/34/714302234.db2.gz	UDJLGXKWUPVSDP-WDEREUQCSA-N	1	1	322.340	1.625	20	5		DDBDMO
CC(C)(C)c1cc2n(n1)CC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000932614909	714367736	/nfs/dbraw/zinc/36/77/36/714367736.db2.gz	QQAXJZWCBSPKSX-UHFFFAOYSA-N	1	1	318.381	1.801	20	5		DDBDMO
CC(C)(C)c1cc2n(n1)CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000932614909	714367738	/nfs/dbraw/zinc/36/77/38/714367738.db2.gz	QQAXJZWCBSPKSX-UHFFFAOYSA-N	1	1	318.381	1.801	20	5		DDBDMO
CC(C)(C)[C@H]1CNC(=O)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000933825197	714676675	/nfs/dbraw/zinc/67/66/75/714676675.db2.gz	CSFVQFQVUIULKZ-CQSZACIVSA-N	1	1	305.378	1.984	20	5		DDBDMO
CC(C)(C)[C@H]1CNC(=O)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000933825197	714676677	/nfs/dbraw/zinc/67/66/77/714676677.db2.gz	CSFVQFQVUIULKZ-CQSZACIVSA-N	1	1	305.378	1.984	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1CN1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934258282	714777753	/nfs/dbraw/zinc/77/77/53/714777753.db2.gz	CMKGNSJLIGXJAX-CVEARBPZSA-N	1	1	323.368	1.765	20	5		DDBDMO
Cc1nc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)s1	ZINC001022063877	734368226	/nfs/dbraw/zinc/36/82/26/734368226.db2.gz	NOQNJUGZKMDIQQ-LSCVPOLPSA-N	1	1	324.406	1.162	20	5		DDBDMO
O=C(NC1CC[NH+](CC2=CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002782104	743423653	/nfs/dbraw/zinc/42/36/53/743423653.db2.gz	HJHOKSJKKSQXLB-HUUCEWRRSA-N	1	1	307.394	1.733	20	5		DDBDMO
O=c1cc([C@@H]2CC[N@@H+](Cc3csc([N+](=O)[O-])c3)C2)[nH]c(=O)[nH]1	ZINC001195694450	746680668	/nfs/dbraw/zinc/68/06/68/746680668.db2.gz	MTYNGVDQMXJPRB-SECBINFHSA-N	1	1	322.346	1.847	20	5		DDBDMO
O=c1cc([C@@H]2CC[N@H+](Cc3csc([N+](=O)[O-])c3)C2)[nH]c(=O)[nH]1	ZINC001195694450	746680669	/nfs/dbraw/zinc/68/06/69/746680669.db2.gz	MTYNGVDQMXJPRB-SECBINFHSA-N	1	1	322.346	1.847	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)c1ccon1	ZINC001031561229	747039648	/nfs/dbraw/zinc/03/96/48/747039648.db2.gz	CYBIPLOSYVMGJG-UHFFFAOYSA-N	1	1	316.317	1.445	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2cncs2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034644062	750626130	/nfs/dbraw/zinc/62/61/30/750626130.db2.gz	BGIIRCSOFFGYNC-FPQZTECRSA-N	1	1	324.406	1.325	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(Cl)cc1-n1cnc(C[NH3+])n1	ZINC001168756775	750746417	/nfs/dbraw/zinc/74/64/17/750746417.db2.gz	RALYGECCBMFHGF-UHFFFAOYSA-N	1	1	311.685	1.074	20	5		DDBDMO
CCOC[C@H]1Cn2nccc2C[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169025784	762203486	/nfs/dbraw/zinc/20/34/86/762203486.db2.gz	UWQQZUWGWUMIDE-ZNMIVQPWSA-N	1	1	322.409	1.797	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC001097190241	756977603	/nfs/dbraw/zinc/97/76/03/756977603.db2.gz	NAHWEXPHIFLHOD-TXEJJXNPSA-N	1	1	321.381	1.389	20	5		DDBDMO
CN(CCNC(=O)C[N@@H+](C)C1CCC1)c1ccccc1[N+](=O)[O-]	ZINC001100386441	776082259	/nfs/dbraw/zinc/08/22/59/776082259.db2.gz	AVFVNNIUDNREAX-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCN(C)C(=O)C[N@H+](C)C(C)C)n1	ZINC001101657888	777354809	/nfs/dbraw/zinc/35/48/09/777354809.db2.gz	WLTYPQSRFRIJNW-UHFFFAOYSA-N	1	1	323.397	1.509	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001101756864	777479775	/nfs/dbraw/zinc/47/97/75/777479775.db2.gz	PWRONXSVZMHOCQ-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cncs1)Cc1ccc([N+](=O)[O-])cc1	ZINC001267187961	837498595	/nfs/dbraw/zinc/49/85/95/837498595.db2.gz	HUUYGCNXMBFBJB-UHFFFAOYSA-N	1	1	320.374	1.913	20	5		DDBDMO
C[N@H+](CCNC(=O)Cn1cccn1)Cc1cccc([N+](=O)[O-])c1	ZINC001266254947	835992882	/nfs/dbraw/zinc/99/28/82/835992882.db2.gz	ARGPPRXHLCEDIW-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cn1cccn1)Cc1cccc([N+](=O)[O-])c1	ZINC001266254947	835992886	/nfs/dbraw/zinc/99/28/86/835992886.db2.gz	ARGPPRXHLCEDIW-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCN([C@@H]2CCC[N@H+](C)C2)CC1	ZINC001326394348	861328860	/nfs/dbraw/zinc/32/88/60/861328860.db2.gz	OBMWYYIXQOYYFC-CQSZACIVSA-N	1	1	319.409	1.514	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NC[C@H]2CCC(=O)N2)ncc1[N+](=O)[O-]	ZINC001156151710	862755278	/nfs/dbraw/zinc/75/52/78/862755278.db2.gz	ROJYWZVDODRBLA-MVIFTORASA-N	1	1	305.338	1.213	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccccc1)C2	ZINC001072725290	857642435	/nfs/dbraw/zinc/64/24/35/857642435.db2.gz	LMXWDCIEBVRCJJ-HUUCEWRRSA-N	1	1	315.373	1.386	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](Cc1ccccc1)C2	ZINC001072725290	857642441	/nfs/dbraw/zinc/64/24/41/857642441.db2.gz	LMXWDCIEBVRCJJ-HUUCEWRRSA-N	1	1	315.373	1.386	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](Cc1ccccc1)C2	ZINC001072725290	857642445	/nfs/dbraw/zinc/64/24/45/857642445.db2.gz	LMXWDCIEBVRCJJ-HUUCEWRRSA-N	1	1	315.373	1.386	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC001123003172	859049493	/nfs/dbraw/zinc/04/94/93/859049493.db2.gz	RHLDJEYWVMVRDE-RYUDHWBXSA-N	1	1	308.338	1.270	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)OC[C@@H]1CCC[N@H+]1CC1CC1	ZINC001123376780	859202652	/nfs/dbraw/zinc/20/26/52/859202652.db2.gz	UWFSHAITWDVGNE-ZDUSSCGKSA-N	1	1	322.365	1.599	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc(Cl)s1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761390	864111207	/nfs/dbraw/zinc/11/12/07/864111207.db2.gz	QKUDTWIYBBUFTA-NXEZZACHSA-N	1	1	317.798	1.663	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC001330570311	864458713	/nfs/dbraw/zinc/45/87/13/864458713.db2.gz	AESZOOKKNROUAC-OSAQELSMSA-N	1	1	321.377	1.569	20	5		DDBDMO
COc1cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)ccc1[N+](=O)[O-]	ZINC001225436623	881832734	/nfs/dbraw/zinc/83/27/34/881832734.db2.gz	XBQHPSRJVMFSDL-RJIBLYRGSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1cc(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)ccc1[N+](=O)[O-]	ZINC001225436623	881832750	/nfs/dbraw/zinc/83/27/50/881832750.db2.gz	XBQHPSRJVMFSDL-RJIBLYRGSA-N	1	1	306.318	1.786	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1cc([N+](=O)[O-])cc2c(Cl)ncnc12	ZINC001159788837	865524396	/nfs/dbraw/zinc/52/43/96/865524396.db2.gz	NFXLGNVGHWFWIO-SNVBAGLBSA-N	1	1	310.745	1.627	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NCC(C)(C)[NH+]1CCN(C)CC1	ZINC001323610529	866720248	/nfs/dbraw/zinc/72/02/48/866720248.db2.gz	RJAFUHDNSAVRME-UHFFFAOYSA-N	1	1	324.429	1.558	20	5		DDBDMO
C[N@@H+]1CCC[C@@](C)(Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C1	ZINC001162338205	867468958	/nfs/dbraw/zinc/46/89/58/867468958.db2.gz	YRTMQLZCZVDNLP-GFCCVEGCSA-N	1	1	300.746	1.778	20	5		DDBDMO
C[N@H+]1CCC[C@@](C)(Nc2c(Cl)[n+]([O-])ccc2[N+](=O)[O-])C1	ZINC001162338205	867468970	/nfs/dbraw/zinc/46/89/70/867468970.db2.gz	YRTMQLZCZVDNLP-GFCCVEGCSA-N	1	1	300.746	1.778	20	5		DDBDMO
O=[N+]([O-])c1cc[n+]([O-])c(NCC[C@H]2CC[NH2+]CC2(F)F)c1	ZINC001162808109	867841092	/nfs/dbraw/zinc/84/10/92/867841092.db2.gz	LUGWAIQRSLNKAY-SECBINFHSA-N	1	1	302.281	1.275	20	5		DDBDMO
C[N@H+]1CC[C@@H](C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001335351187	868242064	/nfs/dbraw/zinc/24/20/64/868242064.db2.gz	OWJOPHGVQKASJG-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
CN1CC[C@@H](C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001335351187	868242079	/nfs/dbraw/zinc/24/20/79/868242079.db2.gz	OWJOPHGVQKASJG-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)n1	ZINC001298101786	870279797	/nfs/dbraw/zinc/27/97/97/870279797.db2.gz	AJJNPSZBJPPSEO-INIZCTEOSA-N	1	1	318.377	1.856	20	5		DDBDMO
C[NH+]1CCN(c2cc(Nc3ccc([N+](=O)[O-])nc3)ncn2)CC1	ZINC001203567058	870646738	/nfs/dbraw/zinc/64/67/38/870646738.db2.gz	VWPKWKIJZCYMOU-UHFFFAOYSA-N	1	1	315.337	1.275	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001339815423	870712357	/nfs/dbraw/zinc/71/23/57/870712357.db2.gz	MPDPUAWHOPFNBN-SMDDNHRTSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@H]2CN(C)CC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815423	870712370	/nfs/dbraw/zinc/71/23/70/870712370.db2.gz	MPDPUAWHOPFNBN-SMDDNHRTSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@@H](C)[C@H]2CN(C)CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815423	870712378	/nfs/dbraw/zinc/71/23/78/870712378.db2.gz	MPDPUAWHOPFNBN-SMDDNHRTSA-N	1	1	308.382	1.650	20	5		DDBDMO
CCn1c(C[N+](=O)[O-])nnc1N1CC[N@H+](C2CCC2)C[C@H](C)C1	ZINC001340112926	870899327	/nfs/dbraw/zinc/89/93/27/870899327.db2.gz	IJJKCDFFKUBWGX-LBPRGKRZSA-N	1	1	322.413	1.385	20	5		DDBDMO
CN(CC[NH2+]CC1CCC2(CC2)CC1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001317584655	871142210	/nfs/dbraw/zinc/14/22/10/871142210.db2.gz	FKJCBFGCGOXHFZ-ZIAGYGMSSA-N	1	1	309.410	1.670	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001347505016	874165470	/nfs/dbraw/zinc/16/54/70/874165470.db2.gz	UOOJJDVBKDPNPE-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891817	874300793	/nfs/dbraw/zinc/30/07/93/874300793.db2.gz	VNQDRCAGKMQEMJ-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc(NC(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc([N+](=O)[O-])c1	ZINC001347891817	874300808	/nfs/dbraw/zinc/30/08/08/874300808.db2.gz	VNQDRCAGKMQEMJ-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC2CC2)C[C@H]1C	ZINC001348145019	874378764	/nfs/dbraw/zinc/37/87/64/874378764.db2.gz	JLMLDVBFJILHMN-VXGBXAGGSA-N	1	1	322.413	1.556	20	5		DDBDMO
O=[N+]([O-])c1cnc(O[C@@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1	ZINC001227111410	882841208	/nfs/dbraw/zinc/84/12/08/882841208.db2.gz	LGMBXRSGJSCRRT-SECBINFHSA-N	1	1	305.250	1.488	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1COC[C@H]1C[N@H+](C)CCO1	ZINC001222777090	880693216	/nfs/dbraw/zinc/69/32/16/880693216.db2.gz	GHQHYWLFUSSXOR-LLVKDONJSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1cccc([N+](=O)[O-])c1COC[C@H]1C[N@@H+](C)CCO1	ZINC001222777090	880693231	/nfs/dbraw/zinc/69/32/31/880693231.db2.gz	GHQHYWLFUSSXOR-LLVKDONJSA-N	1	1	324.333	1.229	20	5		DDBDMO
COc1ccc(CO[C@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC001223651403	881042309	/nfs/dbraw/zinc/04/23/09/881042309.db2.gz	WXZNVYDRWRTFNU-GFCCVEGCSA-N	1	1	310.350	1.841	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CC[N@@H+](C(C)C)C2)cc1O	ZINC001228814219	883685285	/nfs/dbraw/zinc/68/52/85/883685285.db2.gz	KOGYCMLJDQMTNY-SNVBAGLBSA-N	1	1	324.333	1.949	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@@H]2CC[N@H+](C(C)C)C2)cc1O	ZINC001228814219	883685289	/nfs/dbraw/zinc/68/52/89/883685289.db2.gz	KOGYCMLJDQMTNY-SNVBAGLBSA-N	1	1	324.333	1.949	20	5		DDBDMO
CC[N@H+]1CCC[C@H](Oc2nc(NC(C)=O)nc(C)c2[N+](=O)[O-])C1	ZINC001234911804	888246181	/nfs/dbraw/zinc/24/61/81/888246181.db2.gz	QSDWWKMDKFECKM-NSHDSACASA-N	1	1	323.353	1.515	20	5		DDBDMO
N[C@H](Cc1[nH]cc[nH+]1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247347709	893170532	/nfs/dbraw/zinc/17/05/32/893170532.db2.gz	VIQSLHYKULFQOH-SSDOTTSWSA-N	1	1	319.256	1.145	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CCCO1	ZINC001254563643	896502952	/nfs/dbraw/zinc/50/29/52/896502952.db2.gz	ABAOWLRLQWYDOQ-WFASDCNBSA-N	1	1	322.361	1.790	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@@H+]1CC[C@](O)(CF)[C@@H](F)C1)C2	ZINC001254595707	896521124	/nfs/dbraw/zinc/52/11/24/896521124.db2.gz	YNCRIFUJDKGFDZ-KKUMJFAQSA-N	1	1	312.316	1.806	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@@H]([N@H+]1CC[C@](O)(CF)[C@@H](F)C1)C2	ZINC001254595707	896521138	/nfs/dbraw/zinc/52/11/38/896521138.db2.gz	YNCRIFUJDKGFDZ-KKUMJFAQSA-N	1	1	312.316	1.806	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CCN3CCOC[C@@H]3C1)C2	ZINC001254593127	896521935	/nfs/dbraw/zinc/52/19/35/896521935.db2.gz	ISWKNAHUSOXPGB-CVEARBPZSA-N	1	1	303.362	1.078	20	5		DDBDMO
O=C1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]2CCCN12	ZINC001254605307	896526880	/nfs/dbraw/zinc/52/68/80/896526880.db2.gz	BDLKYZGGFSAPOD-HOTGVXAUSA-N	1	1	315.373	1.759	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C[C@]2(C)C1	ZINC001262346304	900128475	/nfs/dbraw/zinc/12/84/75/900128475.db2.gz	PNZFAPBHZZSRGW-PSLIRLAXSA-N	1	1	322.340	1.340	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNc2c([N+](=O)[O-])cnn2C)C[C@H](C)O1	ZINC001262360008	900130536	/nfs/dbraw/zinc/13/05/36/900130536.db2.gz	RUHMTQZEZYHNKK-TXEJJXNPSA-N	1	1	311.386	1.630	20	5		DDBDMO
C[N@H+](C/C=C/c1ccccc1)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001264985076	901393641	/nfs/dbraw/zinc/39/36/41/901393641.db2.gz	LUJKBWIHTWSMBL-IBBQAADRSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@@H+](C/C=C/c1ccccc1)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985076	901393651	/nfs/dbraw/zinc/39/36/51/901393651.db2.gz	LUJKBWIHTWSMBL-IBBQAADRSA-N	1	1	317.389	1.803	20	5		DDBDMO
C[N@H+](C/C=C/c1ccccc1)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001264985076	901393659	/nfs/dbraw/zinc/39/36/59/901393659.db2.gz	LUJKBWIHTWSMBL-IBBQAADRSA-N	1	1	317.389	1.803	20	5		DDBDMO
COc1ccc(OCCN2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000451626498	231143207	/nfs/dbraw/zinc/14/32/07/231143207.db2.gz	FFXHXUFIWAMVEY-SWLSCSKDSA-N	1	1	321.377	1.618	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000451661264	231155733	/nfs/dbraw/zinc/15/57/33/231155733.db2.gz	HZGYZMDHFIRFTE-BETUJISGSA-N	1	1	323.393	1.490	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CCC[N@H+]2CCCO)ccc1[N+](=O)[O-]	ZINC000452347630	231355391	/nfs/dbraw/zinc/35/53/91/231355391.db2.gz	JEQHZWIZBCMJOL-CQSZACIVSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC(C)[N@H+](C)C[C@@H](C)NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000358133231	299085181	/nfs/dbraw/zinc/08/51/81/299085181.db2.gz	PZYMWISOBPTRID-LLVKDONJSA-N	1	1	311.386	1.371	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[C@H]1CCC[N@H+](C)C1	ZINC000458180748	232268252	/nfs/dbraw/zinc/26/82/52/232268252.db2.gz	ZAOAVZBBGVOJHH-GFCCVEGCSA-N	1	1	306.366	1.760	20	5		DDBDMO
CON1CCC([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000459594187	233353151	/nfs/dbraw/zinc/35/31/51/233353151.db2.gz	XPEHBVPKSPZJDX-UHFFFAOYSA-N	1	1	309.366	1.931	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000057554924	352820240	/nfs/dbraw/zinc/82/02/40/352820240.db2.gz	SHQJJIGJHCWEKY-SNVBAGLBSA-N	1	1	305.334	1.570	20	5		DDBDMO
COC1CC[NH+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000067376137	353046312	/nfs/dbraw/zinc/04/63/12/353046312.db2.gz	CZZIAJKDQQDQED-HNNXBMFYSA-N	1	1	319.361	1.811	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174241754	198310260	/nfs/dbraw/zinc/31/02/60/198310260.db2.gz	XKEDJNYAXJJLRC-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)c1	ZINC000108301062	353949006	/nfs/dbraw/zinc/94/90/06/353949006.db2.gz	LPPIONYTSIAXAD-LBPRGKRZSA-N	1	1	319.361	1.818	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCCO)CC1	ZINC000154892600	354209463	/nfs/dbraw/zinc/20/94/63/354209463.db2.gz	ARHNSNXZGFJNHB-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@H+](C)CCO1	ZINC000156796135	354221818	/nfs/dbraw/zinc/22/18/18/354221818.db2.gz	UBEZHSDJULELLZ-IUODEOHRSA-N	1	1	321.377	1.363	20	5		DDBDMO
C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCO1	ZINC000156796135	354221819	/nfs/dbraw/zinc/22/18/19/354221819.db2.gz	UBEZHSDJULELLZ-IUODEOHRSA-N	1	1	321.377	1.363	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H](O)C1CC1	ZINC000305730648	354471258	/nfs/dbraw/zinc/47/12/58/354471258.db2.gz	KIYQMCRENGQLKC-YGRLFVJLSA-N	1	1	307.350	1.625	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NC[C@@H]1CCCC[NH2+]1	ZINC000314019995	354483484	/nfs/dbraw/zinc/48/34/84/354483484.db2.gz	IQBPWBFJHJBIKM-VIFPVBQESA-N	1	1	317.342	1.154	20	5		DDBDMO
C[N@@H+](CCNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])C1CC1	ZINC000314998627	354490587	/nfs/dbraw/zinc/49/05/87/354490587.db2.gz	IXZPXJQBFXLZHR-UHFFFAOYSA-N	1	1	303.322	1.750	20	5		DDBDMO
NC(=O)C[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000589209261	354973977	/nfs/dbraw/zinc/97/39/77/354973977.db2.gz	BLLWSSUWDRGVKZ-JTQLQIEISA-N	1	1	321.333	1.063	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590044204	355042368	/nfs/dbraw/zinc/04/23/68/355042368.db2.gz	IFRXHFZPJYPXOM-ZFWWWQNUSA-N	1	1	303.362	1.933	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](C)c1cn[nH]c1	ZINC000494623410	235062367	/nfs/dbraw/zinc/06/23/67/235062367.db2.gz	ZBGUHCMTNDJBGU-SNVBAGLBSA-N	1	1	303.322	1.916	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590441582	355095552	/nfs/dbraw/zinc/09/55/52/355095552.db2.gz	DAKPKNWYHNDAFA-RISCZKNCSA-N	1	1	304.350	1.413	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[C@H](C[NH+]3CCOCC3)C2)c(F)c1	ZINC000591147747	355254944	/nfs/dbraw/zinc/25/49/44/355254944.db2.gz	LFMJFGXHONZIEV-LLVKDONJSA-N	1	1	310.329	1.287	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1c1ncc([N+](=O)[O-])cc1F	ZINC000591155623	355256720	/nfs/dbraw/zinc/25/67/20/355256720.db2.gz	SEIWNGBBKOLMSX-JTQLQIEISA-N	1	1	312.345	1.410	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N(C)CCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000592798733	355696501	/nfs/dbraw/zinc/69/65/01/355696501.db2.gz	RGOCUICLHIFEFK-TZMCWYRMSA-N	1	1	305.378	1.936	20	5		DDBDMO
CCCN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000592828096	355704820	/nfs/dbraw/zinc/70/48/20/355704820.db2.gz	BNJAXCRZURDKHR-LLVKDONJSA-N	1	1	308.338	1.252	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC000593175626	355817051	/nfs/dbraw/zinc/81/70/51/355817051.db2.gz	WRBJKOAKQIAFHU-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(N3CC([N@H+]4CC[C@@H](O)C4)C3)c2c1	ZINC000593505628	355906736	/nfs/dbraw/zinc/90/67/36/355906736.db2.gz	YFJCJUFUXAJCAX-CQSZACIVSA-N	1	1	314.345	1.398	20	5		DDBDMO
COCCOCC[NH+]1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1	ZINC000593516236	355910649	/nfs/dbraw/zinc/91/06/49/355910649.db2.gz	BPVKVBLZQAIBLM-UHFFFAOYSA-N	1	1	324.381	1.083	20	5		DDBDMO
C[C@H]1CN(c2ccnc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CCO	ZINC000593468918	355895537	/nfs/dbraw/zinc/89/55/37/355895537.db2.gz	GAEWDFKGGWTRBO-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
COC(=O)C[C@]1([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])CCOC1	ZINC000595442479	356494689	/nfs/dbraw/zinc/49/46/89/356494689.db2.gz	SEZIVVWUXIMLIT-CQSZACIVSA-N	1	1	312.297	1.546	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1	ZINC000595607967	356574105	/nfs/dbraw/zinc/57/41/05/356574105.db2.gz	MDIBRYNZNAZYDG-CYBMUJFWSA-N	1	1	317.349	1.587	20	5		DDBDMO
COc1cc(C[N@H+]2CCC[C@](CO)(OC)C2)ccc1[N+](=O)[O-]	ZINC000595660250	356596603	/nfs/dbraw/zinc/59/66/03/356596603.db2.gz	TVJYGDFAFWBDRL-HNNXBMFYSA-N	1	1	310.350	1.577	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH2+][C@H](CO)c2ccc(F)cc2F)c1	ZINC000595868025	356685165	/nfs/dbraw/zinc/68/51/65/356685165.db2.gz	QQFNKWFOHMKRBG-CYBMUJFWSA-N	1	1	312.276	1.393	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ccc(N)c([N+](=O)[O-])n1	ZINC000596214205	356816776	/nfs/dbraw/zinc/81/67/76/356816776.db2.gz	PDAGTDWCGQELAI-LLVKDONJSA-N	1	1	321.381	1.262	20	5		DDBDMO
Cn1c(C(=O)NC[C@H]2CC[N@H+](C(C)(C)C)C2)ccc1[N+](=O)[O-]	ZINC000597855011	357359048	/nfs/dbraw/zinc/35/90/48/357359048.db2.gz	OXIYLKXZGDFKGS-LLVKDONJSA-N	1	1	308.382	1.784	20	5		DDBDMO
CCN(C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000598041279	357439415	/nfs/dbraw/zinc/43/94/15/357439415.db2.gz	SFCAIXINGURTQK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@H+](CC)C1	ZINC000598041279	357439416	/nfs/dbraw/zinc/43/94/16/357439416.db2.gz	SFCAIXINGURTQK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CCN(C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1	ZINC000598041279	357439418	/nfs/dbraw/zinc/43/94/18/357439418.db2.gz	SFCAIXINGURTQK-NSHDSACASA-N	1	1	323.397	1.998	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000598341615	357543852	/nfs/dbraw/zinc/54/38/52/357543852.db2.gz	DSGPGXBNXHXYGR-CYBMUJFWSA-N	1	1	323.397	1.399	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1nccc(C(=O)OC)c1[N+](=O)[O-]	ZINC000598592920	357645099	/nfs/dbraw/zinc/64/50/99/357645099.db2.gz	NDEAINCJYVNSOB-SNVBAGLBSA-N	1	1	310.354	1.919	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@@H](O)C2)c2ccncc21	ZINC000599176769	357840472	/nfs/dbraw/zinc/84/04/72/357840472.db2.gz	XHTKEPVHVQVZMA-LLVKDONJSA-N	1	1	302.334	1.622	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2NCC[N@@H+]1CC[C@H](O)C1	ZINC000599198978	357847385	/nfs/dbraw/zinc/84/73/85/357847385.db2.gz	DKHCPAFPIRQXNH-LBPRGKRZSA-N	1	1	302.334	1.622	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCC1)Nc1ccncc1[N+](=O)[O-]	ZINC000599766048	358053023	/nfs/dbraw/zinc/05/30/23/358053023.db2.gz	IJLOXWIFIPVZJX-GFCCVEGCSA-N	1	1	319.365	1.550	20	5		DDBDMO
Nc1c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-]	ZINC000600474577	358234934	/nfs/dbraw/zinc/23/49/34/358234934.db2.gz	YZZPAVIUFPFLPJ-GFCCVEGCSA-N	1	1	318.377	1.924	20	5		DDBDMO
COc1cncc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1	ZINC000601148938	358422029	/nfs/dbraw/zinc/42/20/29/358422029.db2.gz	HRKSBEZMBDESIH-MRXNPFEDSA-N	1	1	317.345	1.996	20	5		DDBDMO
Cc1ncc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)n1C	ZINC000601148454	358422146	/nfs/dbraw/zinc/42/21/46/358422146.db2.gz	BZNIFKOGDOYAJP-HNNXBMFYSA-N	1	1	304.350	1.634	20	5		DDBDMO
Cc1[nH+]cc(CN[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)n1C	ZINC000601148454	358422147	/nfs/dbraw/zinc/42/21/47/358422147.db2.gz	BZNIFKOGDOYAJP-HNNXBMFYSA-N	1	1	304.350	1.634	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@@H](CO)[C@@H]3CCCOC3)c2c1	ZINC000601176870	358434513	/nfs/dbraw/zinc/43/45/13/358434513.db2.gz	SGVZNHMPAOSTDK-BZNIZROVSA-N	1	1	317.345	1.764	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601776271	358690567	/nfs/dbraw/zinc/69/05/67/358690567.db2.gz	IGBIWJSGGJZNGJ-HNNXBMFYSA-N	1	1	309.366	1.259	20	5		DDBDMO
C[N@H+]1CC[C@@H](CC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000602045169	358789407	/nfs/dbraw/zinc/78/94/07/358789407.db2.gz	KYOVQFFXBJXILI-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3nc4cc([N+](=O)[O-])ccc4o3)[C@@H]2C1	ZINC000602673584	359118592	/nfs/dbraw/zinc/11/85/92/359118592.db2.gz	WAVQSHPJGFRCTJ-ZWNOBZJWSA-N	1	1	302.334	1.872	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H]1[C@@H](O)C(F)(F)F	ZINC000602775667	359182486	/nfs/dbraw/zinc/18/24/86/359182486.db2.gz	MAFJAVFFTSAAQN-MWLCHTKSSA-N	1	1	322.287	1.487	20	5		DDBDMO
CCOCCO[C@H]1CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602800424	359200248	/nfs/dbraw/zinc/20/02/48/359200248.db2.gz	MNAIXOODUKTZKJ-ZDUSSCGKSA-N	1	1	312.370	1.227	20	5		DDBDMO
COc1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)nc1	ZINC000602962492	359325416	/nfs/dbraw/zinc/32/54/16/359325416.db2.gz	KIKBKXNBPGGHJM-INIZCTEOSA-N	1	1	317.345	1.996	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1Cn1cc(C[NH+]2CCCC2)nn1	ZINC000603244837	359511422	/nfs/dbraw/zinc/51/14/22/359511422.db2.gz	VTRXRXNHHAYPFS-UHFFFAOYSA-N	1	1	317.349	1.839	20	5		DDBDMO
C[C@H]1CC[NH2+]C[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000186766430	200006107	/nfs/dbraw/zinc/00/61/07/200006107.db2.gz	HFBXFUUYFWPKBJ-QPUJVOFHSA-N	1	1	303.322	1.199	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000187091458	200060482	/nfs/dbraw/zinc/06/04/82/200060482.db2.gz	DXCIILOFYYGNSQ-GFCCVEGCSA-N	1	1	322.365	1.690	20	5		DDBDMO
C[C@@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@H]1C[N@H+](C)CCO1	ZINC000618588303	363684034	/nfs/dbraw/zinc/68/40/34/363684034.db2.gz	XCBNDNGXHGCPRH-NOZJJQNGSA-N	1	1	305.338	1.024	20	5		DDBDMO
C[C@@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@H]1C[N@@H+](C)CCO1	ZINC000618588303	363684035	/nfs/dbraw/zinc/68/40/35/363684035.db2.gz	XCBNDNGXHGCPRH-NOZJJQNGSA-N	1	1	305.338	1.024	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@H+]1CCCOCC1	ZINC000188838523	200310970	/nfs/dbraw/zinc/31/09/70/200310970.db2.gz	ZFQZWJRXUNHARZ-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2csc([N+](=O)[O-])c2)C1	ZINC000609269456	360285184	/nfs/dbraw/zinc/28/51/84/360285184.db2.gz	QZNBVVCFFCBFAW-NSHDSACASA-N	1	1	313.379	1.497	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000609269443	360285289	/nfs/dbraw/zinc/28/52/89/360285289.db2.gz	QPVCPWUCNSVRDW-CYBMUJFWSA-N	1	1	307.350	1.435	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C(C)(C)CO	ZINC000609894842	360362779	/nfs/dbraw/zinc/36/27/79/360362779.db2.gz	DPHHJHDRWCLUAX-UHFFFAOYSA-N	1	1	307.350	1.187	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)[C@@H]2CC[N@H+](C)C2)c([N+](=O)[O-])c1	ZINC000610069332	360378295	/nfs/dbraw/zinc/37/82/95/360378295.db2.gz	LOVBDWGOQAHPGN-CYBMUJFWSA-N	1	1	320.393	1.773	20	5		DDBDMO
Cc1cc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC000610489196	360449882	/nfs/dbraw/zinc/44/98/82/360449882.db2.gz	LSBXRSSWQOHHQG-CQSZACIVSA-N	1	1	320.393	1.989	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000610920549	360571554	/nfs/dbraw/zinc/57/15/54/360571554.db2.gz	QFTVDFSDQFVLLY-VIFPVBQESA-N	1	1	307.354	1.408	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000610922439	360572714	/nfs/dbraw/zinc/57/27/14/360572714.db2.gz	BALPZUZKTOJCGC-LLVKDONJSA-N	1	1	321.381	1.655	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611561471	360759776	/nfs/dbraw/zinc/75/97/76/360759776.db2.gz	JKYVDYALLWVJPW-GHMZBOCLSA-N	1	1	308.334	1.569	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)nc1	ZINC000612778499	361142824	/nfs/dbraw/zinc/14/28/24/361142824.db2.gz	LVZLZLUYQLTMEU-CYBMUJFWSA-N	1	1	307.354	1.076	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@@]3(C2)NC(=O)NC3=O)cc1[N+](=O)[O-]	ZINC000193470345	201058287	/nfs/dbraw/zinc/05/82/87/201058287.db2.gz	ZMOKORLBYKWWAX-HNNXBMFYSA-N	1	1	318.333	1.077	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@@]3(C2)NC(=O)NC3=O)cc1[N+](=O)[O-]	ZINC000193470345	201058291	/nfs/dbraw/zinc/05/82/91/201058291.db2.gz	ZMOKORLBYKWWAX-HNNXBMFYSA-N	1	1	318.333	1.077	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000194908248	201309616	/nfs/dbraw/zinc/30/96/16/201309616.db2.gz	BPQHJBKYXMEZLJ-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000619536090	364051360	/nfs/dbraw/zinc/05/13/60/364051360.db2.gz	IQOMHTJAJVKRLU-GFCCVEGCSA-N	1	1	307.350	1.492	20	5		DDBDMO
CCOCC[N@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000093315164	193230185	/nfs/dbraw/zinc/23/01/85/193230185.db2.gz	XYTNYROZMBIXPI-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CCOCC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000093315164	193230187	/nfs/dbraw/zinc/23/01/87/193230187.db2.gz	XYTNYROZMBIXPI-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc([N+](=O)[O-])c2cccnc12	ZINC000264821343	204182944	/nfs/dbraw/zinc/18/29/44/204182944.db2.gz	XUCLYZWBXHSKLE-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000264821343	204182949	/nfs/dbraw/zinc/18/29/49/204182949.db2.gz	XUCLYZWBXHSKLE-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000264821343	204182952	/nfs/dbraw/zinc/18/29/52/204182952.db2.gz	XUCLYZWBXHSKLE-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000288336161	220092141	/nfs/dbraw/zinc/09/21/41/220092141.db2.gz	IMGRSZJNGZKJJN-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000288336161	220092143	/nfs/dbraw/zinc/09/21/43/220092143.db2.gz	IMGRSZJNGZKJJN-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000266210213	205184433	/nfs/dbraw/zinc/18/44/33/205184433.db2.gz	XSVFDSGCWVYEHG-LBPRGKRZSA-N	1	1	309.370	1.124	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1	ZINC000288403708	220135918	/nfs/dbraw/zinc/13/59/18/220135918.db2.gz	LHQIHRJATASARS-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1	ZINC000288403708	220135920	/nfs/dbraw/zinc/13/59/20/220135920.db2.gz	LHQIHRJATASARS-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000266418134	205331570	/nfs/dbraw/zinc/33/15/70/205331570.db2.gz	PDQDLBBEIAIUMO-AWEZNQCLSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)c1	ZINC000282941041	217340472	/nfs/dbraw/zinc/34/04/72/217340472.db2.gz	ZVKZATMVDHPORN-TXEJJXNPSA-N	1	1	319.361	1.627	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(CCOc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000284481179	218045100	/nfs/dbraw/zinc/04/51/00/218045100.db2.gz	AWCVUDAWKDAUMK-GDBMZVCRSA-N	1	1	321.377	1.379	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCCCC1)C(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000285113222	218295240	/nfs/dbraw/zinc/29/52/40/218295240.db2.gz	MBYFAJZNJKEWSC-UHFFFAOYSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC(C)(O)CC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000339736769	250634772	/nfs/dbraw/zinc/63/47/72/250634772.db2.gz	NZEFZOTVABSYAP-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000058925582	184131567	/nfs/dbraw/zinc/13/15/67/184131567.db2.gz	QCZHVDCRFWLFDL-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1O	ZINC000341004208	251329878	/nfs/dbraw/zinc/32/98/78/251329878.db2.gz	AMLIPNGNJFPAGQ-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@H]1O	ZINC000341004208	251329881	/nfs/dbraw/zinc/32/98/81/251329881.db2.gz	AMLIPNGNJFPAGQ-BXUZGUMPSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CCC[NH2+]C1	ZINC000269159268	207283429	/nfs/dbraw/zinc/28/34/29/207283429.db2.gz	APJHZENUJBSFQX-UWVGGRQHSA-N	1	1	317.349	1.589	20	5		DDBDMO
COC(=O)[C@H]1CN(c2ccc([N+](=O)[O-])c(OC)c2)CC[N@@H+](C)C1	ZINC000413503516	533010025	/nfs/dbraw/zinc/01/00/25/533010025.db2.gz	SJFOYMIULPJFII-LLVKDONJSA-N	1	1	323.349	1.144	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000156561677	197123311	/nfs/dbraw/zinc/12/33/11/197123311.db2.gz	JQJBSKOPJPPVAD-DYEKYZERSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1[C@H](C)OCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000156561677	197123313	/nfs/dbraw/zinc/12/33/13/197123313.db2.gz	JQJBSKOPJPPVAD-DYEKYZERSA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000072860139	406886203	/nfs/dbraw/zinc/88/62/03/406886203.db2.gz	WSLXWTJMPNKUCC-CYBMUJFWSA-N	1	1	320.393	1.807	20	5		DDBDMO
C[N@H+](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])C1CC1	ZINC000089620214	407141974	/nfs/dbraw/zinc/14/19/74/407141974.db2.gz	RNQAJMXTDXVLKZ-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@@H+](CCNc1cccc(S(C)(=O)=O)c1[N+](=O)[O-])C1CC1	ZINC000089620214	407141975	/nfs/dbraw/zinc/14/19/75/407141975.db2.gz	RNQAJMXTDXVLKZ-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000102486956	407323409	/nfs/dbraw/zinc/32/34/09/407323409.db2.gz	WQHLALCCZDXHMF-LLVKDONJSA-N	1	1	309.370	1.127	20	5		DDBDMO
CC(C)OC[C@@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000098066287	407304972	/nfs/dbraw/zinc/30/49/72/407304972.db2.gz	OPLCOLNJLYMJAW-AWEZNQCLSA-N	1	1	323.393	1.503	20	5		DDBDMO
CCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000105790869	407354349	/nfs/dbraw/zinc/35/43/49/407354349.db2.gz	FMSNPSPUTHJMCY-UHFFFAOYSA-N	1	1	324.337	1.662	20	5		DDBDMO
CCOC[C@H](O)C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000105795384	407354825	/nfs/dbraw/zinc/35/48/25/407354825.db2.gz	WZVCPCMDWFUWAI-CYBMUJFWSA-N	1	1	309.366	1.114	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC000107892727	407381300	/nfs/dbraw/zinc/38/13/00/407381300.db2.gz	YNNJVWSYAYKFJO-SNVBAGLBSA-N	1	1	322.321	1.575	20	5		DDBDMO
CCC(=O)N1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000125589329	407392443	/nfs/dbraw/zinc/39/24/43/407392443.db2.gz	SJRCFKKKLDOXSP-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000126469145	407413684	/nfs/dbraw/zinc/41/36/84/407413684.db2.gz	LLGLWCJQYKMWLV-BIBXISHDSA-N	1	1	300.380	1.672	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000271005834	407464975	/nfs/dbraw/zinc/46/49/75/407464975.db2.gz	ZEZYSRVSKDWVEW-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000271005834	407464980	/nfs/dbraw/zinc/46/49/80/407464980.db2.gz	ZEZYSRVSKDWVEW-NHYWBVRUSA-N	1	1	319.361	1.187	20	5		DDBDMO
COC[C@H]1CC[N@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000265821215	407469014	/nfs/dbraw/zinc/46/90/14/407469014.db2.gz	RZKBQDHNBMYEHP-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000265821215	407469020	/nfs/dbraw/zinc/46/90/20/407469020.db2.gz	RZKBQDHNBMYEHP-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C[C@@H]1O	ZINC000270968062	407443910	/nfs/dbraw/zinc/44/39/10/407443910.db2.gz	VTOGBQOVBXQCDG-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000270999638	407460261	/nfs/dbraw/zinc/46/02/61/407460261.db2.gz	YSKBSBUVENXMOG-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@@H]1O	ZINC000270999638	407460263	/nfs/dbraw/zinc/46/02/63/407460263.db2.gz	YSKBSBUVENXMOG-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(O)CCCC1	ZINC000152180022	407579291	/nfs/dbraw/zinc/57/92/91/407579291.db2.gz	YOVHCXMAXUXUHX-CQSZACIVSA-N	1	1	324.377	1.571	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])CC(C)(C)O	ZINC000114487147	407582696	/nfs/dbraw/zinc/58/26/96/407582696.db2.gz	KJKZDTMOTVMLNB-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2ccc[nH]2)c1	ZINC000266624925	407582993	/nfs/dbraw/zinc/58/29/93/407582993.db2.gz	HAULTVOPEKZBFP-OCCSQVGLSA-N	1	1	305.338	1.317	20	5		DDBDMO
COCC1=CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000185815515	407511183	/nfs/dbraw/zinc/51/11/83/407511183.db2.gz	SVAPUADVUQQFDB-AWEZNQCLSA-N	1	1	322.361	1.613	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000152331060	407614155	/nfs/dbraw/zinc/61/41/55/407614155.db2.gz	CABKFYHKLUYYPD-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2cc(OC)c(OC)cc2[N+](=O)[O-])C[C@H]1O	ZINC000271347252	407646327	/nfs/dbraw/zinc/64/63/27/407646327.db2.gz	PGOWBHLFANAJPY-GXFFZTMASA-N	1	1	310.350	1.815	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)C1	ZINC000152821604	407698435	/nfs/dbraw/zinc/69/84/35/407698435.db2.gz	XVMUNMUJUVJSFZ-GFCCVEGCSA-N	1	1	309.341	1.877	20	5		DDBDMO
CC[NH+](CC)[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])CC(C)C	ZINC000152903839	407712603	/nfs/dbraw/zinc/71/26/03/407712603.db2.gz	IMUCKVAKTAKJPA-LLVKDONJSA-N	1	1	311.386	1.804	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C)CC23CCCCC3)c1[N+](=O)[O-]	ZINC000267062575	407732841	/nfs/dbraw/zinc/73/28/41/407732841.db2.gz	AEQCCZJJUYNBGQ-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C)CC23CCCCC3)c1[N+](=O)[O-]	ZINC000267062575	407732845	/nfs/dbraw/zinc/73/28/45/407732845.db2.gz	AEQCCZJJUYNBGQ-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C)CC23CCCCC3)c1[N+](=O)[O-]	ZINC000267062575	407732849	/nfs/dbraw/zinc/73/28/49/407732849.db2.gz	AEQCCZJJUYNBGQ-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@@H]1O	ZINC000186797456	407773258	/nfs/dbraw/zinc/77/32/58/407773258.db2.gz	VGJPRKOGAFGXNM-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC[C@@H]1O	ZINC000186797456	407773263	/nfs/dbraw/zinc/77/32/63/407773263.db2.gz	VGJPRKOGAFGXNM-YGRLFVJLSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1[nH]ncc1[N+](=O)[O-])Cc1ccc(F)cc1	ZINC000132349127	407781447	/nfs/dbraw/zinc/78/14/47/407781447.db2.gz	LCXCWUCRSYDNKO-UHFFFAOYSA-N	1	1	321.312	1.319	20	5		DDBDMO
C[N@H+](CCNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccc(F)cc1	ZINC000132349127	407781454	/nfs/dbraw/zinc/78/14/54/407781454.db2.gz	LCXCWUCRSYDNKO-UHFFFAOYSA-N	1	1	321.312	1.319	20	5		DDBDMO
Cn1cc([C@@H]2C[NH2+]CCN2C(=O)c2csc([N+](=O)[O-])c2)cn1	ZINC000181330647	407982067	/nfs/dbraw/zinc/98/20/67/407982067.db2.gz	ZEPSXCHONSRGOP-NSHDSACASA-N	1	1	321.362	1.177	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000268158901	407921438	/nfs/dbraw/zinc/92/14/38/407921438.db2.gz	HNJFNEJZLORCAO-PELKAZGASA-N	1	1	322.340	1.529	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000268162288	407924337	/nfs/dbraw/zinc/92/43/37/407924337.db2.gz	CZEFGTNBLRUUKA-SMDDNHRTSA-N	1	1	303.362	1.736	20	5		DDBDMO
CC[NH+](CC)[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000272488349	407943246	/nfs/dbraw/zinc/94/32/46/407943246.db2.gz	GXIRMJJMCVPDLT-GFCCVEGCSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000272562886	407984800	/nfs/dbraw/zinc/98/48/00/407984800.db2.gz	UNRDILDCLUKAFC-GXTWGEPZSA-N	1	1	319.361	1.526	20	5		DDBDMO
NC(=O)NC(=O)CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000135229126	407991566	/nfs/dbraw/zinc/99/15/66/407991566.db2.gz	SDFUTZRLGJJUHM-UHFFFAOYSA-N	1	1	306.322	1.144	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000175239084	408088235	/nfs/dbraw/zinc/08/82/35/408088235.db2.gz	VPLXMZAZNHIVHC-LLVKDONJSA-N	1	1	320.349	1.121	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000175239084	408088240	/nfs/dbraw/zinc/08/82/40/408088240.db2.gz	VPLXMZAZNHIVHC-LLVKDONJSA-N	1	1	320.349	1.121	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000175326421	408106498	/nfs/dbraw/zinc/10/64/98/408106498.db2.gz	XBIRNPJFFYGBLD-NSHDSACASA-N	1	1	322.365	1.499	20	5		DDBDMO
CC(C)[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000155586885	408183022	/nfs/dbraw/zinc/18/30/22/408183022.db2.gz	TWHUBHJJPUJWOF-UHFFFAOYSA-N	1	1	301.368	1.213	20	5		DDBDMO
C[C@H](O)C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)CO	ZINC000190831599	408327897	/nfs/dbraw/zinc/32/78/97/408327897.db2.gz	AICUYZCJOPXMML-UWVGGRQHSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](C)CO	ZINC000190831599	408327901	/nfs/dbraw/zinc/32/79/01/408327901.db2.gz	AICUYZCJOPXMML-UWVGGRQHSA-N	1	1	302.758	1.812	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190860780	408333273	/nfs/dbraw/zinc/33/32/73/408333273.db2.gz	UHYUGJWVKWSEHX-MNOVXSKESA-N	1	1	323.349	1.102	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190860780	408333277	/nfs/dbraw/zinc/33/32/77/408333277.db2.gz	UHYUGJWVKWSEHX-MNOVXSKESA-N	1	1	323.349	1.102	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2	ZINC000158575569	408347936	/nfs/dbraw/zinc/34/79/36/408347936.db2.gz	AQUIAOSMNBEMLR-GXTWGEPZSA-N	1	1	321.352	1.972	20	5		DDBDMO
Cc1ccnc(NC[C@@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000265196172	408576575	/nfs/dbraw/zinc/57/65/75/408576575.db2.gz	LTEZMZBQDGJXFK-AWEZNQCLSA-N	1	1	321.425	1.982	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000248683820	408614874	/nfs/dbraw/zinc/61/48/74/408614874.db2.gz	XXCHNHFZLGYWLR-RYUDHWBXSA-N	1	1	321.381	1.510	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+](CCO)C2CCOCC2)c1	ZINC000275667034	408640410	/nfs/dbraw/zinc/64/04/10/408640410.db2.gz	YTNNWDRPETTZRF-OAHLLOKOSA-N	1	1	310.350	1.102	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@H]1O	ZINC000270855089	408708613	/nfs/dbraw/zinc/70/86/13/408708613.db2.gz	HGYXFZWRMWGFDJ-SMDDNHRTSA-N	1	1	310.350	1.685	20	5		DDBDMO
Cc1cnc(N2CC[N@H+](CC(C)(C)O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000275891325	408709881	/nfs/dbraw/zinc/70/98/81/408709881.db2.gz	XZZINADPICLJJL-GFCCVEGCSA-N	1	1	308.382	1.580	20	5		DDBDMO
O=C1CCCN1[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000270827429	408697906	/nfs/dbraw/zinc/69/79/06/408697906.db2.gz	CDHJAPFWEPRQCH-CQSZACIVSA-N	1	1	319.361	1.670	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000250146518	408777606	/nfs/dbraw/zinc/77/76/06/408777606.db2.gz	ZXASDKLSINTJPX-GXFFZTMASA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](O)[C@@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000250146518	408777607	/nfs/dbraw/zinc/77/76/07/408777607.db2.gz	ZXASDKLSINTJPX-GXFFZTMASA-N	1	1	310.350	1.815	20	5		DDBDMO
CCC(=O)c1ccc(N2CCC[N@H+](CCO)CC2)c([N+](=O)[O-])c1	ZINC000280763762	408830929	/nfs/dbraw/zinc/83/09/29/408830929.db2.gz	RBLBZIHSNBVKTJ-UHFFFAOYSA-N	1	1	321.377	1.692	20	5		DDBDMO
CCC(=O)c1ccc(N2CCC[N@@H+](CCO)CC2)c([N+](=O)[O-])c1	ZINC000280763762	408830932	/nfs/dbraw/zinc/83/09/32/408830932.db2.gz	RBLBZIHSNBVKTJ-UHFFFAOYSA-N	1	1	321.377	1.692	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CCN(c2[nH+]ccn2C)CC1	ZINC000280814141	408839103	/nfs/dbraw/zinc/83/91/03/408839103.db2.gz	XGTATFWHJHICAN-UHFFFAOYSA-N	1	1	319.369	1.180	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000285780968	408862261	/nfs/dbraw/zinc/86/22/61/408862261.db2.gz	NAVAKFBQSMKVFV-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
COc1cc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000192507272	163225512	/nfs/dbraw/zinc/22/55/12/163225512.db2.gz	QNGDUVNADMIHEL-TXEJJXNPSA-N	1	1	305.334	1.237	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@](CO)(c3ccccc3)C2)n1	ZINC000291925581	408945866	/nfs/dbraw/zinc/94/58/66/408945866.db2.gz	SNFSXELCUPSXFU-INIZCTEOSA-N	1	1	316.361	1.427	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NC(=O)[C@@]1(F)CC[N@H+](C(C)(C)C)C1	ZINC000292184019	408997009	/nfs/dbraw/zinc/99/70/09/408997009.db2.gz	GQYVOAFGMZQIRC-CYBMUJFWSA-N	1	1	313.333	1.479	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3ncnc4sc([N+](=O)[O-])cc43)C[C@H]2C1	ZINC000287757713	409087729	/nfs/dbraw/zinc/08/77/29/409087729.db2.gz	NBKXMMQWPSERFO-DTORHVGOSA-N	1	1	305.363	1.597	20	5		DDBDMO
CCC[C@]1(CO)CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000288808733	409182048	/nfs/dbraw/zinc/18/20/48/409182048.db2.gz	MHWCNUUTXCJWNH-INIZCTEOSA-N	1	1	321.377	1.678	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)CCCN2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000289421946	409268526	/nfs/dbraw/zinc/26/85/26/409268526.db2.gz	JFROFMJOLUGPEJ-UHFFFAOYSA-N	1	1	320.437	1.973	20	5		DDBDMO
Cc1ccc(C[N@H+](C)CCCN2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000289421946	409268530	/nfs/dbraw/zinc/26/85/30/409268530.db2.gz	JFROFMJOLUGPEJ-UHFFFAOYSA-N	1	1	320.437	1.973	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@](C)(C(=O)NC)C1	ZINC000280541784	409349717	/nfs/dbraw/zinc/34/97/17/409349717.db2.gz	DKSFFOWVIGTSKP-MRXNPFEDSA-N	1	1	321.377	1.952	20	5		DDBDMO
CNC(=O)[C@@]1(C)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000280721286	409426620	/nfs/dbraw/zinc/42/66/20/409426620.db2.gz	IAYJDADTFAWPQV-HIFRSBDPSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCN2CCO[C@H]1C2	ZINC000295379974	409456801	/nfs/dbraw/zinc/45/68/01/409456801.db2.gz	KJENQXSYSJNPIO-BBRMVZONSA-N	1	1	321.377	1.379	20	5		DDBDMO
Cn1nc([N+](=O)[O-])cc1C(=O)N1CCC[N@H+](C2CCCC2)CC1	ZINC000357033803	164136840	/nfs/dbraw/zinc/13/68/40/164136840.db2.gz	GXSOQCXWDHFBCF-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
O=C1[C@H]([NH+]2CCC(O)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304001330	409559249	/nfs/dbraw/zinc/55/92/49/409559249.db2.gz	RETLHZHUZUYZRJ-CQSZACIVSA-N	1	1	305.334	1.157	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356739012	409562769	/nfs/dbraw/zinc/56/27/69/409562769.db2.gz	NOWIZDLTRVWKGT-NSHDSACASA-N	1	1	309.370	1.036	20	5		DDBDMO
Cc1nc(N2CC[N@@H+](C3CCOCC3)C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000296794498	409641829	/nfs/dbraw/zinc/64/18/29/409641829.db2.gz	OLFJDDMFURQBLY-LLVKDONJSA-N	1	1	321.381	1.383	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCC[C@@H](O)C1	ZINC000304228583	409581136	/nfs/dbraw/zinc/58/11/36/409581136.db2.gz	MLYBWZAXZBQJOR-GFCCVEGCSA-N	1	1	321.333	1.350	20	5		DDBDMO
CC(C)[C@@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000304315512	409600665	/nfs/dbraw/zinc/60/06/65/409600665.db2.gz	OEGKCHNRGHITIU-UKRRQHHQSA-N	1	1	310.398	1.910	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2C2CCOCC2)c1	ZINC000348946813	409603431	/nfs/dbraw/zinc/60/34/31/409603431.db2.gz	HLNCJNFAGKKWQM-GJZGRUSLSA-N	1	1	324.381	1.043	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000331536073	409609828	/nfs/dbraw/zinc/60/98/28/409609828.db2.gz	PWWSKSKGHUIPHR-SNVBAGLBSA-N	1	1	305.334	1.570	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000356835254	409647712	/nfs/dbraw/zinc/64/77/12/409647712.db2.gz	BLKAMKFRESEIQY-RYUDHWBXSA-N	1	1	307.350	1.525	20	5		DDBDMO
C[C@@H]([NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccon1	ZINC000349242775	409758632	/nfs/dbraw/zinc/75/86/32/409758632.db2.gz	PBJQHWWUCIXUMH-GHMZBOCLSA-N	1	1	307.306	1.673	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000338423276	409978415	/nfs/dbraw/zinc/97/84/15/409978415.db2.gz	VMDYMWVBVSFZOB-UHFFFAOYSA-N	1	1	323.349	1.436	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@H]1C	ZINC000346609482	410035519	/nfs/dbraw/zinc/03/55/19/410035519.db2.gz	CZPGRZWINQMHCX-FZMZJTMJSA-N	1	1	308.334	1.857	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)Nc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000357774925	410241623	/nfs/dbraw/zinc/24/16/23/410241623.db2.gz	NCEWVVNOITVOCE-SNVBAGLBSA-N	1	1	309.370	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC[C@@H](CO)C3)o2)cc1	ZINC000298654192	410330686	/nfs/dbraw/zinc/33/06/86/410330686.db2.gz	FLBJJEZWMJFFSF-LLVKDONJSA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](CO)C3)o2)cc1	ZINC000298654192	410330692	/nfs/dbraw/zinc/33/06/92/410330692.db2.gz	FLBJJEZWMJFFSF-LLVKDONJSA-N	1	1	318.333	1.849	20	5		DDBDMO
CC[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C[C@@H](C)O	ZINC000352188385	410534108	/nfs/dbraw/zinc/53/41/08/410534108.db2.gz	YJVZYJUWKHEQOF-LLVKDONJSA-N	1	1	323.349	1.596	20	5		DDBDMO
Cn1c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)ccc1[N+](=O)[O-]	ZINC000347411460	410531203	/nfs/dbraw/zinc/53/12/03/410531203.db2.gz	ANPGINCNBZQOMU-UHFFFAOYSA-N	1	1	308.382	1.785	20	5		DDBDMO
COC1CC([N@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000352229233	410564705	/nfs/dbraw/zinc/56/47/05/410564705.db2.gz	DGMJXAXZVGHEDD-UHFFFAOYSA-N	1	1	319.361	1.593	20	5		DDBDMO
COC1CC([N@@H+](C)CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000352229233	410564710	/nfs/dbraw/zinc/56/47/10/410564710.db2.gz	DGMJXAXZVGHEDD-UHFFFAOYSA-N	1	1	319.361	1.593	20	5		DDBDMO
COc1ccc(CNC(=O)NC[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000299251543	410582277	/nfs/dbraw/zinc/58/22/77/410582277.db2.gz	PJETXVMGTSHDGU-LBPRGKRZSA-N	1	1	322.365	1.497	20	5		DDBDMO
COC[C@@H]1CC[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000352228064	410561915	/nfs/dbraw/zinc/56/19/15/410561915.db2.gz	VBZJAZSRRGRBSQ-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000352228064	410561921	/nfs/dbraw/zinc/56/19/21/410561921.db2.gz	VBZJAZSRRGRBSQ-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000347662138	410661279	/nfs/dbraw/zinc/66/12/79/410661279.db2.gz	YYTVUFAVBCOGGT-LLVKDONJSA-N	1	1	322.365	1.248	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCC(F)(F)CC1	ZINC000347610940	410630930	/nfs/dbraw/zinc/63/09/30/410630930.db2.gz	CAALOCHHZNNECA-LBPRGKRZSA-N	1	1	318.324	1.662	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+](C)[C@@H]2CCOC2)cc1[N+](=O)[O-]	ZINC000355748223	410675446	/nfs/dbraw/zinc/67/54/46/410675446.db2.gz	QMHGTNZXBQCZOO-GFCCVEGCSA-N	1	1	324.333	1.367	20	5		DDBDMO
CC(C)[C@@H](CNc1ncc([N+](=O)[O-])cn1)N1CC[NH+](C)CC1	ZINC000301097633	410655615	/nfs/dbraw/zinc/65/56/15/410655615.db2.gz	QDRJLFLVUUDYKZ-CYBMUJFWSA-N	1	1	308.386	1.069	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[C@H]1C[N@@H+]1CCC[C@@H]1CO	ZINC000301530276	410739006	/nfs/dbraw/zinc/73/90/06/410739006.db2.gz	KWBFAPNDMVVBMY-QWHCGFSZSA-N	1	1	306.366	1.415	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CCC[C@@H]1C[N@@H+]1CCC[C@@H]1CO	ZINC000301530274	410739543	/nfs/dbraw/zinc/73/95/43/410739543.db2.gz	KWBFAPNDMVVBMY-CHWSQXEVSA-N	1	1	306.366	1.415	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@@H](COC(F)F)C1	ZINC000353022928	410740891	/nfs/dbraw/zinc/74/08/91/410740891.db2.gz	FIRGITBYLDXRNG-SNVBAGLBSA-N	1	1	317.292	1.318	20	5		DDBDMO
CC(C)[C@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761722	410678770	/nfs/dbraw/zinc/67/87/70/410678770.db2.gz	SVXYYAOUBPXEOD-CZUORRHYSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761722	410678774	/nfs/dbraw/zinc/67/87/74/410678774.db2.gz	SVXYYAOUBPXEOD-CZUORRHYSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC[C@](C)(O)C[NH+]1CCOCC1	ZINC000301782129	410795924	/nfs/dbraw/zinc/79/59/24/410795924.db2.gz	SZNOVUPFBPYXNZ-HNNXBMFYSA-N	1	1	309.366	1.398	20	5		DDBDMO
CC[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1c(C)nn(C)c1C	ZINC000348048394	410824282	/nfs/dbraw/zinc/82/42/82/410824282.db2.gz	PPUAAGFCLVUXTE-LLVKDONJSA-N	1	1	306.370	1.920	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000330628561	410837976	/nfs/dbraw/zinc/83/79/76/410837976.db2.gz	LSAIBLVRRMKWLC-CHWSQXEVSA-N	1	1	305.378	1.997	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000330636885	410842340	/nfs/dbraw/zinc/84/23/40/410842340.db2.gz	ANSTWDJEZUYFLX-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000330636885	410842343	/nfs/dbraw/zinc/84/23/43/410842343.db2.gz	ANSTWDJEZUYFLX-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000330676361	410868684	/nfs/dbraw/zinc/86/86/84/410868684.db2.gz	UHCPHSOIBNHLIM-LLVKDONJSA-N	1	1	317.349	1.781	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331074818	410932283	/nfs/dbraw/zinc/93/22/83/410932283.db2.gz	VNEWCCORWXVJQG-LBPRGKRZSA-N	1	1	323.397	1.313	20	5		DDBDMO
CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331074818	410932290	/nfs/dbraw/zinc/93/22/90/410932290.db2.gz	VNEWCCORWXVJQG-LBPRGKRZSA-N	1	1	323.397	1.313	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](C(=O)N2CCCC2)C1	ZINC000331425004	411083270	/nfs/dbraw/zinc/08/32/70/411083270.db2.gz	UWHUPZZCAOFOJW-LBPRGKRZSA-N	1	1	321.381	1.163	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](C(=O)N2CCCC2)C1	ZINC000331425004	411083275	/nfs/dbraw/zinc/08/32/75/411083275.db2.gz	UWHUPZZCAOFOJW-LBPRGKRZSA-N	1	1	321.381	1.163	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(O)CCC1	ZINC000353484650	411023747	/nfs/dbraw/zinc/02/37/47/411023747.db2.gz	KJAWONGSLRXSKF-GFCCVEGCSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)C[NH+]1CCOCC1	ZINC000134035370	196356141	/nfs/dbraw/zinc/35/61/41/196356141.db2.gz	HKZCIOMABTUESF-GFCCVEGCSA-N	1	1	307.350	1.293	20	5		DDBDMO
Cc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010077	226003823	/nfs/dbraw/zinc/00/38/23/226003823.db2.gz	YFVAZCJARKURGQ-RYUDHWBXSA-N	1	1	311.357	1.934	20	5		DDBDMO
Cc1cc(N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000419010077	226003828	/nfs/dbraw/zinc/00/38/28/226003828.db2.gz	YFVAZCJARKURGQ-RYUDHWBXSA-N	1	1	311.357	1.934	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1C[N@@H+](C)C[C@H]1C	ZINC000362644508	307023347	/nfs/dbraw/zinc/02/33/47/307023347.db2.gz	RXULOAZCXQIHFN-MFKMUULPSA-N	1	1	307.350	1.417	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000373285249	418419401	/nfs/dbraw/zinc/41/94/01/418419401.db2.gz	AESSLYKARVTVCH-LLVKDONJSA-N	1	1	305.338	1.114	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000366453332	418474833	/nfs/dbraw/zinc/47/48/33/418474833.db2.gz	ZRGQPBHIWXAEFL-WDNDVIMCSA-N	1	1	319.361	1.402	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)C1	ZINC000367774498	418632146	/nfs/dbraw/zinc/63/21/46/418632146.db2.gz	WMDLOSUEGQLINP-HNNXBMFYSA-N	1	1	319.361	1.513	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)C1	ZINC000367774498	418632151	/nfs/dbraw/zinc/63/21/51/418632151.db2.gz	WMDLOSUEGQLINP-HNNXBMFYSA-N	1	1	319.361	1.513	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]1n1ccnc1	ZINC000371324963	418779907	/nfs/dbraw/zinc/77/99/07/418779907.db2.gz	BLOWXHVWFZAVOA-VXGBXAGGSA-N	1	1	304.354	1.608	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C[C@H]1n1ccnc1	ZINC000371324963	418779909	/nfs/dbraw/zinc/77/99/09/418779909.db2.gz	BLOWXHVWFZAVOA-VXGBXAGGSA-N	1	1	304.354	1.608	20	5		DDBDMO
CCc1[nH+]ccn1C[C@H]1CCCN1c1ncc([N+](=O)[O-])c(N)n1	ZINC000371866470	418822335	/nfs/dbraw/zinc/82/23/35/418822335.db2.gz	LCMOWYPJBBJYGM-SNVBAGLBSA-N	1	1	317.353	1.395	20	5		DDBDMO
C[C@H]1CO[C@H](CO)C[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344353	418894327	/nfs/dbraw/zinc/89/43/27/418894327.db2.gz	JDFDCYLZUQBWII-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1CO[C@H](CO)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344353	418894328	/nfs/dbraw/zinc/89/43/28/418894328.db2.gz	JDFDCYLZUQBWII-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000365839914	418915133	/nfs/dbraw/zinc/91/51/33/418915133.db2.gz	UBWWCQCCKPVOTO-ZBEGNZNMSA-N	1	1	319.361	1.769	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1CC[NH+]([C@H]2CCSC2)CC1	ZINC000365870513	418918062	/nfs/dbraw/zinc/91/80/62/418918062.db2.gz	PSHBIKQDZYWVIR-JTQLQIEISA-N	1	1	311.363	1.451	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000411724179	419391427	/nfs/dbraw/zinc/39/14/27/419391427.db2.gz	YMFTWGOZDKSRLO-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000411724179	419391432	/nfs/dbraw/zinc/39/14/32/419391432.db2.gz	YMFTWGOZDKSRLO-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000420929418	419362569	/nfs/dbraw/zinc/36/25/69/419362569.db2.gz	BJNRJJAFFNBGPT-MGPQQGTHSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[C@H]1C[C@H](CO)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000420936983	419371570	/nfs/dbraw/zinc/37/15/70/419371570.db2.gz	JFWLARRQKOJEGQ-STQMWFEESA-N	1	1	321.377	1.508	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@@]23CCOC3)c1	ZINC000421041763	419466229	/nfs/dbraw/zinc/46/62/29/419466229.db2.gz	YPJDGCDNRPXWOY-ZFWWWQNUSA-N	1	1	308.334	1.199	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000411940632	419510028	/nfs/dbraw/zinc/51/00/28/419510028.db2.gz	KNPVQLVNMGVLMH-JTQLQIEISA-N	1	1	318.333	1.646	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000428988699	419959157	/nfs/dbraw/zinc/95/91/57/419959157.db2.gz	ARZCVJZOSYXDDJ-NFAWXSAZSA-N	1	1	307.398	1.453	20	5		DDBDMO
C[C@@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC[N@H+](C2CCC2)C1	ZINC000429404341	420015117	/nfs/dbraw/zinc/01/51/17/420015117.db2.gz	QDLBKENHKLSLEJ-GFCCVEGCSA-N	1	1	307.398	1.635	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](CCO)[C@@H]1CCO[C@H]1C	ZINC000430248479	420096490	/nfs/dbraw/zinc/09/64/90/420096490.db2.gz	ZQKRBBPZMZWIOY-SMDDNHRTSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)[C@@H]1CCO[C@H]1C	ZINC000430248479	420096495	/nfs/dbraw/zinc/09/64/95/420096495.db2.gz	ZQKRBBPZMZWIOY-SMDDNHRTSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@](C)(CN)C(C)C)c([N+](=O)[O-])c1	ZINC000430540694	420132193	/nfs/dbraw/zinc/13/21/93/420132193.db2.gz	AIBDESYXPRUAPI-OAHLLOKOSA-N	1	1	311.382	1.945	20	5		DDBDMO
COc1ccc(OCCN[C@](C)(C[NH3+])C(C)C)c([N+](=O)[O-])c1	ZINC000430540694	420132200	/nfs/dbraw/zinc/13/22/00/420132200.db2.gz	AIBDESYXPRUAPI-OAHLLOKOSA-N	1	1	311.382	1.945	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](CC[NH3+])C1	ZINC000443065773	229988307	/nfs/dbraw/zinc/98/83/07/229988307.db2.gz	CRPMLZFNSRDGPR-CHWSQXEVSA-N	1	1	320.393	1.983	20	5		DDBDMO
Cc1cc(C)cc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000444699050	230124142	/nfs/dbraw/zinc/12/41/42/230124142.db2.gz	DQLPWOKCBDDLBB-INIZCTEOSA-N	1	1	318.377	1.901	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439174041	420499476	/nfs/dbraw/zinc/49/94/76/420499476.db2.gz	YEJPJNVEZHADIP-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000450958719	420571047	/nfs/dbraw/zinc/57/10/47/420571047.db2.gz	WPLQARPVOZHQEF-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450959492	420571645	/nfs/dbraw/zinc/57/16/45/420571645.db2.gz	YMYPIELANMSHOV-LLVKDONJSA-N	1	1	307.350	1.300	20	5		DDBDMO
CC(=O)c1cc(N2CC[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000450959492	420571648	/nfs/dbraw/zinc/57/16/48/420571648.db2.gz	YMYPIELANMSHOV-LLVKDONJSA-N	1	1	307.350	1.300	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000452069540	420619556	/nfs/dbraw/zinc/61/95/56/420619556.db2.gz	QCBAGQNWARKFBT-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000452069540	420619563	/nfs/dbraw/zinc/61/95/63/420619563.db2.gz	QCBAGQNWARKFBT-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H](C)C[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452067395	420620477	/nfs/dbraw/zinc/62/04/77/420620477.db2.gz	MHNDMTOVROIHGC-KGYLQXTDSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H](C)C[C@@H](O)C2)cccc1[N+](=O)[O-]	ZINC000452067395	420620480	/nfs/dbraw/zinc/62/04/80/420620480.db2.gz	MHNDMTOVROIHGC-KGYLQXTDSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000457122580	420621645	/nfs/dbraw/zinc/62/16/45/420621645.db2.gz	OUONMQHGLMTUHE-ZDUSSCGKSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000457130102	420626805	/nfs/dbraw/zinc/62/68/05/420626805.db2.gz	RCXZLZBOMDHQSA-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000457130102	420626807	/nfs/dbraw/zinc/62/68/07/420626807.db2.gz	RCXZLZBOMDHQSA-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000457137205	420627472	/nfs/dbraw/zinc/62/74/72/420627472.db2.gz	XDRRAHPYLJUSIY-GFCCVEGCSA-N	1	1	309.370	1.123	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)/C=C\c1ccc(F)cc1[N+](=O)[O-]	ZINC000493085674	420753184	/nfs/dbraw/zinc/75/31/84/420753184.db2.gz	POVAVVFRPOUYAQ-RQOWECAXSA-N	1	1	303.240	1.457	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1C[C@@H]2C[C@H]1CS2	ZINC000459792257	420874655	/nfs/dbraw/zinc/87/46/55/420874655.db2.gz	JKYOLDJJCJKUGA-SRVKXCTJSA-N	1	1	310.375	1.524	20	5		DDBDMO
CC[C@@H](CNS(C)(=O)=O)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000449442823	421012491	/nfs/dbraw/zinc/01/24/91/421012491.db2.gz	NDMSLRSXMZKMGO-VIFPVBQESA-N	1	1	307.397	1.074	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000449697429	421061977	/nfs/dbraw/zinc/06/19/77/421061977.db2.gz	KWXHVWAKRHXNIT-LBPRGKRZSA-N	1	1	317.349	1.589	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000488799333	421118348	/nfs/dbraw/zinc/11/83/48/421118348.db2.gz	KJQKZVIWGSCKEF-WCQYABFASA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000456353020	421148151	/nfs/dbraw/zinc/14/81/51/421148151.db2.gz	NVXFOGHGEVNDLU-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000525804609	421302544	/nfs/dbraw/zinc/30/25/44/421302544.db2.gz	FHHOMFUTJUKDLI-CYBMUJFWSA-N	1	1	320.393	1.489	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)CC[NH2+]CC2(F)CC2)cc1	ZINC000526984745	421344926	/nfs/dbraw/zinc/34/49/26/421344926.db2.gz	JZLOJZLGOBIIPI-UHFFFAOYSA-N	1	1	302.327	1.460	20	5		DDBDMO
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCC2)O1	ZINC000563080877	421452356	/nfs/dbraw/zinc/45/23/56/421452356.db2.gz	IHAQWKIPSPSCOG-GFCCVEGCSA-N	1	1	307.350	1.400	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCC2)O1	ZINC000563080877	421452357	/nfs/dbraw/zinc/45/23/57/421452357.db2.gz	IHAQWKIPSPSCOG-GFCCVEGCSA-N	1	1	307.350	1.400	20	5		DDBDMO
Cc1[nH+]ccn1CCCCSc1ncc([N+](=O)[O-])c(N)n1	ZINC000563898755	421555259	/nfs/dbraw/zinc/55/52/59/421555259.db2.gz	LGNTVLIJLIBFSS-UHFFFAOYSA-N	1	1	308.367	2.044	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000536639858	421723149	/nfs/dbraw/zinc/72/31/49/421723149.db2.gz	APQSADAIZHZYTN-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000536639858	421723152	/nfs/dbraw/zinc/72/31/52/421723152.db2.gz	APQSADAIZHZYTN-GHMZBOCLSA-N	1	1	306.366	1.801	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1CCOCC1	ZINC000533447240	421674395	/nfs/dbraw/zinc/67/43/95/421674395.db2.gz	RIWOFRFUFNZZTP-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=C1CCCN1CCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000533804411	421683904	/nfs/dbraw/zinc/68/39/04/421683904.db2.gz	YLKPQTQXIYNJQU-UHFFFAOYSA-N	1	1	303.362	1.965	20	5		DDBDMO
O=C1CCCN1CCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000533804411	421683906	/nfs/dbraw/zinc/68/39/06/421683906.db2.gz	YLKPQTQXIYNJQU-UHFFFAOYSA-N	1	1	303.362	1.965	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000521031737	421770181	/nfs/dbraw/zinc/77/01/81/421770181.db2.gz	SBCJANNHDAYNNY-UHFFFAOYSA-N	1	1	322.365	1.321	20	5		DDBDMO
COC(=O)[C@@H]1C[C@H](O)C[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000592201835	422330221	/nfs/dbraw/zinc/33/02/21/422330221.db2.gz	WDTKQPMHNPKIDS-UTUOFQBUSA-N	1	1	308.334	1.512	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCCCNc2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000596075741	422361952	/nfs/dbraw/zinc/36/19/52/422361952.db2.gz	KHKVRQGOERFOOE-GFCCVEGCSA-N	1	1	307.398	2.496	20	5		DDBDMO
CNC(=O)CCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000578374866	422559247	/nfs/dbraw/zinc/55/92/47/422559247.db2.gz	TWXMPSKXVFDHAW-NSHDSACASA-N	1	1	307.354	1.002	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)n1	ZINC000345300447	272213157	/nfs/dbraw/zinc/21/31/57/272213157.db2.gz	KAGSXLZTEIJZJU-GFCCVEGCSA-N	1	1	321.381	1.323	20	5		DDBDMO
Cn1c[nH+]cc1CCc1nc(-c2ccc(N)c([N+](=O)[O-])c2)no1	ZINC000345677647	272302861	/nfs/dbraw/zinc/30/28/61/272302861.db2.gz	ZYYKEJBHZDVOIY-UHFFFAOYSA-N	1	1	314.305	1.746	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](CC)C2)c1[N+](=O)[O-]	ZINC000345925023	272366648	/nfs/dbraw/zinc/36/66/48/272366648.db2.gz	LDPMHUSLQDSQDQ-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[NH+](CCO)CC1	ZINC000276626901	275034441	/nfs/dbraw/zinc/03/44/41/275034441.db2.gz	NMXLCXMKHGUKSX-UHFFFAOYSA-N	1	1	302.334	1.257	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CCC[N@@H+](CC)CC2)c1[N+](=O)[O-]	ZINC000150836874	276300599	/nfs/dbraw/zinc/30/05/99/276300599.db2.gz	HKJFEIQSCTVFKB-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C[C@H](C)[NH2+]1	ZINC000123884401	281179537	/nfs/dbraw/zinc/17/95/37/281179537.db2.gz	WHKUGSHQZJVSAZ-YUMQZZPRSA-N	1	1	305.381	1.027	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000362697232	300117243	/nfs/dbraw/zinc/11/72/43/300117243.db2.gz	JNSCFWAAGGLLOG-UHFFFAOYSA-N	1	1	324.287	1.737	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000363904171	300323804	/nfs/dbraw/zinc/32/38/04/300323804.db2.gz	LBUQBWLFSCICAU-MFKMUULPSA-N	1	1	319.365	1.128	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000364433726	300395971	/nfs/dbraw/zinc/39/59/71/300395971.db2.gz	VLOSITAVPPYYMG-GJZGRUSLSA-N	1	1	319.361	1.266	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000368579778	301056456	/nfs/dbraw/zinc/05/64/56/301056456.db2.gz	UIIKPGDLXUFWMH-GHMZBOCLSA-N	1	1	320.349	1.119	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@H](O)C[C@H]3CO)o2)c1	ZINC000370385924	301328056	/nfs/dbraw/zinc/32/80/56/301328056.db2.gz	HLDKAWJFYPQMRQ-UONOGXRCSA-N	1	1	318.329	1.782	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000370465582	301344669	/nfs/dbraw/zinc/34/46/69/301344669.db2.gz	TWVADDFRNRVSHC-VXGBXAGGSA-N	1	1	323.324	1.327	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000534349514	303332585	/nfs/dbraw/zinc/33/25/85/303332585.db2.gz	SMQHUBFECGTETN-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000534349514	303332588	/nfs/dbraw/zinc/33/25/88/303332588.db2.gz	SMQHUBFECGTETN-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000536608800	303365795	/nfs/dbraw/zinc/36/57/95/303365795.db2.gz	RRAFJVGRAVLPBN-NWDGAFQWSA-N	1	1	321.377	1.697	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000532	307113987	/nfs/dbraw/zinc/11/39/87/307113987.db2.gz	ITNSNNQZROEUJL-VXGBXAGGSA-N	1	1	309.370	1.343	20	5		DDBDMO
CCCNC(=O)[C@@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369000532	307113988	/nfs/dbraw/zinc/11/39/88/307113988.db2.gz	ITNSNNQZROEUJL-VXGBXAGGSA-N	1	1	309.370	1.343	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)nc1	ZINC000371892912	307159678	/nfs/dbraw/zinc/15/96/78/307159678.db2.gz	BOZOJJHHZZXAGI-QWHCGFSZSA-N	1	1	307.354	1.440	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3ccncc3)C2)c1	ZINC000570118845	308159636	/nfs/dbraw/zinc/15/96/36/308159636.db2.gz	YWHNPMKLKOUCEF-UKRRQHHQSA-N	1	1	317.349	1.037	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)n1	ZINC000576762989	308338240	/nfs/dbraw/zinc/33/82/40/308338240.db2.gz	KBQAZJFDCIZIRV-JTQLQIEISA-N	1	1	307.354	1.025	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)[C@@H]2CCOC2)c([N+](=O)[O-])c1	ZINC000299331996	534063646	/nfs/dbraw/zinc/06/36/46/534063646.db2.gz	PWGGKHMRUMNOGT-LLVKDONJSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@](O)(C(F)(F)F)C2)c1	ZINC000330986162	534889228	/nfs/dbraw/zinc/88/92/28/534889228.db2.gz	IULZYLMMCCVQTO-SNVBAGLBSA-N	1	1	308.260	1.181	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@](O)(C(F)(F)F)C2)c1	ZINC000330986162	534889229	/nfs/dbraw/zinc/88/92/29/534889229.db2.gz	IULZYLMMCCVQTO-SNVBAGLBSA-N	1	1	308.260	1.181	20	5		DDBDMO
CC(C)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cnn(C)c1	ZINC000459587287	527944140	/nfs/dbraw/zinc/94/41/40/527944140.db2.gz	FXEAPCVAMLARHH-UHFFFAOYSA-N	1	1	306.370	1.683	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000302456818	528310623	/nfs/dbraw/zinc/31/06/23/528310623.db2.gz	QPDDJNDBRQPHQA-OLZOCXBDSA-N	1	1	323.393	1.885	20	5		DDBDMO
CCOc1cc(N2CC[C@@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000301506475	528312365	/nfs/dbraw/zinc/31/23/65/528312365.db2.gz	CXVKJYZEZRNNEK-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000457141265	529060458	/nfs/dbraw/zinc/06/04/58/529060458.db2.gz	ZAOWVKSSWITJQI-GFCCVEGCSA-N	1	1	323.397	1.468	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000451735509	529289808	/nfs/dbraw/zinc/28/98/08/529289808.db2.gz	YHRAJKWSHVWHMP-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2-c2nn[nH]n2)C1	ZINC000736854502	598503942	/nfs/dbraw/zinc/50/39/42/598503942.db2.gz	CYZJMABRABLCLL-SNVBAGLBSA-N	1	1	317.353	1.529	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000072501209	696394019	/nfs/dbraw/zinc/39/40/19/696394019.db2.gz	FCFGLPDCEZTAIE-CYBMUJFWSA-N	1	1	320.393	1.875	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3ccccn3)C2)c1	ZINC000799191555	700127433	/nfs/dbraw/zinc/12/74/33/700127433.db2.gz	NAELIFJNSVYBRE-JSGCOSHPSA-N	1	1	317.349	1.037	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2nnc3n2CCCC3)c1	ZINC000749675172	700176438	/nfs/dbraw/zinc/17/64/38/700176438.db2.gz	JAAZODVCTXJBDV-ZDUSSCGKSA-N	1	1	317.349	1.346	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776596661	698124741	/nfs/dbraw/zinc/12/47/41/698124741.db2.gz	HKDQJZHPLPYYDN-AWEZNQCLSA-N	1	1	309.366	1.332	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@H](n3cncn3)C2)c1	ZINC000776777818	698139380	/nfs/dbraw/zinc/13/93/80/698139380.db2.gz	RNUWTAGEGVZFEG-ZDUSSCGKSA-N	1	1	313.321	1.441	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(cnn2C[N@H+]2CC[C@H](n3cncn3)C2)c1	ZINC000776777818	698139381	/nfs/dbraw/zinc/13/93/81/698139381.db2.gz	RNUWTAGEGVZFEG-ZDUSSCGKSA-N	1	1	313.321	1.441	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@@H+]1CCO	ZINC000777831403	698225756	/nfs/dbraw/zinc/22/57/56/698225756.db2.gz	CVLQEYWPGCWLCU-SNVBAGLBSA-N	1	1	322.390	1.707	20	5		DDBDMO
C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@H+]1CCO	ZINC000777831403	698225758	/nfs/dbraw/zinc/22/57/58/698225758.db2.gz	CVLQEYWPGCWLCU-SNVBAGLBSA-N	1	1	322.390	1.707	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(O)(C(F)F)CC2)c1	ZINC000778307514	698259890	/nfs/dbraw/zinc/25/98/90/698259890.db2.gz	GGMPLFHPPXRURA-LBPRGKRZSA-N	1	1	316.304	1.720	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000800374541	700218824	/nfs/dbraw/zinc/21/88/24/700218824.db2.gz	RTVUHMXMGJIIPE-WWGRRREGSA-N	1	1	323.393	1.015	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000786922549	699180127	/nfs/dbraw/zinc/18/01/27/699180127.db2.gz	ISHQUXRFQVNLHJ-NSHDSACASA-N	1	1	304.350	1.391	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1	ZINC000735893733	699708894	/nfs/dbraw/zinc/70/88/94/699708894.db2.gz	GZTBNZQHNATDAK-UHFFFAOYSA-N	1	1	308.334	1.782	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000742197898	699866637	/nfs/dbraw/zinc/86/66/37/699866637.db2.gz	VXNXKJXNNADINH-SNVBAGLBSA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000742197898	699866639	/nfs/dbraw/zinc/86/66/39/699866639.db2.gz	VXNXKJXNNADINH-SNVBAGLBSA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@@H]2C)c1	ZINC000742242478	699869931	/nfs/dbraw/zinc/86/99/31/699869931.db2.gz	WDQZKQIIZDCWIT-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@H]2C[C@@H](C)O)c2ncc([N+](=O)[O-])cc12	ZINC000752803522	700388746	/nfs/dbraw/zinc/38/87/46/700388746.db2.gz	JNMLIZQRTPCRKH-PWSUYJOCSA-N	1	1	319.365	1.841	20	5		DDBDMO
COc1cc(NC[C@]2(O)CC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000762817210	700908471	/nfs/dbraw/zinc/90/84/71/700908471.db2.gz	ZACHRROYHAFNEF-CQSZACIVSA-N	1	1	311.338	1.091	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[N@@H+]2CCOC[C@@H]2C1	ZINC000804613453	701203731	/nfs/dbraw/zinc/20/37/31/701203731.db2.gz	SFANILZDNQUGSK-JTQLQIEISA-N	1	1	308.294	1.024	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[N@H+]2CCOC[C@@H]2C1	ZINC000804613453	701203734	/nfs/dbraw/zinc/20/37/34/701203734.db2.gz	SFANILZDNQUGSK-JTQLQIEISA-N	1	1	308.294	1.024	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839649483	701766163	/nfs/dbraw/zinc/76/61/63/701766163.db2.gz	KXMQDAHWEVVUBZ-BZUAXINKSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839649483	701766166	/nfs/dbraw/zinc/76/61/66/701766166.db2.gz	KXMQDAHWEVVUBZ-BZUAXINKSA-N	1	1	317.389	1.332	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839649483	701766172	/nfs/dbraw/zinc/76/61/72/701766172.db2.gz	KXMQDAHWEVVUBZ-BZUAXINKSA-N	1	1	317.389	1.332	20	5		DDBDMO
CC1(C)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839659367	701768684	/nfs/dbraw/zinc/76/86/84/701768684.db2.gz	ZIFCQGGHIRGCCM-HUUCEWRRSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)CCCO1	ZINC000867949632	701848971	/nfs/dbraw/zinc/84/89/71/701848971.db2.gz	FGTPOUYGZBHEJE-IAQYHMDHSA-N	1	1	307.350	1.406	20	5		DDBDMO
CCN(C[C@@H]1CCCO1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867970190	701862516	/nfs/dbraw/zinc/86/25/16/701862516.db2.gz	YRBNEPMMHNJUEQ-GOEBONIOSA-N	1	1	321.377	1.796	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cnccn3)CC2)cc1	ZINC000866121520	706625227	/nfs/dbraw/zinc/62/52/27/706625227.db2.gz	RNTOOPJRYFUMCI-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
CC(C)(C[C@H]1CCC[N@H+](Cn2nccc2[N+](=O)[O-])C1)C(N)=O	ZINC000840110810	701973780	/nfs/dbraw/zinc/97/37/80/701973780.db2.gz	ULCUXEBFKFGTNY-LLVKDONJSA-N	1	1	309.370	1.362	20	5		DDBDMO
CC(C)(C[C@H]1CCC[N@@H+](Cn2nccc2[N+](=O)[O-])C1)C(N)=O	ZINC000840110810	701973781	/nfs/dbraw/zinc/97/37/81/701973781.db2.gz	ULCUXEBFKFGTNY-LLVKDONJSA-N	1	1	309.370	1.362	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH+]1CCCCCC1)C1CCC1	ZINC000840460140	702117803	/nfs/dbraw/zinc/11/78/03/702117803.db2.gz	MLTATZXMWIDAQK-HUUCEWRRSA-N	1	1	309.410	1.909	20	5		DDBDMO
C[NH+]1CCN(C2CCN(c3cccnc3[N+](=O)[O-])CC2)CC1	ZINC000866213103	706650746	/nfs/dbraw/zinc/65/07/46/706650746.db2.gz	ZDAHHHWMQDVCIT-UHFFFAOYSA-N	1	1	305.382	1.206	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H](CO)[C@H]2CO)cc1	ZINC000879362268	706661346	/nfs/dbraw/zinc/66/13/46/706661346.db2.gz	SRSHOBKTQVPKQU-SWLSCSKDSA-N	1	1	310.350	1.039	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000817679648	702449046	/nfs/dbraw/zinc/44/90/46/702449046.db2.gz	VENUOKWZJGOQBL-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=C(O[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000842334523	702705224	/nfs/dbraw/zinc/70/52/24/702705224.db2.gz	YEYJABGMGGAVLZ-RRFJBIMHSA-N	1	1	304.346	1.859	20	5		DDBDMO
O=C(O[C@H]1CCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000842334523	702705226	/nfs/dbraw/zinc/70/52/26/702705226.db2.gz	YEYJABGMGGAVLZ-RRFJBIMHSA-N	1	1	304.346	1.859	20	5		DDBDMO
O=C(O[C@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000842334523	702705228	/nfs/dbraw/zinc/70/52/28/702705228.db2.gz	YEYJABGMGGAVLZ-RRFJBIMHSA-N	1	1	304.346	1.859	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000842624158	702744722	/nfs/dbraw/zinc/74/47/22/702744722.db2.gz	NDDLFUFCAWFUFM-INIZCTEOSA-N	1	1	316.361	1.823	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@@]2(O)CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000842624158	702744724	/nfs/dbraw/zinc/74/47/24/702744724.db2.gz	NDDLFUFCAWFUFM-INIZCTEOSA-N	1	1	316.361	1.823	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@H]1[NH3+]	ZINC000843353690	702865205	/nfs/dbraw/zinc/86/52/05/702865205.db2.gz	MXRDREDUEFAZAB-ZWNOBZJWSA-N	1	1	324.356	1.732	20	5		DDBDMO
C[N@@H+]1CC[C@@H](NC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848582502	703565514	/nfs/dbraw/zinc/56/55/14/703565514.db2.gz	MVOWAFRTJONCCP-SECBINFHSA-N	1	1	315.276	1.387	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000848582502	703565516	/nfs/dbraw/zinc/56/55/16/703565516.db2.gz	MVOWAFRTJONCCP-SECBINFHSA-N	1	1	315.276	1.387	20	5		DDBDMO
Cc1cc(C(=O)N2CCC[C@H]3C[N@H+](C)C[C@H]32)c(N)c([N+](=O)[O-])c1	ZINC000819719284	704164469	/nfs/dbraw/zinc/16/44/69/704164469.db2.gz	RHVHFRTZZHTNFB-SMDDNHRTSA-N	1	1	318.377	1.652	20	5		DDBDMO
C[N@H+]1CCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1(C)C	ZINC000871157340	704233961	/nfs/dbraw/zinc/23/39/61/704233961.db2.gz	LTKPCXCQNAHSMK-CQSZACIVSA-N	1	1	321.377	1.571	20	5		DDBDMO
O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@@H+]1CC[C@@H]2C[C@@H]2C1	ZINC000853575709	704274225	/nfs/dbraw/zinc/27/42/25/704274225.db2.gz	JHDLEIWPXHHOGR-HSMVNMDESA-N	1	1	317.345	1.831	20	5		DDBDMO
O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1C[N@H+]1CC[C@@H]2C[C@@H]2C1	ZINC000853575709	704274226	/nfs/dbraw/zinc/27/42/26/704274226.db2.gz	JHDLEIWPXHHOGR-HSMVNMDESA-N	1	1	317.345	1.831	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC(C[NH+]3CCOCC3)C2)c([N+](=O)[O-])c1	ZINC000820591094	704306637	/nfs/dbraw/zinc/30/66/37/704306637.db2.gz	CINCNFFIWMWSEJ-UHFFFAOYSA-N	1	1	322.321	1.271	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867188240	706918776	/nfs/dbraw/zinc/91/87/76/706918776.db2.gz	WEFPIJJBOZJQGQ-WDEREUQCSA-N	1	1	309.341	1.827	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000874834286	705192179	/nfs/dbraw/zinc/19/21/79/705192179.db2.gz	QUSLQUKNTWVUOJ-WDEREUQCSA-N	1	1	306.322	1.004	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000874836916	705193674	/nfs/dbraw/zinc/19/36/74/705193674.db2.gz	IDKKXSPBGAGTDT-RYUDHWBXSA-N	1	1	304.350	1.486	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839961	705196076	/nfs/dbraw/zinc/19/60/76/705196076.db2.gz	YOHLHBPDTOZNQS-QWRGUYRKSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC000874839961	705196079	/nfs/dbraw/zinc/19/60/79/705196079.db2.gz	YOHLHBPDTOZNQS-QWRGUYRKSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874839961	705196081	/nfs/dbraw/zinc/19/60/81/705196081.db2.gz	YOHLHBPDTOZNQS-QWRGUYRKSA-N	1	1	321.381	1.750	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)OCc1ccc(N(C)C)c([N+](=O)[O-])c1	ZINC000860651468	705246446	/nfs/dbraw/zinc/24/64/46/705246446.db2.gz	RAUDIWNVYOCMRT-UHFFFAOYSA-N	1	1	318.333	1.909	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825099415	705599498	/nfs/dbraw/zinc/59/94/98/705599498.db2.gz	ZCLTXVLJADWJHE-WFASDCNBSA-N	1	1	321.377	1.619	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000827231535	705956212	/nfs/dbraw/zinc/95/62/12/705956212.db2.gz	HIHXYACCLVHVAP-JSGCOSHPSA-N	1	1	321.352	1.829	20	5		DDBDMO
CNc1nccc(C(=O)N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000827252913	705960513	/nfs/dbraw/zinc/96/05/13/705960513.db2.gz	ALTDZYPUZWNRQK-PWSUYJOCSA-N	1	1	319.365	1.198	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)COc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000827374768	705988678	/nfs/dbraw/zinc/98/86/78/705988678.db2.gz	PUIPHAFKSICHDQ-QWHCGFSZSA-N	1	1	319.361	1.526	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000835298519	707217426	/nfs/dbraw/zinc/21/74/26/707217426.db2.gz	VUKQEINRPZLLRJ-GFCCVEGCSA-N	1	1	302.371	1.474	20	5		DDBDMO
O=[N+]([O-])c1cc(C[NH+]2CCC(CO)(CO)CC2)ccc1Cl	ZINC000877797164	706218582	/nfs/dbraw/zinc/21/85/82/706218582.db2.gz	DRTQARORIHNCDA-UHFFFAOYSA-N	1	1	314.769	1.815	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])[C@H]12	ZINC000880528599	707005427	/nfs/dbraw/zinc/00/54/27/707005427.db2.gz	FMNQXOKFKALGIU-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCOc3ccccc3[N+](=O)[O-])[C@H]12	ZINC000880528599	707005429	/nfs/dbraw/zinc/00/54/29/707005429.db2.gz	FMNQXOKFKALGIU-DOMZBBRYSA-N	1	1	319.361	1.574	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000837188358	707594500	/nfs/dbraw/zinc/59/45/00/707594500.db2.gz	DYPQRCQZBDTDOS-JTQLQIEISA-N	1	1	324.356	1.871	20	5		DDBDMO
Cc1cc(C(=O)NCC[C@H]2CCC[N@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000838145137	707854570	/nfs/dbraw/zinc/85/45/70/707854570.db2.gz	VHZMXFXUDSXNGC-GFCCVEGCSA-N	1	1	320.393	1.947	20	5		DDBDMO
CCc1ccc([C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])[NH+](C)C)cc1	ZINC000839461509	708049170	/nfs/dbraw/zinc/04/91/70/708049170.db2.gz	ANFDRSZNOGURLM-KFWWJZLASA-N	1	1	305.378	1.633	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897219485	708257157	/nfs/dbraw/zinc/25/71/57/708257157.db2.gz	LDJGUJPJMUMFSS-QWHCGFSZSA-N	1	1	321.377	1.639	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000912606065	713045749	/nfs/dbraw/zinc/04/57/49/713045749.db2.gz	JDXGQSGNERELRN-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])CN1	ZINC000886098676	708698058	/nfs/dbraw/zinc/69/80/58/708698058.db2.gz	PKHFKEMSRIYGQE-CHWSQXEVSA-N	1	1	304.350	1.480	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000912610451	713048844	/nfs/dbraw/zinc/04/88/44/713048844.db2.gz	QNGUVNPQXYDXNS-UHFFFAOYSA-N	1	1	315.757	1.244	20	5		DDBDMO
COCc1ncc2c(n1)CC[N@@H+](Cc1cccnc1[N+](=O)[O-])C2	ZINC000886303866	708738873	/nfs/dbraw/zinc/73/88/73/708738873.db2.gz	HWCDWDJDMVMWMT-UHFFFAOYSA-N	1	1	315.333	1.485	20	5		DDBDMO
COCc1ncc2c(n1)CC[N@H+](Cc1cccnc1[N+](=O)[O-])C2	ZINC000886303866	708738874	/nfs/dbraw/zinc/73/88/74/708738874.db2.gz	HWCDWDJDMVMWMT-UHFFFAOYSA-N	1	1	315.333	1.485	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[N@H+](C)C[C@@H]1CC(C)C	ZINC000886602163	708791215	/nfs/dbraw/zinc/79/12/15/708791215.db2.gz	LCVJREXQFSTCEI-ZDUSSCGKSA-N	1	1	323.397	1.288	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@]3(CO)CCC[C@@H]23)c1	ZINC000886631176	708799016	/nfs/dbraw/zinc/79/90/16/708799016.db2.gz	FWGGFDQSAGZJHH-ARFHVFGLSA-N	1	1	306.362	1.865	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCN(C)CC[N@H+](C)CC1	ZINC000888992287	709425478	/nfs/dbraw/zinc/42/54/78/709425478.db2.gz	FHNDYIVZDYZQKN-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
C[C@@H](NC(=O)c1c(F)cccc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000900807972	709769319	/nfs/dbraw/zinc/76/93/19/709769319.db2.gz	XMSLQNVDPQEXSA-MFKMUULPSA-N	1	1	324.356	1.098	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)NCCc3ccccc3[N+](=O)[O-])C[C@H]2C1	ZINC000893264037	710582476	/nfs/dbraw/zinc/58/24/76/710582476.db2.gz	BDGGRMJXCSNDBN-OKILXGFUSA-N	1	1	318.377	1.340	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCC(C)([NH+](C)C)CC2)c1[N+](=O)[O-]	ZINC000913394502	713207868	/nfs/dbraw/zinc/20/78/68/713207868.db2.gz	FQYPMCWSEMVIFN-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000928451245	713202585	/nfs/dbraw/zinc/20/25/85/713202585.db2.gz	VIRSIIPMANSJNQ-CMPLNLGQSA-N	1	1	307.350	1.355	20	5		DDBDMO
CCC(=O)c1ccc(N(C)CC[N@@H+](C)CCO)c([N+](=O)[O-])c1	ZINC000894590607	711198313	/nfs/dbraw/zinc/19/83/13/711198313.db2.gz	JTMHOLWALQHPML-UHFFFAOYSA-N	1	1	309.366	1.548	20	5		DDBDMO
CNC(=O)c1ccc(N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c([N+](=O)[O-])c1	ZINC000895192662	711449540	/nfs/dbraw/zinc/44/95/40/711449540.db2.gz	KCCFQFAFPUVSII-OLZOCXBDSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895249675	711466031	/nfs/dbraw/zinc/46/60/31/711466031.db2.gz	WOFKARMZULHBHF-VXGBXAGGSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1CN(C)CC[N@@H+]1C	ZINC000895249675	711466035	/nfs/dbraw/zinc/46/60/35/711466035.db2.gz	WOFKARMZULHBHF-VXGBXAGGSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@H]1CN(C)CC[N@H+]1C	ZINC000895249675	711466037	/nfs/dbraw/zinc/46/60/37/711466037.db2.gz	WOFKARMZULHBHF-VXGBXAGGSA-N	1	1	318.381	1.289	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328398	711485777	/nfs/dbraw/zinc/48/57/77/711485777.db2.gz	FZUADFQDTPVDTO-GXFFZTMASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328398	711485778	/nfs/dbraw/zinc/48/57/78/711485778.db2.gz	FZUADFQDTPVDTO-GXFFZTMASA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@H]1[C@H](Nc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C	ZINC000895735270	711590199	/nfs/dbraw/zinc/59/01/99/711590199.db2.gz	CBRDJOPBCDHFMI-NKWVEPMBSA-N	1	1	307.276	1.852	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)N[C@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000918395946	713541559	/nfs/dbraw/zinc/54/15/59/713541559.db2.gz	VXPQYEYIZQAUCL-NSHDSACASA-N	1	1	322.321	1.635	20	5		DDBDMO
C[N@H+]1CC[C@@H]2C[NH+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931439820	714098612	/nfs/dbraw/zinc/09/86/12/714098612.db2.gz	ONZCVWNFGRTWCP-IJEWVQPXSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931439820	714098620	/nfs/dbraw/zinc/09/86/20/714098620.db2.gz	ONZCVWNFGRTWCP-IJEWVQPXSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000931439820	714098621	/nfs/dbraw/zinc/09/86/21/714098621.db2.gz	ONZCVWNFGRTWCP-IJEWVQPXSA-N	1	1	305.378	1.512	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)[C@H]2C1	ZINC000931609185	714138032	/nfs/dbraw/zinc/13/80/32/714138032.db2.gz	DDQFAIYHSHJTTG-RNCFNFMXSA-N	1	1	308.313	1.902	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000931720608	714169033	/nfs/dbraw/zinc/16/90/33/714169033.db2.gz	SYWPOAHYXFCAEG-IMJJTQAJSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CC[C@@H]2CC[C@H](C1)[N@@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000931720608	714169036	/nfs/dbraw/zinc/16/90/36/714169036.db2.gz	SYWPOAHYXFCAEG-IMJJTQAJSA-N	1	1	305.378	1.797	20	5		DDBDMO
CN1CC[C@@H]2CC[C@H](C1)[N@H+]2C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000931720608	714169039	/nfs/dbraw/zinc/16/90/39/714169039.db2.gz	SYWPOAHYXFCAEG-IMJJTQAJSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@@H]1[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923370497	714331152	/nfs/dbraw/zinc/33/11/52/714331152.db2.gz	PHLSTBNHCOKJCQ-UNIGVISCSA-N	1	1	323.393	1.311	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000933171383	714527240	/nfs/dbraw/zinc/52/72/40/714527240.db2.gz	STKQZOXRRYPUAP-KYOSRNDESA-N	1	1	322.361	1.902	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933229978	714542555	/nfs/dbraw/zinc/54/25/55/714542555.db2.gz	QVGVFUVUDKIYSE-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933229978	714542559	/nfs/dbraw/zinc/54/25/59/714542559.db2.gz	QVGVFUVUDKIYSE-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000933737577	714659343	/nfs/dbraw/zinc/65/93/43/714659343.db2.gz	BGSLKPLPROIBOM-WBMJQRKESA-N	1	1	318.377	1.417	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000934117983	714746187	/nfs/dbraw/zinc/74/61/87/714746187.db2.gz	QWTYMKBEIMBFFC-OUCADQQQSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=C1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CCCCCN1	ZINC000934156288	714756874	/nfs/dbraw/zinc/75/68/74/714756874.db2.gz	CEFLBPNGFJHNTK-HNNXBMFYSA-N	1	1	321.377	1.620	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)c([N+](=O)[O-])n1	ZINC000934329821	714796598	/nfs/dbraw/zinc/79/65/98/714796598.db2.gz	UGRYKKDACKQZFH-JTQLQIEISA-N	1	1	307.379	1.849	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCCN1C(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000935779422	715128000	/nfs/dbraw/zinc/12/80/00/715128000.db2.gz	YISRWQHOACKXLS-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@H](C)[C@H](O)C(F)(F)F)c1[N+](=O)[O-]	ZINC001183270340	743813292	/nfs/dbraw/zinc/81/32/92/743813292.db2.gz	SRTXBZCHEKJWTA-KBUNVGBDSA-N	1	1	324.255	1.710	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC001187670100	744589466	/nfs/dbraw/zinc/58/94/66/744589466.db2.gz	XSLSMMGIPONXFE-UHFFFAOYSA-N	1	1	318.337	1.521	20	5		DDBDMO
CS[C@@H]1CC[C@H]([N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC001116150369	752112715	/nfs/dbraw/zinc/11/27/15/752112715.db2.gz	NSIRQVHNMORPOP-WCFLWFBJSA-N	1	1	314.411	1.368	20	5		DDBDMO
CCOC(=O)[C@@H]1C[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CCS1	ZINC001169046744	762204176	/nfs/dbraw/zinc/20/41/76/762204176.db2.gz	MKCKNRQCOBDCHI-TUAOUCFPSA-N	1	1	302.396	1.412	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCN1C	ZINC000823784950	758362803	/nfs/dbraw/zinc/36/28/03/758362803.db2.gz	UIEZYFQHNVDZSL-YGRLFVJLSA-N	1	1	324.356	1.098	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CC1CCC1)CC2	ZINC001040699260	762652653	/nfs/dbraw/zinc/65/26/53/762652653.db2.gz	AUIJITRLYWOBGH-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]([NH2+]CC2CCCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086364056	761500767	/nfs/dbraw/zinc/50/07/67/761500767.db2.gz	RVSYIQJUTPENSI-KBUPBQIOSA-N	1	1	309.410	1.716	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2)C1	ZINC001097037499	771590816	/nfs/dbraw/zinc/59/08/16/771590816.db2.gz	NEMHZIQMNPQIOV-HDJSIYSDSA-N	1	1	320.393	1.994	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001093642352	774924301	/nfs/dbraw/zinc/92/43/01/774924301.db2.gz	YRXDHNGUFOBOTO-UHFFFAOYSA-N	1	1	318.337	1.031	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001093787412	775078504	/nfs/dbraw/zinc/07/85/04/775078504.db2.gz	BXNDLDPLUKOPEI-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCN(C)c1ccc([N+](=O)[O-])cc1	ZINC001100203914	775817067	/nfs/dbraw/zinc/81/70/67/775817067.db2.gz	LWYPQXKFPMRINM-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
[NH3+]Cc1nc(=O)[nH]n1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172901204	776916140	/nfs/dbraw/zinc/91/61/40/776916140.db2.gz	KYATZUUXTSCEIH-LLVKDONJSA-N	1	1	303.322	1.471	20	5		DDBDMO
Cc1nc(NCCN(C)C(=O)C[N@H+](C)C(C)C)ccc1[N+](=O)[O-]	ZINC001101657942	777354853	/nfs/dbraw/zinc/35/48/53/777354853.db2.gz	ZGIPLIWLYJAKLQ-UHFFFAOYSA-N	1	1	323.397	1.509	20	5		DDBDMO
Cc1ncc(C[N@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)o1	ZINC001267257864	837679554	/nfs/dbraw/zinc/67/95/54/837679554.db2.gz	YPCVLUWQEQTIKZ-ZIAGYGMSSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1ncc(C[N@@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)o1	ZINC001267257864	837679560	/nfs/dbraw/zinc/67/95/60/837679560.db2.gz	YPCVLUWQEQTIKZ-ZIAGYGMSSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1ncc(C[N@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)o1	ZINC001267257864	837679566	/nfs/dbraw/zinc/67/95/66/837679566.db2.gz	YPCVLUWQEQTIKZ-ZIAGYGMSSA-N	1	1	324.381	1.365	20	5		DDBDMO
CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266900784	837028521	/nfs/dbraw/zinc/02/85/21/837028521.db2.gz	GDTAHGBAXUWVJE-VZFUPFRKSA-N	1	1	307.394	1.444	20	5		DDBDMO
CCC/C=C\CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001266900784	837028532	/nfs/dbraw/zinc/02/85/32/837028532.db2.gz	GDTAHGBAXUWVJE-VZFUPFRKSA-N	1	1	307.394	1.444	20	5		DDBDMO
CCC/C=C\CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001266900784	837028540	/nfs/dbraw/zinc/02/85/40/837028540.db2.gz	GDTAHGBAXUWVJE-VZFUPFRKSA-N	1	1	307.394	1.444	20	5		DDBDMO
CN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001267371614	837933754	/nfs/dbraw/zinc/93/37/54/837933754.db2.gz	NYDAIOAIBYXZKO-HZPDHXFCSA-N	1	1	317.389	1.777	20	5		DDBDMO
O=C(NCCC1CC[NH+](CCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001267943249	839233182	/nfs/dbraw/zinc/23/31/82/839233182.db2.gz	GOXWPHCZNWQNLP-CHWSQXEVSA-N	1	1	301.362	1.230	20	5		DDBDMO
Nc1c(C(=O)NCC[NH+]2CCC2)cc(Cl)c(F)c1[N+](=O)[O-]	ZINC001137707445	859965965	/nfs/dbraw/zinc/96/59/65/859965965.db2.gz	OEFAVTQAGFRBCF-UHFFFAOYSA-N	1	1	316.720	1.405	20	5		DDBDMO
CC(C)[N@@H+](C)[C@H]1CCN(c2ncc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC001157011150	863517510	/nfs/dbraw/zinc/51/75/10/863517510.db2.gz	XHJFJNPCEFXKHV-JTQLQIEISA-N	1	1	309.326	1.817	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001157409994	863798289	/nfs/dbraw/zinc/79/82/89/863798289.db2.gz	NGWWBPCQQHFHDZ-FAQJLRJSSA-N	1	1	322.365	1.738	20	5		DDBDMO
CCOc1nc(NCC2([NH+]3CCCC3)COC2)ccc1[N+](=O)[O-]	ZINC001157655999	864023620	/nfs/dbraw/zinc/02/36/20/864023620.db2.gz	QMVJOVITNHYHTJ-UHFFFAOYSA-N	1	1	322.365	1.665	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1nc2ccccc2o1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761134	864110932	/nfs/dbraw/zinc/11/09/32/864110932.db2.gz	NVIABKCLEOKDLJ-ZYHUDNBSSA-N	1	1	318.333	1.089	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC001161493722	866711502	/nfs/dbraw/zinc/71/15/02/866711502.db2.gz	GSLBVFDWIMHFDD-NSHDSACASA-N	1	1	319.361	1.912	20	5		DDBDMO
COc1ccc(C(=O)N2CC[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC001161493722	866711510	/nfs/dbraw/zinc/71/15/10/866711510.db2.gz	GSLBVFDWIMHFDD-NSHDSACASA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2C3CCC2(CO)CC3)c1	ZINC001334498110	867622663	/nfs/dbraw/zinc/62/26/63/867622663.db2.gz	YVZOUDQGMRHKLF-UGWHAMFMSA-N	1	1	322.361	1.324	20	5		DDBDMO
COC(=O)CC(C)(C)[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC001335183510	868116954	/nfs/dbraw/zinc/11/69/54/868116954.db2.gz	VIZINMBIVDWPGV-CYBMUJFWSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[N@H+]1CC[C@H](C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001335351186	868242304	/nfs/dbraw/zinc/24/23/04/868242304.db2.gz	OWJOPHGVQKASJG-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
CN1CC[C@H](C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC001335351186	868242320	/nfs/dbraw/zinc/24/23/20/868242320.db2.gz	OWJOPHGVQKASJG-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
CC[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2C(=O)OC)CC1	ZINC001163771262	868691111	/nfs/dbraw/zinc/69/11/11/868691111.db2.gz	JMPCAWIJJPWXIL-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2N)C[C@H]1C(C)(C)C	ZINC001163929783	868801985	/nfs/dbraw/zinc/80/19/85/868801985.db2.gz	NENIAYAIQVLCNR-AWEZNQCLSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@H]3CCC(=O)N3)ccc([N+](=O)[O-])c2C1	ZINC001164170825	868989798	/nfs/dbraw/zinc/98/97/98/868989798.db2.gz	IVFUVVBRAHNUFI-SNVBAGLBSA-N	1	1	304.350	1.273	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@H]3CCC(=O)N3)ccc([N+](=O)[O-])c2C1	ZINC001164170825	868989806	/nfs/dbraw/zinc/98/98/06/868989806.db2.gz	IVFUVVBRAHNUFI-SNVBAGLBSA-N	1	1	304.350	1.273	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12	ZINC001339316050	870442490	/nfs/dbraw/zinc/44/24/90/870442490.db2.gz	GECHUHDHBHXLHO-LERXQTSPSA-N	1	1	319.361	1.673	20	5		DDBDMO
COc1cc(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC001339815422	870712296	/nfs/dbraw/zinc/71/22/96/870712296.db2.gz	MPDPUAWHOPFNBN-RISCZKNCSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@H](C)[C@@H]2CN(C)CC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815422	870712301	/nfs/dbraw/zinc/71/23/01/870712301.db2.gz	MPDPUAWHOPFNBN-RISCZKNCSA-N	1	1	308.382	1.650	20	5		DDBDMO
COc1cc(N[C@H](C)[C@@H]2CN(C)CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC001339815422	870712310	/nfs/dbraw/zinc/71/23/10/870712310.db2.gz	MPDPUAWHOPFNBN-RISCZKNCSA-N	1	1	308.382	1.650	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2C[C@H]3[C@H](CO)[C@H]3C2)o1	ZINC001307799319	871453997	/nfs/dbraw/zinc/45/39/97/871453997.db2.gz	ODPATYVWDJBPQE-GDNZZTSVSA-N	1	1	316.317	1.315	20	5		DDBDMO
O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2C[C@H]3[C@H](CO)[C@H]3C2)o1	ZINC001307799319	871454002	/nfs/dbraw/zinc/45/40/02/871454002.db2.gz	ODPATYVWDJBPQE-GDNZZTSVSA-N	1	1	316.317	1.315	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@H](CC(C)(C)C(N)=O)C2)c([N+](=O)[O-])n1	ZINC001307781893	871454621	/nfs/dbraw/zinc/45/46/21/871454621.db2.gz	QDNYIKWJATWXFZ-LLVKDONJSA-N	1	1	323.397	1.442	20	5		DDBDMO
C[C@H]1COCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC001341004479	871462666	/nfs/dbraw/zinc/46/26/66/871462666.db2.gz	HHWPXGALRIUCIH-ABAIWWIYSA-N	1	1	307.350	1.264	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC001310518888	871638752	/nfs/dbraw/zinc/63/87/52/871638752.db2.gz	LLCLDSTWQLNPBN-NSHDSACASA-N	1	1	309.370	1.572	20	5		DDBDMO
COC(=O)c1ccc(O[C@@H]2CCc3[nH+]ccn3C2)c([N+](=O)[O-])c1	ZINC001227297270	882957675	/nfs/dbraw/zinc/95/76/75/882957675.db2.gz	BYLWJYGIUCPWHU-LLVKDONJSA-N	1	1	317.301	1.972	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC001353895728	877636362	/nfs/dbraw/zinc/63/63/62/877636362.db2.gz	WHGZUBQHMLMDGQ-ZDUSSCGKSA-N	1	1	321.377	1.746	20	5		DDBDMO
COC(=O)c1ccc(COC[C@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC001223414677	880954213	/nfs/dbraw/zinc/95/42/13/880954213.db2.gz	MKKGLQBMKAIIQT-CYBMUJFWSA-N	1	1	324.333	1.229	20	5		DDBDMO
COC(=O)c1ccc(COC[C@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])c1	ZINC001223414677	880954217	/nfs/dbraw/zinc/95/42/17/880954217.db2.gz	MKKGLQBMKAIIQT-CYBMUJFWSA-N	1	1	324.333	1.229	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CO[C@H](C)C[NH+]1CCOCC1	ZINC001223944143	881158363	/nfs/dbraw/zinc/15/83/63/881158363.db2.gz	XPELJJNZNVVRKS-GFCCVEGCSA-N	1	1	310.350	1.841	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@](C)(CO)[C@@H](O)C1	ZINC001254553296	896499576	/nfs/dbraw/zinc/49/95/76/896499576.db2.gz	UQIKMOKMRJMVPR-UHOFOFEASA-N	1	1	308.378	1.591	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])N1CC([N@@H+](C)[C@@H]2CCOC2)C1	ZINC001254560870	896501497	/nfs/dbraw/zinc/50/14/97/896501497.db2.gz	YRCBPKGSOPROFU-DZGCQCFKSA-N	1	1	319.405	1.931	20	5		DDBDMO
COC(=O)CN1CC[NH+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC001254561128	896502691	/nfs/dbraw/zinc/50/26/91/896502691.db2.gz	FLRYLLQCJDKOFL-ZDUSSCGKSA-N	1	1	321.377	1.316	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCCO1	ZINC001254610923	896531192	/nfs/dbraw/zinc/53/11/92/896531192.db2.gz	MTWOTTIBRBDBGM-HUUCEWRRSA-N	1	1	320.345	1.326	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[NH+](CCO)CC2)cccc1C(F)(F)F	ZINC001262056138	899921361	/nfs/dbraw/zinc/92/13/61/899921361.db2.gz	FXGYVUYLVNLTLJ-UHFFFAOYSA-N	1	1	319.283	1.728	20	5		DDBDMO
CC(C)[N@H+](C)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC001262564502	900247842	/nfs/dbraw/zinc/24/78/42/900247842.db2.gz	KFUSBHGQBYNKDU-CYBMUJFWSA-N	1	1	311.382	1.264	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC001262564502	900247856	/nfs/dbraw/zinc/24/78/56/900247856.db2.gz	KFUSBHGQBYNKDU-CYBMUJFWSA-N	1	1	311.382	1.264	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCCCCF)CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001279555420	903325042	/nfs/dbraw/zinc/32/50/42/903325042.db2.gz	ZFOXCSBNLGDLMW-ZIAGYGMSSA-N	1	1	313.373	1.540	20	5		DDBDMO
O=C(NCC1=CC[N@H+](CCCCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001279555420	903325049	/nfs/dbraw/zinc/32/50/49/903325049.db2.gz	ZFOXCSBNLGDLMW-ZIAGYGMSSA-N	1	1	313.373	1.540	20	5		DDBDMO
O=C(NCC1=CC[N@@H+](CCCCCF)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001279555420	903325061	/nfs/dbraw/zinc/32/50/61/903325061.db2.gz	ZFOXCSBNLGDLMW-ZIAGYGMSSA-N	1	1	313.373	1.540	20	5		DDBDMO
CCCCC[NH+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1	ZINC001280387929	903626265	/nfs/dbraw/zinc/62/62/65/903626265.db2.gz	JQDWZAUQMUURGQ-ZIAGYGMSSA-N	1	1	309.410	1.766	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC001297253833	916840973	/nfs/dbraw/zinc/84/09/73/916840973.db2.gz	ZCORBULHTHNXPU-TXEJJXNPSA-N	1	1	319.361	1.627	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H]1CCC[C@H]1O	ZINC000305361544	231004432	/nfs/dbraw/zinc/00/44/32/231004432.db2.gz	UEYDNHKERNMGSR-IUODEOHRSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CC[C@H](CCCO)C2)c1	ZINC000452135391	231315667	/nfs/dbraw/zinc/31/56/67/231315667.db2.gz	VWWUZLUEUSBKAP-ZFWWWQNUSA-N	1	1	324.377	1.429	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000495224769	529576226	/nfs/dbraw/zinc/57/62/26/529576226.db2.gz	NQILQEBMMRGVCA-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000495224769	529576231	/nfs/dbraw/zinc/57/62/31/529576231.db2.gz	NQILQEBMMRGVCA-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[C@H](CNc1sc(S(C)(=O)=O)cc1[N+](=O)[O-])[NH+](C)C	ZINC000272865333	282318844	/nfs/dbraw/zinc/31/88/44/282318844.db2.gz	RKKRNKQAOPRSJB-SSDOTTSWSA-N	1	1	307.397	1.422	20	5		DDBDMO
C[N@@H+]1CCC[C@@H](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000458215462	530054741	/nfs/dbraw/zinc/05/47/41/530054741.db2.gz	NHABCSBYMVMHQP-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1	ZINC000458215462	530054742	/nfs/dbraw/zinc/05/47/42/530054742.db2.gz	NHABCSBYMVMHQP-NSHDSACASA-N	1	1	307.350	1.762	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ccc([N+](=O)[O-])c3cccnc23)C1	ZINC000358335166	299124669	/nfs/dbraw/zinc/12/46/69/299124669.db2.gz	ZBKFUNWRLTUXAF-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)C1=CC[N@@H+](C)CC1	ZINC000272659564	210064124	/nfs/dbraw/zinc/06/41/24/210064124.db2.gz	BRSGBXCBIVDJNX-GFCCVEGCSA-N	1	1	319.361	1.740	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1[nH]ncc1[N+](=O)[O-])Cc1ccccc1	ZINC000138213331	186014764	/nfs/dbraw/zinc/01/47/64/186014764.db2.gz	GRKCEKGCDHCYJO-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
C[N@H+](CCNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccccc1	ZINC000138213331	186014765	/nfs/dbraw/zinc/01/47/65/186014765.db2.gz	GRKCEKGCDHCYJO-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1n[nH]cc1[N+](=O)[O-])Cc1ccccc1	ZINC000138213331	186014768	/nfs/dbraw/zinc/01/47/68/186014768.db2.gz	GRKCEKGCDHCYJO-UHFFFAOYSA-N	1	1	303.322	1.180	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)CN1CC[NH+](C)CC1	ZINC000287208647	219381926	/nfs/dbraw/zinc/38/19/26/219381926.db2.gz	IGJJTNGWMJPGHO-LBPRGKRZSA-N	1	1	320.393	1.845	20	5		DDBDMO
O=C(NCC1([NH+]2CCSCC2)CCCC1)[C@H]1CC1[N+](=O)[O-]	ZINC000044521421	352387319	/nfs/dbraw/zinc/38/73/19/352387319.db2.gz	FNIXITJXMUASFJ-NWDGAFQWSA-N	1	1	313.423	1.129	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046996832	352475890	/nfs/dbraw/zinc/47/58/90/352475890.db2.gz	UWLQOFPMZNTXFY-UONOGXRCSA-N	1	1	304.350	1.655	20	5		DDBDMO
Cc1cccc(C(=O)NCCC[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000057026675	352795818	/nfs/dbraw/zinc/79/58/18/352795818.db2.gz	VAOPKGAGMCZDJK-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000073900367	353277460	/nfs/dbraw/zinc/27/74/60/353277460.db2.gz	ZKTKQJIKKXSIKF-CQSZACIVSA-N	1	1	306.366	1.878	20	5		DDBDMO
COC[C@](C)(CC(=O)OC)[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000078661374	353527010	/nfs/dbraw/zinc/52/70/10/353527010.db2.gz	HEKCIOXXIXOMCW-LBPRGKRZSA-N	1	1	302.352	1.714	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])nc2)[C@@H](C)C1	ZINC000089265453	353763764	/nfs/dbraw/zinc/76/37/64/353763764.db2.gz	OLUJPFRONYIQBT-NSHDSACASA-N	1	1	308.338	1.063	20	5		DDBDMO
COc1cc(C[N@@H+](CCO)CC2CC2)c([N+](=O)[O-])cc1OC	ZINC000092506012	353859812	/nfs/dbraw/zinc/85/98/12/353859812.db2.gz	ARJLHKBXBXSQEF-UHFFFAOYSA-N	1	1	310.350	1.816	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@H+](C)CCO1	ZINC000129903800	354087427	/nfs/dbraw/zinc/08/74/27/354087427.db2.gz	ITJFZHNJHZWWOT-GWCFXTLKSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1C[N@@H+](C)CCO1	ZINC000129903800	354087432	/nfs/dbraw/zinc/08/74/32/354087432.db2.gz	ITJFZHNJHZWWOT-GWCFXTLKSA-N	1	1	308.338	1.435	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000139418043	354127523	/nfs/dbraw/zinc/12/75/23/354127523.db2.gz	LAYWJMZDPGZJQN-AWEZNQCLSA-N	1	1	321.381	1.400	20	5		DDBDMO
C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@H+](C)CCO1	ZINC000156795822	354221466	/nfs/dbraw/zinc/22/14/66/354221466.db2.gz	UBEZHSDJULELLZ-DOMZBBRYSA-N	1	1	321.377	1.363	20	5		DDBDMO
C[C@@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)[C@@H]1C[N@@H+](C)CCO1	ZINC000156795822	354221469	/nfs/dbraw/zinc/22/14/69/354221469.db2.gz	UBEZHSDJULELLZ-DOMZBBRYSA-N	1	1	321.377	1.363	20	5		DDBDMO
COc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156798663	354221855	/nfs/dbraw/zinc/22/18/55/354221855.db2.gz	NOIQEBRKNSMXIU-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1cc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000156798663	354221857	/nfs/dbraw/zinc/22/18/57/354221857.db2.gz	NOIQEBRKNSMXIU-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1NCCC[NH+]1CCOCC1	ZINC000312660233	354477610	/nfs/dbraw/zinc/47/76/10/354477610.db2.gz	WDIRVVOCXVUUDO-UHFFFAOYSA-N	1	1	300.746	1.777	20	5		DDBDMO
CC(C)[N@@H+](C)CCNc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C	ZINC000587780534	354885634	/nfs/dbraw/zinc/88/56/34/354885634.db2.gz	YEOHCNZMCSSVBX-UHFFFAOYSA-N	1	1	321.381	1.537	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]([N@H+]3CC[C@@H](O)C3)C2)cc([N+](=O)[O-])c1	ZINC000588860629	354943689	/nfs/dbraw/zinc/94/36/89/354943689.db2.gz	KIAFLSQLMLJQHT-DZGCQCFKSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC([C@@H](C)O)CC2)c1	ZINC000589496995	354996117	/nfs/dbraw/zinc/99/61/17/354996117.db2.gz	AHCAGJKRQVUJSX-LLVKDONJSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H](CO)C2)c1	ZINC000589494678	354996303	/nfs/dbraw/zinc/99/63/03/354996303.db2.gz	XRYAFVJQUSHKMJ-NSHDSACASA-N	1	1	308.334	1.586	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](CO)C2)c1	ZINC000589494678	354996305	/nfs/dbraw/zinc/99/63/05/354996305.db2.gz	XRYAFVJQUSHKMJ-NSHDSACASA-N	1	1	308.334	1.586	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000590011105	355040785	/nfs/dbraw/zinc/04/07/85/355040785.db2.gz	HUKWCDIBACTPPT-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@H]2[C@@H](CC[N@@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000590011105	355040787	/nfs/dbraw/zinc/04/07/87/355040787.db2.gz	HUKWCDIBACTPPT-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1C[C@H]2[C@@H](CC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000590011105	355040789	/nfs/dbraw/zinc/04/07/89/355040789.db2.gz	HUKWCDIBACTPPT-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000494851688	235095944	/nfs/dbraw/zinc/09/59/44/235095944.db2.gz	SGIYUXBVSNLYKQ-UHFFFAOYSA-N	1	1	322.409	1.137	20	5		DDBDMO
CN(CCCNC(=O)Cc1ccc([N+](=O)[O-])cc1)CC[NH+](C)C	ZINC000494851688	235095946	/nfs/dbraw/zinc/09/59/46/235095946.db2.gz	SGIYUXBVSNLYKQ-UHFFFAOYSA-N	1	1	322.409	1.137	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000590446390	355099625	/nfs/dbraw/zinc/09/96/25/355099625.db2.gz	TVSMNOSSPTXYPE-NOZJJQNGSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000590446390	355099628	/nfs/dbraw/zinc/09/96/28/355099628.db2.gz	TVSMNOSSPTXYPE-NOZJJQNGSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3[nH]nc4ccc([N+](=O)[O-])cc43)[C@@H]2C1	ZINC000590446390	355099631	/nfs/dbraw/zinc/09/96/31/355099631.db2.gz	TVSMNOSSPTXYPE-NOZJJQNGSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3nc4ccc([N+](=O)[O-])cc4c(=O)[nH]3)C[C@@H]21	ZINC000590720105	355155511	/nfs/dbraw/zinc/15/55/11/355155511.db2.gz	MLCASZGKJPDXSV-RNCFNFMXSA-N	1	1	315.333	1.384	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H]2COC[C@@H]21	ZINC000590971660	355227441	/nfs/dbraw/zinc/22/74/41/355227441.db2.gz	DHGZITCHKUVJBV-NFAWXSAZSA-N	1	1	322.361	1.445	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCNC1CC1	ZINC000591577223	355329829	/nfs/dbraw/zinc/32/98/29/355329829.db2.gz	CPJSDIDIILUTIN-NSHDSACASA-N	1	1	306.366	1.654	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2cscn2)c1	ZINC000591728817	355372957	/nfs/dbraw/zinc/37/29/57/355372957.db2.gz	SDFSDISKNWDLCR-GFCCVEGCSA-N	1	1	309.347	1.581	20	5		DDBDMO
CC[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1[NH3+]	ZINC000592489678	355598567	/nfs/dbraw/zinc/59/85/67/355598567.db2.gz	ZMKOUBPUZMGZFT-QWHCGFSZSA-N	1	1	320.393	1.983	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000593067543	355785680	/nfs/dbraw/zinc/78/56/80/355785680.db2.gz	VPQABKZFSHYHGU-HUUCEWRRSA-N	1	1	324.377	1.964	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000593067543	355785682	/nfs/dbraw/zinc/78/56/82/355785682.db2.gz	VPQABKZFSHYHGU-HUUCEWRRSA-N	1	1	324.377	1.964	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000593070267	355786366	/nfs/dbraw/zinc/78/63/66/355786366.db2.gz	VYTWCBRCFGPTNF-LSDHHAIUSA-N	1	1	324.377	1.835	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C	ZINC000593188847	355821071	/nfs/dbraw/zinc/82/10/71/355821071.db2.gz	RPHPUJJZCQSUDQ-GMTAPVOTSA-N	1	1	309.370	1.039	20	5		DDBDMO
C[C@H](O)C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1	ZINC000594063590	356103597	/nfs/dbraw/zinc/10/35/97/356103597.db2.gz	IWUUKZBUTQZDGQ-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH+]2CC3(CC3(F)F)C2)c1	ZINC000594570237	356252853	/nfs/dbraw/zinc/25/28/53/356252853.db2.gz	IPBODRLWVUFJQN-LLVKDONJSA-N	1	1	314.288	1.676	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595327870	356450811	/nfs/dbraw/zinc/45/08/11/356450811.db2.gz	VJAMMJXPDBPUTI-LBPRGKRZSA-N	1	1	310.354	1.188	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595327870	356450814	/nfs/dbraw/zinc/45/08/14/356450814.db2.gz	VJAMMJXPDBPUTI-LBPRGKRZSA-N	1	1	310.354	1.188	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000595477492	356509966	/nfs/dbraw/zinc/50/99/66/356509966.db2.gz	UOUQAPAHMKRUCZ-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](CCOCCO)C1CCC1	ZINC000595602938	356571806	/nfs/dbraw/zinc/57/18/06/356571806.db2.gz	ZCLGRHUQHJNKLY-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000595742405	356631129	/nfs/dbraw/zinc/63/11/29/356631129.db2.gz	GARUDNIRZYTCEU-ATCWAGBWSA-N	1	1	324.377	1.931	20	5		DDBDMO
C[C@H]1COC2(CCCC2)C[N@@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595815620	356661768	/nfs/dbraw/zinc/66/17/68/356661768.db2.gz	OTDLWVORBHPVOV-ZDUSSCGKSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H]1COC2(CCCC2)C[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595815620	356661770	/nfs/dbraw/zinc/66/17/70/356661770.db2.gz	OTDLWVORBHPVOV-ZDUSSCGKSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(COC2)C1	ZINC000595833480	356670461	/nfs/dbraw/zinc/67/04/61/356670461.db2.gz	KORNYVQGAPVJAC-LLVKDONJSA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC2(COC2)C1	ZINC000595833480	356670462	/nfs/dbraw/zinc/67/04/62/356670462.db2.gz	KORNYVQGAPVJAC-LLVKDONJSA-N	1	1	305.334	1.644	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C[C@]1(C)CO	ZINC000595856992	356679546	/nfs/dbraw/zinc/67/95/46/356679546.db2.gz	HERBBDFSXKPMRO-IVMMDQJWSA-N	1	1	324.377	1.285	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H]2COC[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000595826933	356665924	/nfs/dbraw/zinc/66/59/24/356665924.db2.gz	BESAWYNBWBZWAS-CHWSQXEVSA-N	1	1	319.361	1.892	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC(CO)(CO)C1	ZINC000597218849	357098325	/nfs/dbraw/zinc/09/83/25/357098325.db2.gz	LZYHZANPUFTNPA-NTUHNPAUSA-N	1	1	306.362	1.675	20	5		DDBDMO
CC(=O)NCC[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000347622523	283243561	/nfs/dbraw/zinc/24/35/61/283243561.db2.gz	JAFHLRBBDOVKCB-ZDUSSCGKSA-N	1	1	309.370	1.030	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000597854820	357359235	/nfs/dbraw/zinc/35/92/35/357359235.db2.gz	MSPQBEOXKBEUHW-LLVKDONJSA-N	1	1	309.370	1.028	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597922500	357382519	/nfs/dbraw/zinc/38/25/19/357382519.db2.gz	DXKBIFOBTVBAOG-JTQLQIEISA-N	1	1	309.370	1.239	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000598342080	357543818	/nfs/dbraw/zinc/54/38/18/357543818.db2.gz	DKUPRFKMUXLSFR-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@H]1CC[N@H+]1C1CCCC1	ZINC000599164768	357835576	/nfs/dbraw/zinc/83/55/76/357835576.db2.gz	MBKZHRHWEZVVSU-LLVKDONJSA-N	1	1	319.365	1.518	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H]3CC[C@@H](C2)S3(=O)=O)cc1	ZINC000599633295	358000118	/nfs/dbraw/zinc/00/01/18/358000118.db2.gz	PNUUOOZQBAVLGE-CABCVRRESA-N	1	1	324.402	1.789	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@H]3CC[C@@H](C2)S3(=O)=O)cc1	ZINC000599633295	358000120	/nfs/dbraw/zinc/00/01/20/358000120.db2.gz	PNUUOOZQBAVLGE-CABCVRRESA-N	1	1	324.402	1.789	20	5		DDBDMO
Cc1ccc(NC(=O)NCC[N@H+]2CC[C@@H](O)C2)cc1[N+](=O)[O-]	ZINC000599695554	358029864	/nfs/dbraw/zinc/02/98/64/358029864.db2.gz	MWHITPZXABXGOX-GFCCVEGCSA-N	1	1	308.338	1.091	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+](C(C)C)C1	ZINC000347975829	283313216	/nfs/dbraw/zinc/31/32/16/283313216.db2.gz	HZIIGDBQCAKDMB-LBPRGKRZSA-N	1	1	306.366	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC[N@H+]1CC[C@@H](O)C1	ZINC000599779355	358056500	/nfs/dbraw/zinc/05/65/00/358056500.db2.gz	HCSGWDYQEUDRRB-GFCCVEGCSA-N	1	1	308.338	1.091	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000600809159	358320817	/nfs/dbraw/zinc/32/08/17/358320817.db2.gz	TZKRPVZWSQPUDE-JTQLQIEISA-N	1	1	313.741	1.045	20	5		DDBDMO
CCN1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CC1=O	ZINC000601142413	358418506	/nfs/dbraw/zinc/41/85/06/358418506.db2.gz	QIEDLVHTYWCVSU-UHFFFAOYSA-N	1	1	300.318	1.812	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC(O)(CO)CC3)c2c1	ZINC000601194619	358442176	/nfs/dbraw/zinc/44/21/76/358442176.db2.gz	LQWWRXVHHYWWKG-UHFFFAOYSA-N	1	1	303.318	1.467	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)C(N)=O	ZINC000602637652	359090612	/nfs/dbraw/zinc/09/06/12/359090612.db2.gz	NUDUBDPYOKPTHU-SCSAIBSYSA-N	1	1	308.157	1.382	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1	ZINC000602577940	359051982	/nfs/dbraw/zinc/05/19/82/359051982.db2.gz	RLQBZOARTZJLIO-ZQJOYCHOSA-N	1	1	322.390	1.917	20	5		DDBDMO
CO[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1O	ZINC000602683816	359123150	/nfs/dbraw/zinc/12/31/50/359123150.db2.gz	SWACCMLWHXFSOR-VXGBXAGGSA-N	1	1	320.267	1.805	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1O	ZINC000602683816	359123153	/nfs/dbraw/zinc/12/31/53/359123153.db2.gz	SWACCMLWHXFSOR-VXGBXAGGSA-N	1	1	320.267	1.805	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCc2ccc(O)cc2CC1	ZINC000602789027	359193375	/nfs/dbraw/zinc/19/33/75/359193375.db2.gz	WPSMSCLYYFODSE-UHFFFAOYSA-N	1	1	316.361	1.906	20	5		DDBDMO
COC(=O)CC[N@@H+](CCn1c(C)ncc1[N+](=O)[O-])CC(C)C	ZINC000602767096	359176350	/nfs/dbraw/zinc/17/63/50/359176350.db2.gz	VSAFZGLHJNTJIY-UHFFFAOYSA-N	1	1	312.370	1.621	20	5		DDBDMO
O=c1cc(C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)cc[nH]1	ZINC000602837880	359227967	/nfs/dbraw/zinc/22/79/67/359227967.db2.gz	PNIDXPHNTMEUTC-UHFFFAOYSA-N	1	1	315.333	1.413	20	5		DDBDMO
COC(=O)C1([N@H+](C)CCn2c(C)ncc2[N+](=O)[O-])CCCC1	ZINC000602798934	359200414	/nfs/dbraw/zinc/20/04/14/359200414.db2.gz	YUUOMNHULVDSJB-UHFFFAOYSA-N	1	1	310.354	1.517	20	5		DDBDMO
COC(=O)C1([N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])CCCC1	ZINC000602798934	359200418	/nfs/dbraw/zinc/20/04/18/359200418.db2.gz	YUUOMNHULVDSJB-UHFFFAOYSA-N	1	1	310.354	1.517	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C[C@@]2(CCOC2)O1	ZINC000602823132	359217387	/nfs/dbraw/zinc/21/73/87/359217387.db2.gz	YUGJCAGSRPPTMG-UKRRQHHQSA-N	1	1	324.381	1.370	20	5		DDBDMO
Cn1cc(C[NH2+][C@@]2(CO)CCCc3ccccc32)c([N+](=O)[O-])n1	ZINC000602823746	359218899	/nfs/dbraw/zinc/21/88/99/359218899.db2.gz	CUIVTDNUZCGRRQ-MRXNPFEDSA-N	1	1	316.361	1.642	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602825507	359220079	/nfs/dbraw/zinc/22/00/79/359220079.db2.gz	CFQVTGNSUBDLGZ-ZDUSSCGKSA-N	1	1	323.397	1.480	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](O)C[C@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602901552	359283396	/nfs/dbraw/zinc/28/33/96/359283396.db2.gz	ZZASTAKXRNCCNN-SWLSCSKDSA-N	1	1	310.350	1.311	20	5		DDBDMO
Cn1cc(CN2CCC([C@@H]3CCC[NH2+]C3)CC2)c([N+](=O)[O-])n1	ZINC000603428644	359634812	/nfs/dbraw/zinc/63/48/12/359634812.db2.gz	KUPMIBYDHRBWCQ-CYBMUJFWSA-N	1	1	307.398	1.540	20	5		DDBDMO
CNC(=O)c1ccc(NCC[N@H+]2CCCOCC2)c([N+](=O)[O-])c1	ZINC000188496033	200256441	/nfs/dbraw/zinc/25/64/41/200256441.db2.gz	BWPKEHLASUVOFI-UHFFFAOYSA-N	1	1	322.365	1.089	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2ccccc2[N+](=O)[O-])C1	ZINC000609269558	360285405	/nfs/dbraw/zinc/28/54/05/360285405.db2.gz	UAONIOPJQPNDGO-LBPRGKRZSA-N	1	1	307.350	1.435	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000609269896	360285537	/nfs/dbraw/zinc/28/55/37/360285537.db2.gz	ZDPHISSCBIJCJB-CQSZACIVSA-N	1	1	321.377	1.744	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000609279557	360287504	/nfs/dbraw/zinc/28/75/04/360287504.db2.gz	JRIQMJQZOOLONE-ZDUSSCGKSA-N	1	1	322.365	1.827	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccsc3[N+](=O)[O-])CC2)C1	ZINC000609674473	360343178	/nfs/dbraw/zinc/34/31/78/360343178.db2.gz	HBJMZBRFGZRJHO-GFCCVEGCSA-N	1	1	310.423	1.873	20	5		DDBDMO
Cc1nccc([C@@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)n1	ZINC000610485029	360447503	/nfs/dbraw/zinc/44/75/03/360447503.db2.gz	ZTJODGNTFQBSTG-CYBMUJFWSA-N	1	1	316.365	1.769	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)C[C@@H](O)C2CC2)c([N+](=O)[O-])c1	ZINC000610571772	360472383	/nfs/dbraw/zinc/47/23/83/360472383.db2.gz	NQZUPMMCYGSXOF-CQSZACIVSA-N	1	1	310.350	1.685	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[NH+](C[C@H]3CCCO3)CC2)c1	ZINC000610514158	360457405	/nfs/dbraw/zinc/45/74/05/360457405.db2.gz	AJZPNRVVLBMBMV-CQSZACIVSA-N	1	1	321.377	1.904	20	5		DDBDMO
O=C(C[N@@H+]1C[C@H]2CCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762770	360530976	/nfs/dbraw/zinc/53/09/76/360530976.db2.gz	UDRNEYHHSZMTFO-TZMCWYRMSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(C[N@H+]1C[C@H]2CCC[C@H]21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610762770	360530981	/nfs/dbraw/zinc/53/09/81/360530981.db2.gz	UDRNEYHHSZMTFO-TZMCWYRMSA-N	1	1	301.346	1.968	20	5		DDBDMO
O=C(CC[N@H+]1CCc2c[nH]nc2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000611008783	360599982	/nfs/dbraw/zinc/59/99/82/360599982.db2.gz	KOYFXAVTIPDMTE-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2cn[nH]c2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000611008783	360599983	/nfs/dbraw/zinc/59/99/83/360599983.db2.gz	KOYFXAVTIPDMTE-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
O=C(CC[N@H+]1CCc2cn[nH]c2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000611008783	360599985	/nfs/dbraw/zinc/59/99/85/360599985.db2.gz	KOYFXAVTIPDMTE-UHFFFAOYSA-N	1	1	315.333	1.705	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C	ZINC000611088480	360620101	/nfs/dbraw/zinc/62/01/01/360620101.db2.gz	YXKGVFQFWIPSRX-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C	ZINC000611088480	360620104	/nfs/dbraw/zinc/62/01/04/360620104.db2.gz	YXKGVFQFWIPSRX-SNVBAGLBSA-N	1	1	321.333	1.490	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000611263732	360682978	/nfs/dbraw/zinc/68/29/78/360682978.db2.gz	CZYQWDXEQVCRMX-UHFFFAOYSA-N	1	1	324.333	1.751	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCO1	ZINC000281287260	216212587	/nfs/dbraw/zinc/21/25/87/216212587.db2.gz	GTLNBITZTVPLCQ-HUUCEWRRSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c2c(c1)COCO2	ZINC000612134114	360928773	/nfs/dbraw/zinc/92/87/73/360928773.db2.gz	GSJRKLHXOVSRQX-LKTVYLICSA-N	1	1	320.345	1.664	20	5		DDBDMO
CC1(CO)CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000613043361	361251987	/nfs/dbraw/zinc/25/19/87/361251987.db2.gz	ZJZPTJQBVLKCIT-UHFFFAOYSA-N	1	1	322.361	1.960	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252418	363945852	/nfs/dbraw/zinc/94/58/52/363945852.db2.gz	KYKRSZAHBNJPOE-UWVGGRQHSA-N	1	1	313.354	1.915	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H](n3cc(CO)nn3)C2)c1	ZINC000293041671	223366854	/nfs/dbraw/zinc/36/68/54/223366854.db2.gz	SIFLOJPBDFODPC-OAHLLOKOSA-N	1	1	317.349	1.516	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](n3cc(CO)nn3)C2)c1	ZINC000293041671	223366856	/nfs/dbraw/zinc/36/68/56/223366856.db2.gz	SIFLOJPBDFODPC-OAHLLOKOSA-N	1	1	317.349	1.516	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](CC=Cc1ccccc1[N+](=O)[O-])C2	ZINC000274974940	212052204	/nfs/dbraw/zinc/05/22/04/212052204.db2.gz	WSHVOHGALCFBTK-HWKANZROSA-N	1	1	312.329	1.750	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCOc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000566458979	304160894	/nfs/dbraw/zinc/16/08/94/304160894.db2.gz	ZORIYEPEGZBEBZ-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000264641021	204047963	/nfs/dbraw/zinc/04/79/63/204047963.db2.gz	BWPBBGBLWYNIBY-NSHDSACASA-N	1	1	323.397	1.875	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)[C@H](C)C1	ZINC000288243903	220039427	/nfs/dbraw/zinc/03/94/27/220039427.db2.gz	DUBJXGUIZFLICF-CYBMUJFWSA-N	1	1	321.377	1.835	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)NCC(F)(F)F)c1ccccc1[N+](=O)[O-]	ZINC000266421459	205334351	/nfs/dbraw/zinc/33/43/51/205334351.db2.gz	ARLODDCNTPJGML-MRVPVSSYSA-N	1	1	305.256	1.924	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@H]([NH+]3CCCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000288490005	220175469	/nfs/dbraw/zinc/17/54/69/220175469.db2.gz	ROIRPQDEJWBKOD-GHMZBOCLSA-N	1	1	321.381	1.579	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1	ZINC000338889655	250183535	/nfs/dbraw/zinc/18/35/35/250183535.db2.gz	IIZARROGGLISIJ-UHFFFAOYSA-N	1	1	302.334	1.900	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000273764919	211038622	/nfs/dbraw/zinc/03/86/22/211038622.db2.gz	PSROXLNKMUHJPH-CQSZACIVSA-N	1	1	318.377	1.939	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1	ZINC000109849691	194294207	/nfs/dbraw/zinc/29/42/07/194294207.db2.gz	BGWMDYGRGUEWBB-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
CC[C@]1(C)COCC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871827	251253931	/nfs/dbraw/zinc/25/39/31/251253931.db2.gz	CXSDYYZHWCYEMM-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@]1(C)COCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000340871827	251253934	/nfs/dbraw/zinc/25/39/34/251253934.db2.gz	CXSDYYZHWCYEMM-GOEBONIOSA-N	1	1	324.377	1.835	20	5		DDBDMO
O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000340968971	251310105	/nfs/dbraw/zinc/31/01/05/251310105.db2.gz	DBCWWZJCCVILRK-LBPRGKRZSA-N	1	1	319.361	1.717	20	5		DDBDMO
CC[C@H]1C[N@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1O	ZINC000341004209	251330011	/nfs/dbraw/zinc/33/00/11/251330011.db2.gz	AMLIPNGNJFPAGQ-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1O	ZINC000341004209	251330013	/nfs/dbraw/zinc/33/00/13/251330013.db2.gz	AMLIPNGNJFPAGQ-FZMZJTMJSA-N	1	1	307.350	1.544	20	5		DDBDMO
COCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)CC1	ZINC000425007373	533092639	/nfs/dbraw/zinc/09/26/39/533092639.db2.gz	ZGYBFKBCNWYAMO-UHFFFAOYSA-N	1	1	324.381	1.116	20	5		DDBDMO
CC(C)C(=O)NCC[N@@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271152510	208663889	/nfs/dbraw/zinc/66/38/89/208663889.db2.gz	ITQUOXXUPVTEFU-CQSZACIVSA-N	1	1	309.366	1.332	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000186687422	285189518	/nfs/dbraw/zinc/18/95/18/285189518.db2.gz	BPXUSMKUXCGTKN-MRXNPFEDSA-N	1	1	314.345	1.923	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@H]1O	ZINC000352657976	285202531	/nfs/dbraw/zinc/20/25/31/285202531.db2.gz	CPNFMVGJLPMTBJ-QWHCGFSZSA-N	1	1	318.333	1.990	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C1CC1)[C@H]1CNCCO1	ZINC000422718202	533221909	/nfs/dbraw/zinc/22/19/09/533221909.db2.gz	PIEMKJNPXZSSRX-HZPDHXFCSA-N	1	1	321.377	1.460	20	5		DDBDMO
C[C@H](NC(=O)NCC(F)(F)C[NH3+])c1cccc([N+](=O)[O-])c1	ZINC000417128310	533630363	/nfs/dbraw/zinc/63/03/63/533630363.db2.gz	IAKYPRIMDMNACQ-QMMMGPOBSA-N	1	1	302.281	1.549	20	5		DDBDMO
C[C@@H](O)CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1	ZINC000353528655	285786856	/nfs/dbraw/zinc/78/68/56/285786856.db2.gz	OLRUYFITWCWUOA-BXUZGUMPSA-N	1	1	304.350	1.778	20	5		DDBDMO
Cc1ccc(C)c(S(=O)(=O)N(C)Cc2cnc[nH]2)c1[N+](=O)[O-]	ZINC000579733166	422827224	/nfs/dbraw/zinc/82/72/24/422827224.db2.gz	IRQHXZOBBYGCIP-UHFFFAOYSA-N	1	1	324.362	1.755	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCCC[NH+]2CCOCC2)c2nonc21	ZINC000015206722	406879545	/nfs/dbraw/zinc/87/95/45/406879545.db2.gz	AHEMIUVVYXNQKC-UHFFFAOYSA-N	1	1	307.310	1.265	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@@H+]2CCCC[C@@H]2CCO)c1	ZINC000071794361	406842370	/nfs/dbraw/zinc/84/23/70/406842370.db2.gz	CXIGFPVFGCSJGP-HIFRSBDPSA-N	1	1	324.377	1.571	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@@H]1CCCO1	ZINC000076299723	406962538	/nfs/dbraw/zinc/96/25/38/406962538.db2.gz	QBCZRMUIVXAVIG-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H]1CCCO1	ZINC000076299723	406962541	/nfs/dbraw/zinc/96/25/41/406962541.db2.gz	QBCZRMUIVXAVIG-ZDUSSCGKSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000078639874	407037189	/nfs/dbraw/zinc/03/71/89/407037189.db2.gz	DFXLLUPQKHTNFG-QMMMGPOBSA-N	1	1	306.771	1.771	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000066835224	407260147	/nfs/dbraw/zinc/26/01/47/407260147.db2.gz	XYORAEABXDJNPV-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000066835224	407260149	/nfs/dbraw/zinc/26/01/49/407260149.db2.gz	XYORAEABXDJNPV-NSHDSACASA-N	1	1	308.334	1.988	20	5		DDBDMO
C[C@]1(O)CCC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000123963508	407344170	/nfs/dbraw/zinc/34/41/70/407344170.db2.gz	KFCVBOGQZZBZII-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COC[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000265822722	407469182	/nfs/dbraw/zinc/46/91/82/407469182.db2.gz	SFFZMFDQGPCZGC-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
COc1cc(OCC(=O)N2CCC[N@@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000114675591	407596287	/nfs/dbraw/zinc/59/62/87/407596287.db2.gz	VPQHHLKEZMZNIL-UHFFFAOYSA-N	1	1	323.349	1.146	20	5		DDBDMO
CCOC(=O)C1(O)CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000266959743	407692237	/nfs/dbraw/zinc/69/22/37/407692237.db2.gz	WHFLTKSBKCPFMT-UHFFFAOYSA-N	1	1	308.334	1.485	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC1(CO)CC1	ZINC000186775444	407770370	/nfs/dbraw/zinc/77/03/70/407770370.db2.gz	WRJBQPODGKRFPX-UHFFFAOYSA-N	1	1	307.350	1.628	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000186844194	407783779	/nfs/dbraw/zinc/78/37/79/407783779.db2.gz	HDCBNFZNMDSCTB-GMXABZIVSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](O)[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000186844194	407783781	/nfs/dbraw/zinc/78/37/81/407783781.db2.gz	HDCBNFZNMDSCTB-GMXABZIVSA-N	1	1	321.377	1.933	20	5		DDBDMO
COc1ccc(-c2ccc(C[NH2+][C@H](C)C(N)=O)o2)c([N+](=O)[O-])c1	ZINC000237288630	407809182	/nfs/dbraw/zinc/80/91/82/407809182.db2.gz	RKESGYHKQZQBFS-SECBINFHSA-N	1	1	319.317	1.827	20	5		DDBDMO
C[C@@H]1CN(CCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000187727828	407883544	/nfs/dbraw/zinc/88/35/44/407883544.db2.gz	YGIRYTXGFJISRV-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000187727828	407883553	/nfs/dbraw/zinc/88/35/53/407883553.db2.gz	YGIRYTXGFJISRV-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCN1CCO	ZINC000187727828	407883557	/nfs/dbraw/zinc/88/35/57/407883557.db2.gz	YGIRYTXGFJISRV-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1C[N@@H+](C2CC2)C[C@@H]1C	ZINC000268278936	407982570	/nfs/dbraw/zinc/98/25/70/407982570.db2.gz	WUSBWOKCUIEELZ-GWCFXTLKSA-N	1	1	321.381	1.089	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)C1	ZINC000181663481	408025462	/nfs/dbraw/zinc/02/54/62/408025462.db2.gz	NLAFWVDQLQAKAA-SNVBAGLBSA-N	1	1	321.333	1.395	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000154747723	408078026	/nfs/dbraw/zinc/07/80/26/408078026.db2.gz	SAEWQPORRKZVSO-LLVKDONJSA-N	1	1	314.345	1.967	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000175250752	408088263	/nfs/dbraw/zinc/08/82/63/408088263.db2.gz	UGQAPVYUGKRRDD-GFCCVEGCSA-N	1	1	307.350	1.561	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CC1(O)CCOCC1	ZINC000189776713	408103000	/nfs/dbraw/zinc/10/30/00/408103000.db2.gz	LZXWVSHQXPBYRN-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
CN(C(=O)CNc1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000151100540	408255851	/nfs/dbraw/zinc/25/58/51/408255851.db2.gz	YPRSQQCYOKACRS-LBPRGKRZSA-N	1	1	306.366	1.559	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000246284900	408203606	/nfs/dbraw/zinc/20/36/06/408203606.db2.gz	XESUDVFLGSKCDT-GHMZBOCLSA-N	1	1	322.365	1.236	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269328125	408270021	/nfs/dbraw/zinc/27/00/21/408270021.db2.gz	DMSYRUHWKIRJJX-QWRGUYRKSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCC[N@@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269328125	408270026	/nfs/dbraw/zinc/27/00/26/408270026.db2.gz	DMSYRUHWKIRJJX-QWRGUYRKSA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c1[N+](=O)[O-]	ZINC000269328125	408270032	/nfs/dbraw/zinc/27/00/32/408270032.db2.gz	DMSYRUHWKIRJJX-QWRGUYRKSA-N	1	1	321.381	1.750	20	5		DDBDMO
O=C(NCC1CC1)[C@@H]1CCC[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000176210438	408309269	/nfs/dbraw/zinc/30/92/69/408309269.db2.gz	SIZWUWPDOLROML-CYBMUJFWSA-N	1	1	321.381	1.030	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCn3ccc([N+](=O)[O-])n3)[C@H]2C1	ZINC000246908159	408364795	/nfs/dbraw/zinc/36/47/95/408364795.db2.gz	RPYCQNDTIORNGG-FRRDWIJNSA-N	1	1	310.354	1.060	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)[C@H]2C1	ZINC000246908159	408364801	/nfs/dbraw/zinc/36/48/01/408364801.db2.gz	RPYCQNDTIORNGG-FRRDWIJNSA-N	1	1	310.354	1.060	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000270414113	408526475	/nfs/dbraw/zinc/52/64/75/408526475.db2.gz	SCHDRSYYDYRGBY-OAHLLOKOSA-N	1	1	320.393	1.921	20	5		DDBDMO
CC(C)C[C@@]1(CO)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000191666485	408468002	/nfs/dbraw/zinc/46/80/02/408468002.db2.gz	OYQCLZHTIPLASC-MRXNPFEDSA-N	1	1	323.393	1.630	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000247410647	408468907	/nfs/dbraw/zinc/46/89/07/408468907.db2.gz	NFQPZUUGNMGDEL-TZMCWYRMSA-N	1	1	305.378	1.936	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)C[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000264680832	408544603	/nfs/dbraw/zinc/54/46/03/408544603.db2.gz	PFOULJVORCDCCB-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@H]2CC[N@H+](C)C2)c1[N+](=O)[O-]	ZINC000264680832	408544605	/nfs/dbraw/zinc/54/46/05/408544605.db2.gz	PFOULJVORCDCCB-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C[C@H]2CC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000264680832	408544610	/nfs/dbraw/zinc/54/46/10/408544610.db2.gz	PFOULJVORCDCCB-JTQLQIEISA-N	1	1	309.370	1.294	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@@H](N3CCCC3=O)C2)cc1[N+](=O)[O-]	ZINC000270492124	408550749	/nfs/dbraw/zinc/55/07/49/408550749.db2.gz	ATWDHSSXBDMVHX-CYBMUJFWSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](N3CCCC3=O)C2)cc1[N+](=O)[O-]	ZINC000270492124	408550753	/nfs/dbraw/zinc/55/07/53/408550753.db2.gz	ATWDHSSXBDMVHX-CYBMUJFWSA-N	1	1	319.361	1.800	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2ccncc2)c1	ZINC000270544555	408572845	/nfs/dbraw/zinc/57/28/45/408572845.db2.gz	MBWJOXNFVCFQGS-HUUCEWRRSA-N	1	1	317.349	1.384	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000184229433	408572939	/nfs/dbraw/zinc/57/29/39/408572939.db2.gz	PLGXTWGVGPYFOX-SECBINFHSA-N	1	1	313.329	1.556	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C[C@H]1CCCO1	ZINC000248478435	408577571	/nfs/dbraw/zinc/57/75/71/408577571.db2.gz	ZGOFVNJCMWRHLN-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
COC[C@H](C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000265204225	408578671	/nfs/dbraw/zinc/57/86/71/408578671.db2.gz	UKCIPGSZZPPZPX-LBPRGKRZSA-N	1	1	307.350	1.388	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@@H+]1CCOC	ZINC000265319938	408613086	/nfs/dbraw/zinc/61/30/86/408613086.db2.gz	KNMQHKBVAIBYQP-NSHDSACASA-N	1	1	311.338	1.371	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])o2)CC[N@H+]1CCOC	ZINC000265319938	408613092	/nfs/dbraw/zinc/61/30/92/408613092.db2.gz	KNMQHKBVAIBYQP-NSHDSACASA-N	1	1	311.338	1.371	20	5		DDBDMO
CC(C)[C@@H](CNc1cc(N)ccc1[N+](=O)[O-])[NH+]1CCOCC1	ZINC000192772068	408643735	/nfs/dbraw/zinc/64/37/35/408643735.db2.gz	VAXRZWNHCYKEPM-OAHLLOKOSA-N	1	1	308.382	1.946	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000270872995	408720251	/nfs/dbraw/zinc/72/02/51/408720251.db2.gz	JLEMJKCGSARHGN-ZDUSSCGKSA-N	1	1	319.361	1.670	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CN1CC[N@@H+](C[C@H](C)O)C[C@H]1C	ZINC000249507528	408733633	/nfs/dbraw/zinc/73/36/33/408733633.db2.gz	LKVRLXFUBPWPED-OLZOCXBDSA-N	1	1	323.393	1.490	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000185338656	408797996	/nfs/dbraw/zinc/79/79/96/408797996.db2.gz	XDZFPCKEJOJPDB-UHFFFAOYSA-N	1	1	310.354	1.339	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc(OC)c1[N+](=O)[O-]	ZINC000168307105	408818711	/nfs/dbraw/zinc/81/87/11/408818711.db2.gz	NDYSOTJPMMEURY-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])n[nH]2)C1	ZINC000285912850	408887058	/nfs/dbraw/zinc/88/70/58/408887058.db2.gz	ZECFFXYIXNLSNO-LLVKDONJSA-N	1	1	309.370	1.416	20	5		DDBDMO
C[N@H+]1CCN(CCNC(=O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000281718686	408916464	/nfs/dbraw/zinc/91/64/64/408916464.db2.gz	IINPGMVVBFWKGN-UHFFFAOYSA-N	1	1	320.393	1.351	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1[C@@H](C)C[NH+](C)C[C@@H]1C	ZINC000277362801	408926372	/nfs/dbraw/zinc/92/63/72/408926372.db2.gz	CKBMXQOAIOQJFW-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)NCCF	ZINC000281832928	408937489	/nfs/dbraw/zinc/93/74/89/408937489.db2.gz	ABQWWGSZXURJNI-MRVPVSSYSA-N	1	1	303.721	1.812	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+](C)C2CC2)n1	ZINC000286332328	408965219	/nfs/dbraw/zinc/96/52/19/408965219.db2.gz	BKJHXSYMOLICTC-SECBINFHSA-N	1	1	308.338	1.671	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)C1	ZINC000292078771	408975516	/nfs/dbraw/zinc/97/55/16/408975516.db2.gz	FLJCKMZLTQYALI-HOTGVXAUSA-N	1	1	305.378	1.656	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000277613994	408977679	/nfs/dbraw/zinc/97/76/79/408977679.db2.gz	BBEMLJBQTNVZGQ-UHFFFAOYSA-N	1	1	320.353	1.222	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286447334	408986904	/nfs/dbraw/zinc/98/69/04/408986904.db2.gz	JQPMKXHCGYSHGD-LERXQTSPSA-N	1	1	307.350	1.767	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ncnc2sc([N+](=O)[O-])cc21	ZINC000287304866	409016565	/nfs/dbraw/zinc/01/65/65/409016565.db2.gz	LOEOOZAHOHWQPG-SECBINFHSA-N	1	1	322.394	1.257	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000277895385	409030209	/nfs/dbraw/zinc/03/02/09/409030209.db2.gz	GDRCOEPNCLMJOQ-SNVBAGLBSA-N	1	1	309.370	1.483	20	5		DDBDMO
CC(C)[C@]1(CO)CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000293241511	409074357	/nfs/dbraw/zinc/07/43/57/409074357.db2.gz	YYSOWAHRKPNYKB-MRXNPFEDSA-N	1	1	323.393	1.487	20	5		DDBDMO
COCCO[C@@H]1C[C@@H](CO)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000278398491	409080393	/nfs/dbraw/zinc/08/03/93/409080393.db2.gz	WCFCSRITTLIYLB-GDBMZVCRSA-N	1	1	324.377	1.441	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@@H]([N@@H+](C)CCO)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000293797181	409181879	/nfs/dbraw/zinc/18/18/79/409181879.db2.gz	XXOOKENUVQHEKS-IUODEOHRSA-N	1	1	321.377	1.430	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000294017886	409226484	/nfs/dbraw/zinc/22/64/84/409226484.db2.gz	QGVSHFHNWMBGGZ-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000294017886	409226488	/nfs/dbraw/zinc/22/64/88/409226488.db2.gz	QGVSHFHNWMBGGZ-AOOOYVTPSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[C@@H]1CN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293926784	409207924	/nfs/dbraw/zinc/20/79/24/409207924.db2.gz	HNJXYKXBBJMSCP-TXEJJXNPSA-N	1	1	306.366	1.558	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC[C@@](C)(O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000280275886	409283122	/nfs/dbraw/zinc/28/31/22/409283122.db2.gz	YNEVBANIAGAOLW-MRXNPFEDSA-N	1	1	321.377	1.795	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCCO[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000295083734	409315798	/nfs/dbraw/zinc/31/57/98/409315798.db2.gz	RMVOBGIQMXOMLI-NSHDSACASA-N	1	1	309.370	1.606	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](C)[C@H](C)C2)n1	ZINC000319187105	164034880	/nfs/dbraw/zinc/03/48/80/164034880.db2.gz	OSBAEQIEXGKSQB-NXEZZACHSA-N	1	1	308.338	1.671	20	5		DDBDMO
COC(=O)c1cc(OC[C@H](O)C[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000290750587	409508418	/nfs/dbraw/zinc/50/84/18/409508418.db2.gz	ISCFUJJJPHANIL-LLVKDONJSA-N	1	1	324.333	1.215	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000342452882	409643158	/nfs/dbraw/zinc/64/31/58/409643158.db2.gz	QPLOYVQMBSLFLY-DGCLKSJQSA-N	1	1	319.361	1.573	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000356835252	409646629	/nfs/dbraw/zinc/64/66/29/409646629.db2.gz	BLKAMKFRESEIQY-NWDGAFQWSA-N	1	1	307.350	1.525	20	5		DDBDMO
COc1cc(C[N@H+](C)[C@H](C)C[S@@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630490	409775331	/nfs/dbraw/zinc/77/53/31/409775331.db2.gz	FKWJIRCJPGGSPN-CFMSYZGJSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H](C)C[S@@](C)=O)ccc1[N+](=O)[O-]	ZINC000342630490	409775338	/nfs/dbraw/zinc/77/53/38/409775338.db2.gz	FKWJIRCJPGGSPN-CFMSYZGJSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412982	409826137	/nfs/dbraw/zinc/82/61/37/409826137.db2.gz	ZMTAPUSKLHXABR-GWCFXTLKSA-N	1	1	310.350	1.815	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](C)[C@@H](O)C2)c([N+](=O)[O-])cc1OC	ZINC000349412982	409826144	/nfs/dbraw/zinc/82/61/44/409826144.db2.gz	ZMTAPUSKLHXABR-GWCFXTLKSA-N	1	1	310.350	1.815	20	5		DDBDMO
Cc1[nH+]ccn1CCN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000342658783	409796172	/nfs/dbraw/zinc/79/61/72/409796172.db2.gz	CTTLCRUIPXHELP-UHFFFAOYSA-N	1	1	300.274	1.396	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000346319630	409913949	/nfs/dbraw/zinc/91/39/49/409913949.db2.gz	CMGLOKKIDHYPHZ-JKOKRWQUSA-N	1	1	322.361	1.815	20	5		DDBDMO
C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H]1CCS(=O)(=O)C1	ZINC000354450204	409865613	/nfs/dbraw/zinc/86/56/13/409865613.db2.gz	JXTMVVOUERYFPW-CYBMUJFWSA-N	1	1	312.391	1.504	20	5		DDBDMO
CCC(=O)N[C@H]1CCC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000354675092	410009172	/nfs/dbraw/zinc/00/91/72/410009172.db2.gz	GLSKJLTUEUKKIY-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
CCC(=O)N[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000354675092	410009181	/nfs/dbraw/zinc/00/91/81/410009181.db2.gz	GLSKJLTUEUKKIY-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)c1ccccc1[N+](=O)[O-]	ZINC000571396121	304458373	/nfs/dbraw/zinc/45/83/73/304458373.db2.gz	FCYKVIXEEOATOX-ZDUSSCGKSA-N	1	1	315.333	1.115	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)CC[N@H+]1C	ZINC000332695036	410218005	/nfs/dbraw/zinc/21/80/05/410218005.db2.gz	RJERJTBNEAAPTB-ONGXEEELSA-N	1	1	321.333	1.536	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@@H+]1C[C@@H](C)[C@H](O)C1	ZINC000351817062	410259272	/nfs/dbraw/zinc/25/92/72/410259272.db2.gz	UEMHOAMURUYANV-GBIKHYSHSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)[N@H+]1C[C@@H](C)[C@H](O)C1	ZINC000351817062	410259280	/nfs/dbraw/zinc/25/92/80/410259280.db2.gz	UEMHOAMURUYANV-GBIKHYSHSA-N	1	1	323.349	1.243	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@@H+](C)C2(CO)CC2)c([N+](=O)[O-])c1	ZINC000298571327	410293926	/nfs/dbraw/zinc/29/39/26/410293926.db2.gz	QIBDNNVVSNBAOP-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@H]1CO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000298784507	410397701	/nfs/dbraw/zinc/39/77/01/410397701.db2.gz	YQRNYRNHFXQZCG-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@H]1CO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000298784507	410397707	/nfs/dbraw/zinc/39/77/07/410397707.db2.gz	YQRNYRNHFXQZCG-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000343463244	410475003	/nfs/dbraw/zinc/47/50/03/410475003.db2.gz	UPHOZFAEEILLOA-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1	ZINC000358295507	410441893	/nfs/dbraw/zinc/44/18/93/410441893.db2.gz	BRBMLXOIMXDKGO-ZDUSSCGKSA-N	1	1	317.292	1.675	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000343525034	410508762	/nfs/dbraw/zinc/50/87/62/410508762.db2.gz	LSZZEVSEIMJNMJ-JQWIXIFHSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000299247952	410582927	/nfs/dbraw/zinc/58/29/27/410582927.db2.gz	XWNOFEASLYBYQX-LBPRGKRZSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CCC[N@@H+]1C	ZINC000299247952	410582932	/nfs/dbraw/zinc/58/29/32/410582932.db2.gz	XWNOFEASLYBYQX-LBPRGKRZSA-N	1	1	313.379	1.276	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000340088159	410665828	/nfs/dbraw/zinc/66/58/28/410665828.db2.gz	IOHJJXLZKQLDTC-CYBMUJFWSA-N	1	1	318.377	1.673	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[NH+](C2CC2)CC1	ZINC000301080538	410653029	/nfs/dbraw/zinc/65/30/29/410653029.db2.gz	HSDQTQFFXUSHRC-UHFFFAOYSA-N	1	1	304.350	1.239	20	5		DDBDMO
C[N@H+]1CCC[C@H](N2CCN(c3ncccc3[N+](=O)[O-])CC2)C1	ZINC000301301643	410695157	/nfs/dbraw/zinc/69/51/57/410695157.db2.gz	RKKUVLFDLJKLEJ-ZDUSSCGKSA-N	1	1	305.382	1.206	20	5		DDBDMO
Cc1ccnc(N2CCC[N@H+](C3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000301369505	410709183	/nfs/dbraw/zinc/70/91/83/410709183.db2.gz	PHWXIJMHWHXBOX-UHFFFAOYSA-N	1	1	320.393	1.989	20	5		DDBDMO
CC[C@@H](C)[NH2+][C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccco1	ZINC000359533384	410713748	/nfs/dbraw/zinc/71/37/48/410713748.db2.gz	AFCSYKBEFBUAQV-ZJUUUORDSA-N	1	1	321.337	1.770	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@@H](C)[N@H+](C)C[C@H]1C	ZINC000330575841	410792185	/nfs/dbraw/zinc/79/21/85/410792185.db2.gz	GEEHLZVIRMOIPO-CHWSQXEVSA-N	1	1	320.393	1.866	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000330597690	410810744	/nfs/dbraw/zinc/81/07/44/410810744.db2.gz	SJQMLWYEKVHNTN-VXGBXAGGSA-N	1	1	307.350	1.525	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1	ZINC000330607323	410820568	/nfs/dbraw/zinc/82/05/68/410820568.db2.gz	LMRNKWVMHAOSGO-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1	ZINC000330607323	410820577	/nfs/dbraw/zinc/82/05/77/410820577.db2.gz	LMRNKWVMHAOSGO-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000330836109	410896341	/nfs/dbraw/zinc/89/63/41/410896341.db2.gz	KMIAPKLTJKLNKR-DYEKYZERSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000330836108	410897106	/nfs/dbraw/zinc/89/71/06/410897106.db2.gz	KMIAPKLTJKLNKR-BZPMIXESSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000344117206	410966323	/nfs/dbraw/zinc/96/63/23/410966323.db2.gz	BLLUILYXXDOUDF-UMVBOHGHSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000344349939	411095021	/nfs/dbraw/zinc/09/50/21/411095021.db2.gz	KXMLGWSCCXMGLC-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000344349939	411095024	/nfs/dbraw/zinc/09/50/24/411095024.db2.gz	KXMLGWSCCXMGLC-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@H]2CCc3[nH+]ccn3C2)n1	ZINC000350892675	306758894	/nfs/dbraw/zinc/75/88/94/306758894.db2.gz	SYIQOZSEFWCPNU-QMMMGPOBSA-N	1	1	315.293	1.305	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+](CCO)[C@@H](C)C1	ZINC000188823663	222028792	/nfs/dbraw/zinc/02/87/92/222028792.db2.gz	XUBNRWRDDRFULA-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@@H+](CCO)[C@@H](C)C1	ZINC000188823663	222028794	/nfs/dbraw/zinc/02/87/94/222028794.db2.gz	XUBNRWRDDRFULA-LBPRGKRZSA-N	1	1	322.365	1.434	20	5		DDBDMO
C[C@H]1CCOCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000374992224	418585371	/nfs/dbraw/zinc/58/53/71/418585371.db2.gz	WLEHDDKDNVWDMB-JSGCOSHPSA-N	1	1	310.350	1.445	20	5		DDBDMO
CO[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000361355984	418633368	/nfs/dbraw/zinc/63/33/68/418633368.db2.gz	KHLMITUNAQEBIN-GFCCVEGCSA-N	1	1	304.306	1.866	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000361355984	418633370	/nfs/dbraw/zinc/63/33/70/418633370.db2.gz	KHLMITUNAQEBIN-GFCCVEGCSA-N	1	1	304.306	1.866	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCOC1	ZINC000361579495	418684788	/nfs/dbraw/zinc/68/47/88/418684788.db2.gz	WFJRXQIQUXCZLL-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCOC1	ZINC000361579495	418684790	/nfs/dbraw/zinc/68/47/90/418684790.db2.gz	WFJRXQIQUXCZLL-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](Cc3ccncc3)C2)c1	ZINC000368138690	418695188	/nfs/dbraw/zinc/69/51/88/418695188.db2.gz	KJLVTPWBKGNQCR-CQSZACIVSA-N	1	1	301.350	1.751	20	5		DDBDMO
[NH3+]C[C@@H]1CC[C@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000382486475	418731288	/nfs/dbraw/zinc/73/12/88/418731288.db2.gz	GTGOHOPRRAUTAQ-BDAKNGLRSA-N	1	1	317.342	1.140	20	5		DDBDMO
C[C@@H]1[C@H](C)N(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000411430315	418904221	/nfs/dbraw/zinc/90/42/21/418904221.db2.gz	OALBNPRODBTTJM-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000411430315	418904225	/nfs/dbraw/zinc/90/42/25/418904225.db2.gz	OALBNPRODBTTJM-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000411430315	418904226	/nfs/dbraw/zinc/90/42/26/418904226.db2.gz	OALBNPRODBTTJM-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(CC[N@@H+]1CCCC[C@@H]1CO)Nc1ccc([N+](=O)[O-])cc1	ZINC000411167300	418876065	/nfs/dbraw/zinc/87/60/65/418876065.db2.gz	NXBMBFKVQNSPNS-CQSZACIVSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](O)C[C@@H]1C	ZINC000411413825	418901483	/nfs/dbraw/zinc/90/14/83/418901483.db2.gz	AONLDTWRLPHYJY-CMPLNLGQSA-N	1	1	323.349	1.387	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000417859244	419357006	/nfs/dbraw/zinc/35/70/06/419357006.db2.gz	VWFCIRVJWGHFEV-VIFPVBQESA-N	1	1	316.308	1.857	20	5		DDBDMO
COC[C@@H]1C[C@H](O)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411914999	419484407	/nfs/dbraw/zinc/48/44/07/419484407.db2.gz	VLCKHGDNBKUVJI-KBPBESRZSA-N	1	1	323.349	1.005	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000427597694	419691668	/nfs/dbraw/zinc/69/16/68/419691668.db2.gz	XIMOIRKXSVPUJC-CYBMUJFWSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NC[C@@H]([NH3+])C1CC1	ZINC000414884731	419858173	/nfs/dbraw/zinc/85/81/73/419858173.db2.gz	FZHOVYGFGKOITK-IINYFYTJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@@H](N)C1CC1	ZINC000414884731	419858180	/nfs/dbraw/zinc/85/81/80/419858180.db2.gz	FZHOVYGFGKOITK-IINYFYTJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(Cc2c([N+](=O)[O-])ncn2C)C[C@@H](C)C1	ZINC000429005575	419961362	/nfs/dbraw/zinc/96/13/62/419961362.db2.gz	MNMRJNRJCPYETF-FRRDWIJNSA-N	1	1	307.398	1.490	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(NC(N)=O)CC1	ZINC000430200878	420090867	/nfs/dbraw/zinc/09/08/67/420090867.db2.gz	BEPLPRALZSHDBY-UHFFFAOYSA-N	1	1	308.338	1.236	20	5		DDBDMO
C[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CN	ZINC000420290195	420185089	/nfs/dbraw/zinc/18/50/89/420185089.db2.gz	LMSPBEDFMLCXRQ-SWLSCSKDSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1CN	ZINC000420290195	420185091	/nfs/dbraw/zinc/18/50/91/420185091.db2.gz	LMSPBEDFMLCXRQ-SWLSCSKDSA-N	1	1	320.393	1.983	20	5		DDBDMO
CCC[C@@H]1CNCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420308702	420195560	/nfs/dbraw/zinc/19/55/60/420195560.db2.gz	NWWKLTRLBDYFCK-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
CCC[C@@H]1CNCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420308702	420195564	/nfs/dbraw/zinc/19/55/64/420195564.db2.gz	NWWKLTRLBDYFCK-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](CN)C1CC1	ZINC000420312958	420201087	/nfs/dbraw/zinc/20/10/87/420201087.db2.gz	JHWRWCLHTCGQOY-CQSZACIVSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](CN)C1CC1	ZINC000420312958	420201091	/nfs/dbraw/zinc/20/10/91/420201091.db2.gz	JHWRWCLHTCGQOY-CQSZACIVSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1[NH3+]	ZINC000430940741	420215244	/nfs/dbraw/zinc/21/52/44/420215244.db2.gz	QVIWFIOZHAPQQT-NEPJUHHUSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000420391298	420257838	/nfs/dbraw/zinc/25/78/38/420257838.db2.gz	RXRKDVFVJUGOAQ-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@H]([NH3+])[C@H](C)C1	ZINC000430946077	420218486	/nfs/dbraw/zinc/21/84/86/420218486.db2.gz	YYXIOKUZANYTAX-OCCSQVGLSA-N	1	1	320.393	1.901	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H](C)[C@@H](C[NH3+])C2)c1[N+](=O)[O-]	ZINC000424015910	420306692	/nfs/dbraw/zinc/30/66/92/420306692.db2.gz	NIMYRURNZZBLPF-UWVGGRQHSA-N	1	1	309.370	1.327	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000420590583	420325472	/nfs/dbraw/zinc/32/54/72/420325472.db2.gz	VUFNGXOBNLBSIO-GHMZBOCLSA-N	1	1	304.350	1.732	20	5		DDBDMO
COC(=O)c1cnc(N(C)C[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000420643887	420340482	/nfs/dbraw/zinc/34/04/82/420340482.db2.gz	XPYUJPGSWOFAHT-NSHDSACASA-N	1	1	308.338	1.307	20	5		DDBDMO
Cc1cc(N2CC[N@H+](CC(C)(C)O)C[C@H]2C)ncc1[N+](=O)[O-]	ZINC000302521283	230281686	/nfs/dbraw/zinc/28/16/86/230281686.db2.gz	ITVOOOVPJJDDQT-GFCCVEGCSA-N	1	1	308.382	1.580	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1	ZINC000492384913	420541743	/nfs/dbraw/zinc/54/17/43/420541743.db2.gz	HBKMBITUWLKJSG-WAYWQWQTSA-N	1	1	301.346	1.986	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000456980610	420580419	/nfs/dbraw/zinc/58/04/19/420580419.db2.gz	DDCGZWPXJZWXSV-CYBMUJFWSA-N	1	1	300.318	1.710	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@H](O)C[C@H]1[C@H]1CCCOC1	ZINC000451300862	420596895	/nfs/dbraw/zinc/59/68/95/420596895.db2.gz	MREMEGJMKQVKRJ-LZWOXQAQSA-N	1	1	306.362	1.957	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000457118799	420620979	/nfs/dbraw/zinc/62/09/79/420620979.db2.gz	KKAHNYYGONKDKC-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000457118799	420620985	/nfs/dbraw/zinc/62/09/85/420620985.db2.gz	KKAHNYYGONKDKC-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1	ZINC000457132384	420625869	/nfs/dbraw/zinc/62/58/69/420625869.db2.gz	USURNMVGDSNVIK-LBPRGKRZSA-N	1	1	306.366	1.853	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)CCN1C(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000492988043	420728820	/nfs/dbraw/zinc/72/88/20/420728820.db2.gz	NPYRFTZVECOGRS-KTRBRXNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1C(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000492988043	420728823	/nfs/dbraw/zinc/72/88/23/420728823.db2.gz	NPYRFTZVECOGRS-KTRBRXNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@](O)(CO)C1	ZINC000459727657	420858078	/nfs/dbraw/zinc/85/80/78/420858078.db2.gz	RADGWICRIFVNAM-LPDYGMJQSA-N	1	1	306.362	1.817	20	5		DDBDMO
CC(C)[C@H]1CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000488012769	421062511	/nfs/dbraw/zinc/06/25/11/421062511.db2.gz	UYKPOJNDOMZEAV-OAHLLOKOSA-N	1	1	320.393	1.466	20	5		DDBDMO
CC[C@H]1CN(c2ccc([N+](=O)[O-])nc2)C[C@H]1[NH+]1CCOCC1	ZINC000450397523	421193189	/nfs/dbraw/zinc/19/31/89/421193189.db2.gz	VWFKRBWZRARDEF-GXTWGEPZSA-N	1	1	306.366	1.537	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000516904002	421577001	/nfs/dbraw/zinc/57/70/01/421577001.db2.gz	BFYAJTZEOLLNLS-CYBMUJFWSA-N	1	1	321.377	1.489	20	5		DDBDMO
CCC[C@H](NCC(=O)N1CC[NH2+]CC1)c1cccc([N+](=O)[O-])c1	ZINC000573108296	421921055	/nfs/dbraw/zinc/92/10/55/421921055.db2.gz	LOXHRAFSTVPWFX-HNNXBMFYSA-N	1	1	320.393	1.457	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000574782371	422180715	/nfs/dbraw/zinc/18/07/15/422180715.db2.gz	DVJOWUYVBRGFAB-LBPRGKRZSA-N	1	1	323.397	1.758	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000576885955	422380061	/nfs/dbraw/zinc/38/00/61/422380061.db2.gz	MQGQAFACXBGIQV-LLVKDONJSA-N	1	1	321.381	1.376	20	5		DDBDMO
CC[C@@]1(O)CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000602983367	422441012	/nfs/dbraw/zinc/44/10/12/422441012.db2.gz	IWZIWTXEPXHMNH-CZUORRHYSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1ccnc(N)c1[N+](=O)[O-])C1CC1	ZINC000577745450	422418941	/nfs/dbraw/zinc/41/89/41/422418941.db2.gz	KCFGGBBTZAJTIS-UHFFFAOYSA-N	1	1	307.354	1.176	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589561	422602493	/nfs/dbraw/zinc/60/24/93/422602493.db2.gz	ZVUCRLSZDBDBCQ-ZFWWWQNUSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589561	422602501	/nfs/dbraw/zinc/60/25/01/422602501.db2.gz	ZVUCRLSZDBDBCQ-ZFWWWQNUSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@H]1CN(C)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000578589561	422602506	/nfs/dbraw/zinc/60/25/06/422602506.db2.gz	ZVUCRLSZDBDBCQ-ZFWWWQNUSA-N	1	1	323.393	1.361	20	5		DDBDMO
Cn1c(C(=O)Nc2c[nH+]ccc2-n2cccn2)ccc1[N+](=O)[O-]	ZINC000337643839	271038356	/nfs/dbraw/zinc/03/83/56/271038356.db2.gz	WMOOWQZBBHXLIT-UHFFFAOYSA-N	1	1	312.289	1.766	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2nc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000341934864	271251740	/nfs/dbraw/zinc/25/17/40/271251740.db2.gz	YCWAQMNBLZTNBF-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@@]23CCOC3)c1	ZINC000341978025	271265384	/nfs/dbraw/zinc/26/53/84/271265384.db2.gz	XFMBTZBXLBURAG-HOCLYGCPSA-N	1	1	322.361	1.589	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCCC[C@H]2CCO)c([N+](=O)[O-])c1	ZINC000342074446	271291021	/nfs/dbraw/zinc/29/10/21/271291021.db2.gz	XEZPBTHPHPACLH-AWEZNQCLSA-N	1	1	321.377	1.821	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2C)[C@@H](C)C1	ZINC000344426752	272023096	/nfs/dbraw/zinc/02/30/96/272023096.db2.gz	PUJQHSUKLGSAPL-PHIMTYICSA-N	1	1	306.366	1.853	20	5		DDBDMO
CCOCC[NH+]1CCN(c2cc(OC)ccc2[N+](=O)[O-])CC1	ZINC000266388549	273699377	/nfs/dbraw/zinc/69/93/77/273699377.db2.gz	NTTOOYNFQZVLNK-UHFFFAOYSA-N	1	1	309.366	1.762	20	5		DDBDMO
COCC[NH+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1	ZINC000112073257	274031008	/nfs/dbraw/zinc/03/10/08/274031008.db2.gz	NAMHODRDIBUVCJ-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[NH+](C[C@H](C)O)CC2)c1	ZINC000302482888	274095973	/nfs/dbraw/zinc/09/59/73/274095973.db2.gz	XZXSAQXZUOEVJQ-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[NH+](C[C@@H](C)O)CC2)c1	ZINC000302569096	274096002	/nfs/dbraw/zinc/09/60/02/274096002.db2.gz	XZXSAQXZUOEVJQ-SNVBAGLBSA-N	1	1	313.329	1.245	20	5		DDBDMO
C[N@H+]1CCC[C@]2(CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C2)C1	ZINC000292664754	277087262	/nfs/dbraw/zinc/08/72/62/277087262.db2.gz	CSDOWAYRXXZSDI-INIZCTEOSA-N	1	1	318.377	1.616	20	5		DDBDMO
CC[C@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OC	ZINC000419289658	280826797	/nfs/dbraw/zinc/82/67/97/280826797.db2.gz	QXNOUSOOAUKWLD-CYBMUJFWSA-N	1	1	321.377	1.778	20	5		DDBDMO
O=[N+]([O-])c1ccc(CSC[C@H](O)C[NH+]2CCOCC2)cc1	ZINC000128868375	281325019	/nfs/dbraw/zinc/32/50/19/281325019.db2.gz	XTFXXWFCGXTSOG-CQSZACIVSA-N	1	1	312.391	1.521	20	5		DDBDMO
O=C1C[NH2+]CCN1[C@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1	ZINC000362699972	300117886	/nfs/dbraw/zinc/11/78/86/300117886.db2.gz	XFEUHDOGPQCDLV-LBPRGKRZSA-N	1	1	324.406	1.053	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000362718787	300122407	/nfs/dbraw/zinc/12/24/07/300122407.db2.gz	BJRFOMPVGFFEQN-STQMWFEESA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@H]2CO1)c1ccccc1[N+](=O)[O-]	ZINC000362718787	300122409	/nfs/dbraw/zinc/12/24/09/300122409.db2.gz	BJRFOMPVGFFEQN-STQMWFEESA-N	1	1	319.361	1.578	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000362982493	300193726	/nfs/dbraw/zinc/19/37/26/300193726.db2.gz	MEEQCJVGNRZGER-ZWNOBZJWSA-N	1	1	304.350	1.072	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000363265557	300241751	/nfs/dbraw/zinc/24/17/51/300241751.db2.gz	FYFAKBOAEKPFSW-CABCVRRESA-N	1	1	319.361	1.117	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000364209511	300357127	/nfs/dbraw/zinc/35/71/27/300357127.db2.gz	BRJBKHCNFVXUJK-ZDUSSCGKSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CCC[C@H]2c2nccs2)c1	ZINC000368404319	301019969	/nfs/dbraw/zinc/01/99/69/301019969.db2.gz	LIHNCFGZVNSCLG-RYUDHWBXSA-N	1	1	323.378	1.446	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2c2nccs2)c1	ZINC000368404319	301019971	/nfs/dbraw/zinc/01/99/71/301019971.db2.gz	LIHNCFGZVNSCLG-RYUDHWBXSA-N	1	1	323.378	1.446	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000368587931	301058952	/nfs/dbraw/zinc/05/89/52/301058952.db2.gz	BUQQVMYWXKYPHJ-JSGCOSHPSA-N	1	1	319.361	1.526	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000369143535	301136654	/nfs/dbraw/zinc/13/66/54/301136654.db2.gz	KWOZVDDEPSBEQC-UWVGGRQHSA-N	1	1	307.354	1.237	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2[N+](=O)[O-])C1	ZINC000369709207	301215206	/nfs/dbraw/zinc/21/52/06/301215206.db2.gz	CHJBGEOSVBZVHU-ILXRZTDVSA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000369709207	301215208	/nfs/dbraw/zinc/21/52/08/301215208.db2.gz	CHJBGEOSVBZVHU-ILXRZTDVSA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)[C@H]2CC2[N+](=O)[O-])C1	ZINC000369709207	301215209	/nfs/dbraw/zinc/21/52/09/301215209.db2.gz	CHJBGEOSVBZVHU-ILXRZTDVSA-N	1	1	303.362	1.385	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000363646008	307032476	/nfs/dbraw/zinc/03/24/76/307032476.db2.gz	SWLWDCXQIQJUSK-UHFFFAOYSA-N	1	1	306.366	1.735	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000530869160	303217886	/nfs/dbraw/zinc/21/78/86/303217886.db2.gz	OCYFRNAJURALEO-UHFFFAOYSA-N	1	1	309.414	1.881	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000531804457	303257760	/nfs/dbraw/zinc/25/77/60/303257760.db2.gz	ZPGCKLGGYGKRCB-IAQYHMDHSA-N	1	1	318.377	1.877	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1	ZINC000531912028	303265693	/nfs/dbraw/zinc/26/56/93/303265693.db2.gz	QPXMKRKSUVLUTE-VXGBXAGGSA-N	1	1	309.370	1.384	20	5		DDBDMO
CN1CCC[C@H]([NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)C1=O	ZINC000558442028	303770817	/nfs/dbraw/zinc/77/08/17/303770817.db2.gz	JNUBDDSWTMBTNH-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@]1(O)CC[N@H+](C)C1	ZINC000361854987	307009101	/nfs/dbraw/zinc/00/91/01/307009101.db2.gz	MWMIWJBCSQSZPP-OAHLLOKOSA-N	1	1	322.365	1.400	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@@H](CO)C1	ZINC000362080613	307013127	/nfs/dbraw/zinc/01/31/27/307013127.db2.gz	YGRBIKKXWWFXOJ-QWHCGFSZSA-N	1	1	321.377	1.792	20	5		DDBDMO
O=C1N[C@H]2C[N@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]2CO1	ZINC000369720396	307127513	/nfs/dbraw/zinc/12/75/13/307127513.db2.gz	HTUMZSCWEWMRQI-NEPJUHHUSA-N	1	1	321.333	1.404	20	5		DDBDMO
O=C1N[C@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]2CO1	ZINC000369720396	307127514	/nfs/dbraw/zinc/12/75/14/307127514.db2.gz	HTUMZSCWEWMRQI-NEPJUHHUSA-N	1	1	321.333	1.404	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H](O)C3(CC3)C2)c([N+](=O)[O-])cc1OC	ZINC000375300179	307221026	/nfs/dbraw/zinc/22/10/26/307221026.db2.gz	WJNYTUPGWDIQGA-CQSZACIVSA-N	1	1	308.334	1.569	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H](O)C3(CC3)C2)c([N+](=O)[O-])cc1OC	ZINC000375300179	307221027	/nfs/dbraw/zinc/22/10/27/307221027.db2.gz	WJNYTUPGWDIQGA-CQSZACIVSA-N	1	1	308.334	1.569	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCCC2)C1	ZINC000533195924	307635952	/nfs/dbraw/zinc/63/59/52/307635952.db2.gz	OONAZUZSXXUKQF-GFCCVEGCSA-N	1	1	305.334	1.611	20	5		DDBDMO
Cc1cnc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000566117600	308043807	/nfs/dbraw/zinc/04/38/07/308043807.db2.gz	VXDXADVTHGTRMK-NSHDSACASA-N	1	1	323.374	1.889	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@H]2CCC(=O)N(C)C2)ccc1[N+](=O)[O-]	ZINC000582310095	326010377	/nfs/dbraw/zinc/01/03/77/326010377.db2.gz	YVIDHKRLYZSGTD-LBPRGKRZSA-N	1	1	307.350	1.656	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488732574	484215381	/nfs/dbraw/zinc/21/53/81/484215381.db2.gz	KHRLFTZTGGDMPB-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488732574	484215385	/nfs/dbraw/zinc/21/53/85/484215385.db2.gz	KHRLFTZTGGDMPB-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+](CCCO)C1	ZINC000295916211	534703700	/nfs/dbraw/zinc/70/37/00/534703700.db2.gz	CQVFZMVNUGKNOT-CQSZACIVSA-N	1	1	321.377	1.100	20	5		DDBDMO
CC(C)(O)[C@@H]1CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000305427194	527360211	/nfs/dbraw/zinc/36/02/11/527360211.db2.gz	CAMRGBVYKMBFNW-ZDUSSCGKSA-N	1	1	307.350	1.429	20	5		DDBDMO
CC(C)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cnn(C)c1	ZINC000459594713	527944207	/nfs/dbraw/zinc/94/42/07/527944207.db2.gz	LHYVNOKYUIEYNI-UHFFFAOYSA-N	1	1	306.370	1.683	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC1	ZINC000330872747	528114512	/nfs/dbraw/zinc/11/45/12/528114512.db2.gz	HGBLKDSAJPCYLL-UHFFFAOYSA-N	1	1	321.381	1.295	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1CC1)C2	ZINC000981763040	696906856	/nfs/dbraw/zinc/90/68/56/696906856.db2.gz	CEDYGGOQOUUXOG-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@H+](CCC1CC1)C2	ZINC000981763040	696906858	/nfs/dbraw/zinc/90/68/58/696906858.db2.gz	CEDYGGOQOUUXOG-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CCC[N@@H+](CCC1CC1)C2	ZINC000981763040	696906859	/nfs/dbraw/zinc/90/68/59/696906859.db2.gz	CEDYGGOQOUUXOG-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
C[N@@H+](Cc1cccnc1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985430640	697510176	/nfs/dbraw/zinc/51/01/76/697510176.db2.gz	GXMYVEJWURVUEQ-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[N@H+](Cc1cccnc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985430640	697510177	/nfs/dbraw/zinc/51/01/77/697510177.db2.gz	GXMYVEJWURVUEQ-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[N@@H+](Cc1cccnc1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985430640	697510178	/nfs/dbraw/zinc/51/01/78/697510178.db2.gz	GXMYVEJWURVUEQ-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000773199222	697727310	/nfs/dbraw/zinc/72/73/10/697727310.db2.gz	QCFBCOJYYVXKSC-SNVBAGLBSA-N	1	1	322.321	1.717	20	5		DDBDMO
CCC[N@@H+](CC(=O)N(C)C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579645	698120387	/nfs/dbraw/zinc/12/03/87/698120387.db2.gz	OWAKZGLEJRHOMA-AWEZNQCLSA-N	1	1	309.366	1.428	20	5		DDBDMO
CCC[N@H+](CC(=O)N(C)C)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579645	698120389	/nfs/dbraw/zinc/12/03/89/698120389.db2.gz	OWAKZGLEJRHOMA-AWEZNQCLSA-N	1	1	309.366	1.428	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854195	698144225	/nfs/dbraw/zinc/14/42/25/698144225.db2.gz	PZKWPPHBZIBTOB-SMDDNHRTSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776854195	698144226	/nfs/dbraw/zinc/14/42/26/698144226.db2.gz	PZKWPPHBZIBTOB-SMDDNHRTSA-N	1	1	323.393	1.863	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)OCCC[NH+]1CCOCC1	ZINC000750891960	700254785	/nfs/dbraw/zinc/25/47/85/700254785.db2.gz	WFBBPMZFEBWQHL-UHFFFAOYSA-N	1	1	308.334	1.403	20	5		DDBDMO
O=[N+]([O-])c1cc(S(=O)(=O)NCC[NH+]2CCCC2)cs1	ZINC000788874144	699343853	/nfs/dbraw/zinc/34/38/53/699343853.db2.gz	FULAKXIRKYTXRC-UHFFFAOYSA-N	1	1	305.381	1.030	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000726908303	699388078	/nfs/dbraw/zinc/38/80/78/699388078.db2.gz	XGBDWDZFSLABIB-UHFFFAOYSA-N	1	1	312.395	1.459	20	5		DDBDMO
NC(=[NH+]OCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCOCC1	ZINC000789588736	699397289	/nfs/dbraw/zinc/39/72/89/699397289.db2.gz	BSJBLXBXXRDBJQ-UHFFFAOYSA-N	1	1	324.293	1.928	20	5		DDBDMO
Cc1cccc2c1CC[N@@H+](C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)C2	ZINC000743846584	699928850	/nfs/dbraw/zinc/92/88/50/699928850.db2.gz	OCBGFFJQNBBRGW-OAHLLOKOSA-N	1	1	316.361	1.519	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@@H](COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000802135884	700369960	/nfs/dbraw/zinc/36/99/60/700369960.db2.gz	BLZPXUWXMZVQGP-CQSZACIVSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](COC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000802135884	700369966	/nfs/dbraw/zinc/36/99/66/700369966.db2.gz	BLZPXUWXMZVQGP-CQSZACIVSA-N	1	1	308.334	1.861	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000754778215	700527075	/nfs/dbraw/zinc/52/70/75/700527075.db2.gz	MSAWEKNJFLJQPW-ZDUSSCGKSA-N	1	1	309.370	1.166	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@H+](C)Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000754778215	700527078	/nfs/dbraw/zinc/52/70/78/700527078.db2.gz	MSAWEKNJFLJQPW-ZDUSSCGKSA-N	1	1	309.370	1.166	20	5		DDBDMO
C[C@@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@@H+]1C	ZINC000761078330	700840586	/nfs/dbraw/zinc/84/05/86/700840586.db2.gz	BOPKJHNCSHYIBW-DOMZBBRYSA-N	1	1	318.377	1.336	20	5		DDBDMO
C[C@@H]1CN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[N@H+]1C	ZINC000761078330	700840588	/nfs/dbraw/zinc/84/05/88/700840588.db2.gz	BOPKJHNCSHYIBW-DOMZBBRYSA-N	1	1	318.377	1.336	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNc1nc2ccccn2c1[N+](=O)[O-]	ZINC000808131719	701499948	/nfs/dbraw/zinc/49/99/48/701499948.db2.gz	SEIVTFWRHXMDTK-UHFFFAOYSA-N	1	1	320.397	1.538	20	5		DDBDMO
CN(CCCNc1nc2ccccn2c1[N+](=O)[O-])CC[NH+](C)C	ZINC000808131719	701499950	/nfs/dbraw/zinc/49/99/50/701499950.db2.gz	SEIVTFWRHXMDTK-UHFFFAOYSA-N	1	1	320.397	1.538	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CC[N@H+](C)C(C)(C)CC1	ZINC000879215057	706616564	/nfs/dbraw/zinc/61/65/64/706616564.db2.gz	ZEIKAZWNIODEKO-UHFFFAOYSA-N	1	1	321.381	1.668	20	5		DDBDMO
C[C@H]1CSCCN1C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867927794	701834933	/nfs/dbraw/zinc/83/49/33/701834933.db2.gz	OMWUBFXVHLOEEN-IINYFYTJSA-N	1	1	309.391	1.733	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1	ZINC000816954083	702237696	/nfs/dbraw/zinc/23/76/96/702237696.db2.gz	STGALXSLNNAYNT-BPFGOOJPSA-N	1	1	301.346	1.771	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000879531857	706710841	/nfs/dbraw/zinc/71/08/41/706710841.db2.gz	MFKDWKKAUYXLPE-TVYUQYBPSA-N	1	1	303.318	1.202	20	5		DDBDMO
Nc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000848353164	703542313	/nfs/dbraw/zinc/54/23/13/703542313.db2.gz	YIITWRMBONOIPY-STQMWFEESA-N	1	1	319.365	1.319	20	5		DDBDMO
C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccnn1C	ZINC000879686200	706759068	/nfs/dbraw/zinc/75/90/68/706759068.db2.gz	VUNHUAHVVPIVRL-LLVKDONJSA-N	1	1	317.349	1.642	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-]	ZINC000852437701	704048243	/nfs/dbraw/zinc/04/82/43/704048243.db2.gz	FPWBONWPEWWPNH-LBPRGKRZSA-N	1	1	321.333	1.630	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-]	ZINC000852437701	704048244	/nfs/dbraw/zinc/04/82/44/704048244.db2.gz	FPWBONWPEWWPNH-LBPRGKRZSA-N	1	1	321.333	1.630	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH2+][C@@H]1CCn2ccnc21	ZINC000819337788	704109582	/nfs/dbraw/zinc/10/95/82/704109582.db2.gz	PHCQPLBIQNUYBF-VXGBXAGGSA-N	1	1	318.333	1.266	20	5		DDBDMO
CCO[C@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870873422	704152802	/nfs/dbraw/zinc/15/28/02/704152802.db2.gz	CUDKDDWXHPKDOJ-HOCLYGCPSA-N	1	1	321.377	1.796	20	5		DDBDMO
CCN(C[C@H]1CCOC1)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870875367	704153785	/nfs/dbraw/zinc/15/37/85/704153785.db2.gz	LUKUNUFUXKUTHQ-WBMJQRKESA-N	1	1	321.377	1.654	20	5		DDBDMO
CO[C@@H]1CCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870880780	704155265	/nfs/dbraw/zinc/15/52/65/704155265.db2.gz	ONDRRDOGHYQEBH-UKRRQHHQSA-N	1	1	307.350	1.406	20	5		DDBDMO
CCOC[C@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870897299	704161224	/nfs/dbraw/zinc/16/12/24/704161224.db2.gz	BGUMDMIEIRNJSI-BLLLJJGKSA-N	1	1	321.377	1.654	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000819719807	704164242	/nfs/dbraw/zinc/16/42/42/704164242.db2.gz	HPVXAXNCPQCGBM-CFVMTHIKSA-N	1	1	319.361	1.181	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000860176993	705124014	/nfs/dbraw/zinc/12/40/14/705124014.db2.gz	LFPMQRHCWIYUGN-HOTGVXAUSA-N	1	1	321.377	1.619	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000824003002	705353259	/nfs/dbraw/zinc/35/32/59/705353259.db2.gz	LCFJYEHIXOROSD-VXGBXAGGSA-N	1	1	319.365	1.925	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3N)CC[C@@H]21	ZINC000827278212	705967111	/nfs/dbraw/zinc/96/71/11/705967111.db2.gz	VDUYPHRLGNACGD-YGRLFVJLSA-N	1	1	304.350	1.343	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC[C@@H]21	ZINC000827373163	705988382	/nfs/dbraw/zinc/98/83/82/705988382.db2.gz	GWWIERAYORVNBO-ZFWWWQNUSA-N	1	1	303.362	1.690	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)N(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000877197341	706014625	/nfs/dbraw/zinc/01/46/25/706014625.db2.gz	IEARXBWZMSHOQZ-SGIREYDYSA-N	1	1	321.377	1.795	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC(CO)(CO)CC2)c1	ZINC000877797666	706218743	/nfs/dbraw/zinc/21/87/43/706218743.db2.gz	PACCHTYVFSRTFI-UHFFFAOYSA-N	1	1	314.769	1.815	20	5		DDBDMO
C[C@@H](NCC(=O)NC1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000878356468	706368839	/nfs/dbraw/zinc/36/88/39/706368839.db2.gz	VLRJETXXMLVHAX-GFCCVEGCSA-N	1	1	320.393	1.456	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000865605341	706475544	/nfs/dbraw/zinc/47/55/44/706475544.db2.gz	SMVKPJRZIDHRHP-ZDUSSCGKSA-N	1	1	321.352	1.877	20	5		DDBDMO
COC(=O)[C@H]1[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C[C@@H]21	ZINC000865825830	706537671	/nfs/dbraw/zinc/53/76/71/706537671.db2.gz	JBPLAGPHDYKEGG-JYAVWHMHSA-N	1	1	313.313	1.998	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@@H](C(F)(F)F)O1	ZINC000880056155	706865749	/nfs/dbraw/zinc/86/57/49/706865749.db2.gz	CAELRYGIQQLFMN-UWVGGRQHSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@@H](C(F)(F)F)O1	ZINC000880056155	706865750	/nfs/dbraw/zinc/86/57/50/706865750.db2.gz	CAELRYGIQQLFMN-UWVGGRQHSA-N	1	1	322.287	1.833	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000880311372	706937526	/nfs/dbraw/zinc/93/75/26/706937526.db2.gz	DJAIWTWQMRPDDY-LZWOXQAQSA-N	1	1	319.361	1.038	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2nccs2)C1	ZINC000880320733	706940020	/nfs/dbraw/zinc/94/00/20/706940020.db2.gz	XKZZAWVFFHOCTR-NSHDSACASA-N	1	1	320.374	1.703	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)Cn2cc(C[NH+]3CCCC3)nn2)cc1	ZINC000881397500	707234302	/nfs/dbraw/zinc/23/43/02/707234302.db2.gz	BZKJKQCDVDYRQX-HNNXBMFYSA-N	1	1	317.349	1.516	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@]2(CO)COCC[NH2+]2)c(C(F)F)c1	ZINC000882731110	707764372	/nfs/dbraw/zinc/76/43/72/707764372.db2.gz	UAZSXQQDEQUVCA-ZDUSSCGKSA-N	1	1	317.292	1.295	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C)CC[N@@H+](C)CC2)c1	ZINC000888990976	709424786	/nfs/dbraw/zinc/42/47/86/709424786.db2.gz	LIVGNBYQCICUKN-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCN(C)CC[N@H+](C)CC2)c1	ZINC000888990976	709424788	/nfs/dbraw/zinc/42/47/88/709424788.db2.gz	LIVGNBYQCICUKN-UHFFFAOYSA-N	1	1	320.393	1.223	20	5		DDBDMO
C[C@@H](NC(=O)[C@H]1C[N@H+]2CCN1CCC2)c1ccc([N+](=O)[O-])cc1	ZINC000928249273	713157375	/nfs/dbraw/zinc/15/73/75/713157375.db2.gz	RFGYLYCKLAEGKR-IUODEOHRSA-N	1	1	318.377	1.162	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(O)c(OC)c2[N+](=O)[O-])C[C@H]1C	ZINC000891993968	710348889	/nfs/dbraw/zinc/34/88/89/710348889.db2.gz	XSTLUYDQYPHEJK-LLVKDONJSA-N	1	1	309.366	1.835	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@]3(CCOC3)C2)c1[N+](=O)[O-]	ZINC000892176465	710388535	/nfs/dbraw/zinc/38/85/35/710388535.db2.gz	VHVFXTUVEAZCGO-HNNXBMFYSA-N	1	1	308.334	1.921	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000928451246	713202565	/nfs/dbraw/zinc/20/25/65/713202565.db2.gz	VIRSIIPMANSJNQ-JQWIXIFHSA-N	1	1	307.350	1.355	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F	ZINC000911478900	710814679	/nfs/dbraw/zinc/81/46/79/710814679.db2.gz	UYERBZPNUXOJNM-UHFFFAOYSA-N	1	1	301.293	1.829	20	5		DDBDMO
CN(CCC[N@@H+](C)Cc1ccco1)c1c([N+](=O)[O-])cnn1C	ZINC000893846966	710855735	/nfs/dbraw/zinc/85/57/35/710855735.db2.gz	CFGQONYDZNQKDZ-UHFFFAOYSA-N	1	1	307.354	1.880	20	5		DDBDMO
CC(C)Oc1nc(N2CC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-]	ZINC000893933533	710891395	/nfs/dbraw/zinc/89/13/95/710891395.db2.gz	AQNYLQMMVITDOE-WCQYABFASA-N	1	1	306.366	1.917	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC000893936012	710892121	/nfs/dbraw/zinc/89/21/21/710892121.db2.gz	TYNZPZWGTDGQJQ-YUMQZZPRSA-N	1	1	319.287	1.487	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000894395846	711101897	/nfs/dbraw/zinc/10/18/97/711101897.db2.gz	BZEASVCPSMRHBF-DZGCQCFKSA-N	1	1	318.377	1.749	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000928565978	713230607	/nfs/dbraw/zinc/23/06/07/713230607.db2.gz	CHJDPHNZXUDFKO-CYBMUJFWSA-N	1	1	318.377	1.629	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000928565978	713230611	/nfs/dbraw/zinc/23/06/11/713230611.db2.gz	CHJDPHNZXUDFKO-CYBMUJFWSA-N	1	1	318.377	1.629	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@@H]1C	ZINC000912025198	711129627	/nfs/dbraw/zinc/12/96/27/711129627.db2.gz	ZMLOUQNYDZYKQA-PHIMTYICSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000928571328	713233869	/nfs/dbraw/zinc/23/38/69/713233869.db2.gz	MBFYKBCBMQHGQE-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000928571328	713233871	/nfs/dbraw/zinc/23/38/71/713233871.db2.gz	MBFYKBCBMQHGQE-JTQLQIEISA-N	1	1	321.333	1.190	20	5		DDBDMO
C[N@@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H]1CO	ZINC000894885678	711308130	/nfs/dbraw/zinc/30/81/30/711308130.db2.gz	RRAWAJWPCHPJPC-VIFPVBQESA-N	1	1	320.271	1.121	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])cc2C(F)(F)F)C[C@H]1CO	ZINC000894885678	711308135	/nfs/dbraw/zinc/30/81/35/711308135.db2.gz	RRAWAJWPCHPJPC-VIFPVBQESA-N	1	1	320.271	1.121	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1	ZINC000913536140	713248789	/nfs/dbraw/zinc/24/87/89/713248789.db2.gz	KBZUILSKACMKGR-GASCZTMLSA-N	1	1	303.362	1.832	20	5		DDBDMO
CCN1CCC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1=O	ZINC000895899322	711640995	/nfs/dbraw/zinc/64/09/95/711640995.db2.gz	LPBBCXJSIXXUGG-HNNXBMFYSA-N	1	1	314.345	1.988	20	5		DDBDMO
O=[N+]([O-])c1cc(CNC[C@@H]2CC[N@@H+]2C2CCOCC2)cs1	ZINC000922950107	714195422	/nfs/dbraw/zinc/19/54/22/714195422.db2.gz	CFACEEZLSAMTDE-ZDUSSCGKSA-N	1	1	311.407	1.999	20	5		DDBDMO
O=[N+]([O-])c1cc(CNC[C@@H]2CC[N@H+]2C2CCOCC2)cs1	ZINC000922950107	714195424	/nfs/dbraw/zinc/19/54/24/714195424.db2.gz	CFACEEZLSAMTDE-ZDUSSCGKSA-N	1	1	311.407	1.999	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000932638781	714372084	/nfs/dbraw/zinc/37/20/84/714372084.db2.gz	KMHPREFYQPWBMJ-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000932638781	714372088	/nfs/dbraw/zinc/37/20/88/714372088.db2.gz	KMHPREFYQPWBMJ-LBPRGKRZSA-N	1	1	308.334	1.988	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](C3CCOCC3)C2)n1	ZINC000933080066	714513302	/nfs/dbraw/zinc/51/33/02/714513302.db2.gz	TVUDACMCZPHONK-AWEZNQCLSA-N	1	1	308.382	1.930	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000934321243	714794397	/nfs/dbraw/zinc/79/43/97/714794397.db2.gz	BFDLIJVECFIEEK-OLZOCXBDSA-N	1	1	321.381	1.185	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@H](O)[C@@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570362	714854139	/nfs/dbraw/zinc/85/41/39/714854139.db2.gz	DXABTQLKKXUEBN-GWCFXTLKSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@H](O)[C@@H](F)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000934570362	714854140	/nfs/dbraw/zinc/85/41/40/714854140.db2.gz	DXABTQLKKXUEBN-GWCFXTLKSA-N	1	1	311.313	1.328	20	5		DDBDMO
COC(=O)[C@H](C)N(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001167114317	732681616	/nfs/dbraw/zinc/68/16/16/732681616.db2.gz	ZOOVJWNSVVFLAG-FGEFZZPRSA-N	1	1	308.338	1.520	20	5		DDBDMO
Cc1cc(CC(=O)NCC[NH2+]Cc2ccccc2[N+](=O)[O-])[nH]n1	ZINC001125546556	734481051	/nfs/dbraw/zinc/48/10/51/734481051.db2.gz	GJWHPMDMIIWFGJ-UHFFFAOYSA-N	1	1	317.349	1.075	20	5		DDBDMO
CC(C)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC001025685041	736820135	/nfs/dbraw/zinc/82/01/35/736820135.db2.gz	AMPUANWWJUJOAU-NHAGDIPZSA-N	1	1	303.362	1.797	20	5		DDBDMO
Cc1cncc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)c1	ZINC001002783492	743424625	/nfs/dbraw/zinc/42/46/25/743424625.db2.gz	USLXDKFINSXPKF-HUUCEWRRSA-N	1	1	318.377	1.136	20	5		DDBDMO
Cc1cc(-n2cnc(C[NH3+])n2)nc(-c2cccc([N+](=O)[O-])c2)n1	ZINC001168750167	749047100	/nfs/dbraw/zinc/04/71/00/749047100.db2.gz	KOWOKIDHUYAAFO-UHFFFAOYSA-N	1	1	311.305	1.400	20	5		DDBDMO
Cc1ccc(C[NH2+]C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1	ZINC000996429229	749588313	/nfs/dbraw/zinc/58/83/13/749588313.db2.gz	MTINNCNWXJNWQC-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
CCOC(=O)N1CCC([N@@H+](C)[C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169038631	762193684	/nfs/dbraw/zinc/19/36/84/762193684.db2.gz	JMBWXFDHYSRBNK-OCCSQVGLSA-N	1	1	313.398	1.985	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2C[C@H]3CN(CC4CC4)C[C@@H](C2)O3)C1	ZINC001169023823	762202040	/nfs/dbraw/zinc/20/20/40/762202040.db2.gz	FLWKVSDPPWPYRE-XUWVNRHRSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H](N2C[C@@H]3C[N@@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023823	762202046	/nfs/dbraw/zinc/20/20/46/762202046.db2.gz	FLWKVSDPPWPYRE-XUWVNRHRSA-N	1	1	309.410	1.227	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H](N2C[C@@H]3C[N@H+](CC4CC4)C[C@H](C2)O3)C1	ZINC001169023823	762202050	/nfs/dbraw/zinc/20/20/50/762202050.db2.gz	FLWKVSDPPWPYRE-XUWVNRHRSA-N	1	1	309.410	1.227	20	5		DDBDMO
COC(=O)c1cnc2c(c1)C[N@@H+]([C@H]1CC[C@@H](C[N+](=O)[O-])C1)CC2	ZINC001169055915	762210799	/nfs/dbraw/zinc/21/07/99/762210799.db2.gz	RFGKWGUWYYRBGX-RISCZKNCSA-N	1	1	319.361	1.672	20	5		DDBDMO
COc1cc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)ccn1	ZINC001169056366	762211369	/nfs/dbraw/zinc/21/13/69/762211369.db2.gz	SLESEXBMHIKDRB-KCQAQPDRSA-N	1	1	321.377	1.989	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCN2C)cc1[N+](=O)[O-]	ZINC000823785271	758362692	/nfs/dbraw/zinc/36/26/92/758362692.db2.gz	ZZQIEMZNCHWRON-SWLSCSKDSA-N	1	1	320.393	1.267	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]CCc2cccs2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020139565	760613987	/nfs/dbraw/zinc/61/39/87/760613987.db2.gz	FWBWCMDAKVZSON-FPQZTECRSA-N	1	1	309.391	1.193	20	5		DDBDMO
Cc1ncccc1C[NH2+][C@H]1C[C@H](CNC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001086363518	761492711	/nfs/dbraw/zinc/49/27/11/761492711.db2.gz	YYLKSSJLJARPOH-NMFUWQPSSA-N	1	1	318.377	1.040	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001048524903	769493362	/nfs/dbraw/zinc/49/33/62/769493362.db2.gz	FAJBFAHRJJXCDF-YIDVYQOGSA-N	1	1	321.421	1.811	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CC1CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048524903	769493368	/nfs/dbraw/zinc/49/33/68/769493368.db2.gz	FAJBFAHRJJXCDF-YIDVYQOGSA-N	1	1	321.421	1.811	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CC1CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001048524903	769493372	/nfs/dbraw/zinc/49/33/72/769493372.db2.gz	FAJBFAHRJJXCDF-YIDVYQOGSA-N	1	1	321.421	1.811	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCCNC(=O)C[N@H+](C)C(C)C	ZINC001093674055	774989050	/nfs/dbraw/zinc/98/90/50/774989050.db2.gz	LWGUHCWUZCGWJC-UHFFFAOYSA-N	1	1	309.370	1.167	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1F	ZINC001093787770	775078692	/nfs/dbraw/zinc/07/86/92/775078692.db2.gz	KKHZDSMALQYFSB-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ccc(C)cc1[N+](=O)[O-]	ZINC001093840565	775125133	/nfs/dbraw/zinc/12/51/33/775125133.db2.gz	NKVKKJADTBGIIH-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCCNc1ncccc1[N+](=O)[O-]	ZINC001094434758	775858690	/nfs/dbraw/zinc/85/86/90/775858690.db2.gz	PZZCRJRAPGONAP-UHFFFAOYSA-N	1	1	318.337	1.113	20	5		DDBDMO
CC(C)(C[NH2+]CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001101540679	777230897	/nfs/dbraw/zinc/23/08/97/777230897.db2.gz	PBAFLDLBIKUUGT-HUUCEWRRSA-N	1	1	323.437	1.916	20	5		DDBDMO
CC(C)OCC[NH2+]CCCCCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001178450222	779035094	/nfs/dbraw/zinc/03/50/94/779035094.db2.gz	YGFZQIFWFINRLJ-ZIAGYGMSSA-N	1	1	315.414	1.343	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816080	780904398	/nfs/dbraw/zinc/90/43/98/780904398.db2.gz	QNDUSXVZRVVHMI-TZMCWYRMSA-N	1	1	307.350	1.181	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC001117816080	780904403	/nfs/dbraw/zinc/90/44/03/780904403.db2.gz	QNDUSXVZRVVHMI-TZMCWYRMSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@H](O)C1(O)CCCC1)CC2	ZINC001119684609	781562552	/nfs/dbraw/zinc/56/25/52/781562552.db2.gz	CPEJOVPFKCPDHM-HNNXBMFYSA-N	1	1	306.362	1.619	20	5		DDBDMO
CC[C@@H]1[N@H+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCC[C@]12CCC(=O)N2	ZINC001169021512	850518374	/nfs/dbraw/zinc/51/83/74/850518374.db2.gz	LGKQCJPNRMFIDS-HOSILWTGSA-N	1	1	309.410	1.955	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC001123003165	859049660	/nfs/dbraw/zinc/04/96/60/859049660.db2.gz	RHLDJEYWVMVRDE-NEPJUHHUSA-N	1	1	308.338	1.270	20	5		DDBDMO
Cc1cc(NC(=O)[C@@H](C)C[NH+]2CCOCC2)cc([N+](=O)[O-])c1	ZINC001124043321	859546251	/nfs/dbraw/zinc/54/62/51/859546251.db2.gz	FRZYIXQDFHMEEB-LBPRGKRZSA-N	1	1	307.350	1.810	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(CNC(=O)C2CCCC2)CC1	ZINC001276992296	881507855	/nfs/dbraw/zinc/50/78/55/881507855.db2.gz	UNECGFBWYXYEDP-UHFFFAOYSA-N	1	1	321.381	1.257	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1nc(Cl)c(Cl)cc1[N+](=O)[O-]	ZINC001156624410	863201237	/nfs/dbraw/zinc/20/12/37/863201237.db2.gz	OKMIIDDQADZEHK-UHFFFAOYSA-N	1	1	315.120	1.420	20	5		DDBDMO
O=C(NCCC[NH2+]CCCCC(F)(F)F)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767854	864118257	/nfs/dbraw/zinc/11/82/57/864118257.db2.gz	YAEBBMRAAQLKGK-NXEZZACHSA-N	1	1	311.304	1.480	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@@H+](C[C@@H]1C[C@@H]3COC[C@H]3O1)CC2	ZINC001334613746	867710672	/nfs/dbraw/zinc/71/06/72/867710672.db2.gz	JGWGQTPHQHFIPT-VNQPRFMTSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[N@H+](C[C@@H]1C[C@@H]3COC[C@H]3O1)CC2	ZINC001334613746	867710676	/nfs/dbraw/zinc/71/06/76/867710676.db2.gz	JGWGQTPHQHFIPT-VNQPRFMTSA-N	1	1	304.346	1.757	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC001335117118	868075678	/nfs/dbraw/zinc/07/56/78/868075678.db2.gz	KNCAUYVTBUACJQ-OLZOCXBDSA-N	1	1	309.341	1.769	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@H]([NH3+])C1CN(c2cc([N+](=O)[O-])ccn2)C1	ZINC001163117444	868115230	/nfs/dbraw/zinc/11/52/30/868115230.db2.gz	HACDMUKFKXQNOF-LBPRGKRZSA-N	1	1	308.338	1.095	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC001335422077	868285486	/nfs/dbraw/zinc/28/54/86/868285486.db2.gz	QPNBIYDLVCBQAI-HIFRSBDPSA-N	1	1	318.377	1.483	20	5		DDBDMO
COc1c(O)ccc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c1[N+](=O)[O-]	ZINC001335420867	868285873	/nfs/dbraw/zinc/28/58/73/868285873.db2.gz	JQXCEPBTWCFGMI-ODOQXGPZSA-N	1	1	322.361	1.902	20	5		DDBDMO
CCNC(=O)CN(C)c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001163913378	868786916	/nfs/dbraw/zinc/78/69/16/868786916.db2.gz	FXVBWWVNRZJYSD-VOTSOKGWSA-N	1	1	307.354	1.094	20	5		DDBDMO
COc1cccc(C(=O)NC[C@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001336223740	868800088	/nfs/dbraw/zinc/80/00/88/868800088.db2.gz	MIIXPVVUKIFVJN-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3c(F)cccc3[N+](=O)[O-])[C@@H]2C1	ZINC001338463884	869992507	/nfs/dbraw/zinc/99/25/07/869992507.db2.gz	NPNWPZZTTRJZBA-UMNHJUIQSA-N	1	1	307.325	1.804	20	5		DDBDMO
Nc1cc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)ncc1[N+](=O)[O-]	ZINC001339824727	870715802	/nfs/dbraw/zinc/71/58/02/870715802.db2.gz	RKDIJPVPWZTSNG-JQWIXIFHSA-N	1	1	309.395	1.564	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Nc3ccc(N)c([N+](=O)[O-])c3)[C@H]2C1	ZINC001310993121	871668995	/nfs/dbraw/zinc/66/89/95/871668995.db2.gz	WWHAWJNIEZZPSV-XHVZSJERSA-N	1	1	319.365	1.639	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)C[C@@H]21	ZINC001205641870	871670506	/nfs/dbraw/zinc/67/05/06/871670506.db2.gz	WHUCUHDOTLWZAP-RNCFNFMXSA-N	1	1	308.313	1.902	20	5		DDBDMO
Cc1cc(NC(=O)NC[C@H]2C[N@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC001350262730	875602424	/nfs/dbraw/zinc/60/24/24/875602424.db2.gz	RYAGIUWPVSILIX-AWEZNQCLSA-N	1	1	321.381	1.271	20	5		DDBDMO
COC(=O)c1sc([N+](=O)[O-])cc1O[C@H]1CCC[N@H+](C)C1	ZINC001227541870	883070247	/nfs/dbraw/zinc/07/02/47/883070247.db2.gz	PYMGEDGSCJHVEW-QMMMGPOBSA-N	1	1	300.336	1.916	20	5		DDBDMO
COC(=O)c1sc([N+](=O)[O-])cc1O[C@H]1CCC[N@@H+](C)C1	ZINC001227541870	883070262	/nfs/dbraw/zinc/07/02/62/883070262.db2.gz	PYMGEDGSCJHVEW-QMMMGPOBSA-N	1	1	300.336	1.916	20	5		DDBDMO
CC[NH+]1CCC(Oc2cc(O)c(C(=O)OC)cc2[N+](=O)[O-])CC1	ZINC001228809623	883682065	/nfs/dbraw/zinc/68/20/65/883682065.db2.gz	GXIRWPGPLYYSON-UHFFFAOYSA-N	1	1	324.333	1.950	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@@H](Oc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]1CC(=O)C2	ZINC001229486054	884008627	/nfs/dbraw/zinc/00/86/27/884008627.db2.gz	DKJKMWUBHCFRLQ-MRCXROJRSA-N	1	1	317.301	1.919	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@@H](Oc3nc4cc([N+](=O)[O-])ccc4o3)[C@H]1CC(=O)C2	ZINC001229486054	884008635	/nfs/dbraw/zinc/00/86/35/884008635.db2.gz	DKJKMWUBHCFRLQ-MRCXROJRSA-N	1	1	317.301	1.919	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2cc(C(=O)OC)c([N+](=O)[O-])cc2F)C1	ZINC001229941150	884239345	/nfs/dbraw/zinc/23/93/45/884239345.db2.gz	JDFOATAIQFLTHR-SECBINFHSA-N	1	1	312.297	1.994	20	5		DDBDMO
CC[N@H+]1CC[C@H](Oc2cc(C(=O)OC)c([N+](=O)[O-])cc2F)C1	ZINC001229941151	884241103	/nfs/dbraw/zinc/24/11/03/884241103.db2.gz	JDFOATAIQFLTHR-VIFPVBQESA-N	1	1	312.297	1.994	20	5		DDBDMO
COCC[NH+]1CCC(Oc2cc3[nH]ncc3cc2[N+](=O)[O-])CC1	ZINC001230602000	884641471	/nfs/dbraw/zinc/64/14/71/884641471.db2.gz	STNSIBRLKDQGAP-UHFFFAOYSA-N	1	1	320.349	1.961	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@@H](O)[C@H](F)C3)CC2)cc1	ZINC001254474920	896456926	/nfs/dbraw/zinc/45/69/26/896456926.db2.gz	WNBLXZYSFVKJAQ-HZPDHXFCSA-N	1	1	323.368	1.968	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H](N1CC[NH+]([C@@H]3CCOC3)CC1)C2	ZINC001254596766	896522578	/nfs/dbraw/zinc/52/25/78/896522578.db2.gz	GAYUFNYIZDIGGT-IAGOWNOFSA-N	1	1	317.389	1.469	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([NH+]1CCN([C@@H]3CCOC3)CC1)C2	ZINC001254596766	896522586	/nfs/dbraw/zinc/52/25/86/896522586.db2.gz	GAYUFNYIZDIGGT-IAGOWNOFSA-N	1	1	317.389	1.469	20	5		DDBDMO
CN1C(=O)CC[C@@H]2[C@H]1CC[N@H+]2[C@@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254597108	896524596	/nfs/dbraw/zinc/52/45/96/896524596.db2.gz	USAHMBFSYMOLLW-BZUAXINKSA-N	1	1	315.373	1.757	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC12CC2	ZINC001254611174	896533247	/nfs/dbraw/zinc/53/32/47/896533247.db2.gz	WPLVLYLUIDFOBV-LSDHHAIUSA-N	1	1	316.357	1.947	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](CC)C[C@H]2C)n1	ZINC000248684922	282099507	/nfs/dbraw/zinc/09/95/07/282099507.db2.gz	YSHDXJJSJXCBME-VXGBXAGGSA-N	1	1	323.397	1.614	20	5		DDBDMO
COc1ccc(CNC(=O)[C@@H]2CCC[N@H+]2C2CC2)cc1[N+](=O)[O-]	ZINC000278396060	214140874	/nfs/dbraw/zinc/14/08/74/214140874.db2.gz	FGJSMZMFOGGZSJ-ZDUSSCGKSA-N	1	1	319.361	1.846	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1	ZINC000278783563	214398778	/nfs/dbraw/zinc/39/87/78/214398778.db2.gz	ZDGFYDYEQZLZTO-UHFFFAOYSA-N	1	1	302.334	1.899	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915447	529577072	/nfs/dbraw/zinc/57/70/72/529577072.db2.gz	HHQVQVAKCIJVMZ-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000425915447	529577075	/nfs/dbraw/zinc/57/70/75/529577075.db2.gz	HHQVQVAKCIJVMZ-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[N@@H+](CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-])C(C)C	ZINC000358159152	299091084	/nfs/dbraw/zinc/09/10/84/299091084.db2.gz	YTJTXQMAODOJKI-UHFFFAOYSA-N	1	1	310.354	1.919	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000294423924	529803339	/nfs/dbraw/zinc/80/33/39/529803339.db2.gz	GATYDGOCHQUQTF-GFCCVEGCSA-N	1	1	319.361	1.626	20	5		DDBDMO
C[C@@H](NC(=O)Nc1ccncc1[N+](=O)[O-])C1=CC[N@@H+](C)CC1	ZINC000272773859	210179149	/nfs/dbraw/zinc/17/91/49/210179149.db2.gz	XYOUQOCCGWOGKU-SNVBAGLBSA-N	1	1	305.338	1.762	20	5		DDBDMO
C[NH2+]Cc1noc(-c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1	ZINC000414497992	530011575	/nfs/dbraw/zinc/01/15/75/530011575.db2.gz	HAGFGQFDKKZSNI-UHFFFAOYSA-N	1	1	303.322	1.964	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000458164607	530054678	/nfs/dbraw/zinc/05/46/78/530054678.db2.gz	KICUYGSPTVGQFZ-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358417000	299147002	/nfs/dbraw/zinc/14/70/02/299147002.db2.gz	WJTZSBJHICPBPC-RISCZKNCSA-N	1	1	321.352	1.972	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000155768691	186111570	/nfs/dbraw/zinc/11/15/70/186111570.db2.gz	KCTHFDRRDGIYLI-RYUDHWBXSA-N	1	1	321.381	1.193	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)CC[C@H]2CCCC[N@H+]2C)n1	ZINC000191828469	186260143	/nfs/dbraw/zinc/26/01/43/186260143.db2.gz	GTCNCVSDGGZSTE-GFCCVEGCSA-N	1	1	323.397	1.758	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCO[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000026342665	352208047	/nfs/dbraw/zinc/20/80/47/352208047.db2.gz	PQFVCBKEVURODA-NSHDSACASA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCO[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000026342665	352208051	/nfs/dbraw/zinc/20/80/51/352208051.db2.gz	PQFVCBKEVURODA-NSHDSACASA-N	1	1	307.350	1.953	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCNC(=O)c2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000047432964	352495444	/nfs/dbraw/zinc/49/54/44/352495444.db2.gz	YZHZBALFGUFOST-BETUJISGSA-N	1	1	321.377	1.824	20	5		DDBDMO
C[NH+]1CCC(N2CCC(Nc3ncccc3[N+](=O)[O-])CC2)CC1	ZINC000050954334	352574283	/nfs/dbraw/zinc/57/42/83/352574283.db2.gz	LOLQGPXCUGPDLP-UHFFFAOYSA-N	1	1	319.409	1.960	20	5		DDBDMO
CCn1cnnc1[C@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331807974	234143678	/nfs/dbraw/zinc/14/36/78/234143678.db2.gz	KTDDYGRSNVDSBJ-NSHDSACASA-N	1	1	319.369	1.319	20	5		DDBDMO
CCn1cnnc1[C@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000331807974	234143681	/nfs/dbraw/zinc/14/36/81/234143681.db2.gz	KTDDYGRSNVDSBJ-NSHDSACASA-N	1	1	319.369	1.319	20	5		DDBDMO
COCCC[N@@H+](CCOC)CCOc1cccc([N+](=O)[O-])c1	ZINC000054365852	352689463	/nfs/dbraw/zinc/68/94/63/352689463.db2.gz	HVUMEERSJDNJNG-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
Cc1c(C(=O)NC[C@H]2C[N@H+]3CCC[C@H]3CO2)cccc1[N+](=O)[O-]	ZINC000061650266	352893512	/nfs/dbraw/zinc/89/35/12/352893512.db2.gz	GWNPRVCFQTYLCF-STQMWFEESA-N	1	1	319.361	1.496	20	5		DDBDMO
CN(C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000074448451	353313920	/nfs/dbraw/zinc/31/39/20/353313920.db2.gz	MLUACXOGYBHBNP-OAGGEKHMSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000074448451	353313923	/nfs/dbraw/zinc/31/39/23/353313923.db2.gz	MLUACXOGYBHBNP-OAGGEKHMSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000074448451	353313926	/nfs/dbraw/zinc/31/39/26/353313926.db2.gz	MLUACXOGYBHBNP-OAGGEKHMSA-N	1	1	317.389	1.775	20	5		DDBDMO
COCC[N@@H+]1CCCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1	ZINC000080948090	353638560	/nfs/dbraw/zinc/63/85/60/353638560.db2.gz	HJMVAQXEITYQKL-UHFFFAOYSA-N	1	1	321.377	1.956	20	5		DDBDMO
COCC[N@H+]1CCCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1	ZINC000080948090	353638561	/nfs/dbraw/zinc/63/85/61/353638561.db2.gz	HJMVAQXEITYQKL-UHFFFAOYSA-N	1	1	321.377	1.956	20	5		DDBDMO
CN(C)C(=O)C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000091429774	353825922	/nfs/dbraw/zinc/82/59/22/353825922.db2.gz	YHXYKBHMRGBOAU-UHFFFAOYSA-N	1	1	306.366	1.195	20	5		DDBDMO
CN(C)C(=O)C[N@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000091429774	353825925	/nfs/dbraw/zinc/82/59/25/353825925.db2.gz	YHXYKBHMRGBOAU-UHFFFAOYSA-N	1	1	306.366	1.195	20	5		DDBDMO
COc1ccc(C[N@H+](C)C2(C(N)=O)CCCC2)cc1[N+](=O)[O-]	ZINC000093212723	353889049	/nfs/dbraw/zinc/88/90/49/353889049.db2.gz	COLNKCURRVFPMV-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1ccc(C[N@@H+](C)C2(C(N)=O)CCCC2)cc1[N+](=O)[O-]	ZINC000093212723	353889052	/nfs/dbraw/zinc/88/90/52/353889052.db2.gz	COLNKCURRVFPMV-UHFFFAOYSA-N	1	1	307.350	1.833	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H](C)C[NH+]2CCOCC2)c1[N+](=O)[O-]	ZINC000094163898	353911762	/nfs/dbraw/zinc/91/17/62/353911762.db2.gz	HDEASBHKFWRLRH-LLVKDONJSA-N	1	1	311.386	1.271	20	5		DDBDMO
C[C@@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@H](C)[N@@H+]1C	ZINC000590378026	355078346	/nfs/dbraw/zinc/07/83/46/355078346.db2.gz	VVZIYLSVXJZCSF-TXEJJXNPSA-N	1	1	321.377	1.890	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@H+](C)C[C@@H]21	ZINC000591534394	355324519	/nfs/dbraw/zinc/32/45/19/355324519.db2.gz	AHTTUCVQQBOUDM-WFASDCNBSA-N	1	1	303.362	1.988	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1	ZINC000592530722	355616062	/nfs/dbraw/zinc/61/60/62/355616062.db2.gz	GILQIQUMOGUKBD-TZMCWYRMSA-N	1	1	308.334	1.259	20	5		DDBDMO
[NH3+]Cc1noc([C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1	ZINC000592357521	355566023	/nfs/dbraw/zinc/56/60/23/355566023.db2.gz	JPOLFGWNTPMAPF-SSDOTTSWSA-N	1	1	323.334	1.475	20	5		DDBDMO
[NH3+]Cc1noc([C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])s2)n1	ZINC000592357522	355566158	/nfs/dbraw/zinc/56/61/58/355566158.db2.gz	JPOLFGWNTPMAPF-ZETCQYMHSA-N	1	1	323.334	1.475	20	5		DDBDMO
CN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C)C1	ZINC000593070124	355786435	/nfs/dbraw/zinc/78/64/35/355786435.db2.gz	QEOYVGDPXCAEGZ-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[N@H+]1CCN(C(=O)Cc2ccc(F)cc2[N+](=O)[O-])C(C)(C)C1	ZINC000593111191	355802673	/nfs/dbraw/zinc/80/26/73/355802673.db2.gz	GJIGNEJKEUTLMD-UHFFFAOYSA-N	1	1	309.341	1.829	20	5		DDBDMO
O=c1[nH]ccc2c1C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000276961389	213204738	/nfs/dbraw/zinc/20/47/38/213204738.db2.gz	PZAIOZWXQXMZAQ-OAHLLOKOSA-N	1	1	315.329	1.787	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C(C)(C)C1	ZINC000593339082	355857677	/nfs/dbraw/zinc/85/76/77/355857677.db2.gz	OCDXLWAFMSHAGH-UHFFFAOYSA-N	1	1	324.381	1.116	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C(C)(C)C1	ZINC000593339082	355857680	/nfs/dbraw/zinc/85/76/80/355857680.db2.gz	OCDXLWAFMSHAGH-UHFFFAOYSA-N	1	1	324.381	1.116	20	5		DDBDMO
CC[C@@H](CO)[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000080796241	192192380	/nfs/dbraw/zinc/19/23/80/192192380.db2.gz	CYMWYGMILNWELS-ZDUSSCGKSA-N	1	1	322.365	1.515	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000594716037	356294154	/nfs/dbraw/zinc/29/41/54/356294154.db2.gz	GWZOXUPYWIFDGD-HUUCEWRRSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000594716037	356294158	/nfs/dbraw/zinc/29/41/58/356294158.db2.gz	GWZOXUPYWIFDGD-HUUCEWRRSA-N	1	1	320.324	1.738	20	5		DDBDMO
C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CS1(=O)=O	ZINC000594976966	356366529	/nfs/dbraw/zinc/36/65/29/356366529.db2.gz	RGECIYWDELVJQY-MWLCHTKSSA-N	1	1	316.354	1.789	20	5		DDBDMO
Cc1noc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000595299526	356439532	/nfs/dbraw/zinc/43/95/32/356439532.db2.gz	TUYQJYCZMIRWKZ-CYBMUJFWSA-N	1	1	324.381	1.578	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[C@H](C)[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H]1C	ZINC000595554418	356547982	/nfs/dbraw/zinc/54/79/82/356547982.db2.gz	NYLAREDPGGRZGY-OUCADQQQSA-N	1	1	324.381	1.843	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595745023	356632206	/nfs/dbraw/zinc/63/22/06/356632206.db2.gz	NWTKNHQNKCMWPL-IJLUTSLNSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595833833	356670475	/nfs/dbraw/zinc/67/04/75/356670475.db2.gz	RZRUGRHRWBHWCM-AGIUHOORSA-N	1	1	319.361	1.890	20	5		DDBDMO
O=[N+]([O-])c1cc(F)ccc1CN1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000595865086	356683995	/nfs/dbraw/zinc/68/39/95/356683995.db2.gz	ZAQMHISDEYMVAP-HNNXBMFYSA-N	1	1	323.368	1.765	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596074332	356762431	/nfs/dbraw/zinc/76/24/31/356762431.db2.gz	RATPAFLIMLQSBE-UHFFFAOYSA-N	1	1	310.354	1.074	20	5		DDBDMO
O=c1[nH]ccc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000596079016	356765084	/nfs/dbraw/zinc/76/50/84/356765084.db2.gz	ZEDDSIXNIWOHFW-GFCCVEGCSA-N	1	1	322.365	1.387	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c(C(N)=O)c1)C1=CC[N@@H+](C)CC1	ZINC000596186505	356806130	/nfs/dbraw/zinc/80/61/30/356806130.db2.gz	LILQSWMSGICHFX-SNVBAGLBSA-N	1	1	304.350	1.756	20	5		DDBDMO
Nc1ccc(N2CCC([N@H+]3CCCOCC3)CC2)nc1[N+](=O)[O-]	ZINC000596269340	356838931	/nfs/dbraw/zinc/83/89/31/356838931.db2.gz	RNUNSSMMWLQIJH-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2NCC23CC(C2)C[NH2+]3)n1	ZINC000596655750	356944274	/nfs/dbraw/zinc/94/42/74/356944274.db2.gz	YMPOMNMHHOOICJ-ICRTXTNUSA-N	1	1	305.382	1.617	20	5		DDBDMO
Cc1ccc(CN2CCN(c3[nH+]ccn3C)CC2)cc1[N+](=O)[O-]	ZINC000597255551	357111492	/nfs/dbraw/zinc/11/14/92/357111492.db2.gz	OQINIUIRFZGUEN-UHFFFAOYSA-N	1	1	315.377	1.959	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1	ZINC000597680587	357282341	/nfs/dbraw/zinc/28/23/41/357282341.db2.gz	WYNCABKWTXFAGG-NSHDSACASA-N	1	1	322.365	1.248	20	5		DDBDMO
CC(C)(C)[N@@H+]1CC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597858109	357360745	/nfs/dbraw/zinc/36/07/45/357360745.db2.gz	JQDGAGBXAZMYSQ-NSHDSACASA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000597858109	357360747	/nfs/dbraw/zinc/36/07/47/357360747.db2.gz	JQDGAGBXAZMYSQ-NSHDSACASA-N	1	1	307.350	1.903	20	5		DDBDMO
CC(C)[C@](C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(N)=O	ZINC000347698175	283261918	/nfs/dbraw/zinc/26/19/18/283261918.db2.gz	DAZSSPUETINCET-HNNXBMFYSA-N	1	1	323.349	1.451	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C[C@@H]1CO	ZINC000598645102	357667366	/nfs/dbraw/zinc/66/73/66/357667366.db2.gz	DOKXKCKRNLTKSL-BXUZGUMPSA-N	1	1	322.361	1.912	20	5		DDBDMO
COC(=O)c1cnc(NCCCn2cc[nH+]c2C)c([N+](=O)[O-])c1	ZINC000276732709	213073021	/nfs/dbraw/zinc/07/30/21/213073021.db2.gz	LPWMCRZMLCBQFO-UHFFFAOYSA-N	1	1	319.321	1.784	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC3(CCOCC3)CC[C@H]2CO)c1	ZINC000599544294	357967580	/nfs/dbraw/zinc/96/75/80/357967580.db2.gz	ZKAOVJMAYWXBGC-ZDUSSCGKSA-N	1	1	324.381	1.045	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC1(C)COC1	ZINC000599571976	357979676	/nfs/dbraw/zinc/97/96/76/357979676.db2.gz	ZCCKYLTXPDUSBQ-UHFFFAOYSA-N	1	1	307.350	1.892	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[NH+](C2CC2)CC1	ZINC000601108270	358404516	/nfs/dbraw/zinc/40/45/16/358404516.db2.gz	FYHMWRGHVZQSFD-UHFFFAOYSA-N	1	1	319.287	1.632	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H](O)[C@H]3CCCO3)c2c1	ZINC000601201018	358445275	/nfs/dbraw/zinc/44/52/75/358445275.db2.gz	JVICIHBNMZFSBM-LSDHHAIUSA-N	1	1	303.318	1.517	20	5		DDBDMO
CCc1nn(C)cc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149544	358422443	/nfs/dbraw/zinc/42/24/43/358422443.db2.gz	NXUKXUZYKOJOAC-MRXNPFEDSA-N	1	1	318.377	1.888	20	5		DDBDMO
O=C1C[C@@]2(CCN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)C2)CN1	ZINC000601155806	358424961	/nfs/dbraw/zinc/42/49/61/358424961.db2.gz	GPWXLBPOHRCSTP-INIZCTEOSA-N	1	1	312.329	1.859	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1c1ccc(C(=O)NC)cc1[N+](=O)[O-]	ZINC000601192549	358440634	/nfs/dbraw/zinc/44/06/34/358440634.db2.gz	WRZFDEIKWGJSEF-CYBMUJFWSA-N	1	1	320.393	1.875	20	5		DDBDMO
NC(=O)c1cccc([N+](=O)[O-])c1N1CCC(c2[nH]cc[nH+]2)CC1	ZINC000420588276	283386295	/nfs/dbraw/zinc/38/62/95/283386295.db2.gz	RVKSWZYIHKBRJA-UHFFFAOYSA-N	1	1	315.333	1.801	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@H](CO)C1	ZINC000601979433	358763671	/nfs/dbraw/zinc/76/36/71/358763671.db2.gz	FZAVYLXSIBOFLA-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](CCO)CCc1ccccc1	ZINC000602786169	359189936	/nfs/dbraw/zinc/18/99/36/359189936.db2.gz	OKDTYORWMVEMKQ-UHFFFAOYSA-N	1	1	318.377	1.637	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(Nc3ccccn3)CC2)c([N+](=O)[O-])n1	ZINC000602795683	359197636	/nfs/dbraw/zinc/19/76/36/359197636.db2.gz	BQRKZFHQLFAQBH-UHFFFAOYSA-N	1	1	316.365	1.800	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000602815658	359211999	/nfs/dbraw/zinc/21/19/99/359211999.db2.gz	FOWZWGKTNWPINC-JTQLQIEISA-N	1	1	311.386	1.335	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@@H](C)C(=O)NC(C)(C)C	ZINC000602815658	359212005	/nfs/dbraw/zinc/21/20/05/359212005.db2.gz	FOWZWGKTNWPINC-JTQLQIEISA-N	1	1	311.386	1.335	20	5		DDBDMO
Cc1ccc(C[N@H+](CCO)CCn2c(C)ncc2[N+](=O)[O-])o1	ZINC000602821617	359215865	/nfs/dbraw/zinc/21/58/65/359215865.db2.gz	PLNKUVNVXWKHMS-UHFFFAOYSA-N	1	1	308.338	1.496	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCO)CCn2c(C)ncc2[N+](=O)[O-])o1	ZINC000602821617	359215869	/nfs/dbraw/zinc/21/58/69/359215869.db2.gz	PLNKUVNVXWKHMS-UHFFFAOYSA-N	1	1	308.338	1.496	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](n2ccnn2)CC1	ZINC000602892177	359275758	/nfs/dbraw/zinc/27/57/58/359275758.db2.gz	MLBSMUKRWOIGQQ-ZDUSSCGKSA-N	1	1	319.369	1.418	20	5		DDBDMO
CN(C(=O)C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000602962537	359324995	/nfs/dbraw/zinc/32/49/95/359324995.db2.gz	LZQQAEKRUJGXJD-OAHLLOKOSA-N	1	1	307.350	1.013	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](O)[C@H]2CCCC[C@@H]21	ZINC000602997844	359346809	/nfs/dbraw/zinc/34/68/09/359346809.db2.gz	RXEPSEKECZRDHI-KKUMJFAQSA-N	1	1	321.377	1.382	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC000603400392	359616456	/nfs/dbraw/zinc/61/64/56/359616456.db2.gz	HLLCJWDUHKEZBL-GFCCVEGCSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000186955033	200038141	/nfs/dbraw/zinc/03/81/41/200038141.db2.gz	VCEOYVBCGKHQMJ-CHWSQXEVSA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@@](C[NH3+])(NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000237638910	202313317	/nfs/dbraw/zinc/31/33/17/202313317.db2.gz	PTNGKAQLVAAWBN-AWEZNQCLSA-N	1	1	303.322	1.328	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900751	360567553	/nfs/dbraw/zinc/56/75/53/360567553.db2.gz	KAQDYUUAGJOTTC-YGRLFVJLSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900751	360567559	/nfs/dbraw/zinc/56/75/59/360567559.db2.gz	KAQDYUUAGJOTTC-YGRLFVJLSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900748	360567987	/nfs/dbraw/zinc/56/79/87/360567987.db2.gz	KAQDYUUAGJOTTC-HZMBPMFUSA-N	1	1	322.365	1.085	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000610900748	360567993	/nfs/dbraw/zinc/56/79/93/360567993.db2.gz	KAQDYUUAGJOTTC-HZMBPMFUSA-N	1	1	322.365	1.085	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000611512044	360742016	/nfs/dbraw/zinc/74/20/16/360742016.db2.gz	YACOOVGFGPIIHO-JTQLQIEISA-N	1	1	319.317	1.290	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+](CCCO)C1CC1	ZINC000612077641	360911890	/nfs/dbraw/zinc/91/18/90/360911890.db2.gz	FYNUEMOPHGSLKS-ZDUSSCGKSA-N	1	1	310.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1ncccc1N1CCC[C@H](C[NH+]2CCOCC2)C1	ZINC000619745956	364138880	/nfs/dbraw/zinc/13/88/80/364138880.db2.gz	YDOILUHDMFAQEP-CYBMUJFWSA-N	1	1	306.366	1.538	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1	ZINC000349976893	284124725	/nfs/dbraw/zinc/12/47/25/284124725.db2.gz	XOZLZBKCEWBSPV-UHFFFAOYSA-N	1	1	306.322	1.077	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CCO	ZINC000267873320	206313610	/nfs/dbraw/zinc/31/36/10/206313610.db2.gz	CWKVOYWTHICIAE-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCO	ZINC000267873320	206313614	/nfs/dbraw/zinc/31/36/14/206313614.db2.gz	CWKVOYWTHICIAE-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@H]2CC[N@H+](C)C[C@H]21	ZINC000285090684	218286656	/nfs/dbraw/zinc/28/66/56/218286656.db2.gz	DMCBIJLQIVNOMV-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1(O)CCC1	ZINC000353482959	207380806	/nfs/dbraw/zinc/38/08/06/207380806.db2.gz	GHMQZHRDONKHNL-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1(O)CCC1	ZINC000353482959	207380808	/nfs/dbraw/zinc/38/08/08/207380808.db2.gz	GHMQZHRDONKHNL-UHFFFAOYSA-N	1	1	318.333	1.992	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCSC1	ZINC000119892368	195056573	/nfs/dbraw/zinc/05/65/73/195056573.db2.gz	DFWLCNYVMOKLCN-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H]1CCSC1	ZINC000119892368	195056576	/nfs/dbraw/zinc/05/65/76/195056576.db2.gz	DFWLCNYVMOKLCN-ZDUSSCGKSA-N	1	1	321.402	1.921	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1c(C)c(C)ccc1[N+](=O)[O-]	ZINC000119969190	195071983	/nfs/dbraw/zinc/07/19/83/195071983.db2.gz	JKZDFLFYUMMLKC-UHFFFAOYSA-N	1	1	315.395	1.442	20	5		DDBDMO
CNc1nc(C(=O)NCCCC[N@@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000457170185	533076122	/nfs/dbraw/zinc/07/61/22/533076122.db2.gz	FYXCQSPBIMPDCO-UHFFFAOYSA-N	1	1	321.381	1.636	20	5		DDBDMO
C[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)CN1CC[NH+](C)CC1	ZINC000121848977	195360644	/nfs/dbraw/zinc/36/06/44/195360644.db2.gz	DWVAZBZPNKPVMU-CYBMUJFWSA-N	1	1	320.393	1.208	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2nc(C)ccc2[N+](=O)[O-])CC1	ZINC000121624880	195320020	/nfs/dbraw/zinc/32/00/20/195320020.db2.gz	BFVHPNCNYMQYKK-ZDUSSCGKSA-N	1	1	321.425	1.984	20	5		DDBDMO
CC[NH+](CC)[C@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccco1	ZINC000122437649	195451620	/nfs/dbraw/zinc/45/16/20/195451620.db2.gz	KLZKWGXSGNUWAT-SNVBAGLBSA-N	1	1	321.337	1.724	20	5		DDBDMO
Cc1[nH]nc(C(=O)N(CC[NH+](C)C)C2CCCC2)c1[N+](=O)[O-]	ZINC000330741297	533658508	/nfs/dbraw/zinc/65/85/08/533658508.db2.gz	RQWBTAPZQOPWCK-UHFFFAOYSA-N	1	1	309.370	1.573	20	5		DDBDMO
C[NH+](C)CC(C)(C)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000074441969	406912751	/nfs/dbraw/zinc/91/27/51/406912751.db2.gz	UVDMVQMTCJRCEY-UHFFFAOYSA-N	1	1	319.365	1.789	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@H]([C@@H]3CCCO3)C2)cc1	ZINC000089153782	407125237	/nfs/dbraw/zinc/12/52/37/407125237.db2.gz	LMICUORNKNXPPL-HOTGVXAUSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@H]([C@@H]3CCCO3)C2)cc1	ZINC000089153782	407125240	/nfs/dbraw/zinc/12/52/40/407125240.db2.gz	LMICUORNKNXPPL-HOTGVXAUSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=C(NC[C@H]1C[N@@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000090465493	407168077	/nfs/dbraw/zinc/16/80/77/407168077.db2.gz	DLHBHDLOSCFXCP-MNOVXSKESA-N	1	1	309.322	1.171	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCCC[C@@H]2CO1)c1ccc([N+](=O)[O-])o1	ZINC000090465493	407168079	/nfs/dbraw/zinc/16/80/79/407168079.db2.gz	DLHBHDLOSCFXCP-MNOVXSKESA-N	1	1	309.322	1.171	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C(C)C	ZINC000102897104	407328509	/nfs/dbraw/zinc/32/85/09/407328509.db2.gz	WVQNTRQKHNBNAT-UHFFFAOYSA-N	1	1	312.345	1.776	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000185774960	407499337	/nfs/dbraw/zinc/49/93/37/407499337.db2.gz	AQKWFDRVPVZNHT-ZJUUUORDSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-]	ZINC000185774960	407499345	/nfs/dbraw/zinc/49/93/45/407499345.db2.gz	AQKWFDRVPVZNHT-ZJUUUORDSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)c1[N+](=O)[O-]	ZINC000185774960	407499352	/nfs/dbraw/zinc/49/93/52/407499352.db2.gz	AQKWFDRVPVZNHT-ZJUUUORDSA-N	1	1	307.354	1.189	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000225316914	407581372	/nfs/dbraw/zinc/58/13/72/407581372.db2.gz	MEJMBFGNHDZNBO-ZDUSSCGKSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CCN(C)[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000225316914	407581378	/nfs/dbraw/zinc/58/13/78/407581378.db2.gz	MEJMBFGNHDZNBO-ZDUSSCGKSA-N	1	1	312.801	1.584	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H]1CCOC1	ZINC000178763724	407590540	/nfs/dbraw/zinc/59/05/40/407590540.db2.gz	MZHMXAORDXUXKO-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H]1CCOC1	ZINC000178760060	407591110	/nfs/dbraw/zinc/59/11/10/407591110.db2.gz	FNNGOLQTRZYCFE-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000171127661	407607575	/nfs/dbraw/zinc/60/75/75/407607575.db2.gz	KCTUOGATBLIJHQ-UHFFFAOYSA-N	1	1	320.349	1.384	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@H]1C	ZINC000117295014	407828176	/nfs/dbraw/zinc/82/81/76/407828176.db2.gz	WUISOKGMAHPNAD-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@H]1C	ZINC000117295014	407828179	/nfs/dbraw/zinc/82/81/79/407828179.db2.gz	WUISOKGMAHPNAD-CYBMUJFWSA-N	1	1	321.377	1.696	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC[N@@H+]1CCO	ZINC000187298901	407842609	/nfs/dbraw/zinc/84/26/09/407842609.db2.gz	LUKSVFFKQPLLRU-KTRBRXNASA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000187298901	407842615	/nfs/dbraw/zinc/84/26/15/407842615.db2.gz	LUKSVFFKQPLLRU-KTRBRXNASA-N	1	1	319.361	1.133	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000118494668	407920014	/nfs/dbraw/zinc/92/00/14/407920014.db2.gz	WUBQLYLMQQJZNM-SNVBAGLBSA-N	1	1	322.321	1.493	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000268188249	407937099	/nfs/dbraw/zinc/93/70/99/407937099.db2.gz	YSLYYJPAQNBHQN-UHFFFAOYSA-N	1	1	313.354	1.513	20	5		DDBDMO
C[C@@H]1C[NH2+]CC[C@@H]1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000262812749	407941211	/nfs/dbraw/zinc/94/12/11/407941211.db2.gz	YLJQOWKADJRFJA-SCZZXKLOSA-N	1	1	317.342	1.010	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000245603908	408026235	/nfs/dbraw/zinc/02/62/35/408026235.db2.gz	XKLIMMWUUVNKCH-DZGCQCFKSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@@H]([N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000245603908	408026267	/nfs/dbraw/zinc/02/62/67/408026267.db2.gz	XKLIMMWUUVNKCH-DZGCQCFKSA-N	1	1	322.409	1.419	20	5		DDBDMO
CCN1CC[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)[C@@H](C)C1	ZINC000245603908	408026272	/nfs/dbraw/zinc/02/62/72/408026272.db2.gz	XKLIMMWUUVNKCH-DZGCQCFKSA-N	1	1	322.409	1.419	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000154377239	408027754	/nfs/dbraw/zinc/02/77/54/408027754.db2.gz	MJXZZJCNKWQYLU-CJNGLKHVSA-N	1	1	324.377	1.613	20	5		DDBDMO
C[N@@H+](CCOCc1ccccc1)CCn1ccc([N+](=O)[O-])n1	ZINC000154712611	408073477	/nfs/dbraw/zinc/07/34/77/408073477.db2.gz	IMLNNEIAWXTKLB-UHFFFAOYSA-N	1	1	304.350	1.940	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](CCOCC(F)F)C2)nc1	ZINC000189677552	408077162	/nfs/dbraw/zinc/07/71/62/408077162.db2.gz	VBZSFNHBNMBFGS-SNVBAGLBSA-N	1	1	316.308	1.758	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC1	ZINC000189722695	408090495	/nfs/dbraw/zinc/09/04/95/408090495.db2.gz	YWVTZMFIBSKNPA-LVDDQXARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000246258568	408194168	/nfs/dbraw/zinc/19/41/68/408194168.db2.gz	KNVDZKVPTDSYKV-VHDGCEQUSA-N	1	1	324.377	1.570	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000190191332	408185105	/nfs/dbraw/zinc/18/51/05/408185105.db2.gz	DZPKIAJOPBUWEM-UHFFFAOYSA-N	1	1	303.265	1.074	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1CO	ZINC000190440529	408246767	/nfs/dbraw/zinc/24/67/67/408246767.db2.gz	MYQNXVSWHMYHLY-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000263802368	408265476	/nfs/dbraw/zinc/26/54/76/408265476.db2.gz	TVSKRFHXOWNMJH-UHFFFAOYSA-N	1	1	320.349	1.384	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000155943624	408228885	/nfs/dbraw/zinc/22/88/85/408228885.db2.gz	HUBJICSKXCWNDC-MFKMUULPSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000155943624	408228890	/nfs/dbraw/zinc/22/88/90/408228890.db2.gz	HUBJICSKXCWNDC-MFKMUULPSA-N	1	1	313.379	1.279	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000121516683	408229593	/nfs/dbraw/zinc/22/95/93/408229593.db2.gz	QCZHVDCRFWLFDL-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269549186	408351652	/nfs/dbraw/zinc/35/16/52/408351652.db2.gz	XJARPNMCFVNIPB-GHMZBOCLSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269549186	408351657	/nfs/dbraw/zinc/35/16/57/408351657.db2.gz	XJARPNMCFVNIPB-GHMZBOCLSA-N	1	1	323.397	1.854	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269549186	408351661	/nfs/dbraw/zinc/35/16/61/408351661.db2.gz	XJARPNMCFVNIPB-GHMZBOCLSA-N	1	1	323.397	1.854	20	5		DDBDMO
COCCCNC(=O)C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000159477920	162148573	/nfs/dbraw/zinc/14/85/73/162148573.db2.gz	QJBBQGXUTYELRC-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
COCCCNC(=O)C[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1	ZINC000159477920	162148576	/nfs/dbraw/zinc/14/85/76/162148576.db2.gz	QJBBQGXUTYELRC-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@H+](C)C1CCCC1	ZINC000171576074	162225838	/nfs/dbraw/zinc/22/58/38/162225838.db2.gz	XCLUQTDWERMZDV-UHFFFAOYSA-N	1	1	306.366	1.902	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C	ZINC000172832756	162307165	/nfs/dbraw/zinc/30/71/65/162307165.db2.gz	QCHLORYYCVBTDK-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000172940892	162311678	/nfs/dbraw/zinc/31/16/78/162311678.db2.gz	XYVJLBNPFBYHTD-ZDUSSCGKSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@@H](CN2CCOCC2)C1	ZINC000172940892	162311681	/nfs/dbraw/zinc/31/16/81/162311681.db2.gz	XYVJLBNPFBYHTD-ZDUSSCGKSA-N	1	1	323.368	1.888	20	5		DDBDMO
Cc1cc(C(=O)NCCC[N@H+](C)C(C)C)c(N)c([N+](=O)[O-])c1	ZINC000264219779	408410472	/nfs/dbraw/zinc/41/04/72/408410472.db2.gz	JRJNRDITMCKAMQ-UHFFFAOYSA-N	1	1	308.382	1.946	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCC[C@H](C)C2)n1	ZINC000191772693	408487787	/nfs/dbraw/zinc/48/77/87/408487787.db2.gz	CYNJYGWUYIRUAQ-NSHDSACASA-N	1	1	309.370	1.273	20	5		DDBDMO
COc1cc(C[NH2+][C@H](C(N)=O)C(C)(C)C)c([N+](=O)[O-])cc1F	ZINC000184255755	408578969	/nfs/dbraw/zinc/57/89/69/408578969.db2.gz	DZDMIVYSYIFENA-GFCCVEGCSA-N	1	1	313.329	1.732	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000248584174	408592034	/nfs/dbraw/zinc/59/20/34/408592034.db2.gz	QQHCYTHPSTUFMN-OUCADQQQSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@@H]1O	ZINC000275544150	408595118	/nfs/dbraw/zinc/59/51/18/408595118.db2.gz	ZLRIYRBXYMLJQS-ZFWWWQNUSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@@H+]1CC(C)(C)O	ZINC000192543032	408607961	/nfs/dbraw/zinc/60/79/61/408607961.db2.gz	UYPIGKHIUNQWTJ-SECBINFHSA-N	1	1	300.384	1.333	20	5		DDBDMO
C[C@@H]1CN(c2ncc([N+](=O)[O-])s2)CC[N@H+]1CC(C)(C)O	ZINC000192543032	408607969	/nfs/dbraw/zinc/60/79/69/408607969.db2.gz	UYPIGKHIUNQWTJ-SECBINFHSA-N	1	1	300.384	1.333	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@]3(C2)NC(=O)NC3=O)cccc1[N+](=O)[O-]	ZINC000192680936	408631418	/nfs/dbraw/zinc/63/14/18/408631418.db2.gz	CTAOZEDNXZEFTQ-OAHLLOKOSA-N	1	1	318.333	1.077	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@]3(C2)NC(=O)NC3=O)cccc1[N+](=O)[O-]	ZINC000192680936	408631424	/nfs/dbraw/zinc/63/14/24/408631424.db2.gz	CTAOZEDNXZEFTQ-OAHLLOKOSA-N	1	1	318.333	1.077	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000192742859	408642034	/nfs/dbraw/zinc/64/20/34/408642034.db2.gz	RJPIGXFLARZIPN-VOTSOKGWSA-N	1	1	319.361	1.399	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000270761445	408669827	/nfs/dbraw/zinc/66/98/27/408669827.db2.gz	MTKAFFZOLWEBHW-MNOVXSKESA-N	1	1	309.370	1.179	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CC2([NH+](C)C)CCC2)c1[N+](=O)[O-]	ZINC000275923722	408720888	/nfs/dbraw/zinc/72/08/88/408720888.db2.gz	UUPYKLJTYPFYEI-UHFFFAOYSA-N	1	1	323.397	1.998	20	5		DDBDMO
CS(=O)(=O)c1cccc(NCC(F)(F)C[NH3+])c1[N+](=O)[O-]	ZINC000162686783	408726706	/nfs/dbraw/zinc/72/67/06/408726706.db2.gz	HRXJMWMEPKLEAI-UHFFFAOYSA-N	1	1	309.294	1.004	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000185348428	408797259	/nfs/dbraw/zinc/79/72/59/408797259.db2.gz	PYSMSUBTOLIZLK-UHFFFAOYSA-N	1	1	310.354	1.339	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@@]3(CCOC3)C2)cc1	ZINC000185170918	408773510	/nfs/dbraw/zinc/77/35/10/408773510.db2.gz	RNNXSXOCVFASRQ-HNNXBMFYSA-N	1	1	308.334	1.465	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@@]3(CCOC3)C2)cc1	ZINC000185170918	408773515	/nfs/dbraw/zinc/77/35/15/408773515.db2.gz	RNNXSXOCVFASRQ-HNNXBMFYSA-N	1	1	308.334	1.465	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CCCCO)c([N+](=O)[O-])c1	ZINC000276223849	408826256	/nfs/dbraw/zinc/82/62/56/408826256.db2.gz	BMJLJVQOOXPDMQ-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CCCCO)c([N+](=O)[O-])c1	ZINC000276223849	408826257	/nfs/dbraw/zinc/82/62/57/408826257.db2.gz	BMJLJVQOOXPDMQ-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)c1	ZINC000285631148	408832398	/nfs/dbraw/zinc/83/23/98/408832398.db2.gz	AFKVZRCVMLADTK-GXSJLCMTSA-N	1	1	322.287	1.284	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000285704936	408847106	/nfs/dbraw/zinc/84/71/06/408847106.db2.gz	IYVGSUYMFUFCBY-KBPBESRZSA-N	1	1	305.334	1.140	20	5		DDBDMO
C[N@@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@H]2C1	ZINC000285826302	408871682	/nfs/dbraw/zinc/87/16/82/408871682.db2.gz	PDGPJDBCRMDJGP-VHSXEESVSA-N	1	1	311.363	1.201	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@H]2C1	ZINC000285826302	408871684	/nfs/dbraw/zinc/87/16/84/408871684.db2.gz	PDGPJDBCRMDJGP-VHSXEESVSA-N	1	1	311.363	1.201	20	5		DDBDMO
COc1cc(C(=O)NC[C@@H]2CC[N@@H+](C)C2)cc([N+](=O)[O-])c1C	ZINC000189208425	163089226	/nfs/dbraw/zinc/08/92/26/163089226.db2.gz	OLVGBTGYXMZFMG-NSHDSACASA-N	1	1	307.350	1.593	20	5		DDBDMO
CCc1n[nH]c(C2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)n1	ZINC000190676485	163152337	/nfs/dbraw/zinc/15/23/37/163152337.db2.gz	AAEDUSJJVBGPHY-UHFFFAOYSA-N	1	1	319.369	1.351	20	5		DDBDMO
CCc1nc(C2CC[NH+](CCn3cc([N+](=O)[O-])cn3)CC2)n[nH]1	ZINC000190676485	163152338	/nfs/dbraw/zinc/15/23/38/163152338.db2.gz	AAEDUSJJVBGPHY-UHFFFAOYSA-N	1	1	319.369	1.351	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)CO	ZINC000292141079	408988673	/nfs/dbraw/zinc/98/86/73/408988673.db2.gz	JNQYFQFKCHVJFA-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)CO	ZINC000292141079	408988674	/nfs/dbraw/zinc/98/86/74/408988674.db2.gz	JNQYFQFKCHVJFA-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)cc1[N+](=O)[O-]	ZINC000292269744	409013137	/nfs/dbraw/zinc/01/31/37/409013137.db2.gz	QARTYDXPLQBCIV-INIZCTEOSA-N	1	1	319.361	1.771	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1N1CC[C@H](C[NH+]2CCOCC2)C1	ZINC000287449633	409038187	/nfs/dbraw/zinc/03/81/87/409038187.db2.gz	VPIHIZZALMAQPN-GFCCVEGCSA-N	1	1	309.341	1.892	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCOCC2)CCN1c1ccc([N+](=O)[O-])cn1	ZINC000278814252	409094435	/nfs/dbraw/zinc/09/44/35/409094435.db2.gz	SOUQIJLIJFPBQK-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000279486157	409224257	/nfs/dbraw/zinc/22/42/57/409224257.db2.gz	RENRAPWRKUQVIZ-RNCFNFMXSA-N	1	1	324.356	1.728	20	5		DDBDMO
O=C(CCOc1ccccc1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000280337217	409294171	/nfs/dbraw/zinc/29/41/71/409294171.db2.gz	VUKNNQPDPOOOHL-UHFFFAOYSA-N	1	1	319.361	1.742	20	5		DDBDMO
CCS(=O)(=O)NCC[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285275087	409407847	/nfs/dbraw/zinc/40/78/47/409407847.db2.gz	IYCPSKQPPQFGNQ-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
CCS(=O)(=O)NCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285275087	409407850	/nfs/dbraw/zinc/40/78/50/409407850.db2.gz	IYCPSKQPPQFGNQ-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
NC(=O)c1ccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000317043685	164025214	/nfs/dbraw/zinc/02/52/14/164025214.db2.gz	VBVFLVVBINSNDH-RYUDHWBXSA-N	1	1	304.350	1.732	20	5		DDBDMO
Nc1c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000317417117	164027223	/nfs/dbraw/zinc/02/72/23/164027223.db2.gz	YIWQBNGOTMTALC-WDEREUQCSA-N	1	1	304.350	1.534	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)ccc1[N+](=O)[O-]	ZINC000317768834	164029181	/nfs/dbraw/zinc/02/91/81/164029181.db2.gz	QKAMYUGUZPNYOR-CHWSQXEVSA-N	1	1	307.350	1.879	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000356823130	409638795	/nfs/dbraw/zinc/63/87/95/409638795.db2.gz	SXFBKXSPSVGPIY-LBPRGKRZSA-N	1	1	309.366	1.819	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@@H+]1CCC[C@@H]1CO	ZINC000304220402	409581294	/nfs/dbraw/zinc/58/12/94/409581294.db2.gz	INAKFEYRYIZXMR-GFCCVEGCSA-N	1	1	321.333	1.350	20	5		DDBDMO
COc1c(C(=O)N(C)CC[N@@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000356776160	409595107	/nfs/dbraw/zinc/59/51/07/409595107.db2.gz	JSVWPNLFLWGWCR-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COC[C@]1(C)CC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000296788002	409642210	/nfs/dbraw/zinc/64/22/10/409642210.db2.gz	QNVUGJWMFUCFGU-OAHLLOKOSA-N	1	1	307.350	1.892	20	5		DDBDMO
COC[C@]1(C)CC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000296788002	409642222	/nfs/dbraw/zinc/64/22/22/409642222.db2.gz	QNVUGJWMFUCFGU-OAHLLOKOSA-N	1	1	307.350	1.892	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2[nH]nc(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000354406688	409832312	/nfs/dbraw/zinc/83/23/12/409832312.db2.gz	VZSMNDUYQDIFAZ-MWLCHTKSSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000354406688	409832319	/nfs/dbraw/zinc/83/23/19/409832319.db2.gz	VZSMNDUYQDIFAZ-MWLCHTKSSA-N	1	1	309.370	1.571	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2n[nH]c(C)c2[N+](=O)[O-])C[C@H]1C	ZINC000354406688	409832327	/nfs/dbraw/zinc/83/23/27/409832327.db2.gz	VZSMNDUYQDIFAZ-MWLCHTKSSA-N	1	1	309.370	1.571	20	5		DDBDMO
COc1cccc(C(=O)NCCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000338316002	409899865	/nfs/dbraw/zinc/89/98/65/409899865.db2.gz	FYLGIKHHYPAYAK-UHFFFAOYSA-N	1	1	318.333	1.928	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000338465843	410010860	/nfs/dbraw/zinc/01/08/60/410010860.db2.gz	YRIJECOQGZWOLW-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NC[C@@H]1CCC[N@@H+]1C	ZINC000357663689	410171330	/nfs/dbraw/zinc/17/13/30/410171330.db2.gz	LZSLZOLLHHSKLM-LBPRGKRZSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000355337101	410451971	/nfs/dbraw/zinc/45/19/71/410451971.db2.gz	PRRPGHRCWWRBDP-UHFFFAOYSA-N	1	1	303.362	1.906	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000358408009	410461753	/nfs/dbraw/zinc/46/17/53/410461753.db2.gz	GOLHVTBXCIUCER-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000347480440	410575731	/nfs/dbraw/zinc/57/57/31/410575731.db2.gz	RCPNUUPTIDFHAB-STQMWFEESA-N	1	1	312.366	1.427	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCCC[N@H+](C)C(C)C	ZINC000299518042	410595551	/nfs/dbraw/zinc/59/55/51/410595551.db2.gz	OHISQRNMOADBCJ-UHFFFAOYSA-N	1	1	311.386	1.336	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000343718213	410642684	/nfs/dbraw/zinc/64/26/84/410642684.db2.gz	CZLLPQJUQRXBKB-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN1C	ZINC000343718213	410642693	/nfs/dbraw/zinc/64/26/93/410642693.db2.gz	CZLLPQJUQRXBKB-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCC[N@H+](C)C2CCCCC2)c1[N+](=O)[O-]	ZINC000330530010	410753530	/nfs/dbraw/zinc/75/35/30/410753530.db2.gz	RIDFLTMJCAVRNQ-UHFFFAOYSA-N	1	1	309.370	1.621	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])cnn2C)[C@@H](C)C1	ZINC000330553635	410772479	/nfs/dbraw/zinc/77/24/79/410772479.db2.gz	CTZBMIFKUOKCGS-WDEREUQCSA-N	1	1	309.370	1.131	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000330565224	410781614	/nfs/dbraw/zinc/78/16/14/410781614.db2.gz	ACZKFZRTZIDVSU-QWHCGFSZSA-N	1	1	320.393	1.582	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000330569428	410785620	/nfs/dbraw/zinc/78/56/20/410785620.db2.gz	MCUIDYLCPHOQLE-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000301913966	410825789	/nfs/dbraw/zinc/82/57/89/410825789.db2.gz	CTKCXNPCPMXCNC-UHFFFAOYSA-N	1	1	315.337	1.669	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2C[C@@H]3CC[C@@H](O)[C@H]3C2)c1	ZINC000343995407	410875669	/nfs/dbraw/zinc/87/56/69/410875669.db2.gz	QISFDSGASFYJDQ-RUAUBTSSSA-N	1	1	322.361	1.037	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882402	410902013	/nfs/dbraw/zinc/90/20/13/410902013.db2.gz	ZSFLJIARVHBWQJ-MNOVXSKESA-N	1	1	309.341	2.000	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](C)C[C@H]1C)c1ccc([N+](=O)[O-])cc1F	ZINC000330882402	410902017	/nfs/dbraw/zinc/90/20/17/410902017.db2.gz	ZSFLJIARVHBWQJ-MNOVXSKESA-N	1	1	309.341	2.000	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)c1cnn(C)c1	ZINC000348307511	410910592	/nfs/dbraw/zinc/91/05/92/410910592.db2.gz	MARAAYRSUFFCHK-NSHDSACASA-N	1	1	317.349	1.926	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCN(C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331126543	410965557	/nfs/dbraw/zinc/96/55/57/410965557.db2.gz	HTGIQLWNOLWQDX-GFCCVEGCSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331126543	410965559	/nfs/dbraw/zinc/96/55/59/410965559.db2.gz	HTGIQLWNOLWQDX-GFCCVEGCSA-N	1	1	323.397	1.683	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[N@@H+](C)[C@@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000331126543	410965561	/nfs/dbraw/zinc/96/55/61/410965561.db2.gz	HTGIQLWNOLWQDX-GFCCVEGCSA-N	1	1	323.397	1.683	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](CO)C[C@H]1C	ZINC000344121036	410970830	/nfs/dbraw/zinc/97/08/30/410970830.db2.gz	DZRQLJBNZDCQAO-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](CO)C[C@H]1C	ZINC000344121036	410970836	/nfs/dbraw/zinc/97/08/36/410970836.db2.gz	DZRQLJBNZDCQAO-CHWSQXEVSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)[C@H](C)C1	ZINC000356284391	410943973	/nfs/dbraw/zinc/94/39/73/410943973.db2.gz	PBYBKJYFDVZRCO-VXGBXAGGSA-N	1	1	308.382	1.736	20	5		DDBDMO
C[NH+](C)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1	ZINC000134480996	196395628	/nfs/dbraw/zinc/39/56/28/196395628.db2.gz	KLNQWSYBJLRDDW-UHFFFAOYSA-N	1	1	303.322	1.310	20	5		DDBDMO
O=C(COc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000373929403	418474754	/nfs/dbraw/zinc/47/47/54/418474754.db2.gz	ORJPRKPDEMNBOV-OLZOCXBDSA-N	1	1	319.361	1.717	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@@H](C(N)=O)C2)n1	ZINC000360662144	418486849	/nfs/dbraw/zinc/48/68/49/418486849.db2.gz	FEAOBPVJDNDGKJ-GFCCVEGCSA-N	1	1	321.381	1.298	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)n1	ZINC000191648136	418522328	/nfs/dbraw/zinc/52/23/28/418522328.db2.gz	SZZHSEVRIDOBES-MNOVXSKESA-N	1	1	307.354	1.120	20	5		DDBDMO
Cc1c([C@@H]2CCC[N@H+]2CCn2ccc([N+](=O)[O-])n2)cnn1C	ZINC000360848406	418533817	/nfs/dbraw/zinc/53/38/17/418533817.db2.gz	KJNFMOQACJLTCD-ZDUSSCGKSA-N	1	1	304.354	1.670	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC000375057013	418597602	/nfs/dbraw/zinc/59/76/02/418597602.db2.gz	DPTNQYBJAPRMEX-SWLSCSKDSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])cc3)C[C@@H]21	ZINC000375057010	418598005	/nfs/dbraw/zinc/59/80/05/418598005.db2.gz	DPTNQYBJAPRMEX-DOMZBBRYSA-N	1	1	319.361	1.526	20	5		DDBDMO
CNc1c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000361220807	418607551	/nfs/dbraw/zinc/60/75/51/418607551.db2.gz	MNRSOIYXDAIYCS-GFCCVEGCSA-N	1	1	318.377	1.945	20	5		DDBDMO
CN(CC(=O)N[C@@H]1CC[N@H+](C2CC2)C1)c1ccccc1[N+](=O)[O-]	ZINC000361353925	418632718	/nfs/dbraw/zinc/63/27/18/418632718.db2.gz	JGDGPGWREBSERO-GFCCVEGCSA-N	1	1	318.377	1.384	20	5		DDBDMO
Nc1ccc(N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c[nH+]1	ZINC000344427538	418633522	/nfs/dbraw/zinc/63/35/22/418633522.db2.gz	FQTWWTLVLYKQFQ-UHFFFAOYSA-N	1	1	300.322	1.294	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000368240621	418708585	/nfs/dbraw/zinc/70/85/85/418708585.db2.gz	DHANKWIXMBMHNI-UPJWGTAASA-N	1	1	308.334	1.198	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000368240621	418708586	/nfs/dbraw/zinc/70/85/86/418708586.db2.gz	DHANKWIXMBMHNI-UPJWGTAASA-N	1	1	308.334	1.198	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@](C)(O)C[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000361463929	418657288	/nfs/dbraw/zinc/65/72/88/418657288.db2.gz	HRZLKUZCMRIETO-ZDUSSCGKSA-N	1	1	316.379	1.839	20	5		DDBDMO
COc1ccc(C[N@@H+](CCO)[C@H]2CCO[C@@H]2C)cc1[N+](=O)[O-]	ZINC000361563861	418679192	/nfs/dbraw/zinc/67/91/92/418679192.db2.gz	LMIMPQYUSNQCTM-YPMHNXCESA-N	1	1	310.350	1.575	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCOC1	ZINC000361575867	418682799	/nfs/dbraw/zinc/68/27/99/418682799.db2.gz	FKUGGPSGNIYVEV-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCOC1	ZINC000361575867	418682802	/nfs/dbraw/zinc/68/28/02/418682802.db2.gz	FKUGGPSGNIYVEV-CQSZACIVSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904683	418738457	/nfs/dbraw/zinc/73/84/57/418738457.db2.gz	PRYPEQPVFFEBJJ-DGCLKSJQSA-N	1	1	307.350	1.626	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000385904683	418738458	/nfs/dbraw/zinc/73/84/58/418738458.db2.gz	PRYPEQPVFFEBJJ-DGCLKSJQSA-N	1	1	307.350	1.626	20	5		DDBDMO
COc1ccc(NC(=O)CC[N@H+]2C[C@@H](O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000411420296	418902633	/nfs/dbraw/zinc/90/26/33/418902633.db2.gz	JIUDIBBQMPHMIF-MNOVXSKESA-N	1	1	323.349	1.387	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+](Cc2c([N+](=O)[O-])ncn2C)CC12CCC2	ZINC000373184759	418931051	/nfs/dbraw/zinc/93/10/51/418931051.db2.gz	XKQRDGBDSMYJOL-JTQLQIEISA-N	1	1	308.338	1.103	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cc2c([N+](=O)[O-])ncn2C)CC12CCC2	ZINC000373184759	418931052	/nfs/dbraw/zinc/93/10/52/418931052.db2.gz	XKQRDGBDSMYJOL-JTQLQIEISA-N	1	1	308.338	1.103	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411758361	419400117	/nfs/dbraw/zinc/40/01/17/419400117.db2.gz	NOIOCFHCQHWWOP-FZMZJTMJSA-N	1	1	307.350	1.769	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000417941280	419404141	/nfs/dbraw/zinc/40/41/41/419404141.db2.gz	MYLGOBGYWUBBDY-UHFFFAOYSA-N	1	1	302.281	1.031	20	5		DDBDMO
COc1cc(CN2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000426484128	419484001	/nfs/dbraw/zinc/48/40/01/419484001.db2.gz	KZIDLFIZJLALFQ-GFCCVEGCSA-N	1	1	309.366	1.102	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)C[C@H]1CCC[N@H+]1C	ZINC000421002727	419442229	/nfs/dbraw/zinc/44/22/29/419442229.db2.gz	MOXRGLXWLLBSRP-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](O)CC[C@H]2C)c([N+](=O)[O-])c1	ZINC000421026670	419455798	/nfs/dbraw/zinc/45/57/98/419455798.db2.gz	UODNIWIVZRKGLJ-NEPJUHHUSA-N	1	1	310.350	1.827	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1[nH]ncc1[N+](=O)[O-])CCC(F)(F)F	ZINC000427266952	419629193	/nfs/dbraw/zinc/62/91/93/419629193.db2.gz	MNIUHZNNJBBBGL-UHFFFAOYSA-N	1	1	323.275	1.322	20	5		DDBDMO
CC[N@H+](CCNC(=O)c1n[nH]cc1[N+](=O)[O-])CCC(F)(F)F	ZINC000427266952	419629212	/nfs/dbraw/zinc/62/92/12/419629212.db2.gz	MNIUHZNNJBBBGL-UHFFFAOYSA-N	1	1	323.275	1.322	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1n[nH]cc1[N+](=O)[O-])CCC(F)(F)F	ZINC000427266952	419629218	/nfs/dbraw/zinc/62/92/18/419629218.db2.gz	MNIUHZNNJBBBGL-UHFFFAOYSA-N	1	1	323.275	1.322	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@@H]([NH3+])C1CC1	ZINC000423317285	420011631	/nfs/dbraw/zinc/01/16/31/420011631.db2.gz	KGMTZPDVIJGKJM-IINYFYTJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](N)C1CC1	ZINC000423317285	420011636	/nfs/dbraw/zinc/01/16/36/420011636.db2.gz	KGMTZPDVIJGKJM-IINYFYTJSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CNCC[C@@H]1C	ZINC000423355972	420024949	/nfs/dbraw/zinc/02/49/49/420024949.db2.gz	GCHPJJCJACRMQK-YWPYICTPSA-N	1	1	320.393	1.900	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(N)c2F)[C@@H](C)C[N@@H+]1CCO	ZINC000418996946	420040918	/nfs/dbraw/zinc/04/09/18/420040918.db2.gz	FSHWWNFVEOOGTB-ZJUUUORDSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c(N)c2F)[C@@H](C)C[N@H+]1CCO	ZINC000418996946	420040922	/nfs/dbraw/zinc/04/09/22/420040922.db2.gz	FSHWWNFVEOOGTB-ZJUUUORDSA-N	1	1	312.345	1.207	20	5		DDBDMO
COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCOC1	ZINC000430239612	420094500	/nfs/dbraw/zinc/09/45/00/420094500.db2.gz	BFZHMHLSRPQHSE-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCOC1	ZINC000430239612	420094504	/nfs/dbraw/zinc/09/45/04/420094504.db2.gz	BFZHMHLSRPQHSE-CQSZACIVSA-N	1	1	310.350	1.841	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CO)(OC)CC1	ZINC000430247949	420095748	/nfs/dbraw/zinc/09/57/48/420095748.db2.gz	XKMWATCTAJNXTG-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](CN)C1	ZINC000420324817	420209513	/nfs/dbraw/zinc/20/95/13/420209513.db2.gz	BCNVERRSGCYPSH-DOMZBBRYSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](CN)C1	ZINC000420324817	420209515	/nfs/dbraw/zinc/20/95/15/420209515.db2.gz	BCNVERRSGCYPSH-DOMZBBRYSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(C[NH3+])CC1	ZINC000430606786	420155936	/nfs/dbraw/zinc/15/59/36/420155936.db2.gz	WKNUSTXGPUXZOS-NSHDSACASA-N	1	1	306.366	1.593	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000420766108	420383417	/nfs/dbraw/zinc/38/34/17/420383417.db2.gz	LWBQONSKGARSOZ-GFCCVEGCSA-N	1	1	313.379	1.310	20	5		DDBDMO
CN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000444979772	230147713	/nfs/dbraw/zinc/14/77/13/230147713.db2.gz	AYEUQKMBXFCPBD-NSHDSACASA-N	1	1	306.322	1.004	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000450800283	420533475	/nfs/dbraw/zinc/53/34/75/420533475.db2.gz	YOOHJBGKHKWIBU-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000450800283	420533479	/nfs/dbraw/zinc/53/34/79/420533479.db2.gz	YOOHJBGKHKWIBU-TXEJJXNPSA-N	1	1	321.377	1.689	20	5		DDBDMO
C[C@H](NC(=O)NC[C@@]1(O)CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000458894430	420756621	/nfs/dbraw/zinc/75/66/21/420756621.db2.gz	YJCZUGXBDWYSHD-NHYWBVRUSA-N	1	1	322.365	1.022	20	5		DDBDMO
CCC1C[NH+](Cc2ccc(OCC(=O)OC)c([N+](=O)[O-])c2)C1	ZINC000453601316	420734683	/nfs/dbraw/zinc/73/46/83/420734683.db2.gz	GQCQMVLPXCWEED-UHFFFAOYSA-N	1	1	308.334	1.988	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488725258	421107416	/nfs/dbraw/zinc/10/74/16/421107416.db2.gz	ALCAOBWMBAYRQG-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](CO)[C@H]1C	ZINC000488725258	421107417	/nfs/dbraw/zinc/10/74/17/421107417.db2.gz	ALCAOBWMBAYRQG-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000450279456	421176443	/nfs/dbraw/zinc/17/64/43/421176443.db2.gz	VHGUUFITBFQCBR-GFCCVEGCSA-N	1	1	319.361	1.959	20	5		DDBDMO
COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H]1CCOC1	ZINC000490075666	421188251	/nfs/dbraw/zinc/18/82/51/421188251.db2.gz	YSMONSYUAYDLQL-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H]1CCOC1	ZINC000490075666	421188252	/nfs/dbraw/zinc/18/82/52/421188252.db2.gz	YSMONSYUAYDLQL-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000561147299	421309230	/nfs/dbraw/zinc/30/92/30/421309230.db2.gz	LSQQBNPFQVFXIR-GFCCVEGCSA-N	1	1	321.377	1.699	20	5		DDBDMO
C[N@@H+]([C@@H]1CCC[C@H]1O)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000511586256	421433245	/nfs/dbraw/zinc/43/32/45/421433245.db2.gz	QQJFICOFDACSCV-QLFBSQMISA-N	1	1	319.361	1.545	20	5		DDBDMO
CC1(C)CCC[N@@H+](CCNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000567289864	421611299	/nfs/dbraw/zinc/61/12/99/421611299.db2.gz	RRIGNTIMCUBKAU-UHFFFAOYSA-N	1	1	321.381	1.424	20	5		DDBDMO
CNc1ccc(C(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000531482990	421634600	/nfs/dbraw/zinc/63/46/00/421634600.db2.gz	JXPUARZCZCYKNO-PWSUYJOCSA-N	1	1	318.377	1.992	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)C(=O)N(C)C	ZINC000555926200	421694758	/nfs/dbraw/zinc/69/47/58/421694758.db2.gz	CBWNZIMLOZRKFM-UHFFFAOYSA-N	1	1	322.365	1.298	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000542778313	421828682	/nfs/dbraw/zinc/82/86/82/421828682.db2.gz	KUWDZIAQYYHDGQ-UKRRQHHQSA-N	1	1	318.377	1.830	20	5		DDBDMO
COc1ccc(CNC(=O)C[N@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000582130958	422117724	/nfs/dbraw/zinc/11/77/24/422117724.db2.gz	SDBWSRGMIFILSV-LLVKDONJSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC[NH2+]CCCN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000574799846	422183540	/nfs/dbraw/zinc/18/35/40/422183540.db2.gz	LLIIWLOEVRVWOA-LBPRGKRZSA-N	1	1	308.382	1.901	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1C[C@H](C)O	ZINC000574857981	422196163	/nfs/dbraw/zinc/19/61/63/422196163.db2.gz	OSHACRCQLAQGLC-QWRGUYRKSA-N	1	1	312.345	1.410	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1C[C@H](C)O	ZINC000574857981	422196168	/nfs/dbraw/zinc/19/61/68/422196168.db2.gz	OSHACRCQLAQGLC-QWRGUYRKSA-N	1	1	312.345	1.410	20	5		DDBDMO
C[N@H+]1CC[C@H](Nc2ccc(N)c([N+](=O)[O-])n2)[C@@H]1c1ccccc1	ZINC000590582374	422319874	/nfs/dbraw/zinc/31/98/74/422319874.db2.gz	QUYRIZTUSIZDHK-ZFWWWQNUSA-N	1	1	313.361	2.429	20	5		DDBDMO
C[N@H+]1CC[C@@H](Nc2ccc(N)c([N+](=O)[O-])n2)[C@@H]1c1ccccc1	ZINC000590582372	422320948	/nfs/dbraw/zinc/32/09/48/422320948.db2.gz	QUYRIZTUSIZDHK-HIFRSBDPSA-N	1	1	313.361	2.429	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000341776958	271209614	/nfs/dbraw/zinc/20/96/14/271209614.db2.gz	OHZWGOQWANFPEE-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](CCCO)c1ccccc1	ZINC000341873669	271228699	/nfs/dbraw/zinc/22/86/99/271228699.db2.gz	AGEVXFVMOIIZSO-ZDUSSCGKSA-N	1	1	304.350	1.932	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2[N@@H+](C)CCCC2(C)C)c1[N+](=O)[O-]	ZINC000344673729	272086842	/nfs/dbraw/zinc/08/68/42/272086842.db2.gz	MPZMOHGNPARIKT-JTQLQIEISA-N	1	1	309.370	1.477	20	5		DDBDMO
COCC[N@H+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)C[C@@H]1C	ZINC000275376325	274030246	/nfs/dbraw/zinc/03/02/46/274030246.db2.gz	OGKISFCVPGQIDW-LBPRGKRZSA-N	1	1	320.393	1.720	20	5		DDBDMO
COCC[N@@H+]1CCN(c2cc(OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000266443985	274030782	/nfs/dbraw/zinc/03/07/82/274030782.db2.gz	WNDAFMBMUUTCMA-LBPRGKRZSA-N	1	1	309.366	1.760	20	5		DDBDMO
COCC[N@H+]1CCN(c2cc(OC)ccc2[N+](=O)[O-])C[C@@H]1C	ZINC000266443985	274030784	/nfs/dbraw/zinc/03/07/84/274030784.db2.gz	WNDAFMBMUUTCMA-LBPRGKRZSA-N	1	1	309.366	1.760	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)CCN1c1ccnc2c1cccc2[N+](=O)[O-]	ZINC000450949262	274348945	/nfs/dbraw/zinc/34/89/45/274348945.db2.gz	AMDUUSOZTPNQDQ-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CC[N@@H+]4CCOC[C@H]4C3)ccnc21	ZINC000432178213	275039620	/nfs/dbraw/zinc/03/96/20/275039620.db2.gz	SSEJJHRUJLPYCK-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1cccc2c(N3CC[N@H+]4CCOC[C@H]4C3)ccnc21	ZINC000432178213	275039621	/nfs/dbraw/zinc/03/96/21/275039621.db2.gz	SSEJJHRUJLPYCK-GFCCVEGCSA-N	1	1	314.345	1.664	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000290920594	279360500	/nfs/dbraw/zinc/36/05/00/279360500.db2.gz	KILOQOKVQZKXNI-CYBMUJFWSA-N	1	1	322.409	1.876	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@@H]2C[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000264194751	280187800	/nfs/dbraw/zinc/18/78/00/280187800.db2.gz	OIXDPCHYZZQBJT-LLVKDONJSA-N	1	1	307.354	1.327	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000363052878	300204338	/nfs/dbraw/zinc/20/43/38/300204338.db2.gz	BFFUIIZGLKHCMK-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363052878	300204339	/nfs/dbraw/zinc/20/43/39/300204339.db2.gz	BFFUIIZGLKHCMK-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCCN1C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000363052878	300204340	/nfs/dbraw/zinc/20/43/40/300204340.db2.gz	BFFUIIZGLKHCMK-VNQPRFMTSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000367288880	300822968	/nfs/dbraw/zinc/82/29/68/300822968.db2.gz	ZOFNJOLSUALAAQ-GFCCVEGCSA-N	1	1	313.304	1.836	20	5		DDBDMO
C[C@@H]1[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC12CCOCC2	ZINC000368810577	301091673	/nfs/dbraw/zinc/09/16/73/301091673.db2.gz	OOECYWHQNRSTFQ-JSGCOSHPSA-N	1	1	324.381	1.043	20	5		DDBDMO
C[C@H]1[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CCC12CCOCC2	ZINC000368810579	301091826	/nfs/dbraw/zinc/09/18/26/301091826.db2.gz	OOECYWHQNRSTFQ-OCCSQVGLSA-N	1	1	324.381	1.043	20	5		DDBDMO
C[NH+]1CCN(C[C@H]2CCCN(c3ccc([N+](=O)[O-])cn3)C2)CC1	ZINC000369028597	301122202	/nfs/dbraw/zinc/12/22/02/301122202.db2.gz	XHQWPJFHGWCGLR-CQSZACIVSA-N	1	1	319.409	1.454	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]2Cn2cccn2)n1	ZINC000370027047	301261428	/nfs/dbraw/zinc/26/14/28/301261428.db2.gz	NMCWFPGRRKLTIT-ZDUSSCGKSA-N	1	1	304.354	1.543	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469400	301345864	/nfs/dbraw/zinc/34/58/64/301345864.db2.gz	CUEOTLHVBXFTEC-BEAPCOKYSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370469400	301345866	/nfs/dbraw/zinc/34/58/66/301345866.db2.gz	CUEOTLHVBXFTEC-BEAPCOKYSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469400	301345868	/nfs/dbraw/zinc/34/58/68/301345868.db2.gz	CUEOTLHVBXFTEC-BEAPCOKYSA-N	1	1	303.362	1.431	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2C[C@@H]3CCCCCC[C@H]32)c1	ZINC000375852255	302004653	/nfs/dbraw/zinc/00/46/53/302004653.db2.gz	WLCXRYGDGQNBPW-NWANDNLSSA-N	1	1	308.382	1.807	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@@H](C(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000377647965	302203167	/nfs/dbraw/zinc/20/31/67/302203167.db2.gz	WDRJPONZGXIKBW-CQSZACIVSA-N	1	1	307.350	1.320	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H](OCC(F)(F)F)C2)n1	ZINC000530905033	303220170	/nfs/dbraw/zinc/22/01/70/303220170.db2.gz	KWOWICGQEKQCFN-JTQLQIEISA-N	1	1	322.287	1.835	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](OCC(F)(F)F)C2)n1	ZINC000530905033	303220171	/nfs/dbraw/zinc/22/01/71/303220171.db2.gz	KWOWICGQEKQCFN-JTQLQIEISA-N	1	1	322.287	1.835	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000534349513	303332792	/nfs/dbraw/zinc/33/27/92/303332792.db2.gz	SMQHUBFECGTETN-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000534349513	303332794	/nfs/dbraw/zinc/33/27/94/303332794.db2.gz	SMQHUBFECGTETN-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
Nc1ccc(C(=O)NCc2c[nH+]c3n2CCCC3)cc1[N+](=O)[O-]	ZINC000375962591	307236261	/nfs/dbraw/zinc/23/62/61/307236261.db2.gz	GZHJKXVGZKHWCV-UHFFFAOYSA-N	1	1	315.333	1.640	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)n2)CC1	ZINC000378140212	307282843	/nfs/dbraw/zinc/28/28/43/307282843.db2.gz	SPVCFUPJMVQCLD-UHFFFAOYSA-N	1	1	308.382	1.847	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3nc4sccn4c3[N+](=O)[O-])[C@H]2C1	ZINC000408028070	307298417	/nfs/dbraw/zinc/29/84/17/307298417.db2.gz	CJENSKMOUNEANE-VHSXEESVSA-N	1	1	323.378	1.213	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@H](C)[N@H+]2CCCC[C@H]2C)n1	ZINC000427252854	307302945	/nfs/dbraw/zinc/30/29/45/307302945.db2.gz	ZBACYSYQQBXXMY-NEPJUHHUSA-N	1	1	323.397	1.804	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])c1	ZINC000488733443	484217793	/nfs/dbraw/zinc/21/77/93/484217793.db2.gz	JJHVGGFPYLKBLG-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])c1	ZINC000488733443	484217797	/nfs/dbraw/zinc/21/77/97/484217797.db2.gz	JJHVGGFPYLKBLG-MNOVXSKESA-N	1	1	323.349	1.245	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000548390944	501075784	/nfs/dbraw/zinc/07/57/84/501075784.db2.gz	LVOQJUZFWLPTKQ-UHFFFAOYSA-N	1	1	319.296	1.419	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000598453198	501075989	/nfs/dbraw/zinc/07/59/89/501075989.db2.gz	PZCFVWQXZXBOJP-HNNXBMFYSA-N	1	1	319.361	1.266	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)CC[N@H+]1C	ZINC000330790358	533895997	/nfs/dbraw/zinc/89/59/97/533895997.db2.gz	AOGWGFBYFQORTF-NXEZZACHSA-N	1	1	307.354	1.127	20	5		DDBDMO
C[C@@H]1C[C@H]1[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)C[C@@H](C)C1	ZINC000428988700	534033960	/nfs/dbraw/zinc/03/39/60/534033960.db2.gz	ARZCVJZOSYXDDJ-UMVBOHGHSA-N	1	1	307.398	1.453	20	5		DDBDMO
Cc1nc(NCCN2CC[N@H+](C)C(C)(C)C2)ncc1[N+](=O)[O-]	ZINC000296691722	534489999	/nfs/dbraw/zinc/48/99/99/534489999.db2.gz	CYCNWUSMDNJKKH-UHFFFAOYSA-N	1	1	308.386	1.131	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@H]2CCC[N@H+]2CCCO)c1[N+](=O)[O-]	ZINC000452345522	534608294	/nfs/dbraw/zinc/60/82/94/534608294.db2.gz	FFOFPWADSJTUSW-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
CC[N@H+]1CC[C@@H](NC(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)C1	ZINC000412836461	527793259	/nfs/dbraw/zinc/79/32/59/527793259.db2.gz	ISOHBVHTMUDFFQ-LLVKDONJSA-N	1	1	323.349	1.436	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000820715714	599083897	/nfs/dbraw/zinc/08/38/97/599083897.db2.gz	DNGHYCJVMXTLAG-JTQLQIEISA-N	1	1	317.353	1.671	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-]	ZINC000736324695	598420490	/nfs/dbraw/zinc/42/04/90/598420490.db2.gz	HPRQLMWGUMSUQN-JTQLQIEISA-N	1	1	319.369	1.917	20	5		DDBDMO
CNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)CCCC1	ZINC000797518950	700012956	/nfs/dbraw/zinc/01/29/56/700012956.db2.gz	PAGLREXIJQKFNG-UHFFFAOYSA-N	1	1	307.350	1.752	20	5		DDBDMO
C[N@H+](C[C@@H]1CCCOC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000107672340	696631618	/nfs/dbraw/zinc/63/16/18/696631618.db2.gz	DBIMZUJLVLFSJQ-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCCOC1)Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000107672340	696631620	/nfs/dbraw/zinc/63/16/20/696631620.db2.gz	DBIMZUJLVLFSJQ-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
CC(=O)OC1CC[NH+](Cn2ncc3cc([N+](=O)[O-])ccc32)CC1	ZINC000156884383	696969679	/nfs/dbraw/zinc/96/96/79/696969679.db2.gz	SPIOVFVKJSAURL-UHFFFAOYSA-N	1	1	318.333	1.930	20	5		DDBDMO
O=c1cc2c(n[nH]1)CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000775777998	698031248	/nfs/dbraw/zinc/03/12/48/698031248.db2.gz	STIZPTWHCBAIMG-AWEZNQCLSA-N	1	1	316.317	1.182	20	5		DDBDMO
CCOC[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749959911	700195493	/nfs/dbraw/zinc/19/54/93/700195493.db2.gz	SEKHETXHGGGZQL-LBPRGKRZSA-N	1	1	319.365	1.964	20	5		DDBDMO
CCCNC(=O)C[N@H+](CCC)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579868	698120586	/nfs/dbraw/zinc/12/05/86/698120586.db2.gz	PAFXLQSBDZICOM-HNNXBMFYSA-N	1	1	323.393	1.866	20	5		DDBDMO
CCCNC(=O)C[N@@H+](CCC)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776579868	698120591	/nfs/dbraw/zinc/12/05/91/698120591.db2.gz	PAFXLQSBDZICOM-HNNXBMFYSA-N	1	1	323.393	1.866	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000776604704	698125745	/nfs/dbraw/zinc/12/57/45/698125745.db2.gz	FDFSJJPFMMKITK-MNOVXSKESA-N	1	1	308.256	1.483	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C[C@H](O)C(F)(F)F	ZINC000776604704	698125747	/nfs/dbraw/zinc/12/57/47/698125747.db2.gz	FDFSJJPFMMKITK-MNOVXSKESA-N	1	1	308.256	1.483	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@H](n3cncn3)C2)cc1	ZINC000776879239	698145195	/nfs/dbraw/zinc/14/51/95/698145195.db2.gz	SKVWYKBZUYXXPZ-KBPBESRZSA-N	1	1	303.322	1.167	20	5		DDBDMO
CNc1ccc(C(=O)OCCC[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000750874257	700252280	/nfs/dbraw/zinc/25/22/80/700252280.db2.gz	DTLKTSMYFZXNQJ-UHFFFAOYSA-N	1	1	323.349	1.516	20	5		DDBDMO
O=C1CC2(CCC2)N1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000782860262	698774005	/nfs/dbraw/zinc/77/40/05/698774005.db2.gz	OKRZGKIPIORLCZ-UHFFFAOYSA-N	1	1	319.365	1.541	20	5		DDBDMO
C[C@H]1CC(=O)N(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000782859647	698774013	/nfs/dbraw/zinc/77/40/13/698774013.db2.gz	IQPDYVQCHGUEGB-NSHDSACASA-N	1	1	307.354	1.254	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1C	ZINC000787328291	699206049	/nfs/dbraw/zinc/20/60/49/699206049.db2.gz	QKQBRDZKFRECBF-HONMWMINSA-N	1	1	308.334	1.512	20	5		DDBDMO
C[C@@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1C	ZINC000742195524	699865085	/nfs/dbraw/zinc/86/50/85/699865085.db2.gz	PQWAYABJTPZLTN-LLVKDONJSA-N	1	1	309.391	1.849	20	5		DDBDMO
C[C@@H]1CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000742195524	699865088	/nfs/dbraw/zinc/86/50/88/699865088.db2.gz	PQWAYABJTPZLTN-LLVKDONJSA-N	1	1	309.391	1.849	20	5		DDBDMO
O=C(CC[N@@H+]1CCOCC12CC2)Nc1cc([N+](=O)[O-])ccc1F	ZINC000801981893	700362268	/nfs/dbraw/zinc/36/22/68/700362268.db2.gz	VXWNPUGSWCWWBH-UHFFFAOYSA-N	1	1	323.324	1.927	20	5		DDBDMO
O=C(CC[N@H+]1CCOCC12CC2)Nc1cc([N+](=O)[O-])ccc1F	ZINC000801981893	700362271	/nfs/dbraw/zinc/36/22/71/700362271.db2.gz	VXWNPUGSWCWWBH-UHFFFAOYSA-N	1	1	323.324	1.927	20	5		DDBDMO
Cc1[nH+]ccn1-c1ncccc1CNc1ncc([N+](=O)[O-])cn1	ZINC000760581358	700815060	/nfs/dbraw/zinc/81/50/60/700815060.db2.gz	YOQOZXAFKWUFLO-UHFFFAOYSA-N	1	1	311.305	1.886	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@H](CO)C3CC3)o2)cc1	ZINC000763065892	700923620	/nfs/dbraw/zinc/92/36/20/700923620.db2.gz	HJZULXFKCIFUNJ-GFCCVEGCSA-N	1	1	304.306	1.505	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000771407591	701318800	/nfs/dbraw/zinc/31/88/00/701318800.db2.gz	RRVCBVIPLPVKEN-RYUDHWBXSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000771407591	701318801	/nfs/dbraw/zinc/31/88/01/701318801.db2.gz	RRVCBVIPLPVKEN-RYUDHWBXSA-N	1	1	320.393	1.825	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CCC[N@H+]2Cc2ccccc21	ZINC000841066295	702333136	/nfs/dbraw/zinc/33/31/36/702333136.db2.gz	ZYVJESPAMCDDBT-UMVBOHGHSA-N	1	1	301.346	1.663	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3nc4ccccn4c3[N+](=O)[O-])C2)C1	ZINC000813635638	702388086	/nfs/dbraw/zinc/38/80/86/702388086.db2.gz	AHDHBKLIAMWTCE-OAHLLOKOSA-N	1	1	301.350	1.775	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](COC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000842831984	702781331	/nfs/dbraw/zinc/78/13/31/702781331.db2.gz	RBAKTGUMUXOBEL-ZDUSSCGKSA-N	1	1	324.381	1.845	20	5		DDBDMO
CCCN(C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000843987272	702949294	/nfs/dbraw/zinc/94/92/94/702949294.db2.gz	DLDPBLSKNZATNL-GJZGRUSLSA-N	1	1	321.377	1.571	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]2C1=O	ZINC000879534251	706711140	/nfs/dbraw/zinc/71/11/40/706711140.db2.gz	NVOBMLXQQLQDNZ-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
CN1C(=O)[C@H]2C[N@@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]2C1=O	ZINC000879534251	706711141	/nfs/dbraw/zinc/71/11/41/706711141.db2.gz	NVOBMLXQQLQDNZ-PHIMTYICSA-N	1	1	323.736	1.295	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000869786230	703853536	/nfs/dbraw/zinc/85/35/36/703853536.db2.gz	XXYVNVJCTHRLEQ-LBPRGKRZSA-N	1	1	307.350	1.170	20	5		DDBDMO
CO[C@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870880781	704155962	/nfs/dbraw/zinc/15/59/62/704155962.db2.gz	ONDRRDOGHYQEBH-ZFWWWQNUSA-N	1	1	307.350	1.406	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)[C@H](C)C2)c([N+](=O)[O-])cc1C	ZINC000853485661	704247497	/nfs/dbraw/zinc/24/74/97/704247497.db2.gz	NACBTAGHYXXBGC-GFCCVEGCSA-N	1	1	309.366	1.415	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)[C@H](C)C2)c([N+](=O)[O-])cc1C	ZINC000853485661	704247500	/nfs/dbraw/zinc/24/75/00/704247500.db2.gz	NACBTAGHYXXBGC-GFCCVEGCSA-N	1	1	309.366	1.415	20	5		DDBDMO
COc1cc(N2CCN(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])cc1C	ZINC000853537993	704262990	/nfs/dbraw/zinc/26/29/90/704262990.db2.gz	LNKSEPZIVHVEEL-UHFFFAOYSA-N	1	1	317.349	1.962	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)CO1	ZINC000853799557	704317025	/nfs/dbraw/zinc/31/70/25/704317025.db2.gz	MGYRYBZROIGGRQ-RYUDHWBXSA-N	1	1	319.365	1.764	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2nc3ccccn3c2[N+](=O)[O-])[C@@H](C)CO1	ZINC000853799557	704317027	/nfs/dbraw/zinc/31/70/27/704317027.db2.gz	MGYRYBZROIGGRQ-RYUDHWBXSA-N	1	1	319.365	1.764	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000854496264	704407901	/nfs/dbraw/zinc/40/79/01/704407901.db2.gz	CQBKREVRPGCUAO-UHFFFAOYSA-N	1	1	321.381	1.143	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000855164306	704471937	/nfs/dbraw/zinc/47/19/37/704471937.db2.gz	HZWMLGKGQDZONT-LLVKDONJSA-N	1	1	306.366	1.780	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)Cn2c(C)ncc2[N+](=O)[O-])C[C@@H]1C	ZINC000824221683	705402506	/nfs/dbraw/zinc/40/25/06/705402506.db2.gz	KTTOAVHLDWOZSH-PHIMTYICSA-N	1	1	309.370	1.041	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]21	ZINC000824893155	705553178	/nfs/dbraw/zinc/55/31/78/705553178.db2.gz	MCNAQRPXTBOSCX-RISCZKNCSA-N	1	1	306.322	1.639	20	5		DDBDMO
O=[N+]([O-])c1cccc(-n2cc(CCC[NH+]3CCOCC3)nn2)c1	ZINC000864621174	706215815	/nfs/dbraw/zinc/21/58/15/706215815.db2.gz	FBPASETYDKCWHL-UHFFFAOYSA-N	1	1	317.349	1.440	20	5		DDBDMO
Cn1nnnc1CC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000878206795	706327000	/nfs/dbraw/zinc/32/70/00/706327000.db2.gz	BGAKAMWITFKDEY-UHFFFAOYSA-N	1	1	310.745	1.446	20	5		DDBDMO
Cn1nnnc1CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000878206795	706327001	/nfs/dbraw/zinc/32/70/01/706327001.db2.gz	BGAKAMWITFKDEY-UHFFFAOYSA-N	1	1	310.745	1.446	20	5		DDBDMO
O=C1OC[C@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CCN12	ZINC000865617153	706478817	/nfs/dbraw/zinc/47/88/17/706478817.db2.gz	VSXNLICHYUPWAC-LLVKDONJSA-N	1	1	314.301	1.784	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510074	706528013	/nfs/dbraw/zinc/52/80/13/706528013.db2.gz	QSOZCALVQHWYFH-ZIAGYGMSSA-N	1	1	323.349	1.401	20	5		DDBDMO
CN(C)C(=O)O[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000830510074	706528015	/nfs/dbraw/zinc/52/80/15/706528015.db2.gz	QSOZCALVQHWYFH-ZIAGYGMSSA-N	1	1	323.349	1.401	20	5		DDBDMO
NC(=O)[C@H](F)C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1	ZINC000879048665	706573384	/nfs/dbraw/zinc/57/33/84/706573384.db2.gz	XUMVHTYKMWFMFI-CYBMUJFWSA-N	1	1	313.304	1.769	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)O)C1	ZINC000880146191	706891924	/nfs/dbraw/zinc/89/19/24/706891924.db2.gz	SFJFMPQBJHBXKV-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)O)C1	ZINC000880146191	706891928	/nfs/dbraw/zinc/89/19/28/706891928.db2.gz	SFJFMPQBJHBXKV-LBPRGKRZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCO[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CN(C)C	ZINC000926964185	712923360	/nfs/dbraw/zinc/92/33/60/712923360.db2.gz	WKIYALGJDGAGJN-DGCLKSJQSA-N	1	1	310.398	1.794	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(c2ccnc(F)c2[N+](=O)[O-])CC1	ZINC000881985568	707454882	/nfs/dbraw/zinc/45/48/82/707454882.db2.gz	OZXNVHIPYVQHJD-UHFFFAOYSA-N	1	1	312.345	1.412	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](C)N1CCN(C)CC1	ZINC000873044067	707706092	/nfs/dbraw/zinc/70/60/92/707706092.db2.gz	ASJQGEZKZQDMJT-AWEZNQCLSA-N	1	1	320.437	1.937	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000883468557	708009918	/nfs/dbraw/zinc/00/99/18/708009918.db2.gz	WHFFAAJYPHVNAU-CYBMUJFWSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc([N+](=O)[O-])cc1OC(F)F	ZINC000884825304	708388435	/nfs/dbraw/zinc/38/84/35/708388435.db2.gz	PESXUNDSOUYFRZ-UHFFFAOYSA-N	1	1	305.281	1.532	20	5		DDBDMO
O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885956115	708670986	/nfs/dbraw/zinc/67/09/86/708670986.db2.gz	JDUDKTOKEVNENP-AWEZNQCLSA-N	1	1	318.377	1.728	20	5		DDBDMO
O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000885956115	708670988	/nfs/dbraw/zinc/67/09/88/708670988.db2.gz	JDUDKTOKEVNENP-AWEZNQCLSA-N	1	1	318.377	1.728	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCn2nncc2C1	ZINC000886457536	708763455	/nfs/dbraw/zinc/76/34/55/708763455.db2.gz	DNBBQAOXBRRNGC-UHFFFAOYSA-N	1	1	317.349	1.991	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCCn2nncc2C1	ZINC000886457536	708763457	/nfs/dbraw/zinc/76/34/57/708763457.db2.gz	DNBBQAOXBRRNGC-UHFFFAOYSA-N	1	1	317.349	1.991	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000886863839	708870310	/nfs/dbraw/zinc/87/03/10/708870310.db2.gz	VLYVERXSWWUILU-NSHDSACASA-N	1	1	309.322	1.404	20	5		DDBDMO
C[N@@H+](CCO)CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000899728737	709178727	/nfs/dbraw/zinc/17/87/27/709178727.db2.gz	VXPAUDBZGBKYEF-UHFFFAOYSA-N	1	1	323.374	1.463	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090929	713126289	/nfs/dbraw/zinc/12/62/89/713126289.db2.gz	BJPIUVKPLGRILA-KOLCDFICSA-N	1	1	310.379	1.233	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])[nH]1	ZINC000928090929	713126290	/nfs/dbraw/zinc/12/62/90/713126290.db2.gz	BJPIUVKPLGRILA-KOLCDFICSA-N	1	1	310.379	1.233	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1Nc1cccc(C[NH+]2CCOCC2)c1	ZINC000892098580	710372071	/nfs/dbraw/zinc/37/20/71/710372071.db2.gz	IFNGTWKAULKRJT-UHFFFAOYSA-N	1	1	317.349	1.904	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000892417921	710434017	/nfs/dbraw/zinc/43/40/17/710434017.db2.gz	KGYDYGUNERFCSF-GJZGRUSLSA-N	1	1	318.377	1.973	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000928430891	713192291	/nfs/dbraw/zinc/19/22/91/713192291.db2.gz	JUQJTQLZXFDYKF-AQNFWKISSA-N	1	1	303.362	1.907	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@@H]1CC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318419	711095948	/nfs/dbraw/zinc/09/59/48/711095948.db2.gz	PMQIJENKOFUFDS-GJZGRUSLSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@@H]1CC[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318419	711095953	/nfs/dbraw/zinc/09/59/53/711095953.db2.gz	PMQIJENKOFUFDS-GJZGRUSLSA-N	1	1	315.377	1.711	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C[C@H]1C(C)(C)C	ZINC000912034946	711136422	/nfs/dbraw/zinc/13/64/22/711136422.db2.gz	XBBUNZDAYKYBFT-AWEZNQCLSA-N	1	1	320.393	1.979	20	5		DDBDMO
C[NH+]1CCC(CN2CCN(c3ncccc3[N+](=O)[O-])CC2)CC1	ZINC000894802020	711276230	/nfs/dbraw/zinc/27/62/30/711276230.db2.gz	LSQGQCWGQLCFOZ-UHFFFAOYSA-N	1	1	319.409	1.454	20	5		DDBDMO
CN1C[C@@H](CCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000895478109	711522138	/nfs/dbraw/zinc/52/21/38/711522138.db2.gz	HZRQNZHITRKAFA-NSHDSACASA-N	1	1	314.345	1.845	20	5		DDBDMO
C[C@H]1[C@H](Nc2c3ccccc3n(C)c(=O)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000895737550	711590886	/nfs/dbraw/zinc/59/08/86/711590886.db2.gz	BJCXSFDWTZCKML-CMPLNLGQSA-N	1	1	316.361	1.951	20	5		DDBDMO
Cc1cccc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC000896581026	711758186	/nfs/dbraw/zinc/75/81/86/711758186.db2.gz	FUJHYOMQCJFABI-OCCSQVGLSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1c(NC(=O)C2CN(C)CC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000905083904	711930643	/nfs/dbraw/zinc/93/06/43/711930643.db2.gz	IERYSRDHHKWWHL-UHFFFAOYSA-N	1	1	306.366	1.335	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C	ZINC000905984563	712209674	/nfs/dbraw/zinc/20/96/74/712209674.db2.gz	NCNNTYGLVNKZES-GMTAPVOTSA-N	1	1	309.370	1.039	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000913930631	713321485	/nfs/dbraw/zinc/32/14/85/713321485.db2.gz	KEDWXUQPKIHLSM-BXUZGUMPSA-N	1	1	321.381	1.399	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000913933987	713321967	/nfs/dbraw/zinc/32/19/67/713321967.db2.gz	YCFXHZKTPVRYJD-LLVKDONJSA-N	1	1	307.354	1.010	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)[C@]1(C)C[C@@H](O)C[N@H+]1C	ZINC000908123562	712693434	/nfs/dbraw/zinc/69/34/34/712693434.db2.gz	CUROJBWGSDJAMX-CJNGLKHVSA-N	1	1	321.377	1.051	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCO[C@@H]3CCOC3)CC2)c1	ZINC000929271409	713580275	/nfs/dbraw/zinc/58/02/75/713580275.db2.gz	XPSZIBGTVIWWMO-MRXNPFEDSA-N	1	1	321.377	1.522	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCC[N@H+](C)C1CCCCC1	ZINC000930785081	713920345	/nfs/dbraw/zinc/92/03/45/713920345.db2.gz	OHDXAVGORMMGNE-UHFFFAOYSA-N	1	1	323.397	1.480	20	5		DDBDMO
O=[N+]([O-])CCN1CCO[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]21	ZINC000930849527	713937082	/nfs/dbraw/zinc/93/70/82/713937082.db2.gz	NISJLVXVZGMSAN-HOTGVXAUSA-N	1	1	305.378	1.238	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H]1CCC[N@H+](C(C)C)C1	ZINC000931118450	714006221	/nfs/dbraw/zinc/00/62/21/714006221.db2.gz	TVANXVPILZAVAO-CYBMUJFWSA-N	1	1	323.397	1.336	20	5		DDBDMO
O=[N+]([O-])c1ncccc1CN1CCC([N@H+]2CCCOCC2)CC1	ZINC000931283928	714057538	/nfs/dbraw/zinc/05/75/38/714057538.db2.gz	HVOBSXMXQXQCEL-UHFFFAOYSA-N	1	1	320.393	1.677	20	5		DDBDMO
CCO[C@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000932972989	714446679	/nfs/dbraw/zinc/44/66/79/714446679.db2.gz	VSZWBNBHMVBEGI-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000932972989	714446682	/nfs/dbraw/zinc/44/66/82/714446682.db2.gz	VSZWBNBHMVBEGI-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)cc1	ZINC000934255066	714776205	/nfs/dbraw/zinc/77/62/05/714776205.db2.gz	OJJICVSFFDOSSH-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H]3[C@H]2CCCN3CCO)cc1	ZINC000934255066	714776207	/nfs/dbraw/zinc/77/62/07/714776207.db2.gz	OJJICVSFFDOSSH-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H]3[C@H]2CCCN3CCO)cc1	ZINC000934255066	714776209	/nfs/dbraw/zinc/77/62/09/714776209.db2.gz	OJJICVSFFDOSSH-HZPDHXFCSA-N	1	1	305.378	1.626	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3nc4ccccc4cc3[N+](=O)[O-])C[C@@H]21	ZINC000352355911	719413112	/nfs/dbraw/zinc/41/31/12/719413112.db2.gz	JIQZEOKLQLWFFL-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
N=c1cc(C[NH3+])ncn1-c1ccc([N+](=O)[O-])cc1C(F)(F)F	ZINC001167358612	733288513	/nfs/dbraw/zinc/28/85/13/733288513.db2.gz	WPQJXMOQAKHAOB-UHFFFAOYSA-N	1	1	313.239	1.737	20	5		DDBDMO
CC[NH2+]C[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001105423138	741452949	/nfs/dbraw/zinc/45/29/49/741452949.db2.gz	FRIFXMFDJUEKRN-ANQUJSFKSA-N	1	1	317.389	1.478	20	5		DDBDMO
O=C(NC1CC[NH+](CCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002788944	743431706	/nfs/dbraw/zinc/43/17/06/743431706.db2.gz	QKEDARKJHJOUBG-NXEZZACHSA-N	1	1	309.288	1.185	20	5		DDBDMO
CCN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)C[N@@H+](C)C(C)C	ZINC001106778559	746063659	/nfs/dbraw/zinc/06/36/59/746063659.db2.gz	CJXKLKXJCNWVCO-UHFFFAOYSA-N	1	1	323.397	1.590	20	5		DDBDMO
CCn1nnc(C)c1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC001194029250	746258162	/nfs/dbraw/zinc/25/81/62/746258162.db2.gz	CVQCLVLRHOYUPU-UHFFFAOYSA-N	1	1	319.369	1.548	20	5		DDBDMO
COCCC(=O)N1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001194622379	746427830	/nfs/dbraw/zinc/42/78/30/746427830.db2.gz	ZTIWMYZEZOEZLP-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
COCCC(=O)N1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001194622379	746427834	/nfs/dbraw/zinc/42/78/34/746427834.db2.gz	ZTIWMYZEZOEZLP-UHFFFAOYSA-N	1	1	321.377	1.666	20	5		DDBDMO
Cc1oncc1C[NH2+][C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001034644986	750627099	/nfs/dbraw/zinc/62/70/99/750627099.db2.gz	OWDGACUQXAVESP-AAVRWANBSA-N	1	1	322.365	1.165	20	5		DDBDMO
CCOC(=O)[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)C1CCOCC1	ZINC001168977384	762147622	/nfs/dbraw/zinc/14/76/22/762147622.db2.gz	BDBHWWROLXYGIF-KWCYVHTRSA-N	1	1	314.382	1.380	20	5		DDBDMO
Cc1ncc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC001086082503	760941878	/nfs/dbraw/zinc/94/18/78/760941878.db2.gz	RNUWYYRISSVKLE-LYIQGSDWSA-N	1	1	324.406	1.101	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347079	766277973	/nfs/dbraw/zinc/27/79/73/766277973.db2.gz	QAHMXNMPQXBTEB-SMDDNHRTSA-N	1	1	321.377	1.874	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170347079	766277976	/nfs/dbraw/zinc/27/79/76/766277976.db2.gz	QAHMXNMPQXBTEB-SMDDNHRTSA-N	1	1	321.377	1.874	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@@H+]2CCn3nncc3C2)c([N+](=O)[O-])c1	ZINC001170350686	766279956	/nfs/dbraw/zinc/27/99/56/766279956.db2.gz	CCLYZZUYHRZTDI-NSHDSACASA-N	1	1	317.349	1.642	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCn3nncc3C2)c([N+](=O)[O-])c1	ZINC001170350686	766279960	/nfs/dbraw/zinc/27/99/60/766279960.db2.gz	CCLYZZUYHRZTDI-NSHDSACASA-N	1	1	317.349	1.642	20	5		DDBDMO
CCOC(=O)C1=C(Nc2nc(C)ccc2[N+](=O)[O-])CC[NH2+]C1	ZINC001170518018	767757949	/nfs/dbraw/zinc/75/79/49/767757949.db2.gz	XIRUPQRRXQNLCH-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
N[C@H](CCC[NH3+])Nc1cnc(Oc2ccc([N+](=O)[O-])cc2)nc1	ZINC001170900550	771898985	/nfs/dbraw/zinc/89/89/85/771898985.db2.gz	VWLAULQULYPFBP-ZDUSSCGKSA-N	1	1	318.337	1.613	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCCNC(=O)C[N@H+](C)C(C)C)n1	ZINC001094456656	775894788	/nfs/dbraw/zinc/89/47/88/775894788.db2.gz	LJKWYKSWASNREH-UHFFFAOYSA-N	1	1	323.397	1.557	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001094574237	776049284	/nfs/dbraw/zinc/04/92/84/776049284.db2.gz	SBODASJWLKPAOU-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
CCN(CCNC(=O)C[N@@H+](C)C(C)C)c1ccc([N+](=O)[O-])cn1	ZINC001100546945	776293075	/nfs/dbraw/zinc/29/30/75/776293075.db2.gz	ZZYVZCYLEQEUCL-UHFFFAOYSA-N	1	1	323.397	1.273	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172907597	776918058	/nfs/dbraw/zinc/91/80/58/776918058.db2.gz	GYVBLTOAYUESMD-HIFRSBDPSA-N	1	1	303.362	1.792	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2nncn2CC1	ZINC001173219951	777052568	/nfs/dbraw/zinc/05/25/68/777052568.db2.gz	ADLGVROIAJEPEF-GFCCVEGCSA-N	1	1	301.350	1.676	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+]([C@@H]2CCOC2)CC1	ZINC001173224859	777059492	/nfs/dbraw/zinc/05/94/92/777059492.db2.gz	HLLUUNVAUXLRFI-RHSMWYFYSA-N	1	1	319.405	1.932	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)N(C)CCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001101757025	777479556	/nfs/dbraw/zinc/47/95/56/777479556.db2.gz	WICGULUQGKZIFB-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
O=C(CN1CCCC1)NCCC[NH2+]Cc1ccccc1[N+](=O)[O-]	ZINC001176102741	778047220	/nfs/dbraw/zinc/04/72/20/778047220.db2.gz	KFMUKXASZLAYJJ-UHFFFAOYSA-N	1	1	320.393	1.287	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC001178857451	779213257	/nfs/dbraw/zinc/21/32/57/779213257.db2.gz	VLERTWXNAUWGJQ-CQSZACIVSA-N	1	1	321.377	1.820	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC001119948624	781693553	/nfs/dbraw/zinc/69/35/53/781693553.db2.gz	QELVHAFMNDOANR-AAEUAGOBSA-N	1	1	305.382	1.781	20	5		DDBDMO
C[C@H](c1nnc(N2CC[N@@H+](C)C(C)(C)C2)n1CC1CC1)[N+](=O)[O-]	ZINC001123415781	859225671	/nfs/dbraw/zinc/22/56/71/859225671.db2.gz	UTWPJLCXBMSDOV-LLVKDONJSA-N	1	1	322.413	1.556	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC001124109342	859583713	/nfs/dbraw/zinc/58/37/13/859583713.db2.gz	MLWUUPLRAARESF-RWMBFGLXSA-N	1	1	318.377	1.707	20	5		DDBDMO
Cc1cc(F)ccc1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767689	864118057	/nfs/dbraw/zinc/11/80/57/864118057.db2.gz	RNWDKXCCDVXZAZ-ZIAGYGMSSA-N	1	1	309.341	1.395	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001158784420	864906844	/nfs/dbraw/zinc/90/68/44/864906844.db2.gz	FSPZDJAEJDTNSX-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H]3CC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001158784420	864906850	/nfs/dbraw/zinc/90/68/50/864906850.db2.gz	FSPZDJAEJDTNSX-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H]3CC[N@@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001158784420	864906855	/nfs/dbraw/zinc/90/68/55/864906855.db2.gz	FSPZDJAEJDTNSX-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
COc1nc(N[C@@H]2CCC[C@@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160722694	866068452	/nfs/dbraw/zinc/06/84/52/866068452.db2.gz	IDZJJQQQALMZNO-NEPJUHHUSA-N	1	1	322.365	1.664	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[NH+](C(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC001323521909	866662632	/nfs/dbraw/zinc/66/26/32/866662632.db2.gz	SCBUPAHBZUBCBP-UHFFFAOYSA-N	1	1	309.370	1.193	20	5		DDBDMO
O=[N+]([O-])c1cnccc1N1CC[NH+](CCc2ccncc2)CC1	ZINC001333776064	867003861	/nfs/dbraw/zinc/00/38/61/867003861.db2.gz	CCWIKNPCXXQBDL-UHFFFAOYSA-N	1	1	313.361	1.750	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCC([N@@H+](C)CCCO)CC1	ZINC001321825292	867818395	/nfs/dbraw/zinc/81/83/95/867818395.db2.gz	JBKVHIOEZBFCDT-UHFFFAOYSA-N	1	1	308.382	1.581	20	5		DDBDMO
Cc1c([N+](=O)[O-])cc[n+]([O-])c1NCC[C@@H]1CC[NH2+]CC1(F)F	ZINC001162812730	867846439	/nfs/dbraw/zinc/84/64/39/867846439.db2.gz	NXIXDFKIFICMCK-JTQLQIEISA-N	1	1	316.308	1.583	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC001335565334	868386834	/nfs/dbraw/zinc/38/68/34/868386834.db2.gz	HYCRISVRUHFJHN-ZIAGYGMSSA-N	1	1	306.366	1.334	20	5		DDBDMO
CC(C)[N@H+]1CCN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C[C@H]1C	ZINC001165200464	869423935	/nfs/dbraw/zinc/42/39/35/869423935.db2.gz	ZNVHDCJYRWKCSF-SNVBAGLBSA-N	1	1	314.773	1.801	20	5		DDBDMO
CCOc1nc(N2CCn3c(C)[nH+]cc3C2)ccc1[N+](=O)[O-]	ZINC001165384179	869556852	/nfs/dbraw/zinc/55/68/52/869556852.db2.gz	DFNNZNQOJMXIFZ-UHFFFAOYSA-N	1	1	303.322	1.914	20	5		DDBDMO
Nc1cc(N2CCC([N@H+]3CCCOCC3)CC2)ncc1[N+](=O)[O-]	ZINC001337911289	869685083	/nfs/dbraw/zinc/68/50/83/869685083.db2.gz	XEQRGNKXYHLFMU-UHFFFAOYSA-N	1	1	321.381	1.263	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC001338464796	869992226	/nfs/dbraw/zinc/99/22/26/869992226.db2.gz	QRRKFOLAYBPVNA-YUTCNCBUSA-N	1	1	321.352	1.733	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3c(F)cccc3[N+](=O)[O-])[C@H]2C1	ZINC001338463880	869993038	/nfs/dbraw/zinc/99/30/38/869993038.db2.gz	NPNWPZZTTRJZBA-JBLDHEPKSA-N	1	1	307.325	1.804	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]CCC(F)(F)F)CC1	ZINC001205224673	871443669	/nfs/dbraw/zinc/44/36/69/871443669.db2.gz	WHZBPBMTUDMIPF-GHMZBOCLSA-N	1	1	323.315	1.432	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])[C@H]1[NH2+]CCc2occc21	ZINC001341451900	871663115	/nfs/dbraw/zinc/66/31/15/871663115.db2.gz	UINGDVPGUUVPSI-AWEZNQCLSA-N	1	1	301.302	1.691	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001318836460	872294724	/nfs/dbraw/zinc/29/47/24/872294724.db2.gz	DTIXZLZBFXRRGN-UHFFFAOYSA-N	1	1	322.365	1.198	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC001347181893	874044414	/nfs/dbraw/zinc/04/44/14/874044414.db2.gz	PYCSMZQRQUPWOS-LLVKDONJSA-N	1	1	308.382	1.813	20	5		DDBDMO
Cc1cc(NC(=O)N2CC([N@@H+]3CC[C@@H](O)C3)C2)cc([N+](=O)[O-])c1	ZINC001347890094	874301250	/nfs/dbraw/zinc/30/12/50/874301250.db2.gz	MLFLKONYKXOYGE-CQSZACIVSA-N	1	1	320.349	1.186	20	5		DDBDMO
Cc1cc(NC(=O)N2CC([N@H+]3CC[C@@H](O)C3)C2)cc([N+](=O)[O-])c1	ZINC001347890094	874301263	/nfs/dbraw/zinc/30/12/63/874301263.db2.gz	MLFLKONYKXOYGE-CQSZACIVSA-N	1	1	320.349	1.186	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000175249126	875871769	/nfs/dbraw/zinc/87/17/69/875871769.db2.gz	IVONJECVJHBZHT-CYBMUJFWSA-N	1	1	321.377	1.951	20	5		DDBDMO
Cc1nc(Cl)nc(O[C@H]2CCc3[nH+]ccn3C2)c1[N+](=O)[O-]	ZINC001227339726	882974249	/nfs/dbraw/zinc/97/42/49/882974249.db2.gz	JZTZNINDTISKMR-QMMMGPOBSA-N	1	1	309.713	1.937	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@H]2C1	ZINC001353381047	877291347	/nfs/dbraw/zinc/29/13/47/877291347.db2.gz	VCZPPKUIGIVHSD-SGMGOOAPSA-N	1	1	321.352	1.733	20	5		DDBDMO
CC(C)C(=O)NCC1CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001222387352	880433052	/nfs/dbraw/zinc/43/30/52/880433052.db2.gz	VZUCWUDQMLFFNY-UHFFFAOYSA-N	1	1	323.397	1.313	20	5		DDBDMO
COC(=O)c1ccc(COC2C[NH+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC001223412446	880952029	/nfs/dbraw/zinc/95/20/29/880952029.db2.gz	CWEXLSLMROWEIC-UHFFFAOYSA-N	1	1	308.334	1.991	20	5		DDBDMO
OC[C@@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@H]1O	ZINC001232219394	886166248	/nfs/dbraw/zinc/16/62/48/886166248.db2.gz	TZIRRFBKKKXJGR-GOEBONIOSA-N	1	1	309.369	1.568	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@@H+]1CC[C@](O)(CF)[C@@H](F)C1)C2	ZINC001254595706	896520728	/nfs/dbraw/zinc/52/07/28/896520728.db2.gz	YNCRIFUJDKGFDZ-ILXRZTDVSA-N	1	1	312.316	1.806	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)C[C@H]([N@H+]1CC[C@](O)(CF)[C@@H](F)C1)C2	ZINC001254595706	896520741	/nfs/dbraw/zinc/52/07/41/896520741.db2.gz	YNCRIFUJDKGFDZ-ILXRZTDVSA-N	1	1	312.316	1.806	20	5		DDBDMO
O=C1NCC[C@]12CC[N@H+]([C@@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254594361	896522472	/nfs/dbraw/zinc/52/24/72/896522472.db2.gz	QIINQQHGKCDKHJ-GDBMZVCRSA-N	1	1	301.346	1.274	20	5		DDBDMO
C[NH+](C)CCN1CCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001254600823	896524182	/nfs/dbraw/zinc/52/41/82/896524182.db2.gz	VKGFQKRLYPDEFL-QGZVFWFLSA-N	1	1	318.421	1.241	20	5		DDBDMO
O=[N+]([O-])c1cc2c(nc1N1CC([NH2+]C3COC3)C1)CCCC2	ZINC001307219481	916612373	/nfs/dbraw/zinc/61/23/73/916612373.db2.gz	NWJPQLKPZUTBRN-UHFFFAOYSA-N	1	1	304.350	1.046	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CCC[N@H+]1C1CC1	ZINC000278361389	214116350	/nfs/dbraw/zinc/11/63/50/214116350.db2.gz	AWAZFSUSKFNMHZ-AWEZNQCLSA-N	1	1	319.361	1.846	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1	ZINC000451925289	231236650	/nfs/dbraw/zinc/23/66/50/231236650.db2.gz	GCWKSPBCOGYDRP-OAHLLOKOSA-N	1	1	310.350	1.434	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000295617876	529784637	/nfs/dbraw/zinc/78/46/37/529784637.db2.gz	WBGMAYDCMJKPMM-ZDUSSCGKSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2nccc3cc([N+](=O)[O-])ccc32)C1	ZINC000295617876	529784639	/nfs/dbraw/zinc/78/46/39/529784639.db2.gz	WBGMAYDCMJKPMM-ZDUSSCGKSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C1CC1	ZINC000457204878	529883017	/nfs/dbraw/zinc/88/30/17/529883017.db2.gz	PWBHKILJHNNUDS-UHFFFAOYSA-N	1	1	323.397	1.517	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC000272209565	282317322	/nfs/dbraw/zinc/31/73/22/282317322.db2.gz	PXRNYWMHVZGYGQ-NXEZZACHSA-N	1	1	307.379	1.834	20	5		DDBDMO
C[N@H+]1CCC[C@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000299605311	530062180	/nfs/dbraw/zinc/06/21/80/530062180.db2.gz	YCZGWUDRDWCSAS-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000330860126	232120266	/nfs/dbraw/zinc/12/02/66/232120266.db2.gz	VWMOXXFDSLBUBO-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CN1C	ZINC000330860126	232120269	/nfs/dbraw/zinc/12/02/69/232120269.db2.gz	VWMOXXFDSLBUBO-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)CN1C	ZINC000330860126	232120271	/nfs/dbraw/zinc/12/02/71/232120271.db2.gz	VWMOXXFDSLBUBO-MCIONIFRSA-N	1	1	323.393	1.359	20	5		DDBDMO
Cc1c(NC(=O)NC[C@]2(O)CC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000358444990	299153601	/nfs/dbraw/zinc/15/36/01/299153601.db2.gz	WSFLGYIXUXMIBL-CQSZACIVSA-N	1	1	308.338	1.091	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1	ZINC000459592478	233345644	/nfs/dbraw/zinc/34/56/44/233345644.db2.gz	UOZXUZOCPZUJGE-OAHLLOKOSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1	ZINC000459592478	233345651	/nfs/dbraw/zinc/34/56/51/233345651.db2.gz	UOZXUZOCPZUJGE-OAHLLOKOSA-N	1	1	324.381	1.882	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851815	186193641	/nfs/dbraw/zinc/19/36/41/186193641.db2.gz	DOSKMLLLVZWTPP-FZMZJTMJSA-N	1	1	307.350	1.411	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851815	186193642	/nfs/dbraw/zinc/19/36/42/186193642.db2.gz	DOSKMLLLVZWTPP-FZMZJTMJSA-N	1	1	307.350	1.411	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@@H+]2CCCC[C@@H]2CC)c1[N+](=O)[O-]	ZINC000172163781	198049714	/nfs/dbraw/zinc/04/97/14/198049714.db2.gz	VXRMJCCSSMJFBA-NSHDSACASA-N	1	1	323.397	1.875	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000047142667	352483169	/nfs/dbraw/zinc/48/31/69/352483169.db2.gz	AXLSJEJYDGTUKW-NSHDSACASA-N	1	1	306.366	1.781	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000048023420	352521173	/nfs/dbraw/zinc/52/11/73/352521173.db2.gz	NUPHTBALNDPNRZ-CQSZACIVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000063489996	352914489	/nfs/dbraw/zinc/91/44/89/352914489.db2.gz	FJYBTQVBKAIHCV-ZDUSSCGKSA-N	1	1	321.377	1.820	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2cccc([N+](=O)[O-])c2N)[nH+]1	ZINC000344928873	282873611	/nfs/dbraw/zinc/87/36/11/282873611.db2.gz	VZICYRRMZPRVGF-UHFFFAOYSA-N	1	1	315.333	1.722	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000069475987	353162919	/nfs/dbraw/zinc/16/29/19/353162919.db2.gz	PTFOIQJTEVFYLO-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NCCC[NH+]1CCOCC1	ZINC000277123389	213308218	/nfs/dbraw/zinc/30/82/18/213308218.db2.gz	BCZSNCNOCUNTAO-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
CC(C)[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000075744948	353378949	/nfs/dbraw/zinc/37/89/49/353378949.db2.gz	OEGKCHNRGHITIU-HIFRSBDPSA-N	1	1	310.398	1.910	20	5		DDBDMO
Cc1cnc(NCCC[N@H+]2CCC[C@H](C(N)=O)C2)c([N+](=O)[O-])c1	ZINC000078657968	353526682	/nfs/dbraw/zinc/52/66/82/353526682.db2.gz	USRGDATWKUFQML-LBPRGKRZSA-N	1	1	321.381	1.298	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+][C@H]1C[C@@H](CO)C1)c1ccc([N+](=O)[O-])cc1	ZINC000601291479	358480102	/nfs/dbraw/zinc/48/01/02/358480102.db2.gz	KQRHMNTXMFXBEY-OSAQELSMSA-N	1	1	316.361	1.778	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000089930601	353784033	/nfs/dbraw/zinc/78/40/33/353784033.db2.gz	XHYRNOWWRRLCJY-CMPLNLGQSA-N	1	1	307.350	1.287	20	5		DDBDMO
COC(=O)C(C)(C)[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000093280903	353892058	/nfs/dbraw/zinc/89/20/58/353892058.db2.gz	OCSYQBJWULVUSF-GFCCVEGCSA-N	1	1	324.381	1.703	20	5		DDBDMO
C[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000093343562	353897640	/nfs/dbraw/zinc/89/76/40/353897640.db2.gz	XINRGLZAGHATTP-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@@H]1O	ZINC000093343562	353897642	/nfs/dbraw/zinc/89/76/42/353897642.db2.gz	XINRGLZAGHATTP-DFBGVHRSSA-N	1	1	319.361	1.403	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(NC(C)=O)CC1	ZINC000125172252	354044158	/nfs/dbraw/zinc/04/41/58/354044158.db2.gz	GCESKLJELXQUMI-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000278830123	354416104	/nfs/dbraw/zinc/41/61/04/354416104.db2.gz	IFWVELFHWDNLFG-INIZCTEOSA-N	1	1	319.361	1.576	20	5		DDBDMO
O=C(C[N@H+]1CCCCC[C@H]1CO)Nc1ccccc1[N+](=O)[O-]	ZINC000318623161	354515991	/nfs/dbraw/zinc/51/59/91/354515991.db2.gz	PHQBXLAIUJFBHY-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CCCCC[C@H]1CO)Nc1ccccc1[N+](=O)[O-]	ZINC000318623161	354515995	/nfs/dbraw/zinc/51/59/95/354515995.db2.gz	PHQBXLAIUJFBHY-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)[C@H]2C1	ZINC000585779640	354839602	/nfs/dbraw/zinc/83/96/02/354839602.db2.gz	HPHVDOBKSKGTAJ-HZMBPMFUSA-N	1	1	306.366	1.200	20	5		DDBDMO
Nc1cc(N2CCC[C@H](c3[nH]cc[nH+]3)C2)cc(CO)c1[N+](=O)[O-]	ZINC000587837757	354886609	/nfs/dbraw/zinc/88/66/09/354886609.db2.gz	DLVJPJIHIVHQNS-JTQLQIEISA-N	1	1	317.349	1.776	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)N[C@H]1CCC[N@@H+](C)C1	ZINC000588158180	354906305	/nfs/dbraw/zinc/90/63/05/354906305.db2.gz	KPMBOFJAQDMCSL-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@@H](O)C2CC2)c1	ZINC000589516403	354998658	/nfs/dbraw/zinc/99/86/58/354998658.db2.gz	URFIWRTTWZFSHS-CQSZACIVSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H](O)C2CC2)c1	ZINC000589516403	354998662	/nfs/dbraw/zinc/99/86/62/354998662.db2.gz	URFIWRTTWZFSHS-CQSZACIVSA-N	1	1	308.334	1.584	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000590344481	355074885	/nfs/dbraw/zinc/07/48/85/355074885.db2.gz	TYXRBPVZCXPUKN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000590344481	355074886	/nfs/dbraw/zinc/07/48/86/355074886.db2.gz	TYXRBPVZCXPUKN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1n[nH]c(C(C)C)c1[N+](=O)[O-]	ZINC000590344481	355074889	/nfs/dbraw/zinc/07/48/89/355074889.db2.gz	TYXRBPVZCXPUKN-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2nccc(C(=O)OC)c2[N+](=O)[O-])C1	ZINC000590573554	355117331	/nfs/dbraw/zinc/11/73/31/355117331.db2.gz	BPHVGQOIJOKFTG-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590442880	355096354	/nfs/dbraw/zinc/09/63/54/355096354.db2.gz	HRYNJIYFQBPIJK-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590442880	355096356	/nfs/dbraw/zinc/09/63/56/355096356.db2.gz	HRYNJIYFQBPIJK-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590442880	355096358	/nfs/dbraw/zinc/09/63/58/355096358.db2.gz	HRYNJIYFQBPIJK-KOLCDFICSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590442883	355096746	/nfs/dbraw/zinc/09/67/46/355096746.db2.gz	HRYNJIYFQBPIJK-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590442883	355096752	/nfs/dbraw/zinc/09/67/52/355096752.db2.gz	HRYNJIYFQBPIJK-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000590442883	355096756	/nfs/dbraw/zinc/09/67/56/355096756.db2.gz	HRYNJIYFQBPIJK-ONGXEEELSA-N	1	1	307.354	1.047	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@@H]2CCC[N@@H+]2C)c([N+](=O)[O-])s1	ZINC000601319468	358494057	/nfs/dbraw/zinc/49/40/57/358494057.db2.gz	AXZIRYGWOHCPEL-VIFPVBQESA-N	1	1	319.408	1.337	20	5		DDBDMO
CC(C)O[C@@H]1CCC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000593055559	355781896	/nfs/dbraw/zinc/78/18/96/355781896.db2.gz	LQBZPPXGOBDPGM-UONOGXRCSA-N	1	1	312.370	1.042	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)[C@H](C)CCO)c([N+](=O)[O-])c1	ZINC000593107650	355799858	/nfs/dbraw/zinc/79/98/58/355799858.db2.gz	LZSFWKCNOSWICL-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)[C@H](C)CCO)c([N+](=O)[O-])c1	ZINC000593107650	355799862	/nfs/dbraw/zinc/79/98/62/355799862.db2.gz	LZSFWKCNOSWICL-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
Cc1[nH+]cc2n1C[C@@H](C(=O)NCc1cccc([N+](=O)[O-])c1)CC2	ZINC000593424482	355880966	/nfs/dbraw/zinc/88/09/66/355880966.db2.gz	IAOWLUCOUHSLQP-ZDUSSCGKSA-N	1	1	314.345	1.979	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@H](OC2CCC2)C1	ZINC000594026162	356092714	/nfs/dbraw/zinc/09/27/14/356092714.db2.gz	DWROADFVBNQBCV-HNNXBMFYSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H](O)C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000594063657	356103960	/nfs/dbraw/zinc/10/39/60/356103960.db2.gz	KPTCBJILEYSDGF-NSHDSACASA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@H](O)C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000594063657	356103965	/nfs/dbraw/zinc/10/39/65/356103965.db2.gz	KPTCBJILEYSDGF-NSHDSACASA-N	1	1	319.361	1.329	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C[C@H](C)O)C1CC1	ZINC000594065569	356104141	/nfs/dbraw/zinc/10/41/41/356104141.db2.gz	SKFINWNIXKNPIR-NSHDSACASA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C[C@H](C)O)C1CC1	ZINC000594065569	356104145	/nfs/dbraw/zinc/10/41/45/356104145.db2.gz	SKFINWNIXKNPIR-NSHDSACASA-N	1	1	307.350	1.687	20	5		DDBDMO
O=[N+]([O-])c1ccc(-n2cc(C[N@H+]3CCC[C@@H]3CO)nn2)cc1	ZINC000594640748	356269116	/nfs/dbraw/zinc/26/91/16/356269116.db2.gz	PSUPRSIYIVUQAU-CQSZACIVSA-N	1	1	303.322	1.132	20	5		DDBDMO
O=[N+]([O-])c1ccc(-n2cc(C[N@@H+]3CCC[C@@H]3CO)nn2)cc1	ZINC000594640748	356269120	/nfs/dbraw/zinc/26/91/20/356269120.db2.gz	PSUPRSIYIVUQAU-CQSZACIVSA-N	1	1	303.322	1.132	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[NH2+]C1CCN([C@H]2CCOC2)CC1	ZINC000594501973	356238767	/nfs/dbraw/zinc/23/87/67/356238767.db2.gz	GNAVEBJPJOMEAZ-HNNXBMFYSA-N	1	1	305.378	1.938	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@]1(O)CC[N@@H+](C)C1	ZINC000595032291	356374588	/nfs/dbraw/zinc/37/45/88/356374588.db2.gz	MCVGCLPUDOIYEC-ABAIWWIYSA-N	1	1	309.366	1.321	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cnccn1	ZINC000595474086	356507748	/nfs/dbraw/zinc/50/77/48/356507748.db2.gz	CUNBXQWHXMNQTF-UHFFFAOYSA-N	1	1	315.333	1.498	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1cnccn1	ZINC000595474086	356507751	/nfs/dbraw/zinc/50/77/51/356507751.db2.gz	CUNBXQWHXMNQTF-UHFFFAOYSA-N	1	1	315.333	1.498	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595766585	356643958	/nfs/dbraw/zinc/64/39/58/356643958.db2.gz	QDPKINPPQGBTGK-VXGBXAGGSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1[C@@H](C)O	ZINC000595766585	356643964	/nfs/dbraw/zinc/64/39/64/356643964.db2.gz	QDPKINPPQGBTGK-VXGBXAGGSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC4(COC4)C3)o2)cc1	ZINC000595833157	356669293	/nfs/dbraw/zinc/66/92/93/356669293.db2.gz	ANEICUNRDZXDIM-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC4(COC4)C3)o2)cc1	ZINC000595833157	356669299	/nfs/dbraw/zinc/66/92/99/356669299.db2.gz	ANEICUNRDZXDIM-UHFFFAOYSA-N	1	1	316.317	1.867	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](C(=O)NC(C)C)C2)c1[N+](=O)[O-]	ZINC000595852193	356678296	/nfs/dbraw/zinc/67/82/96/356678296.db2.gz	YOEOMARFWZMUJP-NSHDSACASA-N	1	1	310.354	1.628	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](C(=O)NC(C)C)C2)c1[N+](=O)[O-]	ZINC000595852193	356678299	/nfs/dbraw/zinc/67/82/99/356678299.db2.gz	YOEOMARFWZMUJP-NSHDSACASA-N	1	1	310.354	1.628	20	5		DDBDMO
CC(C)NC(=O)[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000595852037	356678373	/nfs/dbraw/zinc/67/83/73/356678373.db2.gz	XDSVTKUGPDMXES-LBPRGKRZSA-N	1	1	309.370	1.028	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H]2COC[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000595829508	356666651	/nfs/dbraw/zinc/66/66/51/356666651.db2.gz	IGDDJANBBURVBU-CHWSQXEVSA-N	1	1	319.361	1.526	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595873315	356686872	/nfs/dbraw/zinc/68/68/72/356686872.db2.gz	LLJFXEFQABKQIV-BLLLJJGKSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595873315	356686876	/nfs/dbraw/zinc/68/68/76/356686876.db2.gz	LLJFXEFQABKQIV-BLLLJJGKSA-N	1	1	321.377	1.792	20	5		DDBDMO
[NH3+]C1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCCC1	ZINC000595948241	356718458	/nfs/dbraw/zinc/71/84/58/356718458.db2.gz	CDZODYAUAUOHDF-UHFFFAOYSA-N	1	1	303.322	1.472	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C[C@@]1(C)CO	ZINC000597237038	357105952	/nfs/dbraw/zinc/10/59/52/357105952.db2.gz	VZCDNDMKWCXXHT-BZNIZROVSA-N	1	1	322.361	1.816	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1COCCO1	ZINC000597207824	357092663	/nfs/dbraw/zinc/09/26/63/357092663.db2.gz	VYPVBXFDEOTGRS-GFCCVEGCSA-N	1	1	324.333	1.213	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1COCCO1	ZINC000597207824	357092666	/nfs/dbraw/zinc/09/26/66/357092666.db2.gz	VYPVBXFDEOTGRS-GFCCVEGCSA-N	1	1	324.333	1.213	20	5		DDBDMO
CN(CC1C[NH+](C)C1)C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000598160602	357477927	/nfs/dbraw/zinc/47/79/27/357477927.db2.gz	NMXASIJXXVVEQB-UHFFFAOYSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC000598453200	357588223	/nfs/dbraw/zinc/58/82/23/357588223.db2.gz	PZCFVWQXZXBOJP-OAHLLOKOSA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598651466	357671740	/nfs/dbraw/zinc/67/17/40/357671740.db2.gz	SVENGAPEZBXIAW-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)[C@H](CO)C1	ZINC000598651466	357671745	/nfs/dbraw/zinc/67/17/45/357671745.db2.gz	SVENGAPEZBXIAW-YPMHNXCESA-N	1	1	321.377	1.792	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2CC[C@H](O)C2)c(OC(F)F)c1	ZINC000599199639	357847415	/nfs/dbraw/zinc/84/74/15/357847415.db2.gz	ODFGSQDGDARXMJ-JTQLQIEISA-N	1	1	317.292	1.675	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+](C(C)C)C1	ZINC000347975361	283312665	/nfs/dbraw/zinc/31/26/65/283312665.db2.gz	HZIIGDBQCAKDMB-GFCCVEGCSA-N	1	1	306.366	1.901	20	5		DDBDMO
CNC(=O)[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)CCO1	ZINC000601140073	358417587	/nfs/dbraw/zinc/41/75/87/358417587.db2.gz	RACNZRBGLZSFIF-AWEZNQCLSA-N	1	1	316.317	1.094	20	5		DDBDMO
CCN1C[C@@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000601170751	358431551	/nfs/dbraw/zinc/43/15/51/358431551.db2.gz	DNJXTUPDUZIIBZ-JTQLQIEISA-N	1	1	300.318	1.598	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1ccnc2ccc([N+](=O)[O-])cc21	ZINC000601172729	358432453	/nfs/dbraw/zinc/43/24/53/358432453.db2.gz	HOACFGCBXCGJGP-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1	ZINC000601959801	358753403	/nfs/dbraw/zinc/75/34/03/358753403.db2.gz	SHEDPSGHNMJXLX-HNNXBMFYSA-N	1	1	302.334	1.428	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2C[C@@H]3COC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000601974854	358761346	/nfs/dbraw/zinc/76/13/46/358761346.db2.gz	RPAVUXJBXDCPFT-BETUJISGSA-N	1	1	319.361	1.810	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602455886	358989234	/nfs/dbraw/zinc/98/92/34/358989234.db2.gz	ZCBBORNLBMGDSI-LLVKDONJSA-N	1	1	309.370	1.067	20	5		DDBDMO
C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1	ZINC000602577938	359052450	/nfs/dbraw/zinc/05/24/50/359052450.db2.gz	RLQBZOARTZJLIO-STFLBKPXSA-N	1	1	322.390	1.917	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](Cn2ccnn2)C1	ZINC000602797809	359199514	/nfs/dbraw/zinc/19/95/14/359199514.db2.gz	DOBVEGQYLQRIPK-ZDUSSCGKSA-N	1	1	319.369	1.103	20	5		DDBDMO
Cn1cc(C[N@H+](C)[C@H](CO)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602883146	359266868	/nfs/dbraw/zinc/26/68/68/359266868.db2.gz	IGXFKVVMFXOLDX-AWEZNQCLSA-N	1	1	304.350	1.364	20	5		DDBDMO
Cn1cc(C[N@@H+](C)[C@H](CO)Cc2ccccc2)c([N+](=O)[O-])n1	ZINC000602883146	359266871	/nfs/dbraw/zinc/26/68/71/359266871.db2.gz	IGXFKVVMFXOLDX-AWEZNQCLSA-N	1	1	304.350	1.364	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CC[C@H](O)[C@@H]2CCCC[C@H]21	ZINC000602997843	359346537	/nfs/dbraw/zinc/34/65/37/359346537.db2.gz	RXEPSEKECZRDHI-KFWWJZLASA-N	1	1	321.377	1.382	20	5		DDBDMO
Cc1cc(N2CCC([N@@H+]3CCOC[C@@H]3C)CC2)ncc1[N+](=O)[O-]	ZINC000603400380	359616448	/nfs/dbraw/zinc/61/64/48/359616448.db2.gz	GZOMUBLASOXKNQ-ZDUSSCGKSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000603400279	359616730	/nfs/dbraw/zinc/61/67/30/359616730.db2.gz	FLKNNBQXFSXPKC-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
COc1ccc(OCCN[C@H]2C[C@@H]([NH3+])C2(C)C)c([N+](=O)[O-])c1	ZINC000603430958	359635042	/nfs/dbraw/zinc/63/50/42/359635042.db2.gz	DDEHABNBOZKNCT-KGLIPLIRSA-N	1	1	309.366	1.698	20	5		DDBDMO
Cn1cc(CN2CCC[C@H]([C@H]3C[C@@H]([NH3+])CCO3)C2)c([N+](=O)[O-])n1	ZINC000603431399	359636197	/nfs/dbraw/zinc/63/61/97/359636197.db2.gz	WTRWYUQXPPVKMW-FPMFFAJLSA-N	1	1	323.397	1.047	20	5		DDBDMO
C[C@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@H]1C[N@H+](C)CCO1	ZINC000618588305	363683892	/nfs/dbraw/zinc/68/38/92/363683892.db2.gz	XCBNDNGXHGCPRH-TVQRCGJNSA-N	1	1	305.338	1.024	20	5		DDBDMO
C[C@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@H]1C[N@@H+](C)CCO1	ZINC000618588305	363683893	/nfs/dbraw/zinc/68/38/93/363683893.db2.gz	XCBNDNGXHGCPRH-TVQRCGJNSA-N	1	1	305.338	1.024	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@H]([NH2+]C(C)C)C2)c1[N+](=O)[O-]	ZINC000609476892	360311281	/nfs/dbraw/zinc/31/12/81/360311281.db2.gz	YEMCCKLJZKAJFI-NSHDSACASA-N	1	1	323.397	1.873	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CCCC[NH+](C)C)c1[N+](=O)[O-]	ZINC000610112036	360382856	/nfs/dbraw/zinc/38/28/56/360382856.db2.gz	SAMHGNSSJMCEBL-UHFFFAOYSA-N	1	1	311.386	1.684	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610395584	360425311	/nfs/dbraw/zinc/42/53/11/360425311.db2.gz	JTBJGWDGXNKHMQ-GFCCVEGCSA-N	1	1	321.377	1.797	20	5		DDBDMO
C[C@@H]1CCN(CC[NH2+]Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610395584	360425317	/nfs/dbraw/zinc/42/53/17/360425317.db2.gz	JTBJGWDGXNKHMQ-GFCCVEGCSA-N	1	1	321.377	1.797	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH+](CC2(O)CCC2)CC1	ZINC000610705843	360511208	/nfs/dbraw/zinc/51/12/08/360511208.db2.gz	JWRCTOILVVUBFQ-UHFFFAOYSA-N	1	1	319.361	1.268	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000610712469	360512350	/nfs/dbraw/zinc/51/23/50/360512350.db2.gz	BWNUIPZHLWDQTB-GXFFZTMASA-N	1	1	321.381	1.125	20	5		DDBDMO
Nc1ccc(N2CCN(c3sccc3[N+](=O)[O-])CC2)c[nH+]1	ZINC000301943083	283664287	/nfs/dbraw/zinc/66/42/87/283664287.db2.gz	XWWKFDOLTYIYJI-UHFFFAOYSA-N	1	1	305.363	1.960	20	5		DDBDMO
COc1cccc(C(=O)N2CC[NH+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000195413664	201388412	/nfs/dbraw/zinc/38/84/12/201388412.db2.gz	OTMFNFVYTBZYGB-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275347803	212284445	/nfs/dbraw/zinc/28/44/45/212284445.db2.gz	JAPOOYRZSSNTPK-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ncc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1	ZINC000275347803	212284448	/nfs/dbraw/zinc/28/44/48/212284448.db2.gz	JAPOOYRZSSNTPK-VHSXEESVSA-N	1	1	314.773	1.535	20	5		DDBDMO
O=C(NCC[C@H]1CC[NH2+]C1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000262607919	203350245	/nfs/dbraw/zinc/35/02/45/203350245.db2.gz	ZRCPIRQUDURCDM-SECBINFHSA-N	1	1	303.322	1.201	20	5		DDBDMO
NC(=O)c1cc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])on1	ZINC000350393965	284190130	/nfs/dbraw/zinc/19/01/30/284190130.db2.gz	QFVIBHYTYWDZOF-HWKANZROSA-N	1	1	302.290	1.485	20	5		DDBDMO
C[NH+]1CCN(C(=O)c2cc(=O)[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000264637232	204044943	/nfs/dbraw/zinc/04/49/43/204044943.db2.gz	PJILIAOJRKMREE-UHFFFAOYSA-N	1	1	316.317	1.236	20	5		DDBDMO
Cc1cnc(NCCC[N@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC000266226057	205198594	/nfs/dbraw/zinc/19/85/94/205198594.db2.gz	RUKOCVKSIIUUQS-NSHDSACASA-N	1	1	307.354	1.050	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000266276446	205232452	/nfs/dbraw/zinc/23/24/52/205232452.db2.gz	SHIOMQRJXXMPFS-UHFFFAOYSA-N	1	1	304.310	1.096	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](C3CC3)C2)n1	ZINC000336858941	249266482	/nfs/dbraw/zinc/26/64/82/249266482.db2.gz	CYOFCGGTDQOVNZ-SECBINFHSA-N	1	1	306.322	1.425	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(CCOc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000284740407	218158127	/nfs/dbraw/zinc/15/81/27/218158127.db2.gz	DJIMXOKRVHQONB-JKSUJKDBSA-N	1	1	321.377	1.379	20	5		DDBDMO
CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(C)C1=O	ZINC000338966784	250222692	/nfs/dbraw/zinc/22/26/92/250222692.db2.gz	YZIYJJBZDOTZBG-AWEZNQCLSA-N	1	1	319.361	1.873	20	5		DDBDMO
CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(C)C1=O	ZINC000338966784	250222695	/nfs/dbraw/zinc/22/26/95/250222695.db2.gz	YZIYJJBZDOTZBG-AWEZNQCLSA-N	1	1	319.361	1.873	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000288597253	220274483	/nfs/dbraw/zinc/27/44/83/220274483.db2.gz	DWVZTYJUKVMUTE-QWRGUYRKSA-N	1	1	307.350	1.287	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000109992420	194302764	/nfs/dbraw/zinc/30/27/64/194302764.db2.gz	HDSYLTDERZKPPQ-VIFPVBQESA-N	1	1	303.322	1.153	20	5		DDBDMO
C[N@@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000109992420	194302766	/nfs/dbraw/zinc/30/27/66/194302766.db2.gz	HDSYLTDERZKPPQ-VIFPVBQESA-N	1	1	303.322	1.153	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000109992420	194302768	/nfs/dbraw/zinc/30/27/68/194302768.db2.gz	HDSYLTDERZKPPQ-VIFPVBQESA-N	1	1	303.322	1.153	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccccc3)CC2)c1	ZINC000157319261	197178638	/nfs/dbraw/zinc/17/86/38/197178638.db2.gz	YZVYADAHPHXOLR-UHFFFAOYSA-N	1	1	301.350	1.614	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](C)NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000289679220	221149731	/nfs/dbraw/zinc/14/97/31/221149731.db2.gz	VFGXCJHSQSJODT-LLVKDONJSA-N	1	1	315.395	1.602	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N[C@@H]1CCC[N@H+](CCCO)C1	ZINC000294998560	224368629	/nfs/dbraw/zinc/36/86/29/224368629.db2.gz	REXBEPDGAPARAB-LLVKDONJSA-N	1	1	314.773	1.902	20	5		DDBDMO
Cc1nnc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000570391252	304409104	/nfs/dbraw/zinc/40/91/04/304409104.db2.gz	ZWVWCWRTHCNIGT-NSHDSACASA-N	1	1	324.362	1.284	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000068336845	406633143	/nfs/dbraw/zinc/63/31/43/406633143.db2.gz	IGTGBAFALUPENP-BQYQJAHWSA-N	1	1	307.350	1.302	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)CN1CC[NH+](C)CC1	ZINC000074137811	406902874	/nfs/dbraw/zinc/90/28/74/406902874.db2.gz	WCVPUIDYCJZLLB-ZDUSSCGKSA-N	1	1	320.393	1.208	20	5		DDBDMO
COCC[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000054353622	407183181	/nfs/dbraw/zinc/18/31/81/407183181.db2.gz	HTNQFYOOUPPZBR-UHFFFAOYSA-N	1	1	311.338	1.510	20	5		DDBDMO
C[N@H+](C[C@@H]1CCCO1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000067379399	407272325	/nfs/dbraw/zinc/27/23/25/407272325.db2.gz	UIOMHPVRAMROAO-LSDHHAIUSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCCO1)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000067379399	407272327	/nfs/dbraw/zinc/27/23/27/407272327.db2.gz	UIOMHPVRAMROAO-LSDHHAIUSA-N	1	1	319.361	1.811	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@](C)(O)C1	ZINC000123941660	407343963	/nfs/dbraw/zinc/34/39/63/407343963.db2.gz	LFMJRECRFNCDEQ-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@](C)(O)C1	ZINC000123941660	407343965	/nfs/dbraw/zinc/34/39/65/407343965.db2.gz	LFMJRECRFNCDEQ-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@@H](C)C[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000126103398	407405591	/nfs/dbraw/zinc/40/55/91/407405591.db2.gz	GQJZUEIPCGIYDZ-FVINQWEUSA-N	1	1	300.380	1.802	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H](C)C[S@@](C)=O)cc1[N+](=O)[O-]	ZINC000126103398	407405593	/nfs/dbraw/zinc/40/55/93/407405593.db2.gz	GQJZUEIPCGIYDZ-FVINQWEUSA-N	1	1	300.380	1.802	20	5		DDBDMO
C[C@H](O)C1CC[NH+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000111288402	407407107	/nfs/dbraw/zinc/40/71/07/407407107.db2.gz	JGUVVFHTYITGOD-LBPRGKRZSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000270968060	407442643	/nfs/dbraw/zinc/44/26/43/407442643.db2.gz	VTLDDFAQAVVHFE-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000185945534	407548147	/nfs/dbraw/zinc/54/81/47/407548147.db2.gz	NRDTZBQHHSPDQH-HNNXBMFYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@]1(C(N)=O)CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000185945534	407548151	/nfs/dbraw/zinc/54/81/51/407548151.db2.gz	NRDTZBQHHSPDQH-HNNXBMFYSA-N	1	1	307.350	1.704	20	5		DDBDMO
C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C	ZINC000186487629	407679747	/nfs/dbraw/zinc/67/97/47/407679747.db2.gz	AEUAVUKWMKYAIH-YGRLFVJLSA-N	1	1	317.349	1.739	20	5		DDBDMO
C[C@H]([NH2+]CCS(=O)(=O)N(C)C)c1ccccc1[N+](=O)[O-]	ZINC000230993722	407696820	/nfs/dbraw/zinc/69/68/20/407696820.db2.gz	GLSKUFOMJKRVDO-JTQLQIEISA-N	1	1	301.368	1.137	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@]3(C2)OCc2ccccc23)n1	ZINC000186710287	407751988	/nfs/dbraw/zinc/75/19/88/407751988.db2.gz	NQLIWFXVMFZZMB-INIZCTEOSA-N	1	1	314.345	1.923	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+](C)CC(C)(C)O)cccc1[N+](=O)[O-]	ZINC000267150789	407768013	/nfs/dbraw/zinc/76/80/13/407768013.db2.gz	MMVJBPXZXMBNKS-NSHDSACASA-N	1	1	309.366	1.933	20	5		DDBDMO
COc1cc(CNC[C@@H]2CCC[N@@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000237242204	407807401	/nfs/dbraw/zinc/80/74/01/407807401.db2.gz	CUPRTEHPFSMQJY-LBPRGKRZSA-N	1	1	309.366	1.796	20	5		DDBDMO
COc1cc(CNC[C@@H]2CCC[N@H+]2C)c([N+](=O)[O-])cc1OC	ZINC000237242204	407807406	/nfs/dbraw/zinc/80/74/06/407807406.db2.gz	CUPRTEHPFSMQJY-LBPRGKRZSA-N	1	1	309.366	1.796	20	5		DDBDMO
Cc1ccc([C@H](C)NC(=O)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000268023576	407861221	/nfs/dbraw/zinc/86/12/21/407861221.db2.gz	LJSJLZOMQIMVDH-LBPRGKRZSA-N	1	1	306.366	1.921	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000154060549	407965972	/nfs/dbraw/zinc/96/59/72/407965972.db2.gz	OOHUVZBFGXWWDP-CQSZACIVSA-N	1	1	321.377	1.772	20	5		DDBDMO
CCOCC[NH+]1CCN(c2ccc([N+](=O)[O-])cc2COC)CC1	ZINC000175099405	408049018	/nfs/dbraw/zinc/04/90/18/408049018.db2.gz	BQMTWEQJYXPOJY-UHFFFAOYSA-N	1	1	323.393	1.900	20	5		DDBDMO
CC(C)[NH+]1CCC(O)(CNCc2ccccc2[N+](=O)[O-])CC1	ZINC000268452732	408050755	/nfs/dbraw/zinc/05/07/55/408050755.db2.gz	WJMUMNLQWICBLZ-UHFFFAOYSA-N	1	1	307.394	1.920	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCOC2(CCC2)C1	ZINC000182320984	408125168	/nfs/dbraw/zinc/12/51/68/408125168.db2.gz	ROFOEMRDWYTPEB-CYBMUJFWSA-N	1	1	322.361	1.589	20	5		DDBDMO
CCC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)(C)O	ZINC000268505721	408073269	/nfs/dbraw/zinc/07/32/69/408073269.db2.gz	BEJDHNNMDPOWNZ-UHFFFAOYSA-N	1	1	309.366	1.677	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCOC2(CCC2)C1	ZINC000182320984	408125172	/nfs/dbraw/zinc/12/51/72/408125172.db2.gz	ROFOEMRDWYTPEB-CYBMUJFWSA-N	1	1	322.361	1.589	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182242495	408103045	/nfs/dbraw/zinc/10/30/45/408103045.db2.gz	LTJHUTQBLAQSHH-MJBXVCDLSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N1CC[NH2+]Cc2ccccc21	ZINC000269174817	408228586	/nfs/dbraw/zinc/22/85/86/408228586.db2.gz	LJMYTIXRPLNIIC-UHFFFAOYSA-N	1	1	315.333	1.318	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)N[C@@H]1CC[N@@H+](CC2CCCC2)C1	ZINC000173282380	162330177	/nfs/dbraw/zinc/33/01/77/162330177.db2.gz	MUMSSJVNWSKRKU-CYBMUJFWSA-N	1	1	321.381	1.172	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@@]3(CC=CCC3)C2)c1	ZINC000173751628	162361888	/nfs/dbraw/zinc/36/18/88/162361888.db2.gz	ZHBOBZRHYAULQB-HOTGVXAUSA-N	1	1	320.393	1.975	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCO[C@H]([C@H]3CCCO3)C2)cc1	ZINC000247302570	408447219	/nfs/dbraw/zinc/44/72/19/408447219.db2.gz	LMICUORNKNXPPL-CVEARBPZSA-N	1	1	322.361	1.853	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCO[C@H]([C@H]3CCCO3)C2)cc1	ZINC000247302570	408447224	/nfs/dbraw/zinc/44/72/24/408447224.db2.gz	LMICUORNKNXPPL-CVEARBPZSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000247311822	408450598	/nfs/dbraw/zinc/45/05/98/408450598.db2.gz	HMGIBVXCJZTOJJ-IUODEOHRSA-N	1	1	321.377	1.772	20	5		DDBDMO
CC[C@@H]1COCC[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247157036	408418780	/nfs/dbraw/zinc/41/87/80/408418780.db2.gz	IUEVFRFEEPCCHE-TZMCWYRMSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1COCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000247157036	408418784	/nfs/dbraw/zinc/41/87/84/408418784.db2.gz	IUEVFRFEEPCCHE-TZMCWYRMSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(c3ccccn3)CC2)n1	ZINC000183833107	408499234	/nfs/dbraw/zinc/49/92/34/408499234.db2.gz	CXKJGGOIKBEOSC-UHFFFAOYSA-N	1	1	316.365	1.399	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1	ZINC000183985440	408525751	/nfs/dbraw/zinc/52/57/51/408525751.db2.gz	WWJDBSVIQVOCRK-OUKQBFOZSA-N	1	1	321.377	1.429	20	5		DDBDMO
C[C@H](c1ccccn1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270680761	408633558	/nfs/dbraw/zinc/63/35/58/408633558.db2.gz	URCSPOHINMCOLU-YPMHNXCESA-N	1	1	305.338	1.240	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@@H]1O	ZINC000249568588	408742672	/nfs/dbraw/zinc/74/26/72/408742672.db2.gz	NOXJMGAIKGNBIV-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@@H]1O	ZINC000249568588	408742678	/nfs/dbraw/zinc/74/26/78/408742678.db2.gz	NOXJMGAIKGNBIV-UGFHNGPFSA-N	1	1	319.361	1.403	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)NCC1=CC[N@@H+](C)CC1	ZINC000275831882	408689369	/nfs/dbraw/zinc/68/93/69/408689369.db2.gz	YMZWJAJCLJAMAZ-UHFFFAOYSA-N	1	1	320.349	1.987	20	5		DDBDMO
CO[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC[C@H]1C	ZINC000251604256	408782449	/nfs/dbraw/zinc/78/24/49/408782449.db2.gz	FWNVTPSLKZWTNH-QMTHXVAHSA-N	1	1	307.350	1.551	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000270932648	408746116	/nfs/dbraw/zinc/74/61/16/408746116.db2.gz	QIWAYYPVQJQEHU-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H]1O	ZINC000270932648	408746118	/nfs/dbraw/zinc/74/61/18/408746118.db2.gz	QIWAYYPVQJQEHU-GWCFXTLKSA-N	1	1	318.333	1.848	20	5		DDBDMO
COC(=O)c1cnc(N[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000276553291	408881768	/nfs/dbraw/zinc/88/17/68/408881768.db2.gz	KODXESWOJLJMHU-NSHDSACASA-N	1	1	308.338	1.671	20	5		DDBDMO
C[N@H+](CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1CC1	ZINC000276300509	408831466	/nfs/dbraw/zinc/83/14/66/408831466.db2.gz	MYQYRZUIVIYHLG-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
C[N@@H+](CCNc1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C1CC1	ZINC000276300509	408831469	/nfs/dbraw/zinc/83/14/69/408831469.db2.gz	MYQYRZUIVIYHLG-UHFFFAOYSA-N	1	1	313.379	1.504	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H](C)C[N@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000290859521	408845052	/nfs/dbraw/zinc/84/50/52/408845052.db2.gz	ADFBHCKBVNGQST-SNVBAGLBSA-N	1	1	311.386	1.900	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNc2ncc([N+](=O)[O-])s2)CCCO1	ZINC000281999010	408969193	/nfs/dbraw/zinc/96/91/93/408969193.db2.gz	UDJBOBYHJDLXBC-SNVBAGLBSA-N	1	1	300.384	1.964	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@@H]1C	ZINC000277638640	408982479	/nfs/dbraw/zinc/98/24/79/408982479.db2.gz	TUHZCGDKHVQUOJ-HZMBPMFUSA-N	1	1	319.361	1.816	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000292652552	409038869	/nfs/dbraw/zinc/03/88/69/409038869.db2.gz	BVKBJFLJVQFFMA-PHIMTYICSA-N	1	1	322.365	1.695	20	5		DDBDMO
CCOC(=O)c1ccnc(N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000292652552	409038871	/nfs/dbraw/zinc/03/88/71/409038871.db2.gz	BVKBJFLJVQFFMA-PHIMTYICSA-N	1	1	322.365	1.695	20	5		DDBDMO
CC(C)[C@H](NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ncc[nH]1	ZINC000283142075	409096838	/nfs/dbraw/zinc/09/68/38/409096838.db2.gz	XXLSIIATKJWCIE-JTQLQIEISA-N	1	1	305.294	1.546	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@H]([C@H](C)O)C2)cccc1[N+](=O)[O-]	ZINC000248529512	163596911	/nfs/dbraw/zinc/59/69/11/163596911.db2.gz	DSAWPCPXUKTZTM-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1CN(C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000293425310	409111057	/nfs/dbraw/zinc/11/10/57/409111057.db2.gz	NIWCFUDNCHPELC-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000293425310	409111063	/nfs/dbraw/zinc/11/10/63/409111063.db2.gz	NIWCFUDNCHPELC-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000293425310	409111065	/nfs/dbraw/zinc/11/10/65/409111065.db2.gz	NIWCFUDNCHPELC-HZSPNIEDSA-N	1	1	323.393	1.359	20	5		DDBDMO
CC(C)(C)[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CC(N)=O	ZINC000283292916	409130217	/nfs/dbraw/zinc/13/02/17/409130217.db2.gz	MSTPOZIUTSWEQQ-UHFFFAOYSA-N	1	1	322.365	1.509	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](C)N1CCN(C)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293872861	409198563	/nfs/dbraw/zinc/19/85/63/409198563.db2.gz	VACFQQYKYWAMPZ-STQMWFEESA-N	1	1	321.425	1.464	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)CC(C)(C)CO	ZINC000295164059	409350857	/nfs/dbraw/zinc/35/08/57/409350857.db2.gz	FRTXTPVWMKNYMN-ZDUSSCGKSA-N	1	1	312.366	1.285	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCN2CCO[C@H]1C2	ZINC000295389142	409460951	/nfs/dbraw/zinc/46/09/51/409460951.db2.gz	KZODMTYQMSYXRX-JYJNAYRXSA-N	1	1	321.377	1.033	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000318746110	164033537	/nfs/dbraw/zinc/03/35/37/164033537.db2.gz	YGRJQQHAHLLALN-JTQLQIEISA-N	1	1	310.329	1.482	20	5		DDBDMO
CNc1c(C(=O)N2CC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000324009200	164049249	/nfs/dbraw/zinc/04/92/49/164049249.db2.gz	NQLAIUFRNHSLCE-INIZCTEOSA-N	1	1	318.377	1.804	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408075846	164220052	/nfs/dbraw/zinc/22/00/52/164220052.db2.gz	ZYLWWTSLUVZGDQ-UWVGGRQHSA-N	1	1	317.349	1.636	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000408075846	164220054	/nfs/dbraw/zinc/22/00/54/164220054.db2.gz	ZYLWWTSLUVZGDQ-UWVGGRQHSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290694980	409490015	/nfs/dbraw/zinc/49/00/15/409490015.db2.gz	VDGLIZLEIRVDKA-NSHDSACASA-N	1	1	321.381	1.621	20	5		DDBDMO
C[C@@H]1CN(C(=O)NCCc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1C	ZINC000296300777	409497579	/nfs/dbraw/zinc/49/75/79/409497579.db2.gz	COBSTDSNBQEITK-BETUJISGSA-N	1	1	320.393	1.871	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1cccc(C(N)=O)c1[N+](=O)[O-]	ZINC000342406695	409602286	/nfs/dbraw/zinc/60/22/86/409602286.db2.gz	HWYPSNYELUMMQM-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000356891008	409690743	/nfs/dbraw/zinc/69/07/43/409690743.db2.gz	WCVYAGCNCZKOSW-QWHCGFSZSA-N	1	1	320.393	1.948	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCOC[C@@H]1C	ZINC000297929881	410050902	/nfs/dbraw/zinc/05/09/02/410050902.db2.gz	RCTCQSDATWFAFU-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCOC[C@@H]1C	ZINC000297929881	410050910	/nfs/dbraw/zinc/05/09/10/410050910.db2.gz	RCTCQSDATWFAFU-NSHDSACASA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(Cc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000339389467	410150437	/nfs/dbraw/zinc/15/04/37/410150437.db2.gz	CCSAYMMOILPBAN-HOTGVXAUSA-N	1	1	305.378	1.890	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)[C@@H]1C	ZINC000346695007	410088909	/nfs/dbraw/zinc/08/89/09/410088909.db2.gz	XRTIGVQTGIDDNE-ZWNOBZJWSA-N	1	1	308.334	1.987	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1C	ZINC000298236615	410144671	/nfs/dbraw/zinc/14/46/71/410144671.db2.gz	IJHGZKDSSORGMO-INIZCTEOSA-N	1	1	318.377	1.901	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000355065542	410280224	/nfs/dbraw/zinc/28/02/24/410280224.db2.gz	ZHTFFCWILVQLQO-UHFFFAOYSA-N	1	1	310.354	1.177	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000351774802	410224271	/nfs/dbraw/zinc/22/42/71/410224271.db2.gz	NXSDZXPXNLWHRK-LERXQTSPSA-N	1	1	305.334	1.013	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H]1O	ZINC000351774802	410224274	/nfs/dbraw/zinc/22/42/74/410224274.db2.gz	NXSDZXPXNLWHRK-LERXQTSPSA-N	1	1	305.334	1.013	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](C)[N@H+](C)C[C@H]1C	ZINC000352013315	410411986	/nfs/dbraw/zinc/41/19/86/410411986.db2.gz	IPRQUWYDWRMPJD-WDEREUQCSA-N	1	1	309.370	1.041	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1[C@@H](CO)CC[C@H]1CO	ZINC000347335062	410479392	/nfs/dbraw/zinc/47/93/92/410479392.db2.gz	NHQVUIIBYNJRFP-AOOOYVTPSA-N	1	1	300.742	1.566	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1[C@@H](CO)CC[C@H]1CO	ZINC000347335062	410479400	/nfs/dbraw/zinc/47/94/00/410479400.db2.gz	NHQVUIIBYNJRFP-AOOOYVTPSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343609415	410567543	/nfs/dbraw/zinc/56/75/43/410567543.db2.gz	SJUUGEFOEVFGRD-AAEUAGOBSA-N	1	1	306.366	1.877	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000299213248	410570119	/nfs/dbraw/zinc/57/01/19/410570119.db2.gz	HTDYELCWEUDVGJ-UHFFFAOYSA-N	1	1	307.350	1.389	20	5		DDBDMO
O=C(CCN1C[C@H]2C[NH2+]C[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000359305296	410591809	/nfs/dbraw/zinc/59/18/09/410591809.db2.gz	KTBHMENRKKTCNT-VXGBXAGGSA-N	1	1	304.350	1.075	20	5		DDBDMO
Cc1c(NC(=O)CCN2C[C@H]3C[NH2+]C[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000359305457	410593675	/nfs/dbraw/zinc/59/36/75/410593675.db2.gz	LCIQGKZSBDLDPQ-BETUJISGSA-N	1	1	318.377	1.383	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CCCOC1	ZINC000352204017	410543989	/nfs/dbraw/zinc/54/39/89/410543989.db2.gz	WFKVQLKOLZATEZ-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CCCOC1	ZINC000352204017	410543997	/nfs/dbraw/zinc/54/39/97/410543997.db2.gz	WFKVQLKOLZATEZ-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000343583945	410552711	/nfs/dbraw/zinc/55/27/11/410552711.db2.gz	ZIULSRCPHGZWRU-GFCCVEGCSA-N	1	1	323.397	1.517	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1ccco1	ZINC000352570402	410668544	/nfs/dbraw/zinc/66/85/44/410668544.db2.gz	GWJBGJLVCDRIAX-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCc1ccco1	ZINC000352570402	410668548	/nfs/dbraw/zinc/66/85/48/410668548.db2.gz	GWJBGJLVCDRIAX-UHFFFAOYSA-N	1	1	317.345	1.979	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](CCCNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000301197145	410674866	/nfs/dbraw/zinc/67/48/66/410674866.db2.gz	UQYJELUQTGODTP-NSHDSACASA-N	1	1	324.356	1.733	20	5		DDBDMO
CC[NH+](CC)C[C@H]1CCCC[C@@H]1NC(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000343807241	410715231	/nfs/dbraw/zinc/71/52/31/410715231.db2.gz	TURNZJDZRXJHQL-NEPJUHHUSA-N	1	1	323.397	1.948	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344064112	410933258	/nfs/dbraw/zinc/93/32/58/410933258.db2.gz	OSNAMWMAWKDLEC-ZAZJYDDPSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000344064112	410933261	/nfs/dbraw/zinc/93/32/61/410933261.db2.gz	OSNAMWMAWKDLEC-ZAZJYDDPSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@@H]1C[C@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000344133177	410979226	/nfs/dbraw/zinc/97/92/26/410979226.db2.gz	PVXWHSINWAOKJG-MGPQQGTHSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@@H]2CS(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000353467329	411007068	/nfs/dbraw/zinc/00/70/68/411007068.db2.gz	BFKHIONZKDEODA-GFCCVEGCSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@@H]2CS(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000353467329	411007073	/nfs/dbraw/zinc/00/70/73/411007073.db2.gz	BFKHIONZKDEODA-GFCCVEGCSA-N	1	1	313.379	1.156	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000356500216	411057154	/nfs/dbraw/zinc/05/71/54/411057154.db2.gz	DNRFUSMFKOMQHG-UHFFFAOYSA-N	1	1	308.382	1.208	20	5		DDBDMO
CN(CCCNC(=O)c1ccc([N+](=O)[O-])cc1)CC[NH+](C)C	ZINC000356500216	411057157	/nfs/dbraw/zinc/05/71/57/411057157.db2.gz	DNRFUSMFKOMQHG-UHFFFAOYSA-N	1	1	308.382	1.208	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@H]1CO	ZINC000331294351	411063129	/nfs/dbraw/zinc/06/31/29/411063129.db2.gz	XZKWBZGIPPBQTD-GXFFZTMASA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H](C)[C@H]1CO	ZINC000331294351	411063136	/nfs/dbraw/zinc/06/31/36/411063136.db2.gz	XZKWBZGIPPBQTD-GXFFZTMASA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(CC(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331426581	411084640	/nfs/dbraw/zinc/08/46/40/411084640.db2.gz	VCCZXDJVSPJGCL-CYBMUJFWSA-N	1	1	303.362	1.799	20	5		DDBDMO
C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc([S@](C)=O)cc1	ZINC000360211954	411102271	/nfs/dbraw/zinc/10/22/71/411102271.db2.gz	HJUCOAFYFVMDQZ-STFLBKPXSA-N	1	1	322.390	1.917	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC1(C)C	ZINC000295908390	225368059	/nfs/dbraw/zinc/36/80/59/225368059.db2.gz	HJGRIXHMGOEQPN-ZDUSSCGKSA-N	1	1	309.366	1.503	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCOC2)O1	ZINC000373805514	418462018	/nfs/dbraw/zinc/46/20/18/418462018.db2.gz	ODQZJDFEPCJMAA-ZIAGYGMSSA-N	1	1	310.354	1.061	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@]2(CCOC2)O1	ZINC000373805514	418462021	/nfs/dbraw/zinc/46/20/21/418462021.db2.gz	ODQZJDFEPCJMAA-ZIAGYGMSSA-N	1	1	310.354	1.061	20	5		DDBDMO
Cc1[nH+]ccn1CCn1cc(Br)c([N+](=O)[O-])n1	ZINC000049331475	418477211	/nfs/dbraw/zinc/47/72/11/418477211.db2.gz	RTWZWHVDFXJJSO-UHFFFAOYSA-N	1	1	300.116	1.759	20	5		DDBDMO
C[C@H]1CCOCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000374992223	418586501	/nfs/dbraw/zinc/58/65/01/418586501.db2.gz	WLEHDDKDNVWDMB-GXTWGEPZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000408071342	418785805	/nfs/dbraw/zinc/78/58/05/418785805.db2.gz	JVBCXBDCTJSHJD-NSHDSACASA-N	1	1	307.350	1.597	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@@H]21	ZINC000371559687	418800865	/nfs/dbraw/zinc/80/08/65/418800865.db2.gz	AHDIACKQTAIOBH-GWCFXTLKSA-N	1	1	304.350	1.343	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](c2ccnn2C)C1	ZINC000371823804	418819580	/nfs/dbraw/zinc/81/95/80/418819580.db2.gz	GZOVUGPXLORWER-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H](c2ccnn2C)C1	ZINC000371823804	418819582	/nfs/dbraw/zinc/81/95/82/418819582.db2.gz	GZOVUGPXLORWER-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000364881382	418820798	/nfs/dbraw/zinc/82/07/98/418820798.db2.gz	ITZZAKIHOUBVNR-NSHDSACASA-N	1	1	308.294	1.024	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000364881382	418820801	/nfs/dbraw/zinc/82/08/01/418820801.db2.gz	ITZZAKIHOUBVNR-NSHDSACASA-N	1	1	308.294	1.024	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc[nH]c2C1	ZINC000364950385	418827181	/nfs/dbraw/zinc/82/71/81/418827181.db2.gz	BYWCCIDOUXKKAL-MRVPVSSYSA-N	1	1	301.306	1.187	20	5		DDBDMO
COc1cc(N2CCC[N@H+]([C@@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000364954103	418828238	/nfs/dbraw/zinc/82/82/38/418828238.db2.gz	JLGDKYDOJOHHQG-LBPRGKRZSA-N	1	1	309.366	1.496	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(CCC[C@H]3[NH3+])C2)c1[N+](=O)[O-]	ZINC000372788094	418902302	/nfs/dbraw/zinc/90/23/02/418902302.db2.gz	TXJCABZQDQUKNR-ABAIWWIYSA-N	1	1	321.381	1.614	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000411763643	419399732	/nfs/dbraw/zinc/39/97/32/419399732.db2.gz	ZLKOUKRSHVYGMB-UHFFFAOYSA-N	1	1	308.338	1.121	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+](C[C@H]2C[C@@H](O)C2)CC1	ZINC000420981701	419406392	/nfs/dbraw/zinc/40/63/92/419406392.db2.gz	YTNUTBIKHYNLGA-BETUJISGSA-N	1	1	319.361	1.124	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H](CCO)CC1	ZINC000421008006	419443700	/nfs/dbraw/zinc/44/37/00/419443700.db2.gz	CXJLJVBUCSCBLY-ZDUSSCGKSA-N	1	1	309.366	1.241	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C)CC[C@@H]1C	ZINC000426899510	419569528	/nfs/dbraw/zinc/56/95/28/419569528.db2.gz	UXUFCCGJMVHLSB-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000412030463	419572270	/nfs/dbraw/zinc/57/22/70/419572270.db2.gz	FLPOSEODXIRBNI-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000412030463	419572277	/nfs/dbraw/zinc/57/22/77/419572277.db2.gz	FLPOSEODXIRBNI-RISCZKNCSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H](c1ccccc1)[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)C(N)=O	ZINC000428855623	228764412	/nfs/dbraw/zinc/76/44/12/228764412.db2.gz	HICHYZIFRZTDMR-MFKMUULPSA-N	1	1	317.349	1.076	20	5		DDBDMO
O=C(CN1CC[NH+](C2CC2)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000299318747	229047657	/nfs/dbraw/zinc/04/76/57/229047657.db2.gz	HIJLBRALCACXGD-UHFFFAOYSA-N	1	1	304.350	1.313	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@@H]3CNCCO3)o2)c1	ZINC000415095710	419941641	/nfs/dbraw/zinc/94/16/41/419941641.db2.gz	NTDHKMWCJDVLEJ-HNNXBMFYSA-N	1	1	317.345	1.933	20	5		DDBDMO
C[C@@H]1CC[C@H]([N@@H+](CCO)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000429794232	420049322	/nfs/dbraw/zinc/04/93/22/420049322.db2.gz	WTQKGLWUFBGJIV-RISCZKNCSA-N	1	1	321.377	1.677	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC(F)(F)C[NH3+]	ZINC000415586728	420119353	/nfs/dbraw/zinc/11/93/53/420119353.db2.gz	VVWBYSWLXVPHQU-UHFFFAOYSA-N	1	1	302.281	1.927	20	5		DDBDMO
COc1ccc(OCC[NH2+][C@](C)(CN)C2CC2)c([N+](=O)[O-])c1	ZINC000430562469	420139454	/nfs/dbraw/zinc/13/94/54/420139454.db2.gz	RMYGMIGXXZPZGK-OAHLLOKOSA-N	1	1	309.366	1.699	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000433775382	420254002	/nfs/dbraw/zinc/25/40/02/420254002.db2.gz	QUPDZYUWPHOVHM-NSHDSACASA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000433775382	420254004	/nfs/dbraw/zinc/25/40/04/420254004.db2.gz	QUPDZYUWPHOVHM-NSHDSACASA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000433775382	420254008	/nfs/dbraw/zinc/25/40/08/420254008.db2.gz	QUPDZYUWPHOVHM-NSHDSACASA-N	1	1	321.381	1.750	20	5		DDBDMO
CN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@H](C[NH3+])C1CC1	ZINC000423949472	420280192	/nfs/dbraw/zinc/28/01/92/420280192.db2.gz	MVHGOFHWGJPDBL-GFCCVEGCSA-N	1	1	303.322	1.280	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000416304218	420321519	/nfs/dbraw/zinc/32/15/19/420321519.db2.gz	YRTXKVJVWFEWJT-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@H]2C)cc([N+](=O)[O-])c1	ZINC000416304218	420321523	/nfs/dbraw/zinc/32/15/23/420321523.db2.gz	YRTXKVJVWFEWJT-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000416303860	420321971	/nfs/dbraw/zinc/32/19/71/420321971.db2.gz	HMXGOVLBYDOHJA-QWHCGFSZSA-N	1	1	321.377	1.051	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](c4nnc[nH]4)C3)nc2c1	ZINC000425555122	420417982	/nfs/dbraw/zinc/41/79/82/420417982.db2.gz	XKISTDSHLXGQEI-VIFPVBQESA-N	1	1	313.321	1.579	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[N@H+]3CC[C@H](c4nnc[nH]4)C3)nc2c1	ZINC000425555122	420417984	/nfs/dbraw/zinc/41/79/84/420417984.db2.gz	XKISTDSHLXGQEI-VIFPVBQESA-N	1	1	313.321	1.579	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000450959792	420570686	/nfs/dbraw/zinc/57/06/86/420570686.db2.gz	YXXGDUTWKVTWHG-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)C[C@@H]2C)c(F)cc1[N+](=O)[O-]	ZINC000450959792	420570690	/nfs/dbraw/zinc/57/06/90/420570690.db2.gz	YXXGDUTWKVTWHG-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000442132919	420671895	/nfs/dbraw/zinc/67/18/95/420671895.db2.gz	QKSDANHFBDIYED-JQWIXIFHSA-N	1	1	320.349	1.132	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCC2)[C@H]2COC[C@H]21	ZINC000459657317	420841688	/nfs/dbraw/zinc/84/16/88/420841688.db2.gz	FQDQOCPPLVNBHD-UONOGXRCSA-N	1	1	319.361	1.257	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)[C@@H](CO)C1	ZINC000459682949	420845293	/nfs/dbraw/zinc/84/52/93/420845293.db2.gz	FJPRSIVYNTUKFQ-OCCSQVGLSA-N	1	1	310.350	1.167	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)[C@@H](CO)C1	ZINC000459682949	420845298	/nfs/dbraw/zinc/84/52/98/420845298.db2.gz	FJPRSIVYNTUKFQ-OCCSQVGLSA-N	1	1	310.350	1.167	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(NC)n2)C1	ZINC000454924945	420944280	/nfs/dbraw/zinc/94/42/80/420944280.db2.gz	LFYJYRSMSLIPJO-JTQLQIEISA-N	1	1	307.354	1.103	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@@](O)(C2CC2)C1	ZINC000489268547	421142906	/nfs/dbraw/zinc/14/29/06/421142906.db2.gz	MSPKXGAXGXGEQD-INIZCTEOSA-N	1	1	319.361	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@@](O)(C2CC2)C1	ZINC000489268547	421142909	/nfs/dbraw/zinc/14/29/09/421142909.db2.gz	MSPKXGAXGXGEQD-INIZCTEOSA-N	1	1	319.361	1.689	20	5		DDBDMO
COCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CCOC1	ZINC000490051797	421187016	/nfs/dbraw/zinc/18/70/16/421187016.db2.gz	XEBJUUDGEGTODD-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CCOC1	ZINC000490051797	421187018	/nfs/dbraw/zinc/18/70/18/421187018.db2.gz	XEBJUUDGEGTODD-ZDUSSCGKSA-N	1	1	310.350	1.841	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CCCC[N@H+]2CCO)n1	ZINC000450609718	421217011	/nfs/dbraw/zinc/21/70/11/421217011.db2.gz	FZSZMAYFWBSXJI-CYBMUJFWSA-N	1	1	308.382	1.865	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@H+]2CC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000525803885	421303683	/nfs/dbraw/zinc/30/36/83/421303683.db2.gz	XYXAXFMQIPQLIY-JTQLQIEISA-N	1	1	309.370	1.342	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000516382877	421542609	/nfs/dbraw/zinc/54/26/09/421542609.db2.gz	MXEAFSRGTQFWER-GFCCVEGCSA-N	1	1	308.382	1.928	20	5		DDBDMO
CN1CCN(CCC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CC1	ZINC000571225099	421698674	/nfs/dbraw/zinc/69/86/74/421698674.db2.gz	SQHQITDMTLNZJF-INIZCTEOSA-N	1	1	318.421	1.809	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2c[nH]nc2[N+](=O)[O-])C[C@@H](C)C1	ZINC000556321753	421709036	/nfs/dbraw/zinc/70/90/36/421709036.db2.gz	HARCNJZARQDTRO-UMNHJUIQSA-N	1	1	307.354	1.120	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000559368080	421833769	/nfs/dbraw/zinc/83/37/69/421833769.db2.gz	VCGRNVOGNFSVKU-TXEJJXNPSA-N	1	1	323.397	1.806	20	5		DDBDMO
C[C@H](CN1CCN(C)CC1)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000572422983	421786758	/nfs/dbraw/zinc/78/67/58/421786758.db2.gz	NYKVOLPWCDIQIX-CJNGLKHVSA-N	1	1	318.421	1.808	20	5		DDBDMO
CC(C)Oc1nc(N[C@H]2CCc3c[nH+]cn3C2)ccc1[N+](=O)[O-]	ZINC000594581378	422349236	/nfs/dbraw/zinc/34/92/36/422349236.db2.gz	QTGZWQQDTVOWMG-NSHDSACASA-N	1	1	317.349	2.400	20	5		DDBDMO
C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1c(N)cccc1[N+](=O)[O-])C2	ZINC000597710152	422389715	/nfs/dbraw/zinc/38/97/15/422389715.db2.gz	IJXUXVJQJFKMKS-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275333421	274271233	/nfs/dbraw/zinc/27/12/33/274271233.db2.gz	GKGNAUPGRWGQCN-GHMZBOCLSA-N	1	1	324.337	1.394	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[C@H](C)C1	ZINC000275333421	274271238	/nfs/dbraw/zinc/27/12/38/274271238.db2.gz	GKGNAUPGRWGQCN-GHMZBOCLSA-N	1	1	324.337	1.394	20	5		DDBDMO
Cc1nc(N2C[C@H]([NH+]3CCOCC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000286175878	274843234	/nfs/dbraw/zinc/84/32/34/274843234.db2.gz	ADLRXUBZKVNDQH-DGCLKSJQSA-N	1	1	306.366	1.598	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[NH+](CCCO)CC1	ZINC000276542956	275034456	/nfs/dbraw/zinc/03/44/56/275034456.db2.gz	DLDAENYBHYLCMA-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC[C@@H]21	ZINC000133614716	277084568	/nfs/dbraw/zinc/08/45/68/277084568.db2.gz	SOPMXKQHYALAQB-STQMWFEESA-N	1	1	318.377	1.614	20	5		DDBDMO
C[N@@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@H]2C1	ZINC000285826301	277152609	/nfs/dbraw/zinc/15/26/09/277152609.db2.gz	PDGPJDBCRMDJGP-UWVGGRQHSA-N	1	1	311.363	1.201	20	5		DDBDMO
C[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])s3)[C@H]2C1	ZINC000285826301	277152610	/nfs/dbraw/zinc/15/26/10/277152610.db2.gz	PDGPJDBCRMDJGP-UWVGGRQHSA-N	1	1	311.363	1.201	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)CC[N@@H+](C)C1CC1	ZINC000186758734	279237319	/nfs/dbraw/zinc/23/73/19/279237319.db2.gz	FVECSPLNBAMNCT-GFCCVEGCSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCCCN2CC[NH+](C)CC2)n1	ZINC000121247661	281135032	/nfs/dbraw/zinc/13/50/32/281135032.db2.gz	BKQUGGNEHQNUNB-UHFFFAOYSA-N	1	1	307.398	1.738	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362079097	300002186	/nfs/dbraw/zinc/00/21/86/300002186.db2.gz	SVIYDAWWXKFAQT-RYUDHWBXSA-N	1	1	307.350	1.402	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362079097	300002187	/nfs/dbraw/zinc/00/21/87/300002187.db2.gz	SVIYDAWWXKFAQT-RYUDHWBXSA-N	1	1	307.350	1.402	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000362434294	300062074	/nfs/dbraw/zinc/06/20/74/300062074.db2.gz	RMBWJUHRUCVAFZ-NSHDSACASA-N	1	1	301.306	1.234	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000362434294	300062075	/nfs/dbraw/zinc/06/20/75/300062075.db2.gz	RMBWJUHRUCVAFZ-NSHDSACASA-N	1	1	301.306	1.234	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCOCC1	ZINC000363379584	300260267	/nfs/dbraw/zinc/26/02/67/300260267.db2.gz	SQCQMPWRLQTTOL-UHFFFAOYSA-N	1	1	323.349	1.654	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2ccc(F)cc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000363616939	300288259	/nfs/dbraw/zinc/28/82/59/300288259.db2.gz	YRKJPJBDRCESJV-GJZGRUSLSA-N	1	1	321.352	1.572	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1ccc([N+](=O)[O-])s1	ZINC000363692486	300297046	/nfs/dbraw/zinc/29/70/46/300297046.db2.gz	MRNJLXFDICYABA-VHSXEESVSA-N	1	1	311.363	1.249	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@H]2C1	ZINC000363877258	300320345	/nfs/dbraw/zinc/32/03/45/300320345.db2.gz	UGILMMBVZONAEV-WHOFXGATSA-N	1	1	316.361	1.546	20	5		DDBDMO
O=C1NCCCC[C@@H]1[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012313	301119136	/nfs/dbraw/zinc/11/91/36/301119136.db2.gz	UWTKDQWGXVZDII-YPMHNXCESA-N	1	1	307.354	1.097	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000369998240	301254733	/nfs/dbraw/zinc/25/47/33/301254733.db2.gz	QRCPFOHZFWNPPX-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000369998240	301254735	/nfs/dbraw/zinc/25/47/35/301254735.db2.gz	QRCPFOHZFWNPPX-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000369998240	301254737	/nfs/dbraw/zinc/25/47/37/301254737.db2.gz	QRCPFOHZFWNPPX-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
CC[C@H]1C[N@H+]2CCCC[C@H]2CN1Cc1c([N+](=O)[O-])ncn1C	ZINC000375869463	302007719	/nfs/dbraw/zinc/00/77/19/302007719.db2.gz	AGBULJABLODGJF-STQMWFEESA-N	1	1	307.398	1.777	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000377362861	302173075	/nfs/dbraw/zinc/17/30/75/302173075.db2.gz	QSSHTEFZDMSRPO-VHSXEESVSA-N	1	1	305.338	1.127	20	5		DDBDMO
COC(C)(C)C[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000533481671	303319455	/nfs/dbraw/zinc/31/94/55/303319455.db2.gz	WUKVPDDNCYSQLM-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
COC(C)(C)C[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000533481671	303319456	/nfs/dbraw/zinc/31/94/56/303319456.db2.gz	WUKVPDDNCYSQLM-UHFFFAOYSA-N	1	1	321.377	1.841	20	5		DDBDMO
CC1CC[NH+](C[C@@H]2CCCN(C(=O)[C@H]3CC3[N+](=O)[O-])C2)CC1	ZINC000364485932	307046429	/nfs/dbraw/zinc/04/64/29/307046429.db2.gz	SKMBJLXENRHXNE-KKUMJFAQSA-N	1	1	309.410	1.622	20	5		DDBDMO
CSC[C@@H](O)C[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372294466	307167819	/nfs/dbraw/zinc/16/78/19/307167819.db2.gz	JNMAYJPFDUZMTI-JQWIXIFHSA-N	1	1	300.384	1.152	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N1CCC(c2cnc[nH]2)CC1	ZINC000373310102	307184279	/nfs/dbraw/zinc/18/42/79/307184279.db2.gz	JPASZUPFUCVUKO-UHFFFAOYSA-N	1	1	316.321	1.546	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920460	307233163	/nfs/dbraw/zinc/23/31/63/307233163.db2.gz	NRMMBEIURUTKPK-DYEKYZERSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[C@@H]1OCC[C@]12C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C[C@@H](C)O2	ZINC000375920460	307233164	/nfs/dbraw/zinc/23/31/64/307233164.db2.gz	NRMMBEIURUTKPK-DYEKYZERSA-N	1	1	310.354	1.060	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)CC2	ZINC000378510919	307290906	/nfs/dbraw/zinc/29/09/06/307290906.db2.gz	JLIYIXYSOUMNIW-UHFFFAOYSA-N	1	1	318.377	1.877	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+](C)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000569987101	308155361	/nfs/dbraw/zinc/15/53/61/308155361.db2.gz	PMOAIIDHHQPIDY-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000569987101	308155362	/nfs/dbraw/zinc/15/53/62/308155362.db2.gz	PMOAIIDHHQPIDY-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3ccncc3)C2)c1	ZINC000570118843	308159547	/nfs/dbraw/zinc/15/95/47/308159547.db2.gz	YWHNPMKLKOUCEF-HIFRSBDPSA-N	1	1	317.349	1.037	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(C2)CCC[NH2+]C3)c1[N+](=O)[O-]	ZINC000573968119	308257349	/nfs/dbraw/zinc/25/73/49/308257349.db2.gz	GMLBVFAIRYRGCM-HNNXBMFYSA-N	1	1	321.381	1.486	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(c2nccc(C(N)=O)c2[N+](=O)[O-])CC1	ZINC000574128206	308261891	/nfs/dbraw/zinc/26/18/91/308261891.db2.gz	NLUKLTPAPUWNDR-UHFFFAOYSA-N	1	1	321.381	1.399	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](CO)[C@H](O)C1	ZINC000574228351	308266020	/nfs/dbraw/zinc/26/60/20/308266020.db2.gz	ZBXWQMNEJKGHPQ-SWLSCSKDSA-N	1	1	324.377	1.557	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](CO)[C@H](O)C1	ZINC000574228351	308266021	/nfs/dbraw/zinc/26/60/21/308266021.db2.gz	ZBXWQMNEJKGHPQ-SWLSCSKDSA-N	1	1	324.377	1.557	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCC[C@H]1C	ZINC000487986705	484212848	/nfs/dbraw/zinc/21/28/48/484212848.db2.gz	JZFOEXLZWYEGIN-HIFRSBDPSA-N	1	1	323.393	1.894	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCC[C@@H]1C	ZINC000487986707	484212997	/nfs/dbraw/zinc/21/29/97/484212997.db2.gz	JZFOEXLZWYEGIN-ZFWWWQNUSA-N	1	1	323.393	1.894	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000488727964	484215512	/nfs/dbraw/zinc/21/55/12/484215512.db2.gz	WZZVIZLGSRHLMJ-YPMHNXCESA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000595875163	490372424	/nfs/dbraw/zinc/37/24/24/490372424.db2.gz	PWFBSUPWRHBQGQ-WWGRRREGSA-N	1	1	324.377	1.285	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H]2CC[N@H+](C)[C@H]2C1	ZINC000451637233	534338653	/nfs/dbraw/zinc/33/86/53/534338653.db2.gz	XEMRYOZYPMUDKE-DOMZBBRYSA-N	1	1	318.377	1.478	20	5		DDBDMO
O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)NC1CCCC1	ZINC000331694822	534417533	/nfs/dbraw/zinc/41/75/33/534417533.db2.gz	VZOLBIBKUOPVSP-UHFFFAOYSA-N	1	1	318.377	1.797	20	5		DDBDMO
O=C(NCC[C@H]1CCC[NH2+]1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000444268521	534427500	/nfs/dbraw/zinc/42/75/00/534427500.db2.gz	RKELPCDSHPLVPW-SECBINFHSA-N	1	1	303.322	1.343	20	5		DDBDMO
CC(C)(C[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1)C(N)=O	ZINC000295687089	527226980	/nfs/dbraw/zinc/22/69/80/527226980.db2.gz	SHXVCKGNDHYREL-LBPRGKRZSA-N	1	1	323.397	1.405	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000451933574	527785587	/nfs/dbraw/zinc/78/55/87/527785587.db2.gz	FJWMSBSASUZPAI-ZIAGYGMSSA-N	1	1	323.349	1.235	20	5		DDBDMO
CCO[C@@H]1COC[C@H]1[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000451938522	527789772	/nfs/dbraw/zinc/78/97/72/527789772.db2.gz	OEUMTEMZJQTHOG-ZLKJLUDKSA-N	1	1	323.349	1.315	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cnc2N)[C@@H](C)C1	ZINC000330832853	527827481	/nfs/dbraw/zinc/82/74/81/527827481.db2.gz	VKJCIBVOVSVOEE-GWCFXTLKSA-N	1	1	321.381	1.374	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000451546094	528062294	/nfs/dbraw/zinc/06/22/94/528062294.db2.gz	RUWREUVSSJMUOK-NHYWBVRUSA-N	1	1	321.377	1.941	20	5		DDBDMO
C[C@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@@H+](C)C1CC1	ZINC000736025457	598522897	/nfs/dbraw/zinc/52/28/97/598522897.db2.gz	GXOQJEUSYRABMZ-SECBINFHSA-N	1	1	317.353	1.670	20	5		DDBDMO
CCOCC[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000092885242	696597853	/nfs/dbraw/zinc/59/78/53/696597853.db2.gz	KPLXYMFGNCBMFO-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
CCOCC[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000092885242	696597854	/nfs/dbraw/zinc/59/78/54/696597854.db2.gz	KPLXYMFGNCBMFO-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2CCC[N@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000108461806	696634064	/nfs/dbraw/zinc/63/40/64/696634064.db2.gz	RPAABVKNVLBBKM-NSHDSACASA-N	1	1	306.366	1.557	20	5		DDBDMO
O=[N+]([O-])c1cnn(CN2CC[C@@H]3[C@H](CCC[N@H+]3C3CC3)C2)c1	ZINC000157987746	696984944	/nfs/dbraw/zinc/98/49/44/696984944.db2.gz	OVAIUKVHOSXOKK-IUODEOHRSA-N	1	1	305.382	1.698	20	5		DDBDMO
COC(=O)/C(C)=C\C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816053	700136364	/nfs/dbraw/zinc/13/63/64/700136364.db2.gz	CKOORCXASLVZPM-QJGQKNTRSA-N	1	1	320.349	1.595	20	5		DDBDMO
COC(=O)/C(C)=C\C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000748816053	700136365	/nfs/dbraw/zinc/13/63/65/700136365.db2.gz	CKOORCXASLVZPM-QJGQKNTRSA-N	1	1	320.349	1.595	20	5		DDBDMO
Cc1cc(C(=O)NCC[N@@H+]2CC[C@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000749413523	700163120	/nfs/dbraw/zinc/16/31/20/700163120.db2.gz	MIANDDXFRXGKTM-JTQLQIEISA-N	1	1	306.366	1.557	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H](OCCO)C2)cc1	ZINC000776585044	698122117	/nfs/dbraw/zinc/12/21/17/698122117.db2.gz	RQPJJGMQMHEHPO-GJZGRUSLSA-N	1	1	310.350	1.102	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)c2cc3nsnc3c([N+](=O)[O-])c2)C1	ZINC000778260573	698254753	/nfs/dbraw/zinc/25/47/53/698254753.db2.gz	BKJBHQJUPKBTCL-VIFPVBQESA-N	1	1	321.362	1.424	20	5		DDBDMO
O=[N+]([O-])c1ccnn1CN1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000246411953	698349279	/nfs/dbraw/zinc/34/92/79/698349279.db2.gz	QSWSDVLYGBYIRR-GXTWGEPZSA-N	1	1	305.382	1.698	20	5		DDBDMO
Cc1nn(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)c(C)c1[N+](=O)[O-]	ZINC000247045956	698360203	/nfs/dbraw/zinc/36/02/03/698360203.db2.gz	MZAGRNWYCZOTBP-KBPBESRZSA-N	1	1	307.398	1.782	20	5		DDBDMO
Cn1ccnc1[C@H](N[C@@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000780764751	698558305	/nfs/dbraw/zinc/55/83/05/698558305.db2.gz	PVXHBMAJFBIZAR-UKRRQHHQSA-N	1	1	315.377	1.711	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000731455909	699529176	/nfs/dbraw/zinc/52/91/76/699529176.db2.gz	XGRXQMVBAAUZTA-GXTWGEPZSA-N	1	1	323.324	1.327	20	5		DDBDMO
COc1cccc(OC)c1OC1CC[NH+](CC[N+](=O)[O-])CC1	ZINC000791051975	699609010	/nfs/dbraw/zinc/60/90/10/699609010.db2.gz	IZRHIHLYQOVGSU-UHFFFAOYSA-N	1	1	310.350	1.824	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000791255962	699617862	/nfs/dbraw/zinc/61/78/62/699617862.db2.gz	AWMIERYDCUSQTN-OCCSQVGLSA-N	1	1	322.340	1.435	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@@H+]1C	ZINC000742200598	699866946	/nfs/dbraw/zinc/86/69/46/699866946.db2.gz	ZLJSMXICGUYTES-NSHDSACASA-N	1	1	306.366	1.437	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C	ZINC000742200598	699866949	/nfs/dbraw/zinc/86/69/49/699866949.db2.gz	ZLJSMXICGUYTES-NSHDSACASA-N	1	1	306.366	1.437	20	5		DDBDMO
COc1c(C(=O)OCCn2cc[nH+]c2C)cccc1[N+](=O)[O-]	ZINC000796308983	699925378	/nfs/dbraw/zinc/92/53/78/699925378.db2.gz	MCVNBJVDTVCPIE-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801939521	700358452	/nfs/dbraw/zinc/35/84/52/700358452.db2.gz	FNPHLGVIWLEHOA-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801939521	700358456	/nfs/dbraw/zinc/35/84/56/700358456.db2.gz	FNPHLGVIWLEHOA-DTWKUNHWSA-N	1	1	310.329	1.481	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000762207903	700885117	/nfs/dbraw/zinc/88/51/17/700885117.db2.gz	UUEZUKMKHBOGRZ-UHFFFAOYSA-N	1	1	303.322	1.740	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CC[NH+](CCCCO)CC1	ZINC000804501868	701196383	/nfs/dbraw/zinc/19/63/83/701196383.db2.gz	GESBEWQJFOXXJV-UHFFFAOYSA-N	1	1	324.337	1.398	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140404	701234023	/nfs/dbraw/zinc/23/40/23/701234023.db2.gz	OJBJWARMTSCCDH-QWRGUYRKSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000769140404	701234025	/nfs/dbraw/zinc/23/40/25/701234025.db2.gz	OJBJWARMTSCCDH-QWRGUYRKSA-N	1	1	306.366	1.650	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000769145161	701234423	/nfs/dbraw/zinc/23/44/23/701234423.db2.gz	MHXOFCYHURQUEJ-RYUDHWBXSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000769145161	701234424	/nfs/dbraw/zinc/23/44/24/701234424.db2.gz	MHXOFCYHURQUEJ-RYUDHWBXSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)Cc2cccc(F)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000866073870	706611283	/nfs/dbraw/zinc/61/12/83/706611283.db2.gz	UVXIRYYAJSZOAI-CMPLNLGQSA-N	1	1	309.341	1.875	20	5		DDBDMO
Cc1ccccc1[C@H]([C@@H](C)NC(=O)[C@@H]1CC1[N+](=O)[O-])[NH+](C)C	ZINC000839761216	701814800	/nfs/dbraw/zinc/81/48/00/701814800.db2.gz	LYPMYJQNMIXRSA-NGFQHRJXSA-N	1	1	305.378	1.768	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1CC[C@@]2(CCOC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000867956014	701853069	/nfs/dbraw/zinc/85/30/69/701853069.db2.gz	JRGPGFAYQNYDMO-HZPDHXFCSA-N	1	1	319.361	1.408	20	5		DDBDMO
C[C@@H]1OCCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000867970148	701862673	/nfs/dbraw/zinc/86/26/73/701862673.db2.gz	WWQQIXYKRLNUPJ-ZIBATOQPSA-N	1	1	307.350	1.405	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2ccc(C)cc2[N+](=O)[O-])CC1	ZINC000840356959	702082367	/nfs/dbraw/zinc/08/23/67/702082367.db2.gz	FYUZBVVAFBEBKB-UHFFFAOYSA-N	1	1	323.393	1.687	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000812344177	702166878	/nfs/dbraw/zinc/16/68/78/702166878.db2.gz	PVHAUXYQTVKAOE-CABCVRRESA-N	1	1	317.389	1.856	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866205424	706647852	/nfs/dbraw/zinc/64/78/52/706647852.db2.gz	LULDMJKBSFQFIX-CHWSQXEVSA-N	1	1	318.377	1.485	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)n1	ZINC000866209055	706649242	/nfs/dbraw/zinc/64/92/42/706649242.db2.gz	PBMVOPDXBBHGPZ-JQWIXIFHSA-N	1	1	320.349	1.307	20	5		DDBDMO
Cc1cc(F)cc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC000816953612	702237968	/nfs/dbraw/zinc/23/79/68/702237968.db2.gz	KJWUOKUPMYUVMQ-MFKMUULPSA-N	1	1	307.325	1.818	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC(F)(F)[C@@H](CO)C2)cc1	ZINC000812860298	702252655	/nfs/dbraw/zinc/25/26/55/702252655.db2.gz	XPGYTMJWWFGZPB-DGCLKSJQSA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC(F)(F)[C@@H](CO)C2)cc1	ZINC000812860298	702252659	/nfs/dbraw/zinc/25/26/59/702252659.db2.gz	XPGYTMJWWFGZPB-DGCLKSJQSA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC(F)(F)[C@H](CO)C2)cc1	ZINC000812860299	702253248	/nfs/dbraw/zinc/25/32/48/702253248.db2.gz	XPGYTMJWWFGZPB-WCQYABFASA-N	1	1	316.304	1.578	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC(F)(F)[C@H](CO)C2)cc1	ZINC000812860299	702253254	/nfs/dbraw/zinc/25/32/54/702253254.db2.gz	XPGYTMJWWFGZPB-WCQYABFASA-N	1	1	316.304	1.578	20	5		DDBDMO
N[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1	ZINC000841051027	702325824	/nfs/dbraw/zinc/32/58/24/702325824.db2.gz	MSWDPBVLYZDAEM-MRXNPFEDSA-N	1	1	304.394	1.891	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](COC(=O)Cn2ccc([N+](=O)[O-])n2)C1	ZINC000842832239	702781415	/nfs/dbraw/zinc/78/14/15/702781415.db2.gz	BLMGPPDXEBVNHH-LBPRGKRZSA-N	1	1	310.354	1.455	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCOCC1	ZINC000843969267	702947575	/nfs/dbraw/zinc/94/75/75/702947575.db2.gz	ZVDKBJXJJJCVEN-UHFFFAOYSA-N	1	1	308.338	1.297	20	5		DDBDMO
CC1(C)C[C@@H](O)C[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879614943	706738842	/nfs/dbraw/zinc/73/88/42/706738842.db2.gz	CKUFJPJTQLUXPA-ZIAGYGMSSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H]1CN(Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H](C)[N@@H+]1CCO	ZINC000831805358	706784156	/nfs/dbraw/zinc/78/41/56/706784156.db2.gz	VFQIZBQVCLSECG-TXEJJXNPSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@](O)(C3CC3)C2)cc1	ZINC000852500765	704064039	/nfs/dbraw/zinc/06/40/39/704064039.db2.gz	DKDYKZIVGDFEFH-HOTGVXAUSA-N	1	1	306.362	1.865	20	5		DDBDMO
CCOC[C@@H]1CCN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870897301	704161273	/nfs/dbraw/zinc/16/12/73/704161273.db2.gz	BGUMDMIEIRNJSI-MLGOLLRUSA-N	1	1	321.377	1.654	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)[C@](C)(N)c1cccc([N+](=O)[O-])c1	ZINC000870928108	704172281	/nfs/dbraw/zinc/17/22/81/704172281.db2.gz	DXGVAHGXBNLCKV-MRXNPFEDSA-N	1	1	320.393	1.321	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CCC1(C)C	ZINC000871155840	704232994	/nfs/dbraw/zinc/23/29/94/704232994.db2.gz	FBVKVOWZHHORTM-UHFFFAOYSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)[C@@H]2C[C@@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000820272087	704250371	/nfs/dbraw/zinc/25/03/71/704250371.db2.gz	JGIOFBOYOXQOLY-XZDPQHSOSA-N	1	1	315.373	1.861	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000821329052	704391827	/nfs/dbraw/zinc/39/18/27/704391827.db2.gz	UORKZCKIBIBKOJ-GASCZTMLSA-N	1	1	303.362	1.547	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000874837367	705194219	/nfs/dbraw/zinc/19/42/19/705194219.db2.gz	IGUMGLORBWHUKB-STQMWFEESA-N	1	1	321.381	1.222	20	5		DDBDMO
CNc1ccc(C(=O)N2CC[C@H]3[C@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848396	705202409	/nfs/dbraw/zinc/20/24/09/705202409.db2.gz	SGBVGBZXBBYDNV-UONOGXRCSA-N	1	1	318.377	1.945	20	5		DDBDMO
CC[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000823985929	705349740	/nfs/dbraw/zinc/34/97/40/705349740.db2.gz	FGIWWIRHWPWGDE-LLVKDONJSA-N	1	1	321.381	1.983	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2F)C[C@@H]1C	ZINC000826632483	705829680	/nfs/dbraw/zinc/82/96/80/705829680.db2.gz	GXUMUOZLXJTCMT-PHIMTYICSA-N	1	1	312.345	1.674	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ncc([N+](=O)[O-])cc2F)C[C@@H]1C	ZINC000826632483	705829684	/nfs/dbraw/zinc/82/96/84/705829684.db2.gz	GXUMUOZLXJTCMT-PHIMTYICSA-N	1	1	312.345	1.674	20	5		DDBDMO
CN(C)c1[nH+]cc(CNC(=O)c2cc([N+](=O)[O-])ccc2F)n1C	ZINC000827471622	706009271	/nfs/dbraw/zinc/00/92/71/706009271.db2.gz	RNMNKRZIJRDWCJ-UHFFFAOYSA-N	1	1	321.312	1.463	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@@H+](Cc2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000877652129	706170630	/nfs/dbraw/zinc/17/06/30/706170630.db2.gz	BFVNYHDZINXWDY-MRXNPFEDSA-N	1	1	322.361	1.976	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000865608592	706476458	/nfs/dbraw/zinc/47/64/58/706476458.db2.gz	LLRKTLWETGJQLA-LLVKDONJSA-N	1	1	309.341	1.734	20	5		DDBDMO
Cn1c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cnc1Cl	ZINC000865702901	706500233	/nfs/dbraw/zinc/50/02/33/706500233.db2.gz	HYSZEXJKDYUOOS-AWEZNQCLSA-N	1	1	324.768	1.979	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000865998869	706589791	/nfs/dbraw/zinc/58/97/91/706589791.db2.gz	UJFFMCYVQUFREG-ZDUSSCGKSA-N	1	1	323.393	1.998	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@H](C(F)(F)F)O1	ZINC000880056156	706865727	/nfs/dbraw/zinc/86/57/27/706865727.db2.gz	CAELRYGIQQLFMN-VHSXEESVSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CC[C@H](C(F)(F)F)O1	ZINC000880056156	706865729	/nfs/dbraw/zinc/86/57/29/706865729.db2.gz	CAELRYGIQQLFMN-VHSXEESVSA-N	1	1	322.287	1.833	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000880134028	706886262	/nfs/dbraw/zinc/88/62/62/706886262.db2.gz	LIXPZBIFJYGJHD-KBPBESRZSA-N	1	1	318.377	1.362	20	5		DDBDMO
O=C1[C@H]([N@H+]2CC[C@H](CF)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000880296667	706932030	/nfs/dbraw/zinc/93/20/30/706932030.db2.gz	FSVYVZSPYRBSOS-BXUZGUMPSA-N	1	1	307.325	1.992	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432290	706973748	/nfs/dbraw/zinc/97/37/48/706973748.db2.gz	NAQPICPLXRZSMY-ZIAGYGMSSA-N	1	1	320.349	1.707	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000880432290	706973749	/nfs/dbraw/zinc/97/37/49/706973749.db2.gz	NAQPICPLXRZSMY-ZIAGYGMSSA-N	1	1	320.349	1.707	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)cc1NC[C@]1(CO)COCC[NH2+]1	ZINC000882730913	707764327	/nfs/dbraw/zinc/76/43/27/707764327.db2.gz	PVZYUWMJNHMUQN-LBPRGKRZSA-N	1	1	301.730	1.011	20	5		DDBDMO
COc1cccc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c1[N+](=O)[O-]	ZINC000897222344	708259697	/nfs/dbraw/zinc/25/96/97/708259697.db2.gz	UQGGXSVURIMMGA-STQMWFEESA-N	1	1	321.377	1.639	20	5		DDBDMO
Cn1cc(COC(=O)CC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])n1	ZINC000884504575	708318071	/nfs/dbraw/zinc/31/80/71/708318071.db2.gz	LYAZYUVNFSVZON-LBPRGKRZSA-N	1	1	310.354	1.636	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@]3(CO)CCC[C@@H]23)c1	ZINC000886631177	708798963	/nfs/dbraw/zinc/79/89/63/708798963.db2.gz	FWGGFDQSAGZJHH-BZUAXINKSA-N	1	1	306.362	1.865	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC[C@@]3(CO)CCC[C@@H]23)cc1	ZINC000886631260	708799036	/nfs/dbraw/zinc/79/90/36/708799036.db2.gz	IITUCMKALCKUFG-ARFHVFGLSA-N	1	1	306.362	1.865	20	5		DDBDMO
C[N@@H+]1C[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887930362	709168414	/nfs/dbraw/zinc/16/84/14/709168414.db2.gz	FHJSIRSMHYKDMD-ABAIWWIYSA-N	1	1	305.334	1.324	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887930362	709168417	/nfs/dbraw/zinc/16/84/17/709168417.db2.gz	FHJSIRSMHYKDMD-ABAIWWIYSA-N	1	1	305.334	1.324	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000910288547	709868876	/nfs/dbraw/zinc/86/88/76/709868876.db2.gz	WUEOVJAKWNMZIH-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCOC(=O)c2ccc([N+](=O)[O-])n2C)CCO1	ZINC000893392419	710633823	/nfs/dbraw/zinc/63/38/23/710633823.db2.gz	RULUGCJNNJPIOM-LLVKDONJSA-N	1	1	311.338	1.201	20	5		DDBDMO
CO[C@H]1CC[C@@H]1[N@@H+](C)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000902635602	710830831	/nfs/dbraw/zinc/83/08/31/710830831.db2.gz	AWYHMDWWNQMIRW-STQMWFEESA-N	1	1	305.338	1.715	20	5		DDBDMO
CC(C)Oc1nc(N2CC[C@@H]3C[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000893933534	710891597	/nfs/dbraw/zinc/89/15/97/710891597.db2.gz	AQNYLQMMVITDOE-YPMHNXCESA-N	1	1	306.366	1.917	20	5		DDBDMO
Cc1c(CNC(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC000894395851	711102161	/nfs/dbraw/zinc/10/21/61/711102161.db2.gz	BZEASVCPSMRHBF-ZFWWWQNUSA-N	1	1	318.377	1.749	20	5		DDBDMO
C[N@@H+]1CC[C@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000928564872	713230124	/nfs/dbraw/zinc/23/01/24/713230124.db2.gz	GFFVDLSLQCFZRW-ZDUSSCGKSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000928564872	713230126	/nfs/dbraw/zinc/23/01/26/713230126.db2.gz	GFFVDLSLQCFZRW-ZDUSSCGKSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328400	711485682	/nfs/dbraw/zinc/48/56/82/711485682.db2.gz	FZUADFQDTPVDTO-MFKMUULPSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000895328400	711485684	/nfs/dbraw/zinc/48/56/84/711485684.db2.gz	FZUADFQDTPVDTO-MFKMUULPSA-N	1	1	300.742	1.566	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[N@@H+]2CCSC[C@H]12	ZINC000895570474	711545801	/nfs/dbraw/zinc/54/58/01/711545801.db2.gz	UMDURPGDSTZAHN-NWDGAFQWSA-N	1	1	324.406	1.990	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[N@H+]2CCSC[C@H]12	ZINC000895570474	711545802	/nfs/dbraw/zinc/54/58/02/711545802.db2.gz	UMDURPGDSTZAHN-NWDGAFQWSA-N	1	1	324.406	1.990	20	5		DDBDMO
CCOC(=O)c1ccnc(N[C@@H]2CC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000895739037	711591822	/nfs/dbraw/zinc/59/18/22/711591822.db2.gz	AMOJNYWTCWUWIP-GXSJLCMTSA-N	1	1	308.338	1.671	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)N[C@@H]1CC[N@@H+](C)[C@H]1C	ZINC000914290940	713371543	/nfs/dbraw/zinc/37/15/43/713371543.db2.gz	FIQKQXVWVFYDJR-GXFFZTMASA-N	1	1	322.365	1.495	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1Cn1c(=O)onc1-c1cccc([N+](=O)[O-])c1	ZINC000917686709	713509865	/nfs/dbraw/zinc/50/98/65/713509865.db2.gz	XYXGWVNKDKWWGC-GFCCVEGCSA-N	1	1	304.306	1.506	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCO[C@H]3CCOC3)CC2)cc1	ZINC000929154075	713557989	/nfs/dbraw/zinc/55/79/89/713557989.db2.gz	HKAKXMFCQUTPCK-INIZCTEOSA-N	1	1	321.377	1.522	20	5		DDBDMO
CC(C)(C)OC(=O)N1C[C@]2(C)C[N@H+](CC[N+](=O)[O-])C[C@]2(C)C1	ZINC000931328624	714068750	/nfs/dbraw/zinc/06/87/50/714068750.db2.gz	DZRNQUHZHLVIBQ-GASCZTMLSA-N	1	1	313.398	1.842	20	5		DDBDMO
CC(C)(C)OC(=O)N1C[C@]2(C)C[N@@H+](CC[N+](=O)[O-])C[C@]2(C)C1	ZINC000931328624	714068751	/nfs/dbraw/zinc/06/87/51/714068751.db2.gz	DZRNQUHZHLVIBQ-GASCZTMLSA-N	1	1	313.398	1.842	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C(=O)NCC1(C)C	ZINC000931664232	714154533	/nfs/dbraw/zinc/15/45/33/714154533.db2.gz	YJHPXQNTGVOOHD-AWEZNQCLSA-N	1	1	321.377	1.996	20	5		DDBDMO
COC(=O)C[C@@H]1C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000932105415	714260249	/nfs/dbraw/zinc/26/02/49/714260249.db2.gz	UXICHFLJEWKUET-UXIGCNINSA-N	1	1	322.361	1.759	20	5		DDBDMO
CCOC(=O)[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000932644235	714373376	/nfs/dbraw/zinc/37/33/76/714373376.db2.gz	HKPUXNHGSIEVEU-JSGCOSHPSA-N	1	1	308.334	1.513	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCOc3ccccc3[C@H]2CO)n1	ZINC000933383086	714577230	/nfs/dbraw/zinc/57/72/30/714577230.db2.gz	KXQQAEPZBFQNCN-CYBMUJFWSA-N	1	1	318.333	1.219	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCOc3ccccc3[C@H]2CO)n1	ZINC000933383086	714577232	/nfs/dbraw/zinc/57/72/32/714577232.db2.gz	KXQQAEPZBFQNCN-CYBMUJFWSA-N	1	1	318.333	1.219	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](CC)CCC(=O)NC	ZINC000933867845	714687517	/nfs/dbraw/zinc/68/75/17/714687517.db2.gz	QACITXCCNZJWSF-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122783	714748812	/nfs/dbraw/zinc/74/88/12/714748812.db2.gz	WOIFGXQCGSYYQT-KGLIPLIRSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[C@H]1[N@@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000934122783	714748815	/nfs/dbraw/zinc/74/88/15/714748815.db2.gz	WOIFGXQCGSYYQT-KGLIPLIRSA-N	1	1	307.350	1.951	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000935779421	715127940	/nfs/dbraw/zinc/12/79/40/715127940.db2.gz	YISRWQHOACKXLS-GFCCVEGCSA-N	1	1	309.370	1.042	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CCC2CCCC2)C1	ZINC000950056147	720469823	/nfs/dbraw/zinc/46/98/23/720469823.db2.gz	UVQLXNINQWBDHW-HUUCEWRRSA-N	1	1	309.410	1.765	20	5		DDBDMO
O=C(NCC[NH2+]Cc1ccc(F)c(Cl)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932243	742776643	/nfs/dbraw/zinc/77/66/43/742776643.db2.gz	OAEHJTJOXAYHSP-BXKDBHETSA-N	1	1	315.732	1.350	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](CO)CC(F)F)nc2c1	ZINC001180865675	742971065	/nfs/dbraw/zinc/97/10/65/742971065.db2.gz	QVDGKBNVEDPOBZ-SSDOTTSWSA-N	1	1	301.249	1.842	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134270	743705418	/nfs/dbraw/zinc/70/54/18/743705418.db2.gz	GUQDOYDNBAQSQB-AAEUAGOBSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@]1(CO)C[C@H](O)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134270	743705421	/nfs/dbraw/zinc/70/54/21/743705421.db2.gz	GUQDOYDNBAQSQB-AAEUAGOBSA-N	1	1	300.742	1.566	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](CO)[C@H](CCO)C1	ZINC001184364203	744020051	/nfs/dbraw/zinc/02/00/51/744020051.db2.gz	OOJSGTIPHGIZPV-HUTFFOLGSA-N	1	1	320.389	1.921	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(c2nn(C)cc2[N+](=O)[O-])CC1	ZINC001186881358	744458371	/nfs/dbraw/zinc/45/83/71/744458371.db2.gz	NZKVDOUEJNUZSI-LLVKDONJSA-N	1	1	309.370	1.018	20	5		DDBDMO
C[C@@H](O)[C@@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC001194723998	746449771	/nfs/dbraw/zinc/44/97/71/746449771.db2.gz	PKXDHVRPLYZCIT-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
CCNC(=O)CO[C@@H]1CCC[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)C1	ZINC001169039941	762193429	/nfs/dbraw/zinc/19/34/29/762193429.db2.gz	WAXJDACLXJLFCZ-MGPQQGTHSA-N	1	1	313.398	1.049	20	5		DDBDMO
COc1cc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)ccn1	ZINC001169056365	762211241	/nfs/dbraw/zinc/21/12/41/762211241.db2.gz	SLESEXBMHIKDRB-GZBFAFLISA-N	1	1	321.377	1.989	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1CO	ZINC000828725192	759755835	/nfs/dbraw/zinc/75/58/35/759755835.db2.gz	RHRHIORXCJIEBH-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
C[N@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@H]1CO	ZINC000828725192	759755839	/nfs/dbraw/zinc/75/58/39/759755839.db2.gz	RHRHIORXCJIEBH-NSHDSACASA-N	1	1	302.334	1.256	20	5		DDBDMO
O=C(N[C@H]1C[C@H]([NH2+]Cc2ccccc2Cl)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001020138976	760613137	/nfs/dbraw/zinc/61/31/37/760613137.db2.gz	KSBWPOAKKSSRDK-HKUMRIAESA-N	1	1	323.780	1.742	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CCC3(CC3)CC2)C1	ZINC001042710262	764378201	/nfs/dbraw/zinc/37/82/01/764378201.db2.gz	AVGBIVRBXSPSGA-HUUCEWRRSA-N	1	1	321.421	1.765	20	5		DDBDMO
CC(=O)NCCC[NH+]1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC001096242590	768737862	/nfs/dbraw/zinc/73/78/62/768737862.db2.gz	AUTUOPFPKLTKMP-UHFFFAOYSA-N	1	1	324.356	1.382	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1nccc(Br)c1[N+](=O)[O-]	ZINC001170900030	771898318	/nfs/dbraw/zinc/89/83/18/771898318.db2.gz	HIRSRMILQRRLPC-SSDOTTSWSA-N	1	1	304.148	1.188	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCNc1ccc([N+](=O)[O-])cc1F	ZINC001093674328	774989278	/nfs/dbraw/zinc/98/92/78/774989278.db2.gz	VHFYGDJRJOGMHN-UHFFFAOYSA-N	1	1	312.345	1.602	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1ccc(C)cc1[N+](=O)[O-]	ZINC001094008571	775325742	/nfs/dbraw/zinc/32/57/42/775325742.db2.gz	QINJUTHMHHINNO-UHFFFAOYSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCN(C)c1ccc([N+](=O)[O-])cn1	ZINC001100204111	775816135	/nfs/dbraw/zinc/81/61/35/775816135.db2.gz	UWSBPJAWPIEDFO-UHFFFAOYSA-N	1	1	323.397	1.273	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N(C)CCNc1ccccc1[N+](=O)[O-]	ZINC001101875327	777634233	/nfs/dbraw/zinc/63/42/33/777634233.db2.gz	SIRAEOGCRORLCL-UHFFFAOYSA-N	1	1	317.349	1.670	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[C@H](C)[N@H+](C2CC2)C1	ZINC001116230211	780487175	/nfs/dbraw/zinc/48/71/75/780487175.db2.gz	URPUVMHRCBKOMS-QWRGUYRKSA-N	1	1	318.377	1.992	20	5		DDBDMO
CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](C/C=C/Cl)CC1	ZINC001270878953	843004633	/nfs/dbraw/zinc/00/46/33/843004633.db2.gz	GTCFZSIPJWVKDQ-JAVOVTSZSA-N	1	1	315.801	1.622	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC001149206804	861488390	/nfs/dbraw/zinc/48/83/90/861488390.db2.gz	VHPXUSRDMABQKD-UHFFFAOYSA-N	1	1	320.349	1.072	20	5		DDBDMO
CSCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001233639498	846060066	/nfs/dbraw/zinc/06/00/66/846060066.db2.gz	HOZMCYUZVAXFNS-UHFFFAOYSA-N	1	1	311.407	1.896	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCOCC23CC3)ncc1[N+](=O)[O-]	ZINC001155840260	862493143	/nfs/dbraw/zinc/49/31/43/862493143.db2.gz	IOVKAKSFTVORMO-ZZXKWVIFSA-N	1	1	304.350	1.891	20	5		DDBDMO
COc1nc(NCCn2cc[nH+]c2C)nc(OC)c1[N+](=O)[O-]	ZINC001156007381	862629770	/nfs/dbraw/zinc/62/97/70/862629770.db2.gz	NYVMSJNZQABRHK-UHFFFAOYSA-N	1	1	308.298	1.019	20	5		DDBDMO
Cc1nc(NCC2(N(C)C)CC[NH+](C)CC2)ncc1[N+](=O)[O-]	ZINC001156188215	862793260	/nfs/dbraw/zinc/79/32/60/862793260.db2.gz	QLUZVFKMHOETBF-UHFFFAOYSA-N	1	1	308.386	1.131	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CC1CCCC1)C2	ZINC001072725780	857642318	/nfs/dbraw/zinc/64/23/18/857642318.db2.gz	RJTDDYNNKMJREJ-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@H+](CC1CCCC1)C2	ZINC001072725780	857642323	/nfs/dbraw/zinc/64/23/23/857642323.db2.gz	RJTDDYNNKMJREJ-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[N@@H+](CC1CCCC1)C2	ZINC001072725780	857642332	/nfs/dbraw/zinc/64/23/32/857642332.db2.gz	RJTDDYNNKMJREJ-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)C1	ZINC001328431113	862971066	/nfs/dbraw/zinc/97/10/66/862971066.db2.gz	CFTBYDZVUWKSQA-NSHDSACASA-N	1	1	322.321	1.717	20	5		DDBDMO
Cc1ccc(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC001124088462	859571806	/nfs/dbraw/zinc/57/18/06/859571806.db2.gz	UWTJSHZIGRYCQP-BFHYXJOUSA-N	1	1	303.362	1.973	20	5		DDBDMO
CN1CC[NH+](CCO[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001224551123	881445433	/nfs/dbraw/zinc/44/54/33/881445433.db2.gz	CUFDBGZWXBCCOM-MRXNPFEDSA-N	1	1	305.378	1.326	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1cc(F)cc(F)c1)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767542	864117913	/nfs/dbraw/zinc/11/79/13/864117913.db2.gz	PXUBHAMLCWKCMY-CHWSQXEVSA-N	1	1	313.304	1.226	20	5		DDBDMO
C[NH+](C)Cc1ncccc1O[C@@H]1COc2nc([N+](=O)[O-])cn2C1	ZINC001225278725	881759179	/nfs/dbraw/zinc/75/91/79/881759179.db2.gz	QFANQGIPVVIPCY-JTQLQIEISA-N	1	1	319.321	1.088	20	5		DDBDMO
C[C@@H]([NH2+]C1CC[NH+](CC(=O)[O-])CC1)c1cccc([N+](=O)[O-])c1	ZINC001334027199	867247388	/nfs/dbraw/zinc/24/73/88/867247388.db2.gz	YUTWTAVRGABIKY-LLVKDONJSA-N	1	1	307.350	1.794	20	5		DDBDMO
Cc1nc(N2CCC[N@@H+](C[C@H]3CCCO3)CC2)ncc1[N+](=O)[O-]	ZINC001324417764	867266628	/nfs/dbraw/zinc/26/66/28/867266628.db2.gz	QKPXDKGHJYWEIR-CYBMUJFWSA-N	1	1	321.381	1.384	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21	ZINC001324580458	867373104	/nfs/dbraw/zinc/37/31/04/867373104.db2.gz	MLGVWEUIYPRSNJ-HZMBPMFUSA-N	1	1	304.350	1.413	20	5		DDBDMO
COc1nc(N[C@@]2(C)CCC[N@@H+](C)C2)nc(OC)c1[N+](=O)[O-]	ZINC001162341390	867474232	/nfs/dbraw/zinc/47/42/32/867474232.db2.gz	MARDQGXSGPMDQR-ZDUSSCGKSA-N	1	1	311.342	1.298	20	5		DDBDMO
C[N@@H+]1CCCC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022416	868684392	/nfs/dbraw/zinc/68/43/92/868684392.db2.gz	XYWIZRYWSFNJMA-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC001336022416	868684403	/nfs/dbraw/zinc/68/44/03/868684403.db2.gz	XYWIZRYWSFNJMA-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
Cc1[nH+]ccn1CCNc1ccc([N+](=O)[O-])c2c1CNC2=O	ZINC001163932768	868804106	/nfs/dbraw/zinc/80/41/06/868804106.db2.gz	CFMIMRXYEQSWLG-UHFFFAOYSA-N	1	1	301.306	1.455	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+]2CCCC[C@@H]12	ZINC001337735034	869611429	/nfs/dbraw/zinc/61/14/29/869611429.db2.gz	RRJVFKFRLHUQKX-CABCVRRESA-N	1	1	318.377	1.993	20	5		DDBDMO
Cc1nc(N2CCC([N@H+]3CCCOCC3)CC2)ncc1[N+](=O)[O-]	ZINC001347251690	874070528	/nfs/dbraw/zinc/07/05/28/874070528.db2.gz	DTRBPTXAIZXENH-UHFFFAOYSA-N	1	1	321.381	1.384	20	5		DDBDMO
[NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nnc([C@H]2CCOC2)o1	ZINC001217714153	877283734	/nfs/dbraw/zinc/28/37/34/877283734.db2.gz	CURVNAFXYTUTLU-CMPLNLGQSA-N	1	1	304.306	1.724	20	5		DDBDMO
Nc1ccc2n(C(=O)[C@@H]3C[C@H](N)C[NH2+]3)c3ccccc3cc-2c1=O	ZINC001219255824	878061221	/nfs/dbraw/zinc/06/12/21/878061221.db2.gz	LXNWDLSRBIMRFY-FZMZJTMJSA-N	1	1	322.368	1.018	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2C)C1	ZINC001355414033	878544425	/nfs/dbraw/zinc/54/44/25/878544425.db2.gz	ASNDSVMJQKZSSC-NWDGAFQWSA-N	1	1	310.402	1.321	20	5		DDBDMO
C[C@@H](OCC(=O)N1CC[NH+](C)CC1)c1cccc([N+](=O)[O-])c1	ZINC001222542503	880548980	/nfs/dbraw/zinc/54/89/80/880548980.db2.gz	GMDGLRFWLCILPN-GFCCVEGCSA-N	1	1	307.350	1.446	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCc2cccc([N+](=O)[O-])c2C(=O)OC)C1	ZINC001223292835	880908922	/nfs/dbraw/zinc/90/89/22/880908922.db2.gz	AJTJJWMSZGDPRC-LBPRGKRZSA-N	1	1	308.334	1.992	20	5		DDBDMO
Cc1cnc(CO[C@@H](C)C[NH+]2CCOCC2)c(C)c1[N+](=O)[O-]	ZINC001224184957	881261228	/nfs/dbraw/zinc/26/12/28/881261228.db2.gz	ZVYGNFLOIPVCHT-LBPRGKRZSA-N	1	1	309.366	1.844	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CC[N@@H+](C(C)C)C2)cc1O	ZINC001228814218	883683388	/nfs/dbraw/zinc/68/33/88/883683388.db2.gz	KOGYCMLJDQMTNY-JTQLQIEISA-N	1	1	324.333	1.949	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(O[C@H]2CC[N@H+](C(C)C)C2)cc1O	ZINC001228814218	883683397	/nfs/dbraw/zinc/68/33/97/883683397.db2.gz	KOGYCMLJDQMTNY-JTQLQIEISA-N	1	1	324.333	1.949	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC(N[C@@H]3CC34C[NH2+]C4)CC2)cc1	ZINC001246442575	892626570	/nfs/dbraw/zinc/62/65/70/892626570.db2.gz	DCVMIGQHJJGKER-OAHLLOKOSA-N	1	1	302.378	1.515	20	5		DDBDMO
C[C@@H]1[C@H](N)CC[N@@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001246547578	892688615	/nfs/dbraw/zinc/68/86/15/892688615.db2.gz	DRVDCYRJEVATCU-MLGOLLRUSA-N	1	1	304.394	1.985	20	5		DDBDMO
C[C@@H]1[C@H](N)CC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC001246547578	892688622	/nfs/dbraw/zinc/68/86/22/892688622.db2.gz	DRVDCYRJEVATCU-MLGOLLRUSA-N	1	1	304.394	1.985	20	5		DDBDMO
O=[N+]([O-])CCc1nnc([C@H]2CC[N@@H+](Cc3ccccc3)C2)o1	ZINC001255363596	896865007	/nfs/dbraw/zinc/86/50/07/896865007.db2.gz	GIJGQTPZOOSWTO-ZDUSSCGKSA-N	1	1	302.334	1.878	20	5		DDBDMO
CCOC(=O)C[C@H]1CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC001262013463	899896318	/nfs/dbraw/zinc/89/63/18/899896318.db2.gz	CVEFZZHVHQHGSJ-GFCCVEGCSA-N	1	1	310.354	1.517	20	5		DDBDMO
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2C[N@@H+](CC[N+](=O)[O-])C[C@H]21	ZINC001262256055	900055612	/nfs/dbraw/zinc/05/56/12/900055612.db2.gz	DYEHYZDGVASTLZ-JHJVBQTASA-N	1	1	313.398	1.888	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC001262710401	900322706	/nfs/dbraw/zinc/32/27/06/900322706.db2.gz	OTGBYDXAIPQOOP-JTQLQIEISA-N	1	1	308.338	1.673	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCN(C)c1ccc([N+](=O)[O-])c(C)c1	ZINC001263222234	900540077	/nfs/dbraw/zinc/54/00/77/900540077.db2.gz	SYOCEJRQKAGKMA-UHFFFAOYSA-N	1	1	322.409	1.797	20	5		DDBDMO
CCOC(=O)c1cc(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000278297863	214074084	/nfs/dbraw/zinc/07/40/84/214074084.db2.gz	DGGNOANGWPQUSP-TXEJJXNPSA-N	1	1	319.361	1.769	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)n1	ZINC000248668915	282097962	/nfs/dbraw/zinc/09/79/62/282097962.db2.gz	PDMPXYUYXRYKGZ-GHMZBOCLSA-N	1	1	309.370	1.223	20	5		DDBDMO
C[C@@H]1CN(CCOc2ccccc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO	ZINC000451662331	231156064	/nfs/dbraw/zinc/15/60/64/231156064.db2.gz	ILLUCUVMZNEFFK-OKILXGFUSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000495250804	529442109	/nfs/dbraw/zinc/44/21/09/529442109.db2.gz	JKFUQLFBXJVLEQ-HIFRSBDPSA-N	1	1	310.350	1.181	20	5		DDBDMO
COC[C@]1(CO)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000451920288	231232982	/nfs/dbraw/zinc/23/29/82/231232982.db2.gz	ADTAKRRHYNJMLT-OAHLLOKOSA-N	1	1	310.350	1.304	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000451261677	529485432	/nfs/dbraw/zinc/48/54/32/529485432.db2.gz	WDGFJIVZOJCWDU-SWLSCSKDSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)c1ccc([N+](=O)[O-])s1	ZINC000452348346	231355948	/nfs/dbraw/zinc/35/59/48/231355948.db2.gz	LFBVLNQSJCCMRX-JTQLQIEISA-N	1	1	313.379	1.233	20	5		DDBDMO
CN(CC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])c2ncccc12	ZINC000413119384	529911747	/nfs/dbraw/zinc/91/17/47/529911747.db2.gz	XODGBWNJEBGVQB-UHFFFAOYSA-N	1	1	316.361	1.911	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000226226469	201768459	/nfs/dbraw/zinc/76/84/59/201768459.db2.gz	DZBTVGZOUXDWON-UHFFFAOYSA-N	1	1	313.354	1.513	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CC[N@H+]1C	ZINC000358391864	299140824	/nfs/dbraw/zinc/14/08/24/299140824.db2.gz	ITIQALUXLALPCD-JQWIXIFHSA-N	1	1	309.341	1.875	20	5		DDBDMO
CCn1nncc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000459379225	233148788	/nfs/dbraw/zinc/14/87/88/233148788.db2.gz	PCZCPSWMVDXILY-NSHDSACASA-N	1	1	317.353	1.288	20	5		DDBDMO
CCn1nncc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000459379225	233148791	/nfs/dbraw/zinc/14/87/91/233148791.db2.gz	PCZCPSWMVDXILY-NSHDSACASA-N	1	1	317.353	1.288	20	5		DDBDMO
C[C@@]1(O)CCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000280086615	215365439	/nfs/dbraw/zinc/36/54/39/215365439.db2.gz	OETZZGNDABLOOQ-GOEBONIOSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(N)=O)CC1	ZINC000021847334	352175124	/nfs/dbraw/zinc/17/51/24/352175124.db2.gz	BARQAGDLSDRVSH-JTQLQIEISA-N	1	1	320.349	1.119	20	5		DDBDMO
CCN1CC[NH+](CCCNC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000041443587	352308472	/nfs/dbraw/zinc/30/84/72/352308472.db2.gz	KCZPWJAQVXJZKA-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]3CCCC[C@@H]32)c1	ZINC000331774298	234107299	/nfs/dbraw/zinc/10/72/99/234107299.db2.gz	KWJAWZSCYDCDRB-CFVMTHIKSA-N	1	1	308.382	1.807	20	5		DDBDMO
COCC[N@H+](C)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000054355564	352688738	/nfs/dbraw/zinc/68/87/38/352688738.db2.gz	ZMILGEICMGQPKM-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
COCC[N@@H+](C)[C@@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000054355564	352688745	/nfs/dbraw/zinc/68/87/45/352688745.db2.gz	ZMILGEICMGQPKM-JTQLQIEISA-N	1	1	311.338	1.509	20	5		DDBDMO
CC[N@@H+](CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-])C1CC1	ZINC000173048210	198180942	/nfs/dbraw/zinc/18/09/42/198180942.db2.gz	IJMJZORHIPFDST-UHFFFAOYSA-N	1	1	320.393	1.632	20	5		DDBDMO
CCOc1ccc(C(=O)NCC[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000067701578	353062823	/nfs/dbraw/zinc/06/28/23/353062823.db2.gz	VGFYDVHDNLNHNF-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC[C@H](C)O	ZINC000173568788	198228926	/nfs/dbraw/zinc/22/89/26/198228926.db2.gz	PPPJUHWZTGGEQS-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC[C@H](C)O	ZINC000173568788	198228928	/nfs/dbraw/zinc/22/89/28/198228928.db2.gz	PPPJUHWZTGGEQS-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000073811940	353272192	/nfs/dbraw/zinc/27/21/92/353272192.db2.gz	FOAUTBUMBSDAAO-CYBMUJFWSA-N	1	1	306.366	1.531	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000174163412	198300697	/nfs/dbraw/zinc/30/06/97/198300697.db2.gz	WMEDOTMATDNXCL-ZDUSSCGKSA-N	1	1	319.361	1.389	20	5		DDBDMO
COC1CCC([N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000075745690	353379260	/nfs/dbraw/zinc/37/92/60/353379260.db2.gz	ZJKLBYUIHKCOJJ-HRDQMINSSA-N	1	1	312.370	1.042	20	5		DDBDMO
C[N@@H+](CCc1ccc(F)cc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000174749014	198379615	/nfs/dbraw/zinc/37/96/15/198379615.db2.gz	JHDNCOZFFNPRIG-OAHLLOKOSA-N	1	1	322.340	1.466	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2C)CC1	ZINC000078302278	353509685	/nfs/dbraw/zinc/50/96/85/353509685.db2.gz	LFRCCINQMLIDDX-UHFFFAOYSA-N	1	1	308.382	1.847	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000108307521	353950458	/nfs/dbraw/zinc/95/04/58/353950458.db2.gz	FXEWKQXZKNJNNV-CYBMUJFWSA-N	1	1	318.377	1.607	20	5		DDBDMO
COc1ccc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000142316975	354143919	/nfs/dbraw/zinc/14/39/19/354143919.db2.gz	NYYKIZHHPZHLTE-CYBMUJFWSA-N	1	1	319.361	1.914	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)C[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119142	354196393	/nfs/dbraw/zinc/19/63/93/354196393.db2.gz	YKYWFEOVEGBPRU-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1CO[C@H](CO)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000153119142	354196396	/nfs/dbraw/zinc/19/63/96/354196396.db2.gz	YKYWFEOVEGBPRU-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1cccc(OC[C@H](O)C[NH+]2C[C@@H](C)O[C@H](C)C2)c1[N+](=O)[O-]	ZINC000153796989	354201810	/nfs/dbraw/zinc/20/18/10/354201810.db2.gz	MTLKZMVBEPOREX-MGPQQGTHSA-N	1	1	324.377	1.752	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000281125847	354425815	/nfs/dbraw/zinc/42/58/15/354425815.db2.gz	OAKVACLIVUTCRL-MRXNPFEDSA-N	1	1	321.377	1.822	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCCC[C@H]2CO)c([N+](=O)[O-])c1	ZINC000317434370	354511112	/nfs/dbraw/zinc/51/11/12/354511112.db2.gz	WTINYFNJTKCINS-ZDUSSCGKSA-N	1	1	307.350	1.431	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])n2C)C[C@@H](C)C1	ZINC000346231306	283035089	/nfs/dbraw/zinc/03/50/89/283035089.db2.gz	OBROETMBQSTOQC-SGMGOOAPSA-N	1	1	320.393	1.736	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC(F)(F)[C@@H](CO)C1	ZINC000403826586	354670640	/nfs/dbraw/zinc/67/06/40/354670640.db2.gz	CGDNGOOHPKBLNL-SNVBAGLBSA-N	1	1	304.297	1.049	20	5		DDBDMO
C[N@@H+](CCCCS(C)(=O)=O)CCc1ccccc1[N+](=O)[O-]	ZINC000586773500	354863558	/nfs/dbraw/zinc/86/35/58/354863558.db2.gz	NOBYUVYXMXFNIH-UHFFFAOYSA-N	1	1	314.407	1.894	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(c3cc(N)c([N+](=O)[O-])c(CO)c3)CC[C@@H]21	ZINC000588001106	354891736	/nfs/dbraw/zinc/89/17/36/354891736.db2.gz	ONQNTEZXBNMFNE-ABAIWWIYSA-N	1	1	320.393	1.590	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]([C@H](C)O)C2)c1	ZINC000589510899	354997946	/nfs/dbraw/zinc/99/79/46/354997946.db2.gz	UNJXPNISUIDLIX-JQWIXIFHSA-N	1	1	308.334	1.584	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000590537461	355109613	/nfs/dbraw/zinc/10/96/13/355109613.db2.gz	JMHBBNQJBQUVED-AAEUAGOBSA-N	1	1	308.313	1.248	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000590447658	355099075	/nfs/dbraw/zinc/09/90/75/355099075.db2.gz	ZRENJKZSRAHWEG-GXFFZTMASA-N	1	1	305.334	1.380	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CCNc2ccccc2[N+](=O)[O-])C1	ZINC000590446553	355099858	/nfs/dbraw/zinc/09/98/58/355099858.db2.gz	UJAAVCQKXDYSIK-WFASDCNBSA-N	1	1	318.377	1.559	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000590776644	355176525	/nfs/dbraw/zinc/17/65/25/355176525.db2.gz	LHUHAGPYUWGOCP-WCQYABFASA-N	1	1	305.334	1.380	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](CO)[C@H]2C)c1	ZINC000593036810	355776434	/nfs/dbraw/zinc/77/64/34/355776434.db2.gz	UMKDYIOVSVHPBY-YPMHNXCESA-N	1	1	322.361	1.974	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H](CC)CO1	ZINC000593060283	355783786	/nfs/dbraw/zinc/78/37/86/355783786.db2.gz	ZYKUJZVPGOESJM-KWCYVHTRSA-N	1	1	312.370	1.042	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1[C@H](C)C[N@@H+](C)[C@H](C)[C@H]1C	ZINC000593187607	355819855	/nfs/dbraw/zinc/81/98/55/355819855.db2.gz	MKHPHXODYNUZKI-YUSALJHKSA-N	1	1	306.366	1.851	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C[C@@H](C)O)C1CC1	ZINC000594067156	356104865	/nfs/dbraw/zinc/10/48/65/356104865.db2.gz	YSLSFIKXAWSMKR-SNVBAGLBSA-N	1	1	323.349	1.387	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C[C@@H](C)O)C1CC1	ZINC000594067156	356104868	/nfs/dbraw/zinc/10/48/68/356104868.db2.gz	YSLSFIKXAWSMKR-SNVBAGLBSA-N	1	1	323.349	1.387	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCCC[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000594016622	356089666	/nfs/dbraw/zinc/08/96/66/356089666.db2.gz	ANVXTVLFXQWGQQ-OAHLLOKOSA-N	1	1	321.377	1.795	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@@H]23)n1	ZINC000594198107	356136990	/nfs/dbraw/zinc/13/69/90/356136990.db2.gz	RXLMSIDMLHIFIY-RYUDHWBXSA-N	1	1	321.381	1.558	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594600573	356261214	/nfs/dbraw/zinc/26/12/14/356261214.db2.gz	MFEFLQSWRUFQBP-STQMWFEESA-N	1	1	319.365	1.518	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\CN1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594614695	356267163	/nfs/dbraw/zinc/26/71/63/356267163.db2.gz	ZAISAYMHTCYTDF-QWZUFBECSA-N	1	1	303.362	1.359	20	5		DDBDMO
CCS(=O)(=O)C1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CC1	ZINC000594992465	356369278	/nfs/dbraw/zinc/36/92/78/356369278.db2.gz	FJMYTESYRFCAGB-UHFFFAOYSA-N	1	1	304.393	1.713	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](C)S(C)(=O)=O	ZINC000595033062	356375098	/nfs/dbraw/zinc/37/50/98/356375098.db2.gz	AJLZHVHTAXNYFS-VHSXEESVSA-N	1	1	316.379	1.687	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCC(=O)N(C)C1=O	ZINC000595042998	356376007	/nfs/dbraw/zinc/37/60/07/356376007.db2.gz	DKPLGODMRPSMAR-CABZTGNLSA-N	1	1	321.333	1.401	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NCc2cc(OC)c(O)cc2[N+](=O)[O-])C1	ZINC000594992767	356370266	/nfs/dbraw/zinc/37/02/66/356370266.db2.gz	XHGCQIRFAUDSJY-GFCCVEGCSA-N	1	1	309.366	1.883	20	5		DDBDMO
CCCN1CC[C@@H]([NH2+]Cc2cc(OC)c(O)cc2[N+](=O)[O-])C1	ZINC000594992767	356370270	/nfs/dbraw/zinc/37/02/70/356370270.db2.gz	XHGCQIRFAUDSJY-GFCCVEGCSA-N	1	1	309.366	1.883	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595745025	356632199	/nfs/dbraw/zinc/63/21/99/356632199.db2.gz	NWTKNHQNKCMWPL-UTUOFQBUSA-N	1	1	321.377	1.871	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595765912	356644277	/nfs/dbraw/zinc/64/42/77/356644277.db2.gz	LMOMSJMVDSRSRK-SMDDNHRTSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595765912	356644279	/nfs/dbraw/zinc/64/42/79/356644279.db2.gz	LMOMSJMVDSRSRK-SMDDNHRTSA-N	1	1	307.350	1.687	20	5		DDBDMO
C[C@]12COC[C@@H]1C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595759872	356640512	/nfs/dbraw/zinc/64/05/12/356640512.db2.gz	QLCVJRQXWFAFMZ-LRDDRELGSA-N	1	1	319.361	1.892	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]2COC[C@@H]2C1	ZINC000595836632	356671095	/nfs/dbraw/zinc/67/10/95/356671095.db2.gz	XOVZGFKYJLBIMI-AGIUHOORSA-N	1	1	319.361	1.890	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000595826501	356665986	/nfs/dbraw/zinc/66/59/86/356665986.db2.gz	ABFDGELDKBEDBR-STQMWFEESA-N	1	1	322.361	1.951	20	5		DDBDMO
C[C@@H]1C[N@H+](CCCCNc2cc[nH]c(=O)c2[N+](=O)[O-])C[C@H](C)O1	ZINC000596155341	356794476	/nfs/dbraw/zinc/79/44/76/356794476.db2.gz	ICEKCOSRLGJTEK-TXEJJXNPSA-N	1	1	324.381	1.997	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)[C@H](C)C1	ZINC000596268231	356838957	/nfs/dbraw/zinc/83/89/57/356838957.db2.gz	GPYDAPKCOKBKQT-LLVKDONJSA-N	1	1	306.366	1.614	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1	ZINC000596537853	356910413	/nfs/dbraw/zinc/91/04/13/356910413.db2.gz	INFITWAPNXWMAR-CYBMUJFWSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=[N+]([O-])c1cnccc1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2	ZINC000596514978	356902625	/nfs/dbraw/zinc/90/26/25/356902625.db2.gz	PRXPWOCWFIDAGY-HUUCEWRRSA-N	1	1	318.377	1.467	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@@H]3C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000597223812	357100217	/nfs/dbraw/zinc/10/02/17/357100217.db2.gz	UBBHKKQLORKJOJ-CHWSQXEVSA-N	1	1	320.345	1.988	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597921534	357382259	/nfs/dbraw/zinc/38/22/59/357382259.db2.gz	GUQYPEPFMXZTSX-SNVBAGLBSA-N	1	1	323.397	1.873	20	5		DDBDMO
CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)[C@H]1CC[N@@H+](C)C1	ZINC000597947399	357394896	/nfs/dbraw/zinc/39/48/96/357394896.db2.gz	XQZPROCXQQEQKG-ZDUSSCGKSA-N	1	1	321.377	1.835	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCC12CCOCC2)c1ccc([N+](=O)[O-])cc1	ZINC000618318413	363583159	/nfs/dbraw/zinc/58/31/59/363583159.db2.gz	YHJCNXLCMWZWAE-UHFFFAOYSA-N	1	1	319.361	1.813	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCC12CCOCC2)c1ccc([N+](=O)[O-])cc1	ZINC000618318413	363583164	/nfs/dbraw/zinc/58/31/64/363583164.db2.gz	YHJCNXLCMWZWAE-UHFFFAOYSA-N	1	1	319.361	1.813	20	5		DDBDMO
COC(=O)c1ccnc(NC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000598594799	357645734	/nfs/dbraw/zinc/64/57/34/357645734.db2.gz	CSUMCRDCUQZKIP-SNVBAGLBSA-N	1	1	308.338	1.530	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[NH2+]1	ZINC000598572852	357637004	/nfs/dbraw/zinc/63/70/04/357637004.db2.gz	LUAXPXPLEUJQSC-ZDUSSCGKSA-N	1	1	317.349	1.541	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]C[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1	ZINC000599081268	357808967	/nfs/dbraw/zinc/80/89/67/357808967.db2.gz	KQSCMFBJTVJIGU-GLQYFDAESA-N	1	1	316.361	1.778	20	5		DDBDMO
C[C@]1(CO)C[N@@H+](Cc2ccc(F)cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000599627297	357998140	/nfs/dbraw/zinc/99/81/40/357998140.db2.gz	WWCLKWKJIOGYFP-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
C[C@]1(CO)C[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C[C@@]1(C)CO	ZINC000599627297	357998145	/nfs/dbraw/zinc/99/81/45/357998145.db2.gz	WWCLKWKJIOGYFP-GASCZTMLSA-N	1	1	312.341	1.547	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCC(F)(F)CC2)c1	ZINC000599552236	357970744	/nfs/dbraw/zinc/97/07/44/357970744.db2.gz	YRRQYGYJTZSDGV-NSHDSACASA-N	1	1	304.297	1.273	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599624097	357996362	/nfs/dbraw/zinc/99/63/62/357996362.db2.gz	PFTKEMMCNOAEOF-WQVCFCJDSA-N	1	1	308.378	1.969	20	5		DDBDMO
O=C(C[N@H+]1C[C@@H]2CCC[C@]2(CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000599639657	358002125	/nfs/dbraw/zinc/00/21/25/358002125.db2.gz	LJYGLQDHTIUZRL-BLLLJJGKSA-N	1	1	319.361	1.628	20	5		DDBDMO
O=C(C[N@@H+]1C[C@@H]2CCC[C@]2(CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000599639657	358002126	/nfs/dbraw/zinc/00/21/26/358002126.db2.gz	LJYGLQDHTIUZRL-BLLLJJGKSA-N	1	1	319.361	1.628	20	5		DDBDMO
COC(=O)[C@@](C)(NC[C@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000599648755	358007045	/nfs/dbraw/zinc/00/70/45/358007045.db2.gz	FAWVWPIHGPCJBM-ZBFHGGJFSA-N	1	1	321.377	1.667	20	5		DDBDMO
O=C(CC[N@@H+]1CCn2nncc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000565489511	304071602	/nfs/dbraw/zinc/07/16/02/304071602.db2.gz	YJIWLKBBXVYBTJ-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(CC[N@H+]1CCn2nncc2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000565489511	304071605	/nfs/dbraw/zinc/07/16/05/304071605.db2.gz	YJIWLKBBXVYBTJ-UHFFFAOYSA-N	1	1	316.321	1.031	20	5		DDBDMO
O=C(Nc1cccc([N+](=O)[O-])c1)NC1CC([NH+]2CCOCC2)C1	ZINC000600705921	358288168	/nfs/dbraw/zinc/28/81/68/358288168.db2.gz	QSJDRKTWOQNNDU-UHFFFAOYSA-N	1	1	320.349	1.580	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[NH+](CC2CC2)CC1	ZINC000601002334	358377691	/nfs/dbraw/zinc/37/76/91/358377691.db2.gz	NILODXYVJTUIBR-UHFFFAOYSA-N	1	1	307.325	1.902	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccnc2ccc([N+](=O)[O-])cc21	ZINC000601116404	358409376	/nfs/dbraw/zinc/40/93/76/358409376.db2.gz	SXOJPSDBCXLYHD-ZDUSSCGKSA-N	1	1	315.377	1.223	20	5		DDBDMO
CCC(=O)N1CC[C@H](Nc2cc[nH+]c3ccc([N+](=O)[O-])cc23)C1	ZINC000601129857	358414487	/nfs/dbraw/zinc/41/44/87/358414487.db2.gz	NKGYRQMYBWJBIQ-NSHDSACASA-N	1	1	314.345	1.988	20	5		DDBDMO
Cc1nn(C)cc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149161	358422222	/nfs/dbraw/zinc/42/22/22/358422222.db2.gz	KBGQDAVFLFNBMJ-OAHLLOKOSA-N	1	1	304.350	1.634	20	5		DDBDMO
CCn1nccc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601149878	358422248	/nfs/dbraw/zinc/42/22/48/358422248.db2.gz	RFXPYWKBAIITNJ-HNNXBMFYSA-N	1	1	304.350	1.809	20	5		DDBDMO
CC(C)(O)CN1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000602585652	359057081	/nfs/dbraw/zinc/05/70/81/359057081.db2.gz	HVSUQNIZJHCWMZ-UHFFFAOYSA-N	1	1	307.394	1.920	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](n2ccnc2)C1	ZINC000602771581	359179632	/nfs/dbraw/zinc/17/96/32/359179632.db2.gz	FLFZTIUSGSAYHZ-ZDUSSCGKSA-N	1	1	304.354	1.633	20	5		DDBDMO
O=[N+]([O-])c1sc(C[NH2+][C@H]2COC[C@H]2O)cc1Br	ZINC000602725355	359151920	/nfs/dbraw/zinc/15/19/20/359151920.db2.gz	PYRZNMLQNHRIAI-JGVFFNPUSA-N	1	1	323.168	1.268	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C2CCC2)C[C@@H](C)C1	ZINC000602840560	359230061	/nfs/dbraw/zinc/23/00/61/359230061.db2.gz	NUEJYOOMXWADMU-ZDUSSCGKSA-N	1	1	321.425	1.906	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])cn1	ZINC000602799672	359200846	/nfs/dbraw/zinc/20/08/46/359200846.db2.gz	KVEIDWKVRUOEOK-UHFFFAOYSA-N	1	1	305.338	1.635	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C2CC2)C[C@@H](C)C1	ZINC000602832479	359223722	/nfs/dbraw/zinc/22/37/22/359223722.db2.gz	NEGSTRTVKCJHQI-LBPRGKRZSA-N	1	1	307.398	1.516	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCc2ncnn21	ZINC000602832338	359223864	/nfs/dbraw/zinc/22/38/64/359223864.db2.gz	UPMLFLLCGUVUBB-CYBMUJFWSA-N	1	1	301.350	1.848	20	5		DDBDMO
CC(=O)NC[C@H]1CCCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602915329	359291314	/nfs/dbraw/zinc/29/13/14/359291314.db2.gz	BAGAUWUFJGUZHV-CYBMUJFWSA-N	1	1	309.370	1.090	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@H](C)C[C@H]1CO	ZINC000602932434	359302028	/nfs/dbraw/zinc/30/20/28/359302028.db2.gz	XQVISXSQXGOOSZ-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@H](C)C[C@H]1CO	ZINC000602932434	359302033	/nfs/dbraw/zinc/30/20/33/359302033.db2.gz	XQVISXSQXGOOSZ-RISCZKNCSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)[C@H](CO)Cc1ccccc1	ZINC000602882356	359265476	/nfs/dbraw/zinc/26/54/76/359265476.db2.gz	DDFNIVIKCKZGLR-HNNXBMFYSA-N	1	1	318.377	1.635	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1CCC[C@H]2C[N@H+](C)C[C@H]21	ZINC000602961062	359323854	/nfs/dbraw/zinc/32/38/54/359323854.db2.gz	UERXMIWYHKNGKM-WCQYABFASA-N	1	1	319.365	1.278	20	5		DDBDMO
CC[N@H+]1[C@H](C)CN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000603142271	359430672	/nfs/dbraw/zinc/43/06/72/359430672.db2.gz	JCUJDUKSTJNDES-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000603142271	359430676	/nfs/dbraw/zinc/43/06/76/359430676.db2.gz	JCUJDUKSTJNDES-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@H+]1[C@H](C)CN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000603142271	359430680	/nfs/dbraw/zinc/43/06/80/359430680.db2.gz	JCUJDUKSTJNDES-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
CC[N@@H+]1[C@H](C)CN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])C[C@@H]1C	ZINC000603142271	359430685	/nfs/dbraw/zinc/43/06/85/359430685.db2.gz	JCUJDUKSTJNDES-PHIMTYICSA-N	1	1	323.397	1.996	20	5		DDBDMO
C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1O	ZINC000186884098	200026942	/nfs/dbraw/zinc/02/69/42/200026942.db2.gz	NCLSMCTVUJXNSN-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@@H]1O	ZINC000186884098	200026944	/nfs/dbraw/zinc/02/69/44/200026944.db2.gz	NCLSMCTVUJXNSN-MFKMUULPSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000604264293	359730700	/nfs/dbraw/zinc/73/07/00/359730700.db2.gz	CWNNYIHMUXOFPA-GFCCVEGCSA-N	1	1	322.365	1.250	20	5		DDBDMO
CN(c1ccc([N+](=O)[O-])nc1)[C@H]1CC[N@H+](C2CCN(C)CC2)C1	ZINC000609802290	360352556	/nfs/dbraw/zinc/35/25/56/360352556.db2.gz	OOVLWEGXVVHWIF-HNNXBMFYSA-N	1	1	319.409	1.595	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000610891567	360565120	/nfs/dbraw/zinc/56/51/20/360565120.db2.gz	WEUWXUQQASLKHB-GFCCVEGCSA-N	1	1	305.334	1.515	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000610891567	360565124	/nfs/dbraw/zinc/56/51/24/360565124.db2.gz	WEUWXUQQASLKHB-GFCCVEGCSA-N	1	1	305.334	1.515	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C[C@H]1C	ZINC000611087776	360618646	/nfs/dbraw/zinc/61/86/46/360618646.db2.gz	JIFXFADPXQIQHW-LLVKDONJSA-N	1	1	323.397	1.351	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000611088456	360620032	/nfs/dbraw/zinc/62/00/32/360620032.db2.gz	XEOSHALHXKIYFU-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000292545280	223138628	/nfs/dbraw/zinc/13/86/28/223138628.db2.gz	YDYXKYXETSBYTB-FZMZJTMJSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000292545280	223138631	/nfs/dbraw/zinc/13/86/31/223138631.db2.gz	YDYXKYXETSBYTB-FZMZJTMJSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2c2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000618898197	363787866	/nfs/dbraw/zinc/78/78/66/363787866.db2.gz	ZYFLWGBOGOPOMC-XHDPSFHLSA-N	1	1	320.393	1.590	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000261847106	203133381	/nfs/dbraw/zinc/13/33/81/203133381.db2.gz	UYQYBBSPEMYQPD-OAHLLOKOSA-N	1	1	312.329	1.777	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](CC)CN1C(C)=O	ZINC000350487490	284205622	/nfs/dbraw/zinc/20/56/22/284205622.db2.gz	ZNBBBRJACONNRB-UONOGXRCSA-N	1	1	323.397	1.513	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)[C@@H](CC)CN1C(C)=O	ZINC000350487490	284205625	/nfs/dbraw/zinc/20/56/25/284205625.db2.gz	ZNBBBRJACONNRB-UONOGXRCSA-N	1	1	323.397	1.513	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000264603317	204021862	/nfs/dbraw/zinc/02/18/62/204021862.db2.gz	FIKOJISBOZOGFU-UHFFFAOYSA-N	1	1	320.393	1.304	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000264697666	204086386	/nfs/dbraw/zinc/08/63/86/204086386.db2.gz	SQUZSEYDZLHAHP-SNVBAGLBSA-N	1	1	302.334	1.758	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)N1CCC[N@@H+](C)CC1	ZINC000020514937	182226208	/nfs/dbraw/zinc/22/62/08/182226208.db2.gz	ODENRIVYUJSRCB-UHFFFAOYSA-N	1	1	308.338	1.773	20	5		DDBDMO
CCCC[N@@H+](C)CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000112310405	248255539	/nfs/dbraw/zinc/25/55/39/248255539.db2.gz	FHRYVHVZGYXYMM-UHFFFAOYSA-N	1	1	309.366	1.822	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000334075897	249205703	/nfs/dbraw/zinc/20/57/03/249205703.db2.gz	CRUROQPVJLBCGG-MNOVXSKESA-N	1	1	307.350	1.816	20	5		DDBDMO
CNc1c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000336860618	249268627	/nfs/dbraw/zinc/26/86/27/249268627.db2.gz	SOWXHAZUHRGCDQ-SNVBAGLBSA-N	1	1	304.350	1.603	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000106395772	194206241	/nfs/dbraw/zinc/20/62/41/194206241.db2.gz	XNPRSZQIXZGPRD-LBPRGKRZSA-N	1	1	307.350	1.124	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CCCC[C@H]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000109785747	194284357	/nfs/dbraw/zinc/28/43/57/194284357.db2.gz	KFCHWULQBIENQJ-AWEZNQCLSA-N	1	1	321.377	1.795	20	5		DDBDMO
CN(C(=O)C[N@H+]1CCCC[C@H]1CCO)c1ccc([N+](=O)[O-])cc1	ZINC000109785747	194284359	/nfs/dbraw/zinc/28/43/59/194284359.db2.gz	KFCHWULQBIENQJ-AWEZNQCLSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[C@@H](CNC(=O)CNc1ccccc1[N+](=O)[O-])[N@@H+](C)C1CC1	ZINC000057701516	184047651	/nfs/dbraw/zinc/04/76/51/184047651.db2.gz	NOSLVJJPHBRRPD-NSHDSACASA-N	1	1	306.366	1.606	20	5		DDBDMO
Nc1c(C(=O)N2CCC[N@H+](C3CC3)CC2)cc(F)cc1[N+](=O)[O-]	ZINC000061604189	184177508	/nfs/dbraw/zinc/17/75/08/184177508.db2.gz	DDWBXPGTXODVRW-UHFFFAOYSA-N	1	1	322.340	1.626	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000341025439	251344706	/nfs/dbraw/zinc/34/47/06/251344706.db2.gz	JCNSXHOKDYJJTC-JSGCOSHPSA-N	1	1	320.393	1.919	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000269456558	207554487	/nfs/dbraw/zinc/55/44/87/207554487.db2.gz	HCSVNYUIBCJXFH-CYBMUJFWSA-N	1	1	307.350	1.124	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@H](C(N)=O)CC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000352404117	285027883	/nfs/dbraw/zinc/02/78/83/285027883.db2.gz	CGCLMCGKIYZDIR-CMPLNLGQSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1c(CC(=O)NCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000158779105	197300621	/nfs/dbraw/zinc/30/06/21/197300621.db2.gz	VPODXYDJAGJREJ-UHFFFAOYSA-N	1	1	321.377	1.284	20	5		DDBDMO
O=[N+]([O-])c1ccccc1NCC1([NH+]2CCOCC2)CCOCC1	ZINC000413400773	224189578	/nfs/dbraw/zinc/18/95/78/224189578.db2.gz	KRQDJNYCEFYMNE-UHFFFAOYSA-N	1	1	321.377	1.888	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC2([NH+]3CCOCC3)CCOCC2)nc1	ZINC000413403930	224189838	/nfs/dbraw/zinc/18/98/38/224189838.db2.gz	ODBLXQDBIASTSS-UHFFFAOYSA-N	1	1	322.365	1.283	20	5		DDBDMO
COC[C@]1(C(=O)OC)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000294923310	533218126	/nfs/dbraw/zinc/21/81/26/533218126.db2.gz	BBTMVMZGDDWETL-HNNXBMFYSA-N	1	1	308.334	1.606	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000294979688	224355627	/nfs/dbraw/zinc/35/56/27/224355627.db2.gz	GKHWKYHRBQJRFA-MRXNPFEDSA-N	1	1	322.361	1.915	20	5		DDBDMO
[NH3+]C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2)CC12CCOCC2	ZINC000414789837	224395121	/nfs/dbraw/zinc/39/51/21/224395121.db2.gz	OTLBHYPXWCQDFL-AWEZNQCLSA-N	1	1	305.378	1.782	20	5		DDBDMO
CON1CCC([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000459594218	533309471	/nfs/dbraw/zinc/30/94/71/533309471.db2.gz	XPUFCYXUZVQIEQ-UHFFFAOYSA-N	1	1	322.365	1.151	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000491262305	533311362	/nfs/dbraw/zinc/31/13/62/533311362.db2.gz	MQBRTRLAQNPLTH-TWGQIWQCSA-N	1	1	321.377	1.693	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCNC1	ZINC000423193934	533446350	/nfs/dbraw/zinc/44/63/50/533446350.db2.gz	RCQRFWBUISWOOY-AAEUAGOBSA-N	1	1	306.366	1.654	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000124661320	407365828	/nfs/dbraw/zinc/36/58/28/407365828.db2.gz	KAYBMWKJJWPKLA-NWDGAFQWSA-N	1	1	309.370	1.123	20	5		DDBDMO
C[C@@H]1C[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000124661565	407365947	/nfs/dbraw/zinc/36/59/47/407365947.db2.gz	KAYBMWKJJWPKLA-NEPJUHHUSA-N	1	1	309.370	1.123	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C[C@H](C)O)C(C)C	ZINC000107043096	407368531	/nfs/dbraw/zinc/36/85/31/407368531.db2.gz	OUKSESGIEFHOKF-LBPRGKRZSA-N	1	1	309.366	1.933	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000124812242	407370418	/nfs/dbraw/zinc/37/04/18/407370418.db2.gz	LLPVMHOMXAFNEL-STQMWFEESA-N	1	1	321.377	1.915	20	5		DDBDMO
COc1ccc(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000108341337	407384573	/nfs/dbraw/zinc/38/45/73/407384573.db2.gz	KSSVFQROQOSGLK-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC[N@H+]1CC[C@@H](CNC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000107893579	407381032	/nfs/dbraw/zinc/38/10/32/407381032.db2.gz	WAQPDQPAJPCAAU-LBPRGKRZSA-N	1	1	306.366	1.465	20	5		DDBDMO
C[N@H+]1CCN(CCn2cc([N+](=O)[O-])cn2)C2(CCCCC2)C1	ZINC000178402426	407446130	/nfs/dbraw/zinc/44/61/30/407446130.db2.gz	BPJWMXLOUZXMPF-UHFFFAOYSA-N	1	1	307.398	1.742	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)CC1CC1	ZINC000112983534	407454981	/nfs/dbraw/zinc/45/49/81/407454981.db2.gz	JSZLOTUCRLWLNO-UHFFFAOYSA-N	1	1	321.333	1.994	20	5		DDBDMO
CC[N@@H+](CCO)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000270992175	407457432	/nfs/dbraw/zinc/45/74/32/407457432.db2.gz	IIDYDENJDAXJQL-UHFFFAOYSA-N	1	1	304.350	1.810	20	5		DDBDMO
COC(=O)C1(O)CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000271369536	407655922	/nfs/dbraw/zinc/65/59/22/407655922.db2.gz	JAYGEIUGMUPLDK-LLVKDONJSA-N	1	1	308.334	1.656	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cn1	ZINC000130147824	407657425	/nfs/dbraw/zinc/65/74/25/407657425.db2.gz	YPCURRYZWUCUSL-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000132366116	407782408	/nfs/dbraw/zinc/78/24/08/407782408.db2.gz	KGCCBBLIHBYOJK-LBPRGKRZSA-N	1	1	309.370	1.090	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000133326680	407830292	/nfs/dbraw/zinc/83/02/92/407830292.db2.gz	BGMPYHBUFKTADF-FZMZJTMJSA-N	1	1	322.365	1.113	20	5		DDBDMO
C[C@H](NC(=O)NCc1ccccc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000133326680	407830297	/nfs/dbraw/zinc/83/02/97/407830297.db2.gz	BGMPYHBUFKTADF-FZMZJTMJSA-N	1	1	322.365	1.113	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)N2CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC000268023574	407859611	/nfs/dbraw/zinc/85/96/11/407859611.db2.gz	LJSJLZOMQIMVDH-GFCCVEGCSA-N	1	1	306.366	1.921	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C[N@H+]1C1CC1	ZINC000133592006	407863473	/nfs/dbraw/zinc/86/34/73/407863473.db2.gz	BIXNSZRZIVMUNB-BDAKNGLRSA-N	1	1	306.322	1.050	20	5		DDBDMO
[NH3+]C[C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000237883504	407847280	/nfs/dbraw/zinc/84/72/80/407847280.db2.gz	FQUHQKYKKMEDMO-SECBINFHSA-N	1	1	303.322	1.282	20	5		DDBDMO
COc1cc(NC[C@@H]2C[N@@H+](C)CCN2C)c([N+](=O)[O-])cc1F	ZINC000268223923	407956041	/nfs/dbraw/zinc/95/60/41/407956041.db2.gz	SZLCFEGQVFGEOX-SNVBAGLBSA-N	1	1	312.345	1.400	20	5		DDBDMO
COCCOC[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000154377362	408027531	/nfs/dbraw/zinc/02/75/31/408027531.db2.gz	MJXZZJCNKWQYLU-BBRMVZONSA-N	1	1	324.377	1.613	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1(CO)CC1	ZINC000190033520	408151938	/nfs/dbraw/zinc/15/19/38/408151938.db2.gz	NMDHQHRUQOOHRY-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1(CO)CC1	ZINC000190033520	408151942	/nfs/dbraw/zinc/15/19/42/408151942.db2.gz	NMDHQHRUQOOHRY-UHFFFAOYSA-N	1	1	319.361	1.188	20	5		DDBDMO
CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)[C@H]1CCC[N@@H+](C)C1	ZINC000151119915	408260557	/nfs/dbraw/zinc/26/05/57/408260557.db2.gz	SMVRCFPDQYRAEB-JTQLQIEISA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000246483889	408268744	/nfs/dbraw/zinc/26/87/44/408268744.db2.gz	QBSBOWGDUCLFAG-IUODEOHRSA-N	1	1	321.377	1.801	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C1	ZINC000246483889	408268754	/nfs/dbraw/zinc/26/87/54/408268754.db2.gz	QBSBOWGDUCLFAG-IUODEOHRSA-N	1	1	321.377	1.801	20	5		DDBDMO
CCOC(=O)C1([N@H+](C)CCn2cc([N+](=O)[O-])cn2)CCCCC1	ZINC000151193973	408274201	/nfs/dbraw/zinc/27/42/01/408274201.db2.gz	JPKKYWDTMBSTCE-UHFFFAOYSA-N	1	1	324.381	1.989	20	5		DDBDMO
CCOC(=O)C1([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CCCCC1	ZINC000151193973	408274212	/nfs/dbraw/zinc/27/42/12/408274212.db2.gz	JPKKYWDTMBSTCE-UHFFFAOYSA-N	1	1	324.381	1.989	20	5		DDBDMO
O=C(CCCC[NH+]1CCOCC1)NCc1ccc([N+](=O)[O-])cc1	ZINC000263880630	408299260	/nfs/dbraw/zinc/29/92/60/408299260.db2.gz	BJHQOMJLPMCDBK-UHFFFAOYSA-N	1	1	321.377	1.714	20	5		DDBDMO
C[N@@H+](CCOc1ccc(F)cc1)CCn1ccc([N+](=O)[O-])n1	ZINC000176198654	408305668	/nfs/dbraw/zinc/30/56/68/408305668.db2.gz	ZHISDWBOUSVFJL-UHFFFAOYSA-N	1	1	308.313	1.941	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)COC1CCOCC1	ZINC000176424370	408363322	/nfs/dbraw/zinc/36/33/22/408363322.db2.gz	DJAGHYGWORLLIB-AWEZNQCLSA-N	1	1	324.377	1.583	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1	ZINC000246907599	408364872	/nfs/dbraw/zinc/36/48/72/408364872.db2.gz	ROTUHNCMSRZPLI-IUODEOHRSA-N	1	1	321.377	1.650	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192041	408386038	/nfs/dbraw/zinc/38/60/38/408386038.db2.gz	WVPGHUACUMNUMJ-MDZLAQPJSA-N	1	1	308.338	1.065	20	5		DDBDMO
COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000191192041	408386040	/nfs/dbraw/zinc/38/60/40/408386040.db2.gz	WVPGHUACUMNUMJ-MDZLAQPJSA-N	1	1	308.338	1.065	20	5		DDBDMO
COc1ccc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000173953214	162380380	/nfs/dbraw/zinc/38/03/80/162380380.db2.gz	IZLJKNFXBJRSFE-CQSZACIVSA-N	1	1	321.377	1.510	20	5		DDBDMO
COc1ccc(C[N@H+]2CC[C@@H](N3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000173953214	162380386	/nfs/dbraw/zinc/38/03/86/162380386.db2.gz	IZLJKNFXBJRSFE-CQSZACIVSA-N	1	1	321.377	1.510	20	5		DDBDMO
CC1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[NH2+]CC1	ZINC000183385610	408395562	/nfs/dbraw/zinc/39/55/62/408395562.db2.gz	XNBHRQHSFFMEGV-UHFFFAOYSA-N	1	1	317.349	1.591	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C[C@@H](O)C(F)(F)F)C2)nc1	ZINC000248388059	408554492	/nfs/dbraw/zinc/55/44/92/408554492.db2.gz	CUHSTHUGSJZPTG-WCBMZHEXSA-N	1	1	320.271	1.399	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@@H](O)C(F)(F)F)C2)nc1	ZINC000248388059	408554499	/nfs/dbraw/zinc/55/44/99/408554499.db2.gz	CUHSTHUGSJZPTG-WCBMZHEXSA-N	1	1	320.271	1.399	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)CCn3cc([N+](=O)[O-])cn3)CC[C@H]21	ZINC000248178046	408541951	/nfs/dbraw/zinc/54/19/51/408541951.db2.gz	VYMZUZPTLAMBIX-TZMCWYRMSA-N	1	1	321.381	1.124	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000192532347	408604470	/nfs/dbraw/zinc/60/44/70/408604470.db2.gz	QMHAKDDIBYTJLU-NSHDSACASA-N	1	1	305.334	1.524	20	5		DDBDMO
COc1cc(N2CC[N@@H+](C[C@H](C)O)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000248666712	408613593	/nfs/dbraw/zinc/61/35/93/408613593.db2.gz	OHIPZHYPJABUSW-RYUDHWBXSA-N	1	1	309.366	1.495	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2nn(C)cc2[N+](=O)[O-])[nH+]c1	ZINC000270758571	408670264	/nfs/dbraw/zinc/67/02/64/408670264.db2.gz	DZVPWUJSWOXBSO-UHFFFAOYSA-N	1	1	318.337	1.264	20	5		DDBDMO
CN(CCC[N@@H+](C)CCn1ccc([N+](=O)[O-])n1)Cc1ccco1	ZINC000285811579	408868545	/nfs/dbraw/zinc/86/85/45/408868545.db2.gz	VVRYRKWBKLRLCP-UHFFFAOYSA-N	1	1	321.381	1.838	20	5		DDBDMO
Cn1nccc1[C@H]1CCCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000281453505	408886254	/nfs/dbraw/zinc/88/62/54/408886254.db2.gz	QRZRRBBFVYUDAE-CYBMUJFWSA-N	1	1	304.354	1.752	20	5		DDBDMO
Cn1nccc1[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000281453505	408886258	/nfs/dbraw/zinc/88/62/58/408886258.db2.gz	QRZRRBBFVYUDAE-CYBMUJFWSA-N	1	1	304.354	1.752	20	5		DDBDMO
O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000277630159	408980823	/nfs/dbraw/zinc/98/08/23/408980823.db2.gz	XBWGFHDDCWGJRS-GFCCVEGCSA-N	1	1	320.349	1.442	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000283597796	409182708	/nfs/dbraw/zinc/18/27/08/409182708.db2.gz	XZXHYEKADYDQED-JTQLQIEISA-N	1	1	324.356	1.920	20	5		DDBDMO
Cn1c[nH+]cc1CCc1nc(Cc2ccc([N+](=O)[O-])cn2)no1	ZINC000290178231	409313959	/nfs/dbraw/zinc/31/39/59/409313959.db2.gz	VHGXBGVRXDXSMT-UHFFFAOYSA-N	1	1	314.305	1.482	20	5		DDBDMO
COC(=O)Cc1ccc(N2CC[NH+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000295539424	409339197	/nfs/dbraw/zinc/33/91/97/409339197.db2.gz	OFWKPKIHMSEXRM-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
C[C@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1	ZINC000280536479	409348310	/nfs/dbraw/zinc/34/83/10/409348310.db2.gz	PINDOXLJMZUDAN-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1	ZINC000280536479	409348318	/nfs/dbraw/zinc/34/83/18/409348318.db2.gz	PINDOXLJMZUDAN-XJKSGUPXSA-N	1	1	322.361	1.853	20	5		DDBDMO
COc1cc(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000331547552	409622140	/nfs/dbraw/zinc/62/21/40/409622140.db2.gz	RJEXWSJLZBASTJ-LLVKDONJSA-N	1	1	305.334	1.570	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)[C@H](C)[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000356835058	409647087	/nfs/dbraw/zinc/64/70/87/409647087.db2.gz	BFTQUMIKABYBSH-VXGBXAGGSA-N	1	1	323.397	1.349	20	5		DDBDMO
CC[N@H+](Cc1ccccn1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000305034145	409657057	/nfs/dbraw/zinc/65/70/57/409657057.db2.gz	IDKUGBVTDUZGSF-AWEZNQCLSA-N	1	1	305.338	1.069	20	5		DDBDMO
Cc1sc(C(=O)NCC[NH+]2CCC(O)CC2)cc1[N+](=O)[O-]	ZINC000296852889	409667407	/nfs/dbraw/zinc/66/74/07/409667407.db2.gz	HQSOQSWATPQTSB-UHFFFAOYSA-N	1	1	313.379	1.151	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)[C@@H](C)[C@H]1C	ZINC000357012404	409794467	/nfs/dbraw/zinc/79/44/67/409794467.db2.gz	YQJUYRQNWITJOT-QWHCGFSZSA-N	1	1	320.393	1.866	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1NC[C@@]1(O)CC[N@@H+](C)C1	ZINC000342833358	409936262	/nfs/dbraw/zinc/93/62/62/409936262.db2.gz	ZDLUVOPLMXRTGG-HNNXBMFYSA-N	1	1	323.349	1.168	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](CO)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000298081898	410104604	/nfs/dbraw/zinc/10/46/04/410104604.db2.gz	MROYJSYQACDBJA-LBPRGKRZSA-N	1	1	319.361	1.188	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](CO)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000298081898	410104613	/nfs/dbraw/zinc/10/46/13/410104613.db2.gz	MROYJSYQACDBJA-LBPRGKRZSA-N	1	1	319.361	1.188	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000357712961	410203000	/nfs/dbraw/zinc/20/30/00/410203000.db2.gz	XMKYVVJLDXRZNV-SNVBAGLBSA-N	1	1	317.305	1.400	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CO)C1	ZINC000298650427	410331181	/nfs/dbraw/zinc/33/11/81/410331181.db2.gz	YBKBZFDMGJWLAV-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](CO)C1	ZINC000298650427	410331187	/nfs/dbraw/zinc/33/11/87/410331187.db2.gz	YBKBZFDMGJWLAV-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+]1CC=C(CNC(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000343311186	410338065	/nfs/dbraw/zinc/33/80/65/410338065.db2.gz	ZDFGEUYMJRXCTL-UHFFFAOYSA-N	1	1	307.325	1.655	20	5		DDBDMO
CC[C@H](C)[N@@H+](CCO)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000347470435	410570661	/nfs/dbraw/zinc/57/06/61/410570661.db2.gz	HTCIXNZKJSVVAA-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cc1cnn(C)c1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000347848891	410755022	/nfs/dbraw/zinc/75/50/22/410755022.db2.gz	JKDHCJZEVWWJBY-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1cc(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)ncc1[N+](=O)[O-]	ZINC000301851329	410813847	/nfs/dbraw/zinc/81/38/47/410813847.db2.gz	FUZISWZFDOCUMR-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)ncc1[N+](=O)[O-]	ZINC000301851329	410813851	/nfs/dbraw/zinc/81/38/51/410813851.db2.gz	FUZISWZFDOCUMR-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1O	ZINC000330649744	410850141	/nfs/dbraw/zinc/85/01/41/410850141.db2.gz	JELPDOFQFIXSMW-KYOSRNDESA-N	1	1	310.350	1.037	20	5		DDBDMO
C[C@@H]1[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@@H+]1C	ZINC000343962359	410850401	/nfs/dbraw/zinc/85/04/01/410850401.db2.gz	BXKSCESVHMZYQB-MFKMUULPSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[C@@H]1[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CCC[N@H+]1C	ZINC000343962359	410850408	/nfs/dbraw/zinc/85/04/08/410850408.db2.gz	BXKSCESVHMZYQB-MFKMUULPSA-N	1	1	313.379	1.356	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000344044936	410918469	/nfs/dbraw/zinc/91/84/69/410918469.db2.gz	XVGBWYJJIGANLG-GLQYFDAESA-N	1	1	319.361	1.626	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000341187159	410923358	/nfs/dbraw/zinc/92/33/58/410923358.db2.gz	CGVZSRHUSOHKHF-OCCSQVGLSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000341187158	410924255	/nfs/dbraw/zinc/92/42/55/410924255.db2.gz	CGVZSRHUSOHKHF-JSGCOSHPSA-N	1	1	320.393	1.919	20	5		DDBDMO
C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CCS(=O)(=O)C1	ZINC000353774885	411128372	/nfs/dbraw/zinc/12/83/72/411128372.db2.gz	JIAWSDCAUJVRPY-RYWCDNDXSA-N	1	1	324.402	1.975	20	5		DDBDMO
C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1CCS(=O)(=O)C1	ZINC000353774885	411128374	/nfs/dbraw/zinc/12/83/74/411128374.db2.gz	JIAWSDCAUJVRPY-RYWCDNDXSA-N	1	1	324.402	1.975	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cnn1C	ZINC000353727399	411119168	/nfs/dbraw/zinc/11/91/68/411119168.db2.gz	ZNSGQIXYOJSAFM-CYBMUJFWSA-N	1	1	316.365	1.718	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])c(-c2ccc(F)cn2)n1	ZINC000580346127	422922526	/nfs/dbraw/zinc/92/25/26/422922526.db2.gz	XETCAUALIUVEJR-LLVKDONJSA-N	1	1	323.328	1.305	20	5		DDBDMO
O=C1NC(=O)[C@@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@@H]12	ZINC000366571587	418492643	/nfs/dbraw/zinc/49/26/43/418492643.db2.gz	XVCOUZARXKHXIS-UXOHQCDBSA-N	1	1	315.329	1.203	20	5		DDBDMO
COc1cc(OCC(=O)NC[C@@H]2CCC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000195187013	418554959	/nfs/dbraw/zinc/55/49/59/418554959.db2.gz	VEQLIKBXTPNMSS-NSHDSACASA-N	1	1	323.349	1.193	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3ccc([N+](=O)[O-])c4nonc43)C[C@H]21	ZINC000375050721	418596067	/nfs/dbraw/zinc/59/60/67/418596067.db2.gz	SFDVBJDHPQAUOU-JOYOIKCWSA-N	1	1	303.322	1.661	20	5		DDBDMO
CC1(C)[C@@H](O)CC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000361414270	418648000	/nfs/dbraw/zinc/64/80/00/418648000.db2.gz	ILSFYHKNTIMSRU-FZMZJTMJSA-N	1	1	310.350	1.180	20	5		DDBDMO
CO[C@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362574	418636108	/nfs/dbraw/zinc/63/61/08/418636108.db2.gz	TYPVGOVIHFKGSI-RYUDHWBXSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362574	418636112	/nfs/dbraw/zinc/63/61/12/418636112.db2.gz	TYPVGOVIHFKGSI-RYUDHWBXSA-N	1	1	307.350	1.951	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000386438226	418740279	/nfs/dbraw/zinc/74/02/79/418740279.db2.gz	PIWDYMCHBBJYFG-QMMMGPOBSA-N	1	1	321.175	1.255	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2[nH]nc(CC)c2[N+](=O)[O-])CC1	ZINC000365417814	418858531	/nfs/dbraw/zinc/85/85/31/418858531.db2.gz	BVNCIQQSPXFFRU-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCC[N@@H+]1CCCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])CC1	ZINC000365417814	418858534	/nfs/dbraw/zinc/85/85/34/418858534.db2.gz	BVNCIQQSPXFFRU-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2n[nH]c(CC)c2[N+](=O)[O-])CC1	ZINC000365417814	418858537	/nfs/dbraw/zinc/85/85/37/418858537.db2.gz	BVNCIQQSPXFFRU-UHFFFAOYSA-N	1	1	309.370	1.438	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000372351425	418860615	/nfs/dbraw/zinc/86/06/15/418860615.db2.gz	RXXQAWZWGBXOIU-NWANDNLSSA-N	1	1	321.377	1.502	20	5		DDBDMO
CC(C)[N@@H+](CCOc1ccccc1[N+](=O)[O-])C[C@H]1CCC(=O)N1	ZINC000412093747	419654005	/nfs/dbraw/zinc/65/40/05/419654005.db2.gz	WPIXOVYHDZAWFK-CYBMUJFWSA-N	1	1	321.377	1.963	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)NCC(F)(F)C[NH3+]	ZINC000415508161	420094444	/nfs/dbraw/zinc/09/44/44/420094444.db2.gz	UQRJQVVALWRWBC-UHFFFAOYSA-N	1	1	304.253	1.319	20	5		DDBDMO
COc1ccc(OCCN[C@H]2CC[NH2+]CC2(C)C)c([N+](=O)[O-])c1	ZINC000420359693	420233865	/nfs/dbraw/zinc/23/38/65/420233865.db2.gz	KCIBSYUEHQMUFX-HNNXBMFYSA-N	1	1	323.393	1.960	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000423959074	420284411	/nfs/dbraw/zinc/28/44/11/420284411.db2.gz	RCQPTLPBJCXXGR-LLVKDONJSA-N	1	1	305.338	1.574	20	5		DDBDMO
C[NH+](C)C1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000416303013	420319599	/nfs/dbraw/zinc/31/95/99/420319599.db2.gz	QFQUKTVWOQTJHP-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC2([NH+]3CCOCC3)CCCCC2)nc1	ZINC000302151321	230127220	/nfs/dbraw/zinc/12/72/20/230127220.db2.gz	KNIVTLZOSHLDHG-UHFFFAOYSA-N	1	1	321.381	1.832	20	5		DDBDMO
CNc1nc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)ccc1[N+](=O)[O-]	ZINC000454921241	420943414	/nfs/dbraw/zinc/94/34/14/420943414.db2.gz	IIBVGGFIJGPVST-SNVBAGLBSA-N	1	1	319.365	1.246	20	5		DDBDMO
CNc1nc(C(=O)N[C@@H]2CCC[N@@H+](C)[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456017550	421089388	/nfs/dbraw/zinc/08/93/88/421089388.db2.gz	ZBKHHBNCDGUFIE-NXEZZACHSA-N	1	1	307.354	1.244	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[N@@H+](C)[C@H](C(C)C)C2)c1[N+](=O)[O-]	ZINC000489329048	421147623	/nfs/dbraw/zinc/14/76/23/421147623.db2.gz	NNAFKHSEWHBWFH-NSHDSACASA-N	1	1	309.370	1.049	20	5		DDBDMO
NC(=O)c1ccc(N[C@H]2CCn3cc[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000489939525	421180739	/nfs/dbraw/zinc/18/07/39/421180739.db2.gz	OYBBAMSOUOWQAV-JTQLQIEISA-N	1	1	301.306	1.317	20	5		DDBDMO
Cc1nc(N2CC[NH+](CCOC(C)C)CC2)ncc1[N+](=O)[O-]	ZINC000450361582	421188426	/nfs/dbraw/zinc/18/84/26/421188426.db2.gz	CWTGHBIBXCSHLV-UHFFFAOYSA-N	1	1	309.370	1.240	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000525727208	421298664	/nfs/dbraw/zinc/29/86/64/421298664.db2.gz	LBNDHBZBLDHKDG-LBPRGKRZSA-N	1	1	308.382	1.737	20	5		DDBDMO
Cc1c[nH+]cn1C1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)CC1	ZINC000526017655	421323685	/nfs/dbraw/zinc/32/36/85/421323685.db2.gz	AHHKFDORPDCFIU-UHFFFAOYSA-N	1	1	315.333	1.972	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000548125582	421404058	/nfs/dbraw/zinc/40/40/58/421404058.db2.gz	XLDPXAYESZUCKX-ZDUSSCGKSA-N	1	1	323.397	1.514	20	5		DDBDMO
Cc1nnc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000563011407	421437971	/nfs/dbraw/zinc/43/79/71/421437971.db2.gz	JYQVQZAGVJDFPC-JTQLQIEISA-N	1	1	324.362	1.284	20	5		DDBDMO
C[N@H+]1CCN(C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551038781	421526408	/nfs/dbraw/zinc/52/64/08/421526408.db2.gz	DDKKBKYNUHRGHA-ZDUSSCGKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551038781	421526409	/nfs/dbraw/zinc/52/64/09/421526409.db2.gz	DDKKBKYNUHRGHA-ZDUSSCGKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CN1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000551038781	421526410	/nfs/dbraw/zinc/52/64/10/421526410.db2.gz	DDKKBKYNUHRGHA-ZDUSSCGKSA-N	1	1	323.393	1.361	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](O)CN1CC(Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000517041145	421591167	/nfs/dbraw/zinc/59/11/67/421591167.db2.gz	HEPDTQQGRJYVKG-AWEZNQCLSA-N	1	1	323.393	1.359	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC[C@@H]2C2(O)CC2)c([N+](=O)[O-])c1	ZINC000516157682	421531365	/nfs/dbraw/zinc/53/13/65/421531365.db2.gz	RZKHWDOEDKQMDT-CQSZACIVSA-N	1	1	319.361	1.573	20	5		DDBDMO
[NH3+]C[C@@H]1CN(Cc2ccccc2[N+](=O)[O-])CC12CCOCC2	ZINC000519659631	421714305	/nfs/dbraw/zinc/71/43/05/421714305.db2.gz	XIYRINPFFLKADM-CQSZACIVSA-N	1	1	305.378	1.782	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)NCCNc2ccccc2[N+](=O)[O-])C1	ZINC000557418462	421770147	/nfs/dbraw/zinc/77/01/47/421770147.db2.gz	CSFQOPXABYETIL-GFCCVEGCSA-N	1	1	306.366	1.465	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000521144115	421774561	/nfs/dbraw/zinc/77/45/61/421774561.db2.gz	TYNOLPDMRHQNHS-GFCCVEGCSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000521500316	421790884	/nfs/dbraw/zinc/79/08/84/421790884.db2.gz	IODUYKAPUUEBDP-SNVBAGLBSA-N	1	1	323.349	1.784	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000543141263	421833981	/nfs/dbraw/zinc/83/39/81/421833981.db2.gz	USEHCVPIPDLEBB-BFHYXJOUSA-N	1	1	324.377	1.427	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)C)n2)C1	ZINC000576767207	422377289	/nfs/dbraw/zinc/37/72/89/422377289.db2.gz	IADUOLKKZAONQL-LBPRGKRZSA-N	1	1	324.381	1.910	20	5		DDBDMO
Nc1ncc2c(n1)C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2	ZINC000598947783	422400867	/nfs/dbraw/zinc/40/08/67/422400867.db2.gz	MQVPPZAACYJGON-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
Nc1ncc2c(n1)C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2	ZINC000598947783	422400872	/nfs/dbraw/zinc/40/08/72/422400872.db2.gz	MQVPPZAACYJGON-UHFFFAOYSA-N	1	1	315.333	1.404	20	5		DDBDMO
COCC[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000273959482	274026968	/nfs/dbraw/zinc/02/69/68/274026968.db2.gz	FPLHIAZRHDZEGU-UHFFFAOYSA-N	1	1	319.365	1.630	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000299569158	277056552	/nfs/dbraw/zinc/05/65/52/277056552.db2.gz	TWYBBGBPBNPAGH-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@H]21	ZINC000284887871	277129973	/nfs/dbraw/zinc/12/99/73/277129973.db2.gz	GWNNXUMCCNJIDR-KGLIPLIRSA-N	1	1	317.349	1.380	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000193946099	277242090	/nfs/dbraw/zinc/24/20/90/277242090.db2.gz	IJMXKFNWBQQLEV-LLVKDONJSA-N	1	1	322.321	1.461	20	5		DDBDMO
CNC(=O)[C@@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000193946099	277242092	/nfs/dbraw/zinc/24/20/92/277242092.db2.gz	IJMXKFNWBQQLEV-LLVKDONJSA-N	1	1	322.321	1.461	20	5		DDBDMO
C[C@H]1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC[NH2+]1	ZINC000237693137	278438683	/nfs/dbraw/zinc/43/86/83/278438683.db2.gz	KBKFIZPHEUMGRY-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000364037511	300336883	/nfs/dbraw/zinc/33/68/83/300336883.db2.gz	AUDMSVYTBQDMMM-CHWSQXEVSA-N	1	1	321.381	1.233	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000364173982	300353634	/nfs/dbraw/zinc/35/36/34/300353634.db2.gz	KKHOUPHJNCJFPF-AJNGGQMLSA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000364173982	300353637	/nfs/dbraw/zinc/35/36/37/300353637.db2.gz	KKHOUPHJNCJFPF-AJNGGQMLSA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000364173982	300353639	/nfs/dbraw/zinc/35/36/39/300353639.db2.gz	KKHOUPHJNCJFPF-AJNGGQMLSA-N	1	1	318.377	1.198	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CCC[N@H+]([C@H](C)CO)CC1	ZINC000364262036	300364376	/nfs/dbraw/zinc/36/43/76/300364376.db2.gz	ABKZKETVDUKCGJ-CYBMUJFWSA-N	1	1	323.393	1.634	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000364264770	300364658	/nfs/dbraw/zinc/36/46/58/300364658.db2.gz	OQADNCCOVMERCJ-UHFFFAOYSA-N	1	1	307.394	1.873	20	5		DDBDMO
CCc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000378309034	302310722	/nfs/dbraw/zinc/31/07/22/302310722.db2.gz	AVKNPLGGCLLCHB-SNVBAGLBSA-N	1	1	318.337	1.382	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532140710	303276574	/nfs/dbraw/zinc/27/65/74/303276574.db2.gz	RZPWBCMYSSKWNN-RYUDHWBXSA-N	1	1	306.366	1.840	20	5		DDBDMO
CC(=O)N1CCC[C@@H]1[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000363593318	307032240	/nfs/dbraw/zinc/03/22/40/307032240.db2.gz	XYTZNWXWUQWIMD-ZIAGYGMSSA-N	1	1	321.381	1.267	20	5		DDBDMO
C[N@H+]1CCCC12CCN(C(=O)c1cccc([N+](=O)[O-])c1N)CC2	ZINC000364912870	307053814	/nfs/dbraw/zinc/05/38/14/307053814.db2.gz	BWGRXZXANJIQCX-UHFFFAOYSA-N	1	1	318.377	1.877	20	5		DDBDMO
C[C@H]1CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000371440809	307149767	/nfs/dbraw/zinc/14/97/67/307149767.db2.gz	UIFZCKVGGOWFDQ-JSGCOSHPSA-N	1	1	308.382	1.664	20	5		DDBDMO
CNC(=O)c1ccc(NC[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000391175259	307294210	/nfs/dbraw/zinc/29/42/10/307294210.db2.gz	HRPZVBSLVSJZTF-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
CC(C)O[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000564915081	308011899	/nfs/dbraw/zinc/01/18/99/308011899.db2.gz	AUPUACRPYZFQNR-UONOGXRCSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H](N3CCOCC3)C2)c1	ZINC000565174950	308023326	/nfs/dbraw/zinc/02/33/26/308023326.db2.gz	UPIYRRWJLWRCIX-INIZCTEOSA-N	1	1	305.378	1.891	20	5		DDBDMO
C[C@@H]1C[C@H]([NH3+])CCN1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000571773015	308201984	/nfs/dbraw/zinc/20/19/84/308201984.db2.gz	VNCBMWOVCGFFFK-VXGBXAGGSA-N	1	1	306.366	1.735	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)C[NH+]1CC(C)(C)C1	ZINC000580568455	308615347	/nfs/dbraw/zinc/61/53/47/308615347.db2.gz	HDUYGQCIAYOJEY-UHFFFAOYSA-N	1	1	305.378	1.938	20	5		DDBDMO
COC[C@H](C)OC[C@@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361706	332353622	/nfs/dbraw/zinc/35/36/22/332353622.db2.gz	PNXLTCHCCYVXKF-JSGCOSHPSA-N	1	1	324.377	1.365	20	5		DDBDMO
COC[C@H](C)OC[C@@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000583361706	332353624	/nfs/dbraw/zinc/35/36/24/332353624.db2.gz	PNXLTCHCCYVXKF-JSGCOSHPSA-N	1	1	324.377	1.365	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000421020756	484111047	/nfs/dbraw/zinc/11/10/47/484111047.db2.gz	OMAOPEGOJYWBOE-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000421020756	484111055	/nfs/dbraw/zinc/11/10/55/484111055.db2.gz	OMAOPEGOJYWBOE-ZWNOBZJWSA-N	1	1	318.333	1.990	20	5		DDBDMO
CC(C)(C)OC(=O)[C@]1(C)CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000459575336	526525876	/nfs/dbraw/zinc/52/58/76/526525876.db2.gz	FJAAWLOTPGMXLO-OAHLLOKOSA-N	1	1	324.381	1.845	20	5		DDBDMO
[NH3+]C[C@@H]1CCCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000158397177	527210926	/nfs/dbraw/zinc/21/09/26/527210926.db2.gz	AHWGPOIKBLMUSP-JOYOIKCWSA-N	1	1	317.349	1.718	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000330871263	527845847	/nfs/dbraw/zinc/84/58/47/527845847.db2.gz	XSUDTOOPBUQWDR-LLVKDONJSA-N	1	1	321.381	1.376	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@H](C)CO	ZINC000292386971	527900393	/nfs/dbraw/zinc/90/03/93/527900393.db2.gz	ZLZULTAGWZBONX-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
COCC[NH+]1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1	ZINC000139654258	696864594	/nfs/dbraw/zinc/86/45/94/696864594.db2.gz	LJCLACKJSNAHMI-UHFFFAOYSA-N	1	1	305.338	1.011	20	5		DDBDMO
CC(C)CC[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC000981763301	696906531	/nfs/dbraw/zinc/90/65/31/696906531.db2.gz	GFPXZVZKXXYIDP-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)CC[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC000981763301	696906533	/nfs/dbraw/zinc/90/65/33/696906533.db2.gz	GFPXZVZKXXYIDP-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)CC[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC000981763301	696906536	/nfs/dbraw/zinc/90/65/36/696906536.db2.gz	GFPXZVZKXXYIDP-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
C[N@@H+](Cc1ccccn1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985431193	697510086	/nfs/dbraw/zinc/51/00/86/697510086.db2.gz	NGHHDTFIOPVPPU-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[N@H+](Cc1ccccn1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985431193	697510088	/nfs/dbraw/zinc/51/00/88/697510088.db2.gz	NGHHDTFIOPVPPU-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[N@@H+](Cc1ccccn1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985431193	697510089	/nfs/dbraw/zinc/51/00/89/697510089.db2.gz	NGHHDTFIOPVPPU-HUUCEWRRSA-N	1	1	318.377	1.170	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000194739393	697720110	/nfs/dbraw/zinc/72/01/10/697720110.db2.gz	ORHZDCLZAPYEOB-SNVBAGLBSA-N	1	1	308.294	1.327	20	5		DDBDMO
C[N@@H+](CCN1CCCC1=O)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776581997	698121062	/nfs/dbraw/zinc/12/10/62/698121062.db2.gz	LHMCJNPEEMDIHA-AWEZNQCLSA-N	1	1	307.350	1.182	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857804	698144248	/nfs/dbraw/zinc/14/42/48/698144248.db2.gz	NCGWNULFYVHVQS-RISCZKNCSA-N	1	1	323.393	1.863	20	5		DDBDMO
C[C@H](C(=O)NC(C)(C)C)[N@@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000776857804	698144249	/nfs/dbraw/zinc/14/42/49/698144249.db2.gz	NCGWNULFYVHVQS-RISCZKNCSA-N	1	1	323.393	1.863	20	5		DDBDMO
COCCO[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000245923262	698341015	/nfs/dbraw/zinc/34/10/15/698341015.db2.gz	SYZLMZACQIPKTC-JKSUJKDBSA-N	1	1	324.377	1.756	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-]	ZINC000779865023	698476339	/nfs/dbraw/zinc/47/63/39/698476339.db2.gz	KATDFXIVIBALIU-LBPRGKRZSA-N	1	1	304.354	1.355	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-]	ZINC000779865023	698476340	/nfs/dbraw/zinc/47/63/40/698476340.db2.gz	KATDFXIVIBALIU-LBPRGKRZSA-N	1	1	304.354	1.355	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000781961841	698666386	/nfs/dbraw/zinc/66/63/86/698666386.db2.gz	JQDUYENKQWAOEK-LSDHHAIUSA-N	1	1	310.350	1.366	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000786967334	699183661	/nfs/dbraw/zinc/18/36/61/699183661.db2.gz	VSBYVKLTXRQEJQ-UHFFFAOYSA-N	1	1	317.349	1.927	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H]1C	ZINC000787247959	699200019	/nfs/dbraw/zinc/20/00/19/699200019.db2.gz	VTIRFWYJRVRZCZ-ZWNOBZJWSA-N	1	1	318.333	1.785	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H]1C	ZINC000787247959	699200020	/nfs/dbraw/zinc/20/00/20/699200020.db2.gz	VTIRFWYJRVRZCZ-ZWNOBZJWSA-N	1	1	318.333	1.785	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)CCO1	ZINC000725789938	699333976	/nfs/dbraw/zinc/33/39/76/699333976.db2.gz	SKJKQCXQAGPADY-SECBINFHSA-N	1	1	307.310	1.264	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2ccc([N+](=O)[O-])c3nonc32)CCO1	ZINC000725789938	699333979	/nfs/dbraw/zinc/33/39/79/699333979.db2.gz	SKJKQCXQAGPADY-SECBINFHSA-N	1	1	307.310	1.264	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=S)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000730733780	699514741	/nfs/dbraw/zinc/51/47/41/699514741.db2.gz	OBFJHKYNSULUQM-GFCCVEGCSA-N	1	1	324.406	1.602	20	5		DDBDMO
C[N@H+](C[C@H]1CCCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794626927	699819868	/nfs/dbraw/zinc/81/98/68/699819868.db2.gz	YKIJUZRTWAGJFZ-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
C[N@@H+](C[C@H]1CCCOC1)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000794626927	699819871	/nfs/dbraw/zinc/81/98/71/699819871.db2.gz	YKIJUZRTWAGJFZ-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
CC(C)[N@@H+](CCOCCO)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000801994006	700362850	/nfs/dbraw/zinc/36/28/50/700362850.db2.gz	VMODWNSIPHPMNJ-OAHLLOKOSA-N	1	1	312.366	1.348	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)[C@H](C)C1	ZINC000761075341	700839837	/nfs/dbraw/zinc/83/98/37/700839837.db2.gz	FGXWOGKERPBQMX-LLVKDONJSA-N	1	1	322.365	1.178	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@@H+]1C	ZINC000762814240	700908363	/nfs/dbraw/zinc/90/83/63/700908363.db2.gz	BFZJTXSPQZFYPV-QMMMGPOBSA-N	1	1	321.362	1.376	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000762814240	700908364	/nfs/dbraw/zinc/90/83/64/700908364.db2.gz	BFZJTXSPQZFYPV-QMMMGPOBSA-N	1	1	321.362	1.376	20	5		DDBDMO
C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C	ZINC000767179301	701088511	/nfs/dbraw/zinc/08/85/11/701088511.db2.gz	SQBQNZUJHPPKOU-JTQLQIEISA-N	1	1	311.769	1.953	20	5		DDBDMO
C[C@H]1CN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C	ZINC000767179301	701088514	/nfs/dbraw/zinc/08/85/14/701088514.db2.gz	SQBQNZUJHPPKOU-JTQLQIEISA-N	1	1	311.769	1.953	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000771987824	701339455	/nfs/dbraw/zinc/33/94/55/701339455.db2.gz	XHPLQFRODKKBJF-UHFFFAOYSA-N	1	1	318.333	1.779	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839669760	701775121	/nfs/dbraw/zinc/77/51/21/701775121.db2.gz	DUIBIMZAIFGEDH-RBSFLKMASA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@@H+]1CC1CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839669760	701775125	/nfs/dbraw/zinc/77/51/25/701775125.db2.gz	DUIBIMZAIFGEDH-RBSFLKMASA-N	1	1	309.410	1.813	20	5		DDBDMO
O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839669760	701775129	/nfs/dbraw/zinc/77/51/29/701775129.db2.gz	DUIBIMZAIFGEDH-RBSFLKMASA-N	1	1	309.410	1.813	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000840178184	702014690	/nfs/dbraw/zinc/01/46/90/702014690.db2.gz	MUJIVPDTSUBCLR-LBPRGKRZSA-N	1	1	317.349	1.312	20	5		DDBDMO
CCN(C(=O)Cc1cccc(F)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000869240243	702527535	/nfs/dbraw/zinc/52/75/35/702527535.db2.gz	YKTQGIPMKXJAJE-GFCCVEGCSA-N	1	1	309.341	1.829	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](COC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000842831983	702781216	/nfs/dbraw/zinc/78/12/16/702781216.db2.gz	RBAKTGUMUXOBEL-CYBMUJFWSA-N	1	1	324.381	1.845	20	5		DDBDMO
CCN(OC)C(=O)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000843429766	702880244	/nfs/dbraw/zinc/88/02/44/702880244.db2.gz	BGSQMCGDHAKVKH-UHFFFAOYSA-N	1	1	301.730	1.748	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2C(=O)N(C)C(=O)[C@@H]2C1	ZINC000879531858	706711076	/nfs/dbraw/zinc/71/10/76/706711076.db2.gz	MFKDWKKAUYXLPE-WQAKAFBOSA-N	1	1	303.318	1.202	20	5		DDBDMO
C[C@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000844963579	703090887	/nfs/dbraw/zinc/09/08/87/703090887.db2.gz	JFURKVWDHVTEEP-FMKPAKJESA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@]1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000844963579	703090889	/nfs/dbraw/zinc/09/08/89/703090889.db2.gz	JFURKVWDHVTEEP-FMKPAKJESA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@]1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000844963579	703090892	/nfs/dbraw/zinc/09/08/92/703090892.db2.gz	JFURKVWDHVTEEP-FMKPAKJESA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@@]1(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000844963580	703090958	/nfs/dbraw/zinc/09/09/58/703090958.db2.gz	JFURKVWDHVTEEP-IIAWOOMASA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@@]1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1	ZINC000844963580	703090961	/nfs/dbraw/zinc/09/09/61/703090961.db2.gz	JFURKVWDHVTEEP-IIAWOOMASA-N	1	1	303.362	1.432	20	5		DDBDMO
C[C@@]1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+](Cc2ccccc2)C1	ZINC000844963580	703090963	/nfs/dbraw/zinc/09/09/63/703090963.db2.gz	JFURKVWDHVTEEP-IIAWOOMASA-N	1	1	303.362	1.432	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000846972749	703359096	/nfs/dbraw/zinc/35/90/96/703359096.db2.gz	MMWKJAPOBYVRCG-HIFRSBDPSA-N	1	1	321.377	1.571	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](CC(C)(C)O)C1	ZINC000869781039	703850665	/nfs/dbraw/zinc/85/06/65/703850665.db2.gz	BWLBPPSUNVZVIA-LBPRGKRZSA-N	1	1	321.377	1.478	20	5		DDBDMO
CCOC[C@H]1CCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870897300	704161140	/nfs/dbraw/zinc/16/11/40/704161140.db2.gz	BGUMDMIEIRNJSI-LRDDRELGSA-N	1	1	321.377	1.654	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN(C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000821391164	704402748	/nfs/dbraw/zinc/40/27/48/704402748.db2.gz	IMSRUJKUYJIPJF-ZDUSSCGKSA-N	1	1	315.801	1.993	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNC(=O)CCC(C)(C)[N+](=O)[O-])[C@H](C)CO1	ZINC000855408682	704483244	/nfs/dbraw/zinc/48/32/44/704483244.db2.gz	XLUVLXSAPZJMHP-VXGBXAGGSA-N	1	1	301.387	1.047	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNC(=O)CCC(C)(C)[N+](=O)[O-])[C@H](C)CO1	ZINC000855408682	704483245	/nfs/dbraw/zinc/48/32/45/704483245.db2.gz	XLUVLXSAPZJMHP-VXGBXAGGSA-N	1	1	301.387	1.047	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)cc1	ZINC000859924612	705042742	/nfs/dbraw/zinc/04/27/42/705042742.db2.gz	MLZGCFTWNYKWNT-NUEKZKHPSA-N	1	1	306.362	1.723	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)C1	ZINC000874444555	705069071	/nfs/dbraw/zinc/06/90/71/705069071.db2.gz	WTMKBNORHOWNLG-ZDUSSCGKSA-N	1	1	321.377	1.662	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC(=O)[C@@H]2C1)Nc1ccccc1[N+](=O)[O-]	ZINC000860161774	705119745	/nfs/dbraw/zinc/11/97/45/705119745.db2.gz	MCGGARZODHFYMP-GHMZBOCLSA-N	1	1	319.317	1.028	20	5		DDBDMO
COc1c(C(=O)N2CC[C@H]3[C@@H]2CCC[N@H+]3C)cccc1[N+](=O)[O-]	ZINC000874830377	705189295	/nfs/dbraw/zinc/18/92/95/705189295.db2.gz	RGOXYZHZWPMWFB-STQMWFEESA-N	1	1	319.361	1.912	20	5		DDBDMO
Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCC[N@@H+]3C)c(N)c([N+](=O)[O-])c1	ZINC000874839119	705194938	/nfs/dbraw/zinc/19/49/38/705194938.db2.gz	TUIMWCDHTLGSAI-STQMWFEESA-N	1	1	318.377	1.794	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NC[C@H]1CC[N@H+]1C(C)(C)C	ZINC000824657289	705500727	/nfs/dbraw/zinc/50/07/27/705500727.db2.gz	CHQXJGJTDFBRDW-LLVKDONJSA-N	1	1	309.370	1.089	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1C	ZINC000827491049	706012967	/nfs/dbraw/zinc/01/29/67/706012967.db2.gz	KSFJENDBGBOORI-CQSZACIVSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](COC(=O)CCC(C)(C)[N+](=O)[O-])C1	ZINC000835298522	707216860	/nfs/dbraw/zinc/21/68/60/707216860.db2.gz	VUKQEINRPZLLRJ-LBPRGKRZSA-N	1	1	302.371	1.474	20	5		DDBDMO
COC(=O)CC[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000877817797	706223834	/nfs/dbraw/zinc/22/38/34/706223834.db2.gz	AHNDVMZMKSNQHY-LLVKDONJSA-N	1	1	310.354	1.494	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000829328398	706319930	/nfs/dbraw/zinc/31/99/30/706319930.db2.gz	VALNMTDPNIBQGK-HNNXBMFYSA-N	1	1	319.361	1.396	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000829621910	706368385	/nfs/dbraw/zinc/36/83/85/706368385.db2.gz	CMPVOPIENZZLQQ-GFCCVEGCSA-N	1	1	315.414	1.126	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)CCc2cc(F)ccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000830112625	706456816	/nfs/dbraw/zinc/45/68/16/706456816.db2.gz	UIILPSNCEFOTFC-GWCFXTLKSA-N	1	1	309.341	1.875	20	5		DDBDMO
COCC1([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])CCC1	ZINC000880186514	706904703	/nfs/dbraw/zinc/90/47/03/706904703.db2.gz	ZXIGUZWCODHUPZ-ZDUSSCGKSA-N	1	1	324.377	1.835	20	5		DDBDMO
COCC1([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCC1	ZINC000880188327	706905630	/nfs/dbraw/zinc/90/56/30/706905630.db2.gz	ZRRIDAPKMZSRCO-UHFFFAOYSA-N	1	1	307.350	1.695	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCOC[C@H]1OC	ZINC000880436985	706975888	/nfs/dbraw/zinc/97/58/88/706975888.db2.gz	DWCBGRPFGQCERA-UKRRQHHQSA-N	1	1	310.350	1.839	20	5		DDBDMO
CN1CCCC[C@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000872266960	707356614	/nfs/dbraw/zinc/35/66/14/707356614.db2.gz	IUNSXZFYRPVYQN-GJZGRUSLSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC(=O)c1c(N[C@@H](C)CN2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000881951649	707440877	/nfs/dbraw/zinc/44/08/77/707440877.db2.gz	CQJJHYDEGIDSPS-LBPRGKRZSA-N	1	1	320.393	1.845	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(N2C[C@@H]3CCC[N@@H+]3C[C@@H]2CO)c(F)c1	ZINC000872758159	707587233	/nfs/dbraw/zinc/58/72/33/707587233.db2.gz	PYZQOGQEIWIRKX-GXSJLCMTSA-N	1	1	313.304	1.518	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@H]1CCN2c1nc2sccn2c1[N+](=O)[O-]	ZINC000872779839	707596426	/nfs/dbraw/zinc/59/64/26/707596426.db2.gz	IWZUHWKZZBEOFM-NXEZZACHSA-N	1	1	307.379	1.977	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000837445768	707650039	/nfs/dbraw/zinc/65/00/39/707650039.db2.gz	GHHMUSAUABOYMT-GFCCVEGCSA-N	1	1	310.354	1.597	20	5		DDBDMO
Cc1c(C[NH2+]CCCN2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873009598	707692580	/nfs/dbraw/zinc/69/25/80/707692580.db2.gz	OYJVQGXOBRPMER-UHFFFAOYSA-N	1	1	306.410	1.630	20	5		DDBDMO
C[N@@H+](CCNc1cccc(F)c1[N+](=O)[O-])CCOCCO	ZINC000882952426	707868802	/nfs/dbraw/zinc/86/88/02/707868802.db2.gz	UKWWJYRETUVPBM-UHFFFAOYSA-N	1	1	301.318	1.087	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C	ZINC000882959995	707873656	/nfs/dbraw/zinc/87/36/56/707873656.db2.gz	WHYPWGYSSIIWOZ-SNVBAGLBSA-N	1	1	319.365	1.291	20	5		DDBDMO
C[C@@H](NC(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000896612189	708096155	/nfs/dbraw/zinc/09/61/55/708096155.db2.gz	IXSTZRZUVUBPMV-BNOWGMLFSA-N	1	1	318.377	1.859	20	5		DDBDMO
CO[C@@H]1CCOC[C@H]1Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000897120674	708233380	/nfs/dbraw/zinc/23/33/80/708233380.db2.gz	WIACRZGJDRPTFB-HUUCEWRRSA-N	1	1	303.318	1.781	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CC[C@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897220811	708258819	/nfs/dbraw/zinc/25/88/19/708258819.db2.gz	DKFGEXUUIIZGCJ-JKSUJKDBSA-N	1	1	305.378	1.939	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886204767	708714195	/nfs/dbraw/zinc/71/41/95/708714195.db2.gz	PXFXQDOGCLSVPZ-CYBMUJFWSA-N	1	1	306.366	1.871	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)c1	ZINC000887931717	709168826	/nfs/dbraw/zinc/16/88/26/709168826.db2.gz	FWMMTKURPZJCCV-WBMJQRKESA-N	1	1	303.362	1.927	20	5		DDBDMO
C[N@H+]1CCC[C@@](O)(CC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000900857851	709793979	/nfs/dbraw/zinc/79/39/79/709793979.db2.gz	LUHKMQNRORLVFF-MRXNPFEDSA-N	1	1	321.377	1.100	20	5		DDBDMO
O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105959	713132635	/nfs/dbraw/zinc/13/26/35/713132635.db2.gz	XKHQFWOFKJFFJN-AAEUAGOBSA-N	1	1	322.390	1.299	20	5		DDBDMO
O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cn1	ZINC000928105959	713132637	/nfs/dbraw/zinc/13/26/37/713132637.db2.gz	XKHQFWOFKJFFJN-AAEUAGOBSA-N	1	1	322.390	1.299	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000891508900	710222549	/nfs/dbraw/zinc/22/25/49/710222549.db2.gz	IFDBSKNCYIPGOQ-ZDUSSCGKSA-N	1	1	322.365	1.299	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NC[C@H](C)C[NH+]1CCOCC1	ZINC000892621088	710471300	/nfs/dbraw/zinc/47/13/00/710471300.db2.gz	GQGDETGODLIWQW-NSHDSACASA-N	1	1	310.354	1.379	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C	ZINC000928440064	713196835	/nfs/dbraw/zinc/19/68/35/713196835.db2.gz	AMGROLIEJPFZIE-TVQRCGJNSA-N	1	1	311.769	2.000	20	5		DDBDMO
C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895247511	711464755	/nfs/dbraw/zinc/46/47/55/711464755.db2.gz	VFFJIHKBBUNXPW-CABZTGNLSA-N	1	1	313.789	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC000896519871	711737180	/nfs/dbraw/zinc/73/71/80/711737180.db2.gz	YPRMXKXJGZEQAI-ZDUSSCGKSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[N@H+](C)C3(CCCCC3)C2)c1[N+](=O)[O-]	ZINC000908573171	712810851	/nfs/dbraw/zinc/81/08/51/712810851.db2.gz	IKJUJDYLUOTIAH-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@@H+](C)C3(CCCCC3)C2)c1[N+](=O)[O-]	ZINC000908573171	712810853	/nfs/dbraw/zinc/81/08/53/712810853.db2.gz	IKJUJDYLUOTIAH-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[N@H+](C)C3(CCCCC3)C2)c1[N+](=O)[O-]	ZINC000908573171	712810855	/nfs/dbraw/zinc/81/08/55/712810855.db2.gz	IKJUJDYLUOTIAH-UHFFFAOYSA-N	1	1	321.381	1.717	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000918332339	713537765	/nfs/dbraw/zinc/53/77/65/713537765.db2.gz	KTXQEXHMQGDMEN-UHFFFAOYSA-N	1	1	303.322	1.502	20	5		DDBDMO
Cc1ccc(NC(=O)N2C[C@@H]3C[N@@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000929118866	713550324	/nfs/dbraw/zinc/55/03/24/713550324.db2.gz	VEYHYBDDYKSQKI-TXEJJXNPSA-N	1	1	304.350	1.929	20	5		DDBDMO
Cc1nnc(CC[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1	ZINC000929154832	713557940	/nfs/dbraw/zinc/55/79/40/713557940.db2.gz	SGACLMWSRYNLHH-UHFFFAOYSA-N	1	1	317.349	1.651	20	5		DDBDMO
O=[N+]([O-])CC[N@@H+]1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000930242417	713784948	/nfs/dbraw/zinc/78/49/48/713784948.db2.gz	VMGUFYUBOVIQMK-ZDUSSCGKSA-N	1	1	301.350	1.928	20	5		DDBDMO
O=[N+]([O-])CC[N@H+]1CCC[C@H](c2nc(-c3ccccc3)n[nH]2)C1	ZINC000930242417	713784953	/nfs/dbraw/zinc/78/49/53/713784953.db2.gz	VMGUFYUBOVIQMK-ZDUSSCGKSA-N	1	1	301.350	1.928	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@@]2(C1)CCC[N@H+](CC[N+](=O)[O-])C2	ZINC000930490220	713847984	/nfs/dbraw/zinc/84/79/84/713847984.db2.gz	ZQWFHLUPEZOPAQ-HNNXBMFYSA-N	1	1	313.398	1.986	20	5		DDBDMO
CC(C)(C)OC(=O)N1CC[C@@]2(C1)CCC[N@@H+](CC[N+](=O)[O-])C2	ZINC000930490220	713847988	/nfs/dbraw/zinc/84/79/88/713847988.db2.gz	ZQWFHLUPEZOPAQ-HNNXBMFYSA-N	1	1	313.398	1.986	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](CCc1ccc([N+](=O)[O-])cc1)CC2	ZINC000931200235	714033534	/nfs/dbraw/zinc/03/35/34/714033534.db2.gz	MMMMBJCODDHTFE-UHFFFAOYSA-N	1	1	302.334	1.635	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@H+]1C	ZINC000931261543	714050806	/nfs/dbraw/zinc/05/08/06/714050806.db2.gz	BBMUBXWZNBGAGJ-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
CN(C(=O)CN1[C@@H]2CC[C@H]1C[N@H+](C)C2)c1ccc([N+](=O)[O-])cc1	ZINC000931393302	714082889	/nfs/dbraw/zinc/08/28/89/714082889.db2.gz	GNEFXMVPGREDPT-GASCZTMLSA-N	1	1	318.377	1.336	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2ccn(C)n2)C1	ZINC000932132729	714267770	/nfs/dbraw/zinc/26/77/70/714267770.db2.gz	NODASDDXWGJQEQ-ZDUSSCGKSA-N	1	1	318.381	1.713	20	5		DDBDMO
C[C@@H]1CCN[C@H](C)[C@H]1[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923370495	714330964	/nfs/dbraw/zinc/33/09/64/714330964.db2.gz	PHLSTBNHCOKJCQ-HLSYRSCKSA-N	1	1	323.393	1.311	20	5		DDBDMO
COc1ccccc1NC(=O)[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])C1	ZINC000932631790	714370450	/nfs/dbraw/zinc/37/04/50/714370450.db2.gz	IHOASLAQCSZGSF-GFCCVEGCSA-N	1	1	307.350	1.622	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C[NH3+]	ZINC000923497703	714378700	/nfs/dbraw/zinc/37/87/00/714378700.db2.gz	CMVOTGKBZAZCKN-CHWSQXEVSA-N	1	1	320.393	1.474	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000933863677	714686219	/nfs/dbraw/zinc/68/62/19/714686219.db2.gz	FZIWJLHNXNNTSM-UHFFFAOYSA-N	1	1	313.329	1.701	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@@H+]2CCO[C@@H]3COCC[C@@H]32)c1	ZINC000933973523	714711746	/nfs/dbraw/zinc/71/17/46/714711746.db2.gz	DVQXMJYUGXIRQV-LSDHHAIUSA-N	1	1	308.334	1.463	20	5		DDBDMO
O=[N+]([O-])c1cccc(OCC[N@H+]2CCO[C@@H]3COCC[C@@H]32)c1	ZINC000933973523	714711748	/nfs/dbraw/zinc/71/17/48/714711748.db2.gz	DVQXMJYUGXIRQV-LSDHHAIUSA-N	1	1	308.334	1.463	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21	ZINC000934951506	714937270	/nfs/dbraw/zinc/93/72/70/714937270.db2.gz	OUSWEQNSECMHQU-STQMWFEESA-N	1	1	321.381	1.042	20	5		DDBDMO
CCCC[N@@H+](C)C[C@@H](C)NC(=O)Cn1c(C)ncc1[N+](=O)[O-]	ZINC000936027682	715145040	/nfs/dbraw/zinc/14/50/40/715145040.db2.gz	PAQWOFXLXGNHNQ-LLVKDONJSA-N	1	1	311.386	1.336	20	5		DDBDMO
Cc1ccnc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000609669435	721903976	/nfs/dbraw/zinc/90/39/76/721903976.db2.gz	DZNGPAYJKYVGRQ-ZDUSSCGKSA-N	1	1	306.366	1.599	20	5		DDBDMO
CC(C)Oc1ccccc1C[NH2+]CCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001126932222	742776453	/nfs/dbraw/zinc/77/64/53/742776453.db2.gz	MXZAHMLEIIURNS-ZIAGYGMSSA-N	1	1	321.377	1.345	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NC/C=C/CNc1ncccc1[N+](=O)[O-]	ZINC001107232699	749662105	/nfs/dbraw/zinc/66/21/05/749662105.db2.gz	GBHNXZNCGKAPSW-SNAWJCMRSA-N	1	1	321.381	1.414	20	5		DDBDMO
Cc1cncnc1O[C@@H]1CC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169053206	762207898	/nfs/dbraw/zinc/20/78/98/762207898.db2.gz	IEJSUKLVBVTMAX-BFHYXJOUSA-N	1	1	306.366	1.684	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170329525	766255125	/nfs/dbraw/zinc/25/51/25/766255125.db2.gz	QMUMVGLMRRPMBG-MFKMUULPSA-N	1	1	307.350	1.484	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	ZINC001170329525	766255126	/nfs/dbraw/zinc/25/51/26/766255126.db2.gz	QMUMVGLMRRPMBG-MFKMUULPSA-N	1	1	307.350	1.484	20	5		DDBDMO
CCOC(=O)C1C[NH2+]CCC1=Nc1ncc([N+](=O)[O-])cc1NC	ZINC001170513993	767725608	/nfs/dbraw/zinc/72/56/08/767725608.db2.gz	LVJDFTGABUAKJM-UHFFFAOYSA-N	1	1	321.337	1.254	20	5		DDBDMO
CCOC(=O)C1=C(Nc2cc(C)c([N+](=O)[O-])cn2)CC[NH2+]C1	ZINC001170515605	767739572	/nfs/dbraw/zinc/73/95/72/767739572.db2.gz	LCUYZTPCFREUPM-UHFFFAOYSA-N	1	1	306.322	1.521	20	5		DDBDMO
CCCC1(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CCC1	ZINC001132564481	768988591	/nfs/dbraw/zinc/98/85/91/768988591.db2.gz	GJCTWZCKISUPMP-UHFFFAOYSA-N	1	1	323.397	1.505	20	5		DDBDMO
CCC(CC)C[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@H]2C1	ZINC001048814369	769933865	/nfs/dbraw/zinc/93/38/65/769933865.db2.gz	HUAQMZAHMVNHQA-LXTVHRRPSA-N	1	1	309.410	1.478	20	5		DDBDMO
CCC(CC)C[N@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001048814369	769933872	/nfs/dbraw/zinc/93/38/72/769933872.db2.gz	HUAQMZAHMVNHQA-LXTVHRRPSA-N	1	1	309.410	1.478	20	5		DDBDMO
CCC(CC)C[N@@H+]1C[C@H]2CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@H]2C1	ZINC001048814369	769933882	/nfs/dbraw/zinc/93/38/82/769933882.db2.gz	HUAQMZAHMVNHQA-LXTVHRRPSA-N	1	1	309.410	1.478	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC001135487047	771532421	/nfs/dbraw/zinc/53/24/21/771532421.db2.gz	ORUSNBOSVSYUOH-UHFFFAOYSA-N	1	1	311.769	1.955	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1nc(C2CC2)nc(Cl)c1[N+](=O)[O-]	ZINC001170898486	771898117	/nfs/dbraw/zinc/89/81/17/771898117.db2.gz	OIEMRAQAFNCPPQ-SSDOTTSWSA-N	1	1	300.750	1.351	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1nccc(C)c1[N+](=O)[O-]	ZINC001093770767	775067002	/nfs/dbraw/zinc/06/70/02/775067002.db2.gz	HFZIMEMCZVKOAN-UHFFFAOYSA-N	1	1	323.397	1.558	20	5		DDBDMO
Cc1cc(NCCNC(=O)C[N@H+](C)C2CCC2)ccc1[N+](=O)[O-]	ZINC001094221877	775543991	/nfs/dbraw/zinc/54/39/91/775543991.db2.gz	SKBJQHOMIXFFSC-UHFFFAOYSA-N	1	1	320.393	1.916	20	5		DDBDMO
Cc1cnc(C[N@@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)o1	ZINC001267501348	838192948	/nfs/dbraw/zinc/19/29/48/838192948.db2.gz	PVNDORHJBZEGEB-CHWSQXEVSA-N	1	1	324.381	1.365	20	5		DDBDMO
Cc1cnc(C[N@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)o1	ZINC001267501348	838192959	/nfs/dbraw/zinc/19/29/59/838192959.db2.gz	PVNDORHJBZEGEB-CHWSQXEVSA-N	1	1	324.381	1.365	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C)CC1(C)C	ZINC001156591814	863170923	/nfs/dbraw/zinc/17/09/23/863170923.db2.gz	ZGPLBJDQPAXIET-ZDUSSCGKSA-N	1	1	306.366	1.707	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1ccc(-c2ccccc2[N+](=O)[O-])nn1	ZINC001159789038	865525631	/nfs/dbraw/zinc/52/56/31/865525631.db2.gz	PVGDLQYEYVQHJY-CYBMUJFWSA-N	1	1	302.338	1.487	20	5		DDBDMO
CC(C)n1cc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)nn1	ZINC001336699802	869098412	/nfs/dbraw/zinc/09/84/12/869098412.db2.gz	NHOOBGIMGHECBG-AWEZNQCLSA-N	1	1	305.338	1.590	20	5		DDBDMO
COC(=O)c1cnc(N2CC[N@@H+](C(C)C)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC001165199234	869422221	/nfs/dbraw/zinc/42/22/21/869422221.db2.gz	KUCSDRPBTUZJES-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
COc1cccc(N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)c1[N+](=O)[O-]	ZINC001338084768	869791179	/nfs/dbraw/zinc/79/11/79/869791179.db2.gz	SFRITYOSQOMIAC-YPMHNXCESA-N	1	1	308.382	1.650	20	5		DDBDMO
CN(C)[C@@H]1C[C@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1(C)C	ZINC001338553535	870043356	/nfs/dbraw/zinc/04/33/56/870043356.db2.gz	XUEVENUQZRSYCN-QLFBSQMISA-N	1	1	307.394	1.947	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2C(C)=O)C1	ZINC001226532904	882487930	/nfs/dbraw/zinc/48/79/30/882487930.db2.gz	ZWODWSRBAVVAKU-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2C(C)=O)C1	ZINC001226532904	882487934	/nfs/dbraw/zinc/48/79/34/882487934.db2.gz	ZWODWSRBAVVAKU-CYBMUJFWSA-N	1	1	308.334	1.897	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3cccc([N+](=O)[O-])c3N)[C@@H]2C1	ZINC001305873762	871307459	/nfs/dbraw/zinc/30/74/59/871307459.db2.gz	KQCIQNDXWBBDPU-MVWJERBFSA-N	1	1	304.350	1.247	20	5		DDBDMO
CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1C[C@@H](C)[N@@H+](CC)C[C@@H]1C	ZINC001340877176	871404482	/nfs/dbraw/zinc/40/44/82/871404482.db2.gz	CRXZWLLICMCJAS-GRYCIOLGSA-N	1	1	310.402	1.555	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001308109349	871473330	/nfs/dbraw/zinc/47/33/30/871473330.db2.gz	VMMLXNVERUDWHG-HIFRSBDPSA-N	1	1	321.377	1.428	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)[C@H]1C[N@H+](C)CCN1C	ZINC001308948985	871537951	/nfs/dbraw/zinc/53/79/51/871537951.db2.gz	UWLVGWGTOVMINN-WMLDXEAASA-N	1	1	320.437	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CN[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001308948985	871537965	/nfs/dbraw/zinc/53/79/65/871537965.db2.gz	UWLVGWGTOVMINN-WMLDXEAASA-N	1	1	320.437	1.936	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC001347267441	874077837	/nfs/dbraw/zinc/07/78/37/874077837.db2.gz	BCIJFOHTMSXORT-ZDUSSCGKSA-N	1	1	306.366	1.334	20	5		DDBDMO
O=[N+]([O-])c1cnc(OC2CC[NH+](CCF)CC2)c2[nH]cnc21	ZINC001227692775	883136351	/nfs/dbraw/zinc/13/63/51/883136351.db2.gz	CUTCDSXRACBXLV-UHFFFAOYSA-N	1	1	309.301	1.679	20	5		DDBDMO
CC(C)[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1nc[nH]c(=O)c1[N+](=O)[O-])C2	ZINC001228140096	883359863	/nfs/dbraw/zinc/35/98/63/883359863.db2.gz	FXZZVGWZXFUSFN-URLYPYJESA-N	1	1	308.338	1.873	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@@H+]3C)n1	ZINC001234879532	888236191	/nfs/dbraw/zinc/23/61/91/888236191.db2.gz	QHOJMNAAGIZIAZ-AXTRIDKLSA-N	1	1	307.306	1.181	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(O[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)n1	ZINC001234879532	888236203	/nfs/dbraw/zinc/23/62/03/888236203.db2.gz	QHOJMNAAGIZIAZ-AXTRIDKLSA-N	1	1	307.306	1.181	20	5		DDBDMO
N[C@@]12CC[C@@H]1C[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865055	892953981	/nfs/dbraw/zinc/95/39/81/892953981.db2.gz	XVZNMKRVJWRGNR-CXAGYDPISA-N	1	1	316.405	1.987	20	5		DDBDMO
N[C@@]12CC[C@@H]1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865055	892953994	/nfs/dbraw/zinc/95/39/94/892953994.db2.gz	XVZNMKRVJWRGNR-CXAGYDPISA-N	1	1	316.405	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3C[C@@H](O)[C@@H](F)C3)CC2)cc1	ZINC001254473526	896456373	/nfs/dbraw/zinc/45/63/73/896456373.db2.gz	DOHGIKWDIXTXBH-LSDHHAIUSA-N	1	1	309.341	1.578	20	5		DDBDMO
COC(=O)[C@@]1(F)CC[N@@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596396	896520294	/nfs/dbraw/zinc/52/02/94/896520294.db2.gz	CXYQEQFQJWGSPV-UKRRQHHQSA-N	1	1	308.309	1.649	20	5		DDBDMO
COC(=O)[C@@]1(F)CC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254596396	896520301	/nfs/dbraw/zinc/52/03/01/896520301.db2.gz	CXYQEQFQJWGSPV-UKRRQHHQSA-N	1	1	308.309	1.649	20	5		DDBDMO
CC[N@H+]1CCN(c2nnc([C@@H](C)[N+](=O)[O-])n2CC(C)C)C[C@@H]1C	ZINC001263415597	900605030	/nfs/dbraw/zinc/60/50/30/900605030.db2.gz	HFMFGEIQCCKOEG-QWHCGFSZSA-N	1	1	324.429	1.802	20	5		DDBDMO
Cc1cc(C[N@@H+](C)CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])sn1	ZINC001265843348	902478750	/nfs/dbraw/zinc/47/87/50/902478750.db2.gz	ZJEIODMFQQQVBK-VXGBXAGGSA-N	1	1	312.395	1.055	20	5		DDBDMO
CC(C)(O)[C@H]1CCC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000248438513	282083078	/nfs/dbraw/zinc/08/30/78/282083078.db2.gz	BXARNSSQBODSOK-IUODEOHRSA-N	1	1	324.377	1.570	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000249264673	282139651	/nfs/dbraw/zinc/13/96/51/282139651.db2.gz	IIKUBCRXERDDMB-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000249264673	282139656	/nfs/dbraw/zinc/13/96/56/282139656.db2.gz	IIKUBCRXERDDMB-RISCZKNCSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000249264669	282139710	/nfs/dbraw/zinc/13/97/10/282139710.db2.gz	IIKUBCRXERDDMB-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H](CO)O1	ZINC000249264669	282139715	/nfs/dbraw/zinc/13/97/15/282139715.db2.gz	IIKUBCRXERDDMB-FZMZJTMJSA-N	1	1	323.349	1.005	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000444272740	529465270	/nfs/dbraw/zinc/46/52/70/529465270.db2.gz	YXKIKJUWEHJHEG-SNVBAGLBSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000444272740	529465273	/nfs/dbraw/zinc/46/52/73/529465273.db2.gz	YXKIKJUWEHJHEG-SNVBAGLBSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000444272740	529465275	/nfs/dbraw/zinc/46/52/75/529465275.db2.gz	YXKIKJUWEHJHEG-SNVBAGLBSA-N	1	1	307.354	1.189	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Nc3ccncc3[N+](=O)[O-])[C@@H]2C1	ZINC000272768232	210171882	/nfs/dbraw/zinc/17/18/82/210171882.db2.gz	WYWNPNRHLXLBQG-ZWNOBZJWSA-N	1	1	305.338	1.548	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3nc4sccn4c3[N+](=O)[O-])[C@H]2C1	ZINC000272209566	282317249	/nfs/dbraw/zinc/31/72/49/282317249.db2.gz	PXRNYWMHVZGYGQ-UWVGGRQHSA-N	1	1	307.379	1.834	20	5		DDBDMO
Cn1cncc1CC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000459379237	233145249	/nfs/dbraw/zinc/14/52/49/233145249.db2.gz	PDLGEGNAELSWTK-LBPRGKRZSA-N	1	1	316.365	1.452	20	5		DDBDMO
C[C@@H]1CSCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181902554	186216665	/nfs/dbraw/zinc/21/66/65/186216665.db2.gz	PZPFXNFINAYNEN-NEPJUHHUSA-N	1	1	312.391	1.772	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCO[C@@H](C)C1	ZINC000026342642	352207992	/nfs/dbraw/zinc/20/79/92/352207992.db2.gz	SNQDMJHBKJWJPA-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@H](C)C1	ZINC000026342642	352207996	/nfs/dbraw/zinc/20/79/96/352207996.db2.gz	SNQDMJHBKJWJPA-LBPRGKRZSA-N	1	1	307.350	1.953	20	5		DDBDMO
C[N@@H+]1CCc2[nH]c(=NC(=O)c3csc([N+](=O)[O-])c3)sc2C1	ZINC000044904632	352396858	/nfs/dbraw/zinc/39/68/58/352396858.db2.gz	IAIICSNIQRFTAI-UHFFFAOYSA-N	1	1	324.387	1.775	20	5		DDBDMO
C[N@H+]1CCc2[nH]c(=NC(=O)c3csc([N+](=O)[O-])c3)sc2C1	ZINC000044904632	352396861	/nfs/dbraw/zinc/39/68/61/352396861.db2.gz	IAIICSNIQRFTAI-UHFFFAOYSA-N	1	1	324.387	1.775	20	5		DDBDMO
COc1cc(N2CCC([N@@H+](C)CCCO)CC2)ccc1[N+](=O)[O-]	ZINC000172760586	198146242	/nfs/dbraw/zinc/14/62/42/198146242.db2.gz	KUEMXMZOSHRSBJ-UHFFFAOYSA-N	1	1	323.393	1.886	20	5		DDBDMO
CCC[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC(=O)N(C)C	ZINC000056510402	352776403	/nfs/dbraw/zinc/77/64/03/352776403.db2.gz	RSGZNGVCOOKSFB-UHFFFAOYSA-N	1	1	309.366	1.774	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](C)Cn1cc[nH+]c1C	ZINC000066048436	352975591	/nfs/dbraw/zinc/97/55/91/352975591.db2.gz	OZOPUBBWRUZTAQ-JTQLQIEISA-N	1	1	320.353	1.057	20	5		DDBDMO
C[C@@H](O)CC[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000072713780	353210696	/nfs/dbraw/zinc/21/06/96/353210696.db2.gz	HHDYVPXUJRPYAC-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000072713780	353210698	/nfs/dbraw/zinc/21/06/98/353210698.db2.gz	HHDYVPXUJRPYAC-SECBINFHSA-N	1	1	315.757	1.889	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000174288533	198315207	/nfs/dbraw/zinc/31/52/07/198315207.db2.gz	NNIFFYSRNKUJNV-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)cc([N+](=O)[O-])c1	ZINC000174288533	198315209	/nfs/dbraw/zinc/31/52/09/198315209.db2.gz	NNIFFYSRNKUJNV-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000174329853	198319759	/nfs/dbraw/zinc/31/97/59/198319759.db2.gz	UMHLTFHMGWLTJB-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)cc1[N+](=O)[O-]	ZINC000174329853	198319761	/nfs/dbraw/zinc/31/97/61/198319761.db2.gz	UMHLTFHMGWLTJB-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000174334652	198321518	/nfs/dbraw/zinc/32/15/18/198321518.db2.gz	SNABEVJSJGQKDA-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](C[C@@H](C)O)[C@@H](C)C1	ZINC000174334652	198321519	/nfs/dbraw/zinc/32/15/19/198321519.db2.gz	SNABEVJSJGQKDA-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
CN(C)C(=O)C[NH+]1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000079082814	353549524	/nfs/dbraw/zinc/54/95/24/353549524.db2.gz	NGYMLHPJEPHNQS-UHFFFAOYSA-N	1	1	324.356	1.698	20	5		DDBDMO
Cc1cc(NC[C@@H]2C[N@@H+]3CCCC[C@@H]3CO2)ncc1[N+](=O)[O-]	ZINC000090146572	353791436	/nfs/dbraw/zinc/79/14/36/353791436.db2.gz	FUZISWZFDOCUMR-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(NC[C@@H]2C[N@H+]3CCCC[C@@H]3CO2)ncc1[N+](=O)[O-]	ZINC000090146572	353791438	/nfs/dbraw/zinc/79/14/38/353791438.db2.gz	FUZISWZFDOCUMR-CHWSQXEVSA-N	1	1	306.366	1.963	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](CCO)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000492817800	234604439	/nfs/dbraw/zinc/60/44/39/234604439.db2.gz	LLNQYFOMDZVNNI-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1OC	ZINC000142976649	354146678	/nfs/dbraw/zinc/14/66/78/354146678.db2.gz	DGZGOHQYWOZCRA-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+](CCO)CC2CC2)c1	ZINC000143218682	354148532	/nfs/dbraw/zinc/14/85/32/354148532.db2.gz	MAVGZPRZFQLEOU-AWEZNQCLSA-N	1	1	310.350	1.039	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000144479293	354154276	/nfs/dbraw/zinc/15/42/76/354154276.db2.gz	UMISSTUGGPNSCQ-LLVKDONJSA-N	1	1	305.334	1.327	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000587528830	354883585	/nfs/dbraw/zinc/88/35/85/354883585.db2.gz	ZFSVRVLCWOZBNM-NSHDSACASA-N	1	1	308.382	1.812	20	5		DDBDMO
CCOc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590045423	355043577	/nfs/dbraw/zinc/04/35/77/355043577.db2.gz	RZCDKFQHFUJLNX-JSGCOSHPSA-N	1	1	319.361	1.770	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000332520334	235056376	/nfs/dbraw/zinc/05/63/76/235056376.db2.gz	LWANRKTYVLBFAF-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)cccc1[N+](=O)[O-]	ZINC000332520334	235056381	/nfs/dbraw/zinc/05/63/81/235056381.db2.gz	LWANRKTYVLBFAF-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
CN1C(=O)NCC12CC[NH+](Cc1csc([N+](=O)[O-])c1)CC2	ZINC000591839057	355393854	/nfs/dbraw/zinc/39/38/54/355393854.db2.gz	MNIPBZPARCFWCF-UHFFFAOYSA-N	1	1	310.379	1.646	20	5		DDBDMO
C[C@@H]1CC2(C[N@H+]1C[C@H](O)Cn1cc([N+](=O)[O-])cn1)CCOCC2	ZINC000592183077	355527929	/nfs/dbraw/zinc/52/79/29/355527929.db2.gz	QZAUSFSTTUEVCZ-OCCSQVGLSA-N	1	1	324.381	1.043	20	5		DDBDMO
CCCN(C(=O)c1[nH]nc(CC)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592830451	355706122	/nfs/dbraw/zinc/70/61/22/355706122.db2.gz	FEGSWKWHMNSGHK-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(CC)c1[N+](=O)[O-])[C@H]1CC[N@H+](C)C1	ZINC000592830451	355706123	/nfs/dbraw/zinc/70/61/23/355706123.db2.gz	FEGSWKWHMNSGHK-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCN(C(=O)c1n[nH]c(CC)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000592830451	355706126	/nfs/dbraw/zinc/70/61/26/355706126.db2.gz	FEGSWKWHMNSGHK-JTQLQIEISA-N	1	1	309.370	1.437	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C(N)=O)C(C)(C)C)c1	ZINC000593017588	355771035	/nfs/dbraw/zinc/77/10/35/355771035.db2.gz	IEWWALVDLJTHJT-GFCCVEGCSA-N	1	1	323.349	1.371	20	5		DDBDMO
COC[C@H]1C[C@@H](O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000593066361	355785771	/nfs/dbraw/zinc/78/57/71/355785771.db2.gz	MMBVZCKYSCOZFC-ZIAGYGMSSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C[N@H+]1C	ZINC000593187838	355821303	/nfs/dbraw/zinc/82/13/03/355821303.db2.gz	USWHIQWUFBGJCU-TUAOUCFPSA-N	1	1	309.370	1.121	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[N@@H+]2CCOC[C@H]2C1	ZINC000593469043	355895286	/nfs/dbraw/zinc/89/52/86/355895286.db2.gz	VCCAUWPCPOCVPW-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)nccc2N1CC[N@H+]2CCOC[C@H]2C1	ZINC000593469043	355895290	/nfs/dbraw/zinc/89/52/90/355895290.db2.gz	VCCAUWPCPOCVPW-CYBMUJFWSA-N	1	1	314.345	1.664	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])cnc1N[C@@H]1CCC[N@H+]2CCCC[C@H]12	ZINC000594600566	356261316	/nfs/dbraw/zinc/26/13/16/356261316.db2.gz	MFEFLQSWRUFQBP-CHWSQXEVSA-N	1	1	319.365	1.518	20	5		DDBDMO
CC(C)Oc1nc(N2CC[NH+](C[C@@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000594548772	356247819	/nfs/dbraw/zinc/24/78/19/356247819.db2.gz	CRNJSSQLLXJVRS-GFCCVEGCSA-N	1	1	324.381	1.280	20	5		DDBDMO
C[C@@H]1CC[C@H]([NH2+]Cc2csc([N+](=O)[O-])c2)CS1(=O)=O	ZINC000594973894	356366853	/nfs/dbraw/zinc/36/68/53/356366853.db2.gz	GGCMOLCDQFDRBM-SCZZXKLOSA-N	1	1	304.393	1.712	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595327869	356451182	/nfs/dbraw/zinc/45/11/82/356451182.db2.gz	VJAMMJXPDBPUTI-GFCCVEGCSA-N	1	1	310.354	1.188	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H]2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000595327869	356451187	/nfs/dbraw/zinc/45/11/87/356451187.db2.gz	VJAMMJXPDBPUTI-GFCCVEGCSA-N	1	1	310.354	1.188	20	5		DDBDMO
Cc1noc(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)c1[N+](=O)[O-]	ZINC000595339544	356455000	/nfs/dbraw/zinc/45/50/00/356455000.db2.gz	YHLPEDCALJQYKN-LLVKDONJSA-N	1	1	305.338	1.689	20	5		DDBDMO
CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1onc(C)c1[N+](=O)[O-]	ZINC000595485257	356512118	/nfs/dbraw/zinc/51/21/18/356512118.db2.gz	WWIQJBXZWJOXLD-LLVKDONJSA-N	1	1	310.354	1.772	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@@H](O)CN(C)CCc1ccccc1[N+](=O)[O-]	ZINC000595484440	356512815	/nfs/dbraw/zinc/51/28/15/356512815.db2.gz	LCKAYEZTTVMDEM-HNNXBMFYSA-N	1	1	309.410	1.770	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000595473632	356507292	/nfs/dbraw/zinc/50/72/92/356507292.db2.gz	YMXSCOGSGWTFJE-CYBMUJFWSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)c1[N+](=O)[O-]	ZINC000595473632	356507297	/nfs/dbraw/zinc/50/72/97/356507297.db2.gz	YMXSCOGSGWTFJE-CYBMUJFWSA-N	1	1	324.381	1.578	20	5		DDBDMO
Cc1noc(CN2CC[N@@H+](C3CCOCC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000595480450	356510614	/nfs/dbraw/zinc/51/06/14/356510614.db2.gz	KMVALUJLMYWVBN-NSHDSACASA-N	1	1	324.381	1.576	20	5		DDBDMO
O=C1C[C@@H](C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CN1	ZINC000595521972	356532312	/nfs/dbraw/zinc/53/23/12/356532312.db2.gz	HHNSATOMPDZWQN-TZMCWYRMSA-N	1	1	303.362	1.910	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1CCO	ZINC000595695906	356612350	/nfs/dbraw/zinc/61/23/50/356612350.db2.gz	JBFUFRFUZJUKGA-RISCZKNCSA-N	1	1	321.377	1.677	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2COC[C@@]2(C)C1	ZINC000595755407	356637140	/nfs/dbraw/zinc/63/71/40/356637140.db2.gz	ADXYPANMRDXJOW-XHBSWPGZSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595871948	356686716	/nfs/dbraw/zinc/68/67/16/356686716.db2.gz	IXWCYTFQLSDQEG-MEBBXXQBSA-N	1	1	307.350	1.144	20	5		DDBDMO
CC[N@H+]1CCCN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1	ZINC000618279326	363562011	/nfs/dbraw/zinc/56/20/11/363562011.db2.gz	UJLHZAAOFNQXHT-UHFFFAOYSA-N	1	1	303.366	1.999	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596121321	356780926	/nfs/dbraw/zinc/78/09/26/356780926.db2.gz	VOWBIKGRCJTAPC-LBPRGKRZSA-N	1	1	306.366	1.980	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596151942	356792647	/nfs/dbraw/zinc/79/26/47/356792647.db2.gz	MYSZBNFUPDOZAV-GWCFXTLKSA-N	1	1	306.366	1.470	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC[C@@H]([NH+]2CCOCC2)C1	ZINC000596246846	356831192	/nfs/dbraw/zinc/83/11/92/356831192.db2.gz	ILCPEOZZJREQFE-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
COc1cc(C[N@@H+]2CCC3(COC3)C2)c([N+](=O)[O-])cc1OC	ZINC000597228165	357102722	/nfs/dbraw/zinc/10/27/22/357102722.db2.gz	ALXIWTHGPJLQON-UHFFFAOYSA-N	1	1	308.334	1.834	20	5		DDBDMO
COc1cc(C[N@H+]2CCC3(COC3)C2)c([N+](=O)[O-])cc1OC	ZINC000597228165	357102726	/nfs/dbraw/zinc/10/27/26/357102726.db2.gz	ALXIWTHGPJLQON-UHFFFAOYSA-N	1	1	308.334	1.834	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000598342332	357545122	/nfs/dbraw/zinc/54/51/22/357545122.db2.gz	MDOCILWLKDQCNA-LLVKDONJSA-N	1	1	309.370	1.127	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+]1Cc1ccccc1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598511913	357610466	/nfs/dbraw/zinc/61/04/66/357610466.db2.gz	UTWMPRFRLZQWBD-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1Cc1ccccc1)c1[nH]ncc1[N+](=O)[O-]	ZINC000598511913	357610470	/nfs/dbraw/zinc/61/04/70/357610470.db2.gz	UTWMPRFRLZQWBD-LBPRGKRZSA-N	1	1	315.333	1.322	20	5		DDBDMO
COC(=O)[C@@]1(OC)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000599568172	357976919	/nfs/dbraw/zinc/97/69/19/357976919.db2.gz	QVEWEMFEVDZEMP-XHDPSFHLSA-N	1	1	308.334	1.920	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)COC1	ZINC000599571623	357978983	/nfs/dbraw/zinc/97/89/83/357978983.db2.gz	OAGMOXKFALISAH-LBPRGKRZSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)C[C@H]1C[C@@H](O)C1	ZINC000599671894	358018746	/nfs/dbraw/zinc/01/87/46/358018746.db2.gz	KIZSHVWGALSCCO-YUTCNCBUSA-N	1	1	310.350	1.037	20	5		DDBDMO
CCC(O)(CC)C[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000599674048	358019629	/nfs/dbraw/zinc/01/96/29/358019629.db2.gz	ZVBKDZUYMSRBLD-UHFFFAOYSA-N	1	1	309.366	1.677	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000180545306	199174630	/nfs/dbraw/zinc/17/46/30/199174630.db2.gz	WQRUBPNGLYTCSS-WDEREUQCSA-N	1	1	321.381	1.422	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OC	ZINC000180860905	199220040	/nfs/dbraw/zinc/22/00/40/199220040.db2.gz	RFYHUUHNTCHBKA-QWRGUYRKSA-N	1	1	310.350	1.815	20	5		DDBDMO
C[C@H]1CO[C@H](CO)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601131508	358415610	/nfs/dbraw/zinc/41/56/10/358415610.db2.gz	ZMDDOVADHKCTCQ-JQWIXIFHSA-N	1	1	303.318	1.729	20	5		DDBDMO
CCN(C)C(=O)[C@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601153517	358424159	/nfs/dbraw/zinc/42/41/59/358424159.db2.gz	YTZSFHSIKZECCO-JTQLQIEISA-N	1	1	302.334	1.844	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CCC[C@](O)(CO)C3)c2c1	ZINC000601173788	358433175	/nfs/dbraw/zinc/43/31/75/358433175.db2.gz	HJDJZZQPMNDLCJ-OAHLLOKOSA-N	1	1	303.318	1.467	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N[C@](C)(CO)c1cccc([N+](=O)[O-])c1	ZINC000601777817	358691404	/nfs/dbraw/zinc/69/14/04/358691404.db2.gz	LMZMPZYIYWHGGL-UKRRQHHQSA-N	1	1	307.350	1.013	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@H](C(F)F)CC1	ZINC000601973721	358761078	/nfs/dbraw/zinc/76/10/78/358761078.db2.gz	JEGJAQTVKIUKNW-JTQLQIEISA-N	1	1	304.297	1.456	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@H](C(F)F)CC1	ZINC000601973721	358761081	/nfs/dbraw/zinc/76/10/81/358761081.db2.gz	JEGJAQTVKIUKNW-JTQLQIEISA-N	1	1	304.297	1.456	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974806	358761303	/nfs/dbraw/zinc/76/13/03/358761303.db2.gz	QWVNMJDSMURPLI-TXEJJXNPSA-N	1	1	305.334	1.420	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601974806	358761306	/nfs/dbraw/zinc/76/13/06/358761306.db2.gz	QWVNMJDSMURPLI-TXEJJXNPSA-N	1	1	305.334	1.420	20	5		DDBDMO
COCC[N@@H+]1CC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000602545510	359037534	/nfs/dbraw/zinc/03/75/34/359037534.db2.gz	DOGLWDAISKYDCI-NSHDSACASA-N	1	1	320.349	1.546	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NCc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000602545510	359037538	/nfs/dbraw/zinc/03/75/38/359037538.db2.gz	DOGLWDAISKYDCI-NSHDSACASA-N	1	1	320.349	1.546	20	5		DDBDMO
Cn1cc(C[NH+]2CCC(OC[C@@H]3CCOC3)CC2)c([N+](=O)[O-])n1	ZINC000602604892	359067718	/nfs/dbraw/zinc/06/77/18/359067718.db2.gz	QNGBROMAIRYKDD-GFCCVEGCSA-N	1	1	324.381	1.346	20	5		DDBDMO
CCN(CC)C(=O)[C@H]1CCC[N@H+]1CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602770036	359177598	/nfs/dbraw/zinc/17/75/98/359177598.db2.gz	SRYOTZMEKIPJKB-CYBMUJFWSA-N	1	1	323.397	1.433	20	5		DDBDMO
C[N@H+]1CCN(CCn2cc([N+](=O)[O-])ccc2=O)C[C@H]1C(C)(C)C	ZINC000602873789	359257233	/nfs/dbraw/zinc/25/72/33/359257233.db2.gz	LICVFUASNVVYBI-AWEZNQCLSA-N	1	1	322.409	1.419	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)C[C@H]2CO)c1	ZINC000602930989	359300891	/nfs/dbraw/zinc/30/08/91/359300891.db2.gz	QHNPWBBGMVDCIT-RISCZKNCSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](C)C[C@H]2CO)c1	ZINC000602930989	359300896	/nfs/dbraw/zinc/30/08/96/359300896.db2.gz	QHNPWBBGMVDCIT-RISCZKNCSA-N	1	1	322.361	1.974	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3cccc(F)c3)CC2)n1	ZINC000603014856	359358218	/nfs/dbraw/zinc/35/82/18/359358218.db2.gz	NFQFIYVDCLDNCV-UHFFFAOYSA-N	1	1	319.340	1.753	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@@H+](CC)[C@@H](C)C2)n1	ZINC000603146420	359435197	/nfs/dbraw/zinc/43/51/97/359435197.db2.gz	UEVHZCVVQRGHAX-PHIMTYICSA-N	1	1	309.370	1.366	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2C[C@@H](C)[N@H+](CC)[C@@H](C)C2)n1	ZINC000603146420	359435202	/nfs/dbraw/zinc/43/52/02/359435202.db2.gz	UEVHZCVVQRGHAX-PHIMTYICSA-N	1	1	309.370	1.366	20	5		DDBDMO
C[C@@H](CNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[N@H+]1CCC[C@H](C)C1	ZINC000186935577	200034420	/nfs/dbraw/zinc/03/44/20/200034420.db2.gz	OYBWMSRIWBFEHZ-QWRGUYRKSA-N	1	1	322.365	1.546	20	5		DDBDMO
COc1cc(OCC(=O)N[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000604460833	359752563	/nfs/dbraw/zinc/75/25/63/359752563.db2.gz	BJGBKDWZTXLCMQ-NSHDSACASA-N	1	1	323.349	1.193	20	5		DDBDMO
C[C@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@@H]1C[N@H+](C)CCO1	ZINC000618588306	363684099	/nfs/dbraw/zinc/68/40/99/363684099.db2.gz	XCBNDNGXHGCPRH-ZANVPECISA-N	1	1	305.338	1.024	20	5		DDBDMO
C[C@H](N=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)[C@@H]1C[N@@H+](C)CCO1	ZINC000618588306	363684102	/nfs/dbraw/zinc/68/41/02/363684102.db2.gz	XCBNDNGXHGCPRH-ZANVPECISA-N	1	1	305.338	1.024	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000609268827	360285229	/nfs/dbraw/zinc/28/52/29/360285229.db2.gz	DMCZXQSFKTUQII-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[C@@H](O)C1CC[NH+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1	ZINC000611268106	360683796	/nfs/dbraw/zinc/68/37/96/360683796.db2.gz	LZQWOKGNIMBGSW-LLVKDONJSA-N	1	1	322.361	1.959	20	5		DDBDMO
Cc1nn(C[C@@H](O)C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-]	ZINC000611508421	360740701	/nfs/dbraw/zinc/74/07/01/360740701.db2.gz	FYQBMAJBLHZOSG-AWEZNQCLSA-N	1	1	304.350	1.593	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@]2(C1)NC(=O)NC2=O	ZINC000193474668	201056659	/nfs/dbraw/zinc/05/66/59/201056659.db2.gz	FTCVCYRWSUSMEW-HNNXBMFYSA-N	1	1	318.333	1.077	20	5		DDBDMO
O=C(C[N@H+]1CCC[C@H](O)CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000293104437	223397639	/nfs/dbraw/zinc/39/76/39/223397639.db2.gz	LGYUMQQDLOLVQJ-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCC[C@H](O)CC1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000293104437	223397640	/nfs/dbraw/zinc/39/76/40/223397640.db2.gz	LGYUMQQDLOLVQJ-AWEZNQCLSA-N	1	1	319.361	1.331	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC(CC[NH2+]C)CC2)c1[N+](=O)[O-]	ZINC000262155701	203214732	/nfs/dbraw/zinc/21/47/32/203214732.db2.gz	ZJAIBUZBWARJMC-UHFFFAOYSA-N	1	1	323.397	1.732	20	5		DDBDMO
CN(C)C(=O)NCC[N@@H+](C)C/C=C/c1ccccc1[N+](=O)[O-]	ZINC000350049648	284138108	/nfs/dbraw/zinc/13/81/08/284138108.db2.gz	QLSJTQUSYRYXPU-SOFGYWHQSA-N	1	1	306.366	1.811	20	5		DDBDMO
Cn1nccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534638	193266215	/nfs/dbraw/zinc/26/62/15/193266215.db2.gz	JSQHMWIUQHYHNI-LLVKDONJSA-N	1	1	302.338	1.410	20	5		DDBDMO
Cn1nccc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534638	193266218	/nfs/dbraw/zinc/26/62/18/193266218.db2.gz	JSQHMWIUQHYHNI-LLVKDONJSA-N	1	1	302.338	1.410	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000264588536	204012907	/nfs/dbraw/zinc/01/29/07/204012907.db2.gz	AGBALUIXPMZWEF-UHFFFAOYSA-N	1	1	307.350	1.771	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000274880640	212004604	/nfs/dbraw/zinc/00/46/04/212004604.db2.gz	IHIYNZCBZHDCGN-JTQLQIEISA-N	1	1	308.338	1.300	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(=O)c(O)co1	ZINC000282542285	217075116	/nfs/dbraw/zinc/07/51/16/217075116.db2.gz	WDHIAVXDRFNVJC-UHFFFAOYSA-N	1	1	304.302	1.928	20	5		DDBDMO
C[C@@H](CO)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000282732798	217210109	/nfs/dbraw/zinc/21/01/09/217210109.db2.gz	IOQTTZRMKMIPQD-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@@H](CO)[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000282732798	217210111	/nfs/dbraw/zinc/21/01/11/217210111.db2.gz	IOQTTZRMKMIPQD-QMMMGPOBSA-N	1	1	301.730	1.499	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000266117248	205111061	/nfs/dbraw/zinc/11/10/61/205111061.db2.gz	VJNCYNJWCOXLAV-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
C[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)[C@@H]1CCc2ccccc21	ZINC000266419201	205333432	/nfs/dbraw/zinc/33/34/32/205333432.db2.gz	IKDZKBBSJWMWAF-GOEBONIOSA-N	1	1	316.361	1.772	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288454411	220152172	/nfs/dbraw/zinc/15/21/72/220152172.db2.gz	NYUSAFHNXIGABO-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
Cc1c(Cl)cc(S(=O)(=O)N2CC[NH2+]CC2)cc1[N+](=O)[O-]	ZINC000021010339	182260116	/nfs/dbraw/zinc/26/01/16/182260116.db2.gz	RUIRQTMAKKFRRN-UHFFFAOYSA-N	1	1	319.770	1.151	20	5		DDBDMO
Cc1ccc(NCCCNC(=O)c2ccc([N+](=O)[O-])[nH]2)[nH+]c1	ZINC000267893677	206323523	/nfs/dbraw/zinc/32/35/23/206323523.db2.gz	VHLLDBYUIZOIGC-UHFFFAOYSA-N	1	1	303.322	1.858	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000102488857	248243785	/nfs/dbraw/zinc/24/37/85/248243785.db2.gz	JBLOXCFUHJLBRM-CYBMUJFWSA-N	1	1	323.397	1.256	20	5		DDBDMO
CN(C[C@H]1CC[N@@H+](C)C1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000104747408	194033633	/nfs/dbraw/zinc/03/36/33/194033633.db2.gz	UXYNTEYXEOSPTL-NSHDSACASA-N	1	1	313.379	1.167	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NC[C@@H](C)C[NH+]2CCOCC2)c1	ZINC000338671547	250084072	/nfs/dbraw/zinc/08/40/72/250084072.db2.gz	GEYOJYZYKRYSKV-GFCCVEGCSA-N	1	1	309.366	1.984	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000339136977	250309780	/nfs/dbraw/zinc/30/97/80/250309780.db2.gz	NVMKYTOOKRRBMK-GFCCVEGCSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000106394837	194205893	/nfs/dbraw/zinc/20/58/93/194205893.db2.gz	XBYINHISQRDQHW-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[NH+](CC(C)(C)O)CC1	ZINC000106399646	194207364	/nfs/dbraw/zinc/20/73/64/194207364.db2.gz	OBHOUASCBSUBMZ-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cn1nccc1C1=CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000285222049	218339529	/nfs/dbraw/zinc/33/95/29/218339529.db2.gz	ANWHELCVYBZAIP-UHFFFAOYSA-N	1	1	302.338	1.314	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285275867	218362564	/nfs/dbraw/zinc/36/25/64/218362564.db2.gz	IZERAXCPRRCZLS-HNNXBMFYSA-N	1	1	310.350	1.383	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000063812530	184289012	/nfs/dbraw/zinc/28/90/12/184289012.db2.gz	YXKMTMHHGIWMSV-JTQLQIEISA-N	1	1	324.356	1.920	20	5		DDBDMO
COCC[NH+]1CCC(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000269188498	207308126	/nfs/dbraw/zinc/30/81/26/207308126.db2.gz	NNESYDCPXCYVKP-UHFFFAOYSA-N	1	1	323.349	1.141	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CCO)CC1CC1	ZINC000352463825	285068251	/nfs/dbraw/zinc/06/82/51/285068251.db2.gz	KZRXAPJTRLGPOD-UHFFFAOYSA-N	1	1	307.350	1.546	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H](C3CC[NH+](C)CC3)C2)c1[N+](=O)[O-]	ZINC000270063298	208120691	/nfs/dbraw/zinc/12/06/91/208120691.db2.gz	FPBBLVHPRAUKEW-LBPRGKRZSA-N	1	1	321.381	1.430	20	5		DDBDMO
C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)(CO)CO	ZINC000270299523	208374933	/nfs/dbraw/zinc/37/49/33/208374933.db2.gz	BHAZYHDAKRLMKN-UHFFFAOYSA-N	1	1	302.758	1.671	20	5		DDBDMO
CNS(=O)(=O)CCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000352549782	285133193	/nfs/dbraw/zinc/13/31/93/285133193.db2.gz	HEFKSOWNRFIJPG-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C2	ZINC000352617610	285176674	/nfs/dbraw/zinc/17/66/74/285176674.db2.gz	GCIIOGMIHHLDDP-OAHLLOKOSA-N	1	1	307.325	1.836	20	5		DDBDMO
O=C1C[C@@]2(CN1)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)C2	ZINC000352617610	285176677	/nfs/dbraw/zinc/17/66/77/285176677.db2.gz	GCIIOGMIHHLDDP-OAHLLOKOSA-N	1	1	307.325	1.836	20	5		DDBDMO
NC(=O)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000157220172	197170842	/nfs/dbraw/zinc/17/08/42/197170842.db2.gz	GZFLZUFREGUDQS-MRVPVSSYSA-N	1	1	315.276	1.503	20	5		DDBDMO
NC(=O)[C@@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1	ZINC000157220172	197170844	/nfs/dbraw/zinc/17/08/44/197170844.db2.gz	GZFLZUFREGUDQS-MRVPVSSYSA-N	1	1	315.276	1.503	20	5		DDBDMO
COCCCOCC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1	ZINC000271546910	209001452	/nfs/dbraw/zinc/00/14/52/209001452.db2.gz	XNPZIGDAVKAZAZ-UHFFFAOYSA-N	1	1	312.366	1.959	20	5		DDBDMO
Cc1nn(CCC(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000155300680	197041950	/nfs/dbraw/zinc/04/19/50/197041950.db2.gz	XEDLJLCVBIWDKA-PHIMTYICSA-N	1	1	323.397	1.349	20	5		DDBDMO
CC(C)NC(=O)CC[N@@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352707525	285243746	/nfs/dbraw/zinc/24/37/46/285243746.db2.gz	SKKVWHRYPNOAPY-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
CC(C)NC(=O)CC[N@H+]1CCOc2ccc([N+](=O)[O-])cc2C1	ZINC000352707525	285243748	/nfs/dbraw/zinc/24/37/48/285243748.db2.gz	SKKVWHRYPNOAPY-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
Cc1cnn([C@@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])ccc3=O)C2)c1	ZINC000289843487	221264782	/nfs/dbraw/zinc/26/47/82/221264782.db2.gz	KFXMEEWSOOKIJT-CYBMUJFWSA-N	1	1	317.349	1.208	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000451578805	533417060	/nfs/dbraw/zinc/41/70/60/533417060.db2.gz	XRDYSKLTIYLPEE-VNHYZAJKSA-N	1	1	324.377	1.691	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950686	533663724	/nfs/dbraw/zinc/66/37/24/533663724.db2.gz	HZBXNAMLXDEURZ-KOLCDFICSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950686	533663731	/nfs/dbraw/zinc/66/37/31/533663731.db2.gz	HZBXNAMLXDEURZ-KOLCDFICSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950686	533663740	/nfs/dbraw/zinc/66/37/40/533663740.db2.gz	HZBXNAMLXDEURZ-KOLCDFICSA-N	1	1	307.354	1.325	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CCCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000331950686	533663744	/nfs/dbraw/zinc/66/37/44/533663744.db2.gz	HZBXNAMLXDEURZ-KOLCDFICSA-N	1	1	307.354	1.325	20	5		DDBDMO
CCN1CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000068127858	406617289	/nfs/dbraw/zinc/61/72/89/406617289.db2.gz	AIRUSCUCCFPZMC-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000068960806	406671956	/nfs/dbraw/zinc/67/19/56/406671956.db2.gz	GOTGOJQGQDLJOB-UHFFFAOYSA-N	1	1	321.786	1.478	20	5		DDBDMO
O=C(NCCC[NH+]1CCCC1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000074449682	406913005	/nfs/dbraw/zinc/91/30/05/406913005.db2.gz	RFGCPNVZLPSUDX-UHFFFAOYSA-N	1	1	317.349	1.687	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000048269165	407093841	/nfs/dbraw/zinc/09/38/41/407093841.db2.gz	RAFBWPXXIWETFP-BETUJISGSA-N	1	1	323.397	1.276	20	5		DDBDMO
COC(=O)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000066832294	407260113	/nfs/dbraw/zinc/26/01/13/407260113.db2.gz	DWCNBGDYVBCNCA-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[NH+](C2CC2)CC1	ZINC000123020748	407316920	/nfs/dbraw/zinc/31/69/20/407316920.db2.gz	XVOYURUXBRYZGF-UHFFFAOYSA-N	1	1	320.349	1.915	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCCC[NH+]1CCOCC1	ZINC000096921122	407275419	/nfs/dbraw/zinc/27/54/19/407275419.db2.gz	KCZLARWHFJWTCJ-DAXSKMNVSA-N	1	1	319.361	1.447	20	5		DDBDMO
Cc1ccc([C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[NH+](C)C)cc1	ZINC000122351745	407298810	/nfs/dbraw/zinc/29/88/10/407298810.db2.gz	CPHJQSSNVJPHGF-LBPRGKRZSA-N	1	1	317.349	1.659	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](Cc2cc([N+](=O)[O-])ccc2OC)C1	ZINC000111268395	407403718	/nfs/dbraw/zinc/40/37/18/407403718.db2.gz	SRIISTRUSFWPRN-NSHDSACASA-N	1	1	307.350	1.561	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000178516307	407478529	/nfs/dbraw/zinc/47/85/29/407478529.db2.gz	LMTDELSNMWZXOZ-LLVKDONJSA-N	1	1	310.354	1.455	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNCc1ccc([N+](=O)[O-])cc1Cl	ZINC000225339431	407579445	/nfs/dbraw/zinc/57/94/45/407579445.db2.gz	YYYRYXHBJOWAGN-ZDUSSCGKSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1ncccc1[N+](=O)[O-]	ZINC000130133645	407655256	/nfs/dbraw/zinc/65/52/56/407655256.db2.gz	BWJOLOUMSXYQIQ-UHFFFAOYSA-N	1	1	308.382	1.784	20	5		DDBDMO
C[N@@H+](CCc1cnccn1)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000271411918	407672923	/nfs/dbraw/zinc/67/29/23/407672923.db2.gz	YZAFYWMULBOCTJ-OAHLLOKOSA-N	1	1	302.334	1.593	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H](C)C[N@H+]2CCC[C@H](C)C2)c1[N+](=O)[O-]	ZINC000171730934	407751801	/nfs/dbraw/zinc/75/18/01/407751801.db2.gz	WAWRXJKWWOFGMD-WDEREUQCSA-N	1	1	323.397	1.731	20	5		DDBDMO
C[C@H]1C[N@@H+](CC(C)(C)O)CCN1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000186934850	407799313	/nfs/dbraw/zinc/79/93/13/407799313.db2.gz	XDMOSLODHHBDPO-LBPRGKRZSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C(N)=O)C1	ZINC000187420974	407855973	/nfs/dbraw/zinc/85/59/73/407855973.db2.gz	SSHADDZWKUMIAL-FZMZJTMJSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H](C(N)=O)C1	ZINC000187420974	407855976	/nfs/dbraw/zinc/85/59/76/407855976.db2.gz	SSHADDZWKUMIAL-FZMZJTMJSA-N	1	1	307.350	1.559	20	5		DDBDMO
CC(C)NC(=O)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000173470821	407882162	/nfs/dbraw/zinc/88/21/62/407882162.db2.gz	XFEOEDCLGOGLQS-GFCCVEGCSA-N	1	1	321.381	1.391	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000181185932	407960897	/nfs/dbraw/zinc/96/08/97/407960897.db2.gz	BESGJGFMPCGNPP-GFCCVEGCSA-N	1	1	320.393	1.885	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272534061	407967563	/nfs/dbraw/zinc/96/75/63/407967563.db2.gz	ISKRCRQNZQATHP-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000272534061	407967570	/nfs/dbraw/zinc/96/75/70/407967570.db2.gz	ISKRCRQNZQATHP-ZYHUDNBSSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@@H+]1C[C@@H](C)O	ZINC000174613039	407969835	/nfs/dbraw/zinc/96/98/35/407969835.db2.gz	XWXODMWXNBECOU-CHWSQXEVSA-N	1	1	321.377	1.512	20	5		DDBDMO
CC[C@@H]1CN(C(=O)c2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000174613039	407969840	/nfs/dbraw/zinc/96/98/40/407969840.db2.gz	XWXODMWXNBECOU-CHWSQXEVSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)COc1cccc([N+](=O)[O-])c1	ZINC000268253002	407970405	/nfs/dbraw/zinc/97/04/05/407970405.db2.gz	XGELCMDOAKECKZ-IAQYHMDHSA-N	1	1	319.361	1.573	20	5		DDBDMO
CN(CC1CC[NH+](C)CC1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272484570	407944658	/nfs/dbraw/zinc/94/46/58/407944658.db2.gz	GLFQJUNRZQCMHM-UHFFFAOYSA-N	1	1	307.350	1.714	20	5		DDBDMO
C[NH+]1CCC(O)(CNCc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000273043224	408032804	/nfs/dbraw/zinc/03/28/04/408032804.db2.gz	FHKPLJCQHNYLMS-UHFFFAOYSA-N	1	1	313.785	1.795	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)C[C@H]1CO	ZINC000245694117	408045377	/nfs/dbraw/zinc/04/53/77/408045377.db2.gz	MFYKRSUJKGYKQX-UONOGXRCSA-N	1	1	310.350	1.310	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@H]1CO	ZINC000245694117	408045384	/nfs/dbraw/zinc/04/53/84/408045384.db2.gz	MFYKRSUJKGYKQX-UONOGXRCSA-N	1	1	310.350	1.310	20	5		DDBDMO
CCOC(=O)[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000136805962	408125113	/nfs/dbraw/zinc/12/51/13/408125113.db2.gz	UIODTKGWPISSPQ-HIFRSBDPSA-N	1	1	322.361	1.903	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182207062	408092266	/nfs/dbraw/zinc/09/22/66/408092266.db2.gz	NVWLNCNRYMMPAR-AGIUHOORSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1CO[C@@H](C)C[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182207062	408092270	/nfs/dbraw/zinc/09/22/70/408092270.db2.gz	NVWLNCNRYMMPAR-AGIUHOORSA-N	1	1	310.350	1.444	20	5		DDBDMO
Nc1ccc(N2CCN(c3ncc([N+](=O)[O-])s3)CC2)c[nH+]1	ZINC000190322405	408219130	/nfs/dbraw/zinc/21/91/30/408219130.db2.gz	HUNXGOQNWSGSQV-UHFFFAOYSA-N	1	1	306.351	1.355	20	5		DDBDMO
CC1(C)[C@@H]2C[N@H+](C[C@@H](O)COc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000246728753	408328757	/nfs/dbraw/zinc/32/87/57/408328757.db2.gz	LZVXWYKLBXHBOK-YUELXQCFSA-N	1	1	306.362	1.922	20	5		DDBDMO
CC(C)C[NH+]1CCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000269372109	408286582	/nfs/dbraw/zinc/28/65/82/408286582.db2.gz	MOYOPJAGJIUCAN-UHFFFAOYSA-N	1	1	323.397	1.855	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000269406729	408295687	/nfs/dbraw/zinc/29/56/87/408295687.db2.gz	UPQBLPBJSMJJBC-JTQLQIEISA-N	1	1	321.381	1.655	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+]2CC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183221005	408358013	/nfs/dbraw/zinc/35/80/13/408358013.db2.gz	RSAYSIBWSYZCBR-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+]2CC[C@@H]([C@@H](C)O)C2)c([N+](=O)[O-])c1	ZINC000183221005	408358021	/nfs/dbraw/zinc/35/80/21/408358021.db2.gz	RSAYSIBWSYZCBR-GHMZBOCLSA-N	1	1	323.349	1.245	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](CC(C)(C)O)CC1	ZINC000172156114	162262030	/nfs/dbraw/zinc/26/20/30/162262030.db2.gz	SAJIRDVHMFZYDU-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H](OCCO)C1	ZINC000172300060	162269338	/nfs/dbraw/zinc/26/93/38/162269338.db2.gz	NBQZMTASQYSEOB-ZDUSSCGKSA-N	1	1	310.350	1.447	20	5		DDBDMO
C[N@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H](O)COC1CCOCC1	ZINC000176424389	408362491	/nfs/dbraw/zinc/36/24/91/408362491.db2.gz	DJAGHYGWORLLIB-CQSZACIVSA-N	1	1	324.377	1.583	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000183592288	408448802	/nfs/dbraw/zinc/44/88/02/408448802.db2.gz	RINZVZWMBSSBTM-NSHDSACASA-N	1	1	307.354	1.843	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)Nc3ccncc3[N+](=O)[O-])CC[C@@H]21	ZINC000183612310	408454542	/nfs/dbraw/zinc/45/45/42/408454542.db2.gz	SAYDBMBTINCZTD-YPMHNXCESA-N	1	1	319.365	1.938	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000274495311	408426515	/nfs/dbraw/zinc/42/65/15/408426515.db2.gz	CVKJKETUHILCLW-UHFFFAOYSA-N	1	1	320.349	1.120	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCn2ccc([N+](=O)[O-])n2)ccc1O	ZINC000177049857	408506566	/nfs/dbraw/zinc/50/65/66/408506566.db2.gz	UVDBNELPIPVMEJ-UHFFFAOYSA-N	1	1	306.322	1.638	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H]([C@H](C)O)C1	ZINC000248525013	408582082	/nfs/dbraw/zinc/58/20/82/408582082.db2.gz	CMCIEMWMFLZBEV-WOPDTQHZSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)NCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000270569301	408584185	/nfs/dbraw/zinc/58/41/85/408584185.db2.gz	VASDKLYKMUASMB-UHFFFAOYSA-N	1	1	306.366	1.484	20	5		DDBDMO
COC(=O)[C@]1(C)CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1	ZINC000177470817	408631126	/nfs/dbraw/zinc/63/11/26/408631126.db2.gz	BZCHWPWFIKHAMC-OAHLLOKOSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC[N@H+]1CCCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000265466656	408661257	/nfs/dbraw/zinc/66/12/57/408661257.db2.gz	HFVOEAYYINJYEI-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000193590294	408730981	/nfs/dbraw/zinc/73/09/81/408730981.db2.gz	DKKRQMDZXYVUQJ-JTQLQIEISA-N	1	1	317.349	1.869	20	5		DDBDMO
CN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1=O	ZINC000265650089	408732590	/nfs/dbraw/zinc/73/25/90/408732590.db2.gz	NQUXQIHPOLCOHZ-ZDUSSCGKSA-N	1	1	320.349	1.086	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000185218613	408781631	/nfs/dbraw/zinc/78/16/31/408781631.db2.gz	UENLCTLQARFHPN-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000251665690	408783476	/nfs/dbraw/zinc/78/34/76/408783476.db2.gz	LGRKVBSWWMXUKK-QWRGUYRKSA-N	1	1	322.365	1.546	20	5		DDBDMO
C[C@@H](C[S@](C)=O)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000185105834	408759868	/nfs/dbraw/zinc/75/98/68/408759868.db2.gz	VCVIFEGTUZTYFE-YBTHPKLGSA-N	1	1	300.380	1.672	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2CN(C(=O)c3c[nH]c(=O)c([N+](=O)[O-])c3)CC[C@H]21	ZINC000251496177	408780498	/nfs/dbraw/zinc/78/04/98/408780498.db2.gz	DMBWAIRPECDWNB-ZYHUDNBSSA-N	1	1	320.349	1.252	20	5		DDBDMO
CC(=O)c1ccc(OC[C@H](O)C[N@H+](C)C2CC2)c([N+](=O)[O-])c1	ZINC000290797763	408834784	/nfs/dbraw/zinc/83/47/84/408834784.db2.gz	PDQXNBHHDRBPMK-CYBMUJFWSA-N	1	1	308.334	1.631	20	5		DDBDMO
CC(C)[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCOC1	ZINC000291885413	408939905	/nfs/dbraw/zinc/93/99/05/408939905.db2.gz	QKEMPSZWWFGQGW-ZDUSSCGKSA-N	1	1	307.350	1.693	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)CCC[NH+]2CCCC2)c1[N+](=O)[O-]	ZINC000281853529	408941241	/nfs/dbraw/zinc/94/12/41/408941241.db2.gz	YFCRBINJTOKGQG-UHFFFAOYSA-N	1	1	323.397	1.999	20	5		DDBDMO
[NH3+]CC[C@@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000281965688	408963150	/nfs/dbraw/zinc/96/31/50/408963150.db2.gz	NJPUZKLEHYBWQA-JTQLQIEISA-N	1	1	317.349	1.672	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(c3ncc(C)cc3[N+](=O)[O-])[C@H]2C1	ZINC000292814430	409041989	/nfs/dbraw/zinc/04/19/89/409041989.db2.gz	OIFJRQOEHCUNEI-UONOGXRCSA-N	1	1	306.366	1.598	20	5		DDBDMO
C[C@H](CCCC[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000293530044	409131577	/nfs/dbraw/zinc/13/15/77/409131577.db2.gz	UYFAFFRORYZZSC-SECBINFHSA-N	1	1	305.338	1.718	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000278419419	409083904	/nfs/dbraw/zinc/08/39/04/409083904.db2.gz	OMKHCQBQRAGJBZ-NSHDSACASA-N	1	1	306.366	1.066	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H](C)N(C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000293987991	409221105	/nfs/dbraw/zinc/22/11/05/409221105.db2.gz	NOCMVGYZXRWQDZ-AOOOYVTPSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000293987991	409221108	/nfs/dbraw/zinc/22/11/08/409221108.db2.gz	NOCMVGYZXRWQDZ-AOOOYVTPSA-N	1	1	309.370	1.606	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000293987991	409221112	/nfs/dbraw/zinc/22/11/12/409221112.db2.gz	NOCMVGYZXRWQDZ-AOOOYVTPSA-N	1	1	309.370	1.606	20	5		DDBDMO
NC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCCC1	ZINC000283935894	409242682	/nfs/dbraw/zinc/24/26/82/409242682.db2.gz	CVEJXBSMIXDHTC-UHFFFAOYSA-N	1	1	322.321	1.781	20	5		DDBDMO
C[N@@H+]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000294307628	409275588	/nfs/dbraw/zinc/27/55/88/409275588.db2.gz	JAFZGVJELMYMRL-UHFFFAOYSA-N	1	1	319.361	1.722	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000294307628	409275591	/nfs/dbraw/zinc/27/55/91/409275591.db2.gz	JAFZGVJELMYMRL-UHFFFAOYSA-N	1	1	319.361	1.722	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCCc2c1cnn2CCO	ZINC000320025599	164040095	/nfs/dbraw/zinc/04/00/95/164040095.db2.gz	GNSFRGUAJRYJIG-AWEZNQCLSA-N	1	1	316.361	1.951	20	5		DDBDMO
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H]1CC[N@H+](C2CCCC2)C1	ZINC000363010928	164159710	/nfs/dbraw/zinc/15/97/10/164159710.db2.gz	WMQJJUUMKRIUQF-LBPRGKRZSA-N	1	1	321.381	1.315	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290684380	409486337	/nfs/dbraw/zinc/48/63/37/409486337.db2.gz	SUOMGKJCRMMDKA-MNOVXSKESA-N	1	1	321.381	1.621	20	5		DDBDMO
C[C@@H](O)CC[N@@H+](C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000304305563	409602226	/nfs/dbraw/zinc/60/22/26/409602226.db2.gz	JRSVQZPDZCJNEG-RISCZKNCSA-N	1	1	307.350	1.403	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000356891007	409691197	/nfs/dbraw/zinc/69/11/97/409691197.db2.gz	WCVYAGCNCZKOSW-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000354391102	409817385	/nfs/dbraw/zinc/81/73/85/409817385.db2.gz	JUGUTTHEQTXFQQ-OLZOCXBDSA-N	1	1	323.397	1.513	20	5		DDBDMO
COC(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)[C@H]1C	ZINC000346657683	410062089	/nfs/dbraw/zinc/06/20/89/410062089.db2.gz	LHCKZTKLSZRNRQ-SMDDNHRTSA-N	1	1	308.334	1.857	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCn3cc[nH+]c3C2)n1	ZINC000343041834	410096093	/nfs/dbraw/zinc/09/60/93/410096093.db2.gz	GWXWIDCXVMUTNS-VIFPVBQESA-N	1	1	317.305	1.400	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357553300	410101817	/nfs/dbraw/zinc/10/18/17/410101817.db2.gz	UCIKKZUYVMHIBQ-SNVBAGLBSA-N	1	1	307.354	1.375	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000346759158	410136572	/nfs/dbraw/zinc/13/65/72/410136572.db2.gz	APHFVAVIVLZCLM-VXGBXAGGSA-N	1	1	323.397	1.468	20	5		DDBDMO
C[C@@H](CNC(=O)CCn1cc([N+](=O)[O-])cn1)[N@H+]1CCCC[C@@H]1C	ZINC000351700902	410159585	/nfs/dbraw/zinc/15/95/85/410159585.db2.gz	TUWAYWZQIUKYRJ-STQMWFEESA-N	1	1	323.397	1.561	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]2CCC[C@@H]21	ZINC000339721819	410417272	/nfs/dbraw/zinc/41/72/72/410417272.db2.gz	YPFODDBSGORYJY-MELADBBJSA-N	1	1	308.382	1.663	20	5		DDBDMO
C[N@@H+](CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C1CCCC1	ZINC000355203928	410379141	/nfs/dbraw/zinc/37/91/41/410379141.db2.gz	GCTAWQRYZWGVFE-UHFFFAOYSA-N	1	1	323.397	1.517	20	5		DDBDMO
COC(=O)c1cc(C(C)(C)[NH2+]CCn2cc([N+](=O)[O-])cn2)no1	ZINC000351997531	410401704	/nfs/dbraw/zinc/40/17/04/410401704.db2.gz	RSGWEIBXJRDFEW-UHFFFAOYSA-N	1	1	323.309	1.091	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCOC[C@H]2CC2CCC2)c1	ZINC000339781484	410453797	/nfs/dbraw/zinc/45/37/97/410453797.db2.gz	YDYPPRRCIMALAK-HIFRSBDPSA-N	1	1	324.381	1.043	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000355322487	410442099	/nfs/dbraw/zinc/44/20/99/410442099.db2.gz	RRTSYTVVIKUHLP-UHFFFAOYSA-N	1	1	319.361	1.742	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)c1	ZINC000299095443	410519265	/nfs/dbraw/zinc/51/92/65/410519265.db2.gz	KKHRHEBXUSDUAU-VNQPRFMTSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCO[C@@H]3CCC[C@@H]32)c1	ZINC000299095443	410519268	/nfs/dbraw/zinc/51/92/68/410519268.db2.gz	KKHRHEBXUSDUAU-VNQPRFMTSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1cccc2ncnc(N3CCC[N@H+](CCO)CC3)c21	ZINC000347413296	410532829	/nfs/dbraw/zinc/53/28/29/410532829.db2.gz	SMBGPMFMUMCIID-UHFFFAOYSA-N	1	1	317.349	1.042	20	5		DDBDMO
CCC[N@@H+](CCO)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000299242123	410579772	/nfs/dbraw/zinc/57/97/72/410579772.db2.gz	UYXFSMWWCLBPID-UHFFFAOYSA-N	1	1	309.366	1.936	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CCC[N@H+]1C	ZINC000299247948	410582802	/nfs/dbraw/zinc/58/28/02/410582802.db2.gz	XWNOFEASLYBYQX-GFCCVEGCSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@H]1CCC[N@@H+]1C	ZINC000299247948	410582808	/nfs/dbraw/zinc/58/28/08/410582808.db2.gz	XWNOFEASLYBYQX-GFCCVEGCSA-N	1	1	313.379	1.276	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1nn(CC)cc1[N+](=O)[O-]	ZINC000343645197	410592876	/nfs/dbraw/zinc/59/28/76/410592876.db2.gz	TVCUNPWHGGQQOE-NSHDSACASA-N	1	1	309.370	1.415	20	5		DDBDMO
C[C@H](CNc1ncnc2cccc([N+](=O)[O-])c21)[N@@H+](C)C1CC1	ZINC000347443773	410548696	/nfs/dbraw/zinc/54/86/96/410548696.db2.gz	YVVHKDXWXNOGKY-SNVBAGLBSA-N	1	1	301.350	2.433	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000340098172	410673737	/nfs/dbraw/zinc/67/37/37/410673737.db2.gz	VVPHIMVYLITDJU-GXTWGEPZSA-N	1	1	320.393	1.919	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NC[C@@H](C(C)C)N1CC[NH+](C)CC1	ZINC000301087133	410652011	/nfs/dbraw/zinc/65/20/11/410652011.db2.gz	FGKXYKZPYIVPPS-HNNXBMFYSA-N	1	1	321.425	1.982	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000301096447	410656367	/nfs/dbraw/zinc/65/63/67/410656367.db2.gz	GSZWSEQOBOPSSZ-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
CCOc1ccc(C(=O)NC[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000347745998	410697427	/nfs/dbraw/zinc/69/74/27/410697427.db2.gz	LFLAFXOOBXYZDV-LBPRGKRZSA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1OC[C@@H](O)C[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000340168603	410720922	/nfs/dbraw/zinc/72/09/22/410720922.db2.gz	SWJKQYHOQIVWLN-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1OC[C@@H](O)C[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC000340168603	410720924	/nfs/dbraw/zinc/72/09/24/410720924.db2.gz	SWJKQYHOQIVWLN-MJBXVCDLSA-N	1	1	324.377	1.752	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2[C@@H](O)C(F)(F)F)c1	ZINC000340207730	410752611	/nfs/dbraw/zinc/75/26/11/410752611.db2.gz	YXGUXKLVGJFNPS-WDEREUQCSA-N	1	1	322.287	1.569	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@H]2[C@@H](O)C(F)(F)F)c1	ZINC000340207730	410752618	/nfs/dbraw/zinc/75/26/18/410752618.db2.gz	YXGUXKLVGJFNPS-WDEREUQCSA-N	1	1	322.287	1.569	20	5		DDBDMO
C[C@@H]1CN(C(=O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C[N@H+]1C	ZINC000330597687	410810328	/nfs/dbraw/zinc/81/03/28/410810328.db2.gz	SJQMLWYEKVHNTN-NEPJUHHUSA-N	1	1	307.350	1.525	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+](C)C[C@@H]1C	ZINC000330671871	410865580	/nfs/dbraw/zinc/86/55/80/410865580.db2.gz	NHCSOZBDFQKIHE-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN(C)C[C@@H]1C	ZINC000330671871	410865585	/nfs/dbraw/zinc/86/55/85/410865585.db2.gz	NHCSOZBDFQKIHE-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN(C)C[C@@H]1C	ZINC000330671871	410865590	/nfs/dbraw/zinc/86/55/90/410865590.db2.gz	NHCSOZBDFQKIHE-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])n2C)[C@@H](C)C1	ZINC000356284389	410943737	/nfs/dbraw/zinc/94/37/37/410943737.db2.gz	PBYBKJYFDVZRCO-RYUDHWBXSA-N	1	1	308.382	1.736	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)CC1(O)CCC1	ZINC000353480881	411022124	/nfs/dbraw/zinc/02/21/24/411022124.db2.gz	JNSLQXXNHCYXHM-NSHDSACASA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1ccc(OC[C@H](O)C[NH+]2C[C@H](C)O[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000339335567	306735827	/nfs/dbraw/zinc/73/58/27/306735827.db2.gz	XOXYRYKYLLQBGX-MELADBBJSA-N	1	1	324.377	1.752	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(c3nc4c(cc3[N+](=O)[O-])CCCC4)C[C@H]2C1	ZINC000580067738	422881850	/nfs/dbraw/zinc/88/18/50/422881850.db2.gz	HOZVTHPHIWTBGQ-BETUJISGSA-N	1	1	302.378	1.866	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)C[C@@H]21	ZINC000374821230	418565473	/nfs/dbraw/zinc/56/54/73/418565473.db2.gz	DYRXLKABHMWOTP-OTYXRUKQSA-N	1	1	322.340	1.482	20	5		DDBDMO
CNc1c(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360947551	418552676	/nfs/dbraw/zinc/55/26/76/418552676.db2.gz	XMXCEBHQVHAFGA-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000360947551	418552679	/nfs/dbraw/zinc/55/26/79/418552679.db2.gz	XMXCEBHQVHAFGA-QWRGUYRKSA-N	1	1	306.366	1.801	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2c(F)cccc2[N+](=O)[O-])[C@H](C)C1	ZINC000189558571	222048092	/nfs/dbraw/zinc/04/80/92/222048092.db2.gz	AKILFUQAIZUYFN-VXGBXAGGSA-N	1	1	311.357	1.621	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)CO	ZINC000190856875	222090141	/nfs/dbraw/zinc/09/01/41/222090141.db2.gz	LQDZHFBZMBREHV-UWVGGRQHSA-N	1	1	302.758	1.812	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000361421330	418648964	/nfs/dbraw/zinc/64/89/64/418648964.db2.gz	SUFWQXWIYCYCME-CQSZACIVSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000361421330	418648965	/nfs/dbraw/zinc/64/89/65/418648965.db2.gz	SUFWQXWIYCYCME-CQSZACIVSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000375501775	418649466	/nfs/dbraw/zinc/64/94/66/418649466.db2.gz	OBACNHVLBCEETH-CQSZACIVSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@H](CO)N1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000375501775	418649470	/nfs/dbraw/zinc/64/94/70/418649470.db2.gz	OBACNHVLBCEETH-CQSZACIVSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@H](CO)N1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000375501775	418649472	/nfs/dbraw/zinc/64/94/72/418649472.db2.gz	OBACNHVLBCEETH-CQSZACIVSA-N	1	1	307.394	1.526	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000361563070	418679358	/nfs/dbraw/zinc/67/93/58/418679358.db2.gz	FAFSMDULHGYLIK-CQSZACIVSA-N	1	1	303.322	1.168	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1	ZINC000361563070	418679360	/nfs/dbraw/zinc/67/93/60/418679360.db2.gz	FAFSMDULHGYLIK-CQSZACIVSA-N	1	1	303.322	1.168	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000408073944	418785877	/nfs/dbraw/zinc/78/58/77/418785877.db2.gz	VDSKGHUOPYGWPJ-VXGBXAGGSA-N	1	1	321.377	1.986	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@@H]3C2)c2ncccc12	ZINC000371801218	418816558	/nfs/dbraw/zinc/81/65/58/418816558.db2.gz	FKPXOFZUOZOMPO-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@@H]3C2)c2ncccc12	ZINC000371801218	418816560	/nfs/dbraw/zinc/81/65/60/418816560.db2.gz	FKPXOFZUOZOMPO-LBPRGKRZSA-N	1	1	314.345	1.664	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000365249227	418846272	/nfs/dbraw/zinc/84/62/72/418846272.db2.gz	PZTQGNJCHGFBFZ-NEPJUHHUSA-N	1	1	319.361	1.960	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@H](CO)C[C@H](C)C1	ZINC000420936793	419369074	/nfs/dbraw/zinc/36/90/74/419369074.db2.gz	ITWSWATYCPCXEL-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@H](CO)C[C@H](C)C1	ZINC000420936793	419369079	/nfs/dbraw/zinc/36/90/79/419369079.db2.gz	ITWSWATYCPCXEL-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420950418	419382334	/nfs/dbraw/zinc/38/23/34/419382334.db2.gz	WLNMYJIRUJFWIO-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
CC(C)[C@H]1[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000427188146	419615145	/nfs/dbraw/zinc/61/51/45/419615145.db2.gz	WZAHFBFQEGKILY-ZIAGYGMSSA-N	1	1	308.382	1.663	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1CCC[N@H+]1C	ZINC000421704092	419689963	/nfs/dbraw/zinc/68/99/63/419689963.db2.gz	NTQRGJOYUJFVFY-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ncn1	ZINC000428378647	419857974	/nfs/dbraw/zinc/85/79/74/419857974.db2.gz	IKQWHBPXNJQORD-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ncn1	ZINC000428378647	419857977	/nfs/dbraw/zinc/85/79/77/419857977.db2.gz	IKQWHBPXNJQORD-GFCCVEGCSA-N	1	1	314.349	1.775	20	5		DDBDMO
CC(C)[C@H]([NH3+])CN[C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268593	419999985	/nfs/dbraw/zinc/99/99/85/419999985.db2.gz	GPSPLAYWGIKICB-SMDDNHRTSA-N	1	1	308.382	1.885	20	5		DDBDMO
CC(C)[C@H](N)C[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000423268593	419999989	/nfs/dbraw/zinc/99/99/89/419999989.db2.gz	GPSPLAYWGIKICB-SMDDNHRTSA-N	1	1	308.382	1.885	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@]2(CNC(=O)C2)C1	ZINC000430195579	420088242	/nfs/dbraw/zinc/08/82/42/420088242.db2.gz	OGEZMTRRFGBXBV-INIZCTEOSA-N	1	1	319.361	1.706	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000430922430	420207253	/nfs/dbraw/zinc/20/72/53/420207253.db2.gz	AGVAOLMMIBAMFG-VXGBXAGGSA-N	1	1	320.393	1.981	20	5		DDBDMO
C[C@@H]1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](CN)C1	ZINC000420324818	420209800	/nfs/dbraw/zinc/20/98/00/420209800.db2.gz	BCNVERRSGCYPSH-IUODEOHRSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](CN)C1	ZINC000420324818	420209804	/nfs/dbraw/zinc/20/98/04/420209804.db2.gz	BCNVERRSGCYPSH-IUODEOHRSA-N	1	1	320.393	1.983	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C[C@@]1(C)C[NH3+]	ZINC000423983082	420289532	/nfs/dbraw/zinc/28/95/32/420289532.db2.gz	LNFKMMXRCLVJNT-RFAUZJTJSA-N	1	1	317.349	1.528	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000416291932	420310662	/nfs/dbraw/zinc/31/06/62/420310662.db2.gz	IFTBUKDPRHEWEQ-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H](C)[N@H+](CCO)C[C@@H]1C	ZINC000416291932	420310664	/nfs/dbraw/zinc/31/06/64/420310664.db2.gz	IFTBUKDPRHEWEQ-STQMWFEESA-N	1	1	321.377	1.430	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)c1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420604503	420328865	/nfs/dbraw/zinc/32/88/65/420328865.db2.gz	RZELMEBIHLPSPR-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
CCC[N@@H+](C)C[C@H]1CCN(c2cccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000439163688	420483462	/nfs/dbraw/zinc/48/34/62/420483462.db2.gz	SYJUZZKADIOSDK-GFCCVEGCSA-N	1	1	320.393	1.862	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CC[C@H](NC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000492739444	420648408	/nfs/dbraw/zinc/64/84/08/420648408.db2.gz	AIULVEURKHZMSP-NSHDSACASA-N	1	1	308.338	1.236	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](NC(N)=O)C2)ccc1[N+](=O)[O-]	ZINC000492739444	420648410	/nfs/dbraw/zinc/64/84/10/420648410.db2.gz	AIULVEURKHZMSP-NSHDSACASA-N	1	1	308.338	1.236	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456007490	421088168	/nfs/dbraw/zinc/08/81/68/421088168.db2.gz	DFDXNKVKXWDYFQ-VHSXEESVSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456007490	421088171	/nfs/dbraw/zinc/08/81/71/421088171.db2.gz	DFDXNKVKXWDYFQ-VHSXEESVSA-N	1	1	307.354	1.196	20	5		DDBDMO
COc1ccc(CC(=O)N(C)[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000525524753	421292228	/nfs/dbraw/zinc/29/22/28/421292228.db2.gz	JHXJAXUSJHUEMV-ZDUSSCGKSA-N	1	1	321.377	1.699	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000527054190	421351257	/nfs/dbraw/zinc/35/12/57/421351257.db2.gz	SXVPUPNMLABNJI-NSHDSACASA-N	1	1	305.334	1.136	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000548822538	421477118	/nfs/dbraw/zinc/47/71/18/421477118.db2.gz	WMFAJLDEORZDJR-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2ccc3cc([N+](=O)[O-])ccc3n2)CCO1	ZINC000548822538	421477121	/nfs/dbraw/zinc/47/71/21/421477121.db2.gz	WMFAJLDEORZDJR-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
CCN(C[C@@H]1CCC[N@H+]1CC)C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000563916280	421556280	/nfs/dbraw/zinc/55/62/80/421556280.db2.gz	LVCGNVMIXUJLQS-ZDUSSCGKSA-N	1	1	306.366	1.936	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C1CCOCC1	ZINC000530627231	421610855	/nfs/dbraw/zinc/61/08/55/421610855.db2.gz	KLDXABZPQVIDGA-CQSZACIVSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cn1)Cc1ccccc1	ZINC000531627230	421640857	/nfs/dbraw/zinc/64/08/57/421640857.db2.gz	APAAZHXHDCVRKH-UHFFFAOYSA-N	1	1	314.345	1.852	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757793	421665201	/nfs/dbraw/zinc/66/52/01/421665201.db2.gz	IPIDADDNTKXNEM-MNOVXSKESA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@H]1CC[N@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000532757793	421665204	/nfs/dbraw/zinc/66/52/04/421665204.db2.gz	IPIDADDNTKXNEM-MNOVXSKESA-N	1	1	313.379	1.279	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000572177868	421767098	/nfs/dbraw/zinc/76/70/98/421767098.db2.gz	DNQIOUFHBYIYMC-LBPRGKRZSA-N	1	1	321.381	1.297	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)CCOc2cccc([N+](=O)[O-])c2)CCC1=O	ZINC000520952791	421767863	/nfs/dbraw/zinc/76/78/63/421767863.db2.gz	HEWWGDFZYNKUHK-ZDUSSCGKSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cn2C)C1	ZINC000521144116	421774455	/nfs/dbraw/zinc/77/44/55/421774455.db2.gz	TYNOLPDMRHQNHS-LBPRGKRZSA-N	1	1	308.382	1.784	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@@H]([NH+]3CCOCC3)CC2)s1	ZINC000573338431	421948108	/nfs/dbraw/zinc/94/81/08/421948108.db2.gz	NDGLHCTUYGVIJK-LLVKDONJSA-N	1	1	312.395	1.742	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000597860251	422392225	/nfs/dbraw/zinc/39/22/25/422392225.db2.gz	MPLWMPYVUURLNL-JTQLQIEISA-N	1	1	321.381	1.422	20	5		DDBDMO
O=C1N=NCN1C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000578717850	422628223	/nfs/dbraw/zinc/62/82/23/422628223.db2.gz	BYPOSDIAAOQRNW-UHFFFAOYSA-N	1	1	303.322	1.729	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@]12CCOC2	ZINC000341956084	271259196	/nfs/dbraw/zinc/25/91/96/271259196.db2.gz	SKIYNELTTRYQKY-XJKSGUPXSA-N	1	1	322.361	1.589	20	5		DDBDMO
Cn1c(C(=O)NC[C@H]2[N@@H+](C)CCCC2(C)C)ccc1[N+](=O)[O-]	ZINC000344620094	272071937	/nfs/dbraw/zinc/07/19/37/272071937.db2.gz	RKVRLWARCYTRCK-GFCCVEGCSA-N	1	1	308.382	1.784	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@@H+]3CCCC[C@@H]3C2)n1	ZINC000280933395	274004262	/nfs/dbraw/zinc/00/42/62/274004262.db2.gz	HQEHSUNWFSCAHT-LLVKDONJSA-N	1	1	320.349	1.451	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[N@H+]3CCCC[C@@H]3C2)n1	ZINC000280933395	274004263	/nfs/dbraw/zinc/00/42/63/274004263.db2.gz	HQEHSUNWFSCAHT-LLVKDONJSA-N	1	1	320.349	1.451	20	5		DDBDMO
COC(=O)c1cnc(N2CC[NH+](C3CCC3)CC2)c([N+](=O)[O-])c1	ZINC000276774279	277168239	/nfs/dbraw/zinc/16/82/39/277168239.db2.gz	NPTQZHFPGPVPBI-UHFFFAOYSA-N	1	1	320.349	1.451	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000357312607	299006268	/nfs/dbraw/zinc/00/62/68/299006268.db2.gz	JNAMULTUGNQHIS-ZJUUUORDSA-N	1	1	305.338	1.127	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363050833	300203918	/nfs/dbraw/zinc/20/39/18/300203918.db2.gz	NMAYFIITZFOZCJ-XHSDSOJGSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363050833	300203919	/nfs/dbraw/zinc/20/39/19/300203919.db2.gz	NMAYFIITZFOZCJ-XHSDSOJGSA-N	1	1	317.389	1.632	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000363050833	300203921	/nfs/dbraw/zinc/20/39/21/300203921.db2.gz	NMAYFIITZFOZCJ-XHSDSOJGSA-N	1	1	317.389	1.632	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124898	300215457	/nfs/dbraw/zinc/21/54/57/300215457.db2.gz	DHMOEQNNMWIJQT-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000363124898	300215458	/nfs/dbraw/zinc/21/54/58/300215458.db2.gz	DHMOEQNNMWIJQT-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124898	300215459	/nfs/dbraw/zinc/21/54/59/300215459.db2.gz	DHMOEQNNMWIJQT-FVQBIDKESA-N	1	1	317.389	1.775	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2ncccc2[N+](=O)[O-])CC1	ZINC000364606450	300419426	/nfs/dbraw/zinc/41/94/26/300419426.db2.gz	NNKLXFDYORHRNI-UHFFFAOYSA-N	1	1	302.338	1.804	20	5		DDBDMO
COc1cccc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c1[N+](=O)[O-]	ZINC000368486707	301038731	/nfs/dbraw/zinc/03/87/31/301038731.db2.gz	OVOOCYZDYUSQDC-VXGBXAGGSA-N	1	1	307.350	1.879	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C[C@H](O)c3cccc([N+](=O)[O-])c3)C[C@H]21	ZINC000370148577	301283608	/nfs/dbraw/zinc/28/36/08/301283608.db2.gz	BFQHNSYPOOGNPN-WQVCFCJDSA-N	1	1	305.378	1.654	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@@H+]3CCCC[C@@H]3CO2)c1	ZINC000370285625	301309388	/nfs/dbraw/zinc/30/93/88/301309388.db2.gz	ONIMVCQAXAVSMO-OLZOCXBDSA-N	1	1	306.366	1.842	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(NC[C@H]2C[N@H+]3CCCC[C@@H]3CO2)c1	ZINC000370285625	301309389	/nfs/dbraw/zinc/30/93/89/301309389.db2.gz	ONIMVCQAXAVSMO-OLZOCXBDSA-N	1	1	306.366	1.842	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CC[C@@H]12	ZINC000377717983	302218623	/nfs/dbraw/zinc/21/86/23/302218623.db2.gz	CWZIFSXAVOLACA-SWLSCSKDSA-N	1	1	319.361	1.432	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC3(CCC3)[C@@H]2[C@H]2CCCO2)n1	ZINC000377791131	302233826	/nfs/dbraw/zinc/23/38/26/302233826.db2.gz	ZDLPFZIAUNBWFZ-OCCSQVGLSA-N	1	1	306.366	1.825	20	5		DDBDMO
CCc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1n[nH]cc1[N+](=O)[O-]	ZINC000378309033	302310301	/nfs/dbraw/zinc/31/03/01/302310301.db2.gz	AVKNPLGGCLLCHB-JTQLQIEISA-N	1	1	318.337	1.382	20	5		DDBDMO
O=C1NC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@H]12	ZINC000377647622	307275709	/nfs/dbraw/zinc/27/57/09/307275709.db2.gz	FSEYZLZFOIDPIT-PWSUYJOCSA-N	1	1	320.305	1.071	20	5		DDBDMO
O=C1NC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC[C@H]12	ZINC000377647622	307275710	/nfs/dbraw/zinc/27/57/10/307275710.db2.gz	FSEYZLZFOIDPIT-PWSUYJOCSA-N	1	1	320.305	1.071	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)ccc3[N+](=O)[O-])C[C@@H]21	ZINC000378474495	307288766	/nfs/dbraw/zinc/28/87/66/307288766.db2.gz	RBEOYIPRHRRNOW-YGRLFVJLSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CCC[N@@H+](C)C2	ZINC000583103064	337240896	/nfs/dbraw/zinc/24/08/96/337240896.db2.gz	YOJJSHUXNCAOID-HNNXBMFYSA-N	1	1	306.366	1.491	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H]1CCC(=O)N(C)C1	ZINC000584448323	337338983	/nfs/dbraw/zinc/33/89/83/337338983.db2.gz	NFDPFSMZUKRPEP-ZDUSSCGKSA-N	1	1	307.350	1.656	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+](C)[C@H]1CCC(=O)N(C)C1	ZINC000584448323	337338984	/nfs/dbraw/zinc/33/89/84/337338984.db2.gz	NFDPFSMZUKRPEP-ZDUSSCGKSA-N	1	1	307.350	1.656	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000416994087	533865734	/nfs/dbraw/zinc/86/57/34/533865734.db2.gz	JIJLEUREDYTDBI-RYUDHWBXSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000416994087	533865744	/nfs/dbraw/zinc/86/57/44/533865744.db2.gz	JIJLEUREDYTDBI-RYUDHWBXSA-N	1	1	322.365	1.514	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](S(N)(=O)=O)C1	ZINC000330715832	534347702	/nfs/dbraw/zinc/34/77/02/534347702.db2.gz	SYXIJMYRMRVWQN-ZYHUDNBSSA-N	1	1	313.379	1.327	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CC[C@@H](S(N)(=O)=O)C1	ZINC000330715832	534347707	/nfs/dbraw/zinc/34/77/07/534347707.db2.gz	SYXIJMYRMRVWQN-ZYHUDNBSSA-N	1	1	313.379	1.327	20	5		DDBDMO
CC(C)(C)C[C@H]1CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000452080371	526271708	/nfs/dbraw/zinc/27/17/08/526271708.db2.gz	ORWXECISVDMYTJ-OCCSQVGLSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC(C)(C)C[C@@H]1CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000452080368	527699437	/nfs/dbraw/zinc/69/94/37/527699437.db2.gz	ORWXECISVDMYTJ-GXTWGEPZSA-N	1	1	310.398	1.910	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000490293377	527827737	/nfs/dbraw/zinc/82/77/37/527827737.db2.gz	NPDLXRYBCATRJW-OAHLLOKOSA-N	1	1	320.393	1.805	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)CO	ZINC000292869443	527924749	/nfs/dbraw/zinc/92/47/49/527924749.db2.gz	AWBHLRGUMRGRBD-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)CO	ZINC000292869443	527924759	/nfs/dbraw/zinc/92/47/59/527924759.db2.gz	AWBHLRGUMRGRBD-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNc2ncc(C(=O)OC)cc2[N+](=O)[O-])C1	ZINC000302659360	529086027	/nfs/dbraw/zinc/08/60/27/529086027.db2.gz	AQUVLRGMHFMWFD-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CCN(c2[nH+]ccn2C)CC1	ZINC000745973147	700001312	/nfs/dbraw/zinc/00/13/12/700001312.db2.gz	UOSZCNKDKYJPJX-UHFFFAOYSA-N	1	1	301.350	1.963	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000748355977	700113415	/nfs/dbraw/zinc/11/34/15/700113415.db2.gz	UFOMKUIZJXZUQJ-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@H+]1C	ZINC000748355977	700113416	/nfs/dbraw/zinc/11/34/16/700113416.db2.gz	UFOMKUIZJXZUQJ-JTQLQIEISA-N	1	1	321.333	1.142	20	5		DDBDMO
Cc1ncoc1C[N@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC000985426954	697509319	/nfs/dbraw/zinc/50/93/19/697509319.db2.gz	VUIQSQLKVJHBSY-CHWSQXEVSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1ncoc1C[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985426954	697509321	/nfs/dbraw/zinc/50/93/21/697509321.db2.gz	VUIQSQLKVJHBSY-CHWSQXEVSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1ncoc1C[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000985426954	697509322	/nfs/dbraw/zinc/50/93/22/697509322.db2.gz	VUIQSQLKVJHBSY-CHWSQXEVSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C)C(C)(C)C2)c(N)c([N+](=O)[O-])c1	ZINC000774247586	697858862	/nfs/dbraw/zinc/85/88/62/697858862.db2.gz	ACFYOBZRLMVKHG-UHFFFAOYSA-N	1	1	306.366	1.652	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C)C(C)(C)C2)c(N)c([N+](=O)[O-])c1	ZINC000774247586	697858864	/nfs/dbraw/zinc/85/88/64/697858864.db2.gz	ACFYOBZRLMVKHG-UHFFFAOYSA-N	1	1	306.366	1.652	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749939809	700193320	/nfs/dbraw/zinc/19/33/20/700193320.db2.gz	UGPQXLDFYZBIES-JTQLQIEISA-N	1	1	319.321	1.100	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749939809	700193322	/nfs/dbraw/zinc/19/33/22/700193322.db2.gz	UGPQXLDFYZBIES-JTQLQIEISA-N	1	1	319.321	1.100	20	5		DDBDMO
COc1ccc(CN2CC[C@@H](N3CC[NH2+]CC3)C2)cc1[N+](=O)[O-]	ZINC000261938690	698445903	/nfs/dbraw/zinc/44/59/03/698445903.db2.gz	UJVQDNALNCESBM-CQSZACIVSA-N	1	1	320.393	1.083	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H]3C[C@]3(CO)C2)c([N+](=O)[O-])c1	ZINC000782619989	698752273	/nfs/dbraw/zinc/75/22/73/698752273.db2.gz	JSTZMLFAKSQFSG-XHDPSFHLSA-N	1	1	308.334	1.296	20	5		DDBDMO
C[C@H]1CC[N@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000726590694	699369692	/nfs/dbraw/zinc/36/96/92/699369692.db2.gz	QORFNAGFDWEQSE-NSHDSACASA-N	1	1	318.333	1.663	20	5		DDBDMO
C[C@H]1CC[N@@H+](CN2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000726590694	699369693	/nfs/dbraw/zinc/36/96/93/699369693.db2.gz	QORFNAGFDWEQSE-NSHDSACASA-N	1	1	318.333	1.663	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@@H+]1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000789516255	699392215	/nfs/dbraw/zinc/39/22/15/699392215.db2.gz	NCBSRLQABKGMAZ-CYBMUJFWSA-N	1	1	323.397	1.746	20	5		DDBDMO
CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000789516255	699392218	/nfs/dbraw/zinc/39/22/18/699392218.db2.gz	NCBSRLQABKGMAZ-CYBMUJFWSA-N	1	1	323.397	1.746	20	5		DDBDMO
COC[C@H]1CC[N@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000739872344	699781735	/nfs/dbraw/zinc/78/17/35/699781735.db2.gz	PKUUYEBUYOYMSI-JTQLQIEISA-N	1	1	307.306	1.429	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cn2c3cc([N+](=O)[O-])ccc3oc2=O)C1	ZINC000739872344	699781736	/nfs/dbraw/zinc/78/17/36/699781736.db2.gz	PKUUYEBUYOYMSI-JTQLQIEISA-N	1	1	307.306	1.429	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CCC[N@H+](CCO)CC1	ZINC000804432237	701188746	/nfs/dbraw/zinc/18/87/46/701188746.db2.gz	VZVHQHQBAMLWGS-UHFFFAOYSA-N	1	1	310.310	1.007	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC[N@@H+]1CCCOCC1	ZINC000804640212	701205240	/nfs/dbraw/zinc/20/52/40/701205240.db2.gz	CCIWDEJGNBJVAS-UHFFFAOYSA-N	1	1	310.310	1.637	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC[N@H+]1CCCOCC1	ZINC000804640212	701205244	/nfs/dbraw/zinc/20/52/44/701205244.db2.gz	CCIWDEJGNBJVAS-UHFFFAOYSA-N	1	1	310.310	1.637	20	5		DDBDMO
Cc1nn(C[N@@H+]2CC[C@@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000808207284	701507766	/nfs/dbraw/zinc/50/77/66/701507766.db2.gz	PKUZNPRDPRRCFG-GFCCVEGCSA-N	1	1	307.354	1.002	20	5		DDBDMO
Cc1nn(C[N@H+]2CC[C@@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000808207284	701507767	/nfs/dbraw/zinc/50/77/67/701507767.db2.gz	PKUZNPRDPRRCFG-GFCCVEGCSA-N	1	1	307.354	1.002	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)OC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000810614485	701800648	/nfs/dbraw/zinc/80/06/48/701800648.db2.gz	COMQGFMZYIILNK-SNVBAGLBSA-N	1	1	307.310	1.318	20	5		DDBDMO
CC(C)(C(=O)O[C@@H]1CC[N@H+]2CCC[C@@H]2C1)n1cc([N+](=O)[O-])cn1	ZINC000810839513	701859435	/nfs/dbraw/zinc/85/94/35/701859435.db2.gz	BSOLGBGUNNNJDT-DGCLKSJQSA-N	1	1	322.365	1.696	20	5		DDBDMO
Nc1ccc(C(=O)O[C@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000810850730	701862296	/nfs/dbraw/zinc/86/22/96/701862296.db2.gz	NXBIWAGIPBWRCM-NEPJUHHUSA-N	1	1	305.334	1.961	20	5		DDBDMO
C[C@@H]1CN(Cn2ncc3ccc([N+](=O)[O-])cc32)C[C@H](C)[N@@H+]1C	ZINC000840090292	701962668	/nfs/dbraw/zinc/96/26/68/701962668.db2.gz	ODXQCDOOUUBDOQ-TXEJJXNPSA-N	1	1	303.366	1.926	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000840094481	701966374	/nfs/dbraw/zinc/96/63/74/701966374.db2.gz	UMOJYMTZSIKBAX-ZDUSSCGKSA-N	1	1	303.366	1.928	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000868269142	702032479	/nfs/dbraw/zinc/03/24/79/702032479.db2.gz	CPAIYSSDHUWKSK-NSHDSACASA-N	1	1	309.341	1.829	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)Cn1c(=O)oc2cccc([N+](=O)[O-])c21	ZINC000817374832	702361848	/nfs/dbraw/zinc/36/18/48/702361848.db2.gz	MOSOYRLAAJPWRH-NSHDSACASA-N	1	1	320.349	1.486	20	5		DDBDMO
COc1cc(Cc2noc([C@@H](C)[NH3+])n2)c([N+](=O)[O-])c(OC)c1	ZINC000843224897	702845734	/nfs/dbraw/zinc/84/57/34/702845734.db2.gz	AJCDNJWLLJSCPP-SSDOTTSWSA-N	1	1	308.294	1.606	20	5		DDBDMO
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)N1CC[C@@H]2C[N@H+](C)C[C@@H]21	ZINC000843893516	702939078	/nfs/dbraw/zinc/93/90/78/702939078.db2.gz	OGNNCZXIKKXBTD-MFKMUULPSA-N	1	1	307.325	1.818	20	5		DDBDMO
CCCN(C(=O)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1CC[N@@H+](C)C1	ZINC000843992218	702950141	/nfs/dbraw/zinc/95/01/41/702950141.db2.gz	BEAPHMVULYXMGV-GFCCVEGCSA-N	1	1	306.366	1.733	20	5		DDBDMO
Cc1nn(C[NH+]2CCC(Cn3cnnc3)CC2)c(C)c1[N+](=O)[O-]	ZINC000844731646	703065282	/nfs/dbraw/zinc/06/52/82/703065282.db2.gz	HLODLLIVJSPUCK-UHFFFAOYSA-N	1	1	319.369	1.369	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000848351484	703542162	/nfs/dbraw/zinc/54/21/62/703542162.db2.gz	DMEYMQSLYYIMTC-CABCVRRESA-N	1	1	318.377	1.924	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c1	ZINC000818986353	704043920	/nfs/dbraw/zinc/04/39/20/704043920.db2.gz	MDRQUWGJTPBOFQ-OWCLPIDISA-N	1	1	321.377	1.081	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CN3CCC[C@@H]3CO2)c1	ZINC000818986353	704043924	/nfs/dbraw/zinc/04/39/24/704043924.db2.gz	MDRQUWGJTPBOFQ-OWCLPIDISA-N	1	1	321.377	1.081	20	5		DDBDMO
C[C@@H]1C[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C[C@@H](C)C1O	ZINC000852500945	704064095	/nfs/dbraw/zinc/06/40/95/704064095.db2.gz	UMCWJZTUEHMVBC-NXEZZACHSA-N	1	1	309.322	1.952	20	5		DDBDMO
O=C(O[C@H]1C[C@@H]([NH+]2CCOCC2)C1)c1cccc([N+](=O)[O-])c1	ZINC000821587723	704425423	/nfs/dbraw/zinc/42/54/23/704425423.db2.gz	JJLUDCLOLAEFSJ-OKILXGFUSA-N	1	1	306.318	1.615	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000855163130	704471663	/nfs/dbraw/zinc/47/16/63/704471663.db2.gz	SYCVAGYSIKKEFR-KBPBESRZSA-N	1	1	321.377	1.617	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(Cc2ccccc2[N+](=O)[O-])no1	ZINC000822647673	704995877	/nfs/dbraw/zinc/99/58/77/704995877.db2.gz	SRTSSVCOTZWANW-SNVBAGLBSA-N	1	1	320.305	1.522	20	5		DDBDMO
COc1cccc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1[N+](=O)[O-]	ZINC000874827845	705186166	/nfs/dbraw/zinc/18/61/66/705186166.db2.gz	DULZTCRMSKXMSF-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000874845933	705200187	/nfs/dbraw/zinc/20/01/87/705200187.db2.gz	YUROPSXLQFQSHA-LSDHHAIUSA-N	1	1	319.361	1.669	20	5		DDBDMO
CCN(C(=O)Nc1ccc(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000823920841	705340138	/nfs/dbraw/zinc/34/01/38/705340138.db2.gz	FKVXQOOPXLXMJN-NSHDSACASA-N	1	1	307.354	1.735	20	5		DDBDMO
CCn1nc(C)c(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)n1	ZINC000824081015	705369884	/nfs/dbraw/zinc/36/98/84/705369884.db2.gz	RIJXLKJMDCWKNS-CQSZACIVSA-N	1	1	305.338	1.338	20	5		DDBDMO
O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CCC2)CC1	ZINC000825909629	705744541	/nfs/dbraw/zinc/74/45/41/705744541.db2.gz	DEJIIQGXFPDZTL-HNNXBMFYSA-N	1	1	319.361	1.325	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC000827363736	705985557	/nfs/dbraw/zinc/98/55/57/705985557.db2.gz	CABPIJKYHGOBSC-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])CC[C@H]21	ZINC000827374743	705988956	/nfs/dbraw/zinc/98/89/56/705988956.db2.gz	PPCLBPGGUZHLBR-ZIAGYGMSSA-N	1	1	303.362	1.690	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2cc(F)c([N+](=O)[O-])cc2CO)n1C	ZINC000865536545	706457910	/nfs/dbraw/zinc/45/79/10/706457910.db2.gz	BVKTYTYWUTZWTR-UHFFFAOYSA-N	1	1	323.328	1.638	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCOCC1	ZINC000865877364	706549836	/nfs/dbraw/zinc/54/98/36/706549836.db2.gz	YEPNCUVVUPTWOP-UHFFFAOYSA-N	1	1	307.350	1.872	20	5		DDBDMO
C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)NC[C@H]1CCCO1	ZINC000880092306	706876877	/nfs/dbraw/zinc/87/68/77/706876877.db2.gz	MZSCYGMMOWYSQD-YNEHKIRRSA-N	1	1	321.377	1.929	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000880529346	707005636	/nfs/dbraw/zinc/00/56/36/707005636.db2.gz	KXXXSLPMKUJTRF-UKRRQHHQSA-N	1	1	303.362	1.738	20	5		DDBDMO
CC1(C)CCC[N@H+]1CCNC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000837174567	707591429	/nfs/dbraw/zinc/59/14/29/707591429.db2.gz	GURCFTUQXLDZOD-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)CCCNc1ccc([N+](=O)[O-])cc1	ZINC000882483096	707653364	/nfs/dbraw/zinc/65/33/64/707653364.db2.gz	QUHQNFUGDKADNU-OAHLLOKOSA-N	1	1	320.393	1.997	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000837613340	707695498	/nfs/dbraw/zinc/69/54/98/707695498.db2.gz	UFMKNMFONYSEES-LLVKDONJSA-N	1	1	322.365	1.992	20	5		DDBDMO
Cc1c(C[NH2+][C@H](C)CN2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000873045024	707706763	/nfs/dbraw/zinc/70/67/63/707706763.db2.gz	AKANIAUKLHCWSA-CYBMUJFWSA-N	1	1	306.410	1.629	20	5		DDBDMO
Cn1ccnc1[C@@H](NC[C@H]1C[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000873256486	707786799	/nfs/dbraw/zinc/78/67/99/707786799.db2.gz	MXPVUHPRQSOZTD-WHOFXGATSA-N	1	1	315.377	1.745	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000896913087	708180971	/nfs/dbraw/zinc/18/09/71/708180971.db2.gz	MPTDFNZXCMFZIU-YGRLFVJLSA-N	1	1	306.322	1.891	20	5		DDBDMO
C[C@@H](CNC(=O)[C@H]1C[N@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402450	709037613	/nfs/dbraw/zinc/03/76/13/709037613.db2.gz	CDMRAWQHEIGACO-SMDDNHRTSA-N	1	1	307.350	1.145	20	5		DDBDMO
C[C@@H](CNC(=O)[C@H]1C[N@@H+](C)CCO1)c1ccccc1[N+](=O)[O-]	ZINC000887402450	709037617	/nfs/dbraw/zinc/03/76/17/709037617.db2.gz	CDMRAWQHEIGACO-SMDDNHRTSA-N	1	1	307.350	1.145	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000910269079	709853172	/nfs/dbraw/zinc/85/31/72/709853172.db2.gz	DSOGJLVYQBLFKU-IUODEOHRSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)COc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000910296269	709873759	/nfs/dbraw/zinc/87/37/59/709873759.db2.gz	UIZVOGHYMIOHEM-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000913095970	713161811	/nfs/dbraw/zinc/16/18/11/713161811.db2.gz	ACVRCHDLJXGUKT-DRPJVOAASA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095970	713161812	/nfs/dbraw/zinc/16/18/12/713161812.db2.gz	ACVRCHDLJXGUKT-DRPJVOAASA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095970	713161813	/nfs/dbraw/zinc/16/18/13/713161813.db2.gz	ACVRCHDLJXGUKT-DRPJVOAASA-N	1	1	317.389	1.678	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000892418066	710434000	/nfs/dbraw/zinc/43/40/00/710434000.db2.gz	MNDITPFHSKRXML-CJNGLKHVSA-N	1	1	318.377	1.688	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2C[N@@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000893133766	710559753	/nfs/dbraw/zinc/55/97/53/710559753.db2.gz	COJGWQMCISCXIG-GWCFXTLKSA-N	1	1	321.377	1.881	20	5		DDBDMO
COc1c(O)ccc(CN[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000893133766	710559754	/nfs/dbraw/zinc/55/97/54/710559754.db2.gz	COJGWQMCISCXIG-GWCFXTLKSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCCc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC000893266684	710583136	/nfs/dbraw/zinc/58/31/36/710583136.db2.gz	SQKMOQGANXGWNB-HIFRSBDPSA-N	1	1	318.377	1.483	20	5		DDBDMO
CC(C)Oc1nc(N2CC[C@H]3C[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000893933531	710891543	/nfs/dbraw/zinc/89/15/43/710891543.db2.gz	AQNYLQMMVITDOE-AAEUAGOBSA-N	1	1	306.366	1.917	20	5		DDBDMO
COC[C@H](CO)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-]	ZINC000894621898	711220692	/nfs/dbraw/zinc/22/06/92/711220692.db2.gz	XMQGTDPAUOXQLK-VIFPVBQESA-N	1	1	309.149	1.999	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000912237608	711238047	/nfs/dbraw/zinc/23/80/47/711238047.db2.gz	LYDOVHZBXBCKGQ-OAHLLOKOSA-N	1	1	320.393	1.921	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1	ZINC000894799777	711275727	/nfs/dbraw/zinc/27/57/27/711275727.db2.gz	ALQNFBSKHVKVPM-GASCZTMLSA-N	1	1	307.398	1.898	20	5		DDBDMO
CN1C[C@H](CCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CC1=O	ZINC000895478108	711522132	/nfs/dbraw/zinc/52/21/32/711522132.db2.gz	HZRQNZHITRKAFA-LLVKDONJSA-N	1	1	314.345	1.845	20	5		DDBDMO
Cc1cc(NC[C@@H]2CC[N@H+]2C2CCOCC2)ncc1[N+](=O)[O-]	ZINC000896521709	711737612	/nfs/dbraw/zinc/73/76/12/711737612.db2.gz	LDTTUFGCXZSMSC-ZDUSSCGKSA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000896579331	711757782	/nfs/dbraw/zinc/75/77/82/711757782.db2.gz	FQBXIXPPYJPYNC-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1c(CNC(=O)C2CN(C)CC[N@@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000907695867	712615178	/nfs/dbraw/zinc/61/51/78/712615178.db2.gz	RPYVEQRMHPMVFU-UHFFFAOYSA-N	1	1	320.393	1.013	20	5		DDBDMO
C[C@H]1[C@@H](NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000917789286	713514039	/nfs/dbraw/zinc/51/40/39/713514039.db2.gz	MLOUYNZUJNVMGO-FZMZJTMJSA-N	1	1	322.365	1.365	20	5		DDBDMO
C[N@H+](CC[N+](=O)[O-])C[C@H](O)c1cccc(Br)c1	ZINC000930715232	713902350	/nfs/dbraw/zinc/90/23/50/713902350.db2.gz	GQFJIGADVMUDIX-NSHDSACASA-N	1	1	303.156	1.691	20	5		DDBDMO
C[N@@H+](CC[N+](=O)[O-])C[C@H](O)c1cccc(Br)c1	ZINC000930715232	713902351	/nfs/dbraw/zinc/90/23/51/713902351.db2.gz	GQFJIGADVMUDIX-NSHDSACASA-N	1	1	303.156	1.691	20	5		DDBDMO
CC(C)[N@@H+](C)Cc1cc(O[C@H]2CCN(CC[N+](=O)[O-])C2)ccn1	ZINC000931095724	714000186	/nfs/dbraw/zinc/00/01/86/714000186.db2.gz	ZIPZVSWCJNWQLT-INIZCTEOSA-N	1	1	322.409	1.652	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNC[C@H]2CC[N@@H+]2C2CCOCC2)c1	ZINC000922951626	714196239	/nfs/dbraw/zinc/19/62/39/714196239.db2.gz	PYPULANVHDVEGZ-MRXNPFEDSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNC[C@H]2CC[N@H+]2C2CCOCC2)c1	ZINC000922951626	714196241	/nfs/dbraw/zinc/19/62/41/714196241.db2.gz	PYPULANVHDVEGZ-MRXNPFEDSA-N	1	1	305.378	1.938	20	5		DDBDMO
C[C@H]1C[N@@H+](CC[N+](=O)[O-])CC[C@H]1CNC(=O)OC(C)(C)C	ZINC000932710162	714394995	/nfs/dbraw/zinc/39/49/95/714394995.db2.gz	LFXLZLXKEMBGPC-RYUDHWBXSA-N	1	1	301.387	1.746	20	5		DDBDMO
CCC1(CC)CNC(=O)[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1OC	ZINC000933287676	714554825	/nfs/dbraw/zinc/55/48/25/714554825.db2.gz	YMUSHDGWHWAXPX-CQSZACIVSA-N	1	1	321.377	1.998	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000933438650	714589276	/nfs/dbraw/zinc/58/92/76/714589276.db2.gz	BGSBDSMFPFMONP-ZYHUDNBSSA-N	1	1	309.370	1.041	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H]2C2OCCO2)c1	ZINC000933900316	714696597	/nfs/dbraw/zinc/69/65/97/714696597.db2.gz	JIUMPIXXMAFMMM-ZIAGYGMSSA-N	1	1	308.334	1.466	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]2C2OCCO2)c1	ZINC000933900316	714696599	/nfs/dbraw/zinc/69/65/99/714696599.db2.gz	JIUMPIXXMAFMMM-ZIAGYGMSSA-N	1	1	308.334	1.466	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2CC[C@@H]2OC)c1	ZINC000934104977	714741993	/nfs/dbraw/zinc/74/19/93/714741993.db2.gz	APFMXUDUWLBOLA-KBPBESRZSA-N	1	1	308.334	1.991	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2CC[C@@H]2OC)c1	ZINC000934104977	714741994	/nfs/dbraw/zinc/74/19/94/714741994.db2.gz	APFMXUDUWLBOLA-KBPBESRZSA-N	1	1	308.334	1.991	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120308	714747320	/nfs/dbraw/zinc/74/73/20/714747320.db2.gz	SXFWWODOEKMBNS-UONOGXRCSA-N	1	1	307.350	1.667	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000934120308	714747318	/nfs/dbraw/zinc/74/73/18/714747318.db2.gz	SXFWWODOEKMBNS-UONOGXRCSA-N	1	1	307.350	1.667	20	5		DDBDMO
Cc1cc(Cl)nc(N2C[C@H]3OCC[N@H+](C)[C@H]3C2)c1[N+](=O)[O-]	ZINC001164665841	719384902	/nfs/dbraw/zinc/38/49/02/719384902.db2.gz	IWTBKWUDDFDAPD-VHSXEESVSA-N	1	1	312.757	1.471	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(N2C[C@H]3OCC[N@H+](C)[C@H]3C2)nc1Cl	ZINC001164664946	719385307	/nfs/dbraw/zinc/38/53/07/719385307.db2.gz	DAHCHOGOLPNYCK-WDEREUQCSA-N	1	1	312.757	1.471	20	5		DDBDMO
Cc1nc(N2CC[NH+](C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC000610754495	721901106	/nfs/dbraw/zinc/90/11/06/721901106.db2.gz	HWGWAHPWXSQZQW-CYBMUJFWSA-N	1	1	306.366	1.599	20	5		DDBDMO
O=[N+]([O-])c1cc(F)cnc1N1CC[NH+](C[C@@H]2CCCO2)CC1	ZINC000601101241	721904116	/nfs/dbraw/zinc/90/41/16/721904116.db2.gz	VICQXJUDMWTTFJ-LBPRGKRZSA-N	1	1	310.329	1.430	20	5		DDBDMO
COc1c(O)ccc(C[NH2+][C@@H]2COCC[C@H]2OC)c1[N+](=O)[O-]	ZINC001184011352	743956225	/nfs/dbraw/zinc/95/62/25/743956225.db2.gz	AFHFZIPYKLYYGH-ZYHUDNBSSA-N	1	1	312.322	1.203	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3C[C@H](CO)[C@@H](CCO)C3)nc2c1	ZINC001198754690	747599659	/nfs/dbraw/zinc/59/96/59/747599659.db2.gz	VLPXWCDZUSVHHR-WDEREUQCSA-N	1	1	321.333	1.159	20	5		DDBDMO
O=C(C1CCC1)N1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169028398	762185805	/nfs/dbraw/zinc/18/58/05/762185805.db2.gz	RXQPQMCMDXHHPY-DZGCQCFKSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045530	762186251	/nfs/dbraw/zinc/18/62/51/762186251.db2.gz	JKJJQMCRXRNLCL-IUODEOHRSA-N	1	1	320.393	1.996	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2Cc3cnn(C4CCOCC4)c3C2)C1	ZINC001169045530	762186255	/nfs/dbraw/zinc/18/62/55/762186255.db2.gz	JKJJQMCRXRNLCL-IUODEOHRSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCOC[C@@H]1C[N@@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017579	762197690	/nfs/dbraw/zinc/19/76/90/762197690.db2.gz	AQTYZTMBLRVMQE-HZSPNIEDSA-N	1	1	322.409	1.801	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2ncn(C)c21	ZINC001169017579	762197692	/nfs/dbraw/zinc/19/76/92/762197692.db2.gz	AQTYZTMBLRVMQE-HZSPNIEDSA-N	1	1	322.409	1.801	20	5		DDBDMO
C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCN1C	ZINC000823784948	758361285	/nfs/dbraw/zinc/36/12/85/758361285.db2.gz	UIEZYFQHNVDZSL-IINYFYTJSA-N	1	1	324.356	1.098	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)s1	ZINC001020140435	760614969	/nfs/dbraw/zinc/61/49/69/760614969.db2.gz	HJMPVZHFRMERQI-AAVRWANBSA-N	1	1	323.418	1.767	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)NCCNc1cccc(F)c1[N+](=O)[O-]	ZINC001093673958	774987852	/nfs/dbraw/zinc/98/78/52/774987852.db2.gz	FRESNCSMDYLTLB-UHFFFAOYSA-N	1	1	312.345	1.602	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ccc([N+](=O)[O-])c(C)n1	ZINC001093788300	775079760	/nfs/dbraw/zinc/07/97/60/775079760.db2.gz	XVAUONSLKFTMQG-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
NC(=O)[C@H]1C[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1	ZINC001172918305	776930791	/nfs/dbraw/zinc/93/07/91/776930791.db2.gz	AQYYADJFOYGECL-DZGCQCFKSA-N	1	1	319.361	1.028	20	5		DDBDMO
O=C(NCC1([NH2+]Cc2ccon2)CCCCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001115530871	780217530	/nfs/dbraw/zinc/21/75/30/780217530.db2.gz	WDQATYZQBZUIOA-CHWSQXEVSA-N	1	1	322.365	1.249	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)[nH]n1	ZINC001116445205	780509804	/nfs/dbraw/zinc/50/98/04/780509804.db2.gz	QAPKZHKOTJHMBK-NSHDSACASA-N	1	1	302.338	1.708	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)[nH]n1	ZINC001116445205	780509811	/nfs/dbraw/zinc/50/98/11/780509811.db2.gz	QAPKZHKOTJHMBK-NSHDSACASA-N	1	1	302.338	1.708	20	5		DDBDMO
CCc1[nH+]ccn1CCNC(=O)c1cccc([N+](=O)[O-])c1N	ZINC001154615276	861284935	/nfs/dbraw/zinc/28/49/35/861284935.db2.gz	DHZZAJOYLZHUGG-UHFFFAOYSA-N	1	1	303.322	1.366	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+]1C1CCCCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC001152052966	863135514	/nfs/dbraw/zinc/13/55/14/863135514.db2.gz	KXPBCSXWNDWWLS-LBPRGKRZSA-N	1	1	321.381	1.845	20	5		DDBDMO
COc1nc(NCc2ccc(N)[nH+]c2C)nc(OC)c1[N+](=O)[O-]	ZINC001156980942	863494947	/nfs/dbraw/zinc/49/49/47/863494947.db2.gz	QANYJBAQJJMESE-UHFFFAOYSA-N	1	1	320.309	1.300	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H]([N@@H+](C)C(C)C)C2)n1	ZINC001157022494	863522859	/nfs/dbraw/zinc/52/28/59/863522859.db2.gz	YBOWPDKBMJIRFC-LLVKDONJSA-N	1	1	322.365	1.695	20	5		DDBDMO
COc1nc(C)c([N+](=O)[O-])c(N2C[C@H]3CCC[N@@H+](C)[C@H]3C2)n1	ZINC001157263709	863690579	/nfs/dbraw/zinc/69/05/79/863690579.db2.gz	BLGDZVAIBDNVEI-MNOVXSKESA-N	1	1	307.354	1.232	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)c1[N+](=O)[O-]	ZINC001333928906	867163693	/nfs/dbraw/zinc/16/36/93/867163693.db2.gz	CHOLDMWUMQRXEE-SDDRHHMPSA-N	1	1	321.381	1.429	20	5		DDBDMO
CC(=O)Nc1ccc(NC[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162689651	867739310	/nfs/dbraw/zinc/73/93/10/867739310.db2.gz	LUIQTPSXXDXGTG-LBPRGKRZSA-N	1	1	308.338	1.296	20	5		DDBDMO
CC(=O)Nc1ccc(NC[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC001162689651	867739315	/nfs/dbraw/zinc/73/93/15/867739315.db2.gz	LUIQTPSXXDXGTG-LBPRGKRZSA-N	1	1	308.338	1.296	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])cc1NCC[C@@H]1CCC[N@@H+](C)C1	ZINC001165300383	869506656	/nfs/dbraw/zinc/50/66/56/869506656.db2.gz	NECLSNOBVCLYKB-NSHDSACASA-N	1	1	322.365	1.920	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3nc4ccccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC001338161458	869842143	/nfs/dbraw/zinc/84/21/43/869842143.db2.gz	CNOLYLVQGTYZJV-QJPTWQEYSA-N	1	1	301.350	1.995	20	5		DDBDMO
Cc1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc(C)[nH+]1	ZINC001341855966	871858175	/nfs/dbraw/zinc/85/81/75/871858175.db2.gz	JMDZFBVCXUZTGO-UHFFFAOYSA-N	1	1	303.322	1.599	20	5		DDBDMO
COc1c(C(=O)NC[C@@H]2CCCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC001347505044	874165682	/nfs/dbraw/zinc/16/56/82/874165682.db2.gz	UYUPAOMQENGKBS-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CCC/C=C\CC[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001227257419	882936177	/nfs/dbraw/zinc/93/61/77/882936177.db2.gz	ADEGRQLELPQJBU-ZYDHHDLOSA-N	1	1	309.410	1.979	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC001350914986	875955610	/nfs/dbraw/zinc/95/56/10/875955610.db2.gz	GAVKBMRVNSFFIJ-MRCXROJRSA-N	1	1	307.325	1.804	20	5		DDBDMO
OC[C@@H]1C[N@@H+](Cc2ccc3ccc4cccnc4c3n2)C[C@@H]1O	ZINC001232219395	886167231	/nfs/dbraw/zinc/16/72/31/886167231.db2.gz	TZIRRFBKKKXJGR-HOCLYGCPSA-N	1	1	309.369	1.568	20	5		DDBDMO
COc1ccc(C[C@H](C)N[C@@H]2CC[NH2+]C[C@H]2F)c([N+](=O)[O-])c1	ZINC001246087558	892409226	/nfs/dbraw/zinc/40/92/26/892409226.db2.gz	OZWDOPFCTPYFKC-ZLKJLUDKSA-N	1	1	311.357	1.824	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254597368	896524214	/nfs/dbraw/zinc/52/42/14/896524214.db2.gz	CTQRIKUNHMFCLN-CZUORRHYSA-N	1	1	317.389	1.862	20	5		DDBDMO
COC[C@@H](C)OC[C@@H](O)C[N@@H+](C)Cc1ccccc1[N+](=O)[O-]	ZINC000278513723	214203071	/nfs/dbraw/zinc/20/30/71/214203071.db2.gz	FJLDQMLXMSZKAJ-OCCSQVGLSA-N	1	1	312.366	1.439	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@H](n3cncn3)C2)ccc1[N+](=O)[O-]	ZINC000614420175	361846403	/nfs/dbraw/zinc/84/64/03/361846403.db2.gz	OJQPNXHSUAWEDE-LBPRGKRZSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H](n3cncn3)C2)ccc1[N+](=O)[O-]	ZINC000614420175	361846407	/nfs/dbraw/zinc/84/64/07/361846407.db2.gz	OJQPNXHSUAWEDE-LBPRGKRZSA-N	1	1	303.322	1.642	20	5		DDBDMO
C[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@@H]1CO	ZINC000305429846	231007059	/nfs/dbraw/zinc/00/70/59/231007059.db2.gz	DLDTWSBNFQCPSW-IINYFYTJSA-N	1	1	307.350	1.287	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCCNC(=O)c2ccc([N+](=O)[O-])o2)CCCO1	ZINC000278718877	214351736	/nfs/dbraw/zinc/35/17/36/214351736.db2.gz	VVNGCPSVSQBWKN-LLVKDONJSA-N	1	1	311.338	1.419	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000249500634	282161154	/nfs/dbraw/zinc/16/11/54/282161154.db2.gz	XCYWJIKYBZVUOK-RYUDHWBXSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000249500634	282161158	/nfs/dbraw/zinc/16/11/58/282161158.db2.gz	XCYWJIKYBZVUOK-RYUDHWBXSA-N	1	1	323.349	1.005	20	5		DDBDMO
CO[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000451565649	231126572	/nfs/dbraw/zinc/12/65/72/231126572.db2.gz	LMYGYWPNHWHDKR-WFASDCNBSA-N	1	1	321.377	1.914	20	5		DDBDMO
CO[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000451565649	231126575	/nfs/dbraw/zinc/12/65/75/231126575.db2.gz	LMYGYWPNHWHDKR-WFASDCNBSA-N	1	1	321.377	1.914	20	5		DDBDMO
CC[N@H+]1CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000286637324	219097934	/nfs/dbraw/zinc/09/79/34/219097934.db2.gz	SWQZTFPDSBMQKO-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000286637324	219097937	/nfs/dbraw/zinc/09/79/37/219097937.db2.gz	SWQZTFPDSBMQKO-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000286637324	219097939	/nfs/dbraw/zinc/09/79/39/219097939.db2.gz	SWQZTFPDSBMQKO-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CNC(=O)[C@@H](C)C[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444650328	529894901	/nfs/dbraw/zinc/89/49/01/529894901.db2.gz	MUZFMKZKHFNLKB-VIFPVBQESA-N	1	1	305.338	1.285	20	5		DDBDMO
CN(c1ncc([N+](=O)[O-])cc1C(N)=O)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000286374111	282344908	/nfs/dbraw/zinc/34/49/08/282344908.db2.gz	MTSLGUMMMJZQHL-ZACCUICWSA-N	1	1	319.365	1.150	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000299605314	530055894	/nfs/dbraw/zinc/05/58/94/530055894.db2.gz	YCZGWUDRDWCSAS-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000330780626	232062082	/nfs/dbraw/zinc/06/20/82/232062082.db2.gz	XEMGCJOGLCJIGR-VIFPVBQESA-N	1	1	307.354	1.017	20	5		DDBDMO
C[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612904	210013268	/nfs/dbraw/zinc/01/32/68/210013268.db2.gz	ZPOUCBKJMFAFRX-CMPLNLGQSA-N	1	1	305.334	1.609	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272612904	210013270	/nfs/dbraw/zinc/01/32/70/210013270.db2.gz	ZPOUCBKJMFAFRX-CMPLNLGQSA-N	1	1	305.334	1.609	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851805	186193582	/nfs/dbraw/zinc/19/35/82/186193582.db2.gz	DOSKMLLLVZWTPP-RISCZKNCSA-N	1	1	307.350	1.411	20	5		DDBDMO
Cc1ccc([C@@H](C)NC(=O)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000177851805	186193583	/nfs/dbraw/zinc/19/35/83/186193583.db2.gz	DOSKMLLLVZWTPP-RISCZKNCSA-N	1	1	307.350	1.411	20	5		DDBDMO
CC(C)NC(=O)NCC[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000564904424	304025038	/nfs/dbraw/zinc/02/50/38/304025038.db2.gz	DXGGOJRYMPXCLP-UHFFFAOYSA-N	1	1	308.382	1.777	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000041423026	352307261	/nfs/dbraw/zinc/30/72/61/352307261.db2.gz	XMUKVDFFYHCZOU-UHFFFAOYSA-N	1	1	309.366	1.601	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000172894016	198164446	/nfs/dbraw/zinc/16/44/46/198164446.db2.gz	IHRBWDGWUBJIFT-LBPRGKRZSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1	ZINC000172894016	198164447	/nfs/dbraw/zinc/16/44/47/198164447.db2.gz	IHRBWDGWUBJIFT-LBPRGKRZSA-N	1	1	323.349	1.271	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000052295644	352607309	/nfs/dbraw/zinc/60/73/09/352607309.db2.gz	FJLUDMLXANVDOA-UHFFFAOYSA-N	1	1	317.349	1.642	20	5		DDBDMO
CCC[N@H+](CCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000059018959	352860318	/nfs/dbraw/zinc/86/03/18/352860318.db2.gz	MTQOKUKEBIDROX-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
CCC[N@@H+](CCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000059018959	352860320	/nfs/dbraw/zinc/86/03/20/352860320.db2.gz	MTQOKUKEBIDROX-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
C[N@@H+]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000358562894	299198709	/nfs/dbraw/zinc/19/87/09/299198709.db2.gz	AJFOMDDOBZUNFW-VIFPVBQESA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CC[C@H](NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])C1	ZINC000358562894	299198712	/nfs/dbraw/zinc/19/87/12/299198712.db2.gz	AJFOMDDOBZUNFW-VIFPVBQESA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000073811937	353272084	/nfs/dbraw/zinc/27/20/84/353272084.db2.gz	FOAUTBUMBSDAAO-ZDUSSCGKSA-N	1	1	306.366	1.531	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000174285706	198315439	/nfs/dbraw/zinc/31/54/39/198315439.db2.gz	IBVQYERAMSWKOL-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000174285706	198315442	/nfs/dbraw/zinc/31/54/42/198315442.db2.gz	IBVQYERAMSWKOL-NWDGAFQWSA-N	1	1	307.350	1.122	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074321170	353306584	/nfs/dbraw/zinc/30/65/84/353306584.db2.gz	IBNWUIPUGGONBL-GFCCVEGCSA-N	1	1	321.381	1.430	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H](C[N@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074321170	353306586	/nfs/dbraw/zinc/30/65/86/353306586.db2.gz	IBNWUIPUGGONBL-GFCCVEGCSA-N	1	1	321.381	1.430	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H](C[N@@H+](C)CC3CC3)C2)c1[N+](=O)[O-]	ZINC000074321170	353306589	/nfs/dbraw/zinc/30/65/89/353306589.db2.gz	IBNWUIPUGGONBL-GFCCVEGCSA-N	1	1	321.381	1.430	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2ncc(C)cc2[N+](=O)[O-])CC1	ZINC000078632330	353526298	/nfs/dbraw/zinc/52/62/98/353526298.db2.gz	NUZWKKBGCFDBRE-AWEZNQCLSA-N	1	1	321.425	1.984	20	5		DDBDMO
CCc1nn(C)c(N2CC[C@@H](C[NH+]3CCOCC3)C2)c1[N+](=O)[O-]	ZINC000092830322	353872198	/nfs/dbraw/zinc/87/21/98/353872198.db2.gz	QMHWYSPODQFSNS-LBPRGKRZSA-N	1	1	323.397	1.049	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000139638909	354130997	/nfs/dbraw/zinc/13/09/97/354130997.db2.gz	CASWZTAWUYCYKL-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000176868404	198631543	/nfs/dbraw/zinc/63/15/43/198631543.db2.gz	NKLJEFKFQBVKBO-QWRGUYRKSA-N	1	1	306.366	1.732	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C[C@H](O)C1CC1	ZINC000305690721	354470790	/nfs/dbraw/zinc/47/07/90/354470790.db2.gz	BBWCUSVSXPPPPV-AWEZNQCLSA-N	1	1	307.350	1.626	20	5		DDBDMO
CCOc1cc(NC[C@H]2C[N@@H+](C)CCN2C)ccc1[N+](=O)[O-]	ZINC000315929281	354498194	/nfs/dbraw/zinc/49/81/94/354498194.db2.gz	XBVVVJCUJJRXFL-ZDUSSCGKSA-N	1	1	308.382	1.651	20	5		DDBDMO
CN1C[C@H]2CC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000590011976	355040235	/nfs/dbraw/zinc/04/02/35/355040235.db2.gz	NSJXUWKXIVKKHC-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@@H+]1C[C@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000590011976	355040238	/nfs/dbraw/zinc/04/02/38/355040238.db2.gz	NSJXUWKXIVKKHC-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(CCCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000590011976	355040239	/nfs/dbraw/zinc/04/02/39/355040239.db2.gz	NSJXUWKXIVKKHC-CJNGLKHVSA-N	1	1	305.378	2.000	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)[C@@H]2C1	ZINC000590445474	355098875	/nfs/dbraw/zinc/09/88/75/355098875.db2.gz	MYSYZPLZJCWVOV-MEBBXXQBSA-N	1	1	314.345	1.852	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000591083761	355245653	/nfs/dbraw/zinc/24/56/53/355245653.db2.gz	DPLHDZOLGYCNDL-SLBVQIDZSA-N	1	1	315.373	1.861	20	5		DDBDMO
CC(C)O[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000593055710	355781465	/nfs/dbraw/zinc/78/14/65/355781465.db2.gz	NEUBJXSYZHWDBN-AWEZNQCLSA-N	1	1	309.366	1.646	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593679313	355964635	/nfs/dbraw/zinc/96/46/35/355964635.db2.gz	KQCICCCUHHGJTF-KYTCBBFDSA-N	1	1	317.389	1.749	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC([N@H+]3CC[C@@H](O)C3)C2)c(Cl)c1	ZINC000593680421	355965863	/nfs/dbraw/zinc/96/58/63/355965863.db2.gz	VNAIJCKOTBLMIZ-CYBMUJFWSA-N	1	1	311.769	1.499	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)n1	ZINC000594198977	356138583	/nfs/dbraw/zinc/13/85/83/356138583.db2.gz	WXAPPBXZEBOZSJ-MNOVXSKESA-N	1	1	307.354	1.075	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594419786	356204716	/nfs/dbraw/zinc/20/47/16/356204716.db2.gz	RLEVQTSVLOLULK-OLZOCXBDSA-N	1	1	318.377	1.924	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNC2CC[NH+]([C@@H]3CCOC3)CC2)c1	ZINC000594494140	356237547	/nfs/dbraw/zinc/23/75/47/356237547.db2.gz	UXTSHWZWUMVWFW-MRXNPFEDSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccc(OC2C[NH+](C[C@]3(O)CCCOC3)C2)cc1	ZINC000594714291	356293985	/nfs/dbraw/zinc/29/39/85/356293985.db2.gz	LXXXJDYRGOSXQL-OAHLLOKOSA-N	1	1	308.334	1.199	20	5		DDBDMO
CCCC[N@@H+](C)CCNS(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594753104	356307539	/nfs/dbraw/zinc/30/75/39/356307539.db2.gz	FZVUHQXFRZOFQF-UHFFFAOYSA-N	1	1	316.383	1.000	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2CC[NH2+][C@H](C)C2)c(F)cc1[N+](=O)[O-]	ZINC000601337277	358504446	/nfs/dbraw/zinc/50/44/46/358504446.db2.gz	AJXYNQHOSUHPTM-SECBINFHSA-N	1	1	317.342	1.025	20	5		DDBDMO
COC(=O)C[N@H+](CCn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000595664865	356599258	/nfs/dbraw/zinc/59/92/58/356599258.db2.gz	SUOPJEQCKPAYGQ-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
COC(=O)C[N@@H+](CCn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000595664865	356599262	/nfs/dbraw/zinc/59/92/62/356599262.db2.gz	SUOPJEQCKPAYGQ-UHFFFAOYSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[NH+]1C[C@@H](C)C(O)[C@H](C)C1	ZINC000595741694	356631134	/nfs/dbraw/zinc/63/11/34/356631134.db2.gz	DBUWNENQQZKHKS-UTUOFQBUSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595745024	356631863	/nfs/dbraw/zinc/63/18/63/356631863.db2.gz	NWTKNHQNKCMWPL-OZTPJHRESA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595745024	356631868	/nfs/dbraw/zinc/63/18/68/356631868.db2.gz	NWTKNHQNKCMWPL-OZTPJHRESA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595745026	356632700	/nfs/dbraw/zinc/63/27/00/356632700.db2.gz	NWTKNHQNKCMWPL-ZAZJYDDPSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595745026	356632704	/nfs/dbraw/zinc/63/27/04/356632704.db2.gz	NWTKNHQNKCMWPL-ZAZJYDDPSA-N	1	1	321.377	1.871	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2NC(=O)CC[C@H]2C1	ZINC000595728811	356624982	/nfs/dbraw/zinc/62/49/82/356624982.db2.gz	PGGNRDWJKMDCQK-FZMZJTMJSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595765015	356643333	/nfs/dbraw/zinc/64/33/33/356643333.db2.gz	GBQVTPNZQZGZDI-SMDDNHRTSA-N	1	1	319.361	1.329	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595760054	356641094	/nfs/dbraw/zinc/64/10/94/356641094.db2.gz	RWXVRWRSACDOHN-WBMJQRKESA-N	1	1	319.361	1.810	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595760054	356641095	/nfs/dbraw/zinc/64/10/95/356641095.db2.gz	RWXVRWRSACDOHN-WBMJQRKESA-N	1	1	319.361	1.810	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC3(COC3)C2)c1	ZINC000595835396	356671437	/nfs/dbraw/zinc/67/14/37/356671437.db2.gz	PBWNQLQXYMITQG-ZDUSSCGKSA-N	1	1	308.334	1.057	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+]2CC[C@@H]3COC[C@@H]3C2)c2c(c1)COCO2	ZINC000595830710	356667945	/nfs/dbraw/zinc/66/79/45/356667945.db2.gz	LGUJHLHFENSEBX-RISCZKNCSA-N	1	1	320.345	1.930	20	5		DDBDMO
C[NH2+]C1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1	ZINC000237140838	202163523	/nfs/dbraw/zinc/16/35/23/202163523.db2.gz	HPRPFMGPCLCSJB-UHFFFAOYSA-N	1	1	303.322	1.295	20	5		DDBDMO
Cc1[nH+]ccn1CCCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596137796	356788187	/nfs/dbraw/zinc/78/81/87/356788187.db2.gz	XDFZNWOHTDKHKD-UHFFFAOYSA-N	1	1	303.322	1.701	20	5		DDBDMO
COC1CC[NH+](CCNc2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000596160451	356796803	/nfs/dbraw/zinc/79/68/03/356796803.db2.gz	WFTLWHGXLMBIAQ-UHFFFAOYSA-N	1	1	314.773	1.588	20	5		DDBDMO
CCN(C(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000596209672	356815496	/nfs/dbraw/zinc/81/54/96/356815496.db2.gz	BAZICVRZUKBSFR-AWEZNQCLSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@@H](C)CO1	ZINC000596432695	356879105	/nfs/dbraw/zinc/87/91/05/356879105.db2.gz	RTUXGABZVDQRSF-WDEREUQCSA-N	1	1	324.381	1.190	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@@H](C)CO1	ZINC000596432695	356879107	/nfs/dbraw/zinc/87/91/07/356879107.db2.gz	RTUXGABZVDQRSF-WDEREUQCSA-N	1	1	324.381	1.190	20	5		DDBDMO
CC1(C)Cc2n[nH]cc2C[N@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000596599707	356930172	/nfs/dbraw/zinc/93/01/72/356930172.db2.gz	WPCQLHVQQVHNMP-UHFFFAOYSA-N	1	1	304.354	1.599	20	5		DDBDMO
Cc1[nH+]cc(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1C	ZINC000596979778	357033338	/nfs/dbraw/zinc/03/33/38/357033338.db2.gz	OFGTWVFIUFXHAU-UHFFFAOYSA-N	1	1	316.365	1.354	20	5		DDBDMO
COC(=O)c1ccnc(N[C@@H](C)C[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000598626725	357660649	/nfs/dbraw/zinc/66/06/49/357660649.db2.gz	HHNRPKVIMDXJDY-JTQLQIEISA-N	1	1	310.354	1.917	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598647154	357669197	/nfs/dbraw/zinc/66/91/97/357669197.db2.gz	CEBZUTZWMUNWBW-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H](C)[C@@H](CO)C1	ZINC000598647154	357669201	/nfs/dbraw/zinc/66/92/01/357669201.db2.gz	CEBZUTZWMUNWBW-JHJVBQTASA-N	1	1	321.377	1.872	20	5		DDBDMO
COC(=O)CCCC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000599325621	357895140	/nfs/dbraw/zinc/89/51/40/357895140.db2.gz	HXQXQTYZYXMGSU-GFCCVEGCSA-N	1	1	322.365	1.819	20	5		DDBDMO
NS(=O)(=O)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000179520517	199049231	/nfs/dbraw/zinc/04/92/31/199049231.db2.gz	XRNIGYMYXRVINK-UHFFFAOYSA-N	1	1	313.379	1.238	20	5		DDBDMO
Cc1n[nH]cc1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000179535242	199051829	/nfs/dbraw/zinc/05/18/29/199051829.db2.gz	QMUZPOVRQPULBN-UHFFFAOYSA-N	1	1	301.350	1.949	20	5		DDBDMO
C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599652486	358008771	/nfs/dbraw/zinc/00/87/71/358008771.db2.gz	NFGKZWFTSHIWBC-WAAGHKOSSA-N	1	1	303.322	1.167	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000599907085	358078207	/nfs/dbraw/zinc/07/82/07/358078207.db2.gz	KSOHLEIRRHCQEL-UHFFFAOYSA-N	1	1	302.334	1.801	20	5		DDBDMO
O=[N+]([O-])c1ccc2nccc(N3CCC[N@H+](CCO)CC3)c2c1	ZINC000601115032	358408352	/nfs/dbraw/zinc/40/83/52/358408352.db2.gz	XWSPAHMRYVDZED-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CCC[N@@H+](C)CC1	ZINC000601100605	358401923	/nfs/dbraw/zinc/40/19/23/358401923.db2.gz	VXSLREOSNYJULS-UHFFFAOYSA-N	1	1	307.276	1.489	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCCN1c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000601189386	358440030	/nfs/dbraw/zinc/44/00/30/358440030.db2.gz	QPAQAWFKLAFQHS-LLVKDONJSA-N	1	1	306.366	1.614	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000181066803	199247550	/nfs/dbraw/zinc/24/75/50/199247550.db2.gz	VQYLMASHKWVQSF-LLVKDONJSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](O)C[C@@]1(C)CO	ZINC000602910677	359288785	/nfs/dbraw/zinc/28/87/85/359288785.db2.gz	YSPOIBZRKHUVFW-ZBFHGGJFSA-N	1	1	324.377	1.700	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](O)C[C@@]1(C)CO	ZINC000602910677	359288789	/nfs/dbraw/zinc/28/87/89/359288789.db2.gz	YSPOIBZRKHUVFW-ZBFHGGJFSA-N	1	1	324.377	1.700	20	5		DDBDMO
C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1CCO	ZINC000187688144	200145140	/nfs/dbraw/zinc/14/51/40/200145140.db2.gz	LFKFMYYOLJLXNB-NSHDSACASA-N	1	1	313.785	1.747	20	5		DDBDMO
CN1CCC([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000609802169	360351476	/nfs/dbraw/zinc/35/14/76/360351476.db2.gz	BZFHBTDBOUNCKP-CYBMUJFWSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[NH+]1CCC(N2CC[C@@H](Nc3ccc([N+](=O)[O-])nc3)C2)CC1	ZINC000609802169	360351477	/nfs/dbraw/zinc/35/14/77/360351477.db2.gz	BZFHBTDBOUNCKP-CYBMUJFWSA-N	1	1	305.382	1.570	20	5		DDBDMO
C[N@H+]1CC[C@H](C(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1	ZINC000610070454	360377808	/nfs/dbraw/zinc/37/78/08/360377808.db2.gz	AHJHMTNPUKMGBC-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](CCO)C1	ZINC000610213582	360392067	/nfs/dbraw/zinc/39/20/67/360392067.db2.gz	GZVRRJWHIHJNHP-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](CCO)C1	ZINC000610213582	360392069	/nfs/dbraw/zinc/39/20/69/360392069.db2.gz	GZVRRJWHIHJNHP-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
COC[C@@H]1CCC[N@@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610615504	360482149	/nfs/dbraw/zinc/48/21/49/360482149.db2.gz	HSXPCRDSACSXGE-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000610615504	360482154	/nfs/dbraw/zinc/48/21/54/360482154.db2.gz	HSXPCRDSACSXGE-AWEZNQCLSA-N	1	1	319.361	1.595	20	5		DDBDMO
COCC1([N@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1	ZINC000611178734	360650735	/nfs/dbraw/zinc/65/07/35/360650735.db2.gz	LBDCIXYETYVRHL-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
COCC1([N@@H+](C)CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1	ZINC000611178734	360650738	/nfs/dbraw/zinc/65/07/38/360650738.db2.gz	LBDCIXYETYVRHL-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1C	ZINC000611088054	360618911	/nfs/dbraw/zinc/61/89/11/360618911.db2.gz	AQCFRFFLOIEQKD-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C[C@H]1C	ZINC000611088054	360618914	/nfs/dbraw/zinc/61/89/14/360618914.db2.gz	AQCFRFFLOIEQKD-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C	ZINC000611092510	360621291	/nfs/dbraw/zinc/62/12/91/360621291.db2.gz	WSYSCHAEXGWCKF-ZDUSSCGKSA-N	1	1	320.393	1.584	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC[N@@H+](C[C@H]2CCCO2)CC1	ZINC000611296530	360693162	/nfs/dbraw/zinc/69/31/62/360693162.db2.gz	OBTRIUBXJWHWSQ-OAHLLOKOSA-N	1	1	320.393	1.989	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000611561472	360759956	/nfs/dbraw/zinc/75/99/56/360759956.db2.gz	JKYVDYALLWVJPW-MNOVXSKESA-N	1	1	308.334	1.569	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@H]2C1	ZINC000618763285	363753407	/nfs/dbraw/zinc/75/34/07/363753407.db2.gz	IQVCYOQWVBQAOO-PHIMTYICSA-N	1	1	302.334	1.729	20	5		DDBDMO
CN(C)CC[NH+]1CCC(Nc2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000193384463	201043351	/nfs/dbraw/zinc/04/33/51/201043351.db2.gz	DXWIBLTZMSNBKB-UHFFFAOYSA-N	1	1	307.398	1.615	20	5		DDBDMO
CCC[N@H+]1CC[C@H](CNc2cc(N)c([N+](=O)[O-])c(CO)c2)C1	ZINC000613919919	361631702	/nfs/dbraw/zinc/63/17/02/361631702.db2.gz	YRUPOGBSJVXKLP-LLVKDONJSA-N	1	1	308.382	1.813	20	5		DDBDMO
C[C@@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000249732995	202812916	/nfs/dbraw/zinc/81/29/16/202812916.db2.gz	BSDYXMVATFXHMZ-XQQFMLRXSA-N	1	1	323.397	1.274	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000349774540	284047852	/nfs/dbraw/zinc/04/78/52/284047852.db2.gz	IKSMEBMMOAPEGN-NSHDSACASA-N	1	1	315.395	1.602	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000261893666	203145826	/nfs/dbraw/zinc/14/58/26/203145826.db2.gz	FWFOWWCLUNEZEA-GFCCVEGCSA-N	1	1	318.358	1.838	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000350036449	284136526	/nfs/dbraw/zinc/13/65/26/284136526.db2.gz	USLMFHBIQUFAHK-UHFFFAOYSA-N	1	1	311.386	1.375	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCCC[N@@H+](C)C(C)C)c1[N+](=O)[O-]	ZINC000264593991	204016690	/nfs/dbraw/zinc/01/66/90/204016690.db2.gz	GDMNGTQCMLKAJL-UHFFFAOYSA-N	1	1	311.386	1.731	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000282495212	217039244	/nfs/dbraw/zinc/03/92/44/217039244.db2.gz	MXTIWGWHJQHXDP-GFCCVEGCSA-N	1	1	311.357	1.886	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1	ZINC000288403712	220135933	/nfs/dbraw/zinc/13/59/33/220135933.db2.gz	LHQIHRJATASARS-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1	ZINC000288403712	220135935	/nfs/dbraw/zinc/13/59/35/220135935.db2.gz	LHQIHRJATASARS-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000288484433	220171900	/nfs/dbraw/zinc/17/19/00/220171900.db2.gz	PLSCFGJPNHVFSX-LBPRGKRZSA-N	1	1	307.350	1.526	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H]2[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000284795935	218180915	/nfs/dbraw/zinc/18/09/15/218180915.db2.gz	OGZBJKJROSBOJF-DZGCQCFKSA-N	1	1	319.361	1.837	20	5		DDBDMO
COc1ccc(C[N@H+]2CCCC[C@H]2CC(N)=O)cc1[N+](=O)[O-]	ZINC000339137939	250309662	/nfs/dbraw/zinc/30/96/62/250309662.db2.gz	XMHMPHJXGROSAX-LBPRGKRZSA-N	1	1	307.350	1.833	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000106786755	194251927	/nfs/dbraw/zinc/25/19/27/194251927.db2.gz	JXKQSIOHIHFUAJ-LLVKDONJSA-N	1	1	321.381	1.383	20	5		DDBDMO
CC(C)C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])[nH]1)[NH+]1CCOCC1	ZINC000340586393	251124002	/nfs/dbraw/zinc/12/40/02/251124002.db2.gz	WEAVPNZPWJMCKP-LBPRGKRZSA-N	1	1	324.381	1.400	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917675	251275965	/nfs/dbraw/zinc/27/59/65/251275965.db2.gz	UWDBFHJLMILHSN-CABZTGNLSA-N	1	1	304.306	1.600	20	5		DDBDMO
C[C@H]1C[C@H](O)C[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000340917675	251275968	/nfs/dbraw/zinc/27/59/68/251275968.db2.gz	UWDBFHJLMILHSN-CABZTGNLSA-N	1	1	304.306	1.600	20	5		DDBDMO
CC1CC[NH+](CCNC(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000269104864	207242966	/nfs/dbraw/zinc/24/29/66/207242966.db2.gz	BBAHSMBQLIWJJW-UHFFFAOYSA-N	1	1	307.350	1.762	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[NH2+]C1	ZINC000269159270	207283654	/nfs/dbraw/zinc/28/36/54/207283654.db2.gz	APJHZENUJBSFQX-VHSXEESVSA-N	1	1	317.349	1.589	20	5		DDBDMO
Cc1cc(C(=O)NCC[NH+]2CCSCC2)ccc1[N+](=O)[O-]	ZINC000352382844	285011192	/nfs/dbraw/zinc/01/11/92/285011192.db2.gz	SUHYNTOXTXSPGI-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
COc1cc(C[N@@H+]2CCCN(C(N)=O)CC2)ccc1[N+](=O)[O-]	ZINC000352405601	285029140	/nfs/dbraw/zinc/02/91/40/285029140.db2.gz	NEBOIWXXRPMGBF-UHFFFAOYSA-N	1	1	308.338	1.190	20	5		DDBDMO
COc1cc(C[N@H+]2CCCN(C(N)=O)CC2)ccc1[N+](=O)[O-]	ZINC000352405601	285029143	/nfs/dbraw/zinc/02/91/43/285029143.db2.gz	NEBOIWXXRPMGBF-UHFFFAOYSA-N	1	1	308.338	1.190	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC[C@H](Oc3ccncc3)C2)c1	ZINC000120191410	195115202	/nfs/dbraw/zinc/11/52/02/195115202.db2.gz	NQOXFRWBZBJENN-AWEZNQCLSA-N	1	1	303.322	1.340	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[NH+]2CCN(c3ccc(F)cc3)CC2)c1	ZINC000157335875	197180173	/nfs/dbraw/zinc/18/01/73/197180173.db2.gz	CHLHAKGNAVZDRH-UHFFFAOYSA-N	1	1	319.340	1.753	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1C[C@H](C)[N@@H+](CCO)C[C@@H]1C	ZINC000419350882	533137316	/nfs/dbraw/zinc/13/73/16/533137316.db2.gz	ZYWFAGMMRKAWIR-STQMWFEESA-N	1	1	323.393	1.490	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2nc(C)ccc2[N+](=O)[O-])CC1	ZINC000121625087	195319825	/nfs/dbraw/zinc/31/98/25/195319825.db2.gz	BFVHPNCNYMQYKK-CYBMUJFWSA-N	1	1	321.425	1.984	20	5		DDBDMO
COC(=O)[C@](C)(O)C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000451547225	533570178	/nfs/dbraw/zinc/57/01/78/533570178.db2.gz	KOXZQPCGCBWWTQ-CZUORRHYSA-N	1	1	322.361	1.698	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000046990347	407068513	/nfs/dbraw/zinc/06/85/13/407068513.db2.gz	DNFCRLQFYYLAQC-ZDUSSCGKSA-N	1	1	323.397	1.420	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000123492705	407330375	/nfs/dbraw/zinc/33/03/75/407330375.db2.gz	CFWJLSFMUFSWES-ZYHUDNBSSA-N	1	1	309.370	1.041	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCC[N@@H+]2CCCC[C@H]2C)c1[N+](=O)[O-]	ZINC000123689927	407336563	/nfs/dbraw/zinc/33/65/63/407336563.db2.gz	XGHWPKDJYVCAMC-LLVKDONJSA-N	1	1	323.397	1.631	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000108341539	407384621	/nfs/dbraw/zinc/38/46/21/407384621.db2.gz	GJQQWLLMPAUIDF-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
CN(C(=O)C[N@H+]1[C@@H]2CC[C@H]1CC(O)C2)c1ccc([N+](=O)[O-])cc1	ZINC000111320449	407407608	/nfs/dbraw/zinc/40/76/08/407407608.db2.gz	YUTGANBZJHNSPV-YIONKMFJSA-N	1	1	319.361	1.545	20	5		DDBDMO
CN(C(=O)C[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2)c1ccc([N+](=O)[O-])cc1	ZINC000111320449	407407609	/nfs/dbraw/zinc/40/76/09/407407609.db2.gz	YUTGANBZJHNSPV-YIONKMFJSA-N	1	1	319.361	1.545	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000270999644	407461547	/nfs/dbraw/zinc/46/15/47/407461547.db2.gz	YSKBSBUVENXMOG-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C[C@H]1O	ZINC000270999644	407461556	/nfs/dbraw/zinc/46/15/56/407461556.db2.gz	YSKBSBUVENXMOG-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
COC[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000265802582	407462501	/nfs/dbraw/zinc/46/25/01/407462501.db2.gz	OGFHGEREPAZNLK-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000271339260	407643187	/nfs/dbraw/zinc/64/31/87/407643187.db2.gz	CIUTTXXTHJYPHS-LLVKDONJSA-N	1	1	309.370	1.323	20	5		DDBDMO
C[C@@H]([NH3+])C1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000261865530	407646667	/nfs/dbraw/zinc/64/66/67/407646667.db2.gz	GKUBYUNEJRGWNF-SNVBAGLBSA-N	1	1	306.366	1.253	20	5		DDBDMO
CCc1n[nH]c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)c1[N+](=O)[O-]	ZINC000171397333	407681011	/nfs/dbraw/zinc/68/10/11/407681011.db2.gz	FHWBLZNPIBGIQU-SNVBAGLBSA-N	1	1	321.337	1.506	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](CN3CCOCC3)C2)c(F)c1	ZINC000267006356	407713918	/nfs/dbraw/zinc/71/39/18/407713918.db2.gz	FWUSDYFCYDSLTL-ZDUSSCGKSA-N	1	1	323.368	1.888	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000186713432	407753769	/nfs/dbraw/zinc/75/37/69/407753769.db2.gz	IISVSFPLNQNLCN-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
O=C1NCCN1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000267075145	407737966	/nfs/dbraw/zinc/73/79/66/407737966.db2.gz	WQUSRZMEQJWOGJ-UHFFFAOYSA-N	1	1	322.340	1.724	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117295017	407825095	/nfs/dbraw/zinc/82/50/95/407825095.db2.gz	WUISOKGMAHPNAD-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000117295017	407825100	/nfs/dbraw/zinc/82/51/00/407825100.db2.gz	WUISOKGMAHPNAD-ZDUSSCGKSA-N	1	1	321.377	1.696	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000133353211	407831942	/nfs/dbraw/zinc/83/19/42/407831942.db2.gz	MOUIZIYRVPZFRR-LBPRGKRZSA-N	1	1	321.381	1.090	20	5		DDBDMO
Cc1nn(C[C@H](O)C[N@H+]2CCc3ccccc3C2)cc1[N+](=O)[O-]	ZINC000179858431	407838603	/nfs/dbraw/zinc/83/86/03/407838603.db2.gz	IFLRJGCOLSEDER-OAHLLOKOSA-N	1	1	316.361	1.519	20	5		DDBDMO
O=C1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]2N1	ZINC000133487512	407850472	/nfs/dbraw/zinc/85/04/72/407850472.db2.gz	BTXKYAHKVXEELQ-CABCVRRESA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCC[C@H]2N1	ZINC000133487512	407850482	/nfs/dbraw/zinc/85/04/82/407850482.db2.gz	BTXKYAHKVXEELQ-CABCVRRESA-N	1	1	303.362	1.880	20	5		DDBDMO
CC[N@@H+](CCO)CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000118835299	407950214	/nfs/dbraw/zinc/95/02/14/407950214.db2.gz	YJIBKXRVLCQGJW-UHFFFAOYSA-N	1	1	311.338	1.246	20	5		DDBDMO
C[N@@H+]1CCO[C@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000268220548	407955098	/nfs/dbraw/zinc/95/50/98/407955098.db2.gz	JSCLGOCZHYZPJX-LBPRGKRZSA-N	1	1	313.741	1.195	20	5		DDBDMO
C[N@H+]1CCO[C@H](C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000268220548	407955104	/nfs/dbraw/zinc/95/51/04/407955104.db2.gz	JSCLGOCZHYZPJX-LBPRGKRZSA-N	1	1	313.741	1.195	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])cnc2C)C1	ZINC000174518104	407957708	/nfs/dbraw/zinc/95/77/08/407957708.db2.gz	LOYUCVCHVFAGQJ-LBPRGKRZSA-N	1	1	306.366	1.712	20	5		DDBDMO
Cc1c(CC(=O)N2CC[C@H]3CC[N@H+](C)C[C@H]32)cccc1[N+](=O)[O-]	ZINC000272520987	407961938	/nfs/dbraw/zinc/96/19/38/407961938.db2.gz	PWWGFRJQIGPQFO-CZUORRHYSA-N	1	1	317.389	1.998	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@H]1CCC[N@@H+](C)C1	ZINC000153847734	407918042	/nfs/dbraw/zinc/91/80/42/407918042.db2.gz	XWPOYHIRXDBXNN-LBPRGKRZSA-N	1	1	309.370	1.042	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NCC[N@H+](C)C(C)C)cc1[N+](=O)[O-]	ZINC000155573070	408183776	/nfs/dbraw/zinc/18/37/76/408183776.db2.gz	HHQJNGMEONOWNM-UHFFFAOYSA-N	1	1	315.395	1.522	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000246398234	408245478	/nfs/dbraw/zinc/24/54/78/408245478.db2.gz	FGQZCAKNIMSQHN-CMPLNLGQSA-N	1	1	306.366	1.589	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N(C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000269310367	408261710	/nfs/dbraw/zinc/26/17/10/408261710.db2.gz	FUMXRFWUNNWROM-UHFFFAOYSA-N	1	1	309.370	1.608	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)[C@@H]1CO	ZINC000190404578	408236927	/nfs/dbraw/zinc/23/69/27/408236927.db2.gz	YCBSFIUNHOCDRG-XHDPSFHLSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000246721809	408326046	/nfs/dbraw/zinc/32/60/46/408326046.db2.gz	LLXHPKQFPPDTPU-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000246721809	408326051	/nfs/dbraw/zinc/32/60/51/408326051.db2.gz	LLXHPKQFPPDTPU-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2[nH]nc(C(C)C)c2[N+](=O)[O-])CC1	ZINC000269327304	408270746	/nfs/dbraw/zinc/27/07/46/408270746.db2.gz	DLRKKZXPTHVDSB-UHFFFAOYSA-N	1	1	309.370	1.609	20	5		DDBDMO
CC[N@@H+]1CCCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000269327304	408270752	/nfs/dbraw/zinc/27/07/52/408270752.db2.gz	DLRKKZXPTHVDSB-UHFFFAOYSA-N	1	1	309.370	1.609	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2n[nH]c(C(C)C)c2[N+](=O)[O-])CC1	ZINC000269327304	408270755	/nfs/dbraw/zinc/27/07/55/408270755.db2.gz	DLRKKZXPTHVDSB-UHFFFAOYSA-N	1	1	309.370	1.609	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000269439047	408311146	/nfs/dbraw/zinc/31/11/46/408311146.db2.gz	DCXBPYUYZNTRRR-CQSZACIVSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000247511982	408484984	/nfs/dbraw/zinc/48/49/84/408484984.db2.gz	VTHTYBKRYNZQCH-WCQYABFASA-N	1	1	323.397	1.431	20	5		DDBDMO
C[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000248374108	408553208	/nfs/dbraw/zinc/55/32/08/408553208.db2.gz	NVWLNCNRYMMPAR-XQQFMLRXSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@@H](C)CO1	ZINC000248374108	408553211	/nfs/dbraw/zinc/55/32/11/408553211.db2.gz	NVWLNCNRYMMPAR-XQQFMLRXSA-N	1	1	310.350	1.444	20	5		DDBDMO
C[C@H](c1ccncc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000270551592	408574825	/nfs/dbraw/zinc/57/48/25/408574825.db2.gz	BLHSPPCOVNJLTH-RISCZKNCSA-N	1	1	305.338	1.240	20	5		DDBDMO
Cc1ccnc(NC[C@H](C(C)C)N2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000265196173	408575897	/nfs/dbraw/zinc/57/58/97/408575897.db2.gz	LTEZMZBQDGJXFK-CQSZACIVSA-N	1	1	321.425	1.982	20	5		DDBDMO
C[C@H](O)C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000275052572	408576515	/nfs/dbraw/zinc/57/65/15/408576515.db2.gz	TXXBRCWWMXWDHW-JTQLQIEISA-N	1	1	310.310	1.006	20	5		DDBDMO
COc1ccc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)cc1[N+](=O)[O-]	ZINC000192529527	408606621	/nfs/dbraw/zinc/60/66/21/408606621.db2.gz	PZCKQLWTBFONHC-TXEJJXNPSA-N	1	1	305.334	1.237	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000248650912	408608857	/nfs/dbraw/zinc/60/88/57/408608857.db2.gz	AHOPVGYJAVIQDY-RYUDHWBXSA-N	1	1	322.365	1.514	20	5		DDBDMO
NC(=O)c1ccc(N2CC[N@H+]3CCCC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000248783031	408633314	/nfs/dbraw/zinc/63/33/14/408633314.db2.gz	WWIRTXKAEIRAEB-LBPRGKRZSA-N	1	1	304.350	1.368	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](N2CCCC2=O)C1	ZINC000270841171	408705084	/nfs/dbraw/zinc/70/50/84/408705084.db2.gz	FFHZRDOSDQBJOY-AWEZNQCLSA-N	1	1	319.361	1.800	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](N2CCCC2=O)C1	ZINC000270841171	408705087	/nfs/dbraw/zinc/70/50/87/408705087.db2.gz	FFHZRDOSDQBJOY-AWEZNQCLSA-N	1	1	319.361	1.800	20	5		DDBDMO
O=C(c1n[nH]cc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1	ZINC000162670464	408727300	/nfs/dbraw/zinc/72/73/00/408727300.db2.gz	WGGAEJYSPPVETO-CMPLNLGQSA-N	1	1	319.365	1.407	20	5		DDBDMO
C[C@@H]1C[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@H]1O	ZINC000249568586	408743118	/nfs/dbraw/zinc/74/31/18/408743118.db2.gz	NOXJMGAIKGNBIV-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
C[C@@H]1C[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC[C@H]1O	ZINC000249568586	408743124	/nfs/dbraw/zinc/74/31/24/408743124.db2.gz	NOXJMGAIKGNBIV-KCPJHIHWSA-N	1	1	319.361	1.403	20	5		DDBDMO
CC[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000270932654	408747194	/nfs/dbraw/zinc/74/71/94/408747194.db2.gz	QIWAYYPVQJQEHU-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000270932654	408747197	/nfs/dbraw/zinc/74/71/97/408747197.db2.gz	QIWAYYPVQJQEHU-ZWNOBZJWSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC[C@H]1O	ZINC000249599047	408749014	/nfs/dbraw/zinc/74/90/14/408749014.db2.gz	XQKFUJGWWZLFAB-OSAQELSMSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1ccc([N+](=O)[O-])c2cccnc12)C1CC1	ZINC000290869316	408847757	/nfs/dbraw/zinc/84/77/57/408847757.db2.gz	ZNTBDLSLMDJGNF-GFCCVEGCSA-N	1	1	317.345	1.977	20	5		DDBDMO
C[C@H](NC(=O)c1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCC[N@H+](C2CCC2)C1	ZINC000285746221	408855684	/nfs/dbraw/zinc/85/56/84/408855684.db2.gz	HJXCSRZJABAVCB-WDEREUQCSA-N	1	1	321.381	1.701	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H](C)C1	ZINC000281842916	408940063	/nfs/dbraw/zinc/94/00/63/408940063.db2.gz	YPJZGIBJCQSNMP-MFKMUULPSA-N	1	1	307.350	1.693	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C2)C1	ZINC000292144850	408989432	/nfs/dbraw/zinc/98/94/32/408989432.db2.gz	MWPWKPACMVZBKP-MRXNPFEDSA-N	1	1	318.377	1.561	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000277690967	408993110	/nfs/dbraw/zinc/99/31/10/408993110.db2.gz	KJIPTQYKDIIJQM-QWRGUYRKSA-N	1	1	307.354	1.237	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C1(CO)CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000292257049	409010886	/nfs/dbraw/zinc/01/08/86/409010886.db2.gz	YFJGGWIJUMHMNZ-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
Cc1cc(N2CCO[C@H]3CC[N@H+](C)C[C@H]32)c(F)cc1[N+](=O)[O-]	ZINC000292701771	409039424	/nfs/dbraw/zinc/03/94/24/409039424.db2.gz	SBOMCNDSZACXGE-CABCVRRESA-N	1	1	309.341	1.952	20	5		DDBDMO
COCCO[C@@H]1C[C@H](CO)C[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1	ZINC000278398494	409079860	/nfs/dbraw/zinc/07/98/60/409079860.db2.gz	WCFCSRITTLIYLB-GOEBONIOSA-N	1	1	324.377	1.441	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000279486154	409224483	/nfs/dbraw/zinc/22/44/83/409224483.db2.gz	RENRAPWRKUQVIZ-NOZJJQNGSA-N	1	1	324.356	1.728	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000284350128	409330682	/nfs/dbraw/zinc/33/06/82/409330682.db2.gz	MFSPIUBWGDDFOX-ZWXLGZMVSA-N	1	1	319.405	1.995	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)cc1[N+](=O)[O-]	ZINC000295355974	409448916	/nfs/dbraw/zinc/44/89/16/409448916.db2.gz	ZCUKGGOLGHCGTJ-OAHLLOKOSA-N	1	1	309.341	1.931	20	5		DDBDMO
C[C@@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408144232	164241932	/nfs/dbraw/zinc/24/19/32/164241932.db2.gz	HNHNOXLHBMRBGU-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408144232	164241934	/nfs/dbraw/zinc/24/19/34/164241934.db2.gz	HNHNOXLHBMRBGU-VHSXEESVSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC(C)[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@H](C)O	ZINC000304004251	409559503	/nfs/dbraw/zinc/55/95/03/409559503.db2.gz	SHSUFFFAIANROW-LBPRGKRZSA-N	1	1	321.377	1.575	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000356793550	409613327	/nfs/dbraw/zinc/61/33/27/409613327.db2.gz	MFDVNPIRHISQSJ-QWRGUYRKSA-N	1	1	306.366	1.483	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2C)C1	ZINC000338077884	409699032	/nfs/dbraw/zinc/69/90/32/409699032.db2.gz	IQQNFGUVJBIDNK-GFCCVEGCSA-N	1	1	306.366	1.760	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471799	409659423	/nfs/dbraw/zinc/65/94/23/409659423.db2.gz	LMBGWJCXWGIIQI-SMDDNHRTSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])C1	ZINC000342471799	409659433	/nfs/dbraw/zinc/65/94/33/409659433.db2.gz	LMBGWJCXWGIIQI-SMDDNHRTSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c([N+](=O)[O-])c(C)nn2C)C[C@@H]1C	ZINC000354405379	409831504	/nfs/dbraw/zinc/83/15/04/409831504.db2.gz	UQPXDKDFALEWRQ-CMPLNLGQSA-N	1	1	323.397	1.582	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H](C)C1	ZINC000346224449	409863884	/nfs/dbraw/zinc/86/38/84/409863884.db2.gz	NUHFUYOGNIDLPV-LOWVWBTDSA-N	1	1	306.366	1.725	20	5		DDBDMO
O=C(NCCc1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@H]2C1	ZINC000332114504	409897539	/nfs/dbraw/zinc/89/75/39/409897539.db2.gz	WTQIKLZOJNIETN-HNNXBMFYSA-N	1	1	318.377	1.627	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357392602	410010062	/nfs/dbraw/zinc/01/00/62/410010062.db2.gz	OAOIUFQQRAXKPC-CHWSQXEVSA-N	1	1	320.393	1.996	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@@H+]1C1CCN(C)CC1	ZINC000354741677	410051865	/nfs/dbraw/zinc/05/18/65/410051865.db2.gz	DAYJDQWWTDZNJD-CYBMUJFWSA-N	1	1	319.409	1.595	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])nc2)CC[N@H+]1C1CCN(C)CC1	ZINC000354741677	410051872	/nfs/dbraw/zinc/05/18/72/410051872.db2.gz	DAYJDQWWTDZNJD-CYBMUJFWSA-N	1	1	319.409	1.595	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1CCOc1ccccc1[N+](=O)[O-]	ZINC000339139770	410066243	/nfs/dbraw/zinc/06/62/43/410066243.db2.gz	JEECMDPSJQFTTQ-GFCCVEGCSA-N	1	1	307.350	1.704	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)C[C@@H]1CCC[C@H]1O	ZINC000339133972	410062786	/nfs/dbraw/zinc/06/27/86/410062786.db2.gz	BNBSKHRHMQIHPM-GXTWGEPZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H]1CCC[C@H]1O	ZINC000339133972	410062791	/nfs/dbraw/zinc/06/27/91/410062791.db2.gz	BNBSKHRHMQIHPM-GXTWGEPZSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H](CO)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000298085588	410105800	/nfs/dbraw/zinc/10/58/00/410105800.db2.gz	HQAOSMTZCLYWPR-GFCCVEGCSA-N	1	1	307.350	1.628	20	5		DDBDMO
C[C@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000332599261	410190887	/nfs/dbraw/zinc/19/08/87/410190887.db2.gz	IPGFPMLUOVHJEM-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000332599261	410190895	/nfs/dbraw/zinc/19/08/95/410190895.db2.gz	IPGFPMLUOVHJEM-UWVGGRQHSA-N	1	1	321.333	1.488	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H](O)C1	ZINC000351827959	410272150	/nfs/dbraw/zinc/27/21/50/410272150.db2.gz	MSUSNIUMXFCBPM-SMDDNHRTSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1C	ZINC000339632119	410343518	/nfs/dbraw/zinc/34/35/18/410343518.db2.gz	WSMZFLLBZJAREM-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1C	ZINC000339632119	410343522	/nfs/dbraw/zinc/34/35/22/410343522.db2.gz	WSMZFLLBZJAREM-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1C	ZINC000339632119	410343529	/nfs/dbraw/zinc/34/35/29/410343529.db2.gz	WSMZFLLBZJAREM-BETUJISGSA-N	1	1	320.393	1.948	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000343392681	410418376	/nfs/dbraw/zinc/41/83/76/410418376.db2.gz	CKGRTIYGEVNADJ-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000343392681	410418378	/nfs/dbraw/zinc/41/83/78/410418378.db2.gz	CKGRTIYGEVNADJ-LLVKDONJSA-N	1	1	323.349	1.807	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000334042896	410625457	/nfs/dbraw/zinc/62/54/57/410625457.db2.gz	ZJOOVADPLCQLMS-QWRGUYRKSA-N	1	1	307.350	1.816	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])C1	ZINC000301084449	410653595	/nfs/dbraw/zinc/65/35/95/410653595.db2.gz	DFEHSNJDGBXLLG-JTQLQIEISA-N	1	1	317.349	1.997	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000337310862	410709668	/nfs/dbraw/zinc/70/96/68/410709668.db2.gz	BOQVATCONKFUIF-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000337310862	410709674	/nfs/dbraw/zinc/70/96/74/410709674.db2.gz	BOQVATCONKFUIF-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H](C)CN1C	ZINC000337310862	410709678	/nfs/dbraw/zinc/70/96/78/410709678.db2.gz	BOQVATCONKFUIF-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCCC[C@H]2[C@H](O)C(F)(F)F)c1	ZINC000340207727	410752409	/nfs/dbraw/zinc/75/24/09/410752409.db2.gz	YXGUXKLVGJFNPS-QWRGUYRKSA-N	1	1	322.287	1.569	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@H]2[C@H](O)C(F)(F)F)c1	ZINC000340207727	410752414	/nfs/dbraw/zinc/75/24/14/410752414.db2.gz	YXGUXKLVGJFNPS-QWRGUYRKSA-N	1	1	322.287	1.569	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1CO	ZINC000337476466	410815503	/nfs/dbraw/zinc/81/55/03/410815503.db2.gz	SJWHAPYXTZMOCF-NWDGAFQWSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cc1c(CC(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000330581315	410797917	/nfs/dbraw/zinc/79/79/17/410797917.db2.gz	JBGSCRZQYMPNPB-NEPJUHHUSA-N	1	1	305.378	1.997	20	5		DDBDMO
Cn1nccc1C[N@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000348372755	410939493	/nfs/dbraw/zinc/93/94/93/410939493.db2.gz	OPJHJOMOQTXUEX-AWEZNQCLSA-N	1	1	320.349	1.200	20	5		DDBDMO
Cn1nccc1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000348372755	410939499	/nfs/dbraw/zinc/93/94/99/410939499.db2.gz	OPJHJOMOQTXUEX-AWEZNQCLSA-N	1	1	320.349	1.200	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000331111879	410954289	/nfs/dbraw/zinc/95/42/89/410954289.db2.gz	LMHTXUFSHZBTBD-QWHCGFSZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000331111879	410954296	/nfs/dbraw/zinc/95/42/96/410954296.db2.gz	LMHTXUFSHZBTBD-QWHCGFSZSA-N	1	1	324.377	1.834	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H]2CCC[C@H]2O)c([N+](=O)[O-])cc1OC	ZINC000348556869	411015075	/nfs/dbraw/zinc/01/50/75/411015075.db2.gz	QCPRJOWQPBLULT-DGCLKSJQSA-N	1	1	310.350	1.957	20	5		DDBDMO
C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C1CC(O)C1	ZINC000353495453	411030235	/nfs/dbraw/zinc/03/02/35/411030235.db2.gz	NZBXGYRRFULLAM-UHFFFAOYSA-N	1	1	321.333	1.348	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000130772091	196108016	/nfs/dbraw/zinc/10/80/16/196108016.db2.gz	XODWMMHOAMMUPP-UHFFFAOYSA-N	1	1	317.349	1.844	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H](C)CN2CCOCC2)cc1[N+](=O)[O-]	ZINC000271634994	209079805	/nfs/dbraw/zinc/07/98/05/209079805.db2.gz	PXBHSJITOYZJDH-ZDUSSCGKSA-N	1	1	323.393	1.756	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN([C@@H]3CCOC3)CC2)cc1	ZINC000366514973	418483578	/nfs/dbraw/zinc/48/35/78/418483578.db2.gz	LACOSYCDSUBFQE-MRXNPFEDSA-N	1	1	305.378	1.544	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@@H+](C/C=C/c3ccccc3[N+](=O)[O-])CC[C@@H]12	ZINC000366571585	418492400	/nfs/dbraw/zinc/49/24/00/418492400.db2.gz	XVCOUZARXKHXIS-CBSYICTRSA-N	1	1	315.329	1.203	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000366953779	418542479	/nfs/dbraw/zinc/54/24/79/418542479.db2.gz	GTUHCMIFSDNHGS-CQSZACIVSA-N	1	1	309.341	1.640	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000290936322	418578792	/nfs/dbraw/zinc/57/87/92/418578792.db2.gz	KSFKGVQGYQDDGA-UHFFFAOYSA-N	1	1	317.349	1.791	20	5		DDBDMO
C[C@H]1OCC[C@@H]1[N@@H+](CCO)CCOc1ccc([N+](=O)[O-])cc1	ZINC000361583626	418686313	/nfs/dbraw/zinc/68/63/13/418686313.db2.gz	LPGOJQURIIQLMF-DOMZBBRYSA-N	1	1	310.350	1.445	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)COc1c(C)cc(C)cc1[N+](=O)[O-]	ZINC000390641838	418755146	/nfs/dbraw/zinc/75/51/46/418755146.db2.gz	SMWIWRSGFXCWGI-ZDUSSCGKSA-N	1	1	312.366	1.530	20	5		DDBDMO
C[C@H]1C[N@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408145510	418789240	/nfs/dbraw/zinc/78/92/40/418789240.db2.gz	SQIVLRNPNWHDPA-VIFPVBQESA-N	1	1	307.306	1.100	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000408145510	418789242	/nfs/dbraw/zinc/78/92/42/418789242.db2.gz	SQIVLRNPNWHDPA-VIFPVBQESA-N	1	1	307.306	1.100	20	5		DDBDMO
O=C(CC[N@@H+]1CCCC[C@H]1CO)Nc1ccc([N+](=O)[O-])cc1	ZINC000411167299	418875875	/nfs/dbraw/zinc/87/58/75/418875875.db2.gz	NXBMBFKVQNSPNS-AWEZNQCLSA-N	1	1	307.350	1.770	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000372154706	418840389	/nfs/dbraw/zinc/84/03/89/418840389.db2.gz	HUBJICSKXCWNDC-ZWNOBZJWSA-N	1	1	313.379	1.279	20	5		DDBDMO
CNS(=O)(=O)[C@@H]1CC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000372154706	418840390	/nfs/dbraw/zinc/84/03/90/418840390.db2.gz	HUBJICSKXCWNDC-ZWNOBZJWSA-N	1	1	313.379	1.279	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](C(=O)NC)C1	ZINC000420968516	419390882	/nfs/dbraw/zinc/39/08/82/419390882.db2.gz	CBAUIEUKQBPRAV-NSHDSACASA-N	1	1	307.350	1.561	20	5		DDBDMO
CCOc1cc(C[N@H+]2CC[C@H](C(=O)NC)C2)ccc1[N+](=O)[O-]	ZINC000420970436	419392771	/nfs/dbraw/zinc/39/27/71/419392771.db2.gz	GGCGKUSMWZXDKZ-LBPRGKRZSA-N	1	1	307.350	1.561	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C1COC1	ZINC000411777037	419402641	/nfs/dbraw/zinc/40/26/41/419402641.db2.gz	ZJERXFJKBDPKKC-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCC[C@H]1CCO	ZINC000426230007	419412417	/nfs/dbraw/zinc/41/24/17/419412417.db2.gz	JTHPGXCFCIDNLL-QWHCGFSZSA-N	1	1	310.350	1.181	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3c4ccccc4ncc3[N+](=O)[O-])C[C@@H]21	ZINC000413467294	419786372	/nfs/dbraw/zinc/78/63/72/419786372.db2.gz	CIPATMRPLOBMGW-LSDHHAIUSA-N	1	1	314.345	1.662	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCCNC1	ZINC000414866950	419849753	/nfs/dbraw/zinc/84/97/53/419849753.db2.gz	NMYSGJYNAAXFHI-YPMHNXCESA-N	1	1	306.366	1.654	20	5		DDBDMO
C[C@@H]1C[C@@H]1[N@H+]1CCN(CCn2ccc([N+](=O)[O-])n2)C[C@@H](C)C1	ZINC000429027298	419964064	/nfs/dbraw/zinc/96/40/64/419964064.db2.gz	DRMGBCUDPQHEQX-MCIONIFRSA-N	1	1	307.398	1.453	20	5		DDBDMO
COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCOC1	ZINC000430239610	420095026	/nfs/dbraw/zinc/09/50/26/420095026.db2.gz	BFZHMHLSRPQHSE-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
COCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCOC1	ZINC000430239610	420095031	/nfs/dbraw/zinc/09/50/31/420095031.db2.gz	BFZHMHLSRPQHSE-AWEZNQCLSA-N	1	1	310.350	1.841	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000416301902	420318883	/nfs/dbraw/zinc/31/88/83/420318883.db2.gz	VWAAVNSGLKYPQA-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000416301902	420318888	/nfs/dbraw/zinc/31/88/88/420318888.db2.gz	VWAAVNSGLKYPQA-QWHCGFSZSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cn1cc[nH+]c1C[C@H]1CCCN(c2ncc([N+](=O)[O-])cn2)C1	ZINC000302129111	230110282	/nfs/dbraw/zinc/11/02/82/230110282.db2.gz	BLFYMHBPQLQYBH-LLVKDONJSA-N	1	1	302.338	1.577	20	5		DDBDMO
COCCC[N@H+](CCOC)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444597528	230110316	/nfs/dbraw/zinc/11/03/16/230110316.db2.gz	MNNIWHYQGAIVKF-UHFFFAOYSA-N	1	1	322.365	1.956	20	5		DDBDMO
COCCC[N@@H+](CCOC)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444597528	230110317	/nfs/dbraw/zinc/11/03/17/230110317.db2.gz	MNNIWHYQGAIVKF-UHFFFAOYSA-N	1	1	322.365	1.956	20	5		DDBDMO
CN(C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)[C@@H]1CC[N@H+](C2CC2)C1	ZINC000444979769	230148436	/nfs/dbraw/zinc/14/84/36/230148436.db2.gz	AYEUQKMBXFCPBD-LLVKDONJSA-N	1	1	306.322	1.004	20	5		DDBDMO
CCOc1cc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000450792382	420532318	/nfs/dbraw/zinc/53/23/18/420532318.db2.gz	KAGDJPKNUVDQAA-BETUJISGSA-N	1	1	323.393	1.885	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000457108890	420617466	/nfs/dbraw/zinc/61/74/66/420617466.db2.gz	GIXVHPZXYQOKEV-NSHDSACASA-N	1	1	306.366	1.732	20	5		DDBDMO
COc1ccc(OCCN2C[C@H](C[NH3+])C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000442762639	420710048	/nfs/dbraw/zinc/71/00/48/420710048.db2.gz	CHMFMQNCAHBPMN-RYUDHWBXSA-N	1	1	309.366	1.651	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000487948950	421059534	/nfs/dbraw/zinc/05/95/34/421059534.db2.gz	MYWBOJQSNDAASZ-OCCSQVGLSA-N	1	1	305.378	1.793	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])c(NC)n1)C1CC1	ZINC000455402811	421008143	/nfs/dbraw/zinc/00/81/43/421008143.db2.gz	OWSWPULTSLBMHC-UHFFFAOYSA-N	1	1	307.354	1.246	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)CC2(C)C)ccc1[N+](=O)[O-]	ZINC000456012245	421088634	/nfs/dbraw/zinc/08/86/34/421088634.db2.gz	HZYCVIKSZNATRB-UHFFFAOYSA-N	1	1	307.354	1.198	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)CC2(C)C)ccc1[N+](=O)[O-]	ZINC000456012245	421088637	/nfs/dbraw/zinc/08/86/37/421088637.db2.gz	HZYCVIKSZNATRB-UHFFFAOYSA-N	1	1	307.354	1.198	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456019968	421089935	/nfs/dbraw/zinc/08/99/35/421089935.db2.gz	IOKUWNFUAOTOEZ-SKDRFNHKSA-N	1	1	319.365	1.244	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000456227260	421129683	/nfs/dbraw/zinc/12/96/83/421129683.db2.gz	PBNHOAQCQSVGPO-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000456227260	421129685	/nfs/dbraw/zinc/12/96/85/421129685.db2.gz	PBNHOAQCQSVGPO-BETUJISGSA-N	1	1	321.377	1.430	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H](CNC(=O)c2ccnc(N)c2[N+](=O)[O-])C1	ZINC000548414116	421436061	/nfs/dbraw/zinc/43/60/61/421436061.db2.gz	PRXHXPGSJLVGKK-NSHDSACASA-N	1	1	321.381	1.422	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1	ZINC000571577373	421728077	/nfs/dbraw/zinc/72/80/77/421728077.db2.gz	OWLBBQTYIFDNEC-GHMZBOCLSA-N	1	1	318.377	1.992	20	5		DDBDMO
CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000570826067	421672188	/nfs/dbraw/zinc/67/21/88/421672188.db2.gz	YPRAOLZBOGRWJA-NSHDSACASA-N	1	1	323.397	1.948	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2C[N@@H+](C)Cc3ccccc32)c1[N+](=O)[O-]	ZINC000533827346	421683187	/nfs/dbraw/zinc/68/31/87/421683187.db2.gz	BCKFMSAUCJBLBH-LBPRGKRZSA-N	1	1	315.333	1.543	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@H]2C[N@H+](C)Cc3ccccc32)c1[N+](=O)[O-]	ZINC000533827346	421683189	/nfs/dbraw/zinc/68/31/89/421683189.db2.gz	BCKFMSAUCJBLBH-LBPRGKRZSA-N	1	1	315.333	1.543	20	5		DDBDMO
C[C@@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)[NH+]1CC(C)C1	ZINC000520836416	421765628	/nfs/dbraw/zinc/76/56/28/421765628.db2.gz	NUFRXFORBIDRGU-NSHDSACASA-N	1	1	304.350	1.215	20	5		DDBDMO
CC[C@H]1C[N@@H+](C)CCN1C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000581414160	421966377	/nfs/dbraw/zinc/96/63/77/421966377.db2.gz	QFKPYJBCDJWJMO-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
COc1ccc(CN[C@@H](C2CC2)[C@H]2C[NH2+]CCO2)cc1[N+](=O)[O-]	ZINC000422936389	533687247	/nfs/dbraw/zinc/68/72/47/533687247.db2.gz	BNIXBNRPQNYNGA-CVEARBPZSA-N	1	1	321.377	1.460	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@]23CCOC3)c1	ZINC000341978023	271264485	/nfs/dbraw/zinc/26/44/85/271264485.db2.gz	XFMBTZBXLBURAG-GOEBONIOSA-N	1	1	322.361	1.589	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@@H+](CCCNc2c(F)cccc2[N+](=O)[O-])C1	ZINC000342099183	271296987	/nfs/dbraw/zinc/29/69/87/271296987.db2.gz	SXEGWLUYZOLEJK-NSHDSACASA-N	1	1	324.356	1.733	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCNCC1([NH3+])CCC1	ZINC000342128247	271308431	/nfs/dbraw/zinc/30/84/31/271308431.db2.gz	KTIPTTBTCLKCKU-UHFFFAOYSA-N	1	1	306.366	1.703	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]CC1(N)CCC1	ZINC000342128247	271308436	/nfs/dbraw/zinc/30/84/36/271308436.db2.gz	KTIPTTBTCLKCKU-UHFFFAOYSA-N	1	1	306.366	1.703	20	5		DDBDMO
CC(=O)[C@H](NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000342283346	271365951	/nfs/dbraw/zinc/36/59/51/271365951.db2.gz	QVXIHJKLOCDFST-BDJLRTHQSA-N	1	1	321.377	1.975	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1[N@@H+](C)CCCC1(C)C	ZINC000344645710	272079001	/nfs/dbraw/zinc/07/90/01/272079001.db2.gz	PUIDMORIXLKRFZ-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])nn2C)CC[N@H+](C2CCC2)C1	ZINC000344696846	272093522	/nfs/dbraw/zinc/09/35/22/272093522.db2.gz	HRXQGDQDDHDJHR-LLVKDONJSA-N	1	1	321.381	1.275	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1	ZINC000413471281	274017234	/nfs/dbraw/zinc/01/72/34/274017234.db2.gz	FEDHGOZWIVBKFB-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCN(c3[nH]cc[nH+]3)CC2)c1	ZINC000290968697	274118379	/nfs/dbraw/zinc/11/83/79/274118379.db2.gz	PNSLJLWOEIXGLM-UHFFFAOYSA-N	1	1	303.322	1.653	20	5		DDBDMO
CCC[NH+]1CCN(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000286733976	276013239	/nfs/dbraw/zinc/01/32/39/276013239.db2.gz	DTKGNUWAQPTOMU-UHFFFAOYSA-N	1	1	322.365	1.617	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000174534506	276205646	/nfs/dbraw/zinc/20/56/46/276205646.db2.gz	DTVRJUFHQTUCHU-CQSZACIVSA-N	1	1	305.334	1.205	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000174534506	276205648	/nfs/dbraw/zinc/20/56/48/276205648.db2.gz	DTVRJUFHQTUCHU-CQSZACIVSA-N	1	1	305.334	1.205	20	5		DDBDMO
CC(C)(O)C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CC1	ZINC000189913596	277314530	/nfs/dbraw/zinc/31/45/30/277314530.db2.gz	HHMAWGCDADFIAE-UHFFFAOYSA-N	1	1	307.350	1.429	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1[C@H]1CCCO1	ZINC000284669842	280394734	/nfs/dbraw/zinc/39/47/34/280394734.db2.gz	GUTZNXJURBHRSG-ZIAGYGMSSA-N	1	1	307.350	1.400	20	5		DDBDMO
COCCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000363326558	300251993	/nfs/dbraw/zinc/25/19/93/300251993.db2.gz	ZAOFJRHOSLJLAO-UHFFFAOYSA-N	1	1	311.338	1.372	20	5		DDBDMO
Cc1c(C[N@@H+]2CCC[C@]3(CNC(=O)O3)C2)cccc1[N+](=O)[O-]	ZINC000369042764	301123957	/nfs/dbraw/zinc/12/39/57/301123957.db2.gz	WSUPQJVPPUYABO-HNNXBMFYSA-N	1	1	305.334	1.978	20	5		DDBDMO
Cc1c(C[N@H+]2CCC[C@]3(CNC(=O)O3)C2)cccc1[N+](=O)[O-]	ZINC000369042764	301123958	/nfs/dbraw/zinc/12/39/58/301123958.db2.gz	WSUPQJVPPUYABO-HNNXBMFYSA-N	1	1	305.334	1.978	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000369144146	301136543	/nfs/dbraw/zinc/13/65/43/301136543.db2.gz	OFQGBABHUQSSKC-MNOVXSKESA-N	1	1	321.381	1.627	20	5		DDBDMO
O=C1CCCN1C[C@@H]1CCCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000370000861	301255530	/nfs/dbraw/zinc/25/55/30/301255530.db2.gz	FLCWSIYVGUSJGJ-ZDUSSCGKSA-N	1	1	321.381	1.268	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000370083097	301272697	/nfs/dbraw/zinc/27/26/97/301272697.db2.gz	PLMWZWPMACITSL-INIZCTEOSA-N	1	1	322.361	1.829	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000398742301	302361686	/nfs/dbraw/zinc/36/16/86/302361686.db2.gz	WSYVZWMTDHNUPR-GHMZBOCLSA-N	1	1	307.350	1.144	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000532140703	303276442	/nfs/dbraw/zinc/27/64/42/303276442.db2.gz	RZPWBCMYSSKWNN-NEPJUHHUSA-N	1	1	306.366	1.840	20	5		DDBDMO
CN1CCC[C@H]([N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)C1=O	ZINC000538712081	303389835	/nfs/dbraw/zinc/38/98/35/303389835.db2.gz	PLRAFLFAFQYICM-YPMHNXCESA-N	1	1	319.365	1.097	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000366325107	307070966	/nfs/dbraw/zinc/07/09/66/307070966.db2.gz	JEPKZPDASJPCHW-MNOVXSKESA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC(=O)[C@H]2C[N@@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC[C@@H]12	ZINC000366325107	307070967	/nfs/dbraw/zinc/07/09/67/307070967.db2.gz	JEPKZPDASJPCHW-MNOVXSKESA-N	1	1	323.736	1.343	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034070	307114770	/nfs/dbraw/zinc/11/47/70/307114770.db2.gz	CIDVDKFTDUXVSS-DZGCQCFKSA-N	1	1	321.333	1.203	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)O1	ZINC000369034070	307114771	/nfs/dbraw/zinc/11/47/71/307114771.db2.gz	CIDVDKFTDUXVSS-DZGCQCFKSA-N	1	1	321.333	1.203	20	5		DDBDMO
O=C(NC[C@@H]1C[N@@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000371277313	307146432	/nfs/dbraw/zinc/14/64/32/307146432.db2.gz	IOUNPRDBBAKCEV-LSDHHAIUSA-N	1	1	319.361	1.578	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCCC[C@H]2CO1)c1ccc([N+](=O)[O-])cc1	ZINC000371277313	307146433	/nfs/dbraw/zinc/14/64/33/307146433.db2.gz	IOUNPRDBBAKCEV-LSDHHAIUSA-N	1	1	319.361	1.578	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)CNc3ccccc3[N+](=O)[O-])C[C@H]21	ZINC000371555457	307153291	/nfs/dbraw/zinc/15/32/91/307153291.db2.gz	UJOFSJKOXGIUOC-IUODEOHRSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=[N+]([O-])c1cnc(N[C@H]2CCCC[C@@H]2[NH+]2CCOCC2)nc1	ZINC000371892913	307159558	/nfs/dbraw/zinc/15/95/58/307159558.db2.gz	BOZOJJHHZZXAGI-STQMWFEESA-N	1	1	307.354	1.440	20	5		DDBDMO
CCOCC[C@H](O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000373105551	307178850	/nfs/dbraw/zinc/17/88/50/307178850.db2.gz	AMDVVFHJZAYRGF-OCCSQVGLSA-N	1	1	312.370	1.216	20	5		DDBDMO
CCc1ccc(S(=O)(=O)NCC[N@H+](C)CC)cc1[N+](=O)[O-]	ZINC000572956587	308228825	/nfs/dbraw/zinc/22/88/25/308228825.db2.gz	ADKAYEQUJQJMTC-UHFFFAOYSA-N	1	1	315.395	1.387	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@@H]1C1(O)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000573452007	308241229	/nfs/dbraw/zinc/24/12/29/308241229.db2.gz	ZUPJPSZVPFHQSS-CQSZACIVSA-N	1	1	319.361	1.913	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@@H]1C1(O)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000573452007	308241230	/nfs/dbraw/zinc/24/12/30/308241230.db2.gz	ZUPJPSZVPFHQSS-CQSZACIVSA-N	1	1	319.361	1.913	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCc3ccccc3[C@H]2C[NH3+])c1[N+](=O)[O-]	ZINC000576400197	308311986	/nfs/dbraw/zinc/31/19/86/308311986.db2.gz	AJPVBOKXPZISKV-GFCCVEGCSA-N	1	1	315.333	1.325	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@]3(CNC(=O)C3)C2)ccc1[N+](=O)[O-]	ZINC000434749436	533822089	/nfs/dbraw/zinc/82/20/89/533822089.db2.gz	RYOVJDIJSPTPEN-OAHLLOKOSA-N	1	1	305.334	1.315	20	5		DDBDMO
CC[N@H+]1CCCN(CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1	ZINC000158198821	521612128	/nfs/dbraw/zinc/61/21/28/521612128.db2.gz	MMVMAXYINCXISL-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC[C@H](C[NH+]3CCOCC3)C2)c(F)c1	ZINC000413278659	534888443	/nfs/dbraw/zinc/88/84/43/534888443.db2.gz	FLQSYRSKHYEFIQ-GFCCVEGCSA-N	1	1	324.356	1.678	20	5		DDBDMO
CC(C)(C[C@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1)C(N)=O	ZINC000295687059	527231823	/nfs/dbraw/zinc/23/18/23/527231823.db2.gz	SHXVCKGNDHYREL-GFCCVEGCSA-N	1	1	323.397	1.405	20	5		DDBDMO
CC[N@H+]1CC[C@@H](NC(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)C1	ZINC000413826058	527775288	/nfs/dbraw/zinc/77/52/88/527775288.db2.gz	AFENZBMADOVWCN-CQSZACIVSA-N	1	1	318.377	1.757	20	5		DDBDMO
CC[N@H+]1CCN(c2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C[C@@H]1C	ZINC000825466204	607821902	/nfs/dbraw/zinc/82/19/02/607821902.db2.gz	XDKNXDXSXUGBLN-JTQLQIEISA-N	1	1	317.353	1.305	20	5		DDBDMO
COCC[N@H+]1[C@H](C)CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000121314523	696708265	/nfs/dbraw/zinc/70/82/65/696708265.db2.gz	MIDOUUZPNPIMKC-BETUJISGSA-N	1	1	321.377	1.776	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000121314523	696708266	/nfs/dbraw/zinc/70/82/66/696708266.db2.gz	MIDOUUZPNPIMKC-BETUJISGSA-N	1	1	321.377	1.776	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2ccccc2)CCN1Cn1cc([N+](=O)[O-])cn1	ZINC000111172184	696642321	/nfs/dbraw/zinc/64/23/21/696642321.db2.gz	CBSMIFOYZZACDD-CQSZACIVSA-N	1	1	315.377	1.955	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000157008201	696971893	/nfs/dbraw/zinc/97/18/93/696971893.db2.gz	LZXAEAXVYAJMNF-UHFFFAOYSA-N	1	1	305.338	1.360	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278232	698091590	/nfs/dbraw/zinc/09/15/90/698091590.db2.gz	SMJWRJHCEFZQDU-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278232	698091596	/nfs/dbraw/zinc/09/15/96/698091596.db2.gz	SMJWRJHCEFZQDU-CZUORRHYSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](CCO)Cc2cccnc2)cc1	ZINC000776586255	698122113	/nfs/dbraw/zinc/12/21/13/698122113.db2.gz	LVOIGBONQSZNGK-INIZCTEOSA-N	1	1	317.345	1.518	20	5		DDBDMO
COCCO[C@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594002	698124282	/nfs/dbraw/zinc/12/42/82/698124282.db2.gz	QQMCHLJJVMRAAH-HOTGVXAUSA-N	1	1	324.377	1.756	20	5		DDBDMO
CC(=O)N1CC[C@@H](C[N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776594044	698124856	/nfs/dbraw/zinc/12/48/56/698124856.db2.gz	RZAKMXGHKGMOAD-XJKSGUPXSA-N	1	1	321.377	1.428	20	5		DDBDMO
O=C1Nc2ccccc2[C@@]12CC[N@@H+](Cn1nccc1[N+](=O)[O-])C2	ZINC000777557295	698201772	/nfs/dbraw/zinc/20/17/72/698201772.db2.gz	QEYGWVFUZGXWKG-HNNXBMFYSA-N	1	1	313.317	1.345	20	5		DDBDMO
O=C1Nc2ccccc2[C@@]12CC[N@H+](Cn1nccc1[N+](=O)[O-])C2	ZINC000777557295	698201773	/nfs/dbraw/zinc/20/17/73/698201773.db2.gz	QEYGWVFUZGXWKG-HNNXBMFYSA-N	1	1	313.317	1.345	20	5		DDBDMO
C[C@@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000778355889	698267907	/nfs/dbraw/zinc/26/79/07/698267907.db2.gz	MICBHXBNMNHETL-LLVKDONJSA-N	1	1	313.785	1.747	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@H](N2CC[NH2+]CC2)C1	ZINC000262073043	698453193	/nfs/dbraw/zinc/45/31/93/698453193.db2.gz	CVDHYRHUPSMAMV-WMHVBEDNSA-N	1	1	316.405	1.588	20	5		DDBDMO
C[C@H]1C[C@@H](O)C[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000782525611	698734063	/nfs/dbraw/zinc/73/40/63/698734063.db2.gz	ZHZBTKDULMWVKI-GXSJLCMTSA-N	1	1	311.313	1.518	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588967	699642069	/nfs/dbraw/zinc/64/20/69/699642069.db2.gz	GZRZZILHJDSDEE-APHBMKBZSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1OCC[C@@]12C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCO2	ZINC000791588967	699642072	/nfs/dbraw/zinc/64/20/72/699642072.db2.gz	GZRZZILHJDSDEE-APHBMKBZSA-N	1	1	322.361	1.508	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000742197773	699866228	/nfs/dbraw/zinc/86/62/28/699866228.db2.gz	ZWKCYUDSZIYRGO-SECBINFHSA-N	1	1	303.322	1.247	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000742197773	699866231	/nfs/dbraw/zinc/86/62/31/699866231.db2.gz	ZWKCYUDSZIYRGO-SECBINFHSA-N	1	1	303.322	1.247	20	5		DDBDMO
COc1ccc(C(=O)NCC[N@H+]2CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000742242116	699869769	/nfs/dbraw/zinc/86/97/69/699869769.db2.gz	YVJASPINEBNDMD-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000743637069	699921083	/nfs/dbraw/zinc/92/10/83/699921083.db2.gz	KXAUUXFULZNAOE-WDEREUQCSA-N	1	1	306.366	1.698	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000801861467	700347504	/nfs/dbraw/zinc/34/75/04/700347504.db2.gz	HSZNDZQOIFEGCP-UHFFFAOYSA-N	1	1	307.285	1.251	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)OCCC[NH+]1CCOCC1	ZINC000755679018	700577529	/nfs/dbraw/zinc/57/75/29/700577529.db2.gz	WRKHAQFHVJSCCH-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
O=C1OCCN1CCC[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000757167276	700659491	/nfs/dbraw/zinc/65/94/91/700659491.db2.gz	FLRZVXBNUKSOQS-UHFFFAOYSA-N	1	1	305.334	1.795	20	5		DDBDMO
O=C1OCCN1CCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000757167276	700659492	/nfs/dbraw/zinc/65/94/92/700659492.db2.gz	FLRZVXBNUKSOQS-UHFFFAOYSA-N	1	1	305.334	1.795	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)C1	ZINC000762721636	700904768	/nfs/dbraw/zinc/90/47/68/700904768.db2.gz	BSRKWECKIKRBHI-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
C[C@@H]1C[C@@H](NS(=O)(=O)c2csc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000768843147	701208868	/nfs/dbraw/zinc/20/88/68/701208868.db2.gz	RIAPOFMRZYXWAD-BDAKNGLRSA-N	1	1	319.408	1.417	20	5		DDBDMO
CC(=O)N1CCC([N@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CC1	ZINC000769425653	701244428	/nfs/dbraw/zinc/24/44/28/701244428.db2.gz	JNRZDUMXEZCNGO-UHFFFAOYSA-N	1	1	303.362	1.964	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1NCCN1CC[NH+](C)CC1	ZINC000807921673	701491193	/nfs/dbraw/zinc/49/11/93/701491193.db2.gz	SGLHFVFOJOHKFA-UHFFFAOYSA-N	1	1	306.366	1.457	20	5		DDBDMO
C[NH+](C)[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000839695312	701788014	/nfs/dbraw/zinc/78/80/14/701788014.db2.gz	DYCGMZKILHPMCF-UPJWGTAASA-N	1	1	311.769	1.724	20	5		DDBDMO
C[C@@H]1CCC[N@@H+]1CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014212	701912057	/nfs/dbraw/zinc/91/20/57/701912057.db2.gz	IQELVJPGDKOIAB-ABAIWWIYSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CN1C(=O)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014212	701912064	/nfs/dbraw/zinc/91/20/64/701912064.db2.gz	IQELVJPGDKOIAB-ABAIWWIYSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[C@H]1CCC[N@@H+]1CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014221	701912448	/nfs/dbraw/zinc/91/24/48/701912448.db2.gz	IQELVJPGDKOIAB-XHDPSFHLSA-N	1	1	305.334	1.974	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CN1C(=O)C[C@H]1Oc1ccc([N+](=O)[O-])cc1	ZINC000840014221	701912450	/nfs/dbraw/zinc/91/24/50/701912450.db2.gz	IQELVJPGDKOIAB-XHDPSFHLSA-N	1	1	305.334	1.974	20	5		DDBDMO
COC(=O)[C@@H]1CN(c2cccc(F)c2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000840357417	702081925	/nfs/dbraw/zinc/08/19/25/702081925.db2.gz	DSRUGQIBLKGFCK-JTQLQIEISA-N	1	1	311.313	1.275	20	5		DDBDMO
CC(C)[N@@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CO	ZINC000817290055	702331937	/nfs/dbraw/zinc/33/19/37/702331937.db2.gz	AXJYKBXQRRDMNR-GFCCVEGCSA-N	1	1	302.758	1.812	20	5		DDBDMO
CC(C)[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@H](O)CO	ZINC000817290055	702331945	/nfs/dbraw/zinc/33/19/45/702331945.db2.gz	AXJYKBXQRRDMNR-GFCCVEGCSA-N	1	1	302.758	1.812	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000842046558	702663142	/nfs/dbraw/zinc/66/31/42/702663142.db2.gz	DCKUMLCRSMDHSE-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000842046558	702663145	/nfs/dbraw/zinc/66/31/45/702663145.db2.gz	DCKUMLCRSMDHSE-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
Cc1cc(N2CCC[C@@H](OC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)nc(C)[nH+]1	ZINC000842304155	702700418	/nfs/dbraw/zinc/70/04/18/702700418.db2.gz	VIOFRRQLALMYAT-JHJVBQTASA-N	1	1	320.349	1.271	20	5		DDBDMO
C[NH2+]C[C@@H]1CCN(CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1	ZINC000843349231	702864188	/nfs/dbraw/zinc/86/41/88/702864188.db2.gz	NLQKJMDMLCBADG-NSHDSACASA-N	1	1	324.356	1.604	20	5		DDBDMO
CN1C[C@@H]([N@@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000846921250	703352090	/nfs/dbraw/zinc/35/20/90/703352090.db2.gz	REWZLMBIIVVDEW-KBPBESRZSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+](CCOCCO)C2CCC2)c1	ZINC000852291383	703998485	/nfs/dbraw/zinc/99/84/85/703998485.db2.gz	WBLRVJPBMPZDJU-MRXNPFEDSA-N	1	1	324.377	1.492	20	5		DDBDMO
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000852415073	704039130	/nfs/dbraw/zinc/03/91/30/704039130.db2.gz	DASSEBBZYRUUNQ-NWDGAFQWSA-N	1	1	314.725	1.668	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@](O)(C3CC3)C2)c1	ZINC000852500983	704064806	/nfs/dbraw/zinc/06/48/06/704064806.db2.gz	HFWBVBZQQYVKLA-HOTGVXAUSA-N	1	1	306.362	1.865	20	5		DDBDMO
C[C@@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000870789997	704133025	/nfs/dbraw/zinc/13/30/25/704133025.db2.gz	LXJYCTUEUGYULM-RYUDHWBXSA-N	1	1	310.354	1.597	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000820266223	704249590	/nfs/dbraw/zinc/24/95/90/704249590.db2.gz	YDDKBVKDJWWHEY-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCC[N@H+]1CCCC1(C)C	ZINC000822144226	704884395	/nfs/dbraw/zinc/88/43/95/704884395.db2.gz	TVQLIXCCOZMLBK-UHFFFAOYSA-N	1	1	309.370	1.090	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@](O)(c3ccccc3)C2)c1	ZINC000859586996	704944725	/nfs/dbraw/zinc/94/47/25/704944725.db2.gz	VYJNJWWJOWWCEC-INIZCTEOSA-N	1	1	316.361	1.775	20	5		DDBDMO
CC(C)(CCC(=O)NCC[NH+]1Cc2ccccc2C1)[N+](=O)[O-]	ZINC000822757726	705029867	/nfs/dbraw/zinc/02/98/67/705029867.db2.gz	IGKQWMHJVJDECT-UHFFFAOYSA-N	1	1	305.378	1.954	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000874836565	705193691	/nfs/dbraw/zinc/19/36/91/705193691.db2.gz	GJWXXFVAYULFIT-GJZGRUSLSA-N	1	1	303.362	1.832	20	5		DDBDMO
Nc1ccc(NC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-]	ZINC000824003221	705352930	/nfs/dbraw/zinc/35/29/30/705352930.db2.gz	SYPNBSUMTQFFHB-OLZOCXBDSA-N	1	1	319.365	1.925	20	5		DDBDMO
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)OCC[NH+]1CCC1	ZINC000861390675	705455442	/nfs/dbraw/zinc/45/54/42/705455442.db2.gz	ITCRDNKXSSNKTQ-UHFFFAOYSA-N	1	1	306.318	1.807	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-]	ZINC000827329461	705977112	/nfs/dbraw/zinc/97/71/12/705977112.db2.gz	GPTJISULARIDQJ-STQMWFEESA-N	1	1	319.361	1.770	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)CC[C@H]21	ZINC000827338032	705979731	/nfs/dbraw/zinc/97/97/31/705979731.db2.gz	NADCRRXYAWFPCD-BXKDBHETSA-N	1	1	322.340	1.482	20	5		DDBDMO
CO[C@@H]1CC[C@@H](C)N(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000877197339	706014579	/nfs/dbraw/zinc/01/45/79/706014579.db2.gz	IEARXBWZMSHOQZ-DJSGYFEHSA-N	1	1	321.377	1.795	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000828145559	706127336	/nfs/dbraw/zinc/12/73/36/706127336.db2.gz	MHRFTKIOLOPHNN-ZDUSSCGKSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1	ZINC000828145559	706127338	/nfs/dbraw/zinc/12/73/38/706127338.db2.gz	MHRFTKIOLOPHNN-ZDUSSCGKSA-N	1	1	307.350	1.181	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+]2CCCO)c2nonc21	ZINC000828421130	706176125	/nfs/dbraw/zinc/17/61/25/706176125.db2.gz	IXDFKAZKQDEQIT-JTQLQIEISA-N	1	1	321.337	1.390	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1	ZINC000881915339	707423051	/nfs/dbraw/zinc/42/30/51/707423051.db2.gz	LMGZINVJFMMSBM-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1c1nc2ccc([N+](=O)[O-])cc2s1	ZINC000829576548	706359695	/nfs/dbraw/zinc/35/96/95/706359695.db2.gz	CHOCHPCWFVQGIU-JTQLQIEISA-N	1	1	322.390	1.707	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1c1nc2ccc([N+](=O)[O-])cc2s1	ZINC000829576548	706359696	/nfs/dbraw/zinc/35/96/96/706359696.db2.gz	CHOCHPCWFVQGIU-JTQLQIEISA-N	1	1	322.390	1.707	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(c3cc(F)c([N+](=O)[O-])cc3CO)C[C@@H]2C1	ZINC000865905873	706559260	/nfs/dbraw/zinc/55/92/60/706559260.db2.gz	ZRCNBTSRWIPGHK-PWSUYJOCSA-N	1	1	309.341	1.614	20	5		DDBDMO
CCON(C)C(=O)CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865909237	706560882	/nfs/dbraw/zinc/56/08/82/706560882.db2.gz	YVEGXDZUPJGCAZ-UHFFFAOYSA-N	1	1	304.306	1.387	20	5		DDBDMO
CON(C)C(=O)[C@H](C)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865974301	706581390	/nfs/dbraw/zinc/58/13/90/706581390.db2.gz	KJICUQPPGMIFKP-VIFPVBQESA-N	1	1	304.306	1.385	20	5		DDBDMO
C[C@]12C[NH2+]C[C@H]1CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000872152069	707304943	/nfs/dbraw/zinc/30/49/43/707304943.db2.gz	LHYMPYWZIULDAU-BLLLJJGKSA-N	1	1	318.377	1.465	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cn3ncc4ccc([N+](=O)[O-])cc43)CC[C@H]21	ZINC000872726657	707574045	/nfs/dbraw/zinc/57/40/45/707574045.db2.gz	UEAOAUKBONLFGV-UKRRQHHQSA-N	1	1	315.377	1.928	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1ccc([N+](=O)[O-])c2nonc21	ZINC000872780115	707597040	/nfs/dbraw/zinc/59/70/40/707597040.db2.gz	JPCLUSJEILYYIA-ZJUUUORDSA-N	1	1	303.322	1.804	20	5		DDBDMO
O=[N+]([O-])c1cn(C[N@@H+]2C[C@@H]3COC[C@@H]3C2)nc1-c1ccccn1	ZINC000872785961	707601135	/nfs/dbraw/zinc/60/11/35/707601135.db2.gz	MLRVOISSIOABBS-TXEJJXNPSA-N	1	1	315.333	1.389	20	5		DDBDMO
O=[N+]([O-])c1cn(C[N@H+]2C[C@@H]3COC[C@@H]3C2)nc1-c1ccccn1	ZINC000872785961	707601137	/nfs/dbraw/zinc/60/11/37/707601137.db2.gz	MLRVOISSIOABBS-TXEJJXNPSA-N	1	1	315.333	1.389	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000882485670	707656288	/nfs/dbraw/zinc/65/62/88/707656288.db2.gz	JVZNITCCGGHANI-GFCCVEGCSA-N	1	1	307.350	1.356	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNc1ccc(CC(=O)OC)cc1[N+](=O)[O-]	ZINC000882959841	707873982	/nfs/dbraw/zinc/87/39/82/707873982.db2.gz	RSHDPONSCPBRBF-LBPRGKRZSA-N	1	1	307.350	1.816	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)N(C)Cc1ccccc1[N+](=O)[O-]	ZINC000883893571	708077176	/nfs/dbraw/zinc/07/71/76/708077176.db2.gz	NRNGQFXMOGTTDZ-ZDUSSCGKSA-N	1	1	306.366	1.830	20	5		DDBDMO
Cc1cnc(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897221608	708259457	/nfs/dbraw/zinc/25/94/57/708259457.db2.gz	NSDXAKLRZJVJLE-CHWSQXEVSA-N	1	1	306.366	1.334	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1	ZINC000884823607	708387530	/nfs/dbraw/zinc/38/75/30/708387530.db2.gz	XVUKWZUFWMFBTN-UHFFFAOYSA-N	1	1	307.272	1.950	20	5		DDBDMO
CNC(=O)CC[C@@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886204768	708714300	/nfs/dbraw/zinc/71/43/00/708714300.db2.gz	PXFXQDOGCLSVPZ-ZDUSSCGKSA-N	1	1	306.366	1.871	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H]2C[C@@H]2C1	ZINC000886340412	708745709	/nfs/dbraw/zinc/74/57/09/708745709.db2.gz	GMHYNIZZCYVGGW-PHIMTYICSA-N	1	1	305.334	1.884	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1C[C@@H]2CSC[C@@H]2C1	ZINC000886568813	708778002	/nfs/dbraw/zinc/77/80/02/708778002.db2.gz	WWTDEZXCZGGUPV-XQQFMLRXSA-N	1	1	324.402	1.629	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000886578226	708780267	/nfs/dbraw/zinc/78/02/67/708780267.db2.gz	OSNAMWMAWKDLEC-OHTBPHCPSA-N	1	1	319.361	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000886578226	708780269	/nfs/dbraw/zinc/78/02/69/708780269.db2.gz	OSNAMWMAWKDLEC-OHTBPHCPSA-N	1	1	319.361	1.625	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2CCC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000910284317	709865431	/nfs/dbraw/zinc/86/54/31/709865431.db2.gz	NIMKYRAVKUSFPO-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000910284317	709865435	/nfs/dbraw/zinc/86/54/35/709865435.db2.gz	NIMKYRAVKUSFPO-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[N@@H+](CC)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000910284317	709865441	/nfs/dbraw/zinc/86/54/41/709865441.db2.gz	NIMKYRAVKUSFPO-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)C1	ZINC000913385146	713206544	/nfs/dbraw/zinc/20/65/44/713206544.db2.gz	RFZJHNOKWRKRPD-SECBINFHSA-N	1	1	315.732	1.955	20	5		DDBDMO
C[NH+](C)C1(C)CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1	ZINC000913394888	713208129	/nfs/dbraw/zinc/20/81/29/713208129.db2.gz	QJGWNXZVKWHZLS-UHFFFAOYSA-N	1	1	307.350	1.857	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000893875808	710870101	/nfs/dbraw/zinc/87/01/01/710870101.db2.gz	GACKTYCAQNEGBL-ZDUSSCGKSA-N	1	1	320.393	1.778	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc2n1CCOC2	ZINC000894274194	711046986	/nfs/dbraw/zinc/04/69/86/711046986.db2.gz	ZWYJIVYJXSFPNQ-UHFFFAOYSA-N	1	1	316.361	1.996	20	5		DDBDMO
CN(CC[N@@H+](C)CCO)c1ccc2cnccc2c1[N+](=O)[O-]	ZINC000894590351	711197960	/nfs/dbraw/zinc/19/79/60/711197960.db2.gz	DWDDPODZDOQLDK-UHFFFAOYSA-N	1	1	304.350	1.503	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H](CO)[C@H]2C)c1[N+](=O)[O-]	ZINC000894940592	711329943	/nfs/dbraw/zinc/32/99/43/711329943.db2.gz	UHQNOCLNVBUOGF-PWSUYJOCSA-N	1	1	310.350	1.902	20	5		DDBDMO
COC(=O)Cc1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000895738497	711591125	/nfs/dbraw/zinc/59/11/25/711591125.db2.gz	WTPHQFJXUIMQHK-ZYHUDNBSSA-N	1	1	307.350	1.815	20	5		DDBDMO
Cc1cc(NC[C@H]2CC[N@H+]2C2CCOCC2)ncc1[N+](=O)[O-]	ZINC000896521708	711737560	/nfs/dbraw/zinc/73/75/60/711737560.db2.gz	LDTTUFGCXZSMSC-CYBMUJFWSA-N	1	1	306.366	1.963	20	5		DDBDMO
CCOc1cccc([N+](=O)[O-])c1C(=O)NC12CC[NH+](CC1)C2	ZINC000913633530	713273128	/nfs/dbraw/zinc/27/31/28/713273128.db2.gz	HUXMRBSNWFXWFR-UHFFFAOYSA-N	1	1	305.334	1.572	20	5		DDBDMO
O=C1C[C@H]([NH2+]CC[N+](=O)[O-])CN1c1ccc(Cl)c(F)c1	ZINC000905189260	711963542	/nfs/dbraw/zinc/96/35/42/711963542.db2.gz	HDEZEZYMPNNPDD-QMMMGPOBSA-N	1	1	301.705	1.451	20	5		DDBDMO
O=[N+]([O-])c1ccc2cnn(C[N@H+]3CC[C@H](C4OCCO4)C3)c2c1	ZINC000905696117	712121886	/nfs/dbraw/zinc/12/18/86/712121886.db2.gz	UKGSJNMPSQNUSK-LBPRGKRZSA-N	1	1	318.333	1.597	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H](c3ccn(C)n3)C2)c(C)c1[N+](=O)[O-]	ZINC000905717936	712130495	/nfs/dbraw/zinc/13/04/95/712130495.db2.gz	LSALOJJVNNYJDG-CYBMUJFWSA-N	1	1	318.381	1.979	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC[C@@H](c3ccn(C)n3)C2)c(C)c1[N+](=O)[O-]	ZINC000905717936	712130497	/nfs/dbraw/zinc/13/04/97/712130497.db2.gz	LSALOJJVNNYJDG-CYBMUJFWSA-N	1	1	318.381	1.979	20	5		DDBDMO
O=C(NC1CC2(C1)CC([NH2+]CCC1CC1)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC000963790214	717907580	/nfs/dbraw/zinc/90/75/80/717907580.db2.gz	GROJBFIDYOEPQA-QAALLOGESA-N	1	1	307.394	1.469	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])C1)OCc1ccccc1	ZINC000930284975	713793677	/nfs/dbraw/zinc/79/36/77/713793677.db2.gz	KAGRYUWQPMAFOJ-HNNXBMFYSA-N	1	1	321.377	1.902	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+](CC[N+](=O)[O-])C1)OCc1ccccc1	ZINC000930284975	713793679	/nfs/dbraw/zinc/79/36/79/713793679.db2.gz	KAGRYUWQPMAFOJ-HNNXBMFYSA-N	1	1	321.377	1.902	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1C[C@]2(C)C[N@H+](C)C[C@]2(C)C1	ZINC000931319148	714065763	/nfs/dbraw/zinc/06/57/63/714065763.db2.gz	XEGMCOKIHKETRR-GASCZTMLSA-N	1	1	307.398	1.373	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)CN2CCn3cc[nH+]c32)c1	ZINC000931528223	714120385	/nfs/dbraw/zinc/12/03/85/714120385.db2.gz	WPCCAEACGVSJAR-GFCCVEGCSA-N	1	1	304.306	1.051	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000931627342	714141883	/nfs/dbraw/zinc/14/18/83/714141883.db2.gz	NVLMIROGUDLLCA-GJZGRUSLSA-N	1	1	321.377	1.393	20	5		DDBDMO
C[C@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C[NH3+]	ZINC000923497706	714378620	/nfs/dbraw/zinc/37/86/20/714378620.db2.gz	CMVOTGKBZAZCKN-STQMWFEESA-N	1	1	320.393	1.474	20	5		DDBDMO
O=C1NCCC2(CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)O1	ZINC000932756710	714406517	/nfs/dbraw/zinc/40/65/17/714406517.db2.gz	BZVLCJDXUISYGO-UHFFFAOYSA-N	1	1	306.322	1.454	20	5		DDBDMO
C[C@H]1C[C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)c2ncnn21	ZINC000925383084	714837102	/nfs/dbraw/zinc/83/71/02/714837102.db2.gz	QRJUMAXHKRFFHI-GXFFZTMASA-N	1	1	303.322	1.861	20	5		DDBDMO
COc1cnc(N2CC[NH+](C[C@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC001165040130	721907779	/nfs/dbraw/zinc/90/77/79/721907779.db2.gz	ZDUUPILCJQISNV-GFCCVEGCSA-N	1	1	322.365	1.299	20	5		DDBDMO
CCC[C@H]1CN(c2cc(N)c([N+](=O)[O-])cn2)CC[N@H+]1CCOC	ZINC001120913542	782230759	/nfs/dbraw/zinc/23/07/59/782230759.db2.gz	RMVCOPPSEZGDGI-LBPRGKRZSA-N	1	1	323.397	1.509	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC001121198264	782404659	/nfs/dbraw/zinc/40/46/59/782404659.db2.gz	GKCMRVLRHFYRKH-BFHYXJOUSA-N	1	1	303.362	1.594	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccncc2Cl)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063393	734368665	/nfs/dbraw/zinc/36/86/65/734368665.db2.gz	AJIBGEZTJYTBOP-LSCVPOLPSA-N	1	1	324.768	1.137	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNc1cc([N+](=O)[O-])c(=O)n(C)c1	ZINC001167751024	737702030	/nfs/dbraw/zinc/70/20/30/737702030.db2.gz	DJMOUXAGUSFNSO-LBPRGKRZSA-N	1	1	308.382	1.970	20	5		DDBDMO
Cc1ccncc1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001002782156	743423787	/nfs/dbraw/zinc/42/37/87/743423787.db2.gz	JMOQWDFKAWMESH-HUUCEWRRSA-N	1	1	318.377	1.136	20	5		DDBDMO
O=[N+]([O-])c1cnc2cccc(N[C@@H]3CCC[N@@H+](C4COC4)C3)n21	ZINC001168373427	743629062	/nfs/dbraw/zinc/62/90/62/743629062.db2.gz	ANPCPCUSJUHBKB-LLVKDONJSA-N	1	1	317.349	1.518	20	5		DDBDMO
O=[N+]([O-])c1cnc2cccc(N[C@@H]3CCC[N@H+](C4COC4)C3)n21	ZINC001168373427	743629065	/nfs/dbraw/zinc/62/90/65/743629065.db2.gz	ANPCPCUSJUHBKB-LLVKDONJSA-N	1	1	317.349	1.518	20	5		DDBDMO
O=C1N[C@@H]2C[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)CC[C@H]2CO1	ZINC001195809022	746712234	/nfs/dbraw/zinc/71/22/34/746712234.db2.gz	FYYFZFWGCHCDLD-SMDDNHRTSA-N	1	1	321.333	1.404	20	5		DDBDMO
CCn1cc2c(n1)C[N@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@@H]2COC	ZINC001169019275	762198847	/nfs/dbraw/zinc/19/88/47/762198847.db2.gz	HCZSONFZAQHBIR-MGPQQGTHSA-N	1	1	322.409	1.894	20	5		DDBDMO
CCn1cc2c(n1)C[N@@H+]([C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C[C@@H]2COC	ZINC001169019275	762198852	/nfs/dbraw/zinc/19/88/52/762198852.db2.gz	HCZSONFZAQHBIR-MGPQQGTHSA-N	1	1	322.409	1.894	20	5		DDBDMO
O=C(NCC1CC[NH+](CC2CCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001399258	754280474	/nfs/dbraw/zinc/28/04/74/754280474.db2.gz	LENKTLANRUXPKR-HUUCEWRRSA-N	1	1	309.410	1.670	20	5		DDBDMO
COc1ccc(C[C@H](C)n2[nH]c(=O)nc2C[NH3+])c([N+](=O)[O-])c1	ZINC001170305834	766231134	/nfs/dbraw/zinc/23/11/34/766231134.db2.gz	QLNYXLUWMOQXIS-QMMMGPOBSA-N	1	1	307.310	1.163	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CCOC[C@@](C)(O)C2)c([N+](=O)[O-])c1	ZINC001170335724	766257844	/nfs/dbraw/zinc/25/78/44/766257844.db2.gz	QPIBKPMOHIEPAV-LRDDRELGSA-N	1	1	324.377	1.618	20	5		DDBDMO
CC(C)[N@H+]1CCN(c2cc([N+](=O)[O-])cc(Cl)[n+]2[O-])C[C@@H]1C	ZINC001158495602	768462823	/nfs/dbraw/zinc/46/28/23/768462823.db2.gz	ZNVHDCJYRWKCSF-JTQLQIEISA-N	1	1	314.773	1.801	20	5		DDBDMO
CC[N@H+](C)CCC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001146719303	772925620	/nfs/dbraw/zinc/92/56/20/772925620.db2.gz	PHWVPVXVIZSMIV-UHFFFAOYSA-N	1	1	314.411	1.204	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001146719303	772925623	/nfs/dbraw/zinc/92/56/23/772925623.db2.gz	PHWVPVXVIZSMIV-UHFFFAOYSA-N	1	1	314.411	1.204	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCNc1ccc(C)cc1[N+](=O)[O-]	ZINC001093642058	774939894	/nfs/dbraw/zinc/93/98/94/774939894.db2.gz	IONNXFDXGGMDKW-UHFFFAOYSA-N	1	1	317.349	1.636	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1nc(C)ccc1[N+](=O)[O-]	ZINC001093840269	775123468	/nfs/dbraw/zinc/12/34/68/775123468.db2.gz	FCVALBYOXJMPDV-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
NC(=O)[C@@H]1C[N@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1	ZINC001172918310	776931099	/nfs/dbraw/zinc/93/10/99/776931099.db2.gz	AQYYADJFOYGECL-HIFRSBDPSA-N	1	1	319.361	1.028	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)c1	ZINC001176760729	778246077	/nfs/dbraw/zinc/24/60/77/778246077.db2.gz	FFXNBPBKSFXSSA-CALCHBBNSA-N	1	1	320.389	1.942	20	5		DDBDMO
C[C@H](C(=O)N1Cc2ccc([N+](=O)[O-])cc2C1)N1CC[NH+](C)CC1	ZINC001116143339	780478060	/nfs/dbraw/zinc/47/80/60/780478060.db2.gz	LQJAEEKDFMKHHU-GFCCVEGCSA-N	1	1	318.377	1.073	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)OCCC[NH+]1CCOCC1	ZINC001116216838	780486142	/nfs/dbraw/zinc/48/61/42/780486142.db2.gz	YQICYEQHCREOKL-UHFFFAOYSA-N	1	1	323.349	1.516	20	5		DDBDMO
Cc1c[nH]nc1C(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001266273514	836025135	/nfs/dbraw/zinc/02/51/35/836025135.db2.gz	VHHJLQNBHSODLF-UHFFFAOYSA-N	1	1	317.349	1.488	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc(F)c1	ZINC001266390591	836197361	/nfs/dbraw/zinc/19/73/61/836197361.db2.gz	DCYLDXNLQOHAMG-ZIAGYGMSSA-N	1	1	309.341	1.429	20	5		DDBDMO
CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(F)c1	ZINC001266390591	836197365	/nfs/dbraw/zinc/19/73/65/836197365.db2.gz	DCYLDXNLQOHAMG-ZIAGYGMSSA-N	1	1	309.341	1.429	20	5		DDBDMO
CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(F)c1	ZINC001266390591	836197367	/nfs/dbraw/zinc/19/73/67/836197367.db2.gz	DCYLDXNLQOHAMG-ZIAGYGMSSA-N	1	1	309.341	1.429	20	5		DDBDMO
Cc1cc(C)cc(C[N@H+](C)CCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001272014198	844321305	/nfs/dbraw/zinc/32/13/05/844321305.db2.gz	YAFHQBLQOMAMLV-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1cc(C)cc(C[N@@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001272014198	844321313	/nfs/dbraw/zinc/32/13/13/844321313.db2.gz	YAFHQBLQOMAMLV-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1cc(C)cc(C[N@H+](C)CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001272014198	844321325	/nfs/dbraw/zinc/32/13/25/844321325.db2.gz	YAFHQBLQOMAMLV-HZPDHXFCSA-N	1	1	319.405	1.859	20	5		DDBDMO
Cc1cccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)c1	ZINC001326821983	861631968	/nfs/dbraw/zinc/63/19/68/861631968.db2.gz	JXRGUBLKGXLKKC-HUUCEWRRSA-N	1	1	317.389	1.789	20	5		DDBDMO
COC(=O)N(C)CC[N@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC001327678878	862379879	/nfs/dbraw/zinc/37/98/79/862379879.db2.gz	MUEIITYLGMBWRZ-UHFFFAOYSA-N	1	1	321.337	1.532	20	5		DDBDMO
COC(=O)N(C)CC[N@@H+](C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC001327678878	862379898	/nfs/dbraw/zinc/37/98/98/862379898.db2.gz	MUEIITYLGMBWRZ-UHFFFAOYSA-N	1	1	321.337	1.532	20	5		DDBDMO
COC(=O)c1ccnc(NCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC001156007157	862628995	/nfs/dbraw/zinc/62/89/95/862628995.db2.gz	KSYHYHUVVDXQAE-UHFFFAOYSA-N	1	1	305.294	1.393	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](OCCOc3ccc([N+](=O)[O-])cc3)[C@H]1CC(=O)C2	ZINC001224777297	881528944	/nfs/dbraw/zinc/52/89/44/881528944.db2.gz	RGBKRGZQSWYYDY-MAZHCROVSA-N	1	1	320.345	1.794	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1CC[C@H]([N@@H+](C)C(C)C)C1	ZINC001157002496	863511715	/nfs/dbraw/zinc/51/17/15/863511715.db2.gz	ZMWPYRXBUPYQRY-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
CCc1ccccc1CC[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157767856	864117819	/nfs/dbraw/zinc/11/78/19/864117819.db2.gz	YCPFGHAQSTVFLI-HZPDHXFCSA-N	1	1	319.405	1.553	20	5		DDBDMO
CN1CCN(C(=[NH2+])Nc2ncnc3ccc([N+](=O)[O-])cc32)CC1	ZINC001157914828	864252644	/nfs/dbraw/zinc/25/26/44/864252644.db2.gz	LYSHFGXMSMROHK-UHFFFAOYSA-N	1	1	315.337	1.132	20	5		DDBDMO
[NH3+]Cc1ncn(C(F)(F)c2cc([N+](=O)[O-])cnc2Cl)n1	ZINC001157928978	864274100	/nfs/dbraw/zinc/27/41/00/864274100.db2.gz	VUSPDDIIXGXYCS-UHFFFAOYSA-N	1	1	304.644	1.291	20	5		DDBDMO
C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCCNC1=O	ZINC001320080719	866457832	/nfs/dbraw/zinc/45/78/32/866457832.db2.gz	LLIAVZGHETUNQD-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCCNC1=O	ZINC001320080719	866457835	/nfs/dbraw/zinc/45/78/35/866457835.db2.gz	LLIAVZGHETUNQD-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1NCCC[NH+]1CCN(C)CC1	ZINC001161700661	866907306	/nfs/dbraw/zinc/90/73/06/866907306.db2.gz	OSABFDMNAMKZCG-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
CN(CC(C)(C)C[NH+]1CCOCC1)c1c([N+](=O)[O-])cnn1C	ZINC001334965477	867953516	/nfs/dbraw/zinc/95/35/16/867953516.db2.gz	OQDRENXBXMDPHH-UHFFFAOYSA-N	1	1	311.386	1.123	20	5		DDBDMO
NC(=O)c1cc([N+](=O)[O-])ccc1O[C@@H]1CCc2[nH+]ccn2C1	ZINC001226169397	882244597	/nfs/dbraw/zinc/24/45/97/882244597.db2.gz	CUXLKFKWPUDMHZ-SNVBAGLBSA-N	1	1	302.290	1.284	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001338083765	869791000	/nfs/dbraw/zinc/79/10/00/869791000.db2.gz	JKWFCLSDLNHXRD-ZYHUDNBSSA-N	1	1	309.370	1.045	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](Nc3ccc4nonc4c3[N+](=O)[O-])[C@H]2C1	ZINC001338298786	869909624	/nfs/dbraw/zinc/90/96/24/869909624.db2.gz	WFESJUUPYXEGOR-LPEHRKFASA-N	1	1	303.322	1.883	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@H]2CC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001226362590	882387222	/nfs/dbraw/zinc/38/72/22/882387222.db2.gz	XEMWQGCIJCGKMU-JTQLQIEISA-N	1	1	310.306	1.473	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC)C1	ZINC001339468486	870511847	/nfs/dbraw/zinc/51/18/47/870511847.db2.gz	VPCCTRLFFYPMPB-STQMWFEESA-N	1	1	324.429	1.804	20	5		DDBDMO
C[N@H+](CCc1ccccc1)CC(=O)Nc1cc([N+](=O)[O-])n[nH]1	ZINC001303575455	871137910	/nfs/dbraw/zinc/13/79/10/871137910.db2.gz	XBTZSNCLORCKBI-UHFFFAOYSA-N	1	1	303.322	1.431	20	5		DDBDMO
C[N@@H+](CCc1ccccc1)CC(=O)Nc1cc([N+](=O)[O-])n[nH]1	ZINC001303575455	871137917	/nfs/dbraw/zinc/13/79/17/871137917.db2.gz	XBTZSNCLORCKBI-UHFFFAOYSA-N	1	1	303.322	1.431	20	5		DDBDMO
C[N@H+](CCc1ccc2c(c1)OCO2)Cn1cc([N+](=O)[O-])cn1	ZINC001345054539	873239602	/nfs/dbraw/zinc/23/96/02/873239602.db2.gz	PMFJTXAVZQBJBN-UHFFFAOYSA-N	1	1	304.306	1.652	20	5		DDBDMO
C[N@@H+](CCc1ccc2c(c1)OCO2)Cn1cc([N+](=O)[O-])cn1	ZINC001345054539	873239609	/nfs/dbraw/zinc/23/96/09/873239609.db2.gz	PMFJTXAVZQBJBN-UHFFFAOYSA-N	1	1	304.306	1.652	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N1CCC([N@H+]2CC[C@@H](O)C2)CC1	ZINC001347267431	874078699	/nfs/dbraw/zinc/07/86/99/874078699.db2.gz	BCIJFOHTMSXORT-CYBMUJFWSA-N	1	1	306.366	1.334	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c(N)c1F)[C@@H]1C[N@@H+](C)CCN1C	ZINC001348311190	874475850	/nfs/dbraw/zinc/47/58/50/874475850.db2.gz	GOTGLUQOPDFAET-SKDRFNHKSA-N	1	1	311.361	1.362	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@@H+]2C	ZINC001227185375	882899259	/nfs/dbraw/zinc/89/92/59/882899259.db2.gz	QFCZEDBYTUAWBQ-ZKYQVNSYSA-N	1	1	306.318	1.786	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1O[C@@H]1C[C@@H]2CC(=O)C[C@H]1[N@H+]2C	ZINC001227185375	882899279	/nfs/dbraw/zinc/89/92/79/882899279.db2.gz	QFCZEDBYTUAWBQ-ZKYQVNSYSA-N	1	1	306.318	1.786	20	5		DDBDMO
CCOCCC[N@@H+](C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001277397712	884039454	/nfs/dbraw/zinc/03/94/54/884039454.db2.gz	UBLKHLYSRCJJGO-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CCOCCC[N@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001277397712	884039469	/nfs/dbraw/zinc/03/94/69/884039469.db2.gz	UBLKHLYSRCJJGO-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
CCOCCC[N@@H+](C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001277397712	884039481	/nfs/dbraw/zinc/03/94/81/884039481.db2.gz	UBLKHLYSRCJJGO-ZIAGYGMSSA-N	1	1	313.398	1.001	20	5		DDBDMO
O=[N+]([O-])c1c[nH]cc2nc(O[C@H]3CCc4[nH+]ccn4C3)nc1-2	ZINC001230231518	884383512	/nfs/dbraw/zinc/38/35/12/884383512.db2.gz	MAXTXGGUPNGZBI-QMMMGPOBSA-N	1	1	300.278	1.456	20	5		DDBDMO
COc1ccc(C[C@H](C)[NH2+][C@H]2CNCCC2=O)c([N+](=O)[O-])c1	ZINC001246294588	892519775	/nfs/dbraw/zinc/51/97/75/892519775.db2.gz	RIJBOVZNQNFTEJ-GWCFXTLKSA-N	1	1	307.350	1.055	20	5		DDBDMO
COc1ccc(C[C@H](C)N[C@H]2C[NH2+]CCC2=O)c([N+](=O)[O-])c1	ZINC001246294588	892519789	/nfs/dbraw/zinc/51/97/89/892519789.db2.gz	RIJBOVZNQNFTEJ-GWCFXTLKSA-N	1	1	307.350	1.055	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])N1CCCC[C@](O)(C[NH3+])C1	ZINC001246559073	892698988	/nfs/dbraw/zinc/69/89/88/892698988.db2.gz	NFEMFNYYOHHEDD-CJNGLKHVSA-N	1	1	307.394	1.702	20	5		DDBDMO
[NH3+]C[C@@]1(O)CCCCN([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001246564300	892700756	/nfs/dbraw/zinc/70/07/56/892700756.db2.gz	XHKYEOACEBKMRH-CVEARBPZSA-N	1	1	305.378	1.238	20	5		DDBDMO
O=C1CC[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCN1	ZINC001254476102	896455732	/nfs/dbraw/zinc/45/57/32/896455732.db2.gz	MBFKXALCJVTPEU-UHFFFAOYSA-N	1	1	318.377	1.386	20	5		DDBDMO
C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH+]1CCN(C2COC2)CC1	ZINC001254550940	896499101	/nfs/dbraw/zinc/49/91/01/896499101.db2.gz	TUGQMJZMFOMTQD-ZDUSSCGKSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC(C)(C)[N@@H+](C[C@@H](O)CO)[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254592989	896520603	/nfs/dbraw/zinc/52/06/03/896520603.db2.gz	IPXCIVTVGCXDFP-LSDHHAIUSA-N	1	1	308.378	1.516	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254612451	896533300	/nfs/dbraw/zinc/53/33/00/896533300.db2.gz	WGZXYXXBOCDWBK-ZFWWWQNUSA-N	1	1	318.377	1.455	20	5		DDBDMO
Cc1nn(C)c(N2CCC(c3c[nH+]cn3C)CC2)c1[N+](=O)[O-]	ZINC001262727373	900339986	/nfs/dbraw/zinc/33/99/86/900339986.db2.gz	LCBKXNVYSMIGDM-UHFFFAOYSA-N	1	1	304.354	1.754	20	5		DDBDMO
O=C(NCC1([NH2+]CC2CC3(CCC3)C2)CCC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001280480107	903723501	/nfs/dbraw/zinc/72/35/01/903723501.db2.gz	BFAPHYBZQHKHPC-ZIAGYGMSSA-N	1	1	321.421	1.860	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000305762766	231044080	/nfs/dbraw/zinc/04/40/80/231044080.db2.gz	NDMHONBHJREZFC-SMDDNHRTSA-N	1	1	307.350	1.626	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@H](C)[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323658	529466404	/nfs/dbraw/zinc/46/64/04/529466404.db2.gz	LEVBSTVXRRJKCY-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323658	529466406	/nfs/dbraw/zinc/46/64/06/529466406.db2.gz	LEVBSTVXRRJKCY-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@H](C)[N@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323658	529466410	/nfs/dbraw/zinc/46/64/10/529466410.db2.gz	LEVBSTVXRRJKCY-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2C[C@H](C)[N@@H+](CC)C[C@H]2C)c1[N+](=O)[O-]	ZINC000444323658	529466412	/nfs/dbraw/zinc/46/64/12/529466412.db2.gz	LEVBSTVXRRJKCY-VHSXEESVSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC[NH2+]1	ZINC000088059423	185238276	/nfs/dbraw/zinc/23/82/76/185238276.db2.gz	CYLNAJOBHQNWID-MRVPVSSYSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1	ZINC000096948722	185393598	/nfs/dbraw/zinc/39/35/98/185393598.db2.gz	GQYVLZHLQOAHIV-UHFFFAOYSA-N	1	1	320.393	1.951	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000615037696	362123177	/nfs/dbraw/zinc/12/31/77/362123177.db2.gz	IYVPUEPMPMCFLQ-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000615037696	362123181	/nfs/dbraw/zinc/12/31/81/362123181.db2.gz	IYVPUEPMPMCFLQ-FZMZJTMJSA-N	1	1	322.365	1.744	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000451631425	529797856	/nfs/dbraw/zinc/79/78/56/529797856.db2.gz	NORJZCRQSGPGAW-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1CC[C@@H]2C[N@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000451631425	529797857	/nfs/dbraw/zinc/79/78/57/529797857.db2.gz	NORJZCRQSGPGAW-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
CN1CC[C@@H]2C[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000451631425	529797859	/nfs/dbraw/zinc/79/78/59/529797859.db2.gz	NORJZCRQSGPGAW-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000330783994	232065940	/nfs/dbraw/zinc/06/59/40/232065940.db2.gz	RGGXFNOXTSORRT-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000330783994	232065942	/nfs/dbraw/zinc/06/59/42/232065942.db2.gz	RGGXFNOXTSORRT-NEPJUHHUSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748438	215111629	/nfs/dbraw/zinc/11/16/29/215111629.db2.gz	LEEKUTLAUHXQLY-SMDDNHRTSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](O)C(C)(C)C2)cccc1[N+](=O)[O-]	ZINC000279748438	215111632	/nfs/dbraw/zinc/11/16/32/215111632.db2.gz	LEEKUTLAUHXQLY-SMDDNHRTSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC1(C)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000279884191	215205561	/nfs/dbraw/zinc/20/55/61/215205561.db2.gz	UMNYLOAPPWUQNT-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC1(C)C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000279884191	215205564	/nfs/dbraw/zinc/20/55/64/215205564.db2.gz	UMNYLOAPPWUQNT-GFCCVEGCSA-N	1	1	318.333	1.848	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@H+](CCO)CC1	ZINC000171506799	186170334	/nfs/dbraw/zinc/17/03/34/186170334.db2.gz	XNOHXTPDDCUBRT-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
COc1ccc(C[N@@H+]2CCC[C@H](OCCO)C2)cc1[N+](=O)[O-]	ZINC000172298920	198073534	/nfs/dbraw/zinc/07/35/34/198073534.db2.gz	BMWZTRKQQDOURR-ZDUSSCGKSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc(C[N@H+]2CCC[C@H](OCCO)C2)cc1[N+](=O)[O-]	ZINC000172298920	198073536	/nfs/dbraw/zinc/07/35/36/198073536.db2.gz	BMWZTRKQQDOURR-ZDUSSCGKSA-N	1	1	310.350	1.577	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+]3CCCC[C@H]23)n1	ZINC000331725253	234049192	/nfs/dbraw/zinc/04/91/92/234049192.db2.gz	MPZRHBFUMSRBSC-GHMZBOCLSA-N	1	1	307.354	1.168	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000058858038	352854689	/nfs/dbraw/zinc/85/46/89/352854689.db2.gz	RQYIVULGSFWPMY-UHFFFAOYSA-N	1	1	320.393	1.997	20	5		DDBDMO
C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1	ZINC000069129502	353147708	/nfs/dbraw/zinc/14/77/08/353147708.db2.gz	BJPWJCGPAOEENQ-SNVBAGLBSA-N	1	1	313.379	1.356	20	5		DDBDMO
C[N@@H+](CCc1cccs1)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000075966662	353388855	/nfs/dbraw/zinc/38/88/55/353388855.db2.gz	LMBVKDVVQYGIIC-LBPRGKRZSA-N	1	1	310.379	1.388	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@@H](O)C1CC1	ZINC000079769977	353576259	/nfs/dbraw/zinc/57/62/59/353576259.db2.gz	XACXQMJBAUGLGW-CQSZACIVSA-N	1	1	308.334	1.664	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000079914610	353581801	/nfs/dbraw/zinc/58/18/01/353581801.db2.gz	OXQIHQHUSVPXJH-LLVKDONJSA-N	1	1	306.366	1.838	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000089930604	353783464	/nfs/dbraw/zinc/78/34/64/353783464.db2.gz	XHYRNOWWRRLCJY-PWSUYJOCSA-N	1	1	307.350	1.287	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]([C@@H](C)O)C1	ZINC000089932302	353784665	/nfs/dbraw/zinc/78/46/65/353784665.db2.gz	PFCXZYMTTOADHT-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]([C@@H](C)O)C1	ZINC000089932302	353784670	/nfs/dbraw/zinc/78/46/70/353784670.db2.gz	PFCXZYMTTOADHT-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2ncc([N+](=O)[O-])cc2C)CC1	ZINC000092612743	353863420	/nfs/dbraw/zinc/86/34/20/353863420.db2.gz	LHWMIYAVXDYZCA-CYBMUJFWSA-N	1	1	321.425	1.984	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000093344930	353897655	/nfs/dbraw/zinc/89/76/55/353897655.db2.gz	MLEXKCSERCMKIA-ITDIGPHOSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000093344930	353897656	/nfs/dbraw/zinc/89/76/56/353897656.db2.gz	MLEXKCSERCMKIA-ITDIGPHOSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@H](O)C[N@H+](C)Cc1ccccc1	ZINC000305356029	354469996	/nfs/dbraw/zinc/46/99/96/354469996.db2.gz	XQCPFLCLCZDWQV-CQSZACIVSA-N	1	1	304.350	1.593	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305730644	354471284	/nfs/dbraw/zinc/47/12/84/354471284.db2.gz	KIYQMCRENGQLKC-IINYFYTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@H]1C[N@H+](C)CCO1	ZINC000588002842	354891712	/nfs/dbraw/zinc/89/17/12/354891712.db2.gz	VKCVGKITFHZQIL-WCBMZHEXSA-N	1	1	323.378	1.731	20	5		DDBDMO
C[C@H](Nc1ncnc2sc([N+](=O)[O-])cc21)[C@H]1C[N@@H+](C)CCO1	ZINC000588002842	354891714	/nfs/dbraw/zinc/89/17/14/354891714.db2.gz	VKCVGKITFHZQIL-WCBMZHEXSA-N	1	1	323.378	1.731	20	5		DDBDMO
CN(c1cc(N)c([N+](=O)[O-])c(CO)c1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000588073536	354899060	/nfs/dbraw/zinc/89/90/60/354899060.db2.gz	IEBSXAWTLQCJKR-ONXXMXGDSA-N	1	1	320.393	1.731	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@H]2OCC[N@@H+](C)[C@H]2C1	ZINC000588838643	354941107	/nfs/dbraw/zinc/94/11/07/354941107.db2.gz	XHSOQWCGNKXCOZ-NWDGAFQWSA-N	1	1	309.370	1.029	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH+](C)C)[C@H]2C)c1[N+](=O)[O-]	ZINC000590403326	355085694	/nfs/dbraw/zinc/08/56/94/355085694.db2.gz	KSBNHEGZLQRNQW-MWLCHTKSSA-N	1	1	309.370	1.435	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000590442836	355096825	/nfs/dbraw/zinc/09/68/25/355096825.db2.gz	HLYSCOOTNPVXSX-FZMZJTMJSA-N	1	1	304.350	1.169	20	5		DDBDMO
C[C@H](C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1)c1cccc([N+](=O)[O-])c1	ZINC000590776498	355176327	/nfs/dbraw/zinc/17/63/27/355176327.db2.gz	OWMSTCBPFPZDDC-CORIIIEPSA-N	1	1	303.362	1.861	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H]2COC[C@@H]21	ZINC000590971659	355227446	/nfs/dbraw/zinc/22/74/46/355227446.db2.gz	DHGZITCHKUVJBV-IPYPFGDCSA-N	1	1	322.361	1.445	20	5		DDBDMO
Cc1cc(NC(=O)C(=O)N[C@@H]2CCC[N@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000591011448	355231464	/nfs/dbraw/zinc/23/14/64/355231464.db2.gz	UYQRKNWOBLISKE-GFCCVEGCSA-N	1	1	320.349	1.052	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNc2ncc([N+](=O)[O-])cc2F)C1	ZINC000591136851	355253180	/nfs/dbraw/zinc/25/31/80/355253180.db2.gz	MCVCAIJETWOSNT-GFCCVEGCSA-N	1	1	312.345	1.898	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)c1[N+](=O)[O-]	ZINC000591893463	355414944	/nfs/dbraw/zinc/41/49/44/355414944.db2.gz	YKEJWFKTCDVTSV-QWRGUYRKSA-N	1	1	307.354	1.231	20	5		DDBDMO
O=c1c(F)cc([N+](=O)[O-])cn1Cc1[nH+]ccn1CC(F)(F)F	ZINC000592357039	355565723	/nfs/dbraw/zinc/56/57/23/355565723.db2.gz	PNOJPJBSTVBIED-UHFFFAOYSA-N	1	1	320.202	1.703	20	5		DDBDMO
CCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)[C@H]1CC[N@@H+](C)C1	ZINC000592831452	355706609	/nfs/dbraw/zinc/70/66/09/355706609.db2.gz	MMQODIRDNHIOOR-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
CCCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000592832130	355707163	/nfs/dbraw/zinc/70/71/63/355707163.db2.gz	QUGPRRLZWWNPNH-AWEZNQCLSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCCC[C@@H]12	ZINC000594417364	356203062	/nfs/dbraw/zinc/20/30/62/356203062.db2.gz	BZDBOQOBFZCBPD-MNOVXSKESA-N	1	1	307.354	1.075	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1	ZINC000594569033	356251996	/nfs/dbraw/zinc/25/19/96/356251996.db2.gz	XTUIJDHYFLKTKS-HNNXBMFYSA-N	1	1	304.350	1.771	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000595455198	356499666	/nfs/dbraw/zinc/49/96/66/356499666.db2.gz	SZGRDZWJLBSSLX-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
CO[C@]1(CO)CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000595663732	356599657	/nfs/dbraw/zinc/59/96/57/356599657.db2.gz	SXGHESMEZKADFJ-OAHLLOKOSA-N	1	1	321.333	1.709	20	5		DDBDMO
CO[C@]1(CO)CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000595663732	356599661	/nfs/dbraw/zinc/59/96/61/356599661.db2.gz	SXGHESMEZKADFJ-OAHLLOKOSA-N	1	1	321.333	1.709	20	5		DDBDMO
C[C@@H]1C[NH+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H](C)C1O	ZINC000595742402	356631124	/nfs/dbraw/zinc/63/11/24/356631124.db2.gz	FYZPQKPVSCLEMH-GHMZBOCLSA-N	1	1	307.350	1.482	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595737066	356629512	/nfs/dbraw/zinc/62/95/12/356629512.db2.gz	GOECIWRFBOWWRU-OLZOCXBDSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C2	ZINC000595758425	356639403	/nfs/dbraw/zinc/63/94/03/356639403.db2.gz	MYBJAFYYLDLOPZ-IOASZLSFSA-N	1	1	322.361	1.303	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595761060	356642323	/nfs/dbraw/zinc/64/23/23/356642323.db2.gz	WLSUIAYUPQMIJC-HSMVNMDESA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H]2COC[C@]2(C)C1	ZINC000595761060	356642328	/nfs/dbraw/zinc/64/23/28/356642328.db2.gz	WLSUIAYUPQMIJC-HSMVNMDESA-N	1	1	319.361	1.890	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@@H]2C[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595808556	356659938	/nfs/dbraw/zinc/65/99/38/356659938.db2.gz	DAXFMQWRJDWYMS-CHWSQXEVSA-N	1	1	301.346	1.826	20	5		DDBDMO
O=C(C[N@H+]1CC[C@@H]2C[C@@H]2C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000595808556	356659939	/nfs/dbraw/zinc/65/99/39/356659939.db2.gz	DAXFMQWRJDWYMS-CHWSQXEVSA-N	1	1	301.346	1.826	20	5		DDBDMO
COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)C1	ZINC000595848124	356675784	/nfs/dbraw/zinc/67/57/84/356675784.db2.gz	NCCOJBZDPRJTEV-TXEJJXNPSA-N	1	1	308.334	1.987	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NCCn1cc([N+](=O)[O-])ccc1=O	ZINC000595873635	356687135	/nfs/dbraw/zinc/68/71/35/356687135.db2.gz	OQHIGXRHVAAWSV-UHFFFAOYSA-N	1	1	310.398	1.467	20	5		DDBDMO
CCCN(C)CC(C)(C)[NH2+]CCn1cc([N+](=O)[O-])ccc1=O	ZINC000595873635	356687139	/nfs/dbraw/zinc/68/71/39/356687139.db2.gz	OQHIGXRHVAAWSV-UHFFFAOYSA-N	1	1	310.398	1.467	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000596091136	356768699	/nfs/dbraw/zinc/76/86/99/356768699.db2.gz	WBAQOBARJUHHLH-SNVBAGLBSA-N	1	1	304.350	1.603	20	5		DDBDMO
CCOc1cc(CN2CC[NH+](CCO)CC2)ccc1[N+](=O)[O-]	ZINC000276908619	213168424	/nfs/dbraw/zinc/16/84/24/213168424.db2.gz	MWLVPGVXAFKGAG-UHFFFAOYSA-N	1	1	309.366	1.103	20	5		DDBDMO
COc1cccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1[N+](=O)[O-]	ZINC000596540545	356911091	/nfs/dbraw/zinc/91/10/91/356911091.db2.gz	UISGTZUNGIDHKQ-ZDUSSCGKSA-N	1	1	321.377	1.639	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000597202566	357090925	/nfs/dbraw/zinc/09/09/25/357090925.db2.gz	FIMXWALZITXXGG-MRXNPFEDSA-N	1	1	305.378	1.810	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597854857	357358858	/nfs/dbraw/zinc/35/88/58/357358858.db2.gz	NQTVKNAOBPXMIY-JTQLQIEISA-N	1	1	309.370	1.477	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])cnc1C)[C@@H]1CC[N@@H+](CC)C1	ZINC000598041302	357439035	/nfs/dbraw/zinc/43/90/35/357439035.db2.gz	KXPMKQFSDROYJG-GFCCVEGCSA-N	1	1	306.366	1.855	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@H+](C(C)(C)C)C2)n1	ZINC000597920421	357381832	/nfs/dbraw/zinc/38/18/32/357381832.db2.gz	BTGHCHBQOPIFOY-JTQLQIEISA-N	1	1	309.370	1.414	20	5		DDBDMO
CCC[N@@H+](C)CC(C)(C)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000598465391	357593249	/nfs/dbraw/zinc/59/32/49/357593249.db2.gz	MPXIAMVGYRBDCI-UHFFFAOYSA-N	1	1	310.354	1.546	20	5		DDBDMO
COC(=O)c1ccnc(N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000598631032	357662545	/nfs/dbraw/zinc/66/25/45/357662545.db2.gz	NYCNXFPSMPWJKQ-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
C[C@@H](CN1CCOCC1)Nc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601104660	358403386	/nfs/dbraw/zinc/40/33/86/358403386.db2.gz	CFYVGHGTOUPMTM-LBPRGKRZSA-N	1	1	316.361	1.698	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](CO)[C@@H](O)C3)c2c1	ZINC000601153056	358424210	/nfs/dbraw/zinc/42/42/10/358424210.db2.gz	UXTHWLQQXGPNJB-BONVTDFDSA-N	1	1	303.318	1.323	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCCN2c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000601159249	358427159	/nfs/dbraw/zinc/42/71/59/358427159.db2.gz	FKIKTQUVBNFURW-IAQYHMDHSA-N	1	1	312.329	1.858	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000601186544	358439171	/nfs/dbraw/zinc/43/91/71/358439171.db2.gz	PAVDWZHNPDCCFE-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
COC(=O)c1ccnc(N2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000601186544	358439173	/nfs/dbraw/zinc/43/91/73/358439173.db2.gz	PAVDWZHNPDCCFE-UHFFFAOYSA-N	1	1	308.338	1.307	20	5		DDBDMO
COC(=O)[C@]12C[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])C[C@H]1CCCC2	ZINC000602708815	359138921	/nfs/dbraw/zinc/13/89/21/359138921.db2.gz	XZSVHANLQLQJMB-IUODEOHRSA-N	1	1	322.365	1.494	20	5		DDBDMO
CC(C)c1ccc(CN2CC[N@@H+](C)C[C@@H]2CO)cc1[N+](=O)[O-]	ZINC000602716949	359144979	/nfs/dbraw/zinc/14/49/79/359144979.db2.gz	VZYGJYPHRFUOEA-CQSZACIVSA-N	1	1	307.394	1.827	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3nc[nH]n3)CC2)cc1	ZINC000602871283	359254492	/nfs/dbraw/zinc/25/44/92/359254492.db2.gz	PTPMXQDBCYEGSG-UHFFFAOYSA-N	1	1	302.338	1.078	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](C)O[C@]2(CCO[C@@H]2C)C1	ZINC000602819418	359214726	/nfs/dbraw/zinc/21/47/26/359214726.db2.gz	BGPUSIKALOJBCS-YWPYICTPSA-N	1	1	324.381	1.368	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@H+](CCO)C(C)(C)C1	ZINC000618473105	363643650	/nfs/dbraw/zinc/64/36/50/363643650.db2.gz	SSYSETLHWVGWFR-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000618473105	363643655	/nfs/dbraw/zinc/64/36/55/363643655.db2.gz	SSYSETLHWVGWFR-UHFFFAOYSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@@](CO)([NH2+]CC(=O)N1CCCC1)c1cccc([N+](=O)[O-])c1	ZINC000602962314	359324945	/nfs/dbraw/zinc/32/49/45/359324945.db2.gz	IPSHTHBIJLLBDT-HNNXBMFYSA-N	1	1	307.350	1.014	20	5		DDBDMO
Cn1cc(CN2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)c([N+](=O)[O-])n1	ZINC000603430805	359634975	/nfs/dbraw/zinc/63/49/75/359634975.db2.gz	VAIXNJCVJXTNOS-MGPQQGTHSA-N	1	1	323.397	1.189	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000187163611	200069896	/nfs/dbraw/zinc/06/98/96/200069896.db2.gz	YIGVFIPCWFGAFI-LBPRGKRZSA-N	1	1	324.381	1.269	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)CSc2ccc([N+](=O)[O-])cc2)C1	ZINC000604199711	359725726	/nfs/dbraw/zinc/72/57/26/359725726.db2.gz	TYNKBAOIXOTXIY-LLVKDONJSA-N	1	1	309.391	1.897	20	5		DDBDMO
COC1(CO)CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000618550794	363667572	/nfs/dbraw/zinc/66/75/72/363667572.db2.gz	DUYNXWXIRCECGO-UHFFFAOYSA-N	1	1	321.333	1.709	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2CCCOCC2)c(Cl)c1	ZINC000188493599	200256545	/nfs/dbraw/zinc/25/65/45/200256545.db2.gz	KCJGORKJHQTAOR-UHFFFAOYSA-N	1	1	300.746	1.777	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@H+]2CCCOCC2)c(Cl)c1	ZINC000188493599	200256547	/nfs/dbraw/zinc/25/65/47/200256547.db2.gz	KCJGORKJHQTAOR-UHFFFAOYSA-N	1	1	300.746	1.777	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CCCOCC2)c1	ZINC000189423523	200398673	/nfs/dbraw/zinc/39/86/73/200398673.db2.gz	OZUBANSDEIZDOQ-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCOCC2)c1	ZINC000189423523	200398675	/nfs/dbraw/zinc/39/86/75/200398675.db2.gz	OZUBANSDEIZDOQ-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1	ZINC000609384323	360302993	/nfs/dbraw/zinc/30/29/93/360302993.db2.gz	JDQLWRKFZMTUDE-CYBMUJFWSA-N	1	1	318.377	1.851	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609399724	360304020	/nfs/dbraw/zinc/30/40/20/360304020.db2.gz	LPUNLAYTAOWHFE-CQSZACIVSA-N	1	1	318.377	1.878	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000609648795	360340940	/nfs/dbraw/zinc/34/09/40/360340940.db2.gz	FOFMLOUBILSMGN-UHFFFAOYSA-N	1	1	322.365	1.515	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000609450144	360308237	/nfs/dbraw/zinc/30/82/37/360308237.db2.gz	CFZMONVWBKBZTI-NSHDSACASA-N	1	1	307.350	1.308	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000609450144	360308243	/nfs/dbraw/zinc/30/82/43/360308243.db2.gz	CFZMONVWBKBZTI-NSHDSACASA-N	1	1	307.350	1.308	20	5		DDBDMO
Cc1ccc(C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C2CC2)o1	ZINC000610367739	360422832	/nfs/dbraw/zinc/42/28/32/360422832.db2.gz	OAWBGNSKJDUQKC-AWEZNQCLSA-N	1	1	320.349	1.718	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1	ZINC000610504992	360455846	/nfs/dbraw/zinc/45/58/46/360455846.db2.gz	PSJITOCUXNSNOU-LSDHHAIUSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H]2c2cccc(F)c2)c1	ZINC000610504992	360455849	/nfs/dbraw/zinc/45/58/49/360455849.db2.gz	PSJITOCUXNSNOU-LSDHHAIUSA-N	1	1	320.324	1.738	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+](CC2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000610891568	360565604	/nfs/dbraw/zinc/56/56/04/360565604.db2.gz	WEUWXUQQASLKHB-LBPRGKRZSA-N	1	1	305.334	1.515	20	5		DDBDMO
O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000610891568	360565609	/nfs/dbraw/zinc/56/56/09/360565609.db2.gz	WEUWXUQQASLKHB-LBPRGKRZSA-N	1	1	305.334	1.515	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000611088436	360619312	/nfs/dbraw/zinc/61/93/12/360619312.db2.gz	VVXNBZGWZPTJOP-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc(OC)c([N+](=O)[O-])c2)C[C@H]1C	ZINC000611088436	360619318	/nfs/dbraw/zinc/61/93/18/360619318.db2.gz	VVXNBZGWZPTJOP-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
CCC[C@@H]1CN(c2cccnc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000611228213	360667721	/nfs/dbraw/zinc/66/77/21/360667721.db2.gz	UEUPOFMUMZFUAU-CYBMUJFWSA-N	1	1	308.382	1.927	20	5		DDBDMO
Cn1nccc1[C@H]1CCCC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000281396112	216270185	/nfs/dbraw/zinc/27/01/85/216270185.db2.gz	NENUUOAIPBNOGN-CQSZACIVSA-N	1	1	304.354	1.752	20	5		DDBDMO
Cn1nccc1[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000281396112	216270189	/nfs/dbraw/zinc/27/01/89/216270189.db2.gz	NENUUOAIPBNOGN-CQSZACIVSA-N	1	1	304.354	1.752	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C[C@@H]1C	ZINC000619441026	364010133	/nfs/dbraw/zinc/01/01/33/364010133.db2.gz	CGJCTGFQRHMGBX-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C[C@@H]1C	ZINC000619441026	364010138	/nfs/dbraw/zinc/01/01/38/364010138.db2.gz	CGJCTGFQRHMGBX-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CN(C(=O)C[N@@H+]1CC[C@@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000275487484	212367048	/nfs/dbraw/zinc/36/70/48/212367048.db2.gz	PFAXJPDBKVLGFW-CQSZACIVSA-N	1	1	321.377	1.650	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@@H](O)C(C)(C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000275487484	212367049	/nfs/dbraw/zinc/36/70/49/212367049.db2.gz	PFAXJPDBKVLGFW-CQSZACIVSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000349804261	284059935	/nfs/dbraw/zinc/05/99/35/284059935.db2.gz	UVIRLTGVXZBWCR-NSHDSACASA-N	1	1	315.395	1.602	20	5		DDBDMO
NC(=O)[C@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1F	ZINC000264571338	204003202	/nfs/dbraw/zinc/00/32/02/204003202.db2.gz	HPIXLCPJWZKXID-CYBMUJFWSA-N	1	1	310.329	1.486	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](CCOC)C2)c([N+](=O)[O-])c1	ZINC000264585584	204012707	/nfs/dbraw/zinc/01/27/07/204012707.db2.gz	KKXILBXPLZEJBS-GFCCVEGCSA-N	1	1	322.365	1.087	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+](C)[C@@H](C)CC)c1[N+](=O)[O-]	ZINC000264664657	204061973	/nfs/dbraw/zinc/06/19/73/204061973.db2.gz	JHHVSGGKUHSIKT-JTQLQIEISA-N	1	1	311.386	1.731	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000271720220	209154457	/nfs/dbraw/zinc/15/44/57/209154457.db2.gz	KUGFSCXXOAFTID-UPJWGTAASA-N	1	1	321.377	1.881	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000282728777	217206634	/nfs/dbraw/zinc/20/66/34/217206634.db2.gz	LAZWGSFMDIEBQJ-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
COc1cc(N[C@H](C)C[NH+]2CCN(C)CC2)ccc1[N+](=O)[O-]	ZINC000266386548	205308380	/nfs/dbraw/zinc/30/83/80/205308380.db2.gz	NOEDMUGMIJBHEI-GFCCVEGCSA-N	1	1	308.382	1.651	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@H](c2[nH+]ccn2C)C1	ZINC000359595606	299495359	/nfs/dbraw/zinc/49/53/59/299495359.db2.gz	WOFCSGDWNPYAEM-NSHDSACASA-N	1	1	304.354	1.847	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)c2ncc(Cl)cc2[N+](=O)[O-])[N@@H+](C)C1	ZINC000284628844	218107042	/nfs/dbraw/zinc/10/70/42/218107042.db2.gz	UMSGLUVSEUGWDX-QWRGUYRKSA-N	1	1	314.773	1.799	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(CCOc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000284740404	218158300	/nfs/dbraw/zinc/15/83/00/218158300.db2.gz	DJIMXOKRVHQONB-HZPDHXFCSA-N	1	1	321.377	1.379	20	5		DDBDMO
Cc1nn(C)c(C(=O)N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-]	ZINC000294090773	223846281	/nfs/dbraw/zinc/84/62/81/223846281.db2.gz	KFYKXYSNIQXZJU-OAHLLOKOSA-N	1	1	321.381	1.195	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1	ZINC000106469358	194218626	/nfs/dbraw/zinc/21/86/26/194218626.db2.gz	HWIORSDBMOKZQD-UHFFFAOYSA-N	1	1	302.352	1.128	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2ccc([N+](=O)[O-])c([O-])c2)[N@@H+](C)C1	ZINC000285348983	218391996	/nfs/dbraw/zinc/39/19/96/218391996.db2.gz	WWYREDMGFVOXAW-RYUDHWBXSA-N	1	1	323.349	1.092	20	5		DDBDMO
CC[N@@H+]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000060510990	184151005	/nfs/dbraw/zinc/15/10/05/184151005.db2.gz	GZJMJBOTALXQPC-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000060510990	184151007	/nfs/dbraw/zinc/15/10/07/184151007.db2.gz	GZJMJBOTALXQPC-LLVKDONJSA-N	1	1	313.379	1.357	20	5		DDBDMO
CC[N@H+](CCC(=O)OC)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000065670450	184376269	/nfs/dbraw/zinc/37/62/69/184376269.db2.gz	DUPWSGXKHQZRDO-UHFFFAOYSA-N	1	1	309.322	1.418	20	5		DDBDMO
CC[N@@H+](CCC(=O)OC)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000065670450	184376270	/nfs/dbraw/zinc/37/62/70/184376270.db2.gz	DUPWSGXKHQZRDO-UHFFFAOYSA-N	1	1	309.322	1.418	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)CCc1ccccc1[N+](=O)[O-]	ZINC000158960356	197314172	/nfs/dbraw/zinc/31/41/72/197314172.db2.gz	RDNJOXFUFLNQAV-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
COC[C@H]1CCCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000452028472	533130842	/nfs/dbraw/zinc/13/08/42/533130842.db2.gz	HFXUIFUSYPTRKX-CABCVRRESA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@@H]1O	ZINC000352657977	285202597	/nfs/dbraw/zinc/20/25/97/285202597.db2.gz	CPNFMVGJLPMTBJ-STQMWFEESA-N	1	1	318.333	1.990	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCC[C@@H]1O	ZINC000352696690	285234980	/nfs/dbraw/zinc/23/49/80/285234980.db2.gz	JZUVJRYQXCGMNN-CFVMTHIKSA-N	1	1	310.350	1.180	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CCC[NH+]1CCOCC1)CCO2	ZINC000352709243	285244968	/nfs/dbraw/zinc/24/49/68/285244968.db2.gz	ZMPPEKPQUHKEIC-UHFFFAOYSA-N	1	1	321.377	1.512	20	5		DDBDMO
C[C@H](CNC(=O)NCCc1cccc([N+](=O)[O-])c1)[N@@H+](C)C1CC1	ZINC000120713363	195221311	/nfs/dbraw/zinc/22/13/11/195221311.db2.gz	NQBLQGRGUXLDFF-GFCCVEGCSA-N	1	1	320.393	1.919	20	5		DDBDMO
CC1(C)C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)[C@@H]1[C@H]1CCCO1	ZINC000289683222	221151810	/nfs/dbraw/zinc/15/18/10/221151810.db2.gz	HUCLQSZCLQRODY-UKRRQHHQSA-N	1	1	321.377	1.646	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@H]1CCOC1	ZINC000494957214	533327759	/nfs/dbraw/zinc/32/77/59/533327759.db2.gz	NSWXHYMFZIQFRE-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000568921332	304321601	/nfs/dbraw/zinc/32/16/01/304321601.db2.gz	AZHNFGBWABINSO-UHFFFAOYSA-N	1	1	315.333	1.274	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000068338287	406633168	/nfs/dbraw/zinc/63/31/68/406633168.db2.gz	VHQUPZQBELGFHM-VIFPVBQESA-N	1	1	312.345	1.776	20	5		DDBDMO
C[N@@H+]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000048907704	407109628	/nfs/dbraw/zinc/10/96/28/407109628.db2.gz	ZESNOVVKERVJHV-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000048907704	407109630	/nfs/dbraw/zinc/10/96/30/407109630.db2.gz	ZESNOVVKERVJHV-QMMMGPOBSA-N	1	1	319.770	1.231	20	5		DDBDMO
C[N@H+]1CCCN(C(=O)CSc2ccc([N+](=O)[O-])cc2)CC1	ZINC000097617813	407300216	/nfs/dbraw/zinc/30/02/16/407300216.db2.gz	XNQBTEHEWUNMGG-UHFFFAOYSA-N	1	1	309.391	1.851	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCNC1=O	ZINC000105611714	407354808	/nfs/dbraw/zinc/35/48/08/407354808.db2.gz	UCXKSFNMZVUYKO-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000124661108	407365695	/nfs/dbraw/zinc/36/56/95/407365695.db2.gz	KAYBMWKJJWPKLA-VXGBXAGGSA-N	1	1	309.370	1.123	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000178558622	407490310	/nfs/dbraw/zinc/49/03/10/407490310.db2.gz	HIJJHXHUPIHLDV-UHFFFAOYSA-N	1	1	323.349	1.443	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000178558622	407490316	/nfs/dbraw/zinc/49/03/16/407490316.db2.gz	HIJJHXHUPIHLDV-UHFFFAOYSA-N	1	1	323.349	1.443	20	5		DDBDMO
CC[C@H]1CN(c2cc(OC)ccc2[N+](=O)[O-])CC[N@H+]1C[C@@H](C)O	ZINC000266397153	407537872	/nfs/dbraw/zinc/53/78/72/407537872.db2.gz	OXUDAIOITGXYOQ-OLZOCXBDSA-N	1	1	323.393	1.885	20	5		DDBDMO
Cc1nn(C)c(NCCc2cn3c([nH+]2)CCCC3)c1[N+](=O)[O-]	ZINC000114708716	407602081	/nfs/dbraw/zinc/60/20/81/407602081.db2.gz	CITYILOIJIOCKF-UHFFFAOYSA-N	1	1	304.354	1.824	20	5		DDBDMO
COCCC[N@@H+](C)CCNC(=O)c1ccc([N+](=O)[O-])s1	ZINC000152487194	407643438	/nfs/dbraw/zinc/64/34/38/407643438.db2.gz	RXNUXMFSPNUMCN-UHFFFAOYSA-N	1	1	301.368	1.354	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](CCO)c1ccccc1	ZINC000266940280	407683128	/nfs/dbraw/zinc/68/31/28/407683128.db2.gz	PRMMKQAQSFIAMS-OAHLLOKOSA-N	1	1	304.350	1.847	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)CC23CCCCC3)n1	ZINC000271386703	407661446	/nfs/dbraw/zinc/66/14/46/407661446.db2.gz	KNZLJSWHSSMGHY-UHFFFAOYSA-N	1	1	321.381	1.419	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])c4cnccc43)C[C@@H]21	ZINC000153159692	407766461	/nfs/dbraw/zinc/76/64/61/407766461.db2.gz	VUKRLOGMFPPUQF-JKSUJKDBSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@H](CO)C3)n2)cc1	ZINC000267162641	407773203	/nfs/dbraw/zinc/77/32/03/407773203.db2.gz	QXPCYLXQULKKBG-LLVKDONJSA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](CO)C3)n2)cc1	ZINC000267162641	407773211	/nfs/dbraw/zinc/77/32/11/407773211.db2.gz	QXPCYLXQULKKBG-LLVKDONJSA-N	1	1	318.333	1.849	20	5		DDBDMO
Cc1ccc(NC(=O)C(=O)NC[C@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000118107025	407893045	/nfs/dbraw/zinc/89/30/45/407893045.db2.gz	BQQCOTGYCCIVPF-GFCCVEGCSA-N	1	1	320.349	1.052	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000245418484	407969632	/nfs/dbraw/zinc/96/96/32/407969632.db2.gz	AVNOIIBWGRTLRJ-BXUZGUMPSA-N	1	1	307.350	1.493	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000245418484	407969636	/nfs/dbraw/zinc/96/96/36/407969636.db2.gz	AVNOIIBWGRTLRJ-BXUZGUMPSA-N	1	1	307.350	1.493	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000180754489	407915888	/nfs/dbraw/zinc/91/58/88/407915888.db2.gz	JADLIZKSOJGVFY-NSHDSACASA-N	1	1	322.365	1.018	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272583420	407995540	/nfs/dbraw/zinc/99/55/40/407995540.db2.gz	SCPUYFHGWOPXRK-JTQLQIEISA-N	1	1	313.304	1.755	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)[C@@H]2C1	ZINC000272596233	408000230	/nfs/dbraw/zinc/00/02/30/408000230.db2.gz	IMISXLNLOUTTKI-IINYFYTJSA-N	1	1	304.350	1.343	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@@H]1O	ZINC000273121059	408063705	/nfs/dbraw/zinc/06/37/05/408063705.db2.gz	HMMOILAFVIHNSM-DYEKYZERSA-N	1	1	310.350	1.037	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000119581449	408100096	/nfs/dbraw/zinc/10/00/96/408100096.db2.gz	VLMKQDMUEHLALU-CYBMUJFWSA-N	1	1	323.397	1.276	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNc1ncc(C(=O)OC)cc1[N+](=O)[O-]	ZINC000190171661	408182428	/nfs/dbraw/zinc/18/24/28/408182428.db2.gz	OQJVSMPWHHRTAA-SNVBAGLBSA-N	1	1	310.354	1.919	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@H]2C(N)=O)n1	ZINC000268827292	408210731	/nfs/dbraw/zinc/21/07/31/408210731.db2.gz	RGQWUTIKVSEWSQ-NSHDSACASA-N	1	1	307.354	1.050	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@@H]2C(N)=O)n1	ZINC000268827288	408212093	/nfs/dbraw/zinc/21/20/93/408212093.db2.gz	RGQWUTIKVSEWSQ-LLVKDONJSA-N	1	1	307.354	1.050	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@H]1CO)c1cccc([N+](=O)[O-])c1	ZINC000269479663	408324546	/nfs/dbraw/zinc/32/45/46/408324546.db2.gz	XXHRWAJPQIWJQR-HNNXBMFYSA-N	1	1	321.377	1.562	20	5		DDBDMO
C[C@@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1CO	ZINC000190856466	408329907	/nfs/dbraw/zinc/32/99/07/408329907.db2.gz	XSZMJBSKTGDBPE-PWSUYJOCSA-N	1	1	318.333	1.705	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000269379623	408288908	/nfs/dbraw/zinc/28/89/08/408288908.db2.gz	JBFIKGUPCVGDTL-NSHDSACASA-N	1	1	321.381	1.752	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000269379623	408288913	/nfs/dbraw/zinc/28/89/13/408288913.db2.gz	JBFIKGUPCVGDTL-NSHDSACASA-N	1	1	321.381	1.752	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[NH+]2CCN(c3ccccc3F)CC2)n1	ZINC000176189437	408303750	/nfs/dbraw/zinc/30/37/50/408303750.db2.gz	MSFWOOGCBPIMQS-UHFFFAOYSA-N	1	1	319.340	1.753	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000165302466	162159679	/nfs/dbraw/zinc/15/96/79/162159679.db2.gz	QCKNEVVWNOROHP-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000246892716	408360790	/nfs/dbraw/zinc/36/07/90/408360790.db2.gz	FHUVDBOOGVKANM-DOMZBBRYSA-N	1	1	319.361	1.668	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC([NH+]3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000171809681	162242684	/nfs/dbraw/zinc/24/26/84/162242684.db2.gz	HMBVHIHORWIUKJ-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+]2CCCC[C@H]2C1	ZINC000176833794	408455301	/nfs/dbraw/zinc/45/53/01/408455301.db2.gz	QQYIQOGNKPVBQL-LBPRGKRZSA-N	1	1	304.350	1.487	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+]2CCCC[C@H]2C1	ZINC000176833794	408455306	/nfs/dbraw/zinc/45/53/06/408455306.db2.gz	QQYIQOGNKPVBQL-LBPRGKRZSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000183555122	408439543	/nfs/dbraw/zinc/43/95/43/408439543.db2.gz	LKYWIPUPRNYJEG-WDEREUQCSA-N	1	1	307.354	1.936	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@H]1C[N@@H+](C(C)C)C[C@H]1C	ZINC000247506090	408483233	/nfs/dbraw/zinc/48/32/33/408483233.db2.gz	XZVMHIZQSMTWGO-YGRLFVJLSA-N	1	1	306.366	1.757	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000247545939	408490790	/nfs/dbraw/zinc/49/07/90/408490790.db2.gz	YIPSKNDDUFMRJG-JSGCOSHPSA-N	1	1	323.397	1.370	20	5		DDBDMO
C[C@H]1c2cccn2CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000247559688	408492560	/nfs/dbraw/zinc/49/25/60/408492560.db2.gz	QQTRBHWTYFGOKQ-WCQYABFASA-N	1	1	305.338	1.031	20	5		DDBDMO
C[C@H]1c2cccn2CC[N@@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000247559688	408492562	/nfs/dbraw/zinc/49/25/62/408492562.db2.gz	QQTRBHWTYFGOKQ-WCQYABFASA-N	1	1	305.338	1.031	20	5		DDBDMO
CCC[C@H]1C[N@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248462881	408573744	/nfs/dbraw/zinc/57/37/44/408573744.db2.gz	QFWBTHHABKBDED-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CCC[C@H]1C[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000248462881	408573750	/nfs/dbraw/zinc/57/37/50/408573750.db2.gz	QFWBTHHABKBDED-KGLIPLIRSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC1(O)CC[NH+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC1	ZINC000177330281	408582206	/nfs/dbraw/zinc/58/22/06/408582206.db2.gz	OELFOFFRLGONKG-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000265297301	408606446	/nfs/dbraw/zinc/60/64/46/408606446.db2.gz	LNJCFHLJCWLTCP-LLVKDONJSA-N	1	1	309.370	1.051	20	5		DDBDMO
C[C@H]([NH2+]CCCN1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000162111606	408671392	/nfs/dbraw/zinc/67/13/92/408671392.db2.gz	MVPVDQAFMZQEBU-AWEZNQCLSA-N	1	1	306.410	1.883	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000249256511	408707556	/nfs/dbraw/zinc/70/75/56/408707556.db2.gz	HKTYHIWUIFHJQR-NHYWBVRUSA-N	1	1	318.377	1.733	20	5		DDBDMO
O=C1CCCN1[C@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000270858201	408711547	/nfs/dbraw/zinc/71/15/47/408711547.db2.gz	HTWVJMCUVITGLF-AWEZNQCLSA-N	1	1	319.361	1.670	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000265628050	408719994	/nfs/dbraw/zinc/71/99/94/408719994.db2.gz	RGJQUCLTACMPLL-CYBMUJFWSA-N	1	1	322.365	1.115	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(Cc3cc([N+](=O)[O-])cc4c3OCOC4)C[C@H]2C1	ZINC000193627968	408733891	/nfs/dbraw/zinc/73/38/91/408733891.db2.gz	MADVJPWIUYDZIO-OKILXGFUSA-N	1	1	319.361	1.455	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000270949957	408756452	/nfs/dbraw/zinc/75/64/52/408756452.db2.gz	LFTXFMIGGWFOTN-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
C[C@H]1C[C@H](N2CCOCC2)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000285857033	408877531	/nfs/dbraw/zinc/87/75/31/408877531.db2.gz	IJSILTPKOHRNOT-BBRMVZONSA-N	1	1	305.378	1.890	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1[nH]nc(CC)c1[N+](=O)[O-]	ZINC000290876225	408848783	/nfs/dbraw/zinc/84/87/83/408848783.db2.gz	JIKXOYHHIUNNNK-JTQLQIEISA-N	1	1	311.386	1.731	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])n[nH]1)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1	ZINC000285742691	408855090	/nfs/dbraw/zinc/85/50/90/408855090.db2.gz	LBPORQYPDAGMDM-ZWNOBZJWSA-N	1	1	319.365	1.407	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2F)[C@@H](C)C1	ZINC000282094572	408989997	/nfs/dbraw/zinc/98/99/97/408989997.db2.gz	OWOJEYKSQXETGV-NWDGAFQWSA-N	1	1	311.357	1.621	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCc1c[nH+]c(N(C)C)n1C	ZINC000278084529	409062650	/nfs/dbraw/zinc/06/26/50/409062650.db2.gz	XMHWNZKBIVMTMQ-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
CCOCC[NH+]1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1	ZINC000278304020	409079115	/nfs/dbraw/zinc/07/91/15/409079115.db2.gz	GVHDRAUTNAKLMS-UHFFFAOYSA-N	1	1	320.393	1.721	20	5		DDBDMO
CCNC(=O)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)C(C)C	ZINC000293351423	409094977	/nfs/dbraw/zinc/09/49/77/409094977.db2.gz	TWBUFGXTHBWFNS-AWEZNQCLSA-N	1	1	309.366	1.854	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000293373625	409099918	/nfs/dbraw/zinc/09/99/18/409099918.db2.gz	JIIXDRMVULFSSF-FRRDWIJNSA-N	1	1	320.393	1.946	20	5		DDBDMO
C[C@@H]([N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)O	ZINC000295223021	409382965	/nfs/dbraw/zinc/38/29/65/409382965.db2.gz	VVKRZAWYDIXMDI-VXGBXAGGSA-N	1	1	312.366	1.426	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+]3CCC[C@H]3C2)n1	ZINC000322339192	164046726	/nfs/dbraw/zinc/04/67/26/164046726.db2.gz	BPZNZCQJDOXCJM-MNOVXSKESA-N	1	1	320.349	1.815	20	5		DDBDMO
C[C@@H]1CN(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1C	ZINC000296435826	409553204	/nfs/dbraw/zinc/55/32/04/409553204.db2.gz	TVJOAUQDLFIXAZ-BETUJISGSA-N	1	1	320.393	1.871	20	5		DDBDMO
CCc1ccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000304371958	409617470	/nfs/dbraw/zinc/61/74/70/409617470.db2.gz	WICHQQOBOBVPNV-MRXNPFEDSA-N	1	1	318.377	1.847	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@H]2c2ccccc2)c1	ZINC000304339050	409609101	/nfs/dbraw/zinc/60/91/01/409609101.db2.gz	PGALAKOWPHARFT-CVEARBPZSA-N	1	1	316.361	1.989	20	5		DDBDMO
Cc1[nH+]ccn1CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000342673028	409800275	/nfs/dbraw/zinc/80/02/75/409800275.db2.gz	VJUYQQRGMUYOCQ-UHFFFAOYSA-N	1	1	300.274	1.396	20	5		DDBDMO
COCC[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1CC1	ZINC000342695699	409820778	/nfs/dbraw/zinc/82/07/78/409820778.db2.gz	PTEULVODKBKSNJ-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+]1CCOC	ZINC000346560369	410017019	/nfs/dbraw/zinc/01/70/19/410017019.db2.gz	BBGQMSJMAUJAKR-GFCCVEGCSA-N	1	1	324.381	1.496	20	5		DDBDMO
COc1cc(CN2CCC[N@H+]([C@H](C)CO)CC2)ccc1[N+](=O)[O-]	ZINC000346631768	410047069	/nfs/dbraw/zinc/04/70/69/410047069.db2.gz	DGLFEQCGJFKVHB-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
C[C@@H](CO)[N@H+]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])CC1	ZINC000346654075	410058352	/nfs/dbraw/zinc/05/83/52/410058352.db2.gz	RFIDNXQITWUKML-LBPRGKRZSA-N	1	1	311.357	1.622	20	5		DDBDMO
C[C@@H]1CC[C@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)O1	ZINC000298036789	410088058	/nfs/dbraw/zinc/08/80/58/410088058.db2.gz	GVJWYPUQRMXLDV-CHWSQXEVSA-N	1	1	306.366	1.679	20	5		DDBDMO
Cc1nccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1	ZINC000351639854	410129998	/nfs/dbraw/zinc/12/99/98/410129998.db2.gz	FUYOOEPRXQZZGV-CYBMUJFWSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1nccc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1	ZINC000351639854	410130003	/nfs/dbraw/zinc/13/00/03/410130003.db2.gz	FUYOOEPRXQZZGV-CYBMUJFWSA-N	1	1	314.349	1.775	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000298288927	410168029	/nfs/dbraw/zinc/16/80/29/410168029.db2.gz	IFPWOMWYPSKKFA-NSHDSACASA-N	1	1	321.381	1.765	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cn(CCCn2cc[nH+]c2C)c1=O	ZINC000298525045	410271752	/nfs/dbraw/zinc/27/17/52/410271752.db2.gz	WJESZMRDEQJVKA-UHFFFAOYSA-N	1	1	320.305	1.138	20	5		DDBDMO
C[C@H]1C[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](C)N1C	ZINC000339621172	410338851	/nfs/dbraw/zinc/33/88/51/410338851.db2.gz	GERMDTZPVSWVJV-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNc2ncc([N+](=O)[O-])c(N)n2)C[C@H](C)O1	ZINC000298725049	410365377	/nfs/dbraw/zinc/36/53/77/410365377.db2.gz	PPMOUGKLHKHUBF-UWVGGRQHSA-N	1	1	324.385	1.267	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000351959190	410371016	/nfs/dbraw/zinc/37/10/16/410371016.db2.gz	NVEPXUQRWPCOJR-CABZTGNLSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1O	ZINC000351959190	410371019	/nfs/dbraw/zinc/37/10/19/410371019.db2.gz	NVEPXUQRWPCOJR-CABZTGNLSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H](CNc1ncc([N+](=O)[O-])cc1C(N)=O)[N@H+]1CCC[C@@H](C)C1	ZINC000298755312	410384078	/nfs/dbraw/zinc/38/40/78/410384078.db2.gz	YACISCNPJBTAGD-GHMZBOCLSA-N	1	1	321.381	1.621	20	5		DDBDMO
O=C1[C@H]([N@H+]2CCC[C@@H](O)CC2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000339782703	410458249	/nfs/dbraw/zinc/45/82/49/410458249.db2.gz	HESNXNCXLGUGCK-HUUCEWRRSA-N	1	1	319.361	1.547	20	5		DDBDMO
C[C@]12CCC[N@H+]1C[C@H](c1noc(-c3cc([N+](=O)[O-])c[nH]3)n1)OC2	ZINC000347332769	410478784	/nfs/dbraw/zinc/47/87/84/410478784.db2.gz	IGYRQWBFOHNGPN-BXUZGUMPSA-N	1	1	319.321	1.899	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H]2C1	ZINC000355376248	410480977	/nfs/dbraw/zinc/48/09/77/410480977.db2.gz	XEPFMWCKHRBWAD-CABCVRRESA-N	1	1	319.361	1.530	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000352233280	410566103	/nfs/dbraw/zinc/56/61/03/410566103.db2.gz	BOHGUXSLWWWKEN-DOMZBBRYSA-N	1	1	319.361	1.668	20	5		DDBDMO
COC1CC([N@@H+](C)C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000352214145	410555123	/nfs/dbraw/zinc/55/51/23/410555123.db2.gz	YGYYFUSYZRVEEK-JVWICGRDSA-N	1	1	310.350	1.444	20	5		DDBDMO
CCOc1cc(N2CC[N@@H+](C[C@H](C)O)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000301507762	410732809	/nfs/dbraw/zinc/73/28/09/410732809.db2.gz	HMLKTWVJQWVXJL-STQMWFEESA-N	1	1	323.393	1.885	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H]2Cc2ccccc2)c1	ZINC000353040145	410754005	/nfs/dbraw/zinc/75/40/05/410754005.db2.gz	NIBAZDMKTGMDLQ-HOCLYGCPSA-N	1	1	316.361	1.469	20	5		DDBDMO
Cc1nc(N2CCC[C@H]2C[N@H+]2CCC[C@H]2CO)ccc1[N+](=O)[O-]	ZINC000301662799	410767289	/nfs/dbraw/zinc/76/72/89/410767289.db2.gz	NDSWHYVPUMRNEH-KBPBESRZSA-N	1	1	320.393	1.724	20	5		DDBDMO
C[C@@H]1CN(CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C[N@H+]1C	ZINC000330586575	410801903	/nfs/dbraw/zinc/80/19/03/410801903.db2.gz	LSOFUORHDRJYCT-OLZOCXBDSA-N	1	1	320.393	1.582	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1c([N+](=O)[O-])c(C)nn1C	ZINC000330677528	410868936	/nfs/dbraw/zinc/86/89/36/410868936.db2.gz	VHTBYMGFWJXNDD-NSHDSACASA-N	1	1	309.370	1.241	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+](C)C[C@H]1C	ZINC000330680325	410872685	/nfs/dbraw/zinc/87/26/85/410872685.db2.gz	YLXIWHRSGMWGIC-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN(C)C[C@H]1C	ZINC000330680325	410872691	/nfs/dbraw/zinc/87/26/91/410872691.db2.gz	YLXIWHRSGMWGIC-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN(C)C[C@H]1C	ZINC000330680325	410872696	/nfs/dbraw/zinc/87/26/96/410872696.db2.gz	YLXIWHRSGMWGIC-CYBMUJFWSA-N	1	1	320.393	1.868	20	5		DDBDMO
COc1cc(CN[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1O	ZINC000330679903	410874110	/nfs/dbraw/zinc/87/41/10/410874110.db2.gz	YESWMKLXPYYBOU-JQWIXIFHSA-N	1	1	309.366	1.881	20	5		DDBDMO
Cc1nn(CCC(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)c(C)c1[N+](=O)[O-]	ZINC000330605531	410820896	/nfs/dbraw/zinc/82/08/96/410820896.db2.gz	ZDVYNUWHKZJQQQ-MNOVXSKESA-N	1	1	323.397	1.349	20	5		DDBDMO
CC(=O)NC1CCC([N@@H+](C)CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000344083338	410943421	/nfs/dbraw/zinc/94/34/21/410943421.db2.gz	DZQHMQWWCKNKQO-UHFFFAOYSA-N	1	1	309.370	1.170	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](CN)C1CC1	ZINC000359997288	410988910	/nfs/dbraw/zinc/98/89/10/410988910.db2.gz	ACKNSHREPVCQND-OAHLLOKOSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H](CN)C1CC1	ZINC000359997288	410988917	/nfs/dbraw/zinc/98/89/17/410988917.db2.gz	ACKNSHREPVCQND-OAHLLOKOSA-N	1	1	320.393	1.901	20	5		DDBDMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000348522944	410998130	/nfs/dbraw/zinc/99/81/30/410998130.db2.gz	AQSBBLMXRRVNSX-VXGBXAGGSA-N	1	1	307.350	1.559	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000331197235	411011628	/nfs/dbraw/zinc/01/16/28/411011628.db2.gz	OCNYOQCGKTYBCF-GFCCVEGCSA-N	1	1	307.350	1.445	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000331197235	411011630	/nfs/dbraw/zinc/01/16/30/411011630.db2.gz	OCNYOQCGKTYBCF-GFCCVEGCSA-N	1	1	307.350	1.445	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356472353	411047301	/nfs/dbraw/zinc/04/73/01/411047301.db2.gz	ZQFJVRPMILOPNV-PHIMTYICSA-N	1	1	309.370	1.321	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3c[nH]c4nccnc34)nc2c1	ZINC000356411641	411015737	/nfs/dbraw/zinc/01/57/37/411015737.db2.gz	YAZYCPREFVCRJZ-UHFFFAOYSA-N	1	1	323.316	1.984	20	5		DDBDMO
O=C(NCC[N@@H+]1CCCOCC1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000353686553	411109718	/nfs/dbraw/zinc/10/97/18/411109718.db2.gz	FQTNUPWVXNSPIG-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
O=C(NCC[N@H+]1CCCOCC1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000353686553	411109719	/nfs/dbraw/zinc/10/97/19/411109719.db2.gz	FQTNUPWVXNSPIG-UHFFFAOYSA-N	1	1	311.313	1.186	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1CCOc1ccccc1[N+](=O)[O-]	ZINC000419334999	226122063	/nfs/dbraw/zinc/12/20/63/226122063.db2.gz	VYAZMLAXPPUEJS-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@H]2C(=O)NC(=O)[C@H]2C1	ZINC000366332974	418459594	/nfs/dbraw/zinc/45/95/94/418459594.db2.gz	PNBADEOIFUWTCF-USWWRNFRSA-N	1	1	303.318	1.250	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NCC[N@@H+](C)C2CCCC2)n1	ZINC000191804250	222109439	/nfs/dbraw/zinc/10/94/39/222109439.db2.gz	YDFIXTJISBZDLB-UHFFFAOYSA-N	1	1	309.370	1.415	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(CC(=O)Nc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000375031283	418592422	/nfs/dbraw/zinc/59/24/22/418592422.db2.gz	NPCGQTGCLAWNHP-DOMZBBRYSA-N	1	1	318.377	1.559	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])o1)N1C[C@@H]2C[N@H+]3CCCC[C@H]3[C@H]2C1	ZINC000361199466	418604486	/nfs/dbraw/zinc/60/44/86/418604486.db2.gz	DUQVIHZZTVSCAF-SRVKXCTJSA-N	1	1	305.334	1.744	20	5		DDBDMO
O=C1NCCN1[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000361308679	418622163	/nfs/dbraw/zinc/62/21/63/418622163.db2.gz	DYLLQWYWBLULBO-OAHLLOKOSA-N	1	1	318.377	1.627	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CC[C@](O)(C3CC3)C2)c([N+](=O)[O-])c1	ZINC000373239741	418933468	/nfs/dbraw/zinc/93/34/68/418933468.db2.gz	BAAKPOKEWARYLZ-OAHLLOKOSA-N	1	1	305.334	1.041	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H]1CCO	ZINC000426215042	419405707	/nfs/dbraw/zinc/40/57/07/419405707.db2.gz	HQYHBTWWEVELDJ-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H]1CCO	ZINC000426215042	419405712	/nfs/dbraw/zinc/40/57/12/419405712.db2.gz	HQYHBTWWEVELDJ-LBPRGKRZSA-N	1	1	307.350	1.689	20	5		DDBDMO
COC(=O)[C@@H]1CN([C@H](C)c2ccccc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000411912324	419476070	/nfs/dbraw/zinc/47/60/70/419476070.db2.gz	VGKZXMDOVOWJLI-OLZOCXBDSA-N	1	1	321.377	1.692	20	5		DDBDMO
O=[N+]([O-])c1ccnn1Cc1ccc(C[NH+]2CCOCC2)cc1	ZINC000421845182	419748827	/nfs/dbraw/zinc/74/88/27/419748827.db2.gz	PTLWTAVNLBHZJG-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@H]1CCCC[N@H+]1C1CC1	ZINC000434444369	229297477	/nfs/dbraw/zinc/29/74/77/229297477.db2.gz	BZTWYNXXCIRIPR-LLVKDONJSA-N	1	1	307.354	1.075	20	5		DDBDMO
COCC[NH2+]CCN[C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1	ZINC000423325518	420013578	/nfs/dbraw/zinc/01/35/78/420013578.db2.gz	IWSCJUDQULLFTD-CHWSQXEVSA-N	1	1	311.386	1.101	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)ccc1[N+](=O)[O-]	ZINC000430787130	420190079	/nfs/dbraw/zinc/19/00/79/420190079.db2.gz	FFLGINURLBHFHV-JSGCOSHPSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[C@@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@H]1[NH3+]	ZINC000430967672	420227600	/nfs/dbraw/zinc/22/76/00/420227600.db2.gz	UDUFBENVXWVGAC-BXUZGUMPSA-N	1	1	306.366	1.593	20	5		DDBDMO
C[C@H]1CN(c2ccnc3c2cccc3[N+](=O)[O-])CC[N@H+]1CCO	ZINC000432169838	420241241	/nfs/dbraw/zinc/24/12/41/420241241.db2.gz	NEYZOLLTTSKBTA-LBPRGKRZSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000420390872	420257685	/nfs/dbraw/zinc/25/76/85/420257685.db2.gz	RKULHDCHCHLVMT-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000420606510	420329456	/nfs/dbraw/zinc/32/94/56/420329456.db2.gz	XJJSHJREMYWIDB-LLVKDONJSA-N	1	1	306.366	1.980	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(c3nc4sccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC000425286172	420339917	/nfs/dbraw/zinc/33/99/17/420339917.db2.gz	QDHZZKLLSJPSGK-VHSXEESVSA-N	1	1	307.379	1.834	20	5		DDBDMO
COc1cc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)ccc1[N+](=O)[O-]	ZINC000450793494	420531250	/nfs/dbraw/zinc/53/12/50/420531250.db2.gz	PRLHNUPDSIVXMO-BETUJISGSA-N	1	1	307.350	1.879	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[NH2+][C@@H](c2ccccc2)C1	ZINC000457000401	420584345	/nfs/dbraw/zinc/58/43/45/420584345.db2.gz	UQUKUJJLYKIOCC-CQSZACIVSA-N	1	1	300.318	1.710	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[C@@H](CC[NH3+])C1	ZINC000443054760	420740788	/nfs/dbraw/zinc/74/07/88/420740788.db2.gz	AASGDTYZHGIQNX-ZDUSSCGKSA-N	1	1	320.393	1.903	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000447813630	420804794	/nfs/dbraw/zinc/80/47/94/420804794.db2.gz	STZFBLNPCRTPTP-LLVKDONJSA-N	1	1	318.381	2.170	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCCc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000454736257	420918073	/nfs/dbraw/zinc/91/80/73/420918073.db2.gz	YVWSOVVTRNPEPL-HIFRSBDPSA-N	1	1	318.377	1.483	20	5		DDBDMO
[NH3+][C@H]1CCC[C@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449635814	421041061	/nfs/dbraw/zinc/04/10/61/421041061.db2.gz	CHSPHBDNIFPSKI-UWVGGRQHSA-N	1	1	317.349	1.718	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000456355131	421146922	/nfs/dbraw/zinc/14/69/22/421146922.db2.gz	PXRBFQFSOIFLAZ-ZDUSSCGKSA-N	1	1	321.377	1.916	20	5		DDBDMO
C[C@H]1COCC[N@@H+]1CCNc1nccc2cc([N+](=O)[O-])ccc21	ZINC000450310924	421180638	/nfs/dbraw/zinc/18/06/38/421180638.db2.gz	CBZRTBADRNLGMI-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[C@H]1COCC[N@H+]1CCNc1nccc2cc([N+](=O)[O-])ccc21	ZINC000450310924	421180640	/nfs/dbraw/zinc/18/06/40/421180640.db2.gz	CBZRTBADRNLGMI-LBPRGKRZSA-N	1	1	316.361	2.276	20	5		DDBDMO
C[N@H+]1CC[C@@H](Cn2nnnc2Sc2ccc([N+](=O)[O-])nc2)C1	ZINC000450397908	421192949	/nfs/dbraw/zinc/19/29/49/421192949.db2.gz	WMGXQDTZXMMBIP-SECBINFHSA-N	1	1	321.366	1.079	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000548731891	421467990	/nfs/dbraw/zinc/46/79/90/421467990.db2.gz	LJQDKYVLLDTDRJ-CYBMUJFWSA-N	1	1	306.366	1.840	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2C2(O)CC2)c([N+](=O)[O-])c1	ZINC000516157681	421531467	/nfs/dbraw/zinc/53/14/67/421531467.db2.gz	RZKHWDOEDKQMDT-AWEZNQCLSA-N	1	1	319.361	1.573	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CC[N@@H+](C)C(C)(C)C1	ZINC000556084579	421699961	/nfs/dbraw/zinc/69/99/61/421699961.db2.gz	GIGQFUGPQATWFN-GFCCVEGCSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)C1	ZINC000572177867	421767153	/nfs/dbraw/zinc/76/71/53/421767153.db2.gz	DNQIOUFHBYIYMC-GFCCVEGCSA-N	1	1	321.381	1.297	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCNC1	ZINC000423193937	533685405	/nfs/dbraw/zinc/68/54/05/533685405.db2.gz	RCQRFWBUISWOOY-YPMHNXCESA-N	1	1	306.366	1.654	20	5		DDBDMO
CC(C)Oc1nc(N[C@H](C)[C@@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565854	422350371	/nfs/dbraw/zinc/35/03/71/422350371.db2.gz	ISIVTQRRTQGGBC-YPMHNXCESA-N	1	1	324.381	1.908	20	5		DDBDMO
CC(C)Oc1nc(N[C@H](C)[C@@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000594565854	422350376	/nfs/dbraw/zinc/35/03/76/422350376.db2.gz	ISIVTQRRTQGGBC-YPMHNXCESA-N	1	1	324.381	1.908	20	5		DDBDMO
CNc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000314828408	271013062	/nfs/dbraw/zinc/01/30/62/271013062.db2.gz	FPZUMGHRGAJKMC-GFCCVEGCSA-N	1	1	306.366	1.803	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC[N@H+](C2CCC2)C1	ZINC000344730679	272103902	/nfs/dbraw/zinc/10/39/02/272103902.db2.gz	PHXNXZCKVRYQAQ-NSHDSACASA-N	1	1	306.366	1.869	20	5		DDBDMO
COCC[N@H+]1CCCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000269378641	274027183	/nfs/dbraw/zinc/02/71/83/274027183.db2.gz	OKTMFGOGASZULO-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)CO	ZINC000444686810	274267052	/nfs/dbraw/zinc/26/70/52/274267052.db2.gz	UEMOKZFSLIMOIA-VHSXEESVSA-N	1	1	308.338	1.035	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)CO	ZINC000444686810	274267053	/nfs/dbraw/zinc/26/70/53/274267053.db2.gz	UEMOKZFSLIMOIA-VHSXEESVSA-N	1	1	308.338	1.035	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+](CCO)CC2)c2ncccc12	ZINC000171506901	275036097	/nfs/dbraw/zinc/03/60/97/275036097.db2.gz	WHCSZZVSFDBBEM-UHFFFAOYSA-N	1	1	316.361	1.647	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CN1CCN(c2ccncc2[N+](=O)[O-])CC1	ZINC000337313357	277047081	/nfs/dbraw/zinc/04/70/81/277047081.db2.gz	ADTGSDZSFSXCSZ-AWEZNQCLSA-N	1	1	319.409	1.596	20	5		DDBDMO
CC[N@@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCNC1=O	ZINC000282503887	279210889	/nfs/dbraw/zinc/21/08/89/279210889.db2.gz	WXVLABGVGAVXFS-LBPRGKRZSA-N	1	1	323.349	1.193	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CNCC[C@@H]1C	ZINC000414932431	279247515	/nfs/dbraw/zinc/24/75/15/279247515.db2.gz	RBXQHEKUBICHDF-ZOWXZIJZSA-N	1	1	320.393	1.900	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000130583034	281386626	/nfs/dbraw/zinc/38/66/26/281386626.db2.gz	GDGLIIJQQIGANV-UHFFFAOYSA-N	1	1	317.349	1.844	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H]1CCOC1	ZINC000247232101	282039937	/nfs/dbraw/zinc/03/99/37/282039937.db2.gz	ZJFCKPPYVIDVQI-NWDGAFQWSA-N	1	1	307.350	1.890	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000165683178	298215961	/nfs/dbraw/zinc/21/59/61/298215961.db2.gz	LLLJFOBSZBXJRR-LBPRGKRZSA-N	1	1	323.397	1.713	20	5		DDBDMO
C[C@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+](C2CC2)C1	ZINC000295445291	300183264	/nfs/dbraw/zinc/18/32/64/300183264.db2.gz	AJSCWHSTLHTWNI-LLVKDONJSA-N	1	1	318.377	1.733	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@]1(CO)CCCc2ccccc21	ZINC000366919264	300772161	/nfs/dbraw/zinc/77/21/61/300772161.db2.gz	CJWXYFBOQUVWOC-MRXNPFEDSA-N	1	1	316.361	1.642	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CCC[C@@H]2c2nccs2)c1	ZINC000368404320	301019957	/nfs/dbraw/zinc/01/99/57/301019957.db2.gz	LIHNCFGZVNSCLG-VXGBXAGGSA-N	1	1	323.378	1.446	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCC[C@@H]2c2nccs2)c1	ZINC000368404320	301019960	/nfs/dbraw/zinc/01/99/60/301019960.db2.gz	LIHNCFGZVNSCLG-VXGBXAGGSA-N	1	1	323.378	1.446	20	5		DDBDMO
COc1cccc(NC[C@H]2C[N@H+]3CCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000368486706	301038872	/nfs/dbraw/zinc/03/88/72/301038872.db2.gz	OVOOCYZDYUSQDC-RYUDHWBXSA-N	1	1	307.350	1.879	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](n2cncn2)C1	ZINC000368872553	301098338	/nfs/dbraw/zinc/09/83/38/301098338.db2.gz	LPEXJAQJYIUBQA-CYBMUJFWSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](n2cncn2)C1	ZINC000368872553	301098341	/nfs/dbraw/zinc/09/83/41/301098341.db2.gz	LPEXJAQJYIUBQA-CYBMUJFWSA-N	1	1	303.322	1.642	20	5		DDBDMO
CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000369912998	301238720	/nfs/dbraw/zinc/23/87/20/301238720.db2.gz	MLUACXOGYBHBNP-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CCC[N@H+](Cc2ccccc2)C1	ZINC000369912998	301238723	/nfs/dbraw/zinc/23/87/23/301238723.db2.gz	MLUACXOGYBHBNP-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1	ZINC000369912998	301238724	/nfs/dbraw/zinc/23/87/24/301238724.db2.gz	MLUACXOGYBHBNP-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](N2CCNC2=O)C1	ZINC000370376357	301327012	/nfs/dbraw/zinc/32/70/12/301327012.db2.gz	ZJUWMOTYYHEUEM-HNNXBMFYSA-N	1	1	318.377	1.893	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000377481539	302183666	/nfs/dbraw/zinc/18/36/66/302183666.db2.gz	LZKAHZGMXOUWRT-QWHCGFSZSA-N	1	1	319.361	1.496	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])cc1F	ZINC000377510192	302187899	/nfs/dbraw/zinc/18/78/99/302187899.db2.gz	FKHBQBSVJBESCW-VXGBXAGGSA-N	1	1	323.324	1.327	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)CC1	ZINC000532873287	303300281	/nfs/dbraw/zinc/30/02/81/303300281.db2.gz	IWMHOVJXGZFOBF-UHFFFAOYSA-N	1	1	306.366	1.832	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@@H](O)C2(CC2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000364444973	307045834	/nfs/dbraw/zinc/04/58/34/307045834.db2.gz	RFHMFASCNZFKKW-CYBMUJFWSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608734	307191951	/nfs/dbraw/zinc/19/19/51/307191951.db2.gz	DTVBFYPHPNCEIB-BFYDXBDKSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1	ZINC000373608734	307191952	/nfs/dbraw/zinc/19/19/52/307191952.db2.gz	DTVBFYPHPNCEIB-BFYDXBDKSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608734	307191953	/nfs/dbraw/zinc/19/19/53/307191953.db2.gz	DTVBFYPHPNCEIB-BFYDXBDKSA-N	1	1	317.389	1.823	20	5		DDBDMO
CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301691	307242578	/nfs/dbraw/zinc/24/25/78/307242578.db2.gz	HTFUGVZZEAGRCO-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000376301691	307242579	/nfs/dbraw/zinc/24/25/79/307242579.db2.gz	HTFUGVZZEAGRCO-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])[C@@H]1CC[N@@H+](Cc2ccccc2)C1	ZINC000376301691	307242580	/nfs/dbraw/zinc/24/25/80/307242580.db2.gz	HTFUGVZZEAGRCO-BZUAXINKSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1C[C@@H]([NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN1C	ZINC000567345836	308078717	/nfs/dbraw/zinc/07/87/17/308078717.db2.gz	VTVMCALZTVGXPL-VNHYZAJKSA-N	1	1	323.393	1.407	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1CCOC	ZINC000570686454	308176838	/nfs/dbraw/zinc/17/68/38/308176838.db2.gz	QWUBXASGZUXKKM-NSHDSACASA-N	1	1	312.345	1.676	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])cc2F)CC[N@H+]1CCOC	ZINC000570686454	308176839	/nfs/dbraw/zinc/17/68/39/308176839.db2.gz	QWUBXASGZUXKKM-NSHDSACASA-N	1	1	312.345	1.676	20	5		DDBDMO
C[C@H]1[C@@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000488728632	484215715	/nfs/dbraw/zinc/21/57/15/484215715.db2.gz	FLAAXYDCEIKKJP-CMPLNLGQSA-N	1	1	318.333	1.848	20	5		DDBDMO
CC(C)OC[C@@H](O)C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000493796299	484239474	/nfs/dbraw/zinc/23/94/74/484239474.db2.gz	OTSKTBCHCUMZAA-OCCSQVGLSA-N	1	1	324.381	1.262	20	5		DDBDMO
COc1cc(C[NH2+][C@H](CO)c2cnn(C)c2)ccc1[N+](=O)[O-]	ZINC000494808283	533903947	/nfs/dbraw/zinc/90/39/47/533903947.db2.gz	JFMONQDDOCKZOH-GFCCVEGCSA-N	1	1	306.322	1.160	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444688248	534249579	/nfs/dbraw/zinc/24/95/79/534249579.db2.gz	IXNNWQYUAJKGKC-WDEREUQCSA-N	1	1	303.366	1.996	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000305816457	534339513	/nfs/dbraw/zinc/33/95/13/534339513.db2.gz	AFEQTHIZEVAROK-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000305816457	534339520	/nfs/dbraw/zinc/33/95/20/534339520.db2.gz	AFEQTHIZEVAROK-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000156015143	519678120	/nfs/dbraw/zinc/67/81/20/519678120.db2.gz	AHOWTNUTZTUWSL-LLVKDONJSA-N	1	1	322.365	1.546	20	5		DDBDMO
Cc1cccc(C(=O)NC[C@H]2CCCC[N@H+]2CCO)c1[N+](=O)[O-]	ZINC000452378485	534608441	/nfs/dbraw/zinc/60/84/41/534608441.db2.gz	WZIRVILBGOEHHK-CYBMUJFWSA-N	1	1	321.377	1.480	20	5		DDBDMO
[NH3+]C[C@H]1CCCC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000158396888	527233269	/nfs/dbraw/zinc/23/32/69/527233269.db2.gz	AHWGPOIKBLMUSP-BXKDBHETSA-N	1	1	317.349	1.718	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000451546092	528062478	/nfs/dbraw/zinc/06/24/78/528062478.db2.gz	RUWREUVSSJMUOK-ABAIWWIYSA-N	1	1	321.377	1.941	20	5		DDBDMO
CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(=O)OC	ZINC000299362299	528400046	/nfs/dbraw/zinc/40/00/46/528400046.db2.gz	VXXPPNVTIDWGQT-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(=O)OC	ZINC000299362299	528400051	/nfs/dbraw/zinc/40/00/51/528400051.db2.gz	VXXPPNVTIDWGQT-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000451250279	529344018	/nfs/dbraw/zinc/34/40/18/529344018.db2.gz	DEJJOPRJGSIONL-WFASDCNBSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3nn[nH]n3)c2)CC1	ZINC000825459827	607452021	/nfs/dbraw/zinc/45/20/21/607452021.db2.gz	OMDZYRATYOWXRR-UHFFFAOYSA-N	1	1	317.353	1.307	20	5		DDBDMO
C[C@@H]1C[C@H](Nc2nccc(-c3nn[nH]n3)c2[N+](=O)[O-])CC[N@H+]1C	ZINC000820669008	606711922	/nfs/dbraw/zinc/71/19/22/606711922.db2.gz	YKKPZWLSYHOSIN-RKDXNWHRSA-N	1	1	318.341	1.065	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@H]2CCCS2(=O)=O)c1	ZINC000126747974	696764961	/nfs/dbraw/zinc/76/49/61/696764961.db2.gz	OZDDUQJPHPFYGO-LLVKDONJSA-N	1	1	318.782	1.915	20	5		DDBDMO
CC1(C)CC(C[N@H+]2CCCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)C1	ZINC000981137974	697015597	/nfs/dbraw/zinc/01/55/97/697015597.db2.gz	IZAMPTXNLARKQD-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC000981137974	697015600	/nfs/dbraw/zinc/01/56/00/697015600.db2.gz	IZAMPTXNLARKQD-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC1(C)CC(C[N@H+]2CCCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)C1	ZINC000981137974	697015602	/nfs/dbraw/zinc/01/56/02/697015602.db2.gz	IZAMPTXNLARKQD-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
Cc1csc(C[NH2+]C[C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)n1	ZINC000983650503	697286488	/nfs/dbraw/zinc/28/64/88/697286488.db2.gz	VDCXREOZYZHAPP-DDHJBXDOSA-N	1	1	324.406	1.101	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]CC2CC(F)(F)C2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983655339	697286895	/nfs/dbraw/zinc/28/68/95/697286895.db2.gz	SRKUWQPHJCKLFB-HJQYOEGKSA-N	1	1	317.336	1.181	20	5		DDBDMO
CCC[C@@H]1CN(Cn2nccc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000159833888	697312393	/nfs/dbraw/zinc/31/23/93/697312393.db2.gz	KGDBIGRZSNJZPO-CYBMUJFWSA-N	1	1	311.386	1.182	20	5		DDBDMO
CC(C)c1[nH+]ccn1CCNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000772910648	697693568	/nfs/dbraw/zinc/69/35/68/697693568.db2.gz	RQRNXXKWKRQJIR-UHFFFAOYSA-N	1	1	306.326	1.078	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC(O)(C(F)F)CC2)c1	ZINC000778307512	698259839	/nfs/dbraw/zinc/25/98/39/698259839.db2.gz	GGMPLFHPPXRURA-GFCCVEGCSA-N	1	1	316.304	1.720	20	5		DDBDMO
O=C1[C@H]([N@H+]2C[C@H]3C[C@@]3(CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000782613391	698750593	/nfs/dbraw/zinc/75/05/93/698750593.db2.gz	HXIGCXXQUOJDKO-XFJVYGCCSA-N	1	1	317.345	1.014	20	5		DDBDMO
CC[N@H+](C[C@@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000738077784	699752064	/nfs/dbraw/zinc/75/20/64/699752064.db2.gz	XDHDAEAERAANHA-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
CC[N@@H+](C[C@@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000738077784	699752066	/nfs/dbraw/zinc/75/20/66/699752066.db2.gz	XDHDAEAERAANHA-NSHDSACASA-N	1	1	321.333	1.819	20	5		DDBDMO
C[C@@H]1OCC[C@@H]1[N@@H+](CCO)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000796578725	699940130	/nfs/dbraw/zinc/94/01/30/699940130.db2.gz	JXQYSNFJMUYYFS-TUKIKUTGSA-N	1	1	310.350	1.100	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1	ZINC000751918867	700326449	/nfs/dbraw/zinc/32/64/49/700326449.db2.gz	IEXCISVKVAWYOC-OUKQBFOZSA-N	1	1	321.377	1.693	20	5		DDBDMO
COC[C@H]1CCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000751949552	700329842	/nfs/dbraw/zinc/32/98/42/700329842.db2.gz	LQWJNTAPBYORQY-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
COC(=O)[C@@H]1C[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C[C@H]1C	ZINC000755928320	700593361	/nfs/dbraw/zinc/59/33/61/700593361.db2.gz	XLEUENIDNZXVME-ZWNOBZJWSA-N	1	1	318.333	1.643	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CC(O)C1	ZINC000759874424	700778907	/nfs/dbraw/zinc/77/89/07/700778907.db2.gz	HUNAIQYUFAOVBV-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CC(O)C1	ZINC000759874424	700778908	/nfs/dbraw/zinc/77/89/08/700778908.db2.gz	HUNAIQYUFAOVBV-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@@H+](C)[C@H](C)C1	ZINC000761077256	700840219	/nfs/dbraw/zinc/84/02/19/700840219.db2.gz	NSJRNHKQSISBLY-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H](CO)C3CC3)n2)cc1	ZINC000763088160	700925139	/nfs/dbraw/zinc/92/51/39/700925139.db2.gz	WJAXVAVMPUOVSL-LBPRGKRZSA-N	1	1	304.306	1.505	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CCC(=O)OCCn1ccc([N+](=O)[O-])n1	ZINC000803856623	701150105	/nfs/dbraw/zinc/15/01/05/701150105.db2.gz	SSXQQOSALDTAJA-GFCCVEGCSA-N	1	1	310.354	1.599	20	5		DDBDMO
C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)[C@H]1C[N@H+](C)CCO1	ZINC000770237079	701272460	/nfs/dbraw/zinc/27/24/60/701272460.db2.gz	RMXPEBVWAVLZQO-ZDJYVOAGSA-N	1	1	319.361	1.443	20	5		DDBDMO
C[C@H](NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)[C@H]1C[N@@H+](C)CCO1	ZINC000770237079	701272461	/nfs/dbraw/zinc/27/24/61/701272461.db2.gz	RMXPEBVWAVLZQO-ZDJYVOAGSA-N	1	1	319.361	1.443	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000770739797	701292730	/nfs/dbraw/zinc/29/27/30/701292730.db2.gz	MFGNFBCSIRNLQU-NSHDSACASA-N	1	1	307.350	1.818	20	5		DDBDMO
CNC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])c(F)c2)CC1	ZINC000839664770	701771690	/nfs/dbraw/zinc/77/16/90/701771690.db2.gz	CUUSOLDMWKJOFV-UHFFFAOYSA-N	1	1	310.329	1.627	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000839689932	701785251	/nfs/dbraw/zinc/78/52/51/701785251.db2.gz	CHJBGEOSVBZVHU-RRFJBIMHSA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@H+](Cc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839689932	701785255	/nfs/dbraw/zinc/78/52/55/701785255.db2.gz	CHJBGEOSVBZVHU-RRFJBIMHSA-N	1	1	303.362	1.385	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC000839689932	701785257	/nfs/dbraw/zinc/78/52/57/701785257.db2.gz	CHJBGEOSVBZVHU-RRFJBIMHSA-N	1	1	303.362	1.385	20	5		DDBDMO
O=C(Cc1cccc(F)c1[N+](=O)[O-])NCC[N@@H+]1CC=CCC1	ZINC000867921438	701831577	/nfs/dbraw/zinc/83/15/77/701831577.db2.gz	KQXKAEFZHSUFIG-UHFFFAOYSA-N	1	1	307.325	1.655	20	5		DDBDMO
C[C@H]1CSCCN1C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000867927793	701835284	/nfs/dbraw/zinc/83/52/84/701835284.db2.gz	OMWUBFXVHLOEEN-HZMBPMFUSA-N	1	1	309.391	1.733	20	5		DDBDMO
COC(=O)[C@H]1CN(c2ccc(C)cc2[N+](=O)[O-])CC[N@@H+](C)C1	ZINC000840361680	702083324	/nfs/dbraw/zinc/08/33/24/702083324.db2.gz	ZKTSIJJHWYKGBP-GFCCVEGCSA-N	1	1	307.350	1.444	20	5		DDBDMO
CN1CC[NH+](C2CCN(c3sccc3[N+](=O)[O-])CC2)CC1	ZINC000866212994	706651174	/nfs/dbraw/zinc/65/11/74/706651174.db2.gz	PCZDIZSFUSCIOL-UHFFFAOYSA-N	1	1	310.423	1.873	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)COc3ccc([N+](=O)[O-])c(F)c3)[C@@H]2C1	ZINC000816950098	702234270	/nfs/dbraw/zinc/23/42/70/702234270.db2.gz	LVEWAWGJOSJTTG-IINYFYTJSA-N	1	1	323.324	1.275	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@@H]2C1	ZINC000816952046	702234966	/nfs/dbraw/zinc/23/49/66/702234966.db2.gz	BEMWUXMHGRUYJB-AMIZOPFISA-N	1	1	308.313	1.092	20	5		DDBDMO
CNC(=O)NC[C@@H]1CCCC[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000879332926	706652483	/nfs/dbraw/zinc/65/24/83/706652483.db2.gz	NITXSJKYUGEATK-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
CNC(=O)NC[C@@H]1CCCC[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000879332926	706652484	/nfs/dbraw/zinc/65/24/84/706652484.db2.gz	NITXSJKYUGEATK-ZDUSSCGKSA-N	1	1	306.366	1.878	20	5		DDBDMO
O=C(OCC1CC[NH+](Cc2ccco2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000842324874	702703680	/nfs/dbraw/zinc/70/36/80/702703680.db2.gz	IKRIUCSRTGZJJM-ZIAGYGMSSA-N	1	1	308.334	1.700	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](COC(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000842836509	702781907	/nfs/dbraw/zinc/78/19/07/702781907.db2.gz	PIFGPKWUFLLINP-LBPRGKRZSA-N	1	1	310.354	1.455	20	5		DDBDMO
COc1ncncc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000843395227	702873150	/nfs/dbraw/zinc/87/31/50/702873150.db2.gz	QXTAEFWUGPXTOM-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1ncncc1C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000843395227	702873153	/nfs/dbraw/zinc/87/31/53/702873153.db2.gz	QXTAEFWUGPXTOM-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
[NH3+]CC(F)(F)CC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000846673636	703312958	/nfs/dbraw/zinc/31/29/58/703312958.db2.gz	WDBRJDPDYKMIBB-UHFFFAOYSA-N	1	1	307.684	1.849	20	5		DDBDMO
C[N@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@H]1CCOC1	ZINC000848478687	703555019	/nfs/dbraw/zinc/55/50/19/703555019.db2.gz	QURMULKENIFCHM-GJZGRUSLSA-N	1	1	319.361	1.589	20	5		DDBDMO
C[N@@H+](CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@H]1CCOC1	ZINC000848478687	703555020	/nfs/dbraw/zinc/55/50/20/703555020.db2.gz	QURMULKENIFCHM-GJZGRUSLSA-N	1	1	319.361	1.589	20	5		DDBDMO
CCOCC[N@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848483238	703555864	/nfs/dbraw/zinc/55/58/64/703555864.db2.gz	AGIWAFXOPCBKEI-HNNXBMFYSA-N	1	1	321.377	1.837	20	5		DDBDMO
CCOCC[N@@H+](C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000848483238	703555865	/nfs/dbraw/zinc/55/58/65/703555865.db2.gz	AGIWAFXOPCBKEI-HNNXBMFYSA-N	1	1	321.377	1.837	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCC[C@@](O)(C3CC3)C2)cc1	ZINC000852500764	704064172	/nfs/dbraw/zinc/06/41/72/704064172.db2.gz	DKDYKZIVGDFEFH-CVEARBPZSA-N	1	1	306.362	1.865	20	5		DDBDMO
O=C(CC[N@H+]1CCC2(COC2)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000852683700	704099741	/nfs/dbraw/zinc/09/97/41/704099741.db2.gz	PXBAEQXNPYHCBY-UHFFFAOYSA-N	1	1	323.324	1.785	20	5		DDBDMO
C[C@@H](C[C@H]1CCCC[N@H+]1C)OC(=O)Cn1cc([N+](=O)[O-])cn1	ZINC000870789976	704132874	/nfs/dbraw/zinc/13/28/74/704132874.db2.gz	LFZVPOHFWALDKJ-NWDGAFQWSA-N	1	1	310.354	1.597	20	5		DDBDMO
C[N@@H+](C[C@H]1CCOC1)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853501843	704251856	/nfs/dbraw/zinc/25/18/56/704251856.db2.gz	LOFQJDJTPMISRR-GFCCVEGCSA-N	1	1	317.349	1.779	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCC3(COC3)C2)c2ncc([N+](=O)[O-])cc12	ZINC000853598563	704282219	/nfs/dbraw/zinc/28/22/19/704282219.db2.gz	VADZSJLEZLOWLF-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC3(COC3)C2)c2ncc([N+](=O)[O-])cc12	ZINC000853598563	704282222	/nfs/dbraw/zinc/28/22/22/704282222.db2.gz	VADZSJLEZLOWLF-UHFFFAOYSA-N	1	1	303.322	1.328	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2ccc(N)c([N+](=O)[O-])n2)C[C@@H]1C	ZINC000853708751	704303042	/nfs/dbraw/zinc/30/30/42/704303042.db2.gz	UGPYEKCQBJPBID-PHIMTYICSA-N	1	1	309.370	1.117	20	5		DDBDMO
C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)CCC(C)(C)[N+](=O)[O-]	ZINC000854643235	704431974	/nfs/dbraw/zinc/43/19/74/704431974.db2.gz	SEOIQYUICYJEOH-QWHCGFSZSA-N	1	1	313.398	1.144	20	5		DDBDMO
COC(=O)CC[C@H]([NH3+])c1nc(Cc2ccccc2[N+](=O)[O-])no1	ZINC000822647671	704995769	/nfs/dbraw/zinc/99/57/69/704995769.db2.gz	SRTSSVCOTZWANW-JTQLQIEISA-N	1	1	320.305	1.522	20	5		DDBDMO
O=C1OC[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]12	ZINC000860165552	705121057	/nfs/dbraw/zinc/12/10/57/705121057.db2.gz	ACIYFYXVXMSSBS-MWLCHTKSSA-N	1	1	307.262	1.108	20	5		DDBDMO
O=C1OC[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]12	ZINC000860165552	705121060	/nfs/dbraw/zinc/12/10/60/705121060.db2.gz	ACIYFYXVXMSSBS-MWLCHTKSSA-N	1	1	307.262	1.108	20	5		DDBDMO
CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000823968264	705346933	/nfs/dbraw/zinc/34/69/33/705346933.db2.gz	NHIWTVYXONFKSY-AWEZNQCLSA-N	1	1	321.381	1.981	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2ccc([N+](=O)[O-])n2C)C1	ZINC000861345108	705436818	/nfs/dbraw/zinc/43/68/18/705436818.db2.gz	YWBYYBNHHFWONT-IINYFYTJSA-N	1	1	311.338	1.199	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825777200	705730028	/nfs/dbraw/zinc/73/00/28/705730028.db2.gz	RFSZPCQOXBVXDG-SMDDNHRTSA-N	1	1	307.350	1.086	20	5		DDBDMO
CC(C)(O)[C@@H]1CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000877835758	706227225	/nfs/dbraw/zinc/22/72/25/706227225.db2.gz	WTWVTRIQRFQZJO-GFCCVEGCSA-N	1	1	322.361	1.959	20	5		DDBDMO
O=C(NC[C@@H]1C[N@H+]2CCC[C@H]2CO1)c1c(F)cccc1[N+](=O)[O-]	ZINC000865057863	706338114	/nfs/dbraw/zinc/33/81/14/706338114.db2.gz	FXDTVXVYTQFIDS-WDEREUQCSA-N	1	1	323.324	1.327	20	5		DDBDMO
CO[C@@H]1COCC[C@H]1[N@@H+](C)CCOc1ccccc1[N+](=O)[O-]	ZINC000880425589	706970408	/nfs/dbraw/zinc/97/04/08/706970408.db2.gz	GHGPZRGPWFLYBM-IUODEOHRSA-N	1	1	310.350	1.709	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCOC[C@@H]1OC	ZINC000880436986	706976341	/nfs/dbraw/zinc/97/63/41/706976341.db2.gz	DWCBGRPFGQCERA-ZFWWWQNUSA-N	1	1	310.350	1.839	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCO[C@@H](C(F)F)CC2)c1	ZINC000872271347	707358157	/nfs/dbraw/zinc/35/81/57/707358157.db2.gz	NSPFZMJJCOXLJG-QWHCGFSZSA-N	1	1	316.304	1.984	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCO[C@@H](C(F)F)CC2)c1	ZINC000872271347	707358161	/nfs/dbraw/zinc/35/81/61/707358161.db2.gz	NSPFZMJJCOXLJG-QWHCGFSZSA-N	1	1	316.304	1.984	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(N(C)C)cc1F	ZINC000882492289	707663892	/nfs/dbraw/zinc/66/38/92/707663892.db2.gz	PETMYVCDQZIWBC-SNVBAGLBSA-N	1	1	324.356	1.624	20	5		DDBDMO
CN1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+](C)CC1	ZINC000897096858	708229455	/nfs/dbraw/zinc/22/94/55/708229455.db2.gz	HKCMGWHIVIOHSX-UHFFFAOYSA-N	1	1	314.336	1.557	20	5		DDBDMO
CN1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC[N@@H+](C)CC1	ZINC000897096858	708229456	/nfs/dbraw/zinc/22/94/56/708229456.db2.gz	HKCMGWHIVIOHSX-UHFFFAOYSA-N	1	1	314.336	1.557	20	5		DDBDMO
Nc1ccc(N2CC[C@H]3[C@@H]2CCC[N@H+]3CCO)c([N+](=O)[O-])c1	ZINC000897219937	708257709	/nfs/dbraw/zinc/25/77/09/708257709.db2.gz	QIXSAFORLSYVGA-STQMWFEESA-N	1	1	306.366	1.212	20	5		DDBDMO
O=C1CCCN1C[C@H]1CC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285198	708735713	/nfs/dbraw/zinc/73/57/13/708735713.db2.gz	AYSRTBVUXHMETD-LBPRGKRZSA-N	1	1	304.350	1.434	20	5		DDBDMO
O=C1CCCN1C[C@H]1CC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886285198	708735715	/nfs/dbraw/zinc/73/57/15/708735715.db2.gz	AYSRTBVUXHMETD-LBPRGKRZSA-N	1	1	304.350	1.434	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC[C@@]3(CO)CCC[C@@H]23)cc1	ZINC000886631261	708799139	/nfs/dbraw/zinc/79/91/39/708799139.db2.gz	IITUCMKALCKUFG-BZUAXINKSA-N	1	1	306.362	1.865	20	5		DDBDMO
O=C(C1C[NH+]([C@@H]2CCOC2)C1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000900099693	709288745	/nfs/dbraw/zinc/28/87/45/709288745.db2.gz	TUUCTOQLYRSREQ-CQSZACIVSA-N	1	1	317.345	1.205	20	5		DDBDMO
C[C@@H](NC(=O)CN1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000928249664	713157392	/nfs/dbraw/zinc/15/73/92/713157392.db2.gz	URTNCHNZWJOFDW-GFCCVEGCSA-N	1	1	306.366	1.019	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000891741799	710280470	/nfs/dbraw/zinc/28/04/70/710280470.db2.gz	UICQHVBPOZOTMI-LBPRGKRZSA-N	1	1	309.370	1.019	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000892418663	710434342	/nfs/dbraw/zinc/43/43/42/710434342.db2.gz	RZWLIUXWTUALKB-OCCSQVGLSA-N	1	1	304.350	1.440	20	5		DDBDMO
C[C@H]1C[N@@H+](CCCOC(=O)c2cccc([N+](=O)[O-])c2)CCO1	ZINC000893391568	710632406	/nfs/dbraw/zinc/63/24/06/710632406.db2.gz	MPISPAWPGVOKNK-LBPRGKRZSA-N	1	1	308.334	1.862	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@H]([C@H](C)O)C2)c1[N+](=O)[O-]	ZINC000893418027	710644451	/nfs/dbraw/zinc/64/44/51/710644451.db2.gz	NZBVVBPIHICVAZ-QWRGUYRKSA-N	1	1	310.350	1.902	20	5		DDBDMO
C[C@@H]1[C@@H](NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)CC[N@H+]1C	ZINC000928444785	713198754	/nfs/dbraw/zinc/19/87/54/713198754.db2.gz	MLGGHNJTRINTNB-KOLCDFICSA-N	1	1	302.334	1.899	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)CC[N@H+]1C	ZINC000928447854	713201157	/nfs/dbraw/zinc/20/11/57/713201157.db2.gz	AHXPGXYLZZGPRL-NOZJJQNGSA-N	1	1	302.334	1.899	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CCN(C[C@@H]3CCCC[NH2+]C3)C2)nc1	ZINC000903739896	711262779	/nfs/dbraw/zinc/26/27/79/711262779.db2.gz	AXMSJKFAXPKWHH-ZIAGYGMSSA-N	1	1	319.409	1.866	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1Cc2c[nH+]cn2C1	ZINC000894996609	711356725	/nfs/dbraw/zinc/35/67/25/711356725.db2.gz	NLEWNSVRSLEUSB-SNVBAGLBSA-N	1	1	316.317	1.923	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000913538590	713249352	/nfs/dbraw/zinc/24/93/52/713249352.db2.gz	FBZXNMBONSOCOM-GFUWMAFRSA-N	1	1	301.346	1.913	20	5		DDBDMO
C[C@H]1[C@H](Nc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)CC[N@H+]1C	ZINC000895737461	711590900	/nfs/dbraw/zinc/59/09/00/711590900.db2.gz	VRHXZQUCZAELLD-VHSXEESVSA-N	1	1	319.365	1.290	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@H]3C[C@@H]4COC[C@@H]4O3)c2c1	ZINC000896087877	711674394	/nfs/dbraw/zinc/67/43/94/711674394.db2.gz	IIRKASJHXJEHCM-SIVJFFJCSA-N	1	1	315.329	1.781	20	5		DDBDMO
Cc1cc(C(=O)N[C@H](C)[C@@H]2C[N@@H+](C)CCN2C)cc([N+](=O)[O-])c1	ZINC000896568489	711754439	/nfs/dbraw/zinc/75/44/39/711754439.db2.gz	NLSJDHOVGYFGJI-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
C[C@@H]1CN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[C@H]1C[NH3+]	ZINC000904410715	711854435	/nfs/dbraw/zinc/85/44/35/711854435.db2.gz	FYBCPMLRQTXRGB-NEPJUHHUSA-N	1	1	321.377	1.783	20	5		DDBDMO
C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CC1	ZINC000916966611	713476250	/nfs/dbraw/zinc/47/62/50/713476250.db2.gz	DYZWAJKJIDHHNC-UHFFFAOYSA-N	1	1	304.350	1.239	20	5		DDBDMO
Cc1cc(N(C)CC(=O)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000917006957	713477789	/nfs/dbraw/zinc/47/77/89/713477789.db2.gz	ZPCCDZVYMGJXMX-UHFFFAOYSA-N	1	1	306.366	1.113	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000918395545	713541517	/nfs/dbraw/zinc/54/15/17/713541517.db2.gz	PUHJOSZXAQVVJL-GFCCVEGCSA-N	1	1	317.349	1.155	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)Cn2c(C)ncc2[N+](=O)[O-])[C@H](C)C1	ZINC000933440022	714589807	/nfs/dbraw/zinc/58/98/07/714589807.db2.gz	XDMBIQLHULEGAH-YPMHNXCESA-N	1	1	323.397	1.288	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H]2C2OCCO2)c1	ZINC000933900312	714696855	/nfs/dbraw/zinc/69/68/55/714696855.db2.gz	JIUMPIXXMAFMMM-KGLIPLIRSA-N	1	1	308.334	1.466	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@@H]2C2OCCO2)c1	ZINC000933900312	714696856	/nfs/dbraw/zinc/69/68/56/714696856.db2.gz	JIUMPIXXMAFMMM-KGLIPLIRSA-N	1	1	308.334	1.466	20	5		DDBDMO
C[N@H+]1C[C@H](O)C[C@@H]1CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000924989615	714717868	/nfs/dbraw/zinc/71/78/68/714717868.db2.gz	SSJCOIXUVJNSLS-RKDXNWHRSA-N	1	1	313.741	1.043	20	5		DDBDMO
CO[C@@H]1CC[C@@H]1[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000934117982	714746010	/nfs/dbraw/zinc/74/60/10/714746010.db2.gz	QWTYMKBEIMBFFC-MBNYWOFBSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=C1CC[N@@H+](CCOc2ccccc2[N+](=O)[O-])CCCCCN1	ZINC000934161089	714757845	/nfs/dbraw/zinc/75/78/45/714757845.db2.gz	MWNPTHAUVQLVSQ-UHFFFAOYSA-N	1	1	321.377	1.966	20	5		DDBDMO
Cc1c(CN2CC[C@H]3[C@H]2CCC[N@H+]3CCO)cccc1[N+](=O)[O-]	ZINC000934257981	714777791	/nfs/dbraw/zinc/77/77/91/714777791.db2.gz	KSAIBTGNYBTRMG-SJORKVTESA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@@H+]2CC[C@H]3[C@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257981	714777792	/nfs/dbraw/zinc/77/77/92/714777792.db2.gz	KSAIBTGNYBTRMG-SJORKVTESA-N	1	1	319.405	1.934	20	5		DDBDMO
Cc1c(C[N@H+]2CC[C@H]3[C@H]2CCCN3CCO)cccc1[N+](=O)[O-]	ZINC000934257981	714777793	/nfs/dbraw/zinc/77/77/93/714777793.db2.gz	KSAIBTGNYBTRMG-SJORKVTESA-N	1	1	319.405	1.934	20	5		DDBDMO
CN(CCc1cccc([N+](=O)[O-])c1)C(=O)NC[C@H]1CC[N@H+]1C	ZINC000925427317	714853223	/nfs/dbraw/zinc/85/32/23/714853223.db2.gz	ZXYAVHYVZNODNI-CQSZACIVSA-N	1	1	306.366	1.483	20	5		DDBDMO
O=C(CC[N@H+]1CC[C@@H](O)[C@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580208	714857883	/nfs/dbraw/zinc/85/78/83/714857883.db2.gz	XDEASSXBUQIEQA-CHWSQXEVSA-N	1	1	311.313	1.328	20	5		DDBDMO
O=C(CC[N@@H+]1CC[C@@H](O)[C@H](F)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000934580208	714857885	/nfs/dbraw/zinc/85/78/85/714857885.db2.gz	XDEASSXBUQIEQA-CHWSQXEVSA-N	1	1	311.313	1.328	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3cnc4cc([N+](=O)[O-])ccc4n3)C[C@@H]21	ZINC001164669128	719379356	/nfs/dbraw/zinc/37/93/56/719379356.db2.gz	QBKCUQXSDZXWPF-UONOGXRCSA-N	1	1	315.333	1.057	20	5		DDBDMO
C[NH+]1CCN(c2ncc(Nc3cccc([N+](=O)[O-])c3)cn2)CC1	ZINC001204414661	732309837	/nfs/dbraw/zinc/30/98/37/732309837.db2.gz	BHEITMJFLHJBHG-UHFFFAOYSA-N	1	1	314.349	1.880	20	5		DDBDMO
CC(C)=CC[NH2+]C1CC2(CC(NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001121087458	782351299	/nfs/dbraw/zinc/35/12/99/782351299.db2.gz	JKLTTXNIVRNZFW-QAALLOGESA-N	1	1	307.394	1.635	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)c2nnc([C@H](C)[N+](=O)[O-])n2C)[C@@H](C)C1	ZINC001121389459	782487616	/nfs/dbraw/zinc/48/76/16/782487616.db2.gz	SBVMYGZGDPWITD-SRVKXCTJSA-N	1	1	310.402	1.319	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccc(F)cc3)C[C@H]21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001025775185	736852752	/nfs/dbraw/zinc/85/27/52/736852752.db2.gz	BNMINZODVNFTMS-QMIVOQANSA-N	1	1	319.336	1.037	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc(F)cc3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775185	736852754	/nfs/dbraw/zinc/85/27/54/736852754.db2.gz	BNMINZODVNFTMS-QMIVOQANSA-N	1	1	319.336	1.037	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@@H+](Cc3ccc(F)cc3)C[C@H]21)[C@@H]1CC1[N+](=O)[O-]	ZINC001025775185	736852756	/nfs/dbraw/zinc/85/27/56/736852756.db2.gz	BNMINZODVNFTMS-QMIVOQANSA-N	1	1	319.336	1.037	20	5		DDBDMO
CC[N@@H+](C)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2OC)C1	ZINC001181838909	743361424	/nfs/dbraw/zinc/36/14/24/743361424.db2.gz	IDGHKMDVQAPZES-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](O)[C@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC001194723996	746449950	/nfs/dbraw/zinc/44/99/50/746449950.db2.gz	PKXDHVRPLYZCIT-RYUDHWBXSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[N@H+](CCn1cnnc1)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC001197457291	747179350	/nfs/dbraw/zinc/17/93/50/747179350.db2.gz	BDIFWQQJMXHRAZ-UHFFFAOYSA-N	1	1	302.294	1.460	20	5		DDBDMO
C[N@@H+](CCn1cnnc1)Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC001197457291	747179355	/nfs/dbraw/zinc/17/93/55/747179355.db2.gz	BDIFWQQJMXHRAZ-UHFFFAOYSA-N	1	1	302.294	1.460	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197660532	747225499	/nfs/dbraw/zinc/22/54/99/747225499.db2.gz	NSAYYRJGWARKMI-WCQYABFASA-N	1	1	309.322	1.059	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197660532	747225503	/nfs/dbraw/zinc/22/55/03/747225503.db2.gz	NSAYYRJGWARKMI-WCQYABFASA-N	1	1	309.322	1.059	20	5		DDBDMO
O=C(NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1)c1ncc[nH]1	ZINC001031658423	747330813	/nfs/dbraw/zinc/33/08/13/747330813.db2.gz	GGDJSNOBZYILJF-UHFFFAOYSA-N	1	1	315.333	1.180	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007606	762175557	/nfs/dbraw/zinc/17/55/57/762175557.db2.gz	OMIMZTMCAYEEAZ-ZDCRXTMVSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007606	762175559	/nfs/dbraw/zinc/17/55/59/762175559.db2.gz	OMIMZTMCAYEEAZ-ZDCRXTMVSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2C[C@@H](OCC3CC3)[C@H]3COC[C@H]32)C1	ZINC001169030130	762186469	/nfs/dbraw/zinc/18/64/69/762186469.db2.gz	WUHQBOWUUZHXRJ-LYYZXLFJSA-N	1	1	310.394	1.558	20	5		DDBDMO
CC(C)(CC(N)=O)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001169134979	762251791	/nfs/dbraw/zinc/25/17/91/762251791.db2.gz	BBKPFUGQSUXOEL-UHFFFAOYSA-N	1	1	319.321	1.388	20	5		DDBDMO
C[N@@H+]1CCc2c(NC[C@@H](O)C(F)(F)F)ccc([N+](=O)[O-])c2C1	ZINC001169459433	762448168	/nfs/dbraw/zinc/44/81/68/762448168.db2.gz	RYNNRKDSBSFHPX-GFCCVEGCSA-N	1	1	319.283	1.918	20	5		DDBDMO
C[N@H+]1CCc2c(NC[C@@H](O)C(F)(F)F)ccc([N+](=O)[O-])c2C1	ZINC001169459433	762448169	/nfs/dbraw/zinc/44/81/69/762448169.db2.gz	RYNNRKDSBSFHPX-GFCCVEGCSA-N	1	1	319.283	1.918	20	5		DDBDMO
CCc1ccccc1C[NH2+][C@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001020139304	760613050	/nfs/dbraw/zinc/61/30/50/760613050.db2.gz	WZBUBEGWAVKNPO-KLHDSHLOSA-N	1	1	317.389	1.651	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CC2(C1)CC[NH+](C/C=C\Cl)CC2	ZINC001050520311	763699736	/nfs/dbraw/zinc/69/97/36/763699736.db2.gz	OQUVMQFTRBEJCU-QBEVBOACSA-N	1	1	313.785	1.329	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094514428	775969741	/nfs/dbraw/zinc/96/97/41/775969741.db2.gz	HREWFAWIDFAUPS-UHFFFAOYSA-N	1	1	323.397	1.640	20	5		DDBDMO
COC(=O)[C@@H](CN)C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1	ZINC001172901363	776915685	/nfs/dbraw/zinc/91/56/85/776915685.db2.gz	MLFIQNNPCBLZCV-KBPBESRZSA-N	1	1	321.377	1.180	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCN(c2[nH+]cccc2N)CC1	ZINC001154782184	861448230	/nfs/dbraw/zinc/44/82/30/861448230.db2.gz	HMAXJKKYGKUVQK-UHFFFAOYSA-N	1	1	314.349	1.602	20	5		DDBDMO
Cc1ccncc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC1	ZINC001326821587	861632170	/nfs/dbraw/zinc/63/21/70/861632170.db2.gz	GQPZVNPSQCYDMD-ZIAGYGMSSA-N	1	1	318.377	1.184	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001141946888	860979105	/nfs/dbraw/zinc/97/91/05/860979105.db2.gz	GHWLIOBFRHWRCC-VIFPVBQESA-N	1	1	318.337	1.143	20	5		DDBDMO
Cc1cccc(C)c1C[NH2+]CCCNC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761656	864111221	/nfs/dbraw/zinc/11/12/21/864111221.db2.gz	WIINNDHQAIKZMP-UKRRQHHQSA-N	1	1	305.378	1.565	20	5		DDBDMO
C[N@@H+](C1CN(c2cc(Cl)ncc2[N+](=O)[O-])C1)[C@H]1CCOC1	ZINC001158725827	864857096	/nfs/dbraw/zinc/85/70/96/864857096.db2.gz	NSDUFRXZJPCZIO-VIFPVBQESA-N	1	1	312.757	1.553	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CCOc2c(Cl)nccc2[N+](=O)[O-])C1	ZINC001225434892	881832593	/nfs/dbraw/zinc/83/25/93/881832593.db2.gz	OOSFYNQHSXLUCS-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2c(Cl)nccc2[N+](=O)[O-])C1	ZINC001225434892	881832609	/nfs/dbraw/zinc/83/26/09/881832609.db2.gz	OOSFYNQHSXLUCS-SECBINFHSA-N	1	1	301.730	1.743	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCC[C@H]2CCC[N@H+]2C)n1	ZINC001160969371	866232176	/nfs/dbraw/zinc/23/21/76/866232176.db2.gz	WJGIHQROOSZJBC-SNVBAGLBSA-N	1	1	308.338	1.673	20	5		DDBDMO
CC[NH+]1CCN(C[C@@H](C)CNc2c(C)cncc2[N+](=O)[O-])CC1	ZINC001321133453	867341974	/nfs/dbraw/zinc/34/19/74/867341974.db2.gz	MCCOIPOYWSTCRK-ZDUSSCGKSA-N	1	1	321.425	1.406	20	5		DDBDMO
COC(=O)N1CCC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC001335182476	868116873	/nfs/dbraw/zinc/11/68/73/868116873.db2.gz	IMYZLPHGOKPDSV-CQSZACIVSA-N	1	1	323.349	1.402	20	5		DDBDMO
COC(=O)N1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC001335182476	868116884	/nfs/dbraw/zinc/11/68/84/868116884.db2.gz	IMYZLPHGOKPDSV-CQSZACIVSA-N	1	1	323.349	1.402	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N2CCn3cnnc3C2)ncc1[N+](=O)[O-]	ZINC001163679203	868623394	/nfs/dbraw/zinc/62/33/94/868623394.db2.gz	KVQLAVBDJONKQS-ONEGZZNKSA-N	1	1	315.337	1.134	20	5		DDBDMO
CCOC(=O)c1cc([N+](=O)[O-])cnc1N1CCC[N@@H+](CC)CC1	ZINC001163773554	868693759	/nfs/dbraw/zinc/69/37/59/868693759.db2.gz	FEKCUXDYJLTVBP-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
Cc1cnc(NCC2(N(C)C)CC[NH+](C)CC2)cc1[N+](=O)[O-]	ZINC001164213253	869022276	/nfs/dbraw/zinc/02/22/76/869022276.db2.gz	QXKGRGMERLCODD-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164490437	869229690	/nfs/dbraw/zinc/22/96/90/869229690.db2.gz	JPVPPLWHIBGBMK-HUUCEWRRSA-N	1	1	317.389	1.728	20	5		DDBDMO
Cc1[nH+]cc2n1CCN(c1nc(Cl)nc(C)c1[N+](=O)[O-])C2	ZINC001165384086	869557000	/nfs/dbraw/zinc/55/70/00/869557000.db2.gz	CYQYSAULNJZMKU-UHFFFAOYSA-N	1	1	308.729	1.872	20	5		DDBDMO
Cc1c(CNC(=O)[C@@H]2[NH2+]CCc3occc32)cccc1[N+](=O)[O-]	ZINC001340236937	870974917	/nfs/dbraw/zinc/97/49/17/870974917.db2.gz	OLHYSWKVKNHGRX-OAHLLOKOSA-N	1	1	315.329	1.999	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC001310518887	871638804	/nfs/dbraw/zinc/63/88/04/871638804.db2.gz	LLCLDSTWQLNPBN-LLVKDONJSA-N	1	1	309.370	1.572	20	5		DDBDMO
C[NH+]1CCN(CCCO[C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CC1	ZINC001206581156	872449085	/nfs/dbraw/zinc/44/90/85/872449085.db2.gz	BGVPYZZLPJOQLZ-QGZVFWFLSA-N	1	1	319.405	1.716	20	5		DDBDMO
[NH3+][C@H](Cc1cccc([N+](=O)[O-])c1)c1nnc([C@@H]2CCOC2)o1	ZINC001217714157	877285576	/nfs/dbraw/zinc/28/55/76/877285576.db2.gz	CURVNAFXYTUTLU-ZYHUDNBSSA-N	1	1	304.306	1.724	20	5		DDBDMO
CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cnccc3[N+](=O)[O-])C[C@H]1[N@H+]2C	ZINC001228882864	883712407	/nfs/dbraw/zinc/71/24/07/883712407.db2.gz	QYKDPVXUGPEZAB-CDGCEXEKSA-N	1	1	321.333	1.535	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2cc(Cl)cnc2[N+](=O)[O-])C1	ZINC001233715614	887250112	/nfs/dbraw/zinc/25/01/12/887250112.db2.gz	IBDOOHNONOKSTF-SNVBAGLBSA-N	1	1	301.730	1.743	20	5		DDBDMO
C[C@H]1C[N@@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(=O)N1	ZINC001254476629	896455674	/nfs/dbraw/zinc/45/56/74/896455674.db2.gz	URQARVSSBXTOAY-LBPRGKRZSA-N	1	1	318.377	1.384	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(=O)N1	ZINC001254476629	896455679	/nfs/dbraw/zinc/45/56/79/896455679.db2.gz	URQARVSSBXTOAY-LBPRGKRZSA-N	1	1	318.377	1.384	20	5		DDBDMO
COC(=O)[C@@H]1C[N@H+]([C@@H]2Cc3ccc([N+](=O)[O-])cc3C2)CCCO1	ZINC001254610912	896531515	/nfs/dbraw/zinc/53/15/15/896531515.db2.gz	MTWOTTIBRBDBGM-CABCVRRESA-N	1	1	320.345	1.326	20	5		DDBDMO
O=[N+]([O-])CCc1nnc([C@@H]2CC[N@@H+](Cc3ccccc3)C2)o1	ZINC001255363595	896864986	/nfs/dbraw/zinc/86/49/86/896864986.db2.gz	GIJGQTPZOOSWTO-CYBMUJFWSA-N	1	1	302.334	1.878	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C)[C@H]2CO)cccc1[N+](=O)[O-]	ZINC000248880788	282114571	/nfs/dbraw/zinc/11/45/71/282114571.db2.gz	DCRGXLTXMQCLSY-IAQYHMDHSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305762031	231043892	/nfs/dbraw/zinc/04/38/92/231043892.db2.gz	MLEXKCSERCMKIA-IFUGULHKSA-N	1	1	321.377	1.933	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000305762031	231043896	/nfs/dbraw/zinc/04/38/96/231043896.db2.gz	MLEXKCSERCMKIA-IFUGULHKSA-N	1	1	321.377	1.933	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000614663076	361970801	/nfs/dbraw/zinc/97/08/01/361970801.db2.gz	VRGZQSWUKOJGIO-OAHLLOKOSA-N	1	1	308.334	1.713	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@@](O)(C(F)F)C2)cc1	ZINC000451429759	231092367	/nfs/dbraw/zinc/09/23/67/231092367.db2.gz	MBKDLQLZHJNEJX-ZDUSSCGKSA-N	1	1	302.277	1.676	20	5		DDBDMO
CO[C@H]1CC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000451578522	231129686	/nfs/dbraw/zinc/12/96/86/231129686.db2.gz	XKIGOQXZHCKPGW-YGRLFVJLSA-N	1	1	307.350	1.551	20	5		DDBDMO
O=C1C[C@@]2(CC[N@@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)CN1	ZINC000278848615	214443078	/nfs/dbraw/zinc/44/30/78/214443078.db2.gz	KADHYUKDDVXJSW-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@@]2(CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)CN1	ZINC000278848615	214443080	/nfs/dbraw/zinc/44/30/80/214443080.db2.gz	KADHYUKDDVXJSW-AWEZNQCLSA-N	1	1	309.753	1.960	20	5		DDBDMO
COC[C@@H]1CCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000452028475	231274116	/nfs/dbraw/zinc/27/41/16/231274116.db2.gz	HFXUIFUSYPTRKX-LSDHHAIUSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000451250277	529480958	/nfs/dbraw/zinc/48/09/58/529480958.db2.gz	DEJJOPRJGSIONL-IUODEOHRSA-N	1	1	321.377	1.650	20	5		DDBDMO
CC[C@@H](CO)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000295812143	529504514	/nfs/dbraw/zinc/50/45/14/529504514.db2.gz	WZVIFAQIMGZSAK-NSHDSACASA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000295812143	529504515	/nfs/dbraw/zinc/50/45/15/529504515.db2.gz	WZVIFAQIMGZSAK-NSHDSACASA-N	1	1	306.322	1.848	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000495250806	529573928	/nfs/dbraw/zinc/57/39/28/529573928.db2.gz	JKFUQLFBXJVLEQ-UKRRQHHQSA-N	1	1	310.350	1.181	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CC1	ZINC000090525103	185300430	/nfs/dbraw/zinc/30/04/30/185300430.db2.gz	PQIDZLJHTAFJDT-LLVKDONJSA-N	1	1	323.349	1.030	20	5		DDBDMO
C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@@H](O)C(F)(F)F	ZINC000305759264	529925989	/nfs/dbraw/zinc/92/59/89/529925989.db2.gz	CQEHQXCNQIVBGF-LLVKDONJSA-N	1	1	308.256	1.829	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C[C@@H](O)C(F)(F)F	ZINC000305759264	529925990	/nfs/dbraw/zinc/92/59/90/529925990.db2.gz	CQEHQXCNQIVBGF-LLVKDONJSA-N	1	1	308.256	1.829	20	5		DDBDMO
O=C(NCC[NH+]1CCSCC1)Nc1ccncc1[N+](=O)[O-]	ZINC000272756704	210161193	/nfs/dbraw/zinc/16/11/93/210161193.db2.gz	USZRRONMWVXIMU-UHFFFAOYSA-N	1	1	311.367	1.160	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H]1CCOC1	ZINC000106883023	185459739	/nfs/dbraw/zinc/45/97/39/185459739.db2.gz	JIUKTYOCSZXPSV-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000330909833	232155162	/nfs/dbraw/zinc/15/51/62/232155162.db2.gz	PCAOEXHMXVKKFG-ZYHUDNBSSA-N	1	1	309.370	1.089	20	5		DDBDMO
CCOC(=O)C1CC[NH+](CCn2cc([N+](=O)[O-])ccc2=O)CC1	ZINC000159727149	186137732	/nfs/dbraw/zinc/13/77/32/186137732.db2.gz	BXUNKWVGOFFKIR-UHFFFAOYSA-N	1	1	323.349	1.032	20	5		DDBDMO
Cc1cc(NCCC[N@H+]2CCC[C@@H]2C(N)=O)ncc1[N+](=O)[O-]	ZINC000266850566	186359520	/nfs/dbraw/zinc/35/95/20/186359520.db2.gz	RFQKWIGISGMCSF-LLVKDONJSA-N	1	1	307.354	1.050	20	5		DDBDMO
CC(C)NC(=O)C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000026259521	352207332	/nfs/dbraw/zinc/20/73/32/352207332.db2.gz	VOWPGCZHMJQECU-UHFFFAOYSA-N	1	1	322.365	1.380	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1	ZINC000046601863	352456854	/nfs/dbraw/zinc/45/68/54/352456854.db2.gz	XOUDVKPBTWTZTL-UHFFFAOYSA-N	1	1	318.377	1.338	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1	ZINC000047648873	352506484	/nfs/dbraw/zinc/50/64/84/352506484.db2.gz	BBCYMJUKADYPRY-CYBMUJFWSA-N	1	1	318.333	1.803	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NC[C@@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000064334127	352933894	/nfs/dbraw/zinc/93/38/94/352933894.db2.gz	OPIPQXOXQITNGV-LSDHHAIUSA-N	1	1	319.361	1.117	20	5		DDBDMO
Cc1[nH+]ccn1CCCNC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000065875055	352966849	/nfs/dbraw/zinc/96/68/49/352966849.db2.gz	SZYPRBCLEMJIIW-UHFFFAOYSA-N	1	1	317.349	1.718	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1CCCNc1ccncc1[N+](=O)[O-]	ZINC000066812062	353017492	/nfs/dbraw/zinc/01/74/92/353017492.db2.gz	SCNGHNNSLNDCBZ-ZDUSSCGKSA-N	1	1	321.381	1.344	20	5		DDBDMO
C[C@H]([NH2+]C[C@H](C)N1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000173390533	198209135	/nfs/dbraw/zinc/20/91/35/198209135.db2.gz	NLXSAWLBIPJLLC-KBPBESRZSA-N	1	1	306.410	1.881	20	5		DDBDMO
C[N@@H+](CCNC(=O)CCn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000068898328	353135419	/nfs/dbraw/zinc/13/54/19/353135419.db2.gz	OAGVKLUURDLNHY-UHFFFAOYSA-N	1	1	323.397	1.562	20	5		DDBDMO
CCNC(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000174246708	198310323	/nfs/dbraw/zinc/31/03/23/198310323.db2.gz	PRYAMTLGGZHINN-UHFFFAOYSA-N	1	1	307.350	1.574	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000174351764	198323545	/nfs/dbraw/zinc/32/35/45/198323545.db2.gz	ZZXFMGHAUDDOJS-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1cccc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000174351764	198323547	/nfs/dbraw/zinc/32/35/47/198323547.db2.gz	ZZXFMGHAUDDOJS-CHWSQXEVSA-N	1	1	321.377	1.430	20	5		DDBDMO
C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1[N+](=O)[O-]	ZINC000176206041	198558429	/nfs/dbraw/zinc/55/84/29/198558429.db2.gz	NJMDKCPZLYVNTM-UHFFFAOYSA-N	1	1	305.294	1.832	20	5		DDBDMO
C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1[N+](=O)[O-]	ZINC000176206041	198558431	/nfs/dbraw/zinc/55/84/31/198558431.db2.gz	NJMDKCPZLYVNTM-UHFFFAOYSA-N	1	1	305.294	1.832	20	5		DDBDMO
CN(C)C(=O)C(C)(C)[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000114458289	353980581	/nfs/dbraw/zinc/98/05/81/353980581.db2.gz	JVLHNXPPPPEDBF-UHFFFAOYSA-N	1	1	322.365	1.014	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1C[N@H+](C)CCO1	ZINC000157690044	354227181	/nfs/dbraw/zinc/22/71/81/354227181.db2.gz	XJFLPXCFSXWLHF-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCO1	ZINC000157690044	354227185	/nfs/dbraw/zinc/22/71/85/354227185.db2.gz	XJFLPXCFSXWLHF-BXUZGUMPSA-N	1	1	307.350	1.352	20	5		DDBDMO
C[C@]1(C(N)=O)CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000280738393	354423258	/nfs/dbraw/zinc/42/32/58/354423258.db2.gz	LZYSRDOEPPJAEB-HNNXBMFYSA-N	1	1	307.350	1.561	20	5		DDBDMO
COCC[C@H](C)[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293040633	354453140	/nfs/dbraw/zinc/45/31/40/354453140.db2.gz	GZWFRCSHRSPTJT-ZDUSSCGKSA-N	1	1	321.377	1.778	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000346204775	283025265	/nfs/dbraw/zinc/02/52/65/283025265.db2.gz	MNZHPCXYMHGJAY-PHIMTYICSA-N	1	1	323.397	1.873	20	5		DDBDMO
CN(C[C@@H]1CCC[N@@H+](C)C1)c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000587979632	354888944	/nfs/dbraw/zinc/88/89/44/354888944.db2.gz	WYNRRSIHCGUGMJ-LLVKDONJSA-N	1	1	308.382	1.447	20	5		DDBDMO
O=C(c1ccc(F)cc1[N+](=O)[O-])N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000588861860	354944245	/nfs/dbraw/zinc/94/42/45/354944245.db2.gz	VSYGJQZVQCHZQS-RYUDHWBXSA-N	1	1	323.324	1.015	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000590402430	355085783	/nfs/dbraw/zinc/08/57/83/355085783.db2.gz	UDGVNVRIDJSCJA-CABCVRRESA-N	1	1	319.361	1.530	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1	ZINC000592196499	355532572	/nfs/dbraw/zinc/53/25/72/355532572.db2.gz	CBXZXDGZKCIPFD-CHWSQXEVSA-N	1	1	308.334	1.259	20	5		DDBDMO
CC[C@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1[NH3+]	ZINC000592489679	355597884	/nfs/dbraw/zinc/59/78/84/355597884.db2.gz	ZMKOUBPUZMGZFT-STQMWFEESA-N	1	1	320.393	1.983	20	5		DDBDMO
CC[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCCOC1	ZINC000593070266	355786460	/nfs/dbraw/zinc/78/64/60/355786460.db2.gz	VYTWCBRCFGPTNF-HUUCEWRRSA-N	1	1	324.377	1.835	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000593339444	355857834	/nfs/dbraw/zinc/85/78/34/355857834.db2.gz	OFOOYMUUGDRDFV-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000593339444	355857838	/nfs/dbraw/zinc/85/78/38/355857838.db2.gz	OFOOYMUUGDRDFV-UHFFFAOYSA-N	1	1	321.377	1.778	20	5		DDBDMO
C[C@@H](c1ccc([N+](=O)[O-])cc1)[NH+]1CCN(c2nncn2C)CC1	ZINC000594021971	356091650	/nfs/dbraw/zinc/09/16/50/356091650.db2.gz	CGAOEKDXFJBEMN-LBPRGKRZSA-N	1	1	316.365	1.607	20	5		DDBDMO
O=[N+]([O-])c1cc2ccccc2nc1N1CC[N@H+]2C[C@H](O)C[C@H]2C1	ZINC000594603896	356262515	/nfs/dbraw/zinc/26/25/15/356262515.db2.gz	OMJKGCAXIADPTP-QWHCGFSZSA-N	1	1	314.345	1.398	20	5		DDBDMO
Cc1cc(S(=O)(=O)N2C[C@@H](C)[NH2+][C@H](C)C2)c([N+](=O)[O-])s1	ZINC000601338520	358505582	/nfs/dbraw/zinc/50/55/82/358505582.db2.gz	XWMTZKYDPKKUIO-HTQZYQBOSA-N	1	1	319.408	1.336	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000595447611	356496515	/nfs/dbraw/zinc/49/65/15/356496515.db2.gz	OIBVAXJFTXVUDW-CYBMUJFWSA-N	1	1	306.366	1.878	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760089	356640883	/nfs/dbraw/zinc/64/08/83/356640883.db2.gz	SAAVOGBZDSXQDV-IAQYHMDHSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@@]12COC[C@H]1C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000595760089	356640889	/nfs/dbraw/zinc/64/08/89/356640889.db2.gz	SAAVOGBZDSXQDV-IAQYHMDHSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595835871	356671136	/nfs/dbraw/zinc/67/11/36/356671136.db2.gz	WKBHXUJLEKVTOH-FRRDWIJNSA-N	1	1	319.361	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2COC[C@H]2C1	ZINC000595835871	356671138	/nfs/dbraw/zinc/67/11/38/356671138.db2.gz	WKBHXUJLEKVTOH-FRRDWIJNSA-N	1	1	319.361	1.890	20	5		DDBDMO
CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C)C1	ZINC000596188321	356806182	/nfs/dbraw/zinc/80/61/82/356806182.db2.gz	WMQDJBMRRGODBO-HNNXBMFYSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1[nH+]cc(CN2CC(Oc3ccc([N+](=O)[O-])cc3)C2)n1C	ZINC000597145894	357072001	/nfs/dbraw/zinc/07/20/01/357072001.db2.gz	KBXOATXJGAWZAX-UHFFFAOYSA-N	1	1	302.334	1.900	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)ccc1[N+](=O)[O-]	ZINC000597574944	357233828	/nfs/dbraw/zinc/23/38/28/357233828.db2.gz	JEJUEPKJRNKHDZ-GHMZBOCLSA-N	1	1	310.329	1.192	20	5		DDBDMO
Cn1c(C(=O)N2CCC[C@@]3(CC[N@@H+](C)C3)C2)ccc1[N+](=O)[O-]	ZINC000597714733	357298692	/nfs/dbraw/zinc/29/86/92/357298692.db2.gz	ISDRSLTUWYUEKA-HNNXBMFYSA-N	1	1	306.366	1.491	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)OCCO3)c([N+](=O)[O-])c1	ZINC000178414393	198863717	/nfs/dbraw/zinc/86/37/17/198863717.db2.gz	BDFRCQVDHFTHIR-UHFFFAOYSA-N	1	1	323.305	1.842	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000597854616	357359390	/nfs/dbraw/zinc/35/93/90/357359390.db2.gz	KCBVINOYRCLKGM-GFCCVEGCSA-N	1	1	323.397	1.418	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2OC)C1	ZINC000598341623	357543891	/nfs/dbraw/zinc/54/38/91/357543891.db2.gz	DWFRANBJCXIICE-LLVKDONJSA-N	1	1	307.350	1.818	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000598599466	357648584	/nfs/dbraw/zinc/64/85/84/357648584.db2.gz	OIWMFSGPDNZREM-ZJUUUORDSA-N	1	1	308.338	1.671	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000598746060	357714158	/nfs/dbraw/zinc/71/41/58/357714158.db2.gz	QKGAXGWTDAUWJX-VIFPVBQESA-N	1	1	308.338	1.298	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNCC[N@@H+]1CC[C@H](O)C1	ZINC000599017795	357795412	/nfs/dbraw/zinc/79/54/12/357795412.db2.gz	BXZMAWXQLYMNFF-AWEZNQCLSA-N	1	1	309.366	1.150	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1CNCC[N@H+]1CC[C@H](O)C1	ZINC000599017795	357795415	/nfs/dbraw/zinc/79/54/15/357795415.db2.gz	BXZMAWXQLYMNFF-AWEZNQCLSA-N	1	1	309.366	1.150	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]C[C@H]1C[C@@H](O)C1)c1cccc([N+](=O)[O-])c1	ZINC000599083237	357809694	/nfs/dbraw/zinc/80/96/94/357809694.db2.gz	WGOHSFDZLSHTNB-BYCMXARLSA-N	1	1	316.361	1.778	20	5		DDBDMO
C[N@@H+]1CCC[C@@H]1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000598993993	357786992	/nfs/dbraw/zinc/78/69/92/357786992.db2.gz	VJGYUBPFDLAEPN-GFCCVEGCSA-N	1	1	307.350	1.550	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNCc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000598993993	357786996	/nfs/dbraw/zinc/78/69/96/357786996.db2.gz	VJGYUBPFDLAEPN-GFCCVEGCSA-N	1	1	307.350	1.550	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCCC1)c1cc([N+](=O)[O-])n[nH]1	ZINC000600228807	358163717	/nfs/dbraw/zinc/16/37/17/358163717.db2.gz	FQVFCKDQQLXMGG-LLVKDONJSA-N	1	1	307.354	1.455	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000600310434	358192373	/nfs/dbraw/zinc/19/23/73/358192373.db2.gz	IWUVVGVINWMTPT-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H]([C@@H](C)O)C2)c([N+](=O)[O-])cc1OC	ZINC000180860924	199220011	/nfs/dbraw/zinc/22/00/11/199220011.db2.gz	RFYHUUHNTCHBKA-MNOVXSKESA-N	1	1	310.350	1.815	20	5		DDBDMO
CCC[NH+]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1	ZINC000601099927	358402212	/nfs/dbraw/zinc/40/22/12/358402212.db2.gz	IDKXFYSBIRXWIM-UHFFFAOYSA-N	1	1	321.303	1.879	20	5		DDBDMO
C[C@@H]1CN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@H](CO)O1	ZINC000601153502	358424107	/nfs/dbraw/zinc/42/41/07/358424107.db2.gz	PKDHRIZRXRFWSB-PWSUYJOCSA-N	1	1	303.318	1.729	20	5		DDBDMO
C[C@@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@H](C)[N@H+]1C	ZINC000601168981	358430903	/nfs/dbraw/zinc/43/09/03/358430903.db2.gz	HLQXHYPFFQSQHI-OCAPTIKFSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1CN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@H](C)[N@@H+]1C	ZINC000601168981	358430906	/nfs/dbraw/zinc/43/09/06/358430906.db2.gz	HLQXHYPFFQSQHI-OCAPTIKFSA-N	1	1	321.303	1.876	20	5		DDBDMO
Cn1cc(CN2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])n1	ZINC000602442588	358979183	/nfs/dbraw/zinc/97/91/83/358979183.db2.gz	ZNJCOQOJUNQXSC-AWEZNQCLSA-N	1	1	323.397	1.015	20	5		DDBDMO
COCC[N@@H+](C)CCCNCc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602510126	359020322	/nfs/dbraw/zinc/02/03/22/359020322.db2.gz	KHFUOSPURPCQBC-UHFFFAOYSA-N	1	1	322.365	1.794	20	5		DDBDMO
COc1cccc2c1C[N@H+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602681687	359123315	/nfs/dbraw/zinc/12/33/15/359123315.db2.gz	KONGXZZCVOGPQL-UHFFFAOYSA-N	1	1	302.334	1.895	20	5		DDBDMO
COc1cccc2c1C[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])CC2	ZINC000602681687	359123322	/nfs/dbraw/zinc/12/33/22/359123322.db2.gz	KONGXZZCVOGPQL-UHFFFAOYSA-N	1	1	302.334	1.895	20	5		DDBDMO
Cn1cc(CN2CC[N@@H+](C)C3(CCCCC3)C2)c([N+](=O)[O-])n1	ZINC000602836278	359226910	/nfs/dbraw/zinc/22/69/10/359226910.db2.gz	MZDWCEHDYBEFRZ-UHFFFAOYSA-N	1	1	307.398	1.779	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[N@H+](C2CC2)C[C@H](C)C1	ZINC000602832478	359223933	/nfs/dbraw/zinc/22/39/33/359223933.db2.gz	NEGSTRTVKCJHQI-GFCCVEGCSA-N	1	1	307.398	1.516	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000602959326	359323145	/nfs/dbraw/zinc/32/31/45/359323145.db2.gz	SUJPMPJAUBQYMH-NEPJUHHUSA-N	1	1	321.381	1.667	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](O)[C@H](C)C1	ZINC000186823125	200016804	/nfs/dbraw/zinc/01/68/04/200016804.db2.gz	CQJOBKLCANJOJP-DOMZBBRYSA-N	1	1	321.377	1.935	20	5		DDBDMO
CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC(F)(F)C[NH3+]	ZINC000186993951	200044474	/nfs/dbraw/zinc/04/44/74/200044474.db2.gz	GNLNETURNVEVAV-UHFFFAOYSA-N	1	1	323.321	1.030	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1ccc([N+](=O)[O-])cc1	ZINC000189406218	200395731	/nfs/dbraw/zinc/39/57/31/200395731.db2.gz	QIEIOELOTMEHPY-CYBMUJFWSA-N	1	1	307.394	1.872	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CN1CCN(c2cccnc2[N+](=O)[O-])CC1	ZINC000609333880	360294642	/nfs/dbraw/zinc/29/46/42/360294642.db2.gz	BVZDSVWGTMOUIQ-AWEZNQCLSA-N	1	1	319.409	1.596	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000292409445	223059957	/nfs/dbraw/zinc/05/99/57/223059957.db2.gz	LYRKFBACEFYWAR-FPMFFAJLSA-N	1	1	310.350	1.180	20	5		DDBDMO
COc1ccc(OCC[N@@H+](CCCO)C2CC2)c([N+](=O)[O-])c1	ZINC000610369671	360423106	/nfs/dbraw/zinc/42/31/06/360423106.db2.gz	UUPBLCYHZYQZTA-UHFFFAOYSA-N	1	1	310.350	1.829	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C(C)(C)CO1	ZINC000610369646	360423212	/nfs/dbraw/zinc/42/32/12/360423212.db2.gz	MHDHDNZYMKIAKQ-LBPRGKRZSA-N	1	1	312.370	1.042	20	5		DDBDMO
O=C(Nc1ccncc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000359028224	299311196	/nfs/dbraw/zinc/31/11/96/299311196.db2.gz	PJPJJKMDNPUGDK-RYUDHWBXSA-N	1	1	305.338	1.160	20	5		DDBDMO
C[C@H]1COCCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000610990901	360592337	/nfs/dbraw/zinc/59/23/37/360592337.db2.gz	UFQGIZKERFOUGH-GXTWGEPZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H](CNC(=O)Nc1ccncc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000359029745	299311584	/nfs/dbraw/zinc/31/15/84/299311584.db2.gz	SOWIHTXJBXYJCS-NEPJUHHUSA-N	1	1	321.381	1.796	20	5		DDBDMO
CC[N@H+]1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H]1C	ZINC000611092122	360621653	/nfs/dbraw/zinc/62/16/53/360621653.db2.gz	JFIFQSJQYSRZOS-OLZOCXBDSA-N	1	1	320.393	1.948	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000611528149	360749257	/nfs/dbraw/zinc/74/92/57/360749257.db2.gz	HSKNWXBCPKTFMS-NSHDSACASA-N	1	1	322.365	1.018	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN1CCc2cn[nH]c2C1	ZINC000612104155	360920426	/nfs/dbraw/zinc/92/04/26/360920426.db2.gz	CAFQKZNNNVDNCK-LBPRGKRZSA-N	1	1	318.333	1.116	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000194162527	201188921	/nfs/dbraw/zinc/18/89/21/201188921.db2.gz	SXEVHHWPLAGJQU-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000194162527	201188924	/nfs/dbraw/zinc/18/89/24/201188924.db2.gz	SXEVHHWPLAGJQU-LBPRGKRZSA-N	1	1	319.361	1.914	20	5		DDBDMO
COc1cccc(N2CC[NH+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000613869036	361610074	/nfs/dbraw/zinc/61/00/74/361610074.db2.gz	UXXPHMKRORKBOM-CYBMUJFWSA-N	1	1	321.377	1.904	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252417	363945610	/nfs/dbraw/zinc/94/56/10/363945610.db2.gz	KYKRSZAHBNJPOE-NXEZZACHSA-N	1	1	313.354	1.915	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619253069	363946832	/nfs/dbraw/zinc/94/68/32/363946832.db2.gz	QYEQFLJPDWXFFL-ZIAGYGMSSA-N	1	1	307.325	1.853	20	5		DDBDMO
C[N@@H+](CCCCS(C)(=O)=O)CCc1cccc([N+](=O)[O-])c1	ZINC000619785205	364150177	/nfs/dbraw/zinc/15/01/77/364150177.db2.gz	XJTMBYYMWOZDHS-UHFFFAOYSA-N	1	1	314.407	1.894	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](O)CC1	ZINC000293013086	223352605	/nfs/dbraw/zinc/35/26/05/223352605.db2.gz	DRZOVRRKJLIZAR-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](O)CC1	ZINC000293013086	223352608	/nfs/dbraw/zinc/35/26/08/223352608.db2.gz	DRZOVRRKJLIZAR-RYUDHWBXSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC(C)[N@@H+](C)C[C@H](C)NS(=O)(=O)c1ccc([N+](=O)[O-])s1	ZINC000349774436	284047816	/nfs/dbraw/zinc/04/78/16/284047816.db2.gz	HXZPEWUNFFGMDS-VIFPVBQESA-N	1	1	321.424	1.663	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000264659585	204060175	/nfs/dbraw/zinc/06/01/75/204060175.db2.gz	HLHFJNMWUKSGQV-AWEZNQCLSA-N	1	1	321.377	1.964	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc2ncccc2c1[N+](=O)[O-]	ZINC000264796170	204163217	/nfs/dbraw/zinc/16/32/17/204163217.db2.gz	TZCOXTXMGVJDQQ-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[C@H]([NH2+]CC(=O)N1C[C@@H](C)O[C@@H](C)C1)c1ccccc1[N+](=O)[O-]	ZINC000271720222	209153941	/nfs/dbraw/zinc/15/39/41/209153941.db2.gz	KUGFSCXXOAFTID-XQQFMLRXSA-N	1	1	321.377	1.881	20	5		DDBDMO
COc1ccccc1C[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266406670	205324506	/nfs/dbraw/zinc/32/45/06/205324506.db2.gz	FXJNJFMBGAIFIZ-AWEZNQCLSA-N	1	1	320.349	1.293	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c(N)c([N+](=O)[O-])c1	ZINC000104897062	194051160	/nfs/dbraw/zinc/05/11/60/194051160.db2.gz	MJFPIJRNQITTNS-SNVBAGLBSA-N	1	1	306.366	1.698	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCO)CC1CC1	ZINC000352467916	285072666	/nfs/dbraw/zinc/07/26/66/285072666.db2.gz	OIZXTMPPASIKES-UHFFFAOYSA-N	1	1	321.377	1.936	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCCc3occc3C2)c1	ZINC000288708675	220360768	/nfs/dbraw/zinc/36/07/68/220360768.db2.gz	FEPOSAINMNUIKU-ZDUSSCGKSA-N	1	1	306.322	1.194	20	5		DDBDMO
O=[N+]([O-])c1cccnc1N1CC[NH+](CCOCC2CC2)CC1	ZINC000459510319	285165930	/nfs/dbraw/zinc/16/59/30/285165930.db2.gz	NTQCDNAVNLZFOI-UHFFFAOYSA-N	1	1	306.366	1.538	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCC[C@H]1O	ZINC000352669324	285212380	/nfs/dbraw/zinc/21/23/80/285212380.db2.gz	YUXSYXPHUOUBRE-UONOGXRCSA-N	1	1	307.350	1.769	20	5		DDBDMO
O=c1nc([C@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)[nH][nH]1	ZINC000289571831	221076808	/nfs/dbraw/zinc/07/68/08/221076808.db2.gz	YMHWMZQSQUHUHU-LBPRGKRZSA-N	1	1	317.349	1.428	20	5		DDBDMO
Cc1[nH+]cc2n1CC[C@@H](C(=O)NCc1ccc([N+](=O)[O-])cc1)C2	ZINC000289755935	221203964	/nfs/dbraw/zinc/20/39/64/221203964.db2.gz	IOAFVWCSOWNKSN-CYBMUJFWSA-N	1	1	314.345	1.979	20	5		DDBDMO
COC[C@@]1(C(=O)OC)CC[N@@H+](Cc2ccccc2[N+](=O)[O-])C1	ZINC000295036458	224394975	/nfs/dbraw/zinc/39/49/75/224394975.db2.gz	MEHZAOOJSPLJON-OAHLLOKOSA-N	1	1	308.334	1.606	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCC(C)(C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000299503938	533665611	/nfs/dbraw/zinc/66/56/11/533665611.db2.gz	DPBYZWLSUSXWOT-SNVBAGLBSA-N	1	1	323.397	1.867	20	5		DDBDMO
Cn1ccnc1[C@H]([NH2+]CC1(O)CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000353541172	285793115	/nfs/dbraw/zinc/79/31/15/285793115.db2.gz	HGMBXELDGAIJMV-CQSZACIVSA-N	1	1	316.361	1.922	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCO)C1CC1	ZINC000071956114	406870518	/nfs/dbraw/zinc/87/05/18/406870518.db2.gz	OIFQOUBBMZUSMJ-UHFFFAOYSA-N	1	1	323.349	1.389	20	5		DDBDMO
CC[N@@H+](CCNC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1)C(C)C	ZINC000102495533	407323551	/nfs/dbraw/zinc/32/35/51/407323551.db2.gz	OWQOUTXDOCHAAK-UHFFFAOYSA-N	1	1	311.386	1.373	20	5		DDBDMO
CC[NH+](CC)[C@@H](C)CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000068080096	407294510	/nfs/dbraw/zinc/29/45/10/407294510.db2.gz	WXTYRLFGAHKYBI-JTQLQIEISA-N	1	1	319.365	1.931	20	5		DDBDMO
C[C@H](c1ccccc1)[N@H+](CCn1ccc([N+](=O)[O-])n1)CC(N)=O	ZINC000123825928	407340381	/nfs/dbraw/zinc/34/03/81/407340381.db2.gz	UYAAFNDLDZEDOK-GFCCVEGCSA-N	1	1	317.349	1.340	20	5		DDBDMO
C[C@H](c1ccccc1)[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(N)=O	ZINC000123825928	407340382	/nfs/dbraw/zinc/34/03/82/407340382.db2.gz	UYAAFNDLDZEDOK-GFCCVEGCSA-N	1	1	317.349	1.340	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@H]3CO)n2)cc1	ZINC000112552751	407431749	/nfs/dbraw/zinc/43/17/49/407431749.db2.gz	KNONQHCFXOBTEJ-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]3CO)n2)cc1	ZINC000112552751	407431750	/nfs/dbraw/zinc/43/17/50/407431750.db2.gz	KNONQHCFXOBTEJ-LBPRGKRZSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H]1CCOC1	ZINC000178756384	407587710	/nfs/dbraw/zinc/58/77/10/407587710.db2.gz	XZCLADODYOWOBH-RYUDHWBXSA-N	1	1	307.350	1.890	20	5		DDBDMO
CC[N@H+](Cc1ccccc1)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266511437	407539758	/nfs/dbraw/zinc/53/97/58/407539758.db2.gz	YIOXSEUTBXAFPN-OAHLLOKOSA-N	1	1	304.350	1.674	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+](C)CC[C@H](C)O)cccc1[N+](=O)[O-]	ZINC000266715976	407611701	/nfs/dbraw/zinc/61/17/01/407611701.db2.gz	FZJDZVBFMYRHMB-JQWIXIFHSA-N	1	1	309.366	1.933	20	5		DDBDMO
COc1cc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000153771213	407897312	/nfs/dbraw/zinc/89/73/12/407897312.db2.gz	BNUXUKCAWKBFNT-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCOC3(CCOCC3)C2)c1	ZINC000154472672	408041345	/nfs/dbraw/zinc/04/13/45/408041345.db2.gz	JEOKPLFPPSFEHI-OAHLLOKOSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCOC3(CCOCC3)C2)c1	ZINC000154472672	408041346	/nfs/dbraw/zinc/04/13/46/408041346.db2.gz	JEOKPLFPPSFEHI-OAHLLOKOSA-N	1	1	322.361	1.510	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCO[C@H]2CCC[C@@H]21	ZINC000273084923	408049382	/nfs/dbraw/zinc/04/93/82/408049382.db2.gz	YOOSLURCAYKTKK-IPYPFGDCSA-N	1	1	322.361	1.588	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCO[C@H]2CCC[C@@H]21	ZINC000273084923	408049387	/nfs/dbraw/zinc/04/93/87/408049387.db2.gz	YOOSLURCAYKTKK-IPYPFGDCSA-N	1	1	322.361	1.588	20	5		DDBDMO
CC[C@]1(CO)CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000189660487	408071923	/nfs/dbraw/zinc/07/19/23/408071923.db2.gz	BLJGYCRDLPDMAZ-XJKSGUPXSA-N	1	1	324.377	1.571	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000246221498	408182263	/nfs/dbraw/zinc/18/22/63/408182263.db2.gz	DPESEKAWIDKYPG-HIFRSBDPSA-N	1	1	308.334	1.513	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCN(C)CC1	ZINC000122188596	408264051	/nfs/dbraw/zinc/26/40/51/408264051.db2.gz	AZJOOHCUHIHNIH-UHFFFAOYSA-N	1	1	306.366	1.479	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000269328123	408271693	/nfs/dbraw/zinc/27/16/93/408271693.db2.gz	DMSYRUHWKIRJJX-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCC[N@@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000269328123	408271697	/nfs/dbraw/zinc/27/16/97/408271697.db2.gz	DMSYRUHWKIRJJX-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000269328123	408271703	/nfs/dbraw/zinc/27/17/03/408271703.db2.gz	DMSYRUHWKIRJJX-MNOVXSKESA-N	1	1	321.381	1.750	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1	ZINC000269387585	408291817	/nfs/dbraw/zinc/29/18/17/408291817.db2.gz	RFFIEGKJAIBYOY-UHFFFAOYSA-N	1	1	322.756	1.703	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000246607396	408299975	/nfs/dbraw/zinc/29/99/75/408299975.db2.gz	BYZPLROHNFPBLI-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@@H]1C	ZINC000246607396	408299980	/nfs/dbraw/zinc/29/99/80/408299980.db2.gz	BYZPLROHNFPBLI-STQMWFEESA-N	1	1	321.377	1.051	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)[C@H](CO)C1	ZINC000190862196	408334092	/nfs/dbraw/zinc/33/40/92/408334092.db2.gz	ONVIWAJOJUSOJD-OLZOCXBDSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[C@H]1CC(O)C[C@H](C)[NH+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000191258742	408394007	/nfs/dbraw/zinc/39/40/07/408394007.db2.gz	COLOPABOEDCHGX-RYUDHWBXSA-N	1	1	321.377	1.791	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000247289835	408444526	/nfs/dbraw/zinc/44/45/26/408444526.db2.gz	GJQNSQADNRSFSJ-WDEREUQCSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000247289835	408444531	/nfs/dbraw/zinc/44/45/31/408444531.db2.gz	GJQNSQADNRSFSJ-WDEREUQCSA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000247289835	408444537	/nfs/dbraw/zinc/44/45/37/408444537.db2.gz	GJQNSQADNRSFSJ-WDEREUQCSA-N	1	1	323.397	1.825	20	5		DDBDMO
C[C@@H](O)[C@H]1CCCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000264410916	408479226	/nfs/dbraw/zinc/47/92/26/408479226.db2.gz	JNOAHRHTJIKRKO-ZWNOBZJWSA-N	1	1	307.350	1.429	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)c2cccc([N+](=O)[O-])c2N)C[N@H+]1C1CC1	ZINC000177121108	408524590	/nfs/dbraw/zinc/52/45/90/408524590.db2.gz	UMKKDXRQWQXLLT-NXEZZACHSA-N	1	1	304.350	1.532	20	5		DDBDMO
C[C@@H]1C[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)CC[N@H+]1C	ZINC000176868357	408461680	/nfs/dbraw/zinc/46/16/80/408461680.db2.gz	NKLJEFKFQBVKBO-GHMZBOCLSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+]1C[C@H](C)O	ZINC000247392329	408462708	/nfs/dbraw/zinc/46/27/08/408462708.db2.gz	XGBSDKIGFSONRA-AAEUAGOBSA-N	1	1	313.423	1.933	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])[C@H]1CCSC1	ZINC000248465299	408574121	/nfs/dbraw/zinc/57/41/21/408574121.db2.gz	RLDNYIMREMTOMM-RYUDHWBXSA-N	1	1	312.391	1.772	20	5		DDBDMO
CN(C(=O)C[NH+]1CCC(C)(O)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000177336402	408582040	/nfs/dbraw/zinc/58/20/40/408582040.db2.gz	WSINULZPBJBACZ-UHFFFAOYSA-N	1	1	307.350	1.404	20	5		DDBDMO
[NH3+][C@H]1CCC[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000160873998	408535418	/nfs/dbraw/zinc/53/54/18/408535418.db2.gz	AOMQAEYXTOARRG-IUCAKERBSA-N	1	1	303.322	1.471	20	5		DDBDMO
Cn1cc[nH+]c1CC1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1	ZINC000161838063	408645468	/nfs/dbraw/zinc/64/54/68/408645468.db2.gz	ISCBJTOVMQOBRM-UHFFFAOYSA-N	1	1	318.337	1.146	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1	ZINC000192820582	408654809	/nfs/dbraw/zinc/65/48/09/408654809.db2.gz	HFDYUOJMAWLYAP-UONOGXRCSA-N	1	1	323.393	1.361	20	5		DDBDMO
C[C@]1(O)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000177970246	408747940	/nfs/dbraw/zinc/74/79/40/408747940.db2.gz	YGFNBEAQBVAAJQ-AWEZNQCLSA-N	1	1	304.306	1.602	20	5		DDBDMO
C[C@]1(O)CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000177970246	408747944	/nfs/dbraw/zinc/74/79/44/408747944.db2.gz	YGFNBEAQBVAAJQ-AWEZNQCLSA-N	1	1	304.306	1.602	20	5		DDBDMO
CC[NH+]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2OC)CC1	ZINC000193951695	408756533	/nfs/dbraw/zinc/75/65/33/408756533.db2.gz	KDOQLMQUUSJBJM-UHFFFAOYSA-N	1	1	322.365	1.451	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@@H]1CCO	ZINC000194363753	408778770	/nfs/dbraw/zinc/77/87/70/408778770.db2.gz	RRXQJFBHQZREMB-ZIAGYGMSSA-N	1	1	324.377	1.571	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@](C)(C(N)=O)C1	ZINC000280795051	408835228	/nfs/dbraw/zinc/83/52/28/408835228.db2.gz	RLWJNBRSEQYRJB-BMIGLBTASA-N	1	1	320.349	1.119	20	5		DDBDMO
C[N@@H+](C[C@@H](O)Cn1cc(-c2ccccc2[N+](=O)[O-])cn1)C1CC1	ZINC000290802664	408835544	/nfs/dbraw/zinc/83/55/44/408835544.db2.gz	QAMMDGPRACTLPS-CQSZACIVSA-N	1	1	316.361	1.913	20	5		DDBDMO
Cc1cc(N2CC[C@@H]([NH+]3CCOCC3)[C@H]2C)ncc1[N+](=O)[O-]	ZINC000291231177	408862913	/nfs/dbraw/zinc/86/29/13/408862913.db2.gz	WVLJCLMTSRFAPJ-CHWSQXEVSA-N	1	1	306.366	1.598	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@H+](CCO)[C@H](C)C1	ZINC000188786910	163068958	/nfs/dbraw/zinc/06/89/58/163068958.db2.gz	KZBKVCKRRBGXIR-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000188786910	163068960	/nfs/dbraw/zinc/06/89/60/163068960.db2.gz	KZBKVCKRRBGXIR-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NC[C@H]2CCC[N@@H+]2C)c1	ZINC000281735319	408920027	/nfs/dbraw/zinc/92/00/27/408920027.db2.gz	XUPJVOLNZOUNRI-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@H+](C)CCCO	ZINC000281927988	408956268	/nfs/dbraw/zinc/95/62/68/408956268.db2.gz	SFXQUPIKCHXGHD-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)[N@@H+](C)CCCO	ZINC000281927988	408956269	/nfs/dbraw/zinc/95/62/69/408956269.db2.gz	SFXQUPIKCHXGHD-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000277609206	408976596	/nfs/dbraw/zinc/97/65/96/408976596.db2.gz	PNOPMVSYYFROCT-ZIAGYGMSSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C1(CO)CCC1	ZINC000292123166	408984534	/nfs/dbraw/zinc/98/45/34/408984534.db2.gz	KKODWHSZMCCWRK-LBPRGKRZSA-N	1	1	310.350	1.181	20	5		DDBDMO
CO[C@H]1[C@H]2[C@H]3C[C@@H]1C[C@@H]3C[N@H+]2CCn1cc([N+](=O)[O-])ccc1=O	ZINC000286435530	408985107	/nfs/dbraw/zinc/98/51/07/408985107.db2.gz	JBFVOYUNKKICJH-BOOVAVIHSA-N	1	1	319.361	1.112	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]([C@@H](O)C(F)(F)F)C2)n1	ZINC000277721538	408999273	/nfs/dbraw/zinc/99/92/73/408999273.db2.gz	JFNYJKUPLUQVRD-GXSJLCMTSA-N	1	1	322.287	1.427	20	5		DDBDMO
C[N@H+]1CCN(CCNc2cc(N)ccc2[N+](=O)[O-])CC1(C)C	ZINC000282318077	409032445	/nfs/dbraw/zinc/03/24/45/409032445.db2.gz	TUHUJKMFBQNKBY-UHFFFAOYSA-N	1	1	307.398	1.615	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)n1	ZINC000287723347	409082096	/nfs/dbraw/zinc/08/20/96/409082096.db2.gz	FKUQSNPAWRNZQE-NXEZZACHSA-N	1	1	320.349	1.814	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CCC[N@H+](C)CCN(C)C	ZINC000288869012	409190732	/nfs/dbraw/zinc/19/07/32/409190732.db2.gz	LFOIXIDHAHNUNL-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N(C)CCCN(C)CC[NH+](C)C	ZINC000288869012	409190736	/nfs/dbraw/zinc/19/07/36/409190736.db2.gz	LFOIXIDHAHNUNL-UHFFFAOYSA-N	1	1	309.414	1.618	20	5		DDBDMO
C[C@@H](CN1CCN(C)CC1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000293762897	409176131	/nfs/dbraw/zinc/17/61/31/409176131.db2.gz	PDSGYYYLJNBECO-STQMWFEESA-N	1	1	321.425	1.464	20	5		DDBDMO
COC(=O)c1cc(C)nc(N(C)[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000283935754	409242392	/nfs/dbraw/zinc/24/23/92/409242392.db2.gz	XUBKKAVSRQEUJC-NSHDSACASA-N	1	1	322.365	1.615	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)C1CC1	ZINC000284126496	409280565	/nfs/dbraw/zinc/28/05/65/409280565.db2.gz	VFYUJJGLWRDPBR-UHFFFAOYSA-N	1	1	310.329	1.530	20	5		DDBDMO
O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CC[C@@H]2C[NH2+]C[C@H]2C1	ZINC000289542608	409281349	/nfs/dbraw/zinc/28/13/49/409281349.db2.gz	BQXURDDJKNKXQN-ZJUUUORDSA-N	1	1	315.333	1.153	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000284350123	409330071	/nfs/dbraw/zinc/33/00/71/409330071.db2.gz	MFSPIUBWGDDFOX-IPKOWEFYSA-N	1	1	319.405	1.995	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@H+](C)C2CC2)ccc1[N+](=O)[O-]	ZINC000280464935	409316195	/nfs/dbraw/zinc/31/61/95/409316195.db2.gz	FXSTWDOETPUAKX-UHFFFAOYSA-N	1	1	307.350	1.492	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000290378862	409379114	/nfs/dbraw/zinc/37/91/14/409379114.db2.gz	BYKFZCGCXSCUTR-UHFFFAOYSA-N	1	1	308.382	1.208	20	5		DDBDMO
CN(CCCNC(=O)c1ccccc1[N+](=O)[O-])CC[NH+](C)C	ZINC000290378862	409379118	/nfs/dbraw/zinc/37/91/18/409379118.db2.gz	BYKFZCGCXSCUTR-UHFFFAOYSA-N	1	1	308.382	1.208	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCNC(=O)CC1	ZINC000295258409	409401363	/nfs/dbraw/zinc/40/13/63/409401363.db2.gz	GSGCMKLCKNPLOF-AWEZNQCLSA-N	1	1	305.378	1.985	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(N)c3F)C[C@@H]21	ZINC000285018798	409393133	/nfs/dbraw/zinc/39/31/33/409393133.db2.gz	MRVRPDUFEFIHCA-NWDGAFQWSA-N	1	1	310.329	1.225	20	5		DDBDMO
C[N@H+](Cc1ccccn1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000295256185	409399001	/nfs/dbraw/zinc/39/90/01/409399001.db2.gz	ZUCGFNDPNTZDAW-CQSZACIVSA-N	1	1	317.345	1.862	20	5		DDBDMO
NC(=O)c1ccnc(N[C@@H]2CC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000290448205	409406212	/nfs/dbraw/zinc/40/62/12/409406212.db2.gz	CWCJKQDCJIMTLG-GHMZBOCLSA-N	1	1	305.338	1.127	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCN2CCO[C@H]1C2	ZINC000295307464	409424159	/nfs/dbraw/zinc/42/41/59/409424159.db2.gz	FSZXYKGUUZMDTI-HOTGVXAUSA-N	1	1	321.377	1.379	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CCC[N@@H+](C)[C@H]2C)cccc1[N+](=O)[O-]	ZINC000356728515	409556961	/nfs/dbraw/zinc/55/69/61/409556961.db2.gz	FEOUQDHGNLNESO-JQWIXIFHSA-N	1	1	307.350	1.816	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCN(C)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000290720646	409497374	/nfs/dbraw/zinc/49/73/74/409497374.db2.gz	VJPNPJXUABUJJI-UHFFFAOYSA-N	1	1	322.409	1.550	20	5		DDBDMO
CN(CCCN(C)C(=O)c1ccc([N+](=O)[O-])cc1)CC[NH+](C)C	ZINC000290720646	409497380	/nfs/dbraw/zinc/49/73/80/409497380.db2.gz	VJPNPJXUABUJJI-UHFFFAOYSA-N	1	1	322.409	1.550	20	5		DDBDMO
COC(=O)C[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2)C1	ZINC000353902837	409548573	/nfs/dbraw/zinc/54/85/73/409548573.db2.gz	YCGFOYIBJPRNGK-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
COC(=O)C[N@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2)C1	ZINC000353902837	409548583	/nfs/dbraw/zinc/54/85/83/409548583.db2.gz	YCGFOYIBJPRNGK-LBPRGKRZSA-N	1	1	307.350	1.892	20	5		DDBDMO
CN(c1nc2sccn2c1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1	ZINC000354079590	409636808	/nfs/dbraw/zinc/63/68/08/409636808.db2.gz	IXEXWCJLXITCFO-SNVBAGLBSA-N	1	1	307.379	1.977	20	5		DDBDMO
CC(C)[N@@H+](C[C@H](O)Cn1cc([N+](=O)[O-])cn1)C1CCOCC1	ZINC000304288114	409594970	/nfs/dbraw/zinc/59/49/70/409594970.db2.gz	BHOJTAQHTXCNSL-CQSZACIVSA-N	1	1	312.370	1.042	20	5		DDBDMO
CN(C(=O)c1c([N+](=O)[O-])cnn1C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000342501807	409681848	/nfs/dbraw/zinc/68/18/48/409681848.db2.gz	WXMUEGUVVLILJI-ZACCUICWSA-N	1	1	307.354	1.026	20	5		DDBDMO
COc1c(C(=O)NCC[N@@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000356964627	409751753	/nfs/dbraw/zinc/75/17/53/409751753.db2.gz	ZIJRPOHUZBCXOG-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1c(C(=O)NCC[N@H+]2CCCOCC2)cccc1[N+](=O)[O-]	ZINC000356964627	409751767	/nfs/dbraw/zinc/75/17/67/409751767.db2.gz	ZIJRPOHUZBCXOG-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
C[N@@H+](CC[C@@H]1CCCO1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000342609859	409761876	/nfs/dbraw/zinc/76/18/76/409761876.db2.gz	WGULFFXXYIXQOS-CABCVRRESA-N	1	1	324.377	1.835	20	5		DDBDMO
C[N@H+]1CCC[C@H]2CN(c3cccc(C(N)=O)c3[N+](=O)[O-])CC[C@@H]21	ZINC000342706707	409830488	/nfs/dbraw/zinc/83/04/88/409830488.db2.gz	ROVWMGGYPISMEF-AAEUAGOBSA-N	1	1	318.377	1.614	20	5		DDBDMO
CNc1c(C(=O)NCCCn2cc[nH+]c2C)cccc1[N+](=O)[O-]	ZINC000338332482	409920551	/nfs/dbraw/zinc/92/05/51/409920551.db2.gz	IYPTUKSMMOOMBV-UHFFFAOYSA-N	1	1	317.349	1.962	20	5		DDBDMO
C[C@H]1C[C@@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)C[C@@H](C)C1	ZINC000346229195	409870241	/nfs/dbraw/zinc/87/02/41/409870241.db2.gz	ROXQSCVDGWXFEA-SRVKXCTJSA-N	1	1	307.350	1.990	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239814	410007392	/nfs/dbraw/zinc/00/73/92/410007392.db2.gz	IOIPQZRZMLZKKB-VHSXEESVSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@@H+]1C	ZINC000332239814	410007397	/nfs/dbraw/zinc/00/73/97/410007397.db2.gz	IOIPQZRZMLZKKB-VHSXEESVSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000332239814	410007401	/nfs/dbraw/zinc/00/74/01/410007401.db2.gz	IOIPQZRZMLZKKB-VHSXEESVSA-N	1	1	317.349	1.684	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000357392605	410011062	/nfs/dbraw/zinc/01/10/62/410011062.db2.gz	OAOIUFQQRAXKPC-STQMWFEESA-N	1	1	320.393	1.996	20	5		DDBDMO
COc1ccc(CN2CCO[C@@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000332321981	410065785	/nfs/dbraw/zinc/06/57/85/410065785.db2.gz	RORRSKDNHWUOAB-GDBMZVCRSA-N	1	1	321.377	1.508	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1CNC(=O)Cn1cc[nH+]c1C	ZINC000297988425	410071806	/nfs/dbraw/zinc/07/18/06/410071806.db2.gz	YTPCSLLOSSYAGF-UHFFFAOYSA-N	1	1	304.306	1.425	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)c1	ZINC000332336399	410077356	/nfs/dbraw/zinc/07/73/56/410077356.db2.gz	VYAMZIJWPVXMIO-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670374	410066699	/nfs/dbraw/zinc/06/66/99/410066699.db2.gz	UOUSVWTYWOMCSV-YWPYICTPSA-N	1	1	319.361	1.689	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000346670374	410066703	/nfs/dbraw/zinc/06/67/03/410066703.db2.gz	UOUSVWTYWOMCSV-YWPYICTPSA-N	1	1	319.361	1.689	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000354859298	410132276	/nfs/dbraw/zinc/13/22/76/410132276.db2.gz	OPGIGVBZXVYBJY-HNNXBMFYSA-N	1	1	308.334	1.267	20	5		DDBDMO
CCOC(=O)[C@@](C)(O)C[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000354859298	410132283	/nfs/dbraw/zinc/13/22/83/410132283.db2.gz	OPGIGVBZXVYBJY-HNNXBMFYSA-N	1	1	308.334	1.267	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000351779759	410230069	/nfs/dbraw/zinc/23/00/69/410230069.db2.gz	KJRSNMHUEZBJHK-JOYOIKCWSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000351779759	410230073	/nfs/dbraw/zinc/23/00/73/410230073.db2.gz	KJRSNMHUEZBJHK-JOYOIKCWSA-N	1	1	304.306	1.457	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](CO)C1	ZINC000298650420	410328747	/nfs/dbraw/zinc/32/87/47/410328747.db2.gz	YBKBZFDMGJWLAV-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](CO)C1	ZINC000298650420	410328754	/nfs/dbraw/zinc/32/87/54/410328754.db2.gz	YBKBZFDMGJWLAV-RYUDHWBXSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)Nc1ccc([N+](=O)[O-])c2nonc21	ZINC000298729037	410370627	/nfs/dbraw/zinc/37/06/27/410370627.db2.gz	RLYVKAHHTWKOHJ-SECBINFHSA-N	1	1	307.310	1.264	20	5		DDBDMO
CC1=CC[N@@H+](CCNC(=O)Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000355356046	410466853	/nfs/dbraw/zinc/46/68/53/410466853.db2.gz	POCXFTJUKWBTDF-UHFFFAOYSA-N	1	1	303.362	1.906	20	5		DDBDMO
COC[C@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000352233283	410566640	/nfs/dbraw/zinc/56/66/40/410566640.db2.gz	BOHGUXSLWWWKEN-WFASDCNBSA-N	1	1	319.361	1.668	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](Nc2ncnc3cccc([N+](=O)[O-])c32)C1	ZINC000347469557	410568210	/nfs/dbraw/zinc/56/82/10/410568210.db2.gz	ZADUZMMJPMHGDP-LLVKDONJSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[N@@H+](CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CC1	ZINC000340095663	410672789	/nfs/dbraw/zinc/67/27/89/410672789.db2.gz	PSBXXPQKODRJPV-UHFFFAOYSA-N	1	1	316.361	1.829	20	5		DDBDMO
CCOc1cc(N2CC[C@H]3OCC[N@@H+](C)[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000579935189	422859353	/nfs/dbraw/zinc/85/93/53/422859353.db2.gz	PYMQBFCQTDSNTL-HUUCEWRRSA-N	1	1	321.377	1.903	20	5		DDBDMO
CC[C@@]1(C)COCC[N@@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762174	410679007	/nfs/dbraw/zinc/67/90/07/410679007.db2.gz	KUQLDNKEIYNLCT-BBRMVZONSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[C@@]1(C)COCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000343762174	410679010	/nfs/dbraw/zinc/67/90/10/410679010.db2.gz	KUQLDNKEIYNLCT-BBRMVZONSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000330586574	410801729	/nfs/dbraw/zinc/80/17/29/410801729.db2.gz	LSOFUORHDRJYCT-CHWSQXEVSA-N	1	1	320.393	1.582	20	5		DDBDMO
Cc1nn(C)c(C(=O)NCCNc2cccc(C)[nH+]2)c1[N+](=O)[O-]	ZINC000347961997	410814585	/nfs/dbraw/zinc/81/45/85/410814585.db2.gz	DFRZAIYFHXMNLT-UHFFFAOYSA-N	1	1	318.337	1.182	20	5		DDBDMO
C[C@H]1CC[N@@H+](C)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000340296755	410835589	/nfs/dbraw/zinc/83/55/89/410835589.db2.gz	FZKXDSNZLRYZSP-ZDUSSCGKSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CCN1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000330675601	410869798	/nfs/dbraw/zinc/86/97/98/410869798.db2.gz	SHEYVHVRYBCDAE-NSHDSACASA-N	1	1	317.349	1.781	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@@]3(C2)CCC[N@@H+](C)C3)ccc1[N+](=O)[O-]	ZINC000356300133	410954638	/nfs/dbraw/zinc/95/46/38/410954638.db2.gz	OERNBOUUNRRSMO-HNNXBMFYSA-N	1	1	306.366	1.491	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CC3(O)CCCC3)C2)nc1	ZINC000331420061	411079871	/nfs/dbraw/zinc/07/98/71/411079871.db2.gz	KTPOLQGHQZDGFG-GFCCVEGCSA-N	1	1	306.366	1.781	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000331216405	411023585	/nfs/dbraw/zinc/02/35/85/411023585.db2.gz	VVYBLNLRTWBHDE-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@H](C)[N@@H+](C)C[C@@H]1C	ZINC000331216405	411023587	/nfs/dbraw/zinc/02/35/87/411023587.db2.gz	VVYBLNLRTWBHDE-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000341412507	411041793	/nfs/dbraw/zinc/04/17/93/411041793.db2.gz	JUBKZESYBCECSE-PHIMTYICSA-N	1	1	322.365	1.688	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+](C)CC2(C)C)cccc1[N+](=O)[O-]	ZINC000356598336	411101828	/nfs/dbraw/zinc/10/18/28/411101828.db2.gz	UEIVFDOPPHTZAL-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)CC2(C)C)cccc1[N+](=O)[O-]	ZINC000356598336	411101831	/nfs/dbraw/zinc/10/18/31/411101831.db2.gz	UEIVFDOPPHTZAL-UHFFFAOYSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H]1CCC[C@@](CNC(=O)c2n[nH]cc2[N+](=O)[O-])([NH+](C)C)C1	ZINC000137899083	196581419	/nfs/dbraw/zinc/58/14/19/196581419.db2.gz	DDEKFQDNLRUUOJ-IINYFYTJSA-N	1	1	309.370	1.558	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000520780150	416977925	/nfs/dbraw/zinc/97/79/25/416977925.db2.gz	FSJVPJRHOPMGMV-SNVBAGLBSA-N	1	1	309.370	1.492	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000417226104	225252968	/nfs/dbraw/zinc/25/29/68/225252968.db2.gz	KKCCGDXRVJVHPW-UHFFFAOYSA-N	1	1	302.281	1.031	20	5		DDBDMO
C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000418996945	226000294	/nfs/dbraw/zinc/00/02/94/226000294.db2.gz	FSHWWNFVEOOGTB-VHSXEESVSA-N	1	1	312.345	1.207	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c(N)c1F	ZINC000418996945	226000297	/nfs/dbraw/zinc/00/02/97/226000297.db2.gz	FSHWWNFVEOOGTB-VHSXEESVSA-N	1	1	312.345	1.207	20	5		DDBDMO
Cc1cc(C2=CC[N@@H+]([C@@H]3CCNC3=O)CC2)cc([N+](=O)[O-])c1N	ZINC000366488881	418479788	/nfs/dbraw/zinc/47/97/88/418479788.db2.gz	UZRHEIISWHTEMO-CYBMUJFWSA-N	1	1	316.361	1.463	20	5		DDBDMO
Cc1cc(C2=CC[N@H+]([C@@H]3CCNC3=O)CC2)cc([N+](=O)[O-])c1N	ZINC000366488881	418479790	/nfs/dbraw/zinc/47/97/90/418479790.db2.gz	UZRHEIISWHTEMO-CYBMUJFWSA-N	1	1	316.361	1.463	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)CSc3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000192494392	418523427	/nfs/dbraw/zinc/52/34/27/418523427.db2.gz	XWORMIIOOYOLMX-TXEJJXNPSA-N	1	1	321.402	1.707	20	5		DDBDMO
CCn1nc(C)c([N+](=O)[O-])c1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000192626514	418524799	/nfs/dbraw/zinc/52/47/99/418524799.db2.gz	UUWFMFUBUSCJAE-ZDUSSCGKSA-N	1	1	323.397	1.278	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2C[C@H](C)[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000360954386	418553929	/nfs/dbraw/zinc/55/39/29/418553929.db2.gz	MMZGEIXVVCUSKK-QWRGUYRKSA-N	1	1	318.377	1.992	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)NCc1ccccc1[N+](=O)[O-]	ZINC000193200391	222146263	/nfs/dbraw/zinc/14/62/63/222146263.db2.gz	FEBHCQDELVBYDJ-UHFFFAOYSA-N	1	1	324.381	1.362	20	5		DDBDMO
C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)[C@@H](C)[C@H]1[NH3+]	ZINC000297404307	227120464	/nfs/dbraw/zinc/12/04/64/227120464.db2.gz	PQFJTMBEXNNZCS-RVBZMBCESA-N	1	1	317.349	1.669	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375465874	418643576	/nfs/dbraw/zinc/64/35/76/418643576.db2.gz	RDCJRECYZAMPKC-SNVBAGLBSA-N	1	1	318.337	1.578	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@@H](c2nc(C3CC3)no2)C1	ZINC000375465874	418643577	/nfs/dbraw/zinc/64/35/77/418643577.db2.gz	RDCJRECYZAMPKC-SNVBAGLBSA-N	1	1	318.337	1.578	20	5		DDBDMO
CCCCNC(=O)[C@@H](C)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399820	418634770	/nfs/dbraw/zinc/63/47/70/418634770.db2.gz	AXNSRNNSIYELME-CHWSQXEVSA-N	1	1	323.397	1.733	20	5		DDBDMO
CCCCNC(=O)[C@@H](C)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000375399820	418634773	/nfs/dbraw/zinc/63/47/73/418634773.db2.gz	AXNSRNNSIYELME-CHWSQXEVSA-N	1	1	323.397	1.733	20	5		DDBDMO
CC(C)c1ccc(C[N@H+]2CCC[C@](O)(C(N)=O)C2)cc1[N+](=O)[O-]	ZINC000375532146	418655556	/nfs/dbraw/zinc/65/55/56/418655556.db2.gz	IKKVKCXOSSGCDU-MRXNPFEDSA-N	1	1	321.377	1.530	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@H]2CCC[C@H]2[NH+]2CCOCC2)s1	ZINC000375592093	418659814	/nfs/dbraw/zinc/65/98/14/418659814.db2.gz	QOOKXMYQNBRCHT-GHMZBOCLSA-N	1	1	312.395	1.964	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1	ZINC000371343293	418780712	/nfs/dbraw/zinc/78/07/12/418780712.db2.gz	CRSRXNYSNHKSHW-UHFFFAOYSA-N	1	1	318.381	1.806	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[N@@H+](C)CC12CCCCC2	ZINC000361939920	418727636	/nfs/dbraw/zinc/72/76/36/418727636.db2.gz	OSSPHINXKIGTMQ-UHFFFAOYSA-N	1	1	307.398	1.779	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411186085	418877620	/nfs/dbraw/zinc/87/76/20/418877620.db2.gz	IRDVWCIBKFJUMQ-CYBMUJFWSA-N	1	1	320.349	1.134	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000365249231	418846065	/nfs/dbraw/zinc/84/60/65/418846065.db2.gz	PZTQGNJCHGFBFZ-VXGBXAGGSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000412036185	419583053	/nfs/dbraw/zinc/58/30/53/419583053.db2.gz	LWLHJQPXAYUXRN-RISCZKNCSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000412036185	419583062	/nfs/dbraw/zinc/58/30/62/419583062.db2.gz	LWLHJQPXAYUXRN-RISCZKNCSA-N	1	1	319.361	1.187	20	5		DDBDMO
COc1cccc(C(=O)N(C)C[C@H]2CCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000421709844	419691782	/nfs/dbraw/zinc/69/17/82/419691782.db2.gz	HKVLXAYGWAEIJC-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1cn(Cc2cccc(C[NH+]3CCOCC3)c2)cn1	ZINC000421844363	419748467	/nfs/dbraw/zinc/74/84/67/419748467.db2.gz	OBDYLDXREFZGIE-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CNCC[C@H]1C	ZINC000423355971	420023856	/nfs/dbraw/zinc/02/38/56/420023856.db2.gz	GCHPJJCJACRMQK-LALPHHSUSA-N	1	1	320.393	1.900	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](C(N)=O)CC[C@H]1C	ZINC000430226207	420091579	/nfs/dbraw/zinc/09/15/79/420091579.db2.gz	MSQGDHJVRYWODF-PWSUYJOCSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@H]([NH3+])[C@@H](C)C1	ZINC000430919277	420203995	/nfs/dbraw/zinc/20/39/95/420203995.db2.gz	PVUPFVBIAPJKON-JSGCOSHPSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]([NH3+])[C@@H](C)C1	ZINC000430919276	420205086	/nfs/dbraw/zinc/20/50/86/420205086.db2.gz	PVUPFVBIAPJKON-GXTWGEPZSA-N	1	1	320.393	1.901	20	5		DDBDMO
[NH3+]CC[C@@H](Nc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(F)F	ZINC000420270067	420175682	/nfs/dbraw/zinc/17/56/82/420175682.db2.gz	UMLFQMXGOVOVIC-SECBINFHSA-N	1	1	313.264	2.039	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420592778	420325017	/nfs/dbraw/zinc/32/50/17/420325017.db2.gz	BCBVHQSRFMORNG-NSHDSACASA-N	1	1	306.366	1.472	20	5		DDBDMO
COc1cc(C[N@@H+](CCO)C2CCOCC2)ccc1[N+](=O)[O-]	ZINC000444777795	230133733	/nfs/dbraw/zinc/13/37/33/230133733.db2.gz	QZNWBZBPVUYMIJ-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c1	ZINC000450789744	420531433	/nfs/dbraw/zinc/53/14/33/420531433.db2.gz	JJKISNOFDWNMBK-BETUJISGSA-N	1	1	307.350	1.879	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262258	420595364	/nfs/dbraw/zinc/59/53/64/420595364.db2.gz	XDLNEBYOZMHOHR-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000451262258	420595366	/nfs/dbraw/zinc/59/53/66/420595366.db2.gz	XDLNEBYOZMHOHR-QWHCGFSZSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1nc(CC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n[nH]1	ZINC000447604756	420785180	/nfs/dbraw/zinc/78/51/80/420785180.db2.gz	CTRCRBOHDFFANU-NWDGAFQWSA-N	1	1	319.369	1.534	20	5		DDBDMO
Cc1nnc(CC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)[nH]1	ZINC000447604756	420785184	/nfs/dbraw/zinc/78/51/84/420785184.db2.gz	CTRCRBOHDFFANU-NWDGAFQWSA-N	1	1	319.369	1.534	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1CCCO)Nc1cccc([N+](=O)[O-])c1	ZINC000454150245	420806853	/nfs/dbraw/zinc/80/68/53/420806853.db2.gz	QJVRXOKNIPOJBV-AWEZNQCLSA-N	1	1	322.365	1.563	20	5		DDBDMO
CNc1nc(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000455667260	421051557	/nfs/dbraw/zinc/05/15/57/421051557.db2.gz	QDHNQBOSDJAKMX-NSHDSACASA-N	1	1	321.381	1.445	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456026297	421090569	/nfs/dbraw/zinc/09/05/69/421090569.db2.gz	WZIYGHJULSACPS-VHSXEESVSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000456026297	421090573	/nfs/dbraw/zinc/09/05/73/421090573.db2.gz	WZIYGHJULSACPS-VHSXEESVSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)ccc1[N+](=O)[O-]	ZINC000456066598	421095220	/nfs/dbraw/zinc/09/52/20/421095220.db2.gz	MMXGZNZUYJPBJU-NSHDSACASA-N	1	1	321.381	1.634	20	5		DDBDMO
[NH3+]C[C@@H]1CC[C@H](NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000449716769	421068002	/nfs/dbraw/zinc/06/80/02/421068002.db2.gz	LYOUCWUVHBVEAY-BDAKNGLRSA-N	1	1	303.322	1.328	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000456371177	421153275	/nfs/dbraw/zinc/15/32/75/421153275.db2.gz	GUASNUDPDQILOS-SNVBAGLBSA-N	1	1	307.354	1.128	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000456371177	421153278	/nfs/dbraw/zinc/15/32/78/421153278.db2.gz	GUASNUDPDQILOS-SNVBAGLBSA-N	1	1	307.354	1.128	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)[C@@H](C)C1	ZINC000531634632	421641162	/nfs/dbraw/zinc/64/11/62/421641162.db2.gz	BSILMQBNOYCVHL-SMDDNHRTSA-N	1	1	306.366	1.792	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@H]2C(F)F)c1	ZINC000520218983	421741538	/nfs/dbraw/zinc/74/15/38/421741538.db2.gz	LGDNVWFOQMACAQ-NSHDSACASA-N	1	1	315.276	1.283	20	5		DDBDMO
C[N@H+]1C[C@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000558756536	421824902	/nfs/dbraw/zinc/82/49/02/421824902.db2.gz	GRAONBGMRCDRHV-STQMWFEESA-N	1	1	315.333	1.146	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)C1	ZINC000521114074	421773695	/nfs/dbraw/zinc/77/36/95/421773695.db2.gz	RAXKJPYPMKFHGU-JTQLQIEISA-N	1	1	321.333	1.048	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000521884218	421805300	/nfs/dbraw/zinc/80/53/00/421805300.db2.gz	GPNFUUKHNFTCNT-OAHLLOKOSA-N	1	1	321.377	1.964	20	5		DDBDMO
CNc1nccc(C(=O)NCCCC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000582072550	422104322	/nfs/dbraw/zinc/10/43/22/422104322.db2.gz	ZDYOXCMRJLYVKH-UHFFFAOYSA-N	1	1	321.381	1.636	20	5		DDBDMO
CC[N@H+]1CCCC[C@@H]1CNC(=O)c1ccnc(NC)c1[N+](=O)[O-]	ZINC000576595432	422376535	/nfs/dbraw/zinc/37/65/35/422376535.db2.gz	LBZFSGVJVDGOMG-LLVKDONJSA-N	1	1	321.381	1.636	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000342063027	271286919	/nfs/dbraw/zinc/28/69/19/271286919.db2.gz	NZHSYUOKIOTAQT-NSHDSACASA-N	1	1	309.370	1.209	20	5		DDBDMO
CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1c([N+](=O)[O-])ncn1C	ZINC000342063027	271286920	/nfs/dbraw/zinc/28/69/20/271286920.db2.gz	NZHSYUOKIOTAQT-NSHDSACASA-N	1	1	309.370	1.209	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@H]1C	ZINC000345913764	272363733	/nfs/dbraw/zinc/36/37/33/272363733.db2.gz	WANITMJPBZLHSB-MNOVXSKESA-N	1	1	309.370	1.041	20	5		DDBDMO
C[N@H+]1CCO[C@@H]2CN(c3ccc4cc([N+](=O)[O-])ccc4n3)C[C@H]21	ZINC000301658149	277124626	/nfs/dbraw/zinc/12/46/26/277124626.db2.gz	LTIMTAYWLLBBPA-HUUCEWRRSA-N	1	1	314.345	1.662	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CC3(O)CCOCC3)C2)nc1	ZINC000122284229	281153972	/nfs/dbraw/zinc/15/39/72/281153972.db2.gz	KDAXKWINGSMUPZ-LBPRGKRZSA-N	1	1	322.365	1.018	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN1CCN(C)CC1	ZINC000449122697	298919341	/nfs/dbraw/zinc/91/93/41/298919341.db2.gz	MKUYDOOLXQNXFS-CABCVRRESA-N	1	1	320.437	1.751	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000357933505	299024644	/nfs/dbraw/zinc/02/46/44/299024644.db2.gz	JFCQDHXWHVBZKG-LBPRGKRZSA-N	1	1	323.397	1.569	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](CO)[C@H](C)C1	ZINC000362077779	300001501	/nfs/dbraw/zinc/00/15/01/300001501.db2.gz	ONVIWAJOJUSOJD-CHWSQXEVSA-N	1	1	321.377	1.792	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3N)C[C@H]21	ZINC000362279586	300043074	/nfs/dbraw/zinc/04/30/74/300043074.db2.gz	HQQQUWXEYODFOY-NOZJJQNGSA-N	1	1	322.340	1.482	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000362770866	300136608	/nfs/dbraw/zinc/13/66/08/300136608.db2.gz	VLXYHNSOQXQHDG-UHFFFAOYSA-N	1	1	315.320	1.872	20	5		DDBDMO
O=C(NC1CC[NH+](CCc2ccccc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC000363305884	300248647	/nfs/dbraw/zinc/24/86/47/300248647.db2.gz	UNPPXEBNRRDBIT-CVEARBPZSA-N	1	1	317.389	1.475	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000364037514	300337250	/nfs/dbraw/zinc/33/72/50/300337250.db2.gz	AUDMSVYTBQDMMM-STQMWFEESA-N	1	1	321.381	1.233	20	5		DDBDMO
COc1ccc(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)cc1[N+](=O)[O-]	ZINC000367995230	300929655	/nfs/dbraw/zinc/92/96/55/300929655.db2.gz	YFGCUBFWFYKKEF-SNVBAGLBSA-N	1	1	315.276	1.283	20	5		DDBDMO
CC(C)[C@@]1(CO)CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000377651843	302204176	/nfs/dbraw/zinc/20/41/76/302204176.db2.gz	KGAWZKZZVPQTKD-HOTGVXAUSA-N	1	1	308.378	1.969	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1	ZINC000531912027	303265470	/nfs/dbraw/zinc/26/54/70/303265470.db2.gz	QPXMKRKSUVLUTE-RYUDHWBXSA-N	1	1	309.370	1.384	20	5		DDBDMO
Cn1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c1	ZINC000535072231	303343980	/nfs/dbraw/zinc/34/39/80/303343980.db2.gz	NXWJPHJNTDBICH-UHFFFAOYSA-N	1	1	301.350	1.651	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000357658813	306903651	/nfs/dbraw/zinc/90/36/51/306903651.db2.gz	IBHVZYSBRQNJLB-UHFFFAOYSA-N	1	1	315.333	1.847	20	5		DDBDMO
O=C1OCC[C@H]1CC[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369004146	307114318	/nfs/dbraw/zinc/11/43/18/307114318.db2.gz	YNPZAOVNUMJLEU-VXGBXAGGSA-N	1	1	308.338	1.381	20	5		DDBDMO
CN1C[C@@H]2C[N@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373242926	307182202	/nfs/dbraw/zinc/18/22/02/307182202.db2.gz	MMCUXCQNVHFRSK-CQSZACIVSA-N	1	1	304.350	1.189	20	5		DDBDMO
CN1C[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CCN2C1=O	ZINC000373242926	307182203	/nfs/dbraw/zinc/18/22/03/307182203.db2.gz	MMCUXCQNVHFRSK-CQSZACIVSA-N	1	1	304.350	1.189	20	5		DDBDMO
O=C1NCCN1[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000374868284	307214817	/nfs/dbraw/zinc/21/48/17/307214817.db2.gz	JZIHTOUKQAOYTN-LBPRGKRZSA-N	1	1	322.340	1.724	20	5		DDBDMO
O=C1NCCN1[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000374868284	307214818	/nfs/dbraw/zinc/21/48/18/307214818.db2.gz	JZIHTOUKQAOYTN-LBPRGKRZSA-N	1	1	322.340	1.724	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)NCc3cccc([N+](=O)[O-])c3)C[C@@H]21	ZINC000577342901	308379993	/nfs/dbraw/zinc/37/99/93/308379993.db2.gz	NAPHUBUKJRJLDJ-OCCSQVGLSA-N	1	1	304.350	1.440	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000584308595	332236477	/nfs/dbraw/zinc/23/64/77/332236477.db2.gz	OXUGFTWVLFOXSY-WDEREUQCSA-N	1	1	322.365	1.614	20	5		DDBDMO
COC(=O)c1cc(C)nc(N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000584308595	332236479	/nfs/dbraw/zinc/23/64/79/332236479.db2.gz	OXUGFTWVLFOXSY-WDEREUQCSA-N	1	1	322.365	1.614	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1C	ZINC000452046073	533872346	/nfs/dbraw/zinc/87/23/46/533872346.db2.gz	UZMSCMYTDBPDOW-MRXNPFEDSA-N	1	1	318.377	1.901	20	5		DDBDMO
C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000154813059	524682944	/nfs/dbraw/zinc/68/29/44/524682944.db2.gz	WJTZSBJHICPBPC-SMDDNHRTSA-N	1	1	321.352	1.972	20	5		DDBDMO
O=[N+]([O-])c1ccccc1C[N@H+]1C[C@H](O)C[C@H]1[C@@H]1CCCOC1	ZINC000451300858	534887246	/nfs/dbraw/zinc/88/72/46/534887246.db2.gz	MREMEGJMKQVKRJ-FMKPAKJESA-N	1	1	306.362	1.957	20	5		DDBDMO
CC(C)(C)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(N)=O	ZINC000444673575	526639267	/nfs/dbraw/zinc/63/92/67/526639267.db2.gz	JDYQUPBZKXKWPW-LBPRGKRZSA-N	1	1	305.338	1.461	20	5		DDBDMO
C[C@H]1CCC[N@H+]1CCNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000820716761	599083939	/nfs/dbraw/zinc/08/39/39/599083939.db2.gz	LADFTAIGWDTANV-JTQLQIEISA-N	1	1	317.353	1.671	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000151656624	696889116	/nfs/dbraw/zinc/88/91/16/696889116.db2.gz	CLCCSVHNOFYVLY-LBPRGKRZSA-N	1	1	318.333	1.787	20	5		DDBDMO
COC(=O)[C@H]1CCC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000151656624	696889120	/nfs/dbraw/zinc/88/91/20/696889120.db2.gz	CLCCSVHNOFYVLY-LBPRGKRZSA-N	1	1	318.333	1.787	20	5		DDBDMO
O=C(N[C@H]1C[C@H](C[NH2+]Cc2ccsc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC000983658481	697287076	/nfs/dbraw/zinc/28/70/76/697287076.db2.gz	XDWOMYBTVWYPJG-FDYHWXHSSA-N	1	1	309.391	1.398	20	5		DDBDMO
O=C(CC[N@H+]1CCC2(C1)OCCO2)Nc1ccc([N+](=O)[O-])cc1	ZINC000160708426	697319352	/nfs/dbraw/zinc/31/93/52/697319352.db2.gz	CGOMLCSZJLWEPF-UHFFFAOYSA-N	1	1	321.333	1.372	20	5		DDBDMO
CCS(=O)(=O)CC[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000233826745	697790645	/nfs/dbraw/zinc/79/06/45/697790645.db2.gz	BZQXZUHYTCFKJJ-UHFFFAOYSA-N	1	1	306.771	1.773	20	5		DDBDMO
NC(=O)C[C@H]1CCCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582170	698120932	/nfs/dbraw/zinc/12/09/32/698120932.db2.gz	RVCURFPACBJKPP-ZIAGYGMSSA-N	1	1	307.350	1.358	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776586970	698122531	/nfs/dbraw/zinc/12/25/31/698122531.db2.gz	RTDPGTMBFZCJDY-HIFRSBDPSA-N	1	1	308.334	1.513	20	5		DDBDMO
COC(=O)C[C@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776590917	698123640	/nfs/dbraw/zinc/12/36/40/698123640.db2.gz	MFRSJDQBNAWYMN-ZIAGYGMSSA-N	1	1	308.334	1.656	20	5		DDBDMO
Cc1cccc(N2CCN(c3[nH+]ccn3C)CC2)c1[N+](=O)[O-]	ZINC000782350002	698713313	/nfs/dbraw/zinc/71/33/13/698713313.db2.gz	FUKRZCYURRTWMX-UHFFFAOYSA-N	1	1	301.350	1.963	20	5		DDBDMO
COc1c(C(=O)OCCC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000796305834	699925403	/nfs/dbraw/zinc/92/54/03/699925403.db2.gz	DVVRNVBWCBRMQL-UHFFFAOYSA-N	1	1	324.333	1.483	20	5		DDBDMO
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@H]1C[N@H+]2CCC[C@H]2CO1	ZINC000804396399	701186019	/nfs/dbraw/zinc/18/60/19/701186019.db2.gz	HFJVLQHZTHVVKU-QWRGUYRKSA-N	1	1	322.321	1.778	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000804446418	701190959	/nfs/dbraw/zinc/19/09/59/701190959.db2.gz	GEJAKFYJBCIVHM-JTQLQIEISA-N	1	1	309.326	1.161	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000804446418	701190961	/nfs/dbraw/zinc/19/09/61/701190961.db2.gz	GEJAKFYJBCIVHM-JTQLQIEISA-N	1	1	309.326	1.161	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@H+](CCO)C(C)(C)C1	ZINC000804630547	701204856	/nfs/dbraw/zinc/20/48/56/701204856.db2.gz	FBYLBICJNHIXPN-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1N1CC[N@@H+](CCO)C(C)(C)C1	ZINC000804630547	701204858	/nfs/dbraw/zinc/20/48/58/701204858.db2.gz	FBYLBICJNHIXPN-UHFFFAOYSA-N	1	1	321.377	1.690	20	5		DDBDMO
C[C@@]([NH3+])(C(=O)N1C[C@@H]2[C@H](C1)C2(C)C)c1cccc([N+](=O)[O-])c1	ZINC000867948777	701848470	/nfs/dbraw/zinc/84/84/70/701848470.db2.gz	DVGHJGMSHUOERJ-ZENOOKHLSA-N	1	1	303.362	1.883	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c(C)c1[N+](=O)[O-]	ZINC000840118322	701978040	/nfs/dbraw/zinc/97/80/40/701978040.db2.gz	DBDZOADAHRXHMU-MGPQQGTHSA-N	1	1	308.382	1.991	20	5		DDBDMO
CN(C)C(=O)[C@H]1CC[N@@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1	ZINC000840181061	702015378	/nfs/dbraw/zinc/01/53/78/702015378.db2.gz	YXKRUDQWYGQPTG-NSHDSACASA-N	1	1	317.349	1.312	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CCC[C@@H](CO)CC1)OCCO2	ZINC000816666500	702138150	/nfs/dbraw/zinc/13/81/50/702138150.db2.gz	OMAUQFOCQZYDLT-GFCCVEGCSA-N	1	1	322.361	1.960	20	5		DDBDMO
C[NH2+]Cc1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1	ZINC000843225569	702846172	/nfs/dbraw/zinc/84/61/72/702846172.db2.gz	LUMARGBJNGVQNR-UHFFFAOYSA-N	1	1	308.294	1.305	20	5		DDBDMO
CC[C@H]([NH3+])c1nc(Cc2cc(OC)cc(OC)c2[N+](=O)[O-])no1	ZINC000843226198	702846195	/nfs/dbraw/zinc/84/61/95/702846195.db2.gz	VYLRDLJRRJJPAD-JTQLQIEISA-N	1	1	322.321	1.996	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC[C@@H](Cn3ccnn3)C2)c1	ZINC000852314406	704008355	/nfs/dbraw/zinc/00/83/55/704008355.db2.gz	SKLMQWZKHGTNQG-DOMZBBRYSA-N	1	1	317.349	1.242	20	5		DDBDMO
COC[C@@H]1CCCN(C(=O)[C@@](C)([NH3+])c2cccc([N+](=O)[O-])c2)C1	ZINC000870886302	704157973	/nfs/dbraw/zinc/15/79/73/704157973.db2.gz	CRFDFFPHGWWVQO-WBMJQRKESA-N	1	1	321.377	1.654	20	5		DDBDMO
Cc1nn(C[N@H+]2CCC3(COC3)C2)c2cc([N+](=O)[O-])ccc12	ZINC000853597409	704281928	/nfs/dbraw/zinc/28/19/28/704281928.db2.gz	JBDMQVFGSZOAEM-UHFFFAOYSA-N	1	1	302.334	1.933	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000821341804	704393759	/nfs/dbraw/zinc/39/37/59/704393759.db2.gz	FMUILUOTTFVXCO-INIZCTEOSA-N	1	1	322.409	1.029	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@H]1CC[N@@H+](CC)C1	ZINC000855490728	704487493	/nfs/dbraw/zinc/48/74/93/704487493.db2.gz	KOJNWZXLZVHLCQ-JTQLQIEISA-N	1	1	324.356	1.872	20	5		DDBDMO
C[N@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1	ZINC000859962172	705055806	/nfs/dbraw/zinc/05/58/06/705055806.db2.gz	JMCQSTWSIZVZKD-JGZJWPJOSA-N	1	1	308.294	1.199	20	5		DDBDMO
C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1	ZINC000859962172	705055810	/nfs/dbraw/zinc/05/58/10/705055810.db2.gz	JMCQSTWSIZVZKD-JGZJWPJOSA-N	1	1	308.294	1.199	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000874850724	705203641	/nfs/dbraw/zinc/20/36/41/705203641.db2.gz	WFPULLZBCUORJU-CABCVRRESA-N	1	1	303.362	1.832	20	5		DDBDMO
O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[C@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000861718169	705549825	/nfs/dbraw/zinc/54/98/25/705549825.db2.gz	WMWSWAOTWQTABW-RYUDHWBXSA-N	1	1	323.324	1.015	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825098960	705599313	/nfs/dbraw/zinc/59/93/13/705599313.db2.gz	RAHWASLORUWKMO-IUODEOHRSA-N	1	1	321.377	1.476	20	5		DDBDMO
C[C@@H]1CC[N@@H+](CCNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000826722480	705857884	/nfs/dbraw/zinc/85/78/84/705857884.db2.gz	QVTVHFREGAESHG-RISCZKNCSA-N	1	1	307.350	1.086	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)CCc1cc(F)ccc1[N+](=O)[O-]	ZINC000827136916	705937276	/nfs/dbraw/zinc/93/72/76/705937276.db2.gz	UISVVSHFWCWQEE-CYBMUJFWSA-N	1	1	309.341	1.877	20	5		DDBDMO
CCn1ncc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])n1	ZINC000863561056	705958118	/nfs/dbraw/zinc/95/81/18/705958118.db2.gz	BXWWFEKXSKTAGF-UHFFFAOYSA-N	1	1	318.337	1.325	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)CC[C@H]21	ZINC000827269714	705964882	/nfs/dbraw/zinc/96/48/82/705964882.db2.gz	ZCDXABHKJXFDJJ-TVQRCGJNSA-N	1	1	322.340	1.482	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)CC[N@H+]1C	ZINC000827401065	705993059	/nfs/dbraw/zinc/99/30/59/705993059.db2.gz	XFOHLUOJBCQQCA-DGCLKSJQSA-N	1	1	303.362	1.820	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@H](CO)[C@H](CO)C1	ZINC000877764462	706201605	/nfs/dbraw/zinc/20/16/05/706201605.db2.gz	CQVJCKFTLVUKMX-YEKRNXETSA-N	1	1	306.362	1.531	20	5		DDBDMO
C[C@H]1C[C@H](N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000877831480	706227096	/nfs/dbraw/zinc/22/70/96/706227096.db2.gz	UXWOMRDUAOLYJZ-KSZJFAHPSA-N	1	1	323.393	1.061	20	5		DDBDMO
C[C@H]1C[C@H]([NH2+][C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1C	ZINC000877831480	706227099	/nfs/dbraw/zinc/22/70/99/706227099.db2.gz	UXWOMRDUAOLYJZ-KSZJFAHPSA-N	1	1	323.393	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c2nonc21	ZINC000829010146	706272867	/nfs/dbraw/zinc/27/28/67/706272867.db2.gz	HSAIYDRKLWKCRO-AOOOYVTPSA-N	1	1	319.321	1.406	20	5		DDBDMO
CC[N@@H+](CCNC(=O)Cc1cccc(F)c1[N+](=O)[O-])C1CC1	ZINC000865150744	706364289	/nfs/dbraw/zinc/36/42/89/706364289.db2.gz	HJQWRSDDBPUEBY-UHFFFAOYSA-N	1	1	309.341	1.877	20	5		DDBDMO
COC(C[N@@H+](CCCO)Cc1ccc(C)c([N+](=O)[O-])c1)OC	ZINC000878396020	706376795	/nfs/dbraw/zinc/37/67/95/706376795.db2.gz	IJHMMEVVZICFAM-UHFFFAOYSA-N	1	1	312.366	1.707	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2cc(F)c([N+](=O)[O-])cc2CO)C1	ZINC000865642046	706485050	/nfs/dbraw/zinc/48/50/50/706485050.db2.gz	QMJYXYZBFLCTKS-JTQLQIEISA-N	1	1	320.324	1.954	20	5		DDBDMO
C[C@H]1CN(C)C(=O)CN1c1cc[nH+]c2ccc([N+](=O)[O-])cc21	ZINC000865710758	706502987	/nfs/dbraw/zinc/50/29/87/706502987.db2.gz	CMVBIAYSOWPEDC-JTQLQIEISA-N	1	1	300.318	1.810	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](Nc2c(Cl)cncc2[N+](=O)[O-])C1	ZINC000865998463	706589145	/nfs/dbraw/zinc/58/91/45/706589145.db2.gz	IWTLCNBOCNXNDI-VIFPVBQESA-N	1	1	314.773	1.322	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000880438539	706976526	/nfs/dbraw/zinc/97/65/26/706976526.db2.gz	MMWVBLDFNMHJBK-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[C@@H]1CC[C@H](CO)[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000880438539	706976529	/nfs/dbraw/zinc/97/65/29/706976529.db2.gz	MMWVBLDFNMHJBK-BXUZGUMPSA-N	1	1	319.361	1.329	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)[C@@H](O)c3cccc([N+](=O)[O-])c3)C[C@@H]2C1	ZINC000832913226	706997469	/nfs/dbraw/zinc/99/74/69/706997469.db2.gz	YFGLIFYVVRURHO-IPYPFGDCSA-N	1	1	319.361	1.038	20	5		DDBDMO
CCO[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CN(C)C	ZINC000926964184	712923371	/nfs/dbraw/zinc/92/33/71/712923371.db2.gz	WKIYALGJDGAGJN-AAEUAGOBSA-N	1	1	310.398	1.794	20	5		DDBDMO
CC[C@H]1COCC[N@@H+]1CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000872772924	707594324	/nfs/dbraw/zinc/59/43/24/707594324.db2.gz	CLYASZUFHAARQL-NSHDSACASA-N	1	1	319.365	1.994	20	5		DDBDMO
CC[C@H]1COCC[N@H+]1CCNc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000872772924	707594326	/nfs/dbraw/zinc/59/43/26/707594326.db2.gz	CLYASZUFHAARQL-NSHDSACASA-N	1	1	319.365	1.994	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1ccc([N+](=O)[O-])c2nonc21	ZINC000872780114	707596674	/nfs/dbraw/zinc/59/66/74/707596674.db2.gz	JPCLUSJEILYYIA-VHSXEESVSA-N	1	1	303.322	1.804	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCn1nc(C)c([N+](=O)[O-])c1C	ZINC000882486542	707657214	/nfs/dbraw/zinc/65/72/14/707657214.db2.gz	STUVILOQGNMRCT-LBPRGKRZSA-N	1	1	309.370	1.009	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H]1C[N@@H+](C)CCN1C	ZINC000873051184	707709562	/nfs/dbraw/zinc/70/95/62/707709562.db2.gz	DELOHTIHAZAUEN-CQSZACIVSA-N	1	1	306.410	1.547	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1CNC[C@@H]1C[N@H+](C)CCN1C	ZINC000873051184	707709566	/nfs/dbraw/zinc/70/95/66/707709566.db2.gz	DELOHTIHAZAUEN-CQSZACIVSA-N	1	1	306.410	1.547	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897220810	708258738	/nfs/dbraw/zinc/25/87/38/708258738.db2.gz	DKFGEXUUIIZGCJ-HZPDHXFCSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897222772	708260632	/nfs/dbraw/zinc/26/06/32/708260632.db2.gz	XMKVGCYVANMTET-ZIAGYGMSSA-N	1	1	305.378	1.939	20	5		DDBDMO
COC(=O)[C@@H]1CSCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886249985	708725494	/nfs/dbraw/zinc/72/54/94/708725494.db2.gz	XWJCOPMFSWUMEB-NSHDSACASA-N	1	1	311.363	1.328	20	5		DDBDMO
COC(=O)[C@@H]1CSCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886249985	708725496	/nfs/dbraw/zinc/72/54/96/708725496.db2.gz	XWJCOPMFSWUMEB-NSHDSACASA-N	1	1	311.363	1.328	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@](CO)(C(F)(F)F)C2)c1	ZINC000886799101	708846991	/nfs/dbraw/zinc/84/69/91/708846991.db2.gz	MNCIPYHHMWJSHF-SNVBAGLBSA-N	1	1	308.260	1.038	20	5		DDBDMO
C[NH+](C)[C@H]1C[C@@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)C12CCC2	ZINC000898835476	708884177	/nfs/dbraw/zinc/88/41/77/708884177.db2.gz	NPGAMDHQBBQGDL-KGLIPLIRSA-N	1	1	319.361	1.903	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887933100	709169629	/nfs/dbraw/zinc/16/96/29/709169629.db2.gz	CWFLEBXJEBROQY-ZUZCIYMTSA-N	1	1	321.381	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3C[N@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887933100	709169632	/nfs/dbraw/zinc/16/96/32/709169632.db2.gz	CWFLEBXJEBROQY-ZUZCIYMTSA-N	1	1	321.381	1.294	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000887933100	709169634	/nfs/dbraw/zinc/16/96/34/709169634.db2.gz	CWFLEBXJEBROQY-ZUZCIYMTSA-N	1	1	321.381	1.294	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000892417925	710434093	/nfs/dbraw/zinc/43/40/93/710434093.db2.gz	KGYDYGUNERFCSF-LSDHHAIUSA-N	1	1	318.377	1.973	20	5		DDBDMO
COc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc([N+](=O)[O-])c1C	ZINC000928438767	713195955	/nfs/dbraw/zinc/19/59/55/713195955.db2.gz	GVCNLTZQIVFTAR-JQWIXIFHSA-N	1	1	307.350	1.734	20	5		DDBDMO
COc1c(O)ccc(CNCC[N@H+]2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000893355039	710614079	/nfs/dbraw/zinc/61/40/79/710614079.db2.gz	BPJVAMSVMSDMTM-NSHDSACASA-N	1	1	309.366	1.883	20	5		DDBDMO
COc1c(O)ccc(C[NH2+]CCN2CCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000893355039	710614082	/nfs/dbraw/zinc/61/40/82/710614082.db2.gz	BPJVAMSVMSDMTM-NSHDSACASA-N	1	1	309.366	1.883	20	5		DDBDMO
COc1ccc(CC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000928451247	713202597	/nfs/dbraw/zinc/20/25/97/713202597.db2.gz	VIRSIIPMANSJNQ-PWSUYJOCSA-N	1	1	307.350	1.355	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000928569197	713232611	/nfs/dbraw/zinc/23/26/11/713232611.db2.gz	LDWGGRIDMRZSHD-CYBMUJFWSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000928569197	713232612	/nfs/dbraw/zinc/23/26/12/713232612.db2.gz	LDWGGRIDMRZSHD-CYBMUJFWSA-N	1	1	315.333	1.214	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@H](C)C[C@@H](CO)C2)c1[N+](=O)[O-]	ZINC000894973820	711346687	/nfs/dbraw/zinc/34/66/87/711346687.db2.gz	BECKRDUSKGUBBT-GHMZBOCLSA-N	1	1	310.350	1.759	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2c1nc2sccn2c1[N+](=O)[O-]	ZINC000895193624	711449791	/nfs/dbraw/zinc/44/97/91/711449791.db2.gz	ZGJQNJGQOZENQT-VHSXEESVSA-N	1	1	307.379	1.977	20	5		DDBDMO
C[C@@H](Nc1c(Cl)cncc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895248266	711465151	/nfs/dbraw/zinc/46/51/51/711465151.db2.gz	ZPOXDGLMTYDWIL-BXKDBHETSA-N	1	1	313.789	1.111	20	5		DDBDMO
C[N@H+]1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC1(C)C	ZINC000895564971	711542727	/nfs/dbraw/zinc/54/27/27/711542727.db2.gz	RBMLFLBGHBMZIO-UHFFFAOYSA-N	1	1	321.377	1.892	20	5		DDBDMO
CN1CC[C@H]1CNc1nc(NC[C@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000895770300	711601342	/nfs/dbraw/zinc/60/13/42/711601342.db2.gz	LUBOMHMXXRLYHB-NEPJUHHUSA-N	1	1	320.397	1.222	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+]2C2CCOCC2)n1	ZINC000896524203	711738245	/nfs/dbraw/zinc/73/82/45/711738245.db2.gz	WDBLAOPBOQATSP-ZDUSSCGKSA-N	1	1	306.366	1.963	20	5		DDBDMO
O=C(NC12CC[NH+](CC1)C2)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000913631874	713272861	/nfs/dbraw/zinc/27/28/61/713272861.db2.gz	GSLXXUUNVYFWOM-UHFFFAOYSA-N	1	1	311.288	1.651	20	5		DDBDMO
C[N@H+]1CCC[C@H]1Cn1c(=O)onc1-c1cccc([N+](=O)[O-])c1	ZINC000917686710	713509852	/nfs/dbraw/zinc/50/98/52/713509852.db2.gz	XYXGWVNKDKWWGC-LBPRGKRZSA-N	1	1	304.306	1.506	20	5		DDBDMO
Cc1nn(C)c(C(=O)OCC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000920659658	713685836	/nfs/dbraw/zinc/68/58/36/713685836.db2.gz	CQTFBBCTAGIVPU-NSHDSACASA-N	1	1	310.354	1.668	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CC[N+](=O)[O-])[C@H]1CNC(=O)OC(C)(C)C	ZINC000929778919	713688636	/nfs/dbraw/zinc/68/86/36/713688636.db2.gz	KSNRRSVNOIAULF-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])[C@H]1CNC(=O)OC(C)(C)C	ZINC000929778919	713688637	/nfs/dbraw/zinc/68/86/37/713688637.db2.gz	KSNRRSVNOIAULF-NEPJUHHUSA-N	1	1	301.387	1.888	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](C)[C@@H](CO)C2)ccc1[N+](=O)[O-]	ZINC000931402701	714086126	/nfs/dbraw/zinc/08/61/26/714086126.db2.gz	XGKPRDMFWMPCAI-CYBMUJFWSA-N	1	1	309.366	1.102	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCn2cc[nH+]c21	ZINC000931524709	714119357	/nfs/dbraw/zinc/11/93/57/714119357.db2.gz	UTDYTCMRSGLPDL-JTQLQIEISA-N	1	1	301.306	1.639	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923287730	714298365	/nfs/dbraw/zinc/29/83/65/714298365.db2.gz	FLBSVNJCRMWWQQ-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923287730	714298368	/nfs/dbraw/zinc/29/83/68/714298368.db2.gz	FLBSVNJCRMWWQQ-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923287730	714298369	/nfs/dbraw/zinc/29/83/69/714298369.db2.gz	FLBSVNJCRMWWQQ-MNOVXSKESA-N	1	1	321.381	1.579	20	5		DDBDMO
CCO[C@H]1CC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000932969862	714446418	/nfs/dbraw/zinc/44/64/18/714446418.db2.gz	CYLMPBNIPVDERL-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
CCO[C@H]1CC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000932969862	714446421	/nfs/dbraw/zinc/44/64/21/714446421.db2.gz	CYLMPBNIPVDERL-ZDUSSCGKSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@H]2CC[C@H]2OC)c1	ZINC000934104981	714741988	/nfs/dbraw/zinc/74/19/88/714741988.db2.gz	APFMXUDUWLBOLA-UONOGXRCSA-N	1	1	308.334	1.991	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H]2CC[C@H]2OC)c1	ZINC000934104981	714741989	/nfs/dbraw/zinc/74/19/89/714741989.db2.gz	APFMXUDUWLBOLA-UONOGXRCSA-N	1	1	308.334	1.991	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1CN1CC[C@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000934260295	714778126	/nfs/dbraw/zinc/77/81/26/714778126.db2.gz	WDBIAULKMYMJLT-CVEARBPZSA-N	1	1	323.368	1.765	20	5		DDBDMO
O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)C1CCC1	ZINC001025645204	736807601	/nfs/dbraw/zinc/80/76/01/736807601.db2.gz	OLFRGWYJKVNMPJ-ZSHCYNCHSA-N	1	1	315.373	1.941	20	5		DDBDMO
CC(C)c1ccc(C[NH2+]CCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001126936432	742839601	/nfs/dbraw/zinc/83/96/01/742839601.db2.gz	HLNQQOZXBZMWHV-HUUCEWRRSA-N	1	1	305.378	1.681	20	5		DDBDMO
Cc1ccc(C[NH+]2CCC(NC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1	ZINC001002783484	743425118	/nfs/dbraw/zinc/42/51/18/743425118.db2.gz	ULAYJTQZKUZXLE-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC001184387309	744031485	/nfs/dbraw/zinc/03/14/85/744031485.db2.gz	IVUBZHDSDNQJDB-RWMBFGLXSA-N	1	1	321.377	1.739	20	5		DDBDMO
CC(C)CC1(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC001129062177	751205397	/nfs/dbraw/zinc/20/53/97/751205397.db2.gz	XRFQXJDKWYKLKG-UHFFFAOYSA-N	1	1	323.397	1.360	20	5		DDBDMO
O=C1CC[C@H]2[C@H](CC[N@@H+]2[C@H]2CC[C@@H](C[N+](=O)[O-])C2)N1CC1CC1	ZINC001169019305	762199870	/nfs/dbraw/zinc/19/98/70/762199870.db2.gz	HOAZBEKFZLGCFT-UGUYLWEFSA-N	1	1	321.421	1.907	20	5		DDBDMO
C[C@@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)[C@H]1C[N@@H+](C)CCN1C	ZINC000823784949	758361614	/nfs/dbraw/zinc/36/16/14/758361614.db2.gz	UIEZYFQHNVDZSL-QMTHXVAHSA-N	1	1	324.356	1.098	20	5		DDBDMO
O=C(NCC1CC[NH+](CC2=CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001001400701	762826229	/nfs/dbraw/zinc/82/62/29/762826229.db2.gz	VVJJNWLPRIAPLG-HZPDHXFCSA-N	1	1	321.421	1.980	20	5		DDBDMO
COc1ccc(C[C@H](C)[N@H+]2CC[C@H](F)[C@@H](O)C2)c([N+](=O)[O-])c1	ZINC001170327849	766254042	/nfs/dbraw/zinc/25/40/42/766254042.db2.gz	IIKWAZPQSJXIMY-XEGUGMAKSA-N	1	1	312.341	1.939	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2cccnc2)CC1	ZINC001045436900	766306322	/nfs/dbraw/zinc/30/63/22/766306322.db2.gz	XEKUUSUCQLNKFS-ZIAGYGMSSA-N	1	1	318.377	1.218	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C[N@H+]1C1CC1	ZINC001137492694	766350593	/nfs/dbraw/zinc/35/05/93/766350593.db2.gz	XKJYELPGUCOFHQ-BQBZGAKWSA-N	1	1	313.745	1.326	20	5		DDBDMO
CCC(=O)NCCC[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC001096243317	768740579	/nfs/dbraw/zinc/74/05/79/768740579.db2.gz	LFYQKYCHTCGOGK-UHFFFAOYSA-N	1	1	321.381	1.028	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCF)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001048525574	769493263	/nfs/dbraw/zinc/49/32/63/769493263.db2.gz	YCOKXLUWMLTVRD-XVIXHAIJSA-N	1	1	313.373	1.370	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2CCCF)[C@@H]1CC1[N+](=O)[O-]	ZINC001048525574	769493268	/nfs/dbraw/zinc/49/32/68/769493268.db2.gz	YCOKXLUWMLTVRD-XVIXHAIJSA-N	1	1	313.373	1.370	20	5		DDBDMO
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2CCCF)[C@@H]1CC1[N+](=O)[O-]	ZINC001048525574	769493272	/nfs/dbraw/zinc/49/32/72/769493272.db2.gz	YCOKXLUWMLTVRD-XVIXHAIJSA-N	1	1	313.373	1.370	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCn3cnnc3C1)CC2	ZINC001172908054	776918028	/nfs/dbraw/zinc/91/80/28/776918028.db2.gz	KQVVXFMEMDNRJN-AWEZNQCLSA-N	1	1	313.361	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCn3cnnc3C1)CC2	ZINC001172908054	776918037	/nfs/dbraw/zinc/91/80/37/776918037.db2.gz	KQVVXFMEMDNRJN-AWEZNQCLSA-N	1	1	313.361	1.950	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2CCOC[C@@H]2C1	ZINC001173221726	777054380	/nfs/dbraw/zinc/05/43/80/777054380.db2.gz	LIXCXCXNMVUHFH-BBRMVZONSA-N	1	1	305.378	1.542	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1	ZINC001101657650	777352909	/nfs/dbraw/zinc/35/29/09/777352909.db2.gz	JDOBKOHPLILQKW-UHFFFAOYSA-N	1	1	308.382	1.805	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N(C)CCNc1cc(C)c([N+](=O)[O-])cn1	ZINC001101705321	777414822	/nfs/dbraw/zinc/41/48/22/777414822.db2.gz	ARNRKHVLHUSZFG-UHFFFAOYSA-N	1	1	323.397	1.510	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1CO	ZINC001176532607	778172233	/nfs/dbraw/zinc/17/22/33/778172233.db2.gz	BFXDMPOYMISLRM-UONOGXRCSA-N	1	1	319.361	1.184	20	5		DDBDMO
C[N@H+]1C[C@@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC001178709985	779154740	/nfs/dbraw/zinc/15/47/40/779154740.db2.gz	UAWOKBKEAMLKOV-CYBMUJFWSA-N	1	1	306.366	1.463	20	5		DDBDMO
COc1cc(CNC[C@@H]2CCCC[N@@H+]2C)c([N+](=O)[O-])cc1O	ZINC001179730252	779470432	/nfs/dbraw/zinc/47/04/32/779470432.db2.gz	TXQPIQNZXBBAJY-LBPRGKRZSA-N	1	1	309.366	1.883	20	5		DDBDMO
COc1cc(CNC[C@@H]2CCCC[N@H+]2C)c([N+](=O)[O-])cc1O	ZINC001179730252	779470437	/nfs/dbraw/zinc/47/04/37/779470437.db2.gz	TXQPIQNZXBBAJY-LBPRGKRZSA-N	1	1	309.366	1.883	20	5		DDBDMO
Cc1cc(C)cc(C[NH2+]C/C=C/CNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001274014972	851849977	/nfs/dbraw/zinc/84/99/77/851849977.db2.gz	FOCXNZDKFLYEJC-OBMMGQTPSA-N	1	1	317.389	1.731	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC001122733050	858951535	/nfs/dbraw/zinc/95/15/35/858951535.db2.gz	WJLPDSCDCIPOKJ-CHWSQXEVSA-N	1	1	322.413	1.241	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1C[C@H]2C)c1ccccc1[N+](=O)[O-]	ZINC001123975899	859506337	/nfs/dbraw/zinc/50/63/37/859506337.db2.gz	GUSQVLAMRAVGBN-XUJVJEKNSA-N	1	1	318.377	1.160	20	5		DDBDMO
CC[C@H]1C[N@H+](CC)CCN1C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001140660976	860669217	/nfs/dbraw/zinc/66/92/17/860669217.db2.gz	MNYNZHIKPKBWNQ-QMMMGPOBSA-N	1	1	315.761	1.528	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001140660976	860669219	/nfs/dbraw/zinc/66/92/19/860669219.db2.gz	MNYNZHIKPKBWNQ-QMMMGPOBSA-N	1	1	315.761	1.528	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC001203067137	860699852	/nfs/dbraw/zinc/69/98/52/860699852.db2.gz	GTADFWIDBCUPKB-LLVKDONJSA-N	1	1	321.381	1.714	20	5		DDBDMO
COc1cc2ncnc(N[C@H]3CC[N@@H+](C)C3)c2cc1[N+](=O)[O-]	ZINC001156580870	863164225	/nfs/dbraw/zinc/16/42/25/863164225.db2.gz	YHIHDCKEYXGXKM-VIFPVBQESA-N	1	1	303.322	1.663	20	5		DDBDMO
Cc1cc(C)cc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157760372	864111671	/nfs/dbraw/zinc/11/16/71/864111671.db2.gz	DXBJOLSTYPKMRV-HUUCEWRRSA-N	1	1	305.378	1.565	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC001158366056	864605683	/nfs/dbraw/zinc/60/56/83/864605683.db2.gz	VFNZCCVFZMSXAT-SECBINFHSA-N	1	1	310.329	1.530	20	5		DDBDMO
CC[N@@H+](C)[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C1	ZINC001160160795	865704764	/nfs/dbraw/zinc/70/47/64/865704764.db2.gz	RPTGJWNSXCGWES-CQSZACIVSA-N	1	1	305.378	1.998	20	5		DDBDMO
CC(=O)NC[C@H](C)CNc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001160656804	866000948	/nfs/dbraw/zinc/00/09/48/866000948.db2.gz	SAWIFQMJWOAERM-QRGHLMKCSA-N	1	1	321.381	1.706	20	5		DDBDMO
CCCc1[nH]nc(C(=O)Nc2cc(C)[nH+]c(C)c2)c1[N+](=O)[O-]	ZINC001323958502	866977586	/nfs/dbraw/zinc/97/75/86/866977586.db2.gz	INLZAGZQELWTNU-UHFFFAOYSA-N	1	1	303.322	1.956	20	5		DDBDMO
O=C([C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC001324437764	867280423	/nfs/dbraw/zinc/28/04/23/867280423.db2.gz	BXZIUFYWYHXUNM-CABCVRRESA-N	1	1	319.361	1.325	20	5		DDBDMO
COc1c(O)ccc(CN2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC001334318377	867482004	/nfs/dbraw/zinc/48/20/04/867482004.db2.gz	HVLLIFDTIGKOGN-UHFFFAOYSA-N	1	1	309.366	1.835	20	5		DDBDMO
CCC[NH2+]CCN(CCc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001162810111	867844274	/nfs/dbraw/zinc/84/42/74/867844274.db2.gz	DGJGNUYVXBLSAN-HZPDHXFCSA-N	1	1	319.405	1.723	20	5		DDBDMO
Cc1cccc(N2CCN(c3cc([N+](=O)[O-])cc[n+]3[O-])CC2)[nH+]1	ZINC001163659552	868599986	/nfs/dbraw/zinc/59/99/86/868599986.db2.gz	MEBNHUSTZOJUCU-UHFFFAOYSA-N	1	1	315.333	1.258	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2ccccn2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164490618	869229322	/nfs/dbraw/zinc/22/93/22/869229322.db2.gz	OEBSTKOKMRJVIU-ZIAGYGMSSA-N	1	1	318.377	1.123	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNc2cc([N+](=O)[O-])c3nncn3c2)C1	ZINC001165290401	869498490	/nfs/dbraw/zinc/49/84/90/869498490.db2.gz	SPTDNBHTWVVREL-NSHDSACASA-N	1	1	304.354	1.781	20	5		DDBDMO
CCn1c(CCC[N+](=O)[O-])nnc1N1CC[C@@H]2[C@H](CC[N@H+]2C)C1	ZINC001340021300	870845540	/nfs/dbraw/zinc/84/55/40/870845540.db2.gz	RTJBFQCCISPCDV-CHWSQXEVSA-N	1	1	322.413	1.038	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[N@@H+](C)CCO	ZINC001217422691	877195470	/nfs/dbraw/zinc/19/54/70/877195470.db2.gz	MHCAHZZFORRCLV-UHFFFAOYSA-N	1	1	324.381	1.599	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)cccc1[N+](=O)[O-]	ZINC001353285484	877228751	/nfs/dbraw/zinc/22/87/51/877228751.db2.gz	NQVUXIRYFZSNKY-KGYLQXTDSA-N	1	1	319.361	1.673	20	5		DDBDMO
COc1cc(CO[C@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)cc([N+](=O)[O-])c1	ZINC001223395737	880945115	/nfs/dbraw/zinc/94/51/15/880945115.db2.gz	JKQPXBQCYCSAAD-XZJROXQQSA-N	1	1	320.345	1.924	20	5		DDBDMO
COC(=O)c1cccc(CO[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC001223662786	881050418	/nfs/dbraw/zinc/05/04/18/881050418.db2.gz	NIDPHJULPQINJZ-LBPRGKRZSA-N	1	1	308.334	1.992	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@H+]2C/C=C\c1ccccc1[N+](=O)[O-]	ZINC001232304117	886226176	/nfs/dbraw/zinc/22/61/76/886226176.db2.gz	VNCQDYDPAPGEDV-DFCLBCNGSA-N	1	1	301.346	1.818	20	5		DDBDMO
O=C1NC[C@@H]2[C@H]1CCC[N@@H+]2C/C=C\c1ccccc1[N+](=O)[O-]	ZINC001232304117	886226197	/nfs/dbraw/zinc/22/61/97/886226197.db2.gz	VNCQDYDPAPGEDV-DFCLBCNGSA-N	1	1	301.346	1.818	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC001291881663	913591344	/nfs/dbraw/zinc/59/13/44/913591344.db2.gz	DKWQVWFUMBYDOV-LLVKDONJSA-N	1	1	311.769	1.859	20	5		DDBDMO
[NH3+]C[C@@]1(N[C@H]2Cc3ccc([N+](=O)[O-])cc3C2)CN2CCC1CC2	ZINC001254580886	896513658	/nfs/dbraw/zinc/51/36/58/896513658.db2.gz	HTTVOUBZSLYYPJ-DOTOQJQBSA-N	1	1	316.405	1.075	20	5		DDBDMO
CCN1C[C@@H]2C[NH+]([C@H]3Cc4ccc([N+](=O)[O-])cc4C3)C[C@H]2C1	ZINC001254610653	896531489	/nfs/dbraw/zinc/53/14/89/896531489.db2.gz	MGUOIRDTPNIZHY-INMHGKMJSA-N	1	1	301.390	1.946	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](CC)C[C@H]2C)n1	ZINC000248684921	282099384	/nfs/dbraw/zinc/09/93/84/282099384.db2.gz	YSHDXJJSJXCBME-NEPJUHHUSA-N	1	1	323.397	1.614	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C)[C@@H]1CO	ZINC000305706018	231023003	/nfs/dbraw/zinc/02/30/03/231023003.db2.gz	CVNOBPXPYNZQAL-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C)[C@@H]1CO	ZINC000305706018	231023007	/nfs/dbraw/zinc/02/30/07/231023007.db2.gz	CVNOBPXPYNZQAL-ABAIWWIYSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@H]([N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)O	ZINC000451357592	231075846	/nfs/dbraw/zinc/07/58/46/231075846.db2.gz	DPHARPFYCGAPOD-AAEUAGOBSA-N	1	1	312.366	1.426	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1	ZINC000451624712	231141365	/nfs/dbraw/zinc/14/13/65/231141365.db2.gz	BADDLCDEHNSWDT-SLEUVZQESA-N	1	1	318.377	1.558	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CC[C@H](CCCO)C1	ZINC000452126066	231311813	/nfs/dbraw/zinc/31/18/13/231311813.db2.gz	TZIQTMRWBLGYAA-UONOGXRCSA-N	1	1	324.377	1.429	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000452136577	231317478	/nfs/dbraw/zinc/31/74/78/231317478.db2.gz	YQCLSYJKYKSVJB-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
CCOc1cc(CN2CC[N@@H+](CCO)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000452136578	231318176	/nfs/dbraw/zinc/31/81/76/231318176.db2.gz	YQCLSYJKYKSVJB-ZDUSSCGKSA-N	1	1	323.393	1.492	20	5		DDBDMO
CC[C@@H](CO)[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000295667514	529504076	/nfs/dbraw/zinc/50/40/76/529504076.db2.gz	IWYBJCHZDZRHNW-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
CCO[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1(C)C	ZINC000090550316	185302542	/nfs/dbraw/zinc/30/25/42/185302542.db2.gz	SVLIWMZTHGHALV-UONOGXRCSA-N	1	1	323.393	1.892	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000425061296	529822236	/nfs/dbraw/zinc/82/22/36/529822236.db2.gz	YQSQONVHIBCBRA-DZGCQCFKSA-N	1	1	303.362	1.690	20	5		DDBDMO
C[N@@H+](CCCCNc1ncc([N+](=O)[O-])cc1C(N)=O)C1CC1	ZINC000413344367	529884216	/nfs/dbraw/zinc/88/42/16/529884216.db2.gz	CHVRACCCUPAGKS-UHFFFAOYSA-N	1	1	307.354	1.375	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@@H]1CCC[C@H]1O	ZINC000305358540	529984211	/nfs/dbraw/zinc/98/42/11/529984211.db2.gz	SOPUEKVHUQRGKX-GXTWGEPZSA-N	1	1	307.350	1.287	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CCNC(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000458184805	530054442	/nfs/dbraw/zinc/05/44/42/530054442.db2.gz	JUXMVEIUOXWDHD-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@H](O)C[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000279671851	215049606	/nfs/dbraw/zinc/04/96/06/215049606.db2.gz	DLYXIGJOPYGWIV-STQMWFEESA-N	1	1	309.366	1.382	20	5		DDBDMO
CON1CCC([N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)CC1	ZINC000459572430	233324049	/nfs/dbraw/zinc/32/40/49/233324049.db2.gz	AKJWHUBVCPXUHN-UHFFFAOYSA-N	1	1	309.366	1.931	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)n1	ZINC000617405652	363090573	/nfs/dbraw/zinc/09/05/73/363090573.db2.gz	JAEFVYIGTQDJIQ-NSHDSACASA-N	1	1	307.354	1.025	20	5		DDBDMO
CN(CCc1ccccc1[N+](=O)[O-])C(=O)NCC[N@@H+](C)C1CC1	ZINC000287240716	219399889	/nfs/dbraw/zinc/39/98/89/219399889.db2.gz	WVQCSJPBBLCQRZ-UHFFFAOYSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12	ZINC000046992558	352474433	/nfs/dbraw/zinc/47/44/33/352474433.db2.gz	HYJWIIMMGVFQRA-DZGCQCFKSA-N	1	1	303.362	1.880	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000047263223	352487917	/nfs/dbraw/zinc/48/79/17/352487917.db2.gz	VHIUNRUBWNUNIC-UHFFFAOYSA-N	1	1	322.365	1.300	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CC[N@@H+](C)C2)c1C	ZINC000053686179	352664529	/nfs/dbraw/zinc/66/45/29/352664529.db2.gz	WNAIZIQVCNJWIP-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N[C@H]2CC[N@H+](C)C2)c1C	ZINC000053686179	352664533	/nfs/dbraw/zinc/66/45/33/352664533.db2.gz	WNAIZIQVCNJWIP-NSHDSACASA-N	1	1	313.379	1.194	20	5		DDBDMO
CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000060379794	352870089	/nfs/dbraw/zinc/87/00/89/352870089.db2.gz	GGPJQHLKMYIGBW-CQSZACIVSA-N	1	1	312.391	1.646	20	5		DDBDMO
CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCS(=O)(=O)C1	ZINC000060379794	352870090	/nfs/dbraw/zinc/87/00/90/352870090.db2.gz	GGPJQHLKMYIGBW-CQSZACIVSA-N	1	1	312.391	1.646	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)CC1	ZINC000067190631	353037918	/nfs/dbraw/zinc/03/79/18/353037918.db2.gz	OTTWDBFKTKDXPL-UHFFFAOYSA-N	1	1	321.333	1.144	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCNC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000068121332	353090106	/nfs/dbraw/zinc/09/01/06/353090106.db2.gz	HPBFNSLFFWLSGP-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
C[C@@H]1COCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000331926352	234284997	/nfs/dbraw/zinc/28/49/97/234284997.db2.gz	CUZOQUDSTBRKHI-JSGCOSHPSA-N	1	1	310.350	1.303	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@H](c3ccccc3)C2)c1	ZINC000075675353	353375864	/nfs/dbraw/zinc/37/58/64/353375864.db2.gz	LCKZXHWNLNPITC-HOCLYGCPSA-N	1	1	316.361	1.642	20	5		DDBDMO
CN(C)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2N)cc[nH+]1	ZINC000345043289	282905849	/nfs/dbraw/zinc/90/58/49/282905849.db2.gz	GTQOWWYJGQOKQW-UHFFFAOYSA-N	1	1	301.306	1.890	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccccn2)C2CC2)c1	ZINC000174665986	198367527	/nfs/dbraw/zinc/36/75/27/198367527.db2.gz	KKXOCHSZMFCZEN-HNNXBMFYSA-N	1	1	317.349	1.212	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](CO)C1	ZINC000174709324	198373513	/nfs/dbraw/zinc/37/35/13/198373513.db2.gz	YWOKRBUYPRRXHM-NSHDSACASA-N	1	1	323.349	1.246	20	5		DDBDMO
CN(C)C(=O)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccccc1	ZINC000174833663	198391080	/nfs/dbraw/zinc/39/10/80/198391080.db2.gz	IWIMNWWRMSODNO-AWEZNQCLSA-N	1	1	317.349	1.210	20	5		DDBDMO
C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1[N+](=O)[O-]	ZINC000174818487	198389875	/nfs/dbraw/zinc/38/98/75/198389875.db2.gz	IAZSTTROTQNYMO-UHFFFAOYSA-N	1	1	305.294	1.832	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1[N+](=O)[O-]	ZINC000174818487	198389877	/nfs/dbraw/zinc/38/98/77/198389877.db2.gz	IAZSTTROTQNYMO-UHFFFAOYSA-N	1	1	305.294	1.832	20	5		DDBDMO
COCc1cc([N+](=O)[O-])ccc1NCCC[NH+]1CCOCC1	ZINC000080530418	353613663	/nfs/dbraw/zinc/61/36/63/353613663.db2.gz	MLMFDNLVXCPROO-UHFFFAOYSA-N	1	1	309.366	1.875	20	5		DDBDMO
O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@H]2C1	ZINC000141334278	354139408	/nfs/dbraw/zinc/13/94/08/354139408.db2.gz	QPGTWFYDGVCWEJ-ZDUSSCGKSA-N	1	1	318.377	1.703	20	5		DDBDMO
Nc1c(C(=O)N2CCC[N@H+]3CCC[C@H]3C2)cc(F)cc1[N+](=O)[O-]	ZINC000141454064	354140416	/nfs/dbraw/zinc/14/04/16/354140416.db2.gz	HBJNVCXFCWWYPV-NSHDSACASA-N	1	1	322.340	1.626	20	5		DDBDMO
C[C@H](O)C[C@H]1COCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157105094	354223853	/nfs/dbraw/zinc/22/38/53/354223853.db2.gz	SINQPIQYFFDDFG-ZFWWWQNUSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](O)C[C@H]1COCC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000157105094	354223857	/nfs/dbraw/zinc/22/38/57/354223857.db2.gz	SINQPIQYFFDDFG-ZFWWWQNUSA-N	1	1	324.377	1.835	20	5		DDBDMO
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[N@H+](C)CCO1	ZINC000157515131	354224977	/nfs/dbraw/zinc/22/49/77/354224977.db2.gz	GGKZTTCZVMWCFS-TVQRCGJNSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@H]1C[N@@H+](C)CCO1	ZINC000157515131	354224980	/nfs/dbraw/zinc/22/49/80/354224980.db2.gz	GGKZTTCZVMWCFS-TVQRCGJNSA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H]1[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCS1(=O)=O	ZINC000313271203	354478990	/nfs/dbraw/zinc/47/89/90/354478990.db2.gz	BABQZQHAUXVISV-PRHODGIISA-N	1	1	302.327	1.399	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(c3cc(N)c([N+](=O)[O-])c(CO)c3)[C@@H]2C1	ZINC000585779643	354839787	/nfs/dbraw/zinc/83/97/87/354839787.db2.gz	HPHVDOBKSKGTAJ-IINYFYTJSA-N	1	1	306.366	1.200	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H](OC)C2)c1	ZINC000589495777	354996229	/nfs/dbraw/zinc/99/62/29/354996229.db2.gz	LWPMAFMIKQRKIA-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H](OC)C2)c1	ZINC000589495777	354996231	/nfs/dbraw/zinc/99/62/31/354996231.db2.gz	LWPMAFMIKQRKIA-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)C(C)(C)C2)c1	ZINC000589513654	354998097	/nfs/dbraw/zinc/99/80/97/354998097.db2.gz	MSXGCLICYXPXED-CQSZACIVSA-N	1	1	322.361	1.974	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)C(C)(C)C2)c1	ZINC000589513654	354998101	/nfs/dbraw/zinc/99/81/01/354998101.db2.gz	MSXGCLICYXPXED-CQSZACIVSA-N	1	1	322.361	1.974	20	5		DDBDMO
CC[N@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000589737694	355017662	/nfs/dbraw/zinc/01/76/62/355017662.db2.gz	VTBVOQVAVBQSDQ-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
CC[N@@H+](Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])[C@@H]1CCOC1	ZINC000589737694	355017664	/nfs/dbraw/zinc/01/76/64/355017664.db2.gz	VTBVOQVAVBQSDQ-CYBMUJFWSA-N	1	1	308.334	1.992	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC(C[NH+]3CCOCC3)C2)nc2sccn21	ZINC000590568517	355115622	/nfs/dbraw/zinc/11/56/22/355115622.db2.gz	ZCAXAKOPCAKVPH-UHFFFAOYSA-N	1	1	323.378	1.072	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21	ZINC000590443744	355097832	/nfs/dbraw/zinc/09/78/32/355097832.db2.gz	GYHRDEWGBRZYHY-MFKMUULPSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1CC[C@@H](CCCO)C1)OCCO2	ZINC000590663760	355140122	/nfs/dbraw/zinc/14/01/22/355140122.db2.gz	CWIJRBZSRBDYAU-GFCCVEGCSA-N	1	1	322.361	1.960	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+]([C@@H]3CCC[C@@H]3O)CC2)c(F)c1	ZINC000591144261	355253873	/nfs/dbraw/zinc/25/38/73/355253873.db2.gz	BVWRVCXXLKFITN-OLZOCXBDSA-N	1	1	310.329	1.164	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000592209142	355539520	/nfs/dbraw/zinc/53/95/20/355539520.db2.gz	VKGULDRGKUIRCK-YRGRVCCFSA-N	1	1	322.361	1.820	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000593065150	355784952	/nfs/dbraw/zinc/78/49/52/355784952.db2.gz	YAVSHMWGQFVLHK-AEGPPILISA-N	1	1	324.377	1.834	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)CO1	ZINC000593065150	355784954	/nfs/dbraw/zinc/78/49/54/355784954.db2.gz	YAVSHMWGQFVLHK-AEGPPILISA-N	1	1	324.377	1.834	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@H+](C)[C@H](C)[C@H]2C)n1	ZINC000593188905	355821335	/nfs/dbraw/zinc/82/13/35/355821335.db2.gz	FGIUHUPMZOOEGL-GMTAPVOTSA-N	1	1	309.370	1.364	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N2[C@H](C)C[N@@H+](C)[C@H](C)[C@H]2C)n1	ZINC000593188905	355821339	/nfs/dbraw/zinc/82/13/39/355821339.db2.gz	FGIUHUPMZOOEGL-GMTAPVOTSA-N	1	1	309.370	1.364	20	5		DDBDMO
Cc1cc(NC(=O)N2CC[N@H+]3C[C@H](O)C[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000594079908	356107476	/nfs/dbraw/zinc/10/74/76/356107476.db2.gz	CEFFMHRGQYYGQJ-QWHCGFSZSA-N	1	1	320.349	1.186	20	5		DDBDMO
C[NH+](C)[C@H]1C[C@@H](CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000594103101	356114420	/nfs/dbraw/zinc/11/44/20/356114420.db2.gz	VUHHPDKPSKOMFG-JGZJWPJOSA-N	1	1	317.349	1.541	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCCC[C@H]1CO	ZINC000594017222	356089230	/nfs/dbraw/zinc/08/92/30/356089230.db2.gz	VQWCGWKJPHVLBY-UONOGXRCSA-N	1	1	324.377	1.571	20	5		DDBDMO
CCC[C@H]1CN(c2ccncc2[N+](=O)[O-])CC[N@H+]1CCOC	ZINC000346663082	283141922	/nfs/dbraw/zinc/14/19/22/283141922.db2.gz	WHJPUWXPYCZPJB-ZDUSSCGKSA-N	1	1	308.382	1.927	20	5		DDBDMO
NC(=O)c1ccnc(N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1[N+](=O)[O-]	ZINC000594596963	356260265	/nfs/dbraw/zinc/26/02/65/356260265.db2.gz	BPNWVDFWHOWSND-NWDGAFQWSA-N	1	1	319.365	1.518	20	5		DDBDMO
Cc1noc(C[NH+]2CCC(Cn3ccnn3)CC2)c1[N+](=O)[O-]	ZINC000595394634	356476633	/nfs/dbraw/zinc/47/66/33/356476633.db2.gz	FHGAPAVBYPRISI-UHFFFAOYSA-N	1	1	306.326	1.395	20	5		DDBDMO
Cc1noc(C[NH2+][C@H](C2CC2)[C@]2(CO)CCCO2)c1[N+](=O)[O-]	ZINC000595504303	356521695	/nfs/dbraw/zinc/52/16/95/356521695.db2.gz	BJGSSFBCARTKRR-ZIAGYGMSSA-N	1	1	311.338	1.301	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H](C)[C@H]1O	ZINC000595740199	356629967	/nfs/dbraw/zinc/62/99/67/356629967.db2.gz	DFTCKFNHQOIWSC-ATCWAGBWSA-N	1	1	321.377	1.872	20	5		DDBDMO
C[C@@H](O)[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000595766814	356643588	/nfs/dbraw/zinc/64/35/88/356643588.db2.gz	RCGOOCFTOXKNDC-BXUZGUMPSA-N	1	1	307.350	1.403	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@]2(O)C[C@H]2C1	ZINC000595756575	356638869	/nfs/dbraw/zinc/63/88/69/356638869.db2.gz	INLVSUZANAVPJS-BLLLJJGKSA-N	1	1	319.361	1.689	20	5		DDBDMO
NC(=O)c1cc(N[C@H]2CC[N@@H+](CC3CC3)C2)ccc1[N+](=O)[O-]	ZINC000596118909	356780026	/nfs/dbraw/zinc/78/00/26/356780026.db2.gz	GHBNKOQQOLPNDN-LBPRGKRZSA-N	1	1	304.350	1.590	20	5		DDBDMO
Cc1cccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1[N+](=O)[O-]	ZINC000596539728	356911442	/nfs/dbraw/zinc/91/14/42/356911442.db2.gz	QCLBNRYSUXSULP-AWEZNQCLSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[NH+](C)CC1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000597708806	357296066	/nfs/dbraw/zinc/29/60/66/357296066.db2.gz	ORQKQMWJLCPQFR-UHFFFAOYSA-N	1	1	303.322	1.105	20	5		DDBDMO
CCN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1	ZINC000598044188	357440704	/nfs/dbraw/zinc/44/07/04/357440704.db2.gz	ZPPHRLJVXGRLSA-AWEZNQCLSA-N	1	1	321.377	1.916	20	5		DDBDMO
O=C(NC[C@H]1CC[N@@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])[nH]1	ZINC000598512410	357611210	/nfs/dbraw/zinc/61/12/10/357611210.db2.gz	ZNURWOUXRHXRJB-CYBMUJFWSA-N	1	1	314.345	1.927	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1Cc1ccccc1)c1ccc([N+](=O)[O-])[nH]1	ZINC000598512410	357611214	/nfs/dbraw/zinc/61/12/14/357611214.db2.gz	ZNURWOUXRHXRJB-CYBMUJFWSA-N	1	1	314.345	1.927	20	5		DDBDMO
CCC[NH+]1CCN(c2nccc(C(=O)OC)c2[N+](=O)[O-])CC1	ZINC000598586915	357641877	/nfs/dbraw/zinc/64/18/77/357641877.db2.gz	KUTRHYCEDCWKCL-UHFFFAOYSA-N	1	1	308.338	1.308	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H](CO)C1	ZINC000598647067	357668733	/nfs/dbraw/zinc/66/87/33/357668733.db2.gz	BPUSHZBFEBCPKL-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H](CO)C1	ZINC000598647067	357668740	/nfs/dbraw/zinc/66/87/40/357668740.db2.gz	BPUSHZBFEBCPKL-WCQYABFASA-N	1	1	321.377	1.792	20	5		DDBDMO
O=C(CCCC[NH+]1CCOCC1)NCc1cccc([N+](=O)[O-])c1	ZINC000171766853	306684695	/nfs/dbraw/zinc/68/46/95/306684695.db2.gz	ZNXRBWRXZJZVAC-UHFFFAOYSA-N	1	1	321.377	1.714	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)N(C)CCc1ccccc1[N+](=O)[O-]	ZINC000599927889	358082699	/nfs/dbraw/zinc/08/26/99/358082699.db2.gz	AEZDZEWFEXQUTO-UHFFFAOYSA-N	1	1	302.334	1.801	20	5		DDBDMO
COC(=O)c1cnc(NCC2=CC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000276696767	213051725	/nfs/dbraw/zinc/05/17/25/213051725.db2.gz	HRSBGOOVDWQPFJ-UHFFFAOYSA-N	1	1	306.322	1.450	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N1CC[NH+](CC2CC2)CC1	ZINC000180678614	199194820	/nfs/dbraw/zinc/19/48/20/199194820.db2.gz	WIIACURGFWAKFY-UHFFFAOYSA-N	1	1	304.350	1.345	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@H](CNc2ncc(F)cc2[N+](=O)[O-])C1	ZINC000601101229	358402708	/nfs/dbraw/zinc/40/27/08/358402708.db2.gz	UPIAJOCKLFIRBA-GFCCVEGCSA-N	1	1	312.345	1.898	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@H](CO)[C@@H]3CCOC3)c2c1	ZINC000601159133	358426932	/nfs/dbraw/zinc/42/69/32/358426932.db2.gz	HRMJCTSXDCRKGS-NEPJUHHUSA-N	1	1	317.345	1.622	20	5		DDBDMO
CC[C@@H]1[C@@H](C(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000601382719	358527804	/nfs/dbraw/zinc/52/78/04/358527804.db2.gz	GJILKHQIBJOESC-LSDHHAIUSA-N	1	1	305.378	1.984	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCn2c(C)ncc2[N+](=O)[O-])ccc1O	ZINC000602771218	359179551	/nfs/dbraw/zinc/17/95/51/359179551.db2.gz	ABCXWAGEPOIRPQ-UHFFFAOYSA-N	1	1	320.349	1.946	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2nc[nH]n2)CC1	ZINC000602869605	359254171	/nfs/dbraw/zinc/25/41/71/359254171.db2.gz	MEUOZPZPTKKOEK-GFCCVEGCSA-N	1	1	316.365	1.905	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@@H]2C1	ZINC000602796895	359199406	/nfs/dbraw/zinc/19/94/06/359199406.db2.gz	UFYWZRMHBVPWPM-MGPQQGTHSA-N	1	1	324.381	1.368	20	5		DDBDMO
CO[C@@H]1CC[C@H]2OCC[N@@H+](CCn3c(C)ncc3[N+](=O)[O-])[C@@H]2C1	ZINC000602796895	359199408	/nfs/dbraw/zinc/19/94/08/359199408.db2.gz	UFYWZRMHBVPWPM-MGPQQGTHSA-N	1	1	324.381	1.368	20	5		DDBDMO
COc1ccc([C@@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C2CC2)cn1	ZINC000602919855	359295073	/nfs/dbraw/zinc/29/50/73/359295073.db2.gz	XOVOYCAYBWCFOS-AWEZNQCLSA-N	1	1	317.349	1.973	20	5		DDBDMO
COC[C@@](C)(CO)[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-]	ZINC000602933669	359303553	/nfs/dbraw/zinc/30/35/53/359303553.db2.gz	WIYXWXQSVCACJX-CYBMUJFWSA-N	1	1	302.302	1.230	20	5		DDBDMO
CO[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@](C)(CO)C1	ZINC000602963636	359326873	/nfs/dbraw/zinc/32/68/73/359326873.db2.gz	HPSSJNDNLGQSAH-IUODEOHRSA-N	1	1	310.350	1.445	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC[N@@H+](C[C@@H]2CCCO2)CC1	ZINC000604264294	359731174	/nfs/dbraw/zinc/73/11/74/359731174.db2.gz	CWNNYIHMUXOFPA-LBPRGKRZSA-N	1	1	322.365	1.250	20	5		DDBDMO
C[C@](C[NH3+])(NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CC1	ZINC000237613420	202303557	/nfs/dbraw/zinc/30/35/57/202303557.db2.gz	PTNGKAQLVAAWBN-CQSZACIVSA-N	1	1	303.322	1.328	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(CCc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000189572941	200424054	/nfs/dbraw/zinc/42/40/54/200424054.db2.gz	OQOOYPUHRYIPNQ-ZIAGYGMSSA-N	1	1	307.394	1.524	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+](CCO)CCc2ccccc2)n1	ZINC000610485240	360448871	/nfs/dbraw/zinc/44/88/71/360448871.db2.gz	YKNSNWXNBKBKJB-UHFFFAOYSA-N	1	1	304.350	1.328	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000610580815	360476063	/nfs/dbraw/zinc/47/60/63/360476063.db2.gz	NJEMIZQZBXWWPK-SECBINFHSA-N	1	1	304.306	1.433	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1	ZINC000610580815	360476067	/nfs/dbraw/zinc/47/60/67/360476067.db2.gz	NJEMIZQZBXWWPK-SECBINFHSA-N	1	1	304.306	1.433	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000610712471	360512416	/nfs/dbraw/zinc/51/24/16/360512416.db2.gz	BWNUIPZHLWDQTB-ZWNOBZJWSA-N	1	1	321.381	1.125	20	5		DDBDMO
CC(C)c1[nH]nc(C(=O)N2CCCC[C@@H]2C[NH+](C)C)c1[N+](=O)[O-]	ZINC000610922098	360572342	/nfs/dbraw/zinc/57/23/42/360572342.db2.gz	ANARYLPPRVJBAZ-LLVKDONJSA-N	1	1	323.397	1.998	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CCN(c2ccsc2[N+](=O)[O-])CC1	ZINC000610808455	360541947	/nfs/dbraw/zinc/54/19/47/360541947.db2.gz	SOCHJZGXYXZZBC-LLVKDONJSA-N	1	1	324.406	1.399	20	5		DDBDMO
COCCCC[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000293082140	223387378	/nfs/dbraw/zinc/38/73/78/223387378.db2.gz	JVNRSCZJEROLOE-UHFFFAOYSA-N	1	1	321.377	1.779	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1cccnc1	ZINC000261902504	203147585	/nfs/dbraw/zinc/14/75/85/203147585.db2.gz	GQXFJRPPJZSNQN-OAHLLOKOSA-N	1	1	312.329	1.777	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2C[C@@H](c3ccccc3)[C@H]([NH3+])C2)c1[N+](=O)[O-]	ZINC000262112370	203202596	/nfs/dbraw/zinc/20/25/96/203202596.db2.gz	AYXSCLZBZCADJH-NWDGAFQWSA-N	1	1	315.333	1.193	20	5		DDBDMO
CNS(=O)(=O)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000264689166	204082069	/nfs/dbraw/zinc/08/20/69/204082069.db2.gz	DHKMXBMPOSEHMM-UHFFFAOYSA-N	1	1	313.379	1.108	20	5		DDBDMO
CC[C@@H](O)C[NH+]1CCN(C(=O)c2cc(C)ccc2[N+](=O)[O-])CC1	ZINC000266114860	205108201	/nfs/dbraw/zinc/10/82/01/205108201.db2.gz	NMUUKBJABDELDK-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
C[C@H](c1ccc(F)cc1)[N@@H+](C)C[C@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000266416825	205331554	/nfs/dbraw/zinc/33/15/54/205331554.db2.gz	HORHLHQYLUZQQV-ABAIWWIYSA-N	1	1	322.340	1.984	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000174700838	248376066	/nfs/dbraw/zinc/37/60/66/248376066.db2.gz	WQYCPTPBACKFJC-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000174700838	248376072	/nfs/dbraw/zinc/37/60/72/248376072.db2.gz	WQYCPTPBACKFJC-QWRGUYRKSA-N	1	1	323.349	1.245	20	5		DDBDMO
CCN(CC)C(=O)[C@@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000174860225	248384200	/nfs/dbraw/zinc/38/42/00/248384200.db2.gz	NUVNTLBBUXAJDB-ZDUSSCGKSA-N	1	1	309.370	1.124	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2ccc([N+](=O)[O-])cc2C(C)=O)CC1	ZINC000288581051	220257790	/nfs/dbraw/zinc/25/77/90/220257790.db2.gz	XKLYLDVHCATHNB-CYBMUJFWSA-N	1	1	321.377	1.690	20	5		DDBDMO
CO[C@H]1C[C@@H]([N@@H+](C)C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000285244895	218349453	/nfs/dbraw/zinc/34/94/53/218349453.db2.gz	CARKFRSAMJYRSB-UPJWGTAASA-N	1	1	310.350	1.444	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)[C@H](C)C1	ZINC000076491653	207352096	/nfs/dbraw/zinc/35/20/96/207352096.db2.gz	YIPSKNDDUFMRJG-TZMCWYRMSA-N	1	1	323.397	1.370	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)CC1	ZINC000119602936	195000410	/nfs/dbraw/zinc/00/04/10/195000410.db2.gz	JRWTUNNUOYEPFO-UHFFFAOYSA-N	1	1	314.345	1.921	20	5		DDBDMO
COCC[N@@H+](C)CCNc1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC000413118435	224137687	/nfs/dbraw/zinc/13/76/87/224137687.db2.gz	UHIYOPGFVZKXGO-UHFFFAOYSA-N	1	1	322.287	1.999	20	5		DDBDMO
CC(C)(C)OC(=O)[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000156764676	197138503	/nfs/dbraw/zinc/13/85/03/197138503.db2.gz	DMQOJWQXFFRMFD-GFCCVEGCSA-N	1	1	324.381	1.845	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](O)CC1	ZINC000293037207	533327851	/nfs/dbraw/zinc/32/78/51/533327851.db2.gz	GSXKKSCTWHLNOF-FZMZJTMJSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@H](O)CC1	ZINC000293037207	533327857	/nfs/dbraw/zinc/32/78/57/533327857.db2.gz	GSXKKSCTWHLNOF-FZMZJTMJSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H](C)[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000330795645	533404077	/nfs/dbraw/zinc/40/40/77/533404077.db2.gz	WZYZPHSOXNFTTL-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@@H](C)[N@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000330795645	533404079	/nfs/dbraw/zinc/40/40/79/533404079.db2.gz	WZYZPHSOXNFTTL-PHIMTYICSA-N	1	1	307.350	1.768	20	5		DDBDMO
CCc1ccc(S(=O)(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000568881608	304319191	/nfs/dbraw/zinc/31/91/91/304319191.db2.gz	LVWFFJXZKQJGRB-UHFFFAOYSA-N	1	1	323.321	1.030	20	5		DDBDMO
C[C@@H]1CCCC[N@H+]1CCCCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000068084872	406615423	/nfs/dbraw/zinc/61/54/23/406615423.db2.gz	SBVRZFAHHBLQLI-CYBMUJFWSA-N	1	1	323.397	1.562	20	5		DDBDMO
Cn1cc[nH+]c1N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000013693508	406865610	/nfs/dbraw/zinc/86/56/10/406865610.db2.gz	DKBYGTFNLJQHQH-UHFFFAOYSA-N	1	1	315.333	1.291	20	5		DDBDMO
Cn1cnc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1	ZINC000090969440	407173074	/nfs/dbraw/zinc/17/30/74/407173074.db2.gz	KULSMNZTVQZSLG-ZDUSSCGKSA-N	1	1	301.350	1.834	20	5		DDBDMO
C[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@H]1CCCOC1	ZINC000107691360	407378217	/nfs/dbraw/zinc/37/82/17/407378217.db2.gz	SHGDFBZQJXMXSR-LLVKDONJSA-N	1	1	307.350	1.552	20	5		DDBDMO
O=[N+]([O-])c1ccc(S(=O)(=O)N2C[C@H]3CCC[C@@H](C2)[NH2+]3)cc1	ZINC000124783212	407369449	/nfs/dbraw/zinc/36/94/49/407369449.db2.gz	WUNBXJXWDKQGOB-PHIMTYICSA-N	1	1	311.363	1.110	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000127863305	407471869	/nfs/dbraw/zinc/47/18/69/407471869.db2.gz	GJQNSQADNRSFSJ-MNOVXSKESA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000127863305	407471873	/nfs/dbraw/zinc/47/18/73/407471873.db2.gz	GJQNSQADNRSFSJ-MNOVXSKESA-N	1	1	323.397	1.825	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000127863305	407471880	/nfs/dbraw/zinc/47/18/80/407471880.db2.gz	GJQNSQADNRSFSJ-MNOVXSKESA-N	1	1	323.397	1.825	20	5		DDBDMO
C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000185725334	407488827	/nfs/dbraw/zinc/48/88/27/407488827.db2.gz	ULPXXBLXQSENTR-ONGXEEELSA-N	1	1	308.338	1.108	20	5		DDBDMO
C[N@H+]1CCC[C@@H](CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000185774902	407500373	/nfs/dbraw/zinc/50/03/73/407500373.db2.gz	SLAFDLLXCGXMLA-NSHDSACASA-N	1	1	313.379	1.215	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCCCNC(=O)c2nn(C)cc2[N+](=O)[O-])C1	ZINC000271087334	407507211	/nfs/dbraw/zinc/50/72/11/407507211.db2.gz	HHESQRVOXDFPQW-LBPRGKRZSA-N	1	1	323.397	1.570	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000112928607	407450034	/nfs/dbraw/zinc/45/00/34/407450034.db2.gz	PXJMZTROGTXMLL-UHFFFAOYSA-N	1	1	309.366	1.820	20	5		DDBDMO
CC[C@@H]1C[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000270985689	407451750	/nfs/dbraw/zinc/45/17/50/407451750.db2.gz	XSKFXBVGHSWZGK-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[C@@H]1C[N@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1O	ZINC000270985689	407451757	/nfs/dbraw/zinc/45/17/57/407451757.db2.gz	XSKFXBVGHSWZGK-MISXGVKJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[NH+](C)C[C@H]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000114148410	407544469	/nfs/dbraw/zinc/54/44/69/407544469.db2.gz	ITIASNJQADYCOP-SNVBAGLBSA-N	1	1	317.349	1.495	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])CN1CC[NH+](C)CC1	ZINC000114140985	407544965	/nfs/dbraw/zinc/54/49/65/407544965.db2.gz	JXTPSNHKTDHTHQ-ZDUSSCGKSA-N	1	1	320.393	1.208	20	5		DDBDMO
Cc1nn(C)c(N2CCN(c3cc(C)cc[nH+]3)CC2)c1[N+](=O)[O-]	ZINC000153035193	407741456	/nfs/dbraw/zinc/74/14/56/407741456.db2.gz	LLCNVZHXHRYFHY-UHFFFAOYSA-N	1	1	316.365	1.667	20	5		DDBDMO
COc1ccc(NC(=O)C[N@H+](C)CCSC)c([N+](=O)[O-])c1	ZINC000134200876	407890653	/nfs/dbraw/zinc/89/06/53/407890653.db2.gz	RMHYFYXYLAOPHO-UHFFFAOYSA-N	1	1	313.379	1.837	20	5		DDBDMO
COc1ccc(NC(=O)C[N@@H+](C)CCSC)c([N+](=O)[O-])c1	ZINC000134200876	407890659	/nfs/dbraw/zinc/89/06/59/407890659.db2.gz	RMHYFYXYLAOPHO-UHFFFAOYSA-N	1	1	313.379	1.837	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000268135975	407907411	/nfs/dbraw/zinc/90/74/11/407907411.db2.gz	CIGUGXFLKUAGKB-RNCFNFMXSA-N	1	1	304.350	1.390	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H]([C@@H](C)O)C1	ZINC000272527315	407964442	/nfs/dbraw/zinc/96/44/42/407964442.db2.gz	IAQOFUNTCFSODX-OLZOCXBDSA-N	1	1	321.377	1.935	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCOC3(CCOCC3)C2)cc1	ZINC000135639872	408045320	/nfs/dbraw/zinc/04/53/20/408045320.db2.gz	QRNGTJVLKXUFDS-UHFFFAOYSA-N	1	1	322.361	1.855	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@H+]2CCOC3(CCOCC3)C2)cc1	ZINC000135639872	408045332	/nfs/dbraw/zinc/04/53/32/408045332.db2.gz	QRNGTJVLKXUFDS-UHFFFAOYSA-N	1	1	322.361	1.855	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1ccccc1[N+](=O)[O-])C[C@@H]1CCC[C@@H]1O	ZINC000182256727	408105632	/nfs/dbraw/zinc/10/56/32/408105632.db2.gz	NZUIBEWWRDPCIU-YDHLFZDLSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000121239746	408168173	/nfs/dbraw/zinc/16/81/73/408168173.db2.gz	KRXSLTVHWKYVIE-OLZOCXBDSA-N	1	1	321.377	1.772	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](CO)C1	ZINC000122202441	408266470	/nfs/dbraw/zinc/26/64/70/408266470.db2.gz	MBYFPFNQUPBATB-ZDUSSCGKSA-N	1	1	321.377	1.936	20	5		DDBDMO
CC[C@H](C)[N@@H+](C)CCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-]	ZINC000269475173	408322361	/nfs/dbraw/zinc/32/23/61/408322361.db2.gz	VADLOVBIBFEREC-JTQLQIEISA-N	1	1	311.386	1.901	20	5		DDBDMO
NC(=O)c1ccc(C[NH2+][C@H](CO)c2ccccc2)c([N+](=O)[O-])c1	ZINC000182915965	408283110	/nfs/dbraw/zinc/28/31/10/408283110.db2.gz	KHORAWIKOZHTAY-CQSZACIVSA-N	1	1	315.329	1.517	20	5		DDBDMO
C[C@@H](O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000183195805	408349068	/nfs/dbraw/zinc/34/90/68/408349068.db2.gz	CMCIEMWMFLZBEV-QJPTWQEYSA-N	1	1	307.350	1.625	20	5		DDBDMO
Cc1c([C@H](C)[NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])cnn1C	ZINC000183364850	408390288	/nfs/dbraw/zinc/39/02/88/408390288.db2.gz	DGMNLZZLNSFPHB-VIFPVBQESA-N	1	1	317.349	1.586	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000264283056	408425820	/nfs/dbraw/zinc/42/58/20/408425820.db2.gz	ZEJNRIFMPMWQFI-UHFFFAOYSA-N	1	1	303.322	1.420	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C	ZINC000183952697	408517990	/nfs/dbraw/zinc/51/79/90/408517990.db2.gz	OSAGBQAFIAUWSK-UHFFFAOYSA-N	1	1	323.393	1.564	20	5		DDBDMO
CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000247390009	408462068	/nfs/dbraw/zinc/46/20/68/408462068.db2.gz	QIDCXTLBTPEKTI-TZMCWYRMSA-N	1	1	305.378	1.982	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@@H]1CC[N@H+](C)C[C@H]1C	ZINC000247382256	408463033	/nfs/dbraw/zinc/46/30/33/408463033.db2.gz	LMOXTLVGWZTGPC-QMTHXVAHSA-N	1	1	306.366	1.710	20	5		DDBDMO
Cc1cc(C(=O)N(C)[C@H]2CCC[N@@H+](C)C2)c(N)c([N+](=O)[O-])c1	ZINC000176889806	408466441	/nfs/dbraw/zinc/46/64/41/408466441.db2.gz	AFVKODSKOHYMTD-NSHDSACASA-N	1	1	306.366	1.652	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC[C@@H]1O	ZINC000275543106	408595875	/nfs/dbraw/zinc/59/58/75/408595875.db2.gz	ZFKCGJCLFBREOE-WFASDCNBSA-N	1	1	324.377	1.427	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000193590278	408732130	/nfs/dbraw/zinc/73/21/30/408732130.db2.gz	DKKRQMDZXYVUQJ-SNVBAGLBSA-N	1	1	317.349	1.869	20	5		DDBDMO
C[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1O	ZINC000249566284	408742956	/nfs/dbraw/zinc/74/29/56/408742956.db2.gz	NCLSMCTVUJXNSN-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC[C@H]1O	ZINC000249566284	408742962	/nfs/dbraw/zinc/74/29/62/408742962.db2.gz	NCLSMCTVUJXNSN-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CN(CC[N@@H+](C)C1CC1)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000185282293	408791252	/nfs/dbraw/zinc/79/12/52/408791252.db2.gz	GIVDQGOSDFMJNS-UHFFFAOYSA-N	1	1	306.366	1.830	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@H]1O	ZINC000249585228	408746354	/nfs/dbraw/zinc/74/63/54/408746354.db2.gz	SRJKWAIKGGPKBG-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)CC[C@H]1O	ZINC000249585228	408746357	/nfs/dbraw/zinc/74/63/57/408746357.db2.gz	SRJKWAIKGGPKBG-IAQYHMDHSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000270932650	408746765	/nfs/dbraw/zinc/74/67/65/408746765.db2.gz	QIWAYYPVQJQEHU-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H]1O	ZINC000270932650	408746771	/nfs/dbraw/zinc/74/67/71/408746771.db2.gz	QIWAYYPVQJQEHU-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
COCC[NH+]1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000162998561	408750856	/nfs/dbraw/zinc/75/08/56/408750856.db2.gz	NUOXWJGLPMXQFW-UHFFFAOYSA-N	1	1	322.365	1.699	20	5		DDBDMO
CC[C@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000270942883	408752413	/nfs/dbraw/zinc/75/24/13/408752413.db2.gz	RSFKXYPVNIOLCV-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
CC[C@H]1C[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@H]1O	ZINC000270942883	408752418	/nfs/dbraw/zinc/75/24/18/408752418.db2.gz	RSFKXYPVNIOLCV-GXFFZTMASA-N	1	1	318.333	1.848	20	5		DDBDMO
O=C(CC[N@H+](CCO)C1CC1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000185182207	408776529	/nfs/dbraw/zinc/77/65/29/408776529.db2.gz	PLEWKHZPVLMNFB-UHFFFAOYSA-N	1	1	311.313	1.519	20	5		DDBDMO
C[C@H](C(=O)NC[C@@H]1CC[N@@H+](C)C1)c1ccc([N+](=O)[O-])cc1F	ZINC000185183433	408777131	/nfs/dbraw/zinc/77/71/31/408777131.db2.gz	NWUZMFDDRQWAGM-QWRGUYRKSA-N	1	1	309.341	1.905	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCCC[N@H+]2C2CC2)n1	ZINC000277598573	408973845	/nfs/dbraw/zinc/97/38/45/408973845.db2.gz	TYSQBFBYEIGVPS-NSHDSACASA-N	1	1	307.354	1.075	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC(C)(C)CO	ZINC000295180798	409359939	/nfs/dbraw/zinc/35/99/39/409359939.db2.gz	HYOOTIZFPBBLHL-UHFFFAOYSA-N	1	1	321.377	1.434	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)CC(C)(C)CO	ZINC000295180798	409359944	/nfs/dbraw/zinc/35/99/44/409359944.db2.gz	HYOOTIZFPBBLHL-UHFFFAOYSA-N	1	1	321.377	1.434	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C(C)(C)C1	ZINC000284561060	409347100	/nfs/dbraw/zinc/34/71/00/409347100.db2.gz	YHTGVWIRUUYNTM-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C(C)(C)C1	ZINC000284561060	409347108	/nfs/dbraw/zinc/34/71/08/409347108.db2.gz	YHTGVWIRUUYNTM-UHFFFAOYSA-N	1	1	310.329	1.482	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)C[C@@H]21	ZINC000408468100	164341370	/nfs/dbraw/zinc/34/13/70/164341370.db2.gz	PXTXPFYWSKFFBI-RISCZKNCSA-N	1	1	314.345	1.852	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000290704112	409492314	/nfs/dbraw/zinc/49/23/14/409492314.db2.gz	WJXJMSMPFAAKNB-JTQLQIEISA-N	1	1	307.354	1.375	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-]	ZINC000337933941	409581804	/nfs/dbraw/zinc/58/18/04/409581804.db2.gz	FCPNSKGOAURJEX-UHFFFAOYSA-N	1	1	301.368	1.133	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000356843159	409654956	/nfs/dbraw/zinc/65/49/56/409654956.db2.gz	GBLWLEUAMPODOX-QWHCGFSZSA-N	1	1	321.377	1.915	20	5		DDBDMO
CC(C)C[C@H]1CCC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000305052867	409663563	/nfs/dbraw/zinc/66/35/63/409663563.db2.gz	NHUSBRMWLRWMLF-UKRRQHHQSA-N	1	1	310.398	1.910	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCC3)[C@@H]2C2CC2)c1	ZINC000357457082	410050949	/nfs/dbraw/zinc/05/09/49/410050949.db2.gz	VAALKWLSJYAIDC-KBPBESRZSA-N	1	1	306.366	1.417	20	5		DDBDMO
COc1ccc(CN2CCO[C@H]3CC[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000332321988	410066528	/nfs/dbraw/zinc/06/65/28/410066528.db2.gz	RORRSKDNHWUOAB-HOCLYGCPSA-N	1	1	321.377	1.508	20	5		DDBDMO
C[N@H+]1CCCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000298687212	410346433	/nfs/dbraw/zinc/34/64/33/410346433.db2.gz	WIBSWBRYXNWDLL-UHFFFAOYSA-N	1	1	317.349	1.782	20	5		DDBDMO
Cc1ncc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000351872240	410308508	/nfs/dbraw/zinc/30/85/08/410308508.db2.gz	DBJVAWOZMMMICZ-ZDUSSCGKSA-N	1	1	314.349	1.775	20	5		DDBDMO
Cc1ncc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1	ZINC000351872240	410308517	/nfs/dbraw/zinc/30/85/17/410308517.db2.gz	DBJVAWOZMMMICZ-ZDUSSCGKSA-N	1	1	314.349	1.775	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNc2ccc3ncccc3c2[N+](=O)[O-])C1	ZINC000358361129	410453451	/nfs/dbraw/zinc/45/34/51/410453451.db2.gz	WGNGXKOOUJGUDA-OAHLLOKOSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C[C@@H](C)O	ZINC000352232820	410564729	/nfs/dbraw/zinc/56/47/29/410564729.db2.gz	WJQPJCRYFYEZNS-LLVKDONJSA-N	1	1	307.350	1.187	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000343583282	410553393	/nfs/dbraw/zinc/55/33/93/410553393.db2.gz	YGRYMVDBIFJLKQ-CYBMUJFWSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cc[nH]n1	ZINC000337248041	410671822	/nfs/dbraw/zinc/67/18/22/410671822.db2.gz	KONCMRQUNNKDOP-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cc[nH]n1	ZINC000337248041	410671826	/nfs/dbraw/zinc/67/18/26/410671826.db2.gz	KONCMRQUNNKDOP-UHFFFAOYSA-N	1	1	303.322	1.779	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000301310488	410695091	/nfs/dbraw/zinc/69/50/91/410695091.db2.gz	ZRFOBRKCJCYHBM-CQSZACIVSA-N	1	1	304.394	1.811	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])C(C)(C)C1	ZINC000330579595	410794689	/nfs/dbraw/zinc/79/46/89/410794689.db2.gz	SSSVTGSETKUBDF-UHFFFAOYSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000340296754	410835243	/nfs/dbraw/zinc/83/52/43/410835243.db2.gz	FZKXDSNZLRYZSP-CYBMUJFWSA-N	1	1	320.393	1.873	20	5		DDBDMO
O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+](C2CC2)C1	ZINC000341172772	410914154	/nfs/dbraw/zinc/91/41/54/410914154.db2.gz	CKOAHZRXMCVRHE-ZDUSSCGKSA-N	1	1	318.377	1.673	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000331053719	410921002	/nfs/dbraw/zinc/92/10/02/410921002.db2.gz	JNVHOMPLGILSJB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000331053719	410921008	/nfs/dbraw/zinc/92/10/08/410921008.db2.gz	JNVHOMPLGILSJB-GHMZBOCLSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](C)[C@H](CN)C2CC2)cccc1[N+](=O)[O-]	ZINC000359884512	410934126	/nfs/dbraw/zinc/93/41/26/410934126.db2.gz	WNXJSVILLBKUPY-OAHLLOKOSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+](C)[C@H](CN)C2CC2)cccc1[N+](=O)[O-]	ZINC000359884512	410934132	/nfs/dbraw/zinc/93/41/32/410934132.db2.gz	WNXJSVILLBKUPY-OAHLLOKOSA-N	1	1	320.393	1.901	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000331201531	411014101	/nfs/dbraw/zinc/01/41/01/411014101.db2.gz	QJKPRYYDDORZGF-QWHCGFSZSA-N	1	1	321.377	1.881	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000331187877	411005952	/nfs/dbraw/zinc/00/59/52/411005952.db2.gz	ZJLJNNODJLIZGI-GXTWGEPZSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@H]1COC(C)(C)C[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000331187877	411005958	/nfs/dbraw/zinc/00/59/58/411005958.db2.gz	ZJLJNNODJLIZGI-GXTWGEPZSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=C(NCCCC[N@@H+]1CCC[C@@H]1CO)c1ccc([N+](=O)[O-])cc1	ZINC000131399148	196165271	/nfs/dbraw/zinc/16/52/71/196165271.db2.gz	JZIYPCPQEGUCOT-OAHLLOKOSA-N	1	1	321.377	1.562	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1CCc1ccc([N+](=O)[O-])cc1	ZINC000419336573	226122558	/nfs/dbraw/zinc/12/25/58/226122558.db2.gz	XHRUDGNGMWGPDC-KBPBESRZSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1CCO	ZINC000419336573	226122559	/nfs/dbraw/zinc/12/25/59/226122559.db2.gz	XHRUDGNGMWGPDC-KBPBESRZSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)CN1CCO	ZINC000419336573	226122563	/nfs/dbraw/zinc/12/25/63/226122563.db2.gz	XHRUDGNGMWGPDC-KBPBESRZSA-N	1	1	307.394	1.524	20	5		DDBDMO
O=[N+]([O-])c1ncn(Cc2ccc(C[NH+]3CCOCC3)cc2)n1	ZINC000421841236	226793224	/nfs/dbraw/zinc/79/32/24/226793224.db2.gz	IKGSNSWZGDNKQF-UHFFFAOYSA-N	1	1	303.322	1.067	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@H+](CCO)[C@H](C)C1	ZINC000188303926	222010658	/nfs/dbraw/zinc/01/06/58/222010658.db2.gz	MWWAEHBMXCZTDL-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[N@@H+](CCO)[C@H](C)C1	ZINC000188303926	222010661	/nfs/dbraw/zinc/01/06/61/222010661.db2.gz	MWWAEHBMXCZTDL-GFCCVEGCSA-N	1	1	322.365	1.434	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1[C@H]1CCCO1	ZINC000367724744	418627355	/nfs/dbraw/zinc/62/73/55/418627355.db2.gz	HFQBKASWMWDLAD-BFHYXJOUSA-N	1	1	324.381	1.042	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000361362293	418635211	/nfs/dbraw/zinc/63/52/11/418635211.db2.gz	QYLQBQOUNRRICZ-CYBMUJFWSA-N	1	1	305.334	1.205	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C1	ZINC000361362293	418635214	/nfs/dbraw/zinc/63/52/14/418635214.db2.gz	QYLQBQOUNRRICZ-CYBMUJFWSA-N	1	1	305.334	1.205	20	5		DDBDMO
CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC000361364976	418636094	/nfs/dbraw/zinc/63/60/94/418636094.db2.gz	CSLDUOQXZSMXOY-QWHCGFSZSA-N	1	1	324.381	1.080	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCOC1	ZINC000361579496	418683941	/nfs/dbraw/zinc/68/39/41/418683941.db2.gz	WFJRXQIQUXCZLL-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@H]1CCOC1	ZINC000361579496	418683942	/nfs/dbraw/zinc/68/39/42/418683942.db2.gz	WFJRXQIQUXCZLL-LBPRGKRZSA-N	1	1	323.349	1.653	20	5		DDBDMO
CCOc1cc(C[N@@H+](CCO)[C@H]2CCO[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000361584684	418686323	/nfs/dbraw/zinc/68/63/23/418686323.db2.gz	FXXXBGZECLMMND-OCCSQVGLSA-N	1	1	324.377	1.965	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H](C)C[C@@H](CO)C1	ZINC000420933229	419365406	/nfs/dbraw/zinc/36/54/06/419365406.db2.gz	FYGHRIPISSZYKS-FRRDWIJNSA-N	1	1	321.377	1.872	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](CC)O1	ZINC000420945689	419378564	/nfs/dbraw/zinc/37/85/64/419378564.db2.gz	BFVXQEIQXYDMNX-OKILXGFUSA-N	1	1	309.366	1.646	20	5		DDBDMO
CC[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)C[C@H](CC)O1	ZINC000420945689	419378569	/nfs/dbraw/zinc/37/85/69/419378569.db2.gz	BFVXQEIQXYDMNX-OKILXGFUSA-N	1	1	309.366	1.646	20	5		DDBDMO
C[C@@H]1[C@H](CO)CCC[N@H+]1C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000412079787	419633679	/nfs/dbraw/zinc/63/36/79/419633679.db2.gz	NATDXKPYNVKAED-VNHYZAJKSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H]1[C@@H](CO)CCC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000412079909	419634716	/nfs/dbraw/zinc/63/47/16/419634716.db2.gz	LKJRHFUZRYJXID-GXFFZTMASA-N	1	1	307.350	1.287	20	5		DDBDMO
CNC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000412054417	419599552	/nfs/dbraw/zinc/59/95/52/419599552.db2.gz	LUJBKMJRDAMHRX-UHFFFAOYSA-N	1	1	322.365	1.497	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+]1C)C(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000421701038	419689175	/nfs/dbraw/zinc/68/91/75/419689175.db2.gz	GRSJOKXTLBVZDW-LLVKDONJSA-N	1	1	309.370	1.079	20	5		DDBDMO
O=C(CCOc1ccccc1[N+](=O)[O-])N1CC[NH+](C2CC2)CC1	ZINC000299354500	229069669	/nfs/dbraw/zinc/06/96/69/229069669.db2.gz	NMWDSEGTQRPSBA-UHFFFAOYSA-N	1	1	319.361	1.670	20	5		DDBDMO
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCC(F)(F)C[NH3+]	ZINC000423325567	420014431	/nfs/dbraw/zinc/01/44/31/420014431.db2.gz	LQGXIDWWZOCRAN-VIFPVBQESA-N	1	1	316.308	1.496	20	5		DDBDMO
CC(=O)c1cc(N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000418991940	420040190	/nfs/dbraw/zinc/04/01/90/420040190.db2.gz	FFMVPCCEODGBFM-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1cc(N2C[C@H](C)[N@H+](CCO)C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000418991940	420040192	/nfs/dbraw/zinc/04/01/92/420040192.db2.gz	FFMVPCCEODGBFM-NWDGAFQWSA-N	1	1	321.377	1.689	20	5		DDBDMO
Cc1c(NC(=O)CCN2CCC([NH3+])CC2)cccc1[N+](=O)[O-]	ZINC000430603563	420155639	/nfs/dbraw/zinc/15/56/39/420155639.db2.gz	NZHWVGUHCQFLOO-UHFFFAOYSA-N	1	1	306.366	1.655	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CN1	ZINC000434754425	420260836	/nfs/dbraw/zinc/26/08/36/420260836.db2.gz	GCJZOSAXWFUMPN-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])C2)CN1	ZINC000434754425	420260840	/nfs/dbraw/zinc/26/08/40/420260840.db2.gz	GCJZOSAXWFUMPN-CQSZACIVSA-N	1	1	309.753	1.960	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1c1ccncc1	ZINC000423970377	420286734	/nfs/dbraw/zinc/28/67/34/420286734.db2.gz	MPODFTZMXSAGAE-GFCCVEGCSA-N	1	1	318.358	1.838	20	5		DDBDMO
Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+](C)C2)cc1[N+](=O)[O-]	ZINC000416498436	420394815	/nfs/dbraw/zinc/39/48/15/420394815.db2.gz	XHHJLIYHAAYOQX-LLVKDONJSA-N	1	1	313.379	1.133	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NCC[N@@H+]1C[C@H]2CC[C@@H](C1)O2	ZINC000450785967	420530729	/nfs/dbraw/zinc/53/07/29/420530729.db2.gz	BZTJTUJPCCTTQK-PHIMTYICSA-N	1	1	312.757	1.918	20	5		DDBDMO
CNC(=O)c1ccc(N(C)[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])c1	ZINC000450947099	420567122	/nfs/dbraw/zinc/56/71/22/420567122.db2.gz	BALUAASOQXGORI-ZDUSSCGKSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000492988044	420728872	/nfs/dbraw/zinc/72/88/72/420728872.db2.gz	NPYRFTZVECOGRS-YBJDMEARSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000492988044	420728875	/nfs/dbraw/zinc/72/88/75/420728875.db2.gz	NPYRFTZVECOGRS-YBJDMEARSA-N	1	1	319.361	1.133	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H]3CCC[N@H+]3C[C@H]2C)ccc1[N+](=O)[O-]	ZINC000455657473	421050281	/nfs/dbraw/zinc/05/02/81/421050281.db2.gz	MFEZJUZEXLUVAZ-MNOVXSKESA-N	1	1	319.365	1.340	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2C[C@H](O)C[C@H]2[C@@H]2CCCOC2)cc1	ZINC000449430235	421010331	/nfs/dbraw/zinc/01/03/31/421010331.db2.gz	BVOPQTGUJLKBIW-BMFZPTHFSA-N	1	1	306.362	1.957	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC(=O)N(CC)C1	ZINC000449518213	421019356	/nfs/dbraw/zinc/01/93/56/421019356.db2.gz	NDFXXICYJBYOEQ-LBPRGKRZSA-N	1	1	307.350	1.704	20	5		DDBDMO
[NH3+]CC[C@@H](NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C(F)F	ZINC000449612552	421038639	/nfs/dbraw/zinc/03/86/39/421038639.db2.gz	MXCUSGYKMXGTCJ-SECBINFHSA-N	1	1	313.264	1.183	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc([N+](=O)[O-])c(NC)n2)C[C@@H]1C	ZINC000456006773	421088102	/nfs/dbraw/zinc/08/81/02/421088102.db2.gz	CCMFUHDDPZHRBU-WDEREUQCSA-N	1	1	321.381	1.586	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450291519	421177894	/nfs/dbraw/zinc/17/78/94/421177894.db2.gz	SQTJPOGJCSHKHB-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1	ZINC000450291519	421177895	/nfs/dbraw/zinc/17/78/95/421177895.db2.gz	SQTJPOGJCSHKHB-NSHDSACASA-N	1	1	302.334	1.886	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000546809471	421311684	/nfs/dbraw/zinc/31/16/84/421311684.db2.gz	QRSHPSPOOGWVDJ-MRXNPFEDSA-N	1	1	319.361	1.331	20	5		DDBDMO
CNc1ccc(C(=O)NCC[N@H+]2CC[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000524720577	421268045	/nfs/dbraw/zinc/26/80/45/421268045.db2.gz	YRCCZXZAQNUHRW-LLVKDONJSA-N	1	1	306.366	1.708	20	5		DDBDMO
CC[N@@H+]1C[C@@H](C)N(C(=O)c2c([N+](=O)[O-])c(C)nn2C)[C@@H](C)C1	ZINC000561810878	421335888	/nfs/dbraw/zinc/33/58/88/421335888.db2.gz	MXYJRYNLZLEFMR-AOOOYVTPSA-N	1	1	309.370	1.191	20	5		DDBDMO
COc1ccc(CC(=O)N(C)CC[N@@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000548113393	421402135	/nfs/dbraw/zinc/40/21/35/421402135.db2.gz	RTXYYHWVFOXTCD-UHFFFAOYSA-N	1	1	321.377	1.699	20	5		DDBDMO
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[NH2+]C[C@@H]1C(F)F	ZINC000562979039	421434559	/nfs/dbraw/zinc/43/45/59/421434559.db2.gz	BHFOEECAPOTELQ-SNVBAGLBSA-N	1	1	303.240	1.413	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](CC(C)(C)O)C[C@@H]2C)n1	ZINC000548036722	421391698	/nfs/dbraw/zinc/39/16/98/421391698.db2.gz	ASZNBFDRFLEBTO-ZDUSSCGKSA-N	1	1	322.409	1.888	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3CC[N@@H+](C)[C@@H]3C2)c1	ZINC000515294554	421490025	/nfs/dbraw/zinc/49/00/25/421490025.db2.gz	ZUWMWKRPIPYEPY-XHDPSFHLSA-N	1	1	319.361	1.770	20	5		DDBDMO
COc1cc(C[N@H+](C)CCN2CCCC2=O)ccc1[N+](=O)[O-]	ZINC000540910944	421775193	/nfs/dbraw/zinc/77/51/93/421775193.db2.gz	MYXUMZZOUYWICB-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
COc1cc(C[N@@H+](C)CCN2CCCC2=O)ccc1[N+](=O)[O-]	ZINC000540910944	421775195	/nfs/dbraw/zinc/77/51/95/421775195.db2.gz	MYXUMZZOUYWICB-UHFFFAOYSA-N	1	1	307.350	1.658	20	5		DDBDMO
Nc1ccc(NCC[N@H+]2CCc3ccccc3C2)nc1[N+](=O)[O-]	ZINC000596072665	422362196	/nfs/dbraw/zinc/36/21/96/422362196.db2.gz	FCZYUKFQSZDZTG-UHFFFAOYSA-N	1	1	313.361	2.042	20	5		DDBDMO
Cc1cc(CO)cc(NCCNc2ccccc2[N+](=O)[O-])[nH+]1	ZINC000590571084	422319810	/nfs/dbraw/zinc/31/98/10/422319810.db2.gz	BYXMYNPZJVHSIA-UHFFFAOYSA-N	1	1	302.334	2.315	20	5		DDBDMO
CCC[N@@H+](CC)CCNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000182270110	263374781	/nfs/dbraw/zinc/37/47/81/263374781.db2.gz	VZUUEXWXTFRBSW-UHFFFAOYSA-N	1	1	323.349	1.785	20	5		DDBDMO
CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000344775514	272115850	/nfs/dbraw/zinc/11/58/50/272115850.db2.gz	WCBOLPLRMWPMSC-UHFFFAOYSA-N	1	1	323.397	1.021	20	5		DDBDMO
CN(CCN(C)C1CC[NH+](C)CC1)C(=O)c1cc([N+](=O)[O-])c[nH]1	ZINC000344775514	272115852	/nfs/dbraw/zinc/11/58/52/272115852.db2.gz	WCBOLPLRMWPMSC-UHFFFAOYSA-N	1	1	323.397	1.021	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000345647873	272295168	/nfs/dbraw/zinc/29/51/68/272295168.db2.gz	OJWPROFQYULHDG-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC[N@H+](C(C)C)CC2)c1[N+](=O)[O-]	ZINC000345647873	272295169	/nfs/dbraw/zinc/29/51/69/272295169.db2.gz	OJWPROFQYULHDG-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCOC(=O)CC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000121018583	273688721	/nfs/dbraw/zinc/68/87/21/273688721.db2.gz	SJBLZSIEMXWVTR-UHFFFAOYSA-N	1	1	307.350	1.670	20	5		DDBDMO
COCC[N@@H+]1CCCN(c2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC000267484158	274027273	/nfs/dbraw/zinc/02/72/73/274027273.db2.gz	AGQNLBIOUBBXJS-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
COCC[N@H+]1CCCN(c2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC000267484158	274027274	/nfs/dbraw/zinc/02/72/74/274027274.db2.gz	AGQNLBIOUBBXJS-UHFFFAOYSA-N	1	1	314.773	1.802	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC1	ZINC000154941680	274292831	/nfs/dbraw/zinc/29/28/31/274292831.db2.gz	RLCPDYHMTWFYJD-SNVBAGLBSA-N	1	1	306.370	1.420	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)[C@H]1C(C)C	ZINC000429397015	277129634	/nfs/dbraw/zinc/12/96/34/277129634.db2.gz	YEDGIPODVJJHKW-JQWIXIFHSA-N	1	1	310.354	1.348	20	5		DDBDMO
COc1cccc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000195442326	278007869	/nfs/dbraw/zinc/00/78/69/278007869.db2.gz	PDISVDSMHZSCCF-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)[N@@H+](C)C1CC1	ZINC000057716081	278281540	/nfs/dbraw/zinc/28/15/40/278281540.db2.gz	DJPKKWJZXHLVKP-NSHDSACASA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1cc(C(=O)N2CCC[N@H+](C3CC3)CC2)c(N)c([N+](=O)[O-])c1	ZINC000171474128	280324680	/nfs/dbraw/zinc/32/46/80/280324680.db2.gz	LJPIOQZRGSGHKJ-UHFFFAOYSA-N	1	1	318.377	1.796	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000299216639	281262080	/nfs/dbraw/zinc/26/20/80/281262080.db2.gz	HYJXEZFTUZMZGX-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CCC[N@@H+]1C	ZINC000299216639	281262082	/nfs/dbraw/zinc/26/20/82/281262082.db2.gz	HYJXEZFTUZMZGX-NSHDSACASA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1nn(C)cc1[C@H]1CCC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000362281199	300043506	/nfs/dbraw/zinc/04/35/06/300043506.db2.gz	KMGCMIZVYDUIQR-CQSZACIVSA-N	1	1	304.354	1.670	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000363324525	300252006	/nfs/dbraw/zinc/25/20/06/300252006.db2.gz	PQZHIGBGNIIQGF-ZIAGYGMSSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1ccc([N+](=O)[O-])s1	ZINC000363692487	300296967	/nfs/dbraw/zinc/29/69/67/300296967.db2.gz	MRNJLXFDICYABA-ZJUUUORDSA-N	1	1	311.363	1.249	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000364173985	300353500	/nfs/dbraw/zinc/35/35/00/300353500.db2.gz	KKHOUPHJNCJFPF-YJNKXOJESA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@H+](C)[C@H]1c1cccnc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000364173985	300353502	/nfs/dbraw/zinc/35/35/02/300353502.db2.gz	KKHOUPHJNCJFPF-YJNKXOJESA-N	1	1	318.377	1.198	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)[C@H]1c1cccnc1)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000364173985	300353505	/nfs/dbraw/zinc/35/35/05/300353505.db2.gz	KKHOUPHJNCJFPF-YJNKXOJESA-N	1	1	318.377	1.198	20	5		DDBDMO
O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CC[NH2+]C[C@@H]1C(F)F	ZINC000367995015	300929729	/nfs/dbraw/zinc/92/97/29/300929729.db2.gz	XGEZXLKBVLNCAB-SNVBAGLBSA-N	1	1	319.695	1.927	20	5		DDBDMO
O=C(NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2[nH+]ccn21	ZINC000368012831	300932921	/nfs/dbraw/zinc/93/29/21/300932921.db2.gz	XZEUSHFYXNFJIZ-ZDUSSCGKSA-N	1	1	300.318	1.985	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCOCC2(CCC2)C1	ZINC000368707938	301078894	/nfs/dbraw/zinc/07/88/94/301078894.db2.gz	QLRWHZVUBVZDDJ-UHFFFAOYSA-N	1	1	307.350	1.259	20	5		DDBDMO
C[C@H](CN1CCOCC1)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369019287	301119855	/nfs/dbraw/zinc/11/98/55/301119855.db2.gz	XLGWVRMUWQDWJT-KGLIPLIRSA-N	1	1	323.397	1.149	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@H]3OCC[C@H]32)c1	ZINC000369788479	301225368	/nfs/dbraw/zinc/22/53/68/301225368.db2.gz	SKCUFFRRNVNHBM-FVQBIDKESA-N	1	1	322.361	1.588	20	5		DDBDMO
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1c[nH+]c2n1CCCC2	ZINC000375595912	301961124	/nfs/dbraw/zinc/96/11/24/301961124.db2.gz	FNZSXIZWPNLEEM-UHFFFAOYSA-N	1	1	314.345	1.987	20	5		DDBDMO
CCc1nn(C)c(N2CCC[N@@H+](CCOC)CC2)c1[N+](=O)[O-]	ZINC000377172517	302151387	/nfs/dbraw/zinc/15/13/87/302151387.db2.gz	VAAVIJMWMHLDIL-UHFFFAOYSA-N	1	1	311.386	1.049	20	5		DDBDMO
O=C1NC[C@H]2C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]12	ZINC000377715113	302217967	/nfs/dbraw/zinc/21/79/67/302217967.db2.gz	CTYOYUXHKQJIHC-GXSJLCMTSA-N	1	1	316.317	1.304	20	5		DDBDMO
O=C1NC[C@H]2C[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC[C@@H]12	ZINC000377715113	302217970	/nfs/dbraw/zinc/21/79/70/302217970.db2.gz	CTYOYUXHKQJIHC-GXSJLCMTSA-N	1	1	316.317	1.304	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@@H](Oc3ccccc3)C2)n1	ZINC000377967923	302258929	/nfs/dbraw/zinc/25/89/29/302258929.db2.gz	SFUOPOIIBMYPHT-CQSZACIVSA-N	1	1	302.334	1.945	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000378546582	302333480	/nfs/dbraw/zinc/33/34/80/302333480.db2.gz	WQCBQZTZKHDLHZ-WDEREUQCSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCC[C@H](C)C1	ZINC000532134266	303276362	/nfs/dbraw/zinc/27/63/62/303276362.db2.gz	VLVVJCLGMXDMNM-RYUDHWBXSA-N	1	1	306.366	1.840	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2ccc([N+](=O)[O-])cn2)[nH+]1	ZINC000532143377	303277341	/nfs/dbraw/zinc/27/73/41/303277341.db2.gz	ALOCNVXSAAUDFT-UHFFFAOYSA-N	1	1	301.306	1.535	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21	ZINC000536033725	303354006	/nfs/dbraw/zinc/35/40/06/303354006.db2.gz	AMOXTZPMIOVJPC-CQSZACIVSA-N	1	1	314.345	1.850	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21	ZINC000536033725	303354008	/nfs/dbraw/zinc/35/40/08/303354008.db2.gz	AMOXTZPMIOVJPC-CQSZACIVSA-N	1	1	314.345	1.850	20	5		DDBDMO
C[C@H](CC[NH+]1CCOCC1)NC(=O)c1ccc([N+](=O)[O-])s1	ZINC000358035899	306926929	/nfs/dbraw/zinc/92/69/29/306926929.db2.gz	BQXZGGXNOFAFOU-SNVBAGLBSA-N	1	1	313.379	1.497	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@]1(O)CC[N@H+](C)C1	ZINC000361854982	307009144	/nfs/dbraw/zinc/00/91/44/307009144.db2.gz	MWMIWJBCSQSZPP-HNNXBMFYSA-N	1	1	322.365	1.400	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000364072938	307041098	/nfs/dbraw/zinc/04/10/98/307041098.db2.gz	PZXJKQFVHVAEJY-GJZGRUSLSA-N	1	1	319.361	1.266	20	5		DDBDMO
Cc1ccc(CN2CCC[N@H+]([C@@H](C)CO)CC2)cc1[N+](=O)[O-]	ZINC000364973907	307055580	/nfs/dbraw/zinc/05/55/80/307055580.db2.gz	NNDRYDBWCUCALX-AWEZNQCLSA-N	1	1	307.394	1.792	20	5		DDBDMO
Cc1ncccc1O[C@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1	ZINC000365274994	307063364	/nfs/dbraw/zinc/06/33/64/307063364.db2.gz	NMFBHCGXFVJEDS-ZDUSSCGKSA-N	1	1	317.349	1.648	20	5		DDBDMO
C[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000366584301	307076779	/nfs/dbraw/zinc/07/67/79/307076779.db2.gz	FIBVPLVQBQOHHL-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
C[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@]2(CCCOC2)O1	ZINC000366584301	307076780	/nfs/dbraw/zinc/07/67/80/307076780.db2.gz	FIBVPLVQBQOHHL-GXTWGEPZSA-N	1	1	310.354	1.061	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CC[C@H](Cc3ccncc3)C2)n1	ZINC000368632507	307106649	/nfs/dbraw/zinc/10/66/49/307106649.db2.gz	NHEJXEFCZAXYGV-CQSZACIVSA-N	1	1	301.350	1.751	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCN2CCOC[C@@H]2C1	ZINC000371834246	307158539	/nfs/dbraw/zinc/15/85/39/307158539.db2.gz	IFIRIDZIFBDQML-ZFWWWQNUSA-N	1	1	305.378	1.981	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCN2CCOC[C@@H]2C1	ZINC000371834246	307158540	/nfs/dbraw/zinc/15/85/40/307158540.db2.gz	IFIRIDZIFBDQML-ZFWWWQNUSA-N	1	1	305.378	1.981	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@@H](C)[N@@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330449	307168060	/nfs/dbraw/zinc/16/80/60/307168060.db2.gz	KZWUTCHFJKLOHJ-XQQFMLRXSA-N	1	1	323.397	1.731	20	5		DDBDMO
CC[C@H](C)NC(=O)[C@@H](C)[N@H+]1CCC[C@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000372330449	307168061	/nfs/dbraw/zinc/16/80/61/307168061.db2.gz	KZWUTCHFJKLOHJ-XQQFMLRXSA-N	1	1	323.397	1.731	20	5		DDBDMO
Cc1nccc(C[N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000373642622	307193680	/nfs/dbraw/zinc/19/36/80/307193680.db2.gz	VFJCHBJHZRLSRF-CYBMUJFWSA-N	1	1	302.338	1.727	20	5		DDBDMO
Cc1nccc(C[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)n1	ZINC000373642622	307193681	/nfs/dbraw/zinc/19/36/81/307193681.db2.gz	VFJCHBJHZRLSRF-CYBMUJFWSA-N	1	1	302.338	1.727	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CCC[N@H+]([C@H](C)CO)CC1	ZINC000373973118	307198811	/nfs/dbraw/zinc/19/88/11/307198811.db2.gz	BBAQTIDEPAXKDX-CYBMUJFWSA-N	1	1	323.393	1.492	20	5		DDBDMO
CN(C)CC[N@@H+]1CCCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000376217618	307240651	/nfs/dbraw/zinc/24/06/51/307240651.db2.gz	FNOBUIJDAOAVPZ-UHFFFAOYSA-N	1	1	307.398	1.251	20	5		DDBDMO
CN(C)CC[N@H+]1CCCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000376217618	307240652	/nfs/dbraw/zinc/24/06/52/307240652.db2.gz	FNOBUIJDAOAVPZ-UHFFFAOYSA-N	1	1	307.398	1.251	20	5		DDBDMO
Cc1nc(N[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)ccc1[N+](=O)[O-]	ZINC000376666743	307252548	/nfs/dbraw/zinc/25/25/48/307252548.db2.gz	VKKXJNTYBVKYAW-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
Cc1nc(N[C@@H]2CCN(C3CC[NH+](C)CC3)C2)ccc1[N+](=O)[O-]	ZINC000376666743	307252549	/nfs/dbraw/zinc/25/25/49/307252549.db2.gz	VKKXJNTYBVKYAW-CYBMUJFWSA-N	1	1	319.409	1.879	20	5		DDBDMO
O=C1OCCN1C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000496535591	307349021	/nfs/dbraw/zinc/34/90/21/307349021.db2.gz	RQGCYNCKCDOOLW-ZDUSSCGKSA-N	1	1	305.334	1.869	20	5		DDBDMO
C[N@H+]1CC[C@@H](C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000577208708	308370878	/nfs/dbraw/zinc/37/08/78/308370878.db2.gz	PVPDGVUXAAXPLY-CYBMUJFWSA-N	1	1	318.377	1.195	20	5		DDBDMO
C[C@@H]1[C@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000488728932	484215490	/nfs/dbraw/zinc/21/54/90/484215490.db2.gz	IVLIYSNHWQLVRT-DYEKYZERSA-N	1	1	310.350	1.037	20	5		DDBDMO
C[N@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CC1(C)C	ZINC000489475498	484224333	/nfs/dbraw/zinc/22/43/33/484224333.db2.gz	GYHGTQNGURTGMZ-CYBMUJFWSA-N	1	1	321.333	1.992	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2)[C@@H]1CC1(C)C	ZINC000489475498	484224336	/nfs/dbraw/zinc/22/43/36/484224336.db2.gz	GYHGTQNGURTGMZ-CYBMUJFWSA-N	1	1	321.333	1.992	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)c2nccc(C(N)=O)c2[N+](=O)[O-])C[C@@H]1C	ZINC000357540311	484509751	/nfs/dbraw/zinc/50/97/51/484509751.db2.gz	XBOUCIATZSDQAZ-WDEREUQCSA-N	1	1	321.381	1.398	20	5		DDBDMO
C[C@@H]1C[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595875513	490372194	/nfs/dbraw/zinc/37/21/94/490372194.db2.gz	QIPYMBLZMCVMNE-IAQYHMDHSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C[C@]1(C)CO	ZINC000595875513	490372200	/nfs/dbraw/zinc/37/22/00/490372200.db2.gz	QIPYMBLZMCVMNE-IAQYHMDHSA-N	1	1	307.350	1.484	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCSC[C@@H]1C1CCC1	ZINC000419376548	534321539	/nfs/dbraw/zinc/32/15/39/534321539.db2.gz	SDKSMQDYNPGRER-CQSZACIVSA-N	1	1	323.418	1.974	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNc1ncc([N+](=O)[O-])cc1-c1nn[nH]n1	ZINC000735857767	598498912	/nfs/dbraw/zinc/49/89/12/598498912.db2.gz	YRIHOOPCSZFUAZ-UHFFFAOYSA-N	1	1	320.357	1.312	20	5		DDBDMO
COCCCOCC[N@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000091026152	696584345	/nfs/dbraw/zinc/58/43/45/696584345.db2.gz	HYFJSEZRDWFDPC-UHFFFAOYSA-N	1	1	322.365	1.887	20	5		DDBDMO
COCCCOCC[N@@H+](C)Cn1ncc2ccc([N+](=O)[O-])cc21	ZINC000091026152	696584348	/nfs/dbraw/zinc/58/43/48/696584348.db2.gz	HYFJSEZRDWFDPC-UHFFFAOYSA-N	1	1	322.365	1.887	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000108459083	696633951	/nfs/dbraw/zinc/63/39/51/696633951.db2.gz	ARVIPMGGDRHOCR-GFCCVEGCSA-N	1	1	318.377	1.700	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776578189	698120158	/nfs/dbraw/zinc/12/01/58/698120158.db2.gz	CGSMCFHUWYNXKD-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
CN(C)C(=O)[C@@H]1CCC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776578189	698120160	/nfs/dbraw/zinc/12/01/60/698120160.db2.gz	CGSMCFHUWYNXKD-UONOGXRCSA-N	1	1	307.350	1.181	20	5		DDBDMO
COC(=O)[C@H](C)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000246354025	698348230	/nfs/dbraw/zinc/34/82/30/698348230.db2.gz	WOEMMHMHEKODFY-IAQYHMDHSA-N	1	1	322.361	1.902	20	5		DDBDMO
CCC[N@H+](CCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000778968384	698388099	/nfs/dbraw/zinc/38/80/99/698388099.db2.gz	ZUGMZSVDWNJMDJ-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000778968384	698388102	/nfs/dbraw/zinc/38/81/02/698388102.db2.gz	ZUGMZSVDWNJMDJ-UHFFFAOYSA-N	1	1	315.757	1.891	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc([N+](=O)[O-])cc3)C[C@@H]2C1	ZINC000793923440	699787009	/nfs/dbraw/zinc/78/70/09/699787009.db2.gz	AUYBMSOIVQJJJF-KGLIPLIRSA-N	1	1	303.362	1.547	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H]2C1	ZINC000794927329	699836342	/nfs/dbraw/zinc/83/63/42/699836342.db2.gz	FLOBUBRMYNCKKV-RISCZKNCSA-N	1	1	306.322	1.639	20	5		DDBDMO
C[C@@H]1OCC[C@H]1[N@@H+](CCO)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000796575368	699939820	/nfs/dbraw/zinc/93/98/20/699939820.db2.gz	OILNKEAFOLEXGZ-GLQYFDAESA-N	1	1	310.350	1.100	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)n1	ZINC000765461398	701013886	/nfs/dbraw/zinc/01/38/86/701013886.db2.gz	ABMLHTWCGHEQGL-AWEZNQCLSA-N	1	1	320.393	1.989	20	5		DDBDMO
Nc1ccc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC000804327379	701178523	/nfs/dbraw/zinc/17/85/23/701178523.db2.gz	OTCCJWOPFZVOSL-ZDUSSCGKSA-N	1	1	306.366	1.478	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000804381101	701184300	/nfs/dbraw/zinc/18/43/00/701184300.db2.gz	KDKFQEMZKZUGIB-JTQLQIEISA-N	1	1	322.321	1.669	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)C1	ZINC000804381101	701184303	/nfs/dbraw/zinc/18/43/03/701184303.db2.gz	KDKFQEMZKZUGIB-JTQLQIEISA-N	1	1	322.321	1.669	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@@H](C)C[N@@H+]1C	ZINC000769145155	701234247	/nfs/dbraw/zinc/23/42/47/701234247.db2.gz	MHXOFCYHURQUEJ-NEPJUHHUSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)[C@@H](C)C[N@H+]1C	ZINC000769145155	701234249	/nfs/dbraw/zinc/23/42/49/701234249.db2.gz	MHXOFCYHURQUEJ-NEPJUHHUSA-N	1	1	320.393	1.825	20	5		DDBDMO
O=[N+]([O-])c1c(N2CC[NH+]([C@H]3CCOC3)CC2)nc2ccccn21	ZINC000770436956	701277906	/nfs/dbraw/zinc/27/79/06/701277906.db2.gz	MTHADIMMKIXOEQ-LBPRGKRZSA-N	1	1	317.349	1.153	20	5		DDBDMO
C[NH+](C)[C@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000839695311	701787659	/nfs/dbraw/zinc/78/76/59/701787659.db2.gz	DYCGMZKILHPMCF-JHJVBQTASA-N	1	1	311.769	1.724	20	5		DDBDMO
CC[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000839726120	701799068	/nfs/dbraw/zinc/79/90/68/701799068.db2.gz	MQUNQWXRHKLCGR-ARFHVFGLSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@]1(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000839730271	701801019	/nfs/dbraw/zinc/80/10/19/701801019.db2.gz	DTVBFYPHPNCEIB-INMHGKMJSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1	ZINC000839730271	701801031	/nfs/dbraw/zinc/80/10/31/701801031.db2.gz	DTVBFYPHPNCEIB-INMHGKMJSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000839730271	701801040	/nfs/dbraw/zinc/80/10/40/701801040.db2.gz	DTVBFYPHPNCEIB-INMHGKMJSA-N	1	1	317.389	1.823	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](C)Cn1cc[nH+]c1C	ZINC000810616325	701802167	/nfs/dbraw/zinc/80/21/67/701802167.db2.gz	VESZIRSBWWNOGO-SNVBAGLBSA-N	1	1	321.337	1.627	20	5		DDBDMO
CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)[C@@H]1CCSC1	ZINC000867970199	701862598	/nfs/dbraw/zinc/86/25/98/701862598.db2.gz	XLXMFFWTIXRHSW-OCCSQVGLSA-N	1	1	309.391	1.733	20	5		DDBDMO
C[C@H]1CC[N@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982284	701890849	/nfs/dbraw/zinc/89/08/49/701890849.db2.gz	CDAARUKHQXQVKT-XHDPSFHLSA-N	1	1	305.334	1.831	20	5		DDBDMO
C[C@H]1CC[N@@H+](CN2C(=O)C[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000839982284	701890856	/nfs/dbraw/zinc/89/08/56/701890856.db2.gz	CDAARUKHQXQVKT-XHDPSFHLSA-N	1	1	305.334	1.831	20	5		DDBDMO
CC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H]1CCOC1	ZINC000812298282	702141970	/nfs/dbraw/zinc/14/19/70/702141970.db2.gz	LAWJCPUSNHPYFG-CYBMUJFWSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H]1CCOC1	ZINC000812298282	702141971	/nfs/dbraw/zinc/14/19/71/702141971.db2.gz	LAWJCPUSNHPYFG-CYBMUJFWSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCC(N3CC[NH+](C)CC3)CC2)n1	ZINC000866211966	706650382	/nfs/dbraw/zinc/65/03/82/706650382.db2.gz	HGQVBYXNGXUPGS-UHFFFAOYSA-N	1	1	319.409	1.514	20	5		DDBDMO
CC[C@H]([NH3+])c1nc(CC(=O)NCc2ccc([N+](=O)[O-])cc2)no1	ZINC000843225381	702846106	/nfs/dbraw/zinc/84/61/06/702846106.db2.gz	YZVWWVDHCMASFX-NSHDSACASA-N	1	1	319.321	1.247	20	5		DDBDMO
C[C@@H]1[C@H](COC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)CC[N@H+]1C	ZINC000845816833	703206095	/nfs/dbraw/zinc/20/60/95/703206095.db2.gz	ZOMIHZLHOCTKFT-MNOVXSKESA-N	1	1	310.354	1.410	20	5		DDBDMO
O=C(NCC[N@@H+]1CC=CCC1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000831550076	706729776	/nfs/dbraw/zinc/72/97/76/706729776.db2.gz	JNXXETJKHKSAAY-AWEZNQCLSA-N	1	1	305.334	1.006	20	5		DDBDMO
CN1C[C@H]([N@@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000846921253	703352107	/nfs/dbraw/zinc/35/21/07/703352107.db2.gz	REWZLMBIIVVDEW-ZIAGYGMSSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCOC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000848786274	703588927	/nfs/dbraw/zinc/58/89/27/703588927.db2.gz	KGJBHKUCDWDKDL-JTQLQIEISA-N	1	1	308.338	1.603	20	5		DDBDMO
O=C1NCCO[C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000879717940	706768723	/nfs/dbraw/zinc/76/87/23/706768723.db2.gz	IPMYMPSAVXJLSN-GJZGRUSLSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C1NCCO[C@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000879717940	706768724	/nfs/dbraw/zinc/76/87/24/706768724.db2.gz	IPMYMPSAVXJLSN-GJZGRUSLSA-N	1	1	319.361	1.117	20	5		DDBDMO
CC(C)(O)C[N@H+]1CC[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000869786007	703853177	/nfs/dbraw/zinc/85/31/77/703853177.db2.gz	NJTMJSVWGAYDJO-ZDUSSCGKSA-N	1	1	321.377	1.099	20	5		DDBDMO
Cc1c(C(=O)N[C@H]2CC[N@@H+](CC(C)(C)O)C2)cccc1[N+](=O)[O-]	ZINC000869785787	703853345	/nfs/dbraw/zinc/85/33/45/703853345.db2.gz	FBASJYFUJPJZMA-LBPRGKRZSA-N	1	1	321.377	1.478	20	5		DDBDMO
CCc1nnc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819321438	704107475	/nfs/dbraw/zinc/10/74/75/704107475.db2.gz	HNOSRXBLOQJFRM-NSHDSACASA-N	1	1	308.363	1.832	20	5		DDBDMO
C[C@@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000870789517	704132476	/nfs/dbraw/zinc/13/24/76/704132476.db2.gz	HFZLOLUEBLJUSD-STQMWFEESA-N	1	1	324.381	1.988	20	5		DDBDMO
COc1cc(N2CC[N@@H+]3CCOC[C@H]3C2)c([N+](=O)[O-])cc1C	ZINC000853477816	704246226	/nfs/dbraw/zinc/24/62/26/704246226.db2.gz	ZQYBYVCPHOPBKW-GFCCVEGCSA-N	1	1	307.350	1.433	20	5		DDBDMO
COc1cc(N2CC[N@H+]3CCOC[C@H]3C2)c([N+](=O)[O-])cc1C	ZINC000853477816	704246230	/nfs/dbraw/zinc/24/62/30/704246230.db2.gz	ZQYBYVCPHOPBKW-GFCCVEGCSA-N	1	1	307.350	1.433	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CC[C@]2(C1)CCC[N@H+](C)C2	ZINC000820608431	704309911	/nfs/dbraw/zinc/30/99/11/704309911.db2.gz	IWWVOGYXLYSTMC-OAHLLOKOSA-N	1	1	321.381	1.044	20	5		DDBDMO
O=C1CC[C@H](C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)O1	ZINC000821341531	704393786	/nfs/dbraw/zinc/39/37/86/704393786.db2.gz	BAEOEGOYJCBLCE-CQSZACIVSA-N	1	1	305.334	1.422	20	5		DDBDMO
C[C@@H]1C[N@H+](CCNC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](C)CO1	ZINC000855408680	704483166	/nfs/dbraw/zinc/48/31/66/704483166.db2.gz	XLUVLXSAPZJMHP-NWDGAFQWSA-N	1	1	301.387	1.047	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCNC(=O)CCC(C)(C)[N+](=O)[O-])[C@@H](C)CO1	ZINC000855408680	704483167	/nfs/dbraw/zinc/48/31/67/704483167.db2.gz	XLUVLXSAPZJMHP-NWDGAFQWSA-N	1	1	301.387	1.047	20	5		DDBDMO
C[NH+]1CCN(CC2CN(c3cc(Cl)ccc3[N+](=O)[O-])C2)CC1	ZINC000858612204	704734592	/nfs/dbraw/zinc/73/45/92/704734592.db2.gz	ZQIJROPIZAYRBK-UHFFFAOYSA-N	1	1	324.812	1.932	20	5		DDBDMO
C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])[C@H](C)[NH+]1CCOCC1	ZINC000823130185	705148366	/nfs/dbraw/zinc/14/83/66/705148366.db2.gz	VRWYNQLYUVLKFJ-NEPJUHHUSA-N	1	1	301.387	1.047	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](CCCF)CC2)c(N)c([N+](=O)[O-])c1	ZINC000862112487	705655096	/nfs/dbraw/zinc/65/50/96/705655096.db2.gz	KKGLLOHDBVFXOV-UHFFFAOYSA-N	1	1	324.356	1.603	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3c(F)cccc3[N+](=O)[O-])CC[C@@H]21	ZINC000827216574	705952186	/nfs/dbraw/zinc/95/21/86/705952186.db2.gz	ASGRMCVTMMEIEB-JQWIXIFHSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)Cc3ccc(F)cc3[N+](=O)[O-])CC[C@H]21	ZINC000827231534	705956397	/nfs/dbraw/zinc/95/63/97/705956397.db2.gz	HIHXYACCLVHVAP-GXTWGEPZSA-N	1	1	321.352	1.829	20	5		DDBDMO
CC(=O)c1c([N+](=O)[O-])cccc1N1CC[NH+](CCCCO)CC1	ZINC000882013312	707465555	/nfs/dbraw/zinc/46/55/55/707465555.db2.gz	YUAGXWUXEKWZRN-UHFFFAOYSA-N	1	1	321.377	1.692	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000872781505	707597454	/nfs/dbraw/zinc/59/74/54/707597454.db2.gz	UQKWXPOCQJOZJA-MNOVXSKESA-N	1	1	302.338	1.310	20	5		DDBDMO
COCCNC(=O)C1([NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000873130246	707743280	/nfs/dbraw/zinc/74/32/80/707743280.db2.gz	BTYUXFSZTXYHHH-UHFFFAOYSA-N	1	1	307.350	1.288	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000838147247	707854433	/nfs/dbraw/zinc/85/44/33/707854433.db2.gz	BSRMIMDNLFRXCQ-SNVBAGLBSA-N	1	1	324.356	1.778	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000838285983	707888095	/nfs/dbraw/zinc/88/80/95/707888095.db2.gz	QHURDYUONOMYMW-CYBMUJFWSA-N	1	1	305.290	1.377	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000838285986	707888273	/nfs/dbraw/zinc/88/82/73/707888273.db2.gz	QHURDYUONOMYMW-ZDUSSCGKSA-N	1	1	305.290	1.377	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000883182712	707949940	/nfs/dbraw/zinc/94/99/40/707949940.db2.gz	JEFHYEAXZUUXRY-CQSZACIVSA-N	1	1	306.366	1.531	20	5		DDBDMO
Cc1c(NC(=O)C[C@@]2(O)CCC[N@H+](C)C2)cccc1[N+](=O)[O-]	ZINC000899936071	709242842	/nfs/dbraw/zinc/24/28/42/709242842.db2.gz	PHZBTSGRNWHWMH-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC1(C)CC[N@@H+](CCNC(=O)Cc2ccccc2[N+](=O)[O-])C1	ZINC000890081390	709739376	/nfs/dbraw/zinc/73/93/76/709739376.db2.gz	GKALULNQGHILLT-UHFFFAOYSA-N	1	1	305.378	1.985	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000902418424	710747783	/nfs/dbraw/zinc/74/77/83/710747783.db2.gz	LQZSZYHCRBKKEE-GFCCVEGCSA-N	1	1	318.333	1.787	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000902418424	710747786	/nfs/dbraw/zinc/74/77/86/710747786.db2.gz	LQZSZYHCRBKKEE-GFCCVEGCSA-N	1	1	318.333	1.787	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000928554898	713224341	/nfs/dbraw/zinc/22/43/41/713224341.db2.gz	LBUSIIWDRLMKAS-JTQLQIEISA-N	1	1	300.318	1.577	20	5		DDBDMO
CC[N@H+]1CCN(Cc2ccc(O)c(OC)c2[N+](=O)[O-])[C@@H](C)C1	ZINC000894406204	711106190	/nfs/dbraw/zinc/10/61/90/711106190.db2.gz	OFHAQVJXUYSNKC-NSHDSACASA-N	1	1	309.366	1.835	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H](C(=O)N(C)C)C2)c1[N+](=O)[O-]	ZINC000894907024	711314835	/nfs/dbraw/zinc/31/48/35/711314835.db2.gz	GHZWKKACLRSLDU-NSHDSACASA-N	1	1	323.349	1.219	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CCC[C@@H](CO)[C@@H]2C)c1[N+](=O)[O-]	ZINC000894940591	711330237	/nfs/dbraw/zinc/33/02/37/711330237.db2.gz	UHQNOCLNVBUOGF-JQWIXIFHSA-N	1	1	310.350	1.902	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c1[N+](=O)[O-]	ZINC000895386247	711500084	/nfs/dbraw/zinc/50/00/84/711500084.db2.gz	PIUCGUBEOSRVSC-ABAIWWIYSA-N	1	1	308.334	1.777	20	5		DDBDMO
COC(=O)[C@@]1(O)CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1	ZINC000895703736	711582796	/nfs/dbraw/zinc/58/27/96/711582796.db2.gz	ONLYQPWFAWEBAX-OQRGYWNNSA-N	1	1	320.345	1.608	20	5		DDBDMO
CCOC(=O)Cc1ccc(NC[C@@H]2CC[N@H+]2C)c([N+](=O)[O-])c1	ZINC000895769263	711601140	/nfs/dbraw/zinc/60/11/40/711601140.db2.gz	PPXNQJDCLKOESK-LBPRGKRZSA-N	1	1	307.350	1.816	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000896045049	711667967	/nfs/dbraw/zinc/66/79/67/711667967.db2.gz	CDMXGIQWFZDIPQ-WCQGTBRESA-N	1	1	308.334	1.512	20	5		DDBDMO
C[C@@H](NC(=O)c1ccc(F)cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000896554425	711750052	/nfs/dbraw/zinc/75/00/52/711750052.db2.gz	FLPQDDBXTWJUFP-QMTHXVAHSA-N	1	1	324.356	1.098	20	5		DDBDMO
C[NH+]1CCN(C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000929101331	713546518	/nfs/dbraw/zinc/54/65/18/713546518.db2.gz	XEIVQVXKAWEDRQ-UHFFFAOYSA-N	1	1	311.769	1.955	20	5		DDBDMO
O=[N+]([O-])c1cccc(N2CC[NH+](CCO[C@H]3CCOC3)CC2)c1	ZINC000929271408	713580129	/nfs/dbraw/zinc/58/01/29/713580129.db2.gz	XPSZIBGTVIWWMO-INIZCTEOSA-N	1	1	321.377	1.522	20	5		DDBDMO
O=[N+]([O-])CC[NH+]1CCC(c2nc(-c3ccccc3)n[nH]2)CC1	ZINC000929955037	713722761	/nfs/dbraw/zinc/72/27/61/713722761.db2.gz	JWQCRINNGWJHSS-UHFFFAOYSA-N	1	1	301.350	1.928	20	5		DDBDMO
COC(=O)[C@@]1(NCC[N+](=O)[O-])CCC[N@@H+](Cc2ccccc2)C1	ZINC000930151970	713768478	/nfs/dbraw/zinc/76/84/78/713768478.db2.gz	LCIZYEGFWABZKM-MRXNPFEDSA-N	1	1	321.377	1.061	20	5		DDBDMO
COc1cccc([C@@H]2[C@H](NCC[N+](=O)[O-])CC[N@@H+]2C2CC2)c1	ZINC000930353778	713812194	/nfs/dbraw/zinc/81/21/94/713812194.db2.gz	KGWLYTVHIBTOOE-HZPDHXFCSA-N	1	1	305.378	1.839	20	5		DDBDMO
COc1ccc(NC(=O)N2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000930770129	713915995	/nfs/dbraw/zinc/91/59/95/713915995.db2.gz	VUFUOCDWENYWIM-GXFFZTMASA-N	1	1	320.349	1.771	20	5		DDBDMO
Cn1[nH]c(=O)c2c1C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CC2	ZINC000931198701	714032658	/nfs/dbraw/zinc/03/26/58/714032658.db2.gz	XEWLSXVCNGMQJG-UHFFFAOYSA-N	1	1	318.333	1.471	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]2C1	ZINC000931434176	714097257	/nfs/dbraw/zinc/09/72/57/714097257.db2.gz	OPOVIDIITPFERJ-OCCSQVGLSA-N	1	1	318.377	1.077	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCOC(=O)[C@@H]1CCC[N@@H+]1C(C)C	ZINC000923889625	714485129	/nfs/dbraw/zinc/48/51/29/714485129.db2.gz	AKGGMBOXANOCDW-LBPRGKRZSA-N	1	1	310.354	1.516	20	5		DDBDMO
Cc1ccnc(N2CC[C@H]3[C@@H]2CC[N@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928549	721854352	/nfs/dbraw/zinc/85/43/52/721854352.db2.gz	OFDFHGNKIGDNSP-KBPBESRZSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1ccnc(N2CC[C@H]3[C@@H]2CC[N@@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928549	721854353	/nfs/dbraw/zinc/85/43/53/721854353.db2.gz	OFDFHGNKIGDNSP-KBPBESRZSA-N	1	1	319.409	1.513	20	5		DDBDMO
CC(C)(C)c1cnc(-n2cnc(C[NH3+])cc2=N)c([N+](=O)[O-])c1	ZINC001167351128	733271504	/nfs/dbraw/zinc/27/15/04/733271504.db2.gz	DPVDMTOJRQHSBC-UHFFFAOYSA-N	1	1	302.338	1.411	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCN(C)c1ccccc1[N+](=O)[O-]	ZINC001105415316	741191992	/nfs/dbraw/zinc/19/19/92/741191992.db2.gz	NSTPZNOKJYUQNV-UHFFFAOYSA-N	1	1	322.409	1.830	20	5		DDBDMO
O=C(NCC[NH2+]CCc1ccccc1Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001126939414	742881674	/nfs/dbraw/zinc/88/16/74/742881674.db2.gz	XIXLIPVDEAKJBM-DGCLKSJQSA-N	1	1	311.769	1.254	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134274	743705323	/nfs/dbraw/zinc/70/53/23/743705323.db2.gz	GUQDOYDNBAQSQB-DGCLKSJQSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000698134274	743705327	/nfs/dbraw/zinc/70/53/27/743705327.db2.gz	GUQDOYDNBAQSQB-DGCLKSJQSA-N	1	1	300.742	1.566	20	5		DDBDMO
CCCCOCC[N@H+]1CCCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001195768808	746692163	/nfs/dbraw/zinc/69/21/63/746692163.db2.gz	GGPGUGMKAPPGBA-ZIAGYGMSSA-N	1	1	313.398	1.003	20	5		DDBDMO
CCCCOCC[N@@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195768808	746692166	/nfs/dbraw/zinc/69/21/66/746692166.db2.gz	GGPGUGMKAPPGBA-ZIAGYGMSSA-N	1	1	313.398	1.003	20	5		DDBDMO
CCCCOCC[N@H+]1CCCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001195768808	746692168	/nfs/dbraw/zinc/69/21/68/746692168.db2.gz	GGPGUGMKAPPGBA-ZIAGYGMSSA-N	1	1	313.398	1.003	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2C(=O)OC[C@@H]2C1	ZINC001196675118	746932534	/nfs/dbraw/zinc/93/25/34/746932534.db2.gz	LCSMLUJYNVFPIH-KWBADKCTSA-N	1	1	319.317	1.027	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H]2C(=O)OC[C@@H]2C1	ZINC001196675118	746932538	/nfs/dbraw/zinc/93/25/38/746932538.db2.gz	LCSMLUJYNVFPIH-KWBADKCTSA-N	1	1	319.317	1.027	20	5		DDBDMO
CO[C@@H]1CC[NH2+][C@H](c2nc(-c3ncc(F)cc3[N+](=O)[O-])no2)C1	ZINC001212240501	747104772	/nfs/dbraw/zinc/10/47/72/747104772.db2.gz	ALHJPZUGDKGNLQ-BDAKNGLRSA-N	1	1	323.284	1.618	20	5		DDBDMO
CCOC(=O)C1([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)CCOCC1	ZINC001168960760	762155185	/nfs/dbraw/zinc/15/51/85/762155185.db2.gz	GYLJWYWSVPWPLJ-NEPJUHHUSA-N	1	1	300.355	1.134	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)C2)c1	ZINC001169053570	762208212	/nfs/dbraw/zinc/20/82/12/762208212.db2.gz	ITPPFICTYNWZHF-KCQAQPDRSA-N	1	1	321.377	1.989	20	5		DDBDMO
Cc1cnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)nc1	ZINC001169057626	762211216	/nfs/dbraw/zinc/21/12/16/762211216.db2.gz	WKJXUXIZWWHSSM-BFHYXJOUSA-N	1	1	306.366	1.684	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)N[C@H]1C[C@@H](Nc2ccccc2[N+](=O)[O-])C1	ZINC001097203763	756972904	/nfs/dbraw/zinc/97/29/04/756972904.db2.gz	VJPVHACUSTTZKR-BETUJISGSA-N	1	1	320.393	1.996	20	5		DDBDMO
CCN(c1ncnc2cc(OC)c([N+](=O)[O-])cc21)C1C[NH+](C)C1	ZINC001157456338	765238138	/nfs/dbraw/zinc/23/81/38/765238138.db2.gz	NZSYTEXSOSSZJU-UHFFFAOYSA-N	1	1	317.349	1.687	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)CCC(C)(C)C	ZINC001135532373	771561688	/nfs/dbraw/zinc/56/16/88/771561688.db2.gz	SPGNFZXTQSQLJU-UHFFFAOYSA-N	1	1	311.386	1.360	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCNc1ccc(F)cc1[N+](=O)[O-]	ZINC001093787999	775078311	/nfs/dbraw/zinc/07/83/11/775078311.db2.gz	RLVKDSOONAWESG-UHFFFAOYSA-N	1	1	312.345	1.604	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1ncc([N+](=O)[O-])cc1C	ZINC001093840022	775124323	/nfs/dbraw/zinc/12/43/23/775124323.db2.gz	ANRNZOJYCRRNLR-UHFFFAOYSA-N	1	1	309.370	1.168	20	5		DDBDMO
Cc1[nH+]ccn1CC(=O)NCCCNc1ccccc1[N+](=O)[O-]	ZINC001094434367	775858296	/nfs/dbraw/zinc/85/82/96/775858296.db2.gz	FNHUCZNKJFIVPG-UHFFFAOYSA-N	1	1	317.349	1.718	20	5		DDBDMO
O=C(C[N@@H+]1CC[C@]2(CCOC2=O)C1)Nc1ccccc1[N+](=O)[O-]	ZINC001177002704	778384971	/nfs/dbraw/zinc/38/49/71/778384971.db2.gz	NANAJQFFHDCPQP-HNNXBMFYSA-N	1	1	319.317	1.172	20	5		DDBDMO
O=C(C[N@H+]1CC[C@]2(CCOC2=O)C1)Nc1ccccc1[N+](=O)[O-]	ZINC001177002704	778384978	/nfs/dbraw/zinc/38/49/78/778384978.db2.gz	NANAJQFFHDCPQP-HNNXBMFYSA-N	1	1	319.317	1.172	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1)C1CCC1	ZINC001119592596	781529968	/nfs/dbraw/zinc/52/99/68/781529968.db2.gz	IDESZZZSYURMAU-UHFFFAOYSA-N	1	1	303.362	1.964	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccncn1)Cc1ccc([N+](=O)[O-])cc1	ZINC001267223850	837558813	/nfs/dbraw/zinc/55/88/13/837558813.db2.gz	RMEQBZYXJDYXBW-UHFFFAOYSA-N	1	1	315.333	1.247	20	5		DDBDMO
C[N@@H+]1CC[C@H](NC(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)C1	ZINC001156576583	863160778	/nfs/dbraw/zinc/16/07/78/863160778.db2.gz	YAQYDRDUWQDPGQ-QMMMGPOBSA-N	1	1	306.700	1.986	20	5		DDBDMO
C[N@H+]1CC[C@H](NC(F)(F)c2cnc(Cl)c([N+](=O)[O-])c2)C1	ZINC001156576583	863160783	/nfs/dbraw/zinc/16/07/83/863160783.db2.gz	YAQYDRDUWQDPGQ-QMMMGPOBSA-N	1	1	306.700	1.986	20	5		DDBDMO
CC[N@H+]1C[C@@H](NC(=O)CCn2cc([N+](=O)[O-])nc2C)C(C)(C)C1	ZINC001156827422	863372636	/nfs/dbraw/zinc/37/26/36/863372636.db2.gz	DNYXBSOALJLGHD-GFCCVEGCSA-N	1	1	323.397	1.336	20	5		DDBDMO
C[C@H](NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1)C1=CC[N@@H+](C)CC1	ZINC001154042475	864352424	/nfs/dbraw/zinc/35/24/24/864352424.db2.gz	ISWWEGZOYGYSBU-VIFPVBQESA-N	1	1	306.322	1.076	20	5		DDBDMO
Cc1ccc(NC(=O)C[C@]2(O)CCC[N@H+](C)C2)c(N)c1[N+](=O)[O-]	ZINC001158231532	864503055	/nfs/dbraw/zinc/50/30/55/864503055.db2.gz	IKTDZMVLONNRGD-OAHLLOKOSA-N	1	1	322.365	1.271	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cnc1N1CC[N@@H+](C(C)C)[C@@H](C)C1	ZINC001158493745	864688313	/nfs/dbraw/zinc/68/83/13/864688313.db2.gz	JFBPVLQZSLCLKT-NSHDSACASA-N	1	1	322.365	1.695	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC001160477828	865873987	/nfs/dbraw/zinc/87/39/87/865873987.db2.gz	SIFDWLMXZIGQSI-QMMMGPOBSA-N	1	1	317.777	1.822	20	5		DDBDMO
[NH3+]CCc1cn(-c2ncc(F)cc2[N+](=O)[O-])c2ccncc12	ZINC001160945640	866202977	/nfs/dbraw/zinc/20/29/77/866202977.db2.gz	HETCVIBDMQMBTD-UHFFFAOYSA-N	1	1	301.281	1.969	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1	ZINC001333710523	866955758	/nfs/dbraw/zinc/95/57/58/866955758.db2.gz	LHTNYPBFYRVNIE-WCQYABFASA-N	1	1	306.366	1.919	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@]2(C)CCC[N@@H+](C)C2)n1	ZINC001162338564	867469258	/nfs/dbraw/zinc/46/92/58/867469258.db2.gz	BWBOMHLQUINSNY-AWEZNQCLSA-N	1	1	308.338	1.673	20	5		DDBDMO
CC(C)(C)[C@@H](C[NH+]1CCOCC1)Nc1ncc([N+](=O)[O-])cc1N	ZINC001162880516	867897318	/nfs/dbraw/zinc/89/73/18/867897318.db2.gz	LTBRDIWORAMONE-CYBMUJFWSA-N	1	1	323.397	1.731	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CCC([NH+](CC)CC)CC2)c1[N+](=O)[O-]	ZINC001322006269	867930068	/nfs/dbraw/zinc/93/00/68/867930068.db2.gz	DSTDEOVVQRYTSR-UHFFFAOYSA-N	1	1	323.397	1.827	20	5		DDBDMO
COc1c(O)ccc(CN2CC[C@H]3C[N@@H+](C)C[C@@H]32)c1[N+](=O)[O-]	ZINC001336813278	869160432	/nfs/dbraw/zinc/16/04/32/869160432.db2.gz	PMLCHDQIIZKRHG-JQWIXIFHSA-N	1	1	307.350	1.445	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNc2ccc([N+](=O)[O-])c3c2CNC3=O)C1	ZINC001165301154	869508627	/nfs/dbraw/zinc/50/86/27/869508627.db2.gz	YKJOQVYWOOJFJB-LLVKDONJSA-N	1	1	318.377	1.982	20	5		DDBDMO
Cc1nn(C)c(N2C[C@]34C[N@@H+](C)C[C@@]3(C2)CCCC4)c1[N+](=O)[O-]	ZINC001338200992	869866492	/nfs/dbraw/zinc/86/64/92/869866492.db2.gz	OWOZLWJEXFISMT-IYBDPMFKSA-N	1	1	319.409	1.949	20	5		DDBDMO
C[C@H]1C(=O)N(C)CCN1c1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001167038441	870494806	/nfs/dbraw/zinc/49/48/06/870494806.db2.gz	XERRQNRFOGZEJY-QRGHLMKCSA-N	1	1	319.365	1.189	20	5		DDBDMO
CNc1nccc(C(=O)N2CCC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC001349784649	875366494	/nfs/dbraw/zinc/36/64/94/875366494.db2.gz	LENVALQPGXSWMK-LLVKDONJSA-N	1	1	319.365	1.342	20	5		DDBDMO
Cn1cc[nH+]c1C[C@H]1CCCN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC001350475165	875710494	/nfs/dbraw/zinc/71/04/94/875710494.db2.gz	XWJOLRAECMJKFU-LLVKDONJSA-N	1	1	316.365	1.765	20	5		DDBDMO
CN1CCC[C@H](C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC001353289330	877234035	/nfs/dbraw/zinc/23/40/35/877234035.db2.gz	XTBBAZJKTSVQNZ-HIFRSBDPSA-N	1	1	323.393	1.266	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)CCc1c(Cl)cccc1[N+](=O)[O-]	ZINC001357452964	879975429	/nfs/dbraw/zinc/97/54/29/879975429.db2.gz	IXLULSJKIYPXIN-UHFFFAOYSA-N	1	1	321.711	1.891	20	5		DDBDMO
NC(=O)[C@@H]1CC[N@H+](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC001254479426	896456471	/nfs/dbraw/zinc/45/64/71/896456471.db2.gz	ZIEMRWWONQVCNX-GFCCVEGCSA-N	1	1	318.377	1.371	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+](C)CCN1[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569251	896505374	/nfs/dbraw/zinc/50/53/74/896505374.db2.gz	JEQQCRNZZCGRBS-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+](C)CCN1[C@H](C)Cc1ccccc1[N+](=O)[O-]	ZINC001254569251	896505381	/nfs/dbraw/zinc/50/53/81/896505381.db2.gz	JEQQCRNZZCGRBS-IUODEOHRSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565891	896506019	/nfs/dbraw/zinc/50/60/19/896506019.db2.gz	QUFBCPSGGQNBAJ-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
COC(=O)[C@H]1C[N@H+]([C@@H](C)Cc2ccccc2[N+](=O)[O-])CCN1C	ZINC001254565891	896506031	/nfs/dbraw/zinc/50/60/31/896506031.db2.gz	QUFBCPSGGQNBAJ-SWLSCSKDSA-N	1	1	321.377	1.315	20	5		DDBDMO
CN1C(=O)CC[C@@H]2[C@H]1CC[N@H+]2[C@H]1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001254597106	896524062	/nfs/dbraw/zinc/52/40/62/896524062.db2.gz	USAHMBFSYMOLLW-ARFHVFGLSA-N	1	1	315.373	1.757	20	5		DDBDMO
CC[N@H+]1CCCN(c2nnc(-c3ccc([N+](=O)[O-])o3)n2C)CC1	ZINC001262863766	900400185	/nfs/dbraw/zinc/40/01/85/900400185.db2.gz	PBOOTPFSCKYHBN-UHFFFAOYSA-N	1	1	320.353	1.515	20	5		DDBDMO
COc1cc(C[N@H+](C[C@H](C)O)[C@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000248904756	282117073	/nfs/dbraw/zinc/11/70/73/282117073.db2.gz	HUHFHAIQEAUHPR-ZJUUUORDSA-N	1	1	316.329	1.306	20	5		DDBDMO
COc1cc(C[N@@H+](C[C@H](C)O)[C@H](C)CO)c([N+](=O)[O-])cc1F	ZINC000248904756	282117074	/nfs/dbraw/zinc/11/70/74/282117074.db2.gz	HUHFHAIQEAUHPR-ZJUUUORDSA-N	1	1	316.329	1.306	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000305324154	231000277	/nfs/dbraw/zinc/00/02/77/231000277.db2.gz	OSIFBKQNRGCPKW-OAHLLOKOSA-N	1	1	316.361	1.519	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C)[C@@H]1CO	ZINC000305706023	231021867	/nfs/dbraw/zinc/02/18/67/231021867.db2.gz	CVNOBPXPYNZQAL-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C)[C@@H]1CO	ZINC000305706023	231021868	/nfs/dbraw/zinc/02/18/68/231021868.db2.gz	CVNOBPXPYNZQAL-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
C[C@@H]1CN(CCc2ccc([N+](=O)[O-])cc2)C[C@H](C)[N@@H+]1CCO	ZINC000451650479	231151103	/nfs/dbraw/zinc/15/11/03/231151103.db2.gz	FEVVNWUZCPTPFU-OKILXGFUSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC000451650479	231151106	/nfs/dbraw/zinc/15/11/06/231151106.db2.gz	FEVVNWUZCPTPFU-OKILXGFUSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](C)N1CCO	ZINC000451650479	231151109	/nfs/dbraw/zinc/15/11/09/231151109.db2.gz	FEVVNWUZCPTPFU-OKILXGFUSA-N	1	1	307.394	1.524	20	5		DDBDMO
C[C@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000249566764	282174290	/nfs/dbraw/zinc/17/42/90/282174290.db2.gz	NFEFQCMPAUSPEK-SMDDNHRTSA-N	1	1	307.350	1.559	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H](C(N)=O)C1	ZINC000249566764	282174292	/nfs/dbraw/zinc/17/42/92/282174292.db2.gz	NFEFQCMPAUSPEK-SMDDNHRTSA-N	1	1	307.350	1.559	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCC[C@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000458157497	529467481	/nfs/dbraw/zinc/46/74/81/529467481.db2.gz	CMMWQCHQDRZRMZ-SNVBAGLBSA-N	1	1	309.370	1.342	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072369	231291404	/nfs/dbraw/zinc/29/14/04/231291404.db2.gz	WOWDKWGVMPHBNU-WOPDTQHZSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H](C)C[C@H](O)C1	ZINC000452072369	231291408	/nfs/dbraw/zinc/29/14/08/231291408.db2.gz	WOWDKWGVMPHBNU-WOPDTQHZSA-N	1	1	307.350	1.625	20	5		DDBDMO
CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)Cc1cnn(C)c1	ZINC000090524541	185300308	/nfs/dbraw/zinc/30/03/08/185300308.db2.gz	OCXYRDNNUPRQJR-UHFFFAOYSA-N	1	1	305.338	1.012	20	5		DDBDMO
CC1(C)CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1CCO	ZINC000615140542	362170468	/nfs/dbraw/zinc/17/04/68/362170468.db2.gz	VUUORYIRWNUDOA-FNORWQNLSA-N	1	1	319.405	1.997	20	5		DDBDMO
C[N@H+]1CCN(CCNc2ncc([N+](=O)[O-])cc2F)CC1(C)C	ZINC000413289441	529772373	/nfs/dbraw/zinc/77/23/73/529772373.db2.gz	YBEXXTCAUCLCOY-UHFFFAOYSA-N	1	1	311.361	1.567	20	5		DDBDMO
CCOC1CC([N@@H+](C)C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000286721960	219130176	/nfs/dbraw/zinc/13/01/76/219130176.db2.gz	GIBLGZJIRVTOHA-MOKVOYLWSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2[nH]ncc2[N+](=O)[O-])C1	ZINC000138208772	186014886	/nfs/dbraw/zinc/01/48/86/186014886.db2.gz	KZAPWKHISZXBMY-PHIMTYICSA-N	1	1	323.397	1.804	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138208772	186014888	/nfs/dbraw/zinc/01/48/88/186014888.db2.gz	KZAPWKHISZXBMY-PHIMTYICSA-N	1	1	323.397	1.804	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2n[nH]cc2[N+](=O)[O-])C1	ZINC000138208772	186014890	/nfs/dbraw/zinc/01/48/90/186014890.db2.gz	KZAPWKHISZXBMY-PHIMTYICSA-N	1	1	323.397	1.804	20	5		DDBDMO
COc1ccc(OCCNC(C)(C)C[NH+](C)C)c([N+](=O)[O-])c1	ZINC000459548551	233303482	/nfs/dbraw/zinc/30/34/82/233303482.db2.gz	MAIJTBDDUFIESV-UHFFFAOYSA-N	1	1	311.382	1.912	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H](OCCO)C2)cc1	ZINC000172301745	198074808	/nfs/dbraw/zinc/07/48/08/198074808.db2.gz	MQRJJVOQAJXYIA-HNNXBMFYSA-N	1	1	310.350	1.447	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000031096398	352261880	/nfs/dbraw/zinc/26/18/80/352261880.db2.gz	WASBJUOYLJSVRR-UHFFFAOYSA-N	1	1	310.354	1.685	20	5		DDBDMO
CC[NH+]1CCN(CCCCNC(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000042595301	352344296	/nfs/dbraw/zinc/34/42/96/352344296.db2.gz	LGFLJLRHGIQVRA-UHFFFAOYSA-N	1	1	324.381	1.335	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000052294497	352607571	/nfs/dbraw/zinc/60/75/71/352607571.db2.gz	XTPHMCAABRWTHE-UHFFFAOYSA-N	1	1	303.322	1.599	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1cc([N+](=O)[O-])c[nH]1	ZINC000052894359	352631711	/nfs/dbraw/zinc/63/17/11/352631711.db2.gz	JNBHHLDVVKIRHJ-CYBMUJFWSA-N	1	1	314.345	1.927	20	5		DDBDMO
Cc1c(NC(=O)CC[N@H+]2CCOC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000063496567	352914088	/nfs/dbraw/zinc/91/40/88/352914088.db2.gz	AEKFKYHOJPIYNZ-LLVKDONJSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2CCOC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000063496567	352914091	/nfs/dbraw/zinc/91/40/91/352914091.db2.gz	AEKFKYHOJPIYNZ-LLVKDONJSA-N	1	1	307.350	1.953	20	5		DDBDMO
CC[NH+]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000069543962	353167740	/nfs/dbraw/zinc/16/77/40/353167740.db2.gz	LZZFYCPLUMFWQG-UHFFFAOYSA-N	1	1	307.350	1.310	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000070949923	353186654	/nfs/dbraw/zinc/18/66/54/353186654.db2.gz	QDEBEKQYOKAUQI-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000070949923	353186656	/nfs/dbraw/zinc/18/66/56/353186656.db2.gz	QDEBEKQYOKAUQI-LBPRGKRZSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000174472890	198338377	/nfs/dbraw/zinc/33/83/77/198338377.db2.gz	KRWWZHFRJFUCDZ-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
CC(C)c1nc2c(n1C)CC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000174852098	198393568	/nfs/dbraw/zinc/39/35/68/198393568.db2.gz	ZQZNOUZFCPGANA-UHFFFAOYSA-N	1	1	318.381	1.707	20	5		DDBDMO
CC(C)c1nc2c(n1C)CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000174852098	198393570	/nfs/dbraw/zinc/39/35/70/198393570.db2.gz	ZQZNOUZFCPGANA-UHFFFAOYSA-N	1	1	318.381	1.707	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[NH+]([C@@H]2CCSC2)CC1	ZINC000080435043	353608151	/nfs/dbraw/zinc/60/81/51/353608151.db2.gz	ONPOENNRFKGIBB-GFCCVEGCSA-N	1	1	321.402	1.858	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000081527118	353681143	/nfs/dbraw/zinc/68/11/43/353681143.db2.gz	DTHDGSSOUOGRJG-LLVKDONJSA-N	1	1	322.365	1.156	20	5		DDBDMO
CNC(=O)[C@H](C)C[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000081527118	353681144	/nfs/dbraw/zinc/68/11/44/353681144.db2.gz	DTHDGSSOUOGRJG-LLVKDONJSA-N	1	1	322.365	1.156	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1N1CCC([N@@H+]2CCO[C@H](C)C2)CC1	ZINC000092612370	353863329	/nfs/dbraw/zinc/86/33/29/353863329.db2.gz	CGFSSRDJVYMUJC-CYBMUJFWSA-N	1	1	320.393	1.988	20	5		DDBDMO
C[C@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000093332540	353895926	/nfs/dbraw/zinc/89/59/26/353895926.db2.gz	UCLVTWYQWLQXTK-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1O	ZINC000093332540	353895932	/nfs/dbraw/zinc/89/59/32/353895932.db2.gz	UCLVTWYQWLQXTK-FZMZJTMJSA-N	1	1	307.350	1.260	20	5		DDBDMO
CCOCC[N@@H+](C)CCCn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000093311631	353894474	/nfs/dbraw/zinc/89/44/74/353894474.db2.gz	YANAUEPNHVEDLT-UHFFFAOYSA-N	1	1	323.349	1.861	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000157920589	354227651	/nfs/dbraw/zinc/22/76/51/354227651.db2.gz	PZQGPLAJVNMBNZ-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000157920589	354227653	/nfs/dbraw/zinc/22/76/53/354227653.db2.gz	PZQGPLAJVNMBNZ-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
CC(=O)N1CC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000268686113	354406196	/nfs/dbraw/zinc/40/61/96/354406196.db2.gz	NOUGINGDTUCTJC-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC(=O)N1CC[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000268686113	354406201	/nfs/dbraw/zinc/40/62/01/354406201.db2.gz	NOUGINGDTUCTJC-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
Cn1c[nH+]cc1CCCn1cc(Br)c([N+](=O)[O-])n1	ZINC000314147131	354483826	/nfs/dbraw/zinc/48/38/26/354483826.db2.gz	QJFCRTWWOQMIKP-UHFFFAOYSA-N	1	1	314.143	1.920	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc([N+](=O)[O-])c2cnccc12	ZINC000320457842	354527193	/nfs/dbraw/zinc/52/71/93/354527193.db2.gz	OTZUZJYNXFUXPE-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000320457842	354527199	/nfs/dbraw/zinc/52/71/99/354527199.db2.gz	OTZUZJYNXFUXPE-GFCCVEGCSA-N	1	1	315.377	1.801	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000590010679	355040824	/nfs/dbraw/zinc/04/08/24/355040824.db2.gz	OSRDJTJXTLYSJK-NHYWBVRUSA-N	1	1	319.361	1.597	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC3(C2)CC[NH+](C)CC3)c1[N+](=O)[O-]	ZINC000590376017	355078382	/nfs/dbraw/zinc/07/83/82/355078382.db2.gz	SIBLNAFOBZTMLP-UHFFFAOYSA-N	1	1	307.354	1.184	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)COc2ccc([N+](=O)[O-])cc2)C1	ZINC000590443370	355097649	/nfs/dbraw/zinc/09/76/49/355097649.db2.gz	IMZHFRHEEDPNJG-FZMZJTMJSA-N	1	1	305.334	1.136	20	5		DDBDMO
C[C@H](O)[C@@H]1C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056166	355239565	/nfs/dbraw/zinc/23/95/65/355239565.db2.gz	CXRWCONQMQRKHM-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000591056166	355239568	/nfs/dbraw/zinc/23/95/68/355239568.db2.gz	CXRWCONQMQRKHM-WFASDCNBSA-N	1	1	310.350	1.445	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)N2CCC[N@@H+](CC3CCC3)CC2)n1	ZINC000591079645	355244799	/nfs/dbraw/zinc/24/47/99/355244799.db2.gz	RMQFGIRPQMLVHH-UHFFFAOYSA-N	1	1	321.381	1.276	20	5		DDBDMO
C[NH+]1CCC2(CC1)CN(CCc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000592182642	355527787	/nfs/dbraw/zinc/52/77/87/355527787.db2.gz	NDHQVHVBSGWHJV-UHFFFAOYSA-N	1	1	319.405	1.934	20	5		DDBDMO
C[C@@H]1[C@H](C(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)CC[N@H+]1C	ZINC000592794709	355694650	/nfs/dbraw/zinc/69/46/50/355694650.db2.gz	LYLBRRBIDHJOBN-DGCLKSJQSA-N	1	1	321.381	1.295	20	5		DDBDMO
O=[N+]([O-])c1cccc(CNC2CC[NH+]([C@H]3CCOC3)CC2)c1	ZINC000594494139	356237256	/nfs/dbraw/zinc/23/72/56/356237256.db2.gz	UXTSHWZWUMVWFW-INIZCTEOSA-N	1	1	305.378	1.938	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@]1(O)CC[N@@H+](C)C1	ZINC000595032292	356374329	/nfs/dbraw/zinc/37/43/29/356374329.db2.gz	MCVGCLPUDOIYEC-IAQYHMDHSA-N	1	1	309.366	1.321	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1COCCO1	ZINC000595744940	356631919	/nfs/dbraw/zinc/63/19/19/356631919.db2.gz	WJBFRGARQPGQTO-SMDDNHRTSA-N	1	1	323.349	1.269	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H]1COCCO1	ZINC000595744940	356631924	/nfs/dbraw/zinc/63/19/24/356631924.db2.gz	WJBFRGARQPGQTO-SMDDNHRTSA-N	1	1	323.349	1.269	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@H]3NC(=O)CC[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000595728783	356625012	/nfs/dbraw/zinc/62/50/12/356625012.db2.gz	OWHMWUFJAAJYAS-QWHCGFSZSA-N	1	1	319.361	1.704	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@H]2COC[C@]2(C)C1	ZINC000595755461	356637092	/nfs/dbraw/zinc/63/70/92/356637092.db2.gz	ARLLWCNSJQONHQ-WQGACYEGSA-N	1	1	319.361	1.890	20	5		DDBDMO
O=C(C[N@@H+]1CCC2(COC2)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595835996	356671525	/nfs/dbraw/zinc/67/15/25/356671525.db2.gz	XXNHSPSWLUYKHE-UHFFFAOYSA-N	1	1	317.345	1.206	20	5		DDBDMO
O=C(C[N@H+]1CCC2(COC2)C1)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000595835996	356671528	/nfs/dbraw/zinc/67/15/28/356671528.db2.gz	XXNHSPSWLUYKHE-UHFFFAOYSA-N	1	1	317.345	1.206	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595877537	356688361	/nfs/dbraw/zinc/68/83/61/356688361.db2.gz	UYMUJAUPTGUPTE-WBMJQRKESA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)[C@](C)(CO)C1	ZINC000595877537	356688363	/nfs/dbraw/zinc/68/83/63/356688363.db2.gz	UYMUJAUPTGUPTE-WBMJQRKESA-N	1	1	321.377	1.792	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2cc[nH]c(=O)c2[N+](=O)[O-])CC1	ZINC000596081380	356765905	/nfs/dbraw/zinc/76/59/05/356765905.db2.gz	HJJBZXJHDXABDO-GFCCVEGCSA-N	1	1	323.397	1.381	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@@H]1CCN(c2cc[nH]c(=O)c2[N+](=O)[O-])C1	ZINC000596146670	356791327	/nfs/dbraw/zinc/79/13/27/356791327.db2.gz	GVQHFHOUTSFLNJ-LBPRGKRZSA-N	1	1	306.366	1.864	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC[C@@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000276914499	213172692	/nfs/dbraw/zinc/17/26/92/213172692.db2.gz	NZIQTFHEEREXCG-CQSZACIVSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000276914499	213172694	/nfs/dbraw/zinc/17/26/94/213172694.db2.gz	NZIQTFHEEREXCG-CQSZACIVSA-N	1	1	324.377	1.967	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCCOCC3)CC2)cn1	ZINC000596269404	356838993	/nfs/dbraw/zinc/83/89/93/356838993.db2.gz	SZGRULDMJWGVRM-UHFFFAOYSA-N	1	1	306.366	1.681	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@@H+](CC2CC2)C1	ZINC000596498481	356898522	/nfs/dbraw/zinc/89/85/22/356898522.db2.gz	CYPMLVZSTXXNQM-ZDUSSCGKSA-N	1	1	320.393	1.785	20	5		DDBDMO
Cc1ncc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1C	ZINC000597014779	357040584	/nfs/dbraw/zinc/04/05/84/357040584.db2.gz	RYFJYUWLQMFDJU-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1ncc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1C	ZINC000597014779	357040587	/nfs/dbraw/zinc/04/05/87/357040587.db2.gz	RYFJYUWLQMFDJU-GFCCVEGCSA-N	1	1	316.365	1.718	20	5		DDBDMO
Cc1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)cc1[N+](=O)[O-]	ZINC000597202440	357090964	/nfs/dbraw/zinc/09/09/64/357090964.db2.gz	AYSPWFSNOOONHB-HNNXBMFYSA-N	1	1	305.378	1.810	20	5		DDBDMO
CCOc1cc(C[NH+]2CCC(O)(COC)CC2)ccc1[N+](=O)[O-]	ZINC000276836825	213124088	/nfs/dbraw/zinc/12/40/88/213124088.db2.gz	BVVWWGNOMUJUEB-UHFFFAOYSA-N	1	1	324.377	1.967	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)N[C@@H]1CC[N@H+](C2CCCCC2)C1	ZINC000598217749	357496281	/nfs/dbraw/zinc/49/62/81/357496281.db2.gz	AVWDLINCQGLZPI-GFCCVEGCSA-N	1	1	321.381	1.315	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC000598341616	357544342	/nfs/dbraw/zinc/54/43/42/357544342.db2.gz	DSGPGXBNXHXYGR-ZDUSSCGKSA-N	1	1	323.397	1.399	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000599137647	357827091	/nfs/dbraw/zinc/82/70/91/357827091.db2.gz	ARXAVVKTIVUCLD-JTQLQIEISA-N	1	1	307.354	1.233	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000599430459	357932094	/nfs/dbraw/zinc/93/20/94/357932094.db2.gz	SEWIJGJAKLCIHE-UHFFFAOYSA-N	1	1	304.306	1.295	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC3(CCOCC3)CC[C@@H]2CO)c1	ZINC000599544293	357967797	/nfs/dbraw/zinc/96/77/97/357967797.db2.gz	ZKAOVJMAYWXBGC-CYBMUJFWSA-N	1	1	324.381	1.045	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000180006546	199105470	/nfs/dbraw/zinc/10/54/70/199105470.db2.gz	JKGBWKCROZKPNB-NSHDSACASA-N	1	1	321.333	1.538	20	5		DDBDMO
O=C(Cn1cc([N+](=O)[O-])cn1)NC[C@H]1CC[N@H+]1C1CCCCC1	ZINC000600229419	358163309	/nfs/dbraw/zinc/16/33/09/358163309.db2.gz	SCSQJYGMXOXABN-CYBMUJFWSA-N	1	1	321.381	1.315	20	5		DDBDMO
C[N@H+]1CCCC[C@H](CNC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC000600316297	358195286	/nfs/dbraw/zinc/19/52/86/358195286.db2.gz	ZEGKZKQJOWBFFO-SNVBAGLBSA-N	1	1	308.338	1.157	20	5		DDBDMO
C[C@H]1COCCN1CCNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000601113556	358407434	/nfs/dbraw/zinc/40/74/34/358407434.db2.gz	IDHABUDQEPOIBG-LBPRGKRZSA-N	1	1	316.361	1.698	20	5		DDBDMO
CNC(=O)[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1	ZINC000601175948	358433938	/nfs/dbraw/zinc/43/39/38/358433938.db2.gz	RWGQYNULBCXKCP-JTQLQIEISA-N	1	1	300.318	1.715	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N[C@H](CO)[C@@H]3CCCOC3)c2c1	ZINC000601176869	358434635	/nfs/dbraw/zinc/43/46/35/358434635.db2.gz	SGVZNHMPAOSTDK-BDJLRTHQSA-N	1	1	317.345	1.764	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000601187901	358439327	/nfs/dbraw/zinc/43/93/27/358439327.db2.gz	ZLDPNMLPWLPWRC-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
CCOC(=O)c1ccnc(N2CC[N@@H+](C)C(C)(C)C2)c1[N+](=O)[O-]	ZINC000601187901	358439328	/nfs/dbraw/zinc/43/93/28/358439328.db2.gz	ZLDPNMLPWLPWRC-UHFFFAOYSA-N	1	1	322.365	1.697	20	5		DDBDMO
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+](CCO)CCCO	ZINC000602468762	358998102	/nfs/dbraw/zinc/99/81/02/358998102.db2.gz	RKUKNMJTMPPHPM-UHFFFAOYSA-N	1	1	322.283	1.790	20	5		DDBDMO
O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+](CCO)CCCO	ZINC000602468762	358998105	/nfs/dbraw/zinc/99/81/05/358998105.db2.gz	RKUKNMJTMPPHPM-UHFFFAOYSA-N	1	1	322.283	1.790	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CCN1CC[C@H](C[N@@H+](C)CC2CC2)C1	ZINC000602784243	359189413	/nfs/dbraw/zinc/18/94/13/359189413.db2.gz	RHYUXCCVFNBEGB-OAHLLOKOSA-N	1	1	321.425	1.763	20	5		DDBDMO
COCCOC[C@@H]1CC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602787574	359191802	/nfs/dbraw/zinc/19/18/02/359191802.db2.gz	ZOTXGDGPARUUSI-CYBMUJFWSA-N	1	1	312.370	1.085	20	5		DDBDMO
CC(C)NC(=O)[C@H]1CCC[N@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602723119	359149941	/nfs/dbraw/zinc/14/99/41/359149941.db2.gz	QLCOYAFATOOQGC-NSHDSACASA-N	1	1	309.370	1.065	20	5		DDBDMO
CC(C)NC(=O)[C@H]1CCC[N@@H+](Cc2cn(C)nc2[N+](=O)[O-])C1	ZINC000602723119	359149944	/nfs/dbraw/zinc/14/99/44/359149944.db2.gz	QLCOYAFATOOQGC-NSHDSACASA-N	1	1	309.370	1.065	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(Cc2cn(C)nc2[N+](=O)[O-])CC1	ZINC000602838858	359228934	/nfs/dbraw/zinc/22/89/34/359228934.db2.gz	UHSAMPADSVZPNW-GFCCVEGCSA-N	1	1	323.397	1.013	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC000602961563	359324399	/nfs/dbraw/zinc/32/43/99/359324399.db2.gz	VGVOIBOBKLEPCM-LLVKDONJSA-N	1	1	307.354	1.278	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC000602961563	359324402	/nfs/dbraw/zinc/32/44/02/359324402.db2.gz	VGVOIBOBKLEPCM-LLVKDONJSA-N	1	1	307.354	1.278	20	5		DDBDMO
CO[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])[C@@](C)(CO)C1	ZINC000602963637	359326912	/nfs/dbraw/zinc/32/69/12/359326912.db2.gz	HPSSJNDNLGQSAH-SWLSCSKDSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ncc([N+](=O)[O-])cn2)CC1	ZINC000603399530	359616350	/nfs/dbraw/zinc/61/63/50/359616350.db2.gz	CBZASBFVJJTJQB-NSHDSACASA-N	1	1	307.354	1.074	20	5		DDBDMO
C[C@H]1C[C@@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000187123682	200064570	/nfs/dbraw/zinc/06/45/70/200064570.db2.gz	VWIIABPBVOHXGG-ONGXEEELSA-N	1	1	308.338	1.250	20	5		DDBDMO
C[C@H]1CC[C@@](CO)([N@@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000187982173	200186508	/nfs/dbraw/zinc/18/65/08/200186508.db2.gz	VYNUQHZYQBGADJ-MEDUHNTESA-N	1	1	321.377	1.677	20	5		DDBDMO
O=[N+]([O-])c1c(NCC[N@H+]2CCCOCC2)nc2sccn21	ZINC000188498127	200256481	/nfs/dbraw/zinc/25/64/81/200256481.db2.gz	WPLPZLJKCQLWBP-UHFFFAOYSA-N	1	1	311.367	1.438	20	5		DDBDMO
CC[N@@H+](CC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1)C1CC1	ZINC000188513336	200259603	/nfs/dbraw/zinc/25/96/03/200259603.db2.gz	BQBVXQCRXCZWMQ-UHFFFAOYSA-N	1	1	319.361	1.669	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CCC[N@H+](C)C2)c(C)c1[N+](=O)[O-]	ZINC000608839545	360249586	/nfs/dbraw/zinc/24/95/86/360249586.db2.gz	GGCUTFNPQMTGBY-GFCCVEGCSA-N	1	1	309.370	1.009	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C1	ZINC000610239876	360395460	/nfs/dbraw/zinc/39/54/60/360395460.db2.gz	AQMAGFYUVPQLAH-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000610712470	360512501	/nfs/dbraw/zinc/51/25/01/360512501.db2.gz	BWNUIPZHLWDQTB-MFKMUULPSA-N	1	1	321.381	1.125	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)c1	ZINC000610912569	360570772	/nfs/dbraw/zinc/57/07/72/360570772.db2.gz	YMUVKGTWURJEJS-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)c1	ZINC000610912569	360570777	/nfs/dbraw/zinc/57/07/77/360570777.db2.gz	YMUVKGTWURJEJS-FZMZJTMJSA-N	1	1	307.350	1.352	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610931058	360574241	/nfs/dbraw/zinc/57/42/41/360574241.db2.gz	SNDBSIWPRJMYEW-SNVBAGLBSA-N	1	1	321.333	1.063	20	5		DDBDMO
NC(=O)[C@@H]1CCC[N@@H+](Cc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000610931058	360574247	/nfs/dbraw/zinc/57/42/47/360574247.db2.gz	SNDBSIWPRJMYEW-SNVBAGLBSA-N	1	1	321.333	1.063	20	5		DDBDMO
CC(C)(CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000611165974	360643306	/nfs/dbraw/zinc/64/33/06/360643306.db2.gz	QQECIQGQLTWOKR-UHFFFAOYSA-N	1	1	307.350	1.124	20	5		DDBDMO
CC[N@H+]1CCN([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000611092113	360620873	/nfs/dbraw/zinc/62/08/73/360620873.db2.gz	JAESPISAXNWFTR-CHWSQXEVSA-N	1	1	320.393	1.948	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@H](C)O)[C@H](C)C2)n1	ZINC000611616292	360777555	/nfs/dbraw/zinc/77/75/55/360777555.db2.gz	UVILJOULOFNASV-OLZOCXBDSA-N	1	1	308.382	1.498	20	5		DDBDMO
COC[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000612086275	360913439	/nfs/dbraw/zinc/91/34/39/360913439.db2.gz	LVWZMVSICSKQBS-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@H](C)C1	ZINC000281389947	216267742	/nfs/dbraw/zinc/26/77/42/216267742.db2.gz	GGBLTGDWLZNXDJ-MNOVXSKESA-N	1	1	319.365	1.362	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619251939	363945931	/nfs/dbraw/zinc/94/59/31/363945931.db2.gz	CBQXYTQMULKXNZ-KBPBESRZSA-N	1	1	307.325	1.853	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@@H+](C[C@@H](C)O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000275318038	212268599	/nfs/dbraw/zinc/26/85/99/212268599.db2.gz	DBEZBKQSBIIHDR-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@H+](C[C@@H](C)O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000275318038	212268602	/nfs/dbraw/zinc/26/86/02/212268602.db2.gz	DBEZBKQSBIIHDR-VXGBXAGGSA-N	1	1	321.377	1.689	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000275067545	212102224	/nfs/dbraw/zinc/10/22/24/212102224.db2.gz	AHXMBWQYVPLIHR-MWLCHTKSSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000275067545	212102226	/nfs/dbraw/zinc/10/22/26/212102226.db2.gz	AHXMBWQYVPLIHR-MWLCHTKSSA-N	1	1	309.370	1.293	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000275067545	212102227	/nfs/dbraw/zinc/10/22/27/212102227.db2.gz	AHXMBWQYVPLIHR-MWLCHTKSSA-N	1	1	309.370	1.293	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@H+]1C	ZINC000264956126	204300529	/nfs/dbraw/zinc/30/05/29/204300529.db2.gz	YSWSUELVBOJRJJ-GFCCVEGCSA-N	1	1	306.366	1.485	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000338564705	250032524	/nfs/dbraw/zinc/03/25/24/250032524.db2.gz	JMYVMABBGFMYJF-LLVKDONJSA-N	1	1	305.334	1.834	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000338564705	250032528	/nfs/dbraw/zinc/03/25/28/250032528.db2.gz	JMYVMABBGFMYJF-LLVKDONJSA-N	1	1	305.334	1.834	20	5		DDBDMO
O=C(CC[N@H+](CCO)CC1CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000352491454	285088440	/nfs/dbraw/zinc/08/84/40/285088440.db2.gz	QECDQLIJNHHZPB-UHFFFAOYSA-N	1	1	307.350	1.628	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)CN(C)C	ZINC000459544318	533138110	/nfs/dbraw/zinc/13/81/10/533138110.db2.gz	DIBDFDAKLYMXSC-UHFFFAOYSA-N	1	1	324.381	1.472	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCC[C@@H]1O	ZINC000352696691	285235133	/nfs/dbraw/zinc/23/51/33/285235133.db2.gz	JZUVJRYQXCGMNN-QEJZJMRPSA-N	1	1	310.350	1.180	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1C	ZINC000451578804	533414727	/nfs/dbraw/zinc/41/47/27/533414727.db2.gz	XRDYSKLTIYLPEE-UMVBOHGHSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[C@@H](O)C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)CO	ZINC000444686808	533658930	/nfs/dbraw/zinc/65/89/30/533658930.db2.gz	UEMOKZFSLIMOIA-NXEZZACHSA-N	1	1	308.338	1.035	20	5		DDBDMO
C[C@@H](O)C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)CO	ZINC000444686808	533658940	/nfs/dbraw/zinc/65/89/40/533658940.db2.gz	UEMOKZFSLIMOIA-NXEZZACHSA-N	1	1	308.338	1.035	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)C[NH+]1CCOCC1	ZINC000579714561	422821271	/nfs/dbraw/zinc/82/12/71/422821271.db2.gz	YCVKDXZUZMZMGE-LLVKDONJSA-N	1	1	322.365	1.543	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1C[C@H](C)[NH2+][C@@H](C)C1	ZINC000070076740	406808117	/nfs/dbraw/zinc/80/81/17/406808117.db2.gz	RUABHDYNFGQKBJ-QWRGUYRKSA-N	1	1	313.379	1.274	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000072061742	406873014	/nfs/dbraw/zinc/87/30/14/406873014.db2.gz	PZNZFAXZPFRYRO-LLVKDONJSA-N	1	1	309.370	1.477	20	5		DDBDMO
CCC[N@@H+](CCO)CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000076951591	406975364	/nfs/dbraw/zinc/97/53/64/406975364.db2.gz	WOHSSDRVBSWCIR-UHFFFAOYSA-N	1	1	307.350	1.188	20	5		DDBDMO
COCCC[N@@H+](C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000078372894	407026707	/nfs/dbraw/zinc/02/67/07/407026707.db2.gz	ZPBAWIOLFCARLI-UHFFFAOYSA-N	1	1	312.326	1.883	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NC[C@@H]1CCC[NH2+]C1	ZINC000123383820	407327367	/nfs/dbraw/zinc/32/73/67/407327367.db2.gz	DRDXDQFNYBQQNK-SECBINFHSA-N	1	1	317.342	1.012	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@H](CO)C3)n2)c1	ZINC000265831904	407476225	/nfs/dbraw/zinc/47/62/25/407476225.db2.gz	MRNRBOQZTUBJEL-NSHDSACASA-N	1	1	318.333	1.849	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](CO)C3)n2)c1	ZINC000265831904	407476230	/nfs/dbraw/zinc/47/62/30/407476230.db2.gz	MRNRBOQZTUBJEL-NSHDSACASA-N	1	1	318.333	1.849	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[NH+](C3CCCC3)CC2)c1[N+](=O)[O-]	ZINC000170694053	407477699	/nfs/dbraw/zinc/47/76/99/407477699.db2.gz	HEPFHDBBPRDYDY-UHFFFAOYSA-N	1	1	321.381	1.581	20	5		DDBDMO
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCC[C@@H]1CC[NH2+]C1	ZINC000261685019	407577990	/nfs/dbraw/zinc/57/79/90/407577990.db2.gz	MUOBWRBDLVZFLP-VIFPVBQESA-N	1	1	317.342	1.012	20	5		DDBDMO
C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C	ZINC000186487616	407678936	/nfs/dbraw/zinc/67/89/36/407678936.db2.gz	AEUAVUKWMKYAIH-HZMBPMFUSA-N	1	1	317.349	1.739	20	5		DDBDMO
C[C@@H](CNC(=O)NCc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C1CC1	ZINC000171649825	407733385	/nfs/dbraw/zinc/73/33/85/407733385.db2.gz	HCIAYNMIZCLYMU-NSHDSACASA-N	1	1	306.366	1.877	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000354279709	298391610	/nfs/dbraw/zinc/39/16/10/298391610.db2.gz	CTRXGBHZSNVOCK-SNVBAGLBSA-N	1	1	311.363	1.110	20	5		DDBDMO
O=[N+]([O-])c1ccccc1S(=O)(=O)N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000354279709	298391612	/nfs/dbraw/zinc/39/16/12/298391612.db2.gz	CTRXGBHZSNVOCK-SNVBAGLBSA-N	1	1	311.363	1.110	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1cc([N+](=O)[O-])cnc1C	ZINC000153591223	407858802	/nfs/dbraw/zinc/85/88/02/407858802.db2.gz	KAVXBAOXXYTIJZ-UHFFFAOYSA-N	1	1	317.349	1.965	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000268135974	407906320	/nfs/dbraw/zinc/90/63/20/407906320.db2.gz	CIGUGXFLKUAGKB-NOZJJQNGSA-N	1	1	304.350	1.390	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C	ZINC000245466484	407992318	/nfs/dbraw/zinc/99/23/18/407992318.db2.gz	ZBIWUFYWKRZQKS-YPMHNXCESA-N	1	1	319.361	1.912	20	5		DDBDMO
CC[C@@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000181545157	408012537	/nfs/dbraw/zinc/01/25/37/408012537.db2.gz	YJIAXYPPVILBFZ-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000181545157	408012542	/nfs/dbraw/zinc/01/25/42/408012542.db2.gz	YJIAXYPPVILBFZ-QWHCGFSZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000154747829	408077723	/nfs/dbraw/zinc/07/77/23/408077723.db2.gz	SAEWQPORRKZVSO-NSHDSACASA-N	1	1	314.345	1.967	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000182492208	408178716	/nfs/dbraw/zinc/17/87/16/408178716.db2.gz	LZPBWQMQNGGYDP-XQQFMLRXSA-N	1	1	310.350	1.037	20	5		DDBDMO
COc1cccc2c1CC[N@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000182675621	408221426	/nfs/dbraw/zinc/22/14/26/408221426.db2.gz	PJQZIUWKGUKXFW-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1cccc2c1CC[N@@H+](CCn1cc([N+](=O)[O-])cn1)C2	ZINC000182675621	408221430	/nfs/dbraw/zinc/22/14/30/408221430.db2.gz	PJQZIUWKGUKXFW-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
Nc1nc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)ncc1[N+](=O)[O-]	ZINC000269427720	408305553	/nfs/dbraw/zinc/30/55/53/408305553.db2.gz	OJQKNFJRHJVVPE-CMPLNLGQSA-N	1	1	318.381	1.420	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000269432747	408308480	/nfs/dbraw/zinc/30/84/80/408308480.db2.gz	CIWNUFWVEGQKAL-KOLCDFICSA-N	1	1	321.381	1.654	20	5		DDBDMO
C[C@@H](CNc1ccc([N+](=O)[O-])c2nonc21)[NH+]1CCN(C)CC1	ZINC000263919403	408313596	/nfs/dbraw/zinc/31/35/96/408313596.db2.gz	RWFDXSJZRRUXNN-JTQLQIEISA-N	1	1	320.353	1.179	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000274433782	408404053	/nfs/dbraw/zinc/40/40/53/408404053.db2.gz	GHVURZFCBMBNIY-NSHDSACASA-N	1	1	324.356	1.919	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C1	ZINC000264438277	408489536	/nfs/dbraw/zinc/48/95/36/408489536.db2.gz	BJYCJJTYMZGVIA-BTKRWWFXSA-N	1	1	319.361	1.445	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000177030511	408501157	/nfs/dbraw/zinc/50/11/57/408501157.db2.gz	FQINRWJALAEYQL-LLVKDONJSA-N	1	1	306.366	1.733	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534278	408566283	/nfs/dbraw/zinc/56/62/83/408566283.db2.gz	WDMVXQYWFPEHNU-SWLSCSKDSA-N	1	1	321.377	1.793	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000270534278	408566287	/nfs/dbraw/zinc/56/62/87/408566287.db2.gz	WDMVXQYWFPEHNU-SWLSCSKDSA-N	1	1	321.377	1.793	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1	ZINC000264609586	408539973	/nfs/dbraw/zinc/53/99/73/408539973.db2.gz	ZDAMVITUNCKZRT-ZDUSSCGKSA-N	1	1	307.350	1.354	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000192690368	408631896	/nfs/dbraw/zinc/63/18/96/408631896.db2.gz	CVCKGRKQBODRJU-GHMZBOCLSA-N	1	1	319.361	1.958	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](CC)C3)c1[N+](=O)[O-]	ZINC000192688215	408632579	/nfs/dbraw/zinc/63/25/79/408632579.db2.gz	VINLCSHBZIEAMB-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@@H+](CC)C3)c1[N+](=O)[O-]	ZINC000192688215	408632584	/nfs/dbraw/zinc/63/25/84/408632584.db2.gz	VINLCSHBZIEAMB-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2CC[N@H+](CC)C3)c1[N+](=O)[O-]	ZINC000192688215	408632588	/nfs/dbraw/zinc/63/25/88/408632588.db2.gz	VINLCSHBZIEAMB-WDEREUQCSA-N	1	1	321.381	1.579	20	5		DDBDMO
COCC[N@H+]1CC[C@@H](NC(=O)NCc2ccc([N+](=O)[O-])cc2)C1	ZINC000265653649	408731366	/nfs/dbraw/zinc/73/13/66/408731366.db2.gz	XZLJFJJBDVHVBS-CYBMUJFWSA-N	1	1	322.365	1.115	20	5		DDBDMO
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2c([N+](=O)[O-])cnn2C)C1	ZINC000163605339	408784023	/nfs/dbraw/zinc/78/40/23/408784023.db2.gz	ROOLIICVJQQSGG-LLVKDONJSA-N	1	1	323.397	1.569	20	5		DDBDMO
O=C1NCC[C@@H]1[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000178206434	408786693	/nfs/dbraw/zinc/78/66/93/408786693.db2.gz	LOHMIJZNRBHBRW-AWEZNQCLSA-N	1	1	305.334	1.327	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000249733596	408758698	/nfs/dbraw/zinc/75/86/98/408758698.db2.gz	CLDIVELLORBZQE-GHMZBOCLSA-N	1	1	323.397	1.487	20	5		DDBDMO
C[C@H](C[S@](C)=O)[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1	ZINC000185105852	408758889	/nfs/dbraw/zinc/75/88/89/408758889.db2.gz	VCVIFEGTUZTYFE-GIPWTMENSA-N	1	1	300.380	1.672	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000276501257	408872177	/nfs/dbraw/zinc/87/21/77/408872177.db2.gz	JMWODCZBGYTLRB-YMTOWFKASA-N	1	1	304.350	1.390	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[C@H]([NH+]3CCCC3)[C@H]2C)c1[N+](=O)[O-]	ZINC000286989442	409003118	/nfs/dbraw/zinc/00/31/18/409003118.db2.gz	GXVHQJYVZHKGAX-MNOVXSKESA-N	1	1	307.354	1.325	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1CO	ZINC000281952717	408959357	/nfs/dbraw/zinc/95/93/57/408959357.db2.gz	FQKFDWBHJKQAIU-FZMZJTMJSA-N	1	1	307.350	1.626	20	5		DDBDMO
C[N@@H+](Cc1ccccc1)C1CN(c2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000286391343	408976242	/nfs/dbraw/zinc/97/62/42/408976242.db2.gz	OYFSBMPRLTYOIP-UHFFFAOYSA-N	1	1	314.349	1.288	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000287310710	409017626	/nfs/dbraw/zinc/01/76/26/409017626.db2.gz	JKGPJECJYBQGSE-OCCSQVGLSA-N	1	1	312.366	1.427	20	5		DDBDMO
CC[C@@H](C)[N@@H+](CCO)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000287310715	409017992	/nfs/dbraw/zinc/01/79/92/409017992.db2.gz	JKGPJECJYBQGSE-TZMCWYRMSA-N	1	1	312.366	1.427	20	5		DDBDMO
CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(C)C1=O	ZINC000282349963	409039046	/nfs/dbraw/zinc/03/90/46/409039046.db2.gz	ANMHSDHKQXSCPT-ZDUSSCGKSA-N	1	1	305.334	1.564	20	5		DDBDMO
CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(C)C1=O	ZINC000282349963	409039047	/nfs/dbraw/zinc/03/90/47/409039047.db2.gz	ANMHSDHKQXSCPT-ZDUSSCGKSA-N	1	1	305.334	1.564	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)[N@H+](C)[C@@H](C)C1	ZINC000293346393	409093843	/nfs/dbraw/zinc/09/38/43/409093843.db2.gz	HLNZEXCDKNZFDQ-XQQFMLRXSA-N	1	1	320.393	1.946	20	5		DDBDMO
CC(C)[C@@H](NC(=O)c1c[n-]c(=O)c([N+](=O)[O-])c1)c1ncc[nH]1	ZINC000283142077	409096916	/nfs/dbraw/zinc/09/69/16/409096916.db2.gz	XXLSIIATKJWCIE-SNVBAGLBSA-N	1	1	305.294	1.546	20	5		DDBDMO
C[C@@H](CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N)[N@@H+](C)C1CC1	ZINC000279311304	409190174	/nfs/dbraw/zinc/19/01/74/409190174.db2.gz	AVQBEAIVROXNKN-QMMMGPOBSA-N	1	1	310.329	1.529	20	5		DDBDMO
O=C1[C@H]([N@@H+]2CC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432673	409623814	/nfs/dbraw/zinc/62/38/14/409623814.db2.gz	PMDHQMOOWZFLDO-SMDDNHRTSA-N	1	1	305.334	1.014	20	5		DDBDMO
O=C1[C@H]([N@H+]2CC[C@H](CO)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000304432673	409623822	/nfs/dbraw/zinc/62/38/22/409623822.db2.gz	PMDHQMOOWZFLDO-SMDDNHRTSA-N	1	1	305.334	1.014	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC(C)(C)O	ZINC000304121991	409577956	/nfs/dbraw/zinc/57/79/56/409577956.db2.gz	RFHHEXAPMIZBFR-UHFFFAOYSA-N	1	1	309.366	1.935	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C2CC2)C[C@H]1C	ZINC000342451402	409642714	/nfs/dbraw/zinc/64/27/14/409642714.db2.gz	PAVZHJAPORMNHZ-YMTOWFKASA-N	1	1	304.350	1.511	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2ccc(C(=O)NC)cc2[N+](=O)[O-])C[C@H]1C	ZINC000345167194	409654638	/nfs/dbraw/zinc/65/46/38/409654638.db2.gz	XVMKPUBDQJDZCV-NEPJUHHUSA-N	1	1	320.393	1.873	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356851428	409665875	/nfs/dbraw/zinc/66/58/75/409665875.db2.gz	MPTRJULPERWSEL-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000356851428	409665884	/nfs/dbraw/zinc/66/58/84/409665884.db2.gz	MPTRJULPERWSEL-RKDXNWHRSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[N@@H+](CC[C@@H]1CCCO1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000342602185	409757063	/nfs/dbraw/zinc/75/70/63/409757063.db2.gz	LWWGOVZWSFESCM-KBPBESRZSA-N	1	1	324.377	1.835	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)C[C@@H]1C	ZINC000354385294	409814538	/nfs/dbraw/zinc/81/45/38/409814538.db2.gz	CTOWRJJSCWJBOP-WCQYABFASA-N	1	1	323.397	1.431	20	5		DDBDMO
C[C@@H]([NH3+])C[C@@H](C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-]	ZINC000320233249	409904011	/nfs/dbraw/zinc/90/40/11/409904011.db2.gz	HQWCRHGZFNNQIQ-HTQZYQBOSA-N	1	1	305.331	1.138	20	5		DDBDMO
CC[N@@H+]1CCO[C@H](C(=O)NCc2cccc([N+](=O)[O-])c2C)C1	ZINC000357154822	409907443	/nfs/dbraw/zinc/90/74/43/409907443.db2.gz	FKXLWESIFCHIGF-AWEZNQCLSA-N	1	1	307.350	1.240	20	5		DDBDMO
CC[N@H+]1CCO[C@H](C(=O)NCc2cccc([N+](=O)[O-])c2C)C1	ZINC000357154822	409907450	/nfs/dbraw/zinc/90/74/50/409907450.db2.gz	FKXLWESIFCHIGF-AWEZNQCLSA-N	1	1	307.350	1.240	20	5		DDBDMO
CC(C)[C@H](CNc1ccncc1[N+](=O)[O-])N1CC[NH+](C)CC1	ZINC000316708002	409858292	/nfs/dbraw/zinc/85/82/92/409858292.db2.gz	ZFZJIULWDLHROF-AWEZNQCLSA-N	1	1	307.398	1.674	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCOC[C@H](C)C1	ZINC000332355522	410088475	/nfs/dbraw/zinc/08/84/75/410088475.db2.gz	PVAOXFIMSDRNFB-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCOC[C@H](C)C1	ZINC000332355522	410088484	/nfs/dbraw/zinc/08/84/84/410088484.db2.gz	PVAOXFIMSDRNFB-NEPJUHHUSA-N	1	1	307.350	1.890	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2CCn3cc[nH+]c3C2)n1	ZINC000343041832	410096140	/nfs/dbraw/zinc/09/61/40/410096140.db2.gz	GWXWIDCXVMUTNS-SECBINFHSA-N	1	1	317.305	1.400	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C1(CCO)CCOCC1	ZINC000355021056	410247149	/nfs/dbraw/zinc/24/71/49/410247149.db2.gz	ZBGKANCPTFQJLF-UHFFFAOYSA-N	1	1	324.377	1.837	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)[C@H](CC)CN1C(C)=O	ZINC000357907374	410321499	/nfs/dbraw/zinc/32/14/99/410321499.db2.gz	FEJWCSRNMBXCBN-ZIAGYGMSSA-N	1	1	323.397	1.513	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](C)[N@H+](C)C[C@@H]1C	ZINC000352013314	410411913	/nfs/dbraw/zinc/41/19/13/410411913.db2.gz	IPRQUWYDWRMPJD-QWRGUYRKSA-N	1	1	309.370	1.041	20	5		DDBDMO
COc1ccc(C(=O)N[C@H]2CCC[N@@H+](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000343525035	410508676	/nfs/dbraw/zinc/50/86/76/410508676.db2.gz	LSZZEVSEIMJNMJ-PWSUYJOCSA-N	1	1	307.350	1.816	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)[C@@H]1CCCOC1	ZINC000352203421	410544652	/nfs/dbraw/zinc/54/46/52/410544652.db2.gz	RRUXDFFSQLKSSD-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H]1CCCOC1	ZINC000352203421	410544656	/nfs/dbraw/zinc/54/46/56/410544656.db2.gz	RRUXDFFSQLKSSD-GFCCVEGCSA-N	1	1	323.349	1.653	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000359519092	410704382	/nfs/dbraw/zinc/70/43/82/410704382.db2.gz	QVMRSNAXQAYQHG-GFCCVEGCSA-N	1	1	308.382	1.880	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H]1CCO)Nc1ccccc1[N+](=O)[O-]	ZINC000337409949	410764471	/nfs/dbraw/zinc/76/44/71/410764471.db2.gz	LCCGQADXXQZTFB-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000302750016	410857527	/nfs/dbraw/zinc/85/75/27/410857527.db2.gz	GWKLHYSZFDCPBI-GXSJLCMTSA-N	1	1	320.349	1.814	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CC[N@H+](C)C[C@@H]1C	ZINC000330663424	410859457	/nfs/dbraw/zinc/85/94/57/410859457.db2.gz	FCCVQLYOJRHALH-LBPRGKRZSA-N	1	1	306.366	1.478	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC[N@H+](C)C[C@H]1C	ZINC000330665857	410862529	/nfs/dbraw/zinc/86/25/29/410862529.db2.gz	HJMAGSLFNVTKRL-GFCCVEGCSA-N	1	1	306.366	1.478	20	5		DDBDMO
CC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@@H+]1C[C@H](C)O	ZINC000330602312	410817489	/nfs/dbraw/zinc/81/74/89/410817489.db2.gz	FHKOUZBNQXMHOU-GXTWGEPZSA-N	1	1	323.393	1.577	20	5		DDBDMO
CC[C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O	ZINC000330602312	410817498	/nfs/dbraw/zinc/81/74/98/410817498.db2.gz	FHKOUZBNQXMHOU-GXTWGEPZSA-N	1	1	323.393	1.577	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000359809572	410893194	/nfs/dbraw/zinc/89/31/94/410893194.db2.gz	QLVCZUSGVSTSNL-SNVBAGLBSA-N	1	1	309.370	1.422	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)CC1(O)CCC1	ZINC000353481976	411021220	/nfs/dbraw/zinc/02/12/20/411021220.db2.gz	DTKAMKJZRYOSKH-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC(O)C1	ZINC000353498200	411033238	/nfs/dbraw/zinc/03/32/38/411033238.db2.gz	UGAZJJIBWBSGEC-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC(O)C1	ZINC000353498200	411033245	/nfs/dbraw/zinc/03/32/45/411033245.db2.gz	UGAZJJIBWBSGEC-UHFFFAOYSA-N	1	1	313.741	1.642	20	5		DDBDMO
COc1cc(C[NH2+]Cc2cnc(C)[nH]c2=O)c([N+](=O)[O-])cc1O	ZINC000344332604	411094554	/nfs/dbraw/zinc/09/45/54/411094554.db2.gz	OTWGGHYNOLIBRN-UHFFFAOYSA-N	1	1	320.305	1.403	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1c([N+](=O)[O-])cnn1C	ZINC000129571616	196058977	/nfs/dbraw/zinc/05/89/77/196058977.db2.gz	DIDQJMAECMOXLG-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000516314129	416721460	/nfs/dbraw/zinc/72/14/60/416721460.db2.gz	XHVVEDRPFPUWRR-NXEZZACHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000516314129	416721462	/nfs/dbraw/zinc/72/14/62/416721462.db2.gz	XHVVEDRPFPUWRR-NXEZZACHSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360945989	418551718	/nfs/dbraw/zinc/55/17/18/418551718.db2.gz	SUXNAGYZENRUNZ-MFKMUULPSA-N	1	1	318.377	1.849	20	5		DDBDMO
CCc1nn(C)c(NC[C@@H]2CCC[N@H+]2CCOC)c1[N+](=O)[O-]	ZINC000360967103	418556641	/nfs/dbraw/zinc/55/66/41/418556641.db2.gz	WZIMKJVAABQKBE-NSHDSACASA-N	1	1	311.386	1.413	20	5		DDBDMO
O=C1[C@@H]([N@@H+]2C[C@@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316762	418628155	/nfs/dbraw/zinc/62/81/55/418628155.db2.gz	ZHMWGBYYEFISPT-UONOGXRCSA-N	1	1	317.345	1.157	20	5		DDBDMO
O=C1[C@@H]([N@H+]2C[C@@H](O)C3(CC3)C2)CCN1c1cccc([N+](=O)[O-])c1	ZINC000375316762	418628156	/nfs/dbraw/zinc/62/81/56/418628156.db2.gz	ZHMWGBYYEFISPT-UONOGXRCSA-N	1	1	317.345	1.157	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000361427936	418650860	/nfs/dbraw/zinc/65/08/60/418650860.db2.gz	WGDZQNFAWDESAN-CQSZACIVSA-N	1	1	319.361	1.329	20	5		DDBDMO
CC1(C)[C@H](O)CC[N@H+]1CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000361427936	418650863	/nfs/dbraw/zinc/65/08/63/418650863.db2.gz	WGDZQNFAWDESAN-CQSZACIVSA-N	1	1	319.361	1.329	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000361361229	418634680	/nfs/dbraw/zinc/63/46/80/418634680.db2.gz	DLPCIWCGZTTYHS-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
CO[C@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362572	418636141	/nfs/dbraw/zinc/63/61/41/418636141.db2.gz	TYPVGOVIHFKGSI-NEPJUHHUSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1	ZINC000361362572	418636144	/nfs/dbraw/zinc/63/61/44/418636144.db2.gz	TYPVGOVIHFKGSI-NEPJUHHUSA-N	1	1	307.350	1.951	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](CC(N)=O)C1	ZINC000367995054	418671439	/nfs/dbraw/zinc/67/14/39/418671439.db2.gz	XRBUYXLXWCYHGV-LLVKDONJSA-N	1	1	320.349	1.039	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000367995054	418671440	/nfs/dbraw/zinc/67/14/40/418671440.db2.gz	XRBUYXLXWCYHGV-LLVKDONJSA-N	1	1	320.349	1.039	20	5		DDBDMO
[NH3+]C[C@@H]1CC[C@@H](NS(=O)(=O)c2c(F)cccc2[N+](=O)[O-])C1	ZINC000382486491	418731099	/nfs/dbraw/zinc/73/10/99/418731099.db2.gz	GTGOHOPRRAUTAQ-RKDXNWHRSA-N	1	1	317.342	1.140	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3c4c(ccc3[N+](=O)[O-])NCC4)C[C@H]21	ZINC000408404819	418801766	/nfs/dbraw/zinc/80/17/66/418801766.db2.gz	JWRRITFUDABSQC-KGLIPLIRSA-N	1	1	304.350	1.082	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CC[C@H](Oc2ccccc2)C1	ZINC000371825690	418820510	/nfs/dbraw/zinc/82/05/10/418820510.db2.gz	XRPUQOWYRGBFKX-ZDUSSCGKSA-N	1	1	302.334	1.982	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CC[C@H](Oc2ccccc2)C1	ZINC000371825690	418820513	/nfs/dbraw/zinc/82/05/13/418820513.db2.gz	XRPUQOWYRGBFKX-ZDUSSCGKSA-N	1	1	302.334	1.982	20	5		DDBDMO
COc1ccc(OCCN2CCC[N@@H+](C)CC2)c([N+](=O)[O-])c1	ZINC000411150677	418873914	/nfs/dbraw/zinc/87/39/14/418873914.db2.gz	XDOKTSWEFVOFDY-UHFFFAOYSA-N	1	1	309.366	1.620	20	5		DDBDMO
C[N@H+]1CCCN([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000411157155	418874871	/nfs/dbraw/zinc/87/48/71/418874871.db2.gz	PXZGOYHOVWKEFD-HNNXBMFYSA-N	1	1	318.377	1.338	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CC[C@H](n3cncn3)C2)cc1	ZINC000372483319	418875844	/nfs/dbraw/zinc/87/58/44/418875844.db2.gz	UIJHTGYPADMOLL-AWEZNQCLSA-N	1	1	317.349	1.902	20	5		DDBDMO
CC(C)(O)C[N@H+]1CCCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000372552581	418882674	/nfs/dbraw/zinc/88/26/74/418882674.db2.gz	KESNRPZYJSJEDK-UHFFFAOYSA-N	1	1	307.394	1.873	20	5		DDBDMO
Cn1ccnc1[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000365633760	418885806	/nfs/dbraw/zinc/88/58/06/418885806.db2.gz	WIWGCESWCKCTOQ-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
Cn1ccnc1[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000365633760	418885810	/nfs/dbraw/zinc/88/58/10/418885810.db2.gz	WIWGCESWCKCTOQ-LLVKDONJSA-N	1	1	304.354	1.441	20	5		DDBDMO
COCC[C@H]1COCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000365846812	418915939	/nfs/dbraw/zinc/91/59/39/418915939.db2.gz	KNWAHHBYHYKQOR-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
COCC[C@H]1COCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000365846812	418915940	/nfs/dbraw/zinc/91/59/40/418915940.db2.gz	KNWAHHBYHYKQOR-AWEZNQCLSA-N	1	1	310.350	1.711	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1CCO	ZINC000426215037	419405389	/nfs/dbraw/zinc/40/53/89/419405389.db2.gz	HQYHBTWWEVELDJ-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1CCO	ZINC000426215037	419405398	/nfs/dbraw/zinc/40/53/98/419405398.db2.gz	HQYHBTWWEVELDJ-GFCCVEGCSA-N	1	1	307.350	1.689	20	5		DDBDMO
O=C(CC[N@@H+](C1CC1)C1COC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000411775928	419405479	/nfs/dbraw/zinc/40/54/79/419405479.db2.gz	ZCXJGSJOJLHOGE-UHFFFAOYSA-N	1	1	305.334	1.787	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000421008934	419444508	/nfs/dbraw/zinc/44/45/08/419444508.db2.gz	HHEWYXVBYPLVEQ-QMTHXVAHSA-N	1	1	308.334	1.807	20	5		DDBDMO
C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000421008934	419444517	/nfs/dbraw/zinc/44/45/17/419444517.db2.gz	HHEWYXVBYPLVEQ-QMTHXVAHSA-N	1	1	308.334	1.807	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@]23CCOC3)c1	ZINC000421041762	419465925	/nfs/dbraw/zinc/46/59/25/419465925.db2.gz	YPJDGCDNRPXWOY-UKRRQHHQSA-N	1	1	308.334	1.199	20	5		DDBDMO
C[C@@H]1C[C@H](O)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000412038602	419579313	/nfs/dbraw/zinc/57/93/13/419579313.db2.gz	OSUXFJMZOKOXFF-RISCZKNCSA-N	1	1	307.350	1.626	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000418539847	419864824	/nfs/dbraw/zinc/86/48/24/419864824.db2.gz	NXBADLFGNXPDMX-UHFFFAOYSA-N	1	1	314.292	1.257	20	5		DDBDMO
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCC(F)(F)C[NH3+]	ZINC000414939621	419884601	/nfs/dbraw/zinc/88/46/01/419884601.db2.gz	ZCSWEDVFXVTHMF-VIFPVBQESA-N	1	1	316.308	1.496	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)NCCC[NH+]1CCN(C)CC1	ZINC000299655989	229304694	/nfs/dbraw/zinc/30/46/94/229304694.db2.gz	PNEAYXYMBUUSEC-UHFFFAOYSA-N	1	1	320.393	1.271	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NC[C@H]([NH3+])C1CC1	ZINC000423317288	420011273	/nfs/dbraw/zinc/01/12/73/420011273.db2.gz	KGMTZPDVIJGKJM-YGRLFVJLSA-N	1	1	306.366	1.639	20	5		DDBDMO
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H](N)C1CC1	ZINC000423317288	420011276	/nfs/dbraw/zinc/01/12/76/420011276.db2.gz	KGMTZPDVIJGKJM-YGRLFVJLSA-N	1	1	306.366	1.639	20	5		DDBDMO
Cn1c2cc(F)ccc2[nH+]c1NCCn1cc([N+](=O)[O-])cn1	ZINC000431404129	420238179	/nfs/dbraw/zinc/23/81/79/420238179.db2.gz	NZYJMCWVBHAFDW-UHFFFAOYSA-N	1	1	304.285	1.929	20	5		DDBDMO
COc1ccc(CN[C@@H](C)C[C@H]2COCC[NH2+]2)cc1[N+](=O)[O-]	ZINC000422951209	533684037	/nfs/dbraw/zinc/68/40/37/533684037.db2.gz	ZWAARSCEDWYBJX-AAEUAGOBSA-N	1	1	309.366	1.460	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000457092332	420610025	/nfs/dbraw/zinc/61/00/25/420610025.db2.gz	XIGCBLCKNDSHMI-CYBMUJFWSA-N	1	1	321.377	1.915	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC2(CCC2)[C@H]2COC[C@@H]21	ZINC000459657308	420840764	/nfs/dbraw/zinc/84/07/64/420840764.db2.gz	FQDQOCPPLVNBHD-KBPBESRZSA-N	1	1	319.361	1.257	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000488717124	421107378	/nfs/dbraw/zinc/10/73/78/421107378.db2.gz	KGBTXMSTHOJIKE-JQWIXIFHSA-N	1	1	318.333	1.848	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000488725761	421108278	/nfs/dbraw/zinc/10/82/78/421108278.db2.gz	BDKBKHIBIKDFHE-VXGBXAGGSA-N	1	1	307.350	1.260	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000456343861	421144782	/nfs/dbraw/zinc/14/47/82/421144782.db2.gz	GTTOMRXRMQFSBP-CYBMUJFWSA-N	1	1	321.377	1.916	20	5		DDBDMO
CC[C@H]1C[N@@H+](CC)CCN1C(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000456379835	421155375	/nfs/dbraw/zinc/15/53/75/421155375.db2.gz	NISFKJVQZWTSBB-NSHDSACASA-N	1	1	308.338	1.252	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CCC[N@@H+]1CCCO	ZINC000450594320	421214335	/nfs/dbraw/zinc/21/43/35/421214335.db2.gz	KIICISMXHIRXGT-NSHDSACASA-N	1	1	314.773	1.902	20	5		DDBDMO
Cc1[nH+]ccn1CCCCNC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000525096697	421277666	/nfs/dbraw/zinc/27/76/66/421277666.db2.gz	IQPZYFITMNSIJW-UHFFFAOYSA-N	1	1	305.338	1.648	20	5		DDBDMO
C[N@H+]1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@H]1c1ccccc1	ZINC000548955260	421487897	/nfs/dbraw/zinc/48/78/97/421487897.db2.gz	ZACBQHAHPAFBLT-CHWSQXEVSA-N	1	1	315.333	1.493	20	5		DDBDMO
C[C@H]1C[C@H]([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000519643614	421712913	/nfs/dbraw/zinc/71/29/13/421712913.db2.gz	WSUGYLISVYPOJL-QWHCGFSZSA-N	1	1	320.393	1.996	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)N1CCN(c2[nH]cc[nH+]2)CC1	ZINC000573525062	421974601	/nfs/dbraw/zinc/97/46/01/421974601.db2.gz	MNXCMIZICFTCNY-UHFFFAOYSA-N	1	1	315.333	1.589	20	5		DDBDMO
C[N@H+]1C[C@@H](CNc2ncc([N+](=O)[O-])cn2)[C@H](c2ccccc2)C1	ZINC000591985362	422328499	/nfs/dbraw/zinc/32/84/99/422328499.db2.gz	HKKDBBMYVBYAAR-HIFRSBDPSA-N	1	1	313.361	2.142	20	5		DDBDMO
CC(C)C[N@@H+](C)CCCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000593480077	422338411	/nfs/dbraw/zinc/33/84/11/422338411.db2.gz	MBOSQXIAUGBJKY-UHFFFAOYSA-N	1	1	306.370	2.027	20	5		DDBDMO
Cc1cc(CO)cc(NCCOc2ccc([N+](=O)[O-])cc2)[nH+]1	ZINC000596123023	422364818	/nfs/dbraw/zinc/36/48/18/422364818.db2.gz	XBOWUHHTRUJTEO-UHFFFAOYSA-N	1	1	303.318	2.281	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H](O)[C@H]1C	ZINC000590762473	422323288	/nfs/dbraw/zinc/32/32/88/422323288.db2.gz	ZTSGLGRQVLBKBL-BXUZGUMPSA-N	1	1	307.350	1.687	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@]12CCOC2	ZINC000341956078	271258791	/nfs/dbraw/zinc/25/87/91/271258791.db2.gz	SKIYNELTTRYQKY-CJNGLKHVSA-N	1	1	322.361	1.589	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CCC[N@@H+](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000345308425	272215409	/nfs/dbraw/zinc/21/54/09/272215409.db2.gz	WZBOILMMRLHXGD-VHSXEESVSA-N	1	1	309.370	1.654	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000172940884	275035866	/nfs/dbraw/zinc/03/58/66/275035866.db2.gz	XYVJLBNPFBYHTD-CYBMUJFWSA-N	1	1	323.368	1.888	20	5		DDBDMO
O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CC[C@H](CN2CCOCC2)C1	ZINC000172940884	275035867	/nfs/dbraw/zinc/03/58/67/275035867.db2.gz	XYVJLBNPFBYHTD-CYBMUJFWSA-N	1	1	323.368	1.888	20	5		DDBDMO
CCN1CC[NH+]([C@@H]2CCN(c3ccc(N)cc3[N+](=O)[O-])C2)CC1	ZINC000287222681	276199085	/nfs/dbraw/zinc/19/90/85/276199085.db2.gz	ITYHSJKMISFBTO-CQSZACIVSA-N	1	1	319.409	1.393	20	5		DDBDMO
C[N@H+]1CCO[C@H]2CN(c3ccc4cc([N+](=O)[O-])ccc4n3)C[C@@H]21	ZINC000153110538	277131406	/nfs/dbraw/zinc/13/14/06/277131406.db2.gz	LTIMTAYWLLBBPA-GJZGRUSLSA-N	1	1	314.345	1.662	20	5		DDBDMO
CNC(=O)CC[N@@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C	ZINC000170917241	277226153	/nfs/dbraw/zinc/22/61/53/277226153.db2.gz	PCGKOUURVOSUAA-UHFFFAOYSA-N	1	1	309.366	1.950	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332584815	278264886	/nfs/dbraw/zinc/26/48/86/278264886.db2.gz	IAQOHTLHEPBUQT-LBPRGKRZSA-N	1	1	306.366	1.069	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000332584815	278264888	/nfs/dbraw/zinc/26/48/88/278264888.db2.gz	IAQOHTLHEPBUQT-LBPRGKRZSA-N	1	1	306.366	1.069	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NCC[NH+]1CCSCC1	ZINC000264827604	279800075	/nfs/dbraw/zinc/80/00/75/279800075.db2.gz	SKKXCINKQKAVDP-UHFFFAOYSA-N	1	1	309.391	1.302	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933162	281029923	/nfs/dbraw/zinc/02/99/23/281029923.db2.gz	DLNGUECRMIZDCE-QWHCGFSZSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H](O)[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000089933162	281029925	/nfs/dbraw/zinc/02/99/25/281029925.db2.gz	DLNGUECRMIZDCE-QWHCGFSZSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000125286807	281205837	/nfs/dbraw/zinc/20/58/37/281205837.db2.gz	LJSJMAZWIYLTEW-ZDUSSCGKSA-N	1	1	318.377	1.757	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2c2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290732637	290241077	/nfs/dbraw/zinc/24/10/77/290241077.db2.gz	GCQVBDUUNXUHKH-JQWIXIFHSA-N	1	1	319.365	1.009	20	5		DDBDMO
C[N@H+]1CCC[C@@H](N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000369353102	301170370	/nfs/dbraw/zinc/17/03/70/301170370.db2.gz	BLYCICCETVHSGG-QGZVFWFLSA-N	1	1	318.421	1.807	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3C[C@@H](O)C[C@@H]3CO)o2)c1	ZINC000370385923	301328143	/nfs/dbraw/zinc/32/81/43/301328143.db2.gz	HLDKAWJFYPQMRQ-KGLIPLIRSA-N	1	1	318.329	1.782	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1	ZINC000376307852	302061395	/nfs/dbraw/zinc/06/13/95/302061395.db2.gz	QCLVJRIPKQUMSI-UHFFFAOYSA-N	1	1	307.354	1.130	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1	ZINC000530819581	303214039	/nfs/dbraw/zinc/21/40/39/303214039.db2.gz	WOBPIFUDQADKAG-ZDUSSCGKSA-N	1	1	320.393	1.737	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N[C@@H]1CCCC[C@@H]1[NH+]1CCOCC1	ZINC000531912025	303265718	/nfs/dbraw/zinc/26/57/18/303265718.db2.gz	QPXMKRKSUVLUTE-NEPJUHHUSA-N	1	1	309.370	1.384	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)cc1[N+](=O)[O-]	ZINC000536608799	303365532	/nfs/dbraw/zinc/36/55/32/303365532.db2.gz	RRAFJVGRAVLPBN-NEPJUHHUSA-N	1	1	321.377	1.697	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000561216286	303835424	/nfs/dbraw/zinc/83/54/24/303835424.db2.gz	SPTVUNUDXOBYAN-UHFFFAOYSA-N	1	1	314.292	1.257	20	5		DDBDMO
COC(=O)C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCOC1	ZINC000361732383	307004844	/nfs/dbraw/zinc/00/48/44/307004844.db2.gz	CEGXAXBNRYVPEV-AWEZNQCLSA-N	1	1	312.297	1.546	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H](c3ccncn3)C2)n1	ZINC000363428955	307027828	/nfs/dbraw/zinc/02/78/28/307027828.db2.gz	FNFJTZQLRHZKIQ-LBPRGKRZSA-N	1	1	302.338	1.461	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+](C2CC2)CC1	ZINC000372894233	307175710	/nfs/dbraw/zinc/17/57/10/307175710.db2.gz	YCCJGENSGILAKK-UHFFFAOYSA-N	1	1	319.361	1.914	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ncccc3O)C2)nc1	ZINC000565976313	308039905	/nfs/dbraw/zinc/03/99/05/308039905.db2.gz	AWDCFFKUPHWXLH-NSHDSACASA-N	1	1	315.333	1.777	20	5		DDBDMO
C[C@@H](CCN(C)C)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000572714622	308222832	/nfs/dbraw/zinc/22/28/32/308222832.db2.gz	RQYSJKBVGMQUML-LBPRGKRZSA-N	1	1	308.382	1.853	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000582367942	326020592	/nfs/dbraw/zinc/02/05/92/326020592.db2.gz	NJISUZKRKDJBQY-HNNXBMFYSA-N	1	1	307.394	1.872	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1CCCO	ZINC000452344048	534333802	/nfs/dbraw/zinc/33/38/02/534333802.db2.gz	CEPBCOXNDTVKRL-AWEZNQCLSA-N	1	1	321.377	1.480	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@H](CCC[N@@H+]2C)C1	ZINC000154398279	527313373	/nfs/dbraw/zinc/31/33/73/527313373.db2.gz	DWVCBCMWPDXPEA-DOMZBBRYSA-N	1	1	318.377	1.855	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000330890007	528548312	/nfs/dbraw/zinc/54/83/12/528548312.db2.gz	BPXYYFSFWDHXDO-VHSXEESVSA-N	1	1	309.370	1.483	20	5		DDBDMO
CC[N@@H+](CCNc1ccc(-c2nn[nH]n2)cc1[N+](=O)[O-])C(C)C	ZINC000736536540	598352676	/nfs/dbraw/zinc/35/26/76/598352676.db2.gz	LBECYSCQPOIHKU-UHFFFAOYSA-N	1	1	319.369	1.917	20	5		DDBDMO
Cc1cccc(NCCNC(=O)c2ccc(N)c([N+](=O)[O-])c2)[nH+]1	ZINC000126353595	696761626	/nfs/dbraw/zinc/76/16/26/696761626.db2.gz	KFGRLHFHZIWRHC-UHFFFAOYSA-N	1	1	315.333	1.722	20	5		DDBDMO
COc1ccccc1OCC[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000176213668	697403135	/nfs/dbraw/zinc/40/31/35/697403135.db2.gz	GPLUCOGAFNFJCG-UHFFFAOYSA-N	1	1	320.349	1.811	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCSC[C@H]2CCO)cc1	ZINC000776585904	698122085	/nfs/dbraw/zinc/12/20/85/698122085.db2.gz	CTBGIDVLTUBFEA-KGLIPLIRSA-N	1	1	312.391	1.428	20	5		DDBDMO
COCCO[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000781961836	698666413	/nfs/dbraw/zinc/66/64/13/698666413.db2.gz	JQDUYENKQWAOEK-CABCVRRESA-N	1	1	310.350	1.366	20	5		DDBDMO
Cc1nn(CN2CC[N@@H+](C3CCOCC3)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000782914319	698784124	/nfs/dbraw/zinc/78/41/24/698784124.db2.gz	SNVONUHHIOPWHE-GFCCVEGCSA-N	1	1	323.397	1.242	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1csc([N+](=O)[O-])c1	ZINC000750883195	700254388	/nfs/dbraw/zinc/25/43/88/700254388.db2.gz	QHIUGKOPASXAQF-UHFFFAOYSA-N	1	1	300.336	1.535	20	5		DDBDMO
COCC[N@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@@H]1CCOC1	ZINC000782960569	698789156	/nfs/dbraw/zinc/78/91/56/698789156.db2.gz	HDQOBSMGQTVDRZ-CQSZACIVSA-N	1	1	320.349	1.639	20	5		DDBDMO
COCC[N@@H+](Cn1ncc2ccc([N+](=O)[O-])cc21)[C@@H]1CCOC1	ZINC000782960569	698789157	/nfs/dbraw/zinc/78/91/57/698789157.db2.gz	HDQOBSMGQTVDRZ-CQSZACIVSA-N	1	1	320.349	1.639	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(CCC[NH2+]3)C2)c1[N+](=O)[O-]	ZINC000424023265	699147409	/nfs/dbraw/zinc/14/74/09/699147409.db2.gz	FJWPWKLCQBBFAB-AWEZNQCLSA-N	1	1	307.354	1.239	20	5		DDBDMO
COC(=O)[C@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]1C	ZINC000787247953	699199942	/nfs/dbraw/zinc/19/99/42/699199942.db2.gz	VTIRFWYJRVRZCZ-GWCFXTLKSA-N	1	1	318.333	1.785	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]1C	ZINC000787247953	699199943	/nfs/dbraw/zinc/19/99/43/699199943.db2.gz	VTIRFWYJRVRZCZ-GWCFXTLKSA-N	1	1	318.333	1.785	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@@H+]3CCOC[C@@H]3C2)c1	ZINC000754081543	700481532	/nfs/dbraw/zinc/48/15/32/700481532.db2.gz	LUOJQPVTSUJMIW-JTQLQIEISA-N	1	1	311.313	1.263	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@H+]3CCOC[C@@H]3C2)c1	ZINC000754081543	700481533	/nfs/dbraw/zinc/48/15/33/700481533.db2.gz	LUOJQPVTSUJMIW-JTQLQIEISA-N	1	1	311.313	1.263	20	5		DDBDMO
Cc1[nH+]ccn1CCCOC(=O)c1cccc([N+](=O)[O-])c1N	ZINC000767665123	701127239	/nfs/dbraw/zinc/12/72/39/701127239.db2.gz	JYUBQVQGPLMHLZ-UHFFFAOYSA-N	1	1	304.306	1.929	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCO[C@@]3(CCOC3)C2)cc1	ZINC000769220540	701237334	/nfs/dbraw/zinc/23/73/34/701237334.db2.gz	MCERGUOIDGXQHK-CABCVRRESA-N	1	1	308.334	1.120	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCO[C@@]3(CCOC3)C2)cc1	ZINC000769220540	701237335	/nfs/dbraw/zinc/23/73/35/701237335.db2.gz	MCERGUOIDGXQHK-CABCVRRESA-N	1	1	308.334	1.120	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@@H]1C[N@H+](C)CCO1	ZINC000770474559	701279500	/nfs/dbraw/zinc/27/95/00/701279500.db2.gz	BLXWGIBIDQMIGU-KCJUWKMLSA-N	1	1	307.310	1.262	20	5		DDBDMO
C[C@@H](Nc1ccc([N+](=O)[O-])c2nonc21)[C@@H]1C[N@@H+](C)CCO1	ZINC000770474559	701279501	/nfs/dbraw/zinc/27/95/01/701279501.db2.gz	BLXWGIBIDQMIGU-KCJUWKMLSA-N	1	1	307.310	1.262	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406645	701318776	/nfs/dbraw/zinc/31/87/76/701318776.db2.gz	PDVKGQFKAGFYLB-QWRGUYRKSA-N	1	1	306.366	1.650	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@@H]2C)c(N)c([N+](=O)[O-])c1	ZINC000771406645	701318777	/nfs/dbraw/zinc/31/87/77/701318777.db2.gz	PDVKGQFKAGFYLB-QWRGUYRKSA-N	1	1	306.366	1.650	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000771407589	701318930	/nfs/dbraw/zinc/31/89/30/701318930.db2.gz	RRVCBVIPLPVKEN-NWDGAFQWSA-N	1	1	320.393	1.825	20	5		DDBDMO
C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000771407589	701318932	/nfs/dbraw/zinc/31/89/32/701318932.db2.gz	RRVCBVIPLPVKEN-NWDGAFQWSA-N	1	1	320.393	1.825	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](C)N1CC[NH+](C)CC1	ZINC000807960071	701492279	/nfs/dbraw/zinc/49/22/79/701492279.db2.gz	LFYHIUYDTDJUIK-LBPRGKRZSA-N	1	1	320.393	1.845	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000840093263	701965360	/nfs/dbraw/zinc/96/53/60/701965360.db2.gz	IZTDFTPIHRKOCW-LLVKDONJSA-N	1	1	320.349	1.486	20	5		DDBDMO
CC[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCOC1	ZINC000812296365	702140682	/nfs/dbraw/zinc/14/06/82/702140682.db2.gz	PTMAWDSXNROMTO-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
CC[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCOC1	ZINC000812296365	702140685	/nfs/dbraw/zinc/14/06/85/702140685.db2.gz	PTMAWDSXNROMTO-CQSZACIVSA-N	1	1	317.349	1.922	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)S(=O)(=O)c1csc([N+](=O)[O-])c1	ZINC000817151531	702290830	/nfs/dbraw/zinc/29/08/30/702290830.db2.gz	SVKOOZSOFVUZIF-VIFPVBQESA-N	1	1	319.408	1.371	20	5		DDBDMO
CN(CC[NH+]1CC2(C1)CCOCC2)c1ncc([N+](=O)[O-])s1	ZINC000866257082	706659378	/nfs/dbraw/zinc/65/93/78/706659378.db2.gz	FIOFBNCZDFWOPO-UHFFFAOYSA-N	1	1	312.395	1.600	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCNC(=O)Cc2cccc(F)c2[N+](=O)[O-])C1	ZINC000866271485	706662179	/nfs/dbraw/zinc/66/21/79/706662179.db2.gz	MCNYLOYVFFBFGW-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
C[N@@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000848035478	703498344	/nfs/dbraw/zinc/49/83/44/703498344.db2.gz	VUOKRBMQLKBMPO-ZDUSSCGKSA-N	1	1	307.350	1.181	20	5		DDBDMO
C[N@H+]1CCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(C)C	ZINC000848035478	703498345	/nfs/dbraw/zinc/49/83/45/703498345.db2.gz	VUOKRBMQLKBMPO-ZDUSSCGKSA-N	1	1	307.350	1.181	20	5		DDBDMO
CNC(=O)C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000879753463	706779766	/nfs/dbraw/zinc/77/97/66/706779766.db2.gz	BFQOPUVRFKVJSW-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
CNC(=O)C[N@@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1	ZINC000879753463	706779768	/nfs/dbraw/zinc/77/97/68/706779768.db2.gz	BFQOPUVRFKVJSW-UHFFFAOYSA-N	1	1	317.349	1.040	20	5		DDBDMO
Nc1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000853964790	704341573	/nfs/dbraw/zinc/34/15/73/704341573.db2.gz	APXVDNZTLNQIOM-ZDUSSCGKSA-N	1	1	306.366	1.212	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N1CCC[C@@]2(CC[N@H+](C)C2)C1	ZINC000821030224	704361861	/nfs/dbraw/zinc/36/18/61/704361861.db2.gz	CPCSHHBHTPMPND-HNNXBMFYSA-N	1	1	321.381	1.044	20	5		DDBDMO
CCN(C(=O)c1cc([N+](=O)[O-])c(F)cc1N)[C@@H]1CC[N@@H+](CC)C1	ZINC000855490729	704487563	/nfs/dbraw/zinc/48/75/63/704487563.db2.gz	KOJNWZXLZVHLCQ-SNVBAGLBSA-N	1	1	324.356	1.872	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[C@H]2C[N@H+](C)C[C@H]21	ZINC000823100736	705139574	/nfs/dbraw/zinc/13/95/74/705139574.db2.gz	IHNCATLRNQNNMQ-GXTWGEPZSA-N	1	1	303.362	1.988	20	5		DDBDMO
C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)CC1(C)COC1	ZINC000863296163	705893093	/nfs/dbraw/zinc/89/30/93/705893093.db2.gz	KAUNPOLJNVCLTM-UHFFFAOYSA-N	1	1	317.349	1.779	20	5		DDBDMO
C[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1)CC1(C)COC1	ZINC000863296163	705893095	/nfs/dbraw/zinc/89/30/95/705893095.db2.gz	KAUNPOLJNVCLTM-UHFFFAOYSA-N	1	1	317.349	1.779	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)cc1	ZINC000877789315	706214079	/nfs/dbraw/zinc/21/40/79/706214079.db2.gz	IENXCGBOHLGGCA-ZIAGYGMSSA-N	1	1	324.402	1.504	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H]3CS(=O)(=O)C[C@H]3C2)cc1	ZINC000877789315	706214081	/nfs/dbraw/zinc/21/40/81/706214081.db2.gz	IENXCGBOHLGGCA-ZIAGYGMSSA-N	1	1	324.402	1.504	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CO)(CO)CC1	ZINC000877797145	706218811	/nfs/dbraw/zinc/21/88/11/706218811.db2.gz	DGYBIDPDBLRDFF-UHFFFAOYSA-N	1	1	324.377	1.560	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000877892711	706233560	/nfs/dbraw/zinc/23/35/60/706233560.db2.gz	CKHQCDFIYVNJEA-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
CCN(OC)C(=O)CNc1cc[nH+]c2ccc([N+](=O)[O-])cc12	ZINC000865901586	706557709	/nfs/dbraw/zinc/55/77/09/706557709.db2.gz	YIYQZWISDIMSAM-UHFFFAOYSA-N	1	1	304.306	1.387	20	5		DDBDMO
NC(=O)[C@H](F)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000879045931	706571558	/nfs/dbraw/zinc/57/15/58/706571558.db2.gz	OIEMWSARSHRYKU-CYBMUJFWSA-N	1	1	313.304	1.769	20	5		DDBDMO
CC(C)(O)[C@H]1CC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000880138960	706888230	/nfs/dbraw/zinc/88/82/30/706888230.db2.gz	JGQOKTFDKRDWDK-GXTWGEPZSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000867147789	706909253	/nfs/dbraw/zinc/90/92/53/706909253.db2.gz	OJTOCWCQVJXYPU-MNOVXSKESA-N	1	1	309.341	1.827	20	5		DDBDMO
CC(=O)N1C[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C[C@@H]2C1	ZINC000880311451	706937491	/nfs/dbraw/zinc/93/74/91/706937491.db2.gz	GWXILTCYYRUIMN-BETUJISGSA-N	1	1	307.325	1.644	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[NH2+]C1(c2ncccn2)CCC1	ZINC000880368375	706954838	/nfs/dbraw/zinc/95/48/38/706954838.db2.gz	YDQSAOMJZBZJMV-UHFFFAOYSA-N	1	1	302.338	1.559	20	5		DDBDMO
COc1ccc(C[N@H+](C)[C@@H](CC(C)C)C(N)=O)cc1[N+](=O)[O-]	ZINC000880588447	707029481	/nfs/dbraw/zinc/02/94/81/707029481.db2.gz	VXRNPTLIUAMZPB-ZDUSSCGKSA-N	1	1	309.366	1.935	20	5		DDBDMO
COc1ccc(C[N@@H+](C)[C@@H](CC(C)C)C(N)=O)cc1[N+](=O)[O-]	ZINC000880588447	707029482	/nfs/dbraw/zinc/02/94/82/707029482.db2.gz	VXRNPTLIUAMZPB-ZDUSSCGKSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC(C)(CCC(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)[N+](=O)[O-]	ZINC000834591783	707090639	/nfs/dbraw/zinc/09/06/39/707090639.db2.gz	DMTSSYMXDJAHGX-VXGBXAGGSA-N	1	1	301.362	1.467	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CCC([N@H+]2CC[C@H](O)C2)CC1	ZINC000882636705	707726829	/nfs/dbraw/zinc/72/68/29/707726829.db2.gz	WCUYRQSATSUNSL-NSHDSACASA-N	1	1	310.329	1.164	20	5		DDBDMO
O=[N+]([O-])c1ccc(NC[C@@]2(CO)COCC[NH2+]2)c(C(F)F)c1	ZINC000882731109	707764552	/nfs/dbraw/zinc/76/45/52/707764552.db2.gz	UAZSXQQDEQUVCA-CYBMUJFWSA-N	1	1	317.292	1.295	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3ncnc4sc([N+](=O)[O-])cc43)C[C@]2(C)C1	ZINC000896913470	708181077	/nfs/dbraw/zinc/18/10/77/708181077.db2.gz	RBCRTCRPNRSOIP-OTYXRUKQSA-N	1	1	319.390	1.987	20	5		DDBDMO
C[C@H](CNC(=O)N1CC[NH+](C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000897078919	708224587	/nfs/dbraw/zinc/22/45/87/708224587.db2.gz	YSGUZDFKCHLTRS-GFCCVEGCSA-N	1	1	306.366	1.655	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1N1CC[C@@H]2[C@@H]1CCC[N@H+]2CCO	ZINC000897220808	708258825	/nfs/dbraw/zinc/25/88/25/708258825.db2.gz	DKFGEXUUIIZGCJ-CVEARBPZSA-N	1	1	305.378	1.939	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(Cc2cccnc2[N+](=O)[O-])[C@@H](C)C1	ZINC000886114472	708700620	/nfs/dbraw/zinc/70/06/20/708700620.db2.gz	PTKYOKHFXKWZIG-LBPRGKRZSA-N	1	1	322.365	1.059	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(Cc2cccnc2[N+](=O)[O-])[C@@H](C)C1	ZINC000886114472	708700621	/nfs/dbraw/zinc/70/06/21/708700621.db2.gz	PTKYOKHFXKWZIG-LBPRGKRZSA-N	1	1	322.365	1.059	20	5		DDBDMO
Cc1c(NC(=O)C2C[NH+]([C@H]3CCOC3)C2)cccc1[N+](=O)[O-]	ZINC000899934946	709242447	/nfs/dbraw/zinc/24/24/47/709242447.db2.gz	FNHJSRXWOGIFHB-LBPRGKRZSA-N	1	1	305.334	1.562	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@@]1(O)CCC[N@H+](C)C1	ZINC000899936887	709243452	/nfs/dbraw/zinc/24/34/52/709243452.db2.gz	JFNRWHOERAFCPU-INIZCTEOSA-N	1	1	321.377	1.997	20	5		DDBDMO
O=C(c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000889780163	709631588	/nfs/dbraw/zinc/63/15/88/709631588.db2.gz	IPIMDYMXYREFAD-CABCVRRESA-N	1	1	319.361	1.266	20	5		DDBDMO
O=C(c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCC[N@@H+]2CCO	ZINC000889783127	709634087	/nfs/dbraw/zinc/63/40/87/709634087.db2.gz	VLWISJJKFTVIRV-GJZGRUSLSA-N	1	1	319.361	1.266	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096536	713128950	/nfs/dbraw/zinc/12/89/50/713128950.db2.gz	MVOBRTKUXJWBPO-OCCSQVGLSA-N	1	1	321.402	1.904	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccccc1[N+](=O)[O-]	ZINC000928096536	713128951	/nfs/dbraw/zinc/12/89/51/713128951.db2.gz	MVOBRTKUXJWBPO-OCCSQVGLSA-N	1	1	321.402	1.904	20	5		DDBDMO
C[N@@H+]1C[C@@]2(C)CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000913286021	713191642	/nfs/dbraw/zinc/19/16/42/713191642.db2.gz	XUXNZWFCZNPVIP-IYBDPMFKSA-N	1	1	319.361	1.714	20	5		DDBDMO
C[N@H+]1C[C@@]2(C)CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@]2(C)C1	ZINC000913286021	713191643	/nfs/dbraw/zinc/19/16/43/713191643.db2.gz	XUXNZWFCZNPVIP-IYBDPMFKSA-N	1	1	319.361	1.714	20	5		DDBDMO
Cn1cc[nH+]c1N1CCC(Nc2c([N+](=O)[O-])cnn2C)CC1	ZINC000893443895	710656272	/nfs/dbraw/zinc/65/62/72/710656272.db2.gz	NWNVEDKTZDCOOR-UHFFFAOYSA-N	1	1	305.342	1.143	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000893872508	710867390	/nfs/dbraw/zinc/86/73/90/710867390.db2.gz	KVXNSPKRHFFLFQ-LBPRGKRZSA-N	1	1	307.350	1.574	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@H]2CC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000928558879	713226454	/nfs/dbraw/zinc/22/64/54/713226454.db2.gz	YEBNUEOFQRBWKB-SECBINFHSA-N	1	1	310.329	1.234	20	5		DDBDMO
CN(C)c1cc(F)c(C(=O)NC[C@H]2CC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000928558879	713226456	/nfs/dbraw/zinc/22/64/56/713226456.db2.gz	YEBNUEOFQRBWKB-SECBINFHSA-N	1	1	310.329	1.234	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1ccc(O)c(OC)c1[N+](=O)[O-]	ZINC000894686702	711238316	/nfs/dbraw/zinc/23/83/16/711238316.db2.gz	ARUBDDFGDXGKMP-VXGBXAGGSA-N	1	1	310.350	1.902	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@@H+](C)[C@@H](CO)C1	ZINC000913546382	713252902	/nfs/dbraw/zinc/25/29/02/713252902.db2.gz	OMRCSBCYJJPTKK-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+](C)[C@@H](CO)C1	ZINC000913546382	713252904	/nfs/dbraw/zinc/25/29/04/713252904.db2.gz	OMRCSBCYJJPTKK-SAAWKEMMSA-N	1	1	319.361	1.133	20	5		DDBDMO
C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H]1C[N@@H+](C)CCN1C	ZINC000895247512	711464762	/nfs/dbraw/zinc/46/47/62/711464762.db2.gz	VFFJIHKBBUNXPW-JOYOIKCWSA-N	1	1	313.789	1.689	20	5		DDBDMO
COc1ccc2c(c1)ncc([N+](=O)[O-])c2NC[C@@H]1CC[N@H+]1C	ZINC000895768859	711600819	/nfs/dbraw/zinc/60/08/19/711600819.db2.gz	JMSSXCJBCQFUFA-JTQLQIEISA-N	1	1	302.334	1.690	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(Cn3ncc4cc([N+](=O)[O-])ccc43)C[C@]2(C)C1	ZINC000904438508	711858592	/nfs/dbraw/zinc/85/85/92/711858592.db2.gz	YBSWIZPPMCRYRK-CJNGLKHVSA-N	1	1	315.377	1.786	20	5		DDBDMO
C[C@H](CNC[C@H](O)C[NH+]1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643916	712105096	/nfs/dbraw/zinc/10/50/96/712105096.db2.gz	OLJQCUOLNWWVKV-KGLIPLIRSA-N	1	1	307.394	1.745	20	5		DDBDMO
C[C@H](C[NH2+]C[C@H](O)CN1CCCC1)c1ccccc1[N+](=O)[O-]	ZINC000905643916	712105097	/nfs/dbraw/zinc/10/50/97/712105097.db2.gz	OLJQCUOLNWWVKV-KGLIPLIRSA-N	1	1	307.394	1.745	20	5		DDBDMO
C[N@H+]1CCC[C@H](NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)C1	ZINC000918395546	713541488	/nfs/dbraw/zinc/54/14/88/713541488.db2.gz	PUHJOSZXAQVVJL-LBPRGKRZSA-N	1	1	317.349	1.155	20	5		DDBDMO
C[C@@H]([NH2+]CC[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1	ZINC000930214004	713778906	/nfs/dbraw/zinc/77/89/06/713778906.db2.gz	LXTUHVDGJMENEC-LLVKDONJSA-N	1	1	311.357	1.714	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)CCc2cc(F)ccc2[N+](=O)[O-])C1	ZINC000930362938	713814418	/nfs/dbraw/zinc/81/44/18/713814418.db2.gz	BRWGXFRXUQWHDD-NSHDSACASA-N	1	1	309.341	1.734	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1	ZINC000930875002	713947550	/nfs/dbraw/zinc/94/75/50/713947550.db2.gz	KCVVRENKVGTVFO-ABAIWWIYSA-N	1	1	319.365	1.136	20	5		DDBDMO
C[C@@H]1[C@@H](N(C)C)CC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044509	713989772	/nfs/dbraw/zinc/98/97/72/713989772.db2.gz	NNODNCYMAIEMTG-DOMZBBRYSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[C@@H]1[C@@H](N(C)C)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000931044509	713989775	/nfs/dbraw/zinc/98/97/75/713989775.db2.gz	NNODNCYMAIEMTG-DOMZBBRYSA-N	1	1	320.393	1.948	20	5		DDBDMO
COC1(OC)CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1O	ZINC000931631376	714143102	/nfs/dbraw/zinc/14/31/02/714143102.db2.gz	DPCXFXYSHJYKNR-CQSZACIVSA-N	1	1	310.350	1.459	20	5		DDBDMO
COC1(OC)CC[N@@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C[C@H]1O	ZINC000931631376	714143103	/nfs/dbraw/zinc/14/31/03/714143103.db2.gz	DPCXFXYSHJYKNR-CQSZACIVSA-N	1	1	310.350	1.459	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCc3nc[nH]c3C23CCC3)c1	ZINC000931679005	714159188	/nfs/dbraw/zinc/15/91/88/714159188.db2.gz	RTHAIVWUPJMRLA-UHFFFAOYSA-N	1	1	302.338	1.452	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCc3nc[nH]c3C23CCC3)c1	ZINC000931679005	714159191	/nfs/dbraw/zinc/15/91/91/714159191.db2.gz	RTHAIVWUPJMRLA-UHFFFAOYSA-N	1	1	302.338	1.452	20	5		DDBDMO
CN(C(=O)CN1CC[C@@H](CC[NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000923486168	714372404	/nfs/dbraw/zinc/37/24/04/714372404.db2.gz	CAVDQWMHPAMTGZ-GFCCVEGCSA-N	1	1	306.366	1.228	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000932648671	714376329	/nfs/dbraw/zinc/37/63/29/714376329.db2.gz	ZOGASRYZLCEIQH-GFCCVEGCSA-N	1	1	308.334	1.859	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933229101	714542742	/nfs/dbraw/zinc/54/27/42/714542742.db2.gz	GNXQRYJQEYQTHY-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@H]1C(=O)NCCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000933229101	714542744	/nfs/dbraw/zinc/54/27/44/714542744.db2.gz	GNXQRYJQEYQTHY-KBPBESRZSA-N	1	1	307.350	1.229	20	5		DDBDMO
CO[C@@H]1CCOC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000934042490	714729900	/nfs/dbraw/zinc/72/99/00/714729900.db2.gz	ULGZFGDWDPHIDD-ZIAGYGMSSA-N	1	1	324.333	1.355	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000934131118	714751371	/nfs/dbraw/zinc/75/13/71/714751371.db2.gz	KBRRFIBMVMTPOZ-BPLDGKMQSA-N	1	1	310.350	1.444	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@H]2CC2CCOCC2)c1	ZINC000934637807	714867899	/nfs/dbraw/zinc/86/78/99/714867899.db2.gz	NRFWPUGJDBDNCU-CQSZACIVSA-N	1	1	324.381	1.309	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@H]2CC2CCOCC2)c1	ZINC000934637807	714867901	/nfs/dbraw/zinc/86/79/01/714867901.db2.gz	NRFWPUGJDBDNCU-CQSZACIVSA-N	1	1	324.381	1.309	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12	ZINC001121197460	782403776	/nfs/dbraw/zinc/40/37/76/782403776.db2.gz	ASSVUBAEDOONDS-LERXQTSPSA-N	1	1	319.361	1.673	20	5		DDBDMO
O=C(N[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001022063967	734368584	/nfs/dbraw/zinc/36/85/84/734368584.db2.gz	RFNFJEQGEWNMBC-XJFOESAGSA-N	1	1	323.780	1.742	20	5		DDBDMO
C[C@@H](O)C[NH+]1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC1	ZINC000588538522	734794332	/nfs/dbraw/zinc/79/43/32/734794332.db2.gz	YWVTZMFIBSKNPA-LLPBQKLSSA-N	1	1	319.361	1.133	20	5		DDBDMO
CC(C)(F)C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21	ZINC001025648519	736808899	/nfs/dbraw/zinc/80/88/99/736808899.db2.gz	GFVVBBUBJHSXIK-WDNDVIMCSA-N	1	1	321.352	1.889	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1C	ZINC001020140107	736999370	/nfs/dbraw/zinc/99/93/70/736999370.db2.gz	YSNDLVZKMIXAQD-KLHDSHLOSA-N	1	1	317.389	1.705	20	5		DDBDMO
N=C(NCCCC[NH3+])Nc1ncnc2cc(F)c([N+](=O)[O-])cc21	ZINC001167878430	739167193	/nfs/dbraw/zinc/16/71/93/739167193.db2.gz	RPGVWNGMRDUZAF-UHFFFAOYSA-N	1	1	321.316	1.352	20	5		DDBDMO
O=C(NC1CC[NH+](Cc2cccc(F)c2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001002784271	743422996	/nfs/dbraw/zinc/42/29/96/743422996.db2.gz	AEEBZWPUBRJGML-HUUCEWRRSA-N	1	1	321.352	1.572	20	5		DDBDMO
CN1C[C@@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@H+](C)C3)CC1=O	ZINC001168725892	747981135	/nfs/dbraw/zinc/98/11/35/747981135.db2.gz	HYSBRLIOMMWUQV-LLVKDONJSA-N	1	1	318.377	1.473	20	5		DDBDMO
CN1C[C@@H](CNc2ccc([N+](=O)[O-])c3c2CC[N@@H+](C)C3)CC1=O	ZINC001168725892	747981137	/nfs/dbraw/zinc/98/11/37/747981137.db2.gz	HYSBRLIOMMWUQV-LLVKDONJSA-N	1	1	318.377	1.473	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]CC2CC(F)(F)C2)CC1	ZINC000996428695	749586211	/nfs/dbraw/zinc/58/62/11/749586211.db2.gz	GISPTZPSVXXJTI-VXGBXAGGSA-N	1	1	317.336	1.278	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCC3CC3)C2)CC1	ZINC001035186894	751287541	/nfs/dbraw/zinc/28/75/41/751287541.db2.gz	KITKVBRXZYNTIJ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CCC3CC3)C2)CC1	ZINC001035186894	751287545	/nfs/dbraw/zinc/28/75/45/751287545.db2.gz	KITKVBRXZYNTIJ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CCC3CC3)C2)CC1	ZINC001035186894	751287551	/nfs/dbraw/zinc/28/75/51/751287551.db2.gz	KITKVBRXZYNTIJ-HUUCEWRRSA-N	1	1	321.421	1.766	20	5		DDBDMO
CC(C)C(C)(C)C(=O)NCC[NH2+]Cc1c([N+](=O)[O-])ncn1C	ZINC001128158322	754562262	/nfs/dbraw/zinc/56/22/62/754562262.db2.gz	GRXCUBCOEPUZQL-UHFFFAOYSA-N	1	1	311.386	1.216	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC001017543885	758011946	/nfs/dbraw/zinc/01/19/46/758011946.db2.gz	HOXBROLXJCIRMW-LXTVHRRPSA-N	1	1	321.421	1.763	20	5		DDBDMO
CC1(C)CC(C[N@H+]2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001017543885	758011960	/nfs/dbraw/zinc/01/19/60/758011960.db2.gz	HOXBROLXJCIRMW-LXTVHRRPSA-N	1	1	321.421	1.763	20	5		DDBDMO
CC1(C)CC(C[N@@H+]2C[C@H]3CC[C@@H](C2)N3C(=O)[C@@H]2CC2[N+](=O)[O-])C1	ZINC001017543885	758011971	/nfs/dbraw/zinc/01/19/71/758011971.db2.gz	HOXBROLXJCIRMW-LXTVHRRPSA-N	1	1	321.421	1.763	20	5		DDBDMO
Cc1ccc(C[NH2+][C@H]2C[C@@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC001086082686	760941525	/nfs/dbraw/zinc/94/15/25/760941525.db2.gz	ZOZKVARHBUEGAT-QKPAOTATSA-N	1	1	317.389	1.645	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@@H+]2CC[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329368	766255122	/nfs/dbraw/zinc/25/51/22/766255122.db2.gz	PMPRZXWUOCNROL-ABAIWWIYSA-N	1	1	312.341	1.941	20	5		DDBDMO
COc1ccc(C[C@@H](C)[N@H+]2CC[C@@](F)(CO)C2)c([N+](=O)[O-])c1	ZINC001170329368	766255123	/nfs/dbraw/zinc/25/51/23/766255123.db2.gz	PMPRZXWUOCNROL-ABAIWWIYSA-N	1	1	312.341	1.941	20	5		DDBDMO
C[NH+]1CC(CNC(F)(F)c2ccc([N+](=O)[O-])c(Cl)n2)C1	ZINC001159218483	771098230	/nfs/dbraw/zinc/09/82/30/771098230.db2.gz	PSCZYILXLFWBOP-UHFFFAOYSA-N	1	1	306.700	1.844	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001135813382	771731730	/nfs/dbraw/zinc/73/17/30/771731730.db2.gz	DGQGAANPVMIXPO-NSHDSACASA-N	1	1	321.381	1.566	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCNc1cc(C)ccc1[N+](=O)[O-]	ZINC001093840577	775125394	/nfs/dbraw/zinc/12/53/94/775125394.db2.gz	NWLURGPNMIGIMH-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
CCC[N@@H+](C)CC(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094517416	775975724	/nfs/dbraw/zinc/97/57/24/775975724.db2.gz	QFDHKZWRZPEUIL-UHFFFAOYSA-N	1	1	309.370	1.250	20	5		DDBDMO
O=C1N[C@@H]2C[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC[C@H]2CO1	ZINC001171741012	776460121	/nfs/dbraw/zinc/46/01/21/776460121.db2.gz	KBELJIDDBYYVGO-GXTWGEPZSA-N	1	1	305.334	1.568	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001173235015	777064462	/nfs/dbraw/zinc/06/44/62/777064462.db2.gz	VRLCJZFGPUTVIN-SWLSCSKDSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001173235015	777064466	/nfs/dbraw/zinc/06/44/66/777064466.db2.gz	VRLCJZFGPUTVIN-SWLSCSKDSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001173235014	777065282	/nfs/dbraw/zinc/06/52/82/777065282.db2.gz	VRLCJZFGPUTVIN-IUODEOHRSA-N	1	1	319.361	1.069	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CCN2C(=O)COC[C@H]2C1	ZINC001173235014	777065283	/nfs/dbraw/zinc/06/52/83/777065283.db2.gz	VRLCJZFGPUTVIN-IUODEOHRSA-N	1	1	319.361	1.069	20	5		DDBDMO
O=C(NCC[N@H+](CCC(F)(F)F)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266592030	836509344	/nfs/dbraw/zinc/50/93/44/836509344.db2.gz	GHLUXVFOVWGTQX-NXEZZACHSA-N	1	1	309.288	1.185	20	5		DDBDMO
O=C(NCC[N@@H+](CCC(F)(F)F)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266592030	836509353	/nfs/dbraw/zinc/50/93/53/836509353.db2.gz	GHLUXVFOVWGTQX-NXEZZACHSA-N	1	1	309.288	1.185	20	5		DDBDMO
CC(C)OCC(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001271977763	844254230	/nfs/dbraw/zinc/25/42/30/844254230.db2.gz	VAEIUMYHPZETDO-UHFFFAOYSA-N	1	1	323.393	1.910	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H](C)[N@H+]1C	ZINC001328044645	862655998	/nfs/dbraw/zinc/65/59/98/862655998.db2.gz	LOAQGQVZCLLYNV-UHIISALHSA-N	1	1	307.350	1.179	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C	ZINC001328044645	862656006	/nfs/dbraw/zinc/65/60/06/862656006.db2.gz	LOAQGQVZCLLYNV-UHIISALHSA-N	1	1	307.350	1.179	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1	ZINC001122733054	858951839	/nfs/dbraw/zinc/95/18/39/858951839.db2.gz	WJLPDSCDCIPOKJ-QWHCGFSZSA-N	1	1	322.413	1.241	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)O[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC001123003169	859049550	/nfs/dbraw/zinc/04/95/50/859049550.db2.gz	RHLDJEYWVMVRDE-NWDGAFQWSA-N	1	1	308.338	1.270	20	5		DDBDMO
CCOC(=O)c1cnc(Cl)c([N+](=O)[O-])c1N1CC[C@H]1[NH2+]C	ZINC001156637200	863217968	/nfs/dbraw/zinc/21/79/68/863217968.db2.gz	ATBUONHABMVRRI-QMMMGPOBSA-N	1	1	314.729	1.576	20	5		DDBDMO
CN(C)c1cccc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001157761701	864111599	/nfs/dbraw/zinc/11/15/99/864111599.db2.gz	YJZAMAAVQOEBMR-HUUCEWRRSA-N	1	1	320.393	1.014	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC)CCN1C(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001157818824	864170067	/nfs/dbraw/zinc/17/00/67/864170067.db2.gz	YFFGPQPZNWMBRS-LLVKDONJSA-N	1	1	307.354	1.128	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cnc(N)c([N+](=O)[O-])c1	ZINC001157818824	864170072	/nfs/dbraw/zinc/17/00/72/864170072.db2.gz	YFFGPQPZNWMBRS-LLVKDONJSA-N	1	1	307.354	1.128	20	5		DDBDMO
C[N@H+]1CCN(Cn2c(=O)oc3cccc([N+](=O)[O-])c32)CC1(C)C	ZINC001331049709	864803661	/nfs/dbraw/zinc/80/36/61/864803661.db2.gz	KTYLRLJMCLDMLE-UHFFFAOYSA-N	1	1	320.349	1.486	20	5		DDBDMO
COc1cc(N[C@H]2CCC[C@@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC001160722166	866066429	/nfs/dbraw/zinc/06/64/29/866066429.db2.gz	FKVHXZISEQSIFB-RYUDHWBXSA-N	1	1	322.365	1.664	20	5		DDBDMO
COc1nc(N[C@H]2CCC[C@H]2[NH+]2CCOCC2)ccc1[N+](=O)[O-]	ZINC001160722696	866067791	/nfs/dbraw/zinc/06/77/91/866067791.db2.gz	IDZJJQQQALMZNO-NWDGAFQWSA-N	1	1	322.365	1.664	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)NCC[N@@H+]1CCCC[C@@H]1C	ZINC001333288962	866596632	/nfs/dbraw/zinc/59/66/32/866596632.db2.gz	JPHLFNGQKXMZQU-NSHDSACASA-N	1	1	309.370	1.090	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)OCCn1cc[nH+]c1C	ZINC001320557934	866829395	/nfs/dbraw/zinc/82/93/95/866829395.db2.gz	RLCOQNZNTQUHKX-UHFFFAOYSA-N	1	1	304.306	1.998	20	5		DDBDMO
CCN(CC[NH2+]CC=C(Cl)Cl)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001320733694	866988608	/nfs/dbraw/zinc/98/86/08/866988608.db2.gz	ADZUTCGIWDALDF-RKDXNWHRSA-N	1	1	310.181	1.409	20	5		DDBDMO
C[N@H+](CC(=O)OCc1cccnc1[N+](=O)[O-])[C@H]1CCSC1	ZINC001333907372	867145248	/nfs/dbraw/zinc/14/52/48/867145248.db2.gz	AYOUTYNOKMIBLI-NSHDSACASA-N	1	1	311.363	1.470	20	5		DDBDMO
C[N@@H+](CC(=O)OCc1cccnc1[N+](=O)[O-])[C@H]1CCSC1	ZINC001333907372	867145257	/nfs/dbraw/zinc/14/52/57/867145257.db2.gz	AYOUTYNOKMIBLI-NSHDSACASA-N	1	1	311.363	1.470	20	5		DDBDMO
CC[NH+]1CCN(C[C@H](C)CNc2c(C)cncc2[N+](=O)[O-])CC1	ZINC001321133450	867341724	/nfs/dbraw/zinc/34/17/24/867341724.db2.gz	MCCOIPOYWSTCRK-CYBMUJFWSA-N	1	1	321.425	1.406	20	5		DDBDMO
CC(C)(C)[C@H](C[NH+]1CCOCC1)Nc1ncc([N+](=O)[O-])cc1N	ZINC001162880517	867896561	/nfs/dbraw/zinc/89/65/61/867896561.db2.gz	LTBRDIWORAMONE-ZDUSSCGKSA-N	1	1	323.397	1.731	20	5		DDBDMO
COC(=O)CC(C)(C)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC001335183843	868117355	/nfs/dbraw/zinc/11/73/55/868117355.db2.gz	YPPGFCGLQGEDIV-UHFFFAOYSA-N	1	1	323.349	1.467	20	5		DDBDMO
O=C(NCCC1(C[NH2+]Cc2ccsc2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001164494287	869231153	/nfs/dbraw/zinc/23/11/53/869231153.db2.gz	DEEVTYWJGUHLSP-CHWSQXEVSA-N	1	1	323.418	1.789	20	5		DDBDMO
COc1cc([N+](=O)[O-])cnc1N[C@@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001338083761	869791480	/nfs/dbraw/zinc/79/14/80/869791480.db2.gz	JKWFCLSDLNHXRD-CMPLNLGQSA-N	1	1	309.370	1.045	20	5		DDBDMO
Cc1nc(Nc2ccc([N+](=O)[O-])nc2)cc(N2CCOCC2)[nH+]1	ZINC001203567135	870646385	/nfs/dbraw/zinc/64/63/85/870646385.db2.gz	XZDMLZXJCFZNOM-UHFFFAOYSA-N	1	1	316.321	1.668	20	5		DDBDMO
Nc1cc(N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ncc1[N+](=O)[O-]	ZINC001339824728	870717979	/nfs/dbraw/zinc/71/79/79/870717979.db2.gz	RKDIJPVPWZTSNG-PWSUYJOCSA-N	1	1	309.395	1.564	20	5		DDBDMO
C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCn1cnnc1	ZINC001308052834	871465619	/nfs/dbraw/zinc/46/56/19/871465619.db2.gz	USFFWOWRMQCAPM-UHFFFAOYSA-N	1	1	318.337	1.147	20	5		DDBDMO
CC(C)c1ccc(C[NH2+]CC(=O)N2CCCO2)cc1[N+](=O)[O-]	ZINC001308546335	871510852	/nfs/dbraw/zinc/51/08/52/871510852.db2.gz	MRRNXGVKDXDKQS-UHFFFAOYSA-N	1	1	307.350	1.972	20	5		DDBDMO
C[C@@H](c1ccccn1)[N@H+]1CC[C@@H](Oc2ncc([N+](=O)[O-])cn2)C1	ZINC001226733071	882617704	/nfs/dbraw/zinc/61/77/04/882617704.db2.gz	GPOJQFLFGLOMGC-WCQYABFASA-N	1	1	315.333	1.994	20	5		DDBDMO
CC(C)Cn1c(C[N+](=O)[O-])nnc1N1CCC[N@H+](C(C)C)CC1	ZINC001342988646	872458965	/nfs/dbraw/zinc/45/89/65/872458965.db2.gz	RZSUNVSFIZLBDL-UHFFFAOYSA-N	1	1	324.429	1.631	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]3CCCC[C@H]3C2)c1	ZINC001319181583	872482975	/nfs/dbraw/zinc/48/29/75/872482975.db2.gz	MKZCNYDJRIZNDQ-VNHYZAJKSA-N	1	1	308.382	1.664	20	5		DDBDMO
CS[C@@H]1CC[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC001319451831	872635504	/nfs/dbraw/zinc/63/55/04/872635504.db2.gz	QQCUGUIIBJOVSI-DGCLKSJQSA-N	1	1	311.407	1.972	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CNC(=O)Cc1ccc(F)cc1[N+](=O)[O-]	ZINC001349853101	875414121	/nfs/dbraw/zinc/41/41/21/875414121.db2.gz	RYOREFOJXUUJMS-ZDUSSCGKSA-N	1	1	309.341	1.877	20	5		DDBDMO
Cc1[nH]c(=O)cc(O[C@@H]2C[C@@H]3CC(=O)C[C@H]2[N@H+]3C)c1[N+](=O)[O-]	ZINC001228686849	883618809	/nfs/dbraw/zinc/61/88/09/883618809.db2.gz	RMNAYGGAQFNRKM-JMJZKYOTSA-N	1	1	307.306	1.187	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])ccc1O[C@H]1CCc2[nH+]ccn2C1	ZINC001229059780	883796947	/nfs/dbraw/zinc/79/69/47/883796947.db2.gz	VDTYFZSXCRJQKL-NSHDSACASA-N	1	1	317.301	1.972	20	5		DDBDMO
CC(=O)Nc1cc(O[C@H]2CC[N@@H+](C)C2)c(C(C)=O)cc1[N+](=O)[O-]	ZINC001229128987	883837643	/nfs/dbraw/zinc/83/76/43/883837643.db2.gz	GTYUDQKWDPQRGL-NSHDSACASA-N	1	1	321.333	1.839	20	5		DDBDMO
CC(=O)Nc1cc(O[C@H]2CC[N@H+](C)C2)c(C(C)=O)cc1[N+](=O)[O-]	ZINC001229128987	883837651	/nfs/dbraw/zinc/83/76/51/883837651.db2.gz	GTYUDQKWDPQRGL-NSHDSACASA-N	1	1	321.333	1.839	20	5		DDBDMO
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1nc3c[nH]cc([N+](=O)[O-])c-3n1)C2	ZINC001230230568	884382734	/nfs/dbraw/zinc/38/27/34/884382734.db2.gz	VBKPKOKFMYOMCF-MYJAWHEDSA-N	1	1	303.322	1.870	20	5		DDBDMO
COc1ccc(C[C@@H](C)[NH2+][C@@H]2CNCCC2=O)c([N+](=O)[O-])c1	ZINC001246294596	892521125	/nfs/dbraw/zinc/52/11/25/892521125.db2.gz	RIJBOVZNQNFTEJ-ZWNOBZJWSA-N	1	1	307.350	1.055	20	5		DDBDMO
COc1ccc(C[C@@H](C)N[C@@H]2C[NH2+]CCC2=O)c([N+](=O)[O-])c1	ZINC001246294596	892521138	/nfs/dbraw/zinc/52/11/38/892521138.db2.gz	RIJBOVZNQNFTEJ-ZWNOBZJWSA-N	1	1	307.350	1.055	20	5		DDBDMO
C[C@H](Cc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H]2CNC(=O)[C@H]2C1	ZINC001254559143	896501190	/nfs/dbraw/zinc/50/11/90/896501190.db2.gz	IXFJFTUYSWLKFX-XBFCOCLRSA-N	1	1	303.362	1.594	20	5		DDBDMO
C[C@]1(CO)CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C[C@@H]1O	ZINC001254592068	896522700	/nfs/dbraw/zinc/52/27/00/896522700.db2.gz	ABVXNTGSQXHNHO-HRCADAONSA-N	1	1	306.362	1.127	20	5		DDBDMO
COC(=O)CO[C@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254609955	896529880	/nfs/dbraw/zinc/52/98/80/896529880.db2.gz	GRMZEZKUBIZNCB-GJZGRUSLSA-N	1	1	320.345	1.326	20	5		DDBDMO
CC(=O)N(C)[C@@H]1CC[N@H+]([C@H]2Cc3ccc([N+](=O)[O-])cc3C2)C1	ZINC001254611675	896532766	/nfs/dbraw/zinc/53/27/66/896532766.db2.gz	QZEULWTXESPNMS-CVEARBPZSA-N	1	1	303.362	1.615	20	5		DDBDMO
O=C(NCCC[N@@H+](C/C=C/Cl)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001266135587	903000749	/nfs/dbraw/zinc/00/07/49/903000749.db2.gz	PVGJQEHPGTVEHL-JRTDTAFDSA-N	1	1	301.774	1.375	20	5		DDBDMO
O=C(NCCC[N@H+](C/C=C/Cl)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001266135587	903000758	/nfs/dbraw/zinc/00/07/58/903000758.db2.gz	PVGJQEHPGTVEHL-JRTDTAFDSA-N	1	1	301.774	1.375	20	5		DDBDMO
O=C(NCCC[N@@H+](C/C=C/Cl)C1CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001266135587	903000776	/nfs/dbraw/zinc/00/07/76/903000776.db2.gz	PVGJQEHPGTVEHL-JRTDTAFDSA-N	1	1	301.774	1.375	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1C[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000305324153	231000384	/nfs/dbraw/zinc/00/03/84/231000384.db2.gz	OSIFBKQNRGCPKW-HNNXBMFYSA-N	1	1	316.361	1.519	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@](O)(C(F)F)C2)cc1	ZINC000451429758	231092439	/nfs/dbraw/zinc/09/24/39/231092439.db2.gz	MBKDLQLZHJNEJX-CYBMUJFWSA-N	1	1	302.277	1.676	20	5		DDBDMO
COCC[NH+]1CCN(c2cc(C(=O)OC)ccc2[N+](=O)[O-])CC1	ZINC000360151718	306974902	/nfs/dbraw/zinc/97/49/02/306974902.db2.gz	ZDUIUASPETUPST-UHFFFAOYSA-N	1	1	323.349	1.150	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000458169029	530060458	/nfs/dbraw/zinc/06/04/58/530060458.db2.gz	FBKNZZLLWRYHIR-CYBMUJFWSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCCO1	ZINC000181706867	199341685	/nfs/dbraw/zinc/34/16/85/199341685.db2.gz	ZXVGBDRWWXNVCC-STQMWFEESA-N	1	1	310.350	1.445	20	5		DDBDMO
Cc1ccc(C[N@@H+](CCO)CCn2ccc([N+](=O)[O-])n2)cc1	ZINC000181970426	199369157	/nfs/dbraw/zinc/36/91/57/199369157.db2.gz	DSEUGHCRCDTNMS-UHFFFAOYSA-N	1	1	304.350	1.594	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)CC[C@@H](C)O	ZINC000072713603	191219716	/nfs/dbraw/zinc/21/97/16/191219716.db2.gz	RXQQDWXUAIZBSG-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(CO)CC3)o2)cc1	ZINC000058591594	352848629	/nfs/dbraw/zinc/84/86/29/352848629.db2.gz	KHPZYYVGCAWEJZ-UHFFFAOYSA-N	1	1	318.333	1.849	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC[C@@H](C)O	ZINC000173568800	198228628	/nfs/dbraw/zinc/22/86/28/198228628.db2.gz	PPPJUHWZTGGEQS-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC[C@@H](C)O	ZINC000173568800	198228630	/nfs/dbraw/zinc/22/86/30/198228630.db2.gz	PPPJUHWZTGGEQS-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000068779489	353129273	/nfs/dbraw/zinc/12/92/73/353129273.db2.gz	RRIWGFGEYVVRJM-UHFFFAOYSA-N	1	1	321.377	1.916	20	5		DDBDMO
CCC1(O)CC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000072724046	353212424	/nfs/dbraw/zinc/21/24/24/353212424.db2.gz	RNYTVYKMYUWXSK-UHFFFAOYSA-N	1	1	307.350	1.431	20	5		DDBDMO
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](O)CN1CCOCC1	ZINC000073021807	353233097	/nfs/dbraw/zinc/23/30/97/353233097.db2.gz	SNWGRWSVIZJDAK-BBRMVZONSA-N	1	1	323.393	1.281	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000074073836	353289724	/nfs/dbraw/zinc/28/97/24/353289724.db2.gz	TTYZHIOJBMYPHF-UHFFFAOYSA-N	1	1	321.377	1.918	20	5		DDBDMO
C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C[C@H](O)C1CC1	ZINC000079769974	353576572	/nfs/dbraw/zinc/57/65/72/353576572.db2.gz	XACXQMJBAUGLGW-AWEZNQCLSA-N	1	1	308.334	1.664	20	5		DDBDMO
COC(=O)CC[N@@H+]1CCN(c2ncccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000089265720	353763684	/nfs/dbraw/zinc/76/36/84/353763684.db2.gz	NWVPUUXIYLWBML-NSHDSACASA-N	1	1	308.338	1.063	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ncccc2[N+](=O)[O-])[C@@H](C)C1	ZINC000089265720	353763686	/nfs/dbraw/zinc/76/36/86/353763686.db2.gz	NWVPUUXIYLWBML-NSHDSACASA-N	1	1	308.338	1.063	20	5		DDBDMO
COC(=O)CC[N@H+]1CCN(c2ccc([N+](=O)[O-])nc2)[C@H](C)C1	ZINC000089265452	353763876	/nfs/dbraw/zinc/76/38/76/353763876.db2.gz	OLUJPFRONYIQBT-LLVKDONJSA-N	1	1	308.338	1.063	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000125915718	354049343	/nfs/dbraw/zinc/04/93/43/354049343.db2.gz	GWKGJMSOBHQBBF-LLVKDONJSA-N	1	1	318.337	1.138	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@H]2C[N@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369549	354224222	/nfs/dbraw/zinc/22/42/22/354224222.db2.gz	LVHPFGXRKVIJEU-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
Cc1cc(C(=O)N[C@@H](C)[C@H]2C[N@@H+](C)CCO2)ccc1[N+](=O)[O-]	ZINC000157369549	354224225	/nfs/dbraw/zinc/22/42/25/354224225.db2.gz	LVHPFGXRKVIJEU-SMDDNHRTSA-N	1	1	307.350	1.352	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)c2ccncc21	ZINC000405209751	354677456	/nfs/dbraw/zinc/67/74/56/354677456.db2.gz	HPLVGVCXYHONOI-NWDGAFQWSA-N	1	1	314.345	1.398	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CCOC[C@@H]2[C@H]2CCCC[C@H]2O)c1	ZINC000585800599	354849312	/nfs/dbraw/zinc/84/93/12/354849312.db2.gz	ASSFKBLNZGTBAM-RBSFLKMASA-N	1	1	324.381	1.043	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CCOC[C@@H]2[C@H]2CCCC[C@H]2O)c1	ZINC000585800599	354849315	/nfs/dbraw/zinc/84/93/15/354849315.db2.gz	ASSFKBLNZGTBAM-RBSFLKMASA-N	1	1	324.381	1.043	20	5		DDBDMO
C[C@H]1C[C@H](Nc2cc(N)c([N+](=O)[O-])c(CO)c2)C[N@H+]1C1CC1	ZINC000589584117	355002018	/nfs/dbraw/zinc/00/20/18/355002018.db2.gz	GCANXYHTCVQIKG-CABZTGNLSA-N	1	1	306.366	1.706	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](O)[C@H](C)C2)c1	ZINC000589514773	354999044	/nfs/dbraw/zinc/99/90/44/354999044.db2.gz	LNSYVYHLUHZHFD-QMTHXVAHSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H](O)[C@H](C)C2)c1	ZINC000589514773	354999049	/nfs/dbraw/zinc/99/90/49/354999049.db2.gz	LNSYVYHLUHZHFD-QMTHXVAHSA-N	1	1	308.334	1.584	20	5		DDBDMO
CN(C(=O)CN1CC[C@@H]2C[N@@H+](C)C[C@@H]21)c1ccc([N+](=O)[O-])cc1	ZINC000590012324	355040180	/nfs/dbraw/zinc/04/01/80/355040180.db2.gz	QWZXLAMFDMQCFV-DOMZBBRYSA-N	1	1	318.377	1.194	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000590537462	355109632	/nfs/dbraw/zinc/10/96/32/355109632.db2.gz	JMHBBNQJBQUVED-DGCLKSJQSA-N	1	1	308.313	1.248	20	5		DDBDMO
CCOc1cc(N2CC(C[NH+]3CCOCC3)C2)ccc1[N+](=O)[O-]	ZINC000590568478	355115764	/nfs/dbraw/zinc/11/57/64/355115764.db2.gz	VYUIOFNRHRNSPS-UHFFFAOYSA-N	1	1	321.377	1.762	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-]	ZINC000590442356	355096716	/nfs/dbraw/zinc/09/67/16/355096716.db2.gz	FNKLKDCVNYVVSW-AAEUAGOBSA-N	1	1	305.334	1.380	20	5		DDBDMO
Cc1nc(C[NH2+]C[C@H](O)COc2ccccc2[N+](=O)[O-])cs1	ZINC000591729008	355373956	/nfs/dbraw/zinc/37/39/56/355373956.db2.gz	CRRXEDVOKMDAGD-LBPRGKRZSA-N	1	1	323.374	1.889	20	5		DDBDMO
CC1([NH3+])CCN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1	ZINC000592485201	355596490	/nfs/dbraw/zinc/59/64/90/355596490.db2.gz	RBUBJVZOUOKTFN-UHFFFAOYSA-N	1	1	306.366	1.737	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)CCN12	ZINC000346477470	283110352	/nfs/dbraw/zinc/11/03/52/283110352.db2.gz	GBLSVDRQZHQUCT-AWEZNQCLSA-N	1	1	319.361	1.670	20	5		DDBDMO
CCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)[C@@H]1CC[N@@H+](C)C1	ZINC000592830308	355705892	/nfs/dbraw/zinc/70/58/92/355705892.db2.gz	CSPWISRYVJKJMR-GFCCVEGCSA-N	1	1	309.370	1.124	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@@H]2CC[N@@H+](C)[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000592765333	355681670	/nfs/dbraw/zinc/68/16/70/355681670.db2.gz	DQBNUUUMFLHABK-NOZJJQNGSA-N	1	1	321.333	1.660	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)COc1ccc(C(=O)OC)c([N+](=O)[O-])c1	ZINC000594571494	356252863	/nfs/dbraw/zinc/25/28/63/356252863.db2.gz	HRDPKWLDIQWLGV-JTQLQIEISA-N	1	1	312.322	1.073	20	5		DDBDMO
C[N@@H+](Cc1cnccn1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000080980431	192207244	/nfs/dbraw/zinc/20/72/44/192207244.db2.gz	KZNMTNDLJXURTH-CQSZACIVSA-N	1	1	318.333	1.257	20	5		DDBDMO
C[N@H+](Cc1cnccn1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000080980431	192207247	/nfs/dbraw/zinc/20/72/47/192207247.db2.gz	KZNMTNDLJXURTH-CQSZACIVSA-N	1	1	318.333	1.257	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(c3nc4sccn4c3[N+](=O)[O-])[C@@H]2C1	ZINC000408028064	283158803	/nfs/dbraw/zinc/15/88/03/283158803.db2.gz	CJENSKMOUNEANE-NXEZZACHSA-N	1	1	323.378	1.213	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000595193281	356404161	/nfs/dbraw/zinc/40/41/61/356404161.db2.gz	RUTDYVREINBROX-LBPRGKRZSA-N	1	1	320.349	1.134	20	5		DDBDMO
Cc1noc(C[N@H+]2CCCC[C@H]2[C@H]2CNC(=O)C2)c1[N+](=O)[O-]	ZINC000595406330	356481822	/nfs/dbraw/zinc/48/18/22/356481822.db2.gz	BXHCMZIXAODAHS-MNOVXSKESA-N	1	1	308.338	1.382	20	5		DDBDMO
Cc1noc(C[N@@H+]2CCC[C@H](Cn3ccnn3)C2)c1[N+](=O)[O-]	ZINC000595395076	356476738	/nfs/dbraw/zinc/47/67/38/356476738.db2.gz	GRAJYNXKVQJPNP-NSHDSACASA-N	1	1	306.326	1.395	20	5		DDBDMO
Cc1noc(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)c1[N+](=O)[O-]	ZINC000595395076	356476742	/nfs/dbraw/zinc/47/67/42/356476742.db2.gz	GRAJYNXKVQJPNP-NSHDSACASA-N	1	1	306.326	1.395	20	5		DDBDMO
Cc1noc(C[N@H+]2C[C@H](N3CCOCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000595493931	356516910	/nfs/dbraw/zinc/51/69/10/356516910.db2.gz	XEORYTOFGUISES-ZYHUDNBSSA-N	1	1	310.354	1.186	20	5		DDBDMO
Cc1noc(C[N@@H+]2C[C@H](N3CCOCC3)C[C@H]2C)c1[N+](=O)[O-]	ZINC000595493931	356516912	/nfs/dbraw/zinc/51/69/12/356516912.db2.gz	XEORYTOFGUISES-ZYHUDNBSSA-N	1	1	310.354	1.186	20	5		DDBDMO
C[N@H+](CC1=CCCOC1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000595746965	356633596	/nfs/dbraw/zinc/63/35/96/356633596.db2.gz	HKKRKBGSQHPHNN-AWEZNQCLSA-N	1	1	322.361	1.613	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@H]3COC[C@H]3C2)c1	ZINC000595826891	356665754	/nfs/dbraw/zinc/66/57/54/356665754.db2.gz	AWPAMPVMNJOSFM-UMVBOHGHSA-N	1	1	322.361	1.303	20	5		DDBDMO
O=[N+]([O-])c1cncc(Cl)c1N1CC(C[NH+]2CCOCC2)C1	ZINC000596240334	356828970	/nfs/dbraw/zinc/82/89/70/356828970.db2.gz	WDJBOXWXSMPJJK-UHFFFAOYSA-N	1	1	312.757	1.412	20	5		DDBDMO
Cc1cc(N[C@@H](C)C[N@H+](C)CCCN(C)C)ncc1[N+](=O)[O-]	ZINC000596361262	356863431	/nfs/dbraw/zinc/86/34/31/356863431.db2.gz	RBTGCOCHOJLDEC-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1cc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)ncc1[N+](=O)[O-]	ZINC000596361262	356863434	/nfs/dbraw/zinc/86/34/34/356863434.db2.gz	RBTGCOCHOJLDEC-ZDUSSCGKSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1cccc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)c1[N+](=O)[O-]	ZINC000596539730	356911415	/nfs/dbraw/zinc/91/14/15/356911415.db2.gz	QCLBNRYSUXSULP-CQSZACIVSA-N	1	1	305.378	1.939	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597714179	357299003	/nfs/dbraw/zinc/29/90/03/357299003.db2.gz	HAIGTEOVKIDQSW-CQSZACIVSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@]3(CC[N@@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597714179	357299006	/nfs/dbraw/zinc/29/90/06/357299006.db2.gz	HAIGTEOVKIDQSW-CQSZACIVSA-N	1	1	307.354	1.184	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@]3(CC[N@H+](C)C3)C2)c1[N+](=O)[O-]	ZINC000597714179	357299010	/nfs/dbraw/zinc/29/90/10/357299010.db2.gz	HAIGTEOVKIDQSW-CQSZACIVSA-N	1	1	307.354	1.184	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H](CNC(=O)CCn2cc([N+](=O)[O-])cn2)C1	ZINC000597854617	357358689	/nfs/dbraw/zinc/35/86/89/357358689.db2.gz	KCBVINOYRCLKGM-LBPRGKRZSA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-]	ZINC000597855530	357359328	/nfs/dbraw/zinc/35/93/28/357359328.db2.gz	SFSOITPRPAABKW-NSHDSACASA-N	1	1	323.397	1.487	20	5		DDBDMO
CCN(C(=O)CN(C)c1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1	ZINC000597944552	357393912	/nfs/dbraw/zinc/39/39/12/357393912.db2.gz	FBKDZTXRTDRAII-CYBMUJFWSA-N	1	1	320.393	1.584	20	5		DDBDMO
CCN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1	ZINC000597944665	357394180	/nfs/dbraw/zinc/39/41/80/357394180.db2.gz	DNJNTWHSVJCOPE-ZDUSSCGKSA-N	1	1	309.341	1.829	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598648529	357668427	/nfs/dbraw/zinc/66/84/27/357668427.db2.gz	UCQWXYUOKGHQGN-RDBSUJKOSA-N	1	1	324.377	1.285	20	5		DDBDMO
C[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)COC1	ZINC000599574055	357980373	/nfs/dbraw/zinc/98/03/73/357980373.db2.gz	NDXJBNHZDCHPBR-CYBMUJFWSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@](C)(CO)[C@](C)(CO)C1	ZINC000599624803	357997191	/nfs/dbraw/zinc/99/71/91/357997191.db2.gz	WSELLIRYEIUORU-VBNZEHGJSA-N	1	1	308.378	1.969	20	5		DDBDMO
Cc1c(CC(=O)N2CC[NH+](CCCF)CC2)cccc1[N+](=O)[O-]	ZINC000600076546	358116981	/nfs/dbraw/zinc/11/69/81/358116981.db2.gz	PCMRFDFBRWPUMO-UHFFFAOYSA-N	1	1	323.368	1.950	20	5		DDBDMO
Cc1ccc(C(=O)NC2CC([NH+]3CCOCC3)C2)cc1[N+](=O)[O-]	ZINC000600068437	358114337	/nfs/dbraw/zinc/11/43/37/358114337.db2.gz	CEFKXLPWMRCCBY-UHFFFAOYSA-N	1	1	319.361	1.496	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2N)C1	ZINC000600312969	358193106	/nfs/dbraw/zinc/19/31/06/358193106.db2.gz	WHNXDRBKJSGGRI-JTQLQIEISA-N	1	1	324.356	1.778	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(CNC[C@@H]3COCC[NH2+]3)o2)c1	ZINC000600678506	358280633	/nfs/dbraw/zinc/28/06/33/358280633.db2.gz	RPUWFGFAXTYVFA-CYBMUJFWSA-N	1	1	317.345	1.933	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000600808738	358320874	/nfs/dbraw/zinc/32/08/74/358320874.db2.gz	QOALUDXFZNWPHD-JTQLQIEISA-N	1	1	313.741	1.045	20	5		DDBDMO
C[C@H]1CN(CCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1	ZINC000601111857	358406671	/nfs/dbraw/zinc/40/66/71/358406671.db2.gz	YLYYQZROCSJDQZ-LBPRGKRZSA-N	1	1	316.361	1.698	20	5		DDBDMO
Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1NC[C@@H]1CC[N@@H+](C)C1	ZINC000601114531	358407815	/nfs/dbraw/zinc/40/78/15/358407815.db2.gz	QOZQLONNZWLNTL-ZETCQYMHSA-N	1	1	307.276	1.711	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)C1	ZINC000602195464	358876819	/nfs/dbraw/zinc/87/68/19/358876819.db2.gz	LSUJJTKVKJUDQE-MLGOLLRUSA-N	1	1	321.377	1.260	20	5		DDBDMO
CN(C)CCC[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000602506908	359018567	/nfs/dbraw/zinc/01/85/67/359018567.db2.gz	YAIHNULSVOHZNX-UHFFFAOYSA-N	1	1	307.398	1.500	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccccc1)C[C@@H](C)O	ZINC000602781559	359185804	/nfs/dbraw/zinc/18/58/04/359185804.db2.gz	TVCIFOBKMGTBAA-CYBMUJFWSA-N	1	1	318.377	1.983	20	5		DDBDMO
CC1(C)CO[C@@H](C[NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)C1	ZINC000602837531	359227978	/nfs/dbraw/zinc/22/79/78/359227978.db2.gz	OOFRBGNXXDEEFE-CYBMUJFWSA-N	1	1	320.393	1.927	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](OC(F)F)C1	ZINC000602809091	359205806	/nfs/dbraw/zinc/20/58/06/359205806.db2.gz	YQXRPXUYBIQSKX-JTQLQIEISA-N	1	1	304.297	1.803	20	5		DDBDMO
Cn1cc([C@H]2C[N@@H+](Cc3cn(C)nc3[N+](=O)[O-])CC2(C)C)cn1	ZINC000602832559	359224118	/nfs/dbraw/zinc/22/41/18/359224118.db2.gz	PXPBLJQCIWLKAN-CYBMUJFWSA-N	1	1	318.381	1.687	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])[C@H](CO)C1	ZINC000602930625	359300839	/nfs/dbraw/zinc/30/08/39/359300839.db2.gz	IDILTDPBBBZSBQ-HZSPNIEDSA-N	1	1	324.377	1.427	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@H](OC)C[C@]1(C)CO	ZINC000602964700	359327910	/nfs/dbraw/zinc/32/79/10/359327910.db2.gz	SFVDFVLKXSZJPP-UKRRQHHQSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1C[C@H](OC)C[C@]1(C)CO	ZINC000602964700	359327911	/nfs/dbraw/zinc/32/79/11/359327911.db2.gz	SFVDFVLKXSZJPP-UKRRQHHQSA-N	1	1	310.350	1.575	20	5		DDBDMO
CCN1[C@H](C)CN(C(=O)c2cc([O-])cc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000603145876	359434230	/nfs/dbraw/zinc/43/42/30/359434230.db2.gz	QSEMTFKAHYYWAS-PHIMTYICSA-N	1	1	307.350	1.855	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C[C@@H](C)O)CC2)cc([N+](=O)[O-])c1	ZINC000186820154	200017554	/nfs/dbraw/zinc/01/75/54/200017554.db2.gz	ZTXIEPNKRUGIHA-GFCCVEGCSA-N	1	1	307.350	1.042	20	5		DDBDMO
C[C@H]1COCC[N@H+]1C1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000603401187	359617749	/nfs/dbraw/zinc/61/77/49/359617749.db2.gz	ITZREGFHQXAJGW-LBPRGKRZSA-N	1	1	306.366	1.679	20	5		DDBDMO
C[C@H]([NH3+])[C@H]1CCCCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237555916	202281640	/nfs/dbraw/zinc/28/16/40/202281640.db2.gz	TVDXZADYHAEZKR-TVQRCGJNSA-N	1	1	317.349	1.813	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000604278267	359732210	/nfs/dbraw/zinc/73/22/10/359732210.db2.gz	ZLSBSQLOABCARO-VIFPVBQESA-N	1	1	317.342	1.106	20	5		DDBDMO
C[N@H+]1CCC[C@H](NS(=O)(=O)c2ccc([N+](=O)[O-])cc2F)C1	ZINC000604278267	359732216	/nfs/dbraw/zinc/73/22/16/359732216.db2.gz	ZLSBSQLOABCARO-VIFPVBQESA-N	1	1	317.342	1.106	20	5		DDBDMO
CNc1ccc(C(=O)N[C@@H]2CC[N@@H+](CCOC)C2)cc1[N+](=O)[O-]	ZINC000609347444	360299478	/nfs/dbraw/zinc/29/94/78/360299478.db2.gz	KZBWNCUZHQBOJO-GFCCVEGCSA-N	1	1	322.365	1.087	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2CC[N@@H+](CC3CC3)C2)c([N+](=O)[O-])c1	ZINC000609384324	360303375	/nfs/dbraw/zinc/30/33/75/360303375.db2.gz	JDQLWRKFZMTUDE-ZDUSSCGKSA-N	1	1	318.377	1.851	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C[C@H](C)O)CC2)ccc1[N+](=O)[O-]	ZINC000189691926	200438907	/nfs/dbraw/zinc/43/89/07/200438907.db2.gz	DYUJJIFQGZJDCS-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)Cc2cn[nH]c2)c([N+](=O)[O-])c1	ZINC000610662218	360495021	/nfs/dbraw/zinc/49/50/21/360495021.db2.gz	XSOJCBFLEYKWNI-UHFFFAOYSA-N	1	1	306.322	1.837	20	5		DDBDMO
C[C@H](NC(=O)[C@@H]1C[N@H+]2CCN1CCC2)c1cccc([N+](=O)[O-])c1	ZINC000611201351	360657719	/nfs/dbraw/zinc/65/77/19/360657719.db2.gz	UAPCPWTVCHOIQV-WFASDCNBSA-N	1	1	318.377	1.162	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])s1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619252419	363945399	/nfs/dbraw/zinc/94/53/99/363945399.db2.gz	KYKRSZAHBNJPOE-VHSXEESVSA-N	1	1	313.354	1.915	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1CNCC[N@H+]1CC=CCC1)OCCO2	ZINC000619433167	364007011	/nfs/dbraw/zinc/00/70/11/364007011.db2.gz	ZWMYNCSDRIADNE-UHFFFAOYSA-N	1	1	319.361	1.718	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1CNCC[N@@H+]1CC=CCC1)OCCO2	ZINC000619433167	364007018	/nfs/dbraw/zinc/00/70/18/364007018.db2.gz	ZWMYNCSDRIADNE-UHFFFAOYSA-N	1	1	319.361	1.718	20	5		DDBDMO
COc1c(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cccc1[N+](=O)[O-]	ZINC000619435626	364007449	/nfs/dbraw/zinc/00/74/49/364007449.db2.gz	MCYGHVBJDRQVDH-LBPRGKRZSA-N	1	1	319.361	1.818	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@@H+](C[C@H](C)O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000275318029	212268411	/nfs/dbraw/zinc/26/84/11/212268411.db2.gz	DBEZBKQSBIIHDR-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
CC(=O)c1ccc(N2CC[N@H+](C[C@H](C)O)C[C@H]2C)c([N+](=O)[O-])c1	ZINC000275318029	212268413	/nfs/dbraw/zinc/26/84/13/212268413.db2.gz	DBEZBKQSBIIHDR-NEPJUHHUSA-N	1	1	321.377	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@H]1CCS(=O)(=O)C1	ZINC000349961140	284120375	/nfs/dbraw/zinc/12/03/75/284120375.db2.gz	BEGWOPRPDXNZOC-GFCCVEGCSA-N	1	1	312.391	1.770	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@H]1CCS(=O)(=O)C1	ZINC000349961140	284120377	/nfs/dbraw/zinc/12/03/77/284120377.db2.gz	BEGWOPRPDXNZOC-GFCCVEGCSA-N	1	1	312.391	1.770	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](Cc1ccncc1)C1CC1	ZINC000093221573	193217881	/nfs/dbraw/zinc/21/78/81/193217881.db2.gz	VKOWRAODXWNREV-UHFFFAOYSA-N	1	1	314.345	1.816	20	5		DDBDMO
COc1ccc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000264672159	204069242	/nfs/dbraw/zinc/06/92/42/204069242.db2.gz	WWZKVJYWOFZCLG-LLVKDONJSA-N	1	1	319.361	1.818	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(Cc2ccc([N+](=O)[O-])c(F)c2)[C@@H](C)C1	ZINC000282496769	217041085	/nfs/dbraw/zinc/04/10/85/217041085.db2.gz	NAPSMDDDCFBNAH-RYUDHWBXSA-N	1	1	311.357	1.621	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CC[NH+](CCO)CC2)cc1OC(F)F	ZINC000266100732	205098488	/nfs/dbraw/zinc/09/84/88/205098488.db2.gz	HQOHCUYZGHLWDM-UHFFFAOYSA-N	1	1	317.292	1.311	20	5		DDBDMO
NC(=O)[C@H]1CCCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000282802544	217260112	/nfs/dbraw/zinc/26/01/12/217260112.db2.gz	XGPLYJLMHXXMFM-CYBMUJFWSA-N	1	1	320.349	1.263	20	5		DDBDMO
CCc1n[nH]c(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266445139	205352832	/nfs/dbraw/zinc/35/28/32/205352832.db2.gz	BGXIXVPMJRKZAG-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)c1[N+](=O)[O-]	ZINC000266445139	205352836	/nfs/dbraw/zinc/35/28/36/205352836.db2.gz	BGXIXVPMJRKZAG-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
CCc1[nH]nc(C(=O)N(C)CC[C@@H]2CCCC[N@H+]2C)c1[N+](=O)[O-]	ZINC000266445139	205352838	/nfs/dbraw/zinc/35/28/38/205352838.db2.gz	BGXIXVPMJRKZAG-NSHDSACASA-N	1	1	323.397	1.827	20	5		DDBDMO
O=C(C[N@H+]1CCCC[C@@H]1CO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000159883831	197370994	/nfs/dbraw/zinc/37/09/94/197370994.db2.gz	YQRNYRNHFXQZCG-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@@H+]1CCCC[C@@H]1CO)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000159883831	197370996	/nfs/dbraw/zinc/37/09/96/197370996.db2.gz	YQRNYRNHFXQZCG-CQSZACIVSA-N	1	1	319.361	1.331	20	5		DDBDMO
CO[C@H]1C[C@@H](CN(C)C(=O)c2cccc(C)c2[N+](=O)[O-])[N@@H+](C)C1	ZINC000284583504	218089694	/nfs/dbraw/zinc/08/96/94/218089694.db2.gz	IKYWOFFPUIEWTP-STQMWFEESA-N	1	1	321.377	1.694	20	5		DDBDMO
O=[N+]([O-])c1c2cccnc2ccc1N1CC[NH+](CCO)CC1	ZINC000059371578	285079706	/nfs/dbraw/zinc/07/97/06/285079706.db2.gz	VCJZMRHXCMZVKR-UHFFFAOYSA-N	1	1	302.334	1.257	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@]1(C)CO	ZINC000567970557	304256738	/nfs/dbraw/zinc/25/67/38/304256738.db2.gz	ICJWDIAWSILKOG-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@]1(C)CO	ZINC000567970557	304256740	/nfs/dbraw/zinc/25/67/40/304256740.db2.gz	ICJWDIAWSILKOG-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[C@@H](CNC(=O)c1[nH]ncc1[N+](=O)[O-])[N@@H+](C)Cc1ccccc1	ZINC000154876438	197000445	/nfs/dbraw/zinc/00/04/45/197000445.db2.gz	NZVJARWHISDWFN-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
C[C@@H](CNC(=O)c1n[nH]cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1	ZINC000154876438	197000447	/nfs/dbraw/zinc/00/04/47/197000447.db2.gz	NZVJARWHISDWFN-NSHDSACASA-N	1	1	317.349	1.568	20	5		DDBDMO
CN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000352700714	285238849	/nfs/dbraw/zinc/23/88/49/285238849.db2.gz	UFJJWJOORWPDPX-CYBMUJFWSA-N	1	1	320.349	1.086	20	5		DDBDMO
O=[N+]([O-])c1ccc(Cl)c(CNCC[NH+]2CCC(O)CC2)c1	ZINC000294723607	224193417	/nfs/dbraw/zinc/19/34/17/224193417.db2.gz	BANPJEALBYRWQO-UHFFFAOYSA-N	1	1	313.785	1.795	20	5		DDBDMO
CN(C)CC[N@@H+](C)CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000289688761	221156803	/nfs/dbraw/zinc/15/68/03/221156803.db2.gz	HKMLLFGRHUFZPI-UHFFFAOYSA-N	1	1	323.397	1.600	20	5		DDBDMO
CN(CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1)CC[NH+](C)C	ZINC000289688761	221156804	/nfs/dbraw/zinc/15/68/04/221156804.db2.gz	HKMLLFGRHUFZPI-UHFFFAOYSA-N	1	1	323.397	1.600	20	5		DDBDMO
Cc1n[nH]c(C(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000352820995	285320783	/nfs/dbraw/zinc/32/07/83/285320783.db2.gz	RPDFTKVLHXIVLU-ZJUUUORDSA-N	1	1	309.370	1.477	20	5		DDBDMO
COc1ccc(C[NH+]2CCC3(COC(=O)N3)CC2)cc1[N+](=O)[O-]	ZINC000495251310	533554593	/nfs/dbraw/zinc/55/45/93/533554593.db2.gz	KDTNPGBZFYGSOA-UHFFFAOYSA-N	1	1	321.333	1.678	20	5		DDBDMO
Cc1n[nH]c(C(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)c1[N+](=O)[O-]	ZINC000299449230	533665433	/nfs/dbraw/zinc/66/54/33/533665433.db2.gz	PWYPTCSQJRHULP-PHIMTYICSA-N	1	1	323.397	1.724	20	5		DDBDMO
Cn1ccnc1[C@@H]([NH2+]CC1(O)CCC1)c1cccc([N+](=O)[O-])c1	ZINC000353514417	285779196	/nfs/dbraw/zinc/77/91/96/285779196.db2.gz	GRWHIUNBHZVQDY-AWEZNQCLSA-N	1	1	316.361	1.922	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC[NH2+]C[C@H]2C)c1C	ZINC000193356915	292291508	/nfs/dbraw/zinc/29/15/08/292291508.db2.gz	AOAOANVPDYIRRJ-SNVBAGLBSA-N	1	1	313.379	1.194	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000068800582	406662095	/nfs/dbraw/zinc/66/20/95/406662095.db2.gz	MEJMBFGNHDZNBO-CYBMUJFWSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN1CCN(C)[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000068800582	406662110	/nfs/dbraw/zinc/66/21/10/406662110.db2.gz	MEJMBFGNHDZNBO-CYBMUJFWSA-N	1	1	312.801	1.584	20	5		DDBDMO
CN(C)C(=O)C[N@@H+]1CCCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000029847192	406928061	/nfs/dbraw/zinc/92/80/61/406928061.db2.gz	VTEZVZBKYMZUST-UHFFFAOYSA-N	1	1	320.393	1.191	20	5		DDBDMO
CN(C)C(=O)C[N@H+]1CCCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000029847192	406928063	/nfs/dbraw/zinc/92/80/63/406928063.db2.gz	VTEZVZBKYMZUST-UHFFFAOYSA-N	1	1	320.393	1.191	20	5		DDBDMO
COCC[N@@H+](C)CCCNc1nc2sccn2c1[N+](=O)[O-]	ZINC000075676862	406939555	/nfs/dbraw/zinc/93/95/55/406939555.db2.gz	KJGWRLAINAWQHH-UHFFFAOYSA-N	1	1	313.383	1.684	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000090554572	407169557	/nfs/dbraw/zinc/16/95/57/407169557.db2.gz	RXXQAWZWGBXOIU-YUELXQCFSA-N	1	1	321.377	1.502	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000097667751	407301365	/nfs/dbraw/zinc/30/13/65/407301365.db2.gz	GDHHXCFIRXVDHA-WDEREUQCSA-N	1	1	322.365	1.133	20	5		DDBDMO
NS(=O)(=O)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000104064473	407345916	/nfs/dbraw/zinc/34/59/16/407345916.db2.gz	QIULHGKRYNJJIH-UHFFFAOYSA-N	1	1	313.379	1.095	20	5		DDBDMO
C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCN1CCOCC1	ZINC000112406703	407429163	/nfs/dbraw/zinc/42/91/63/407429163.db2.gz	RITXUTUXHJPJBV-UHFFFAOYSA-N	1	1	323.393	1.628	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000113198163	407472855	/nfs/dbraw/zinc/47/28/55/407472855.db2.gz	AZKZIYLUTIGOGI-GFCCVEGCSA-N	1	1	309.370	1.172	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000271326462	407636101	/nfs/dbraw/zinc/63/61/01/407636101.db2.gz	AEIVBBQOSZJZOF-LLVKDONJSA-N	1	1	309.370	1.179	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000152879540	407709754	/nfs/dbraw/zinc/70/97/54/407709754.db2.gz	PTXFMOQIANTXKX-GUTXKFCHSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCC[C@@H]2C1	ZINC000171584484	407712219	/nfs/dbraw/zinc/71/22/19/407712219.db2.gz	NBTVRIHNBQAFBW-HSBSLETESA-N	1	1	301.346	1.915	20	5		DDBDMO
C[C@H](O)C[C@H]1CCC[N@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000152996003	407730560	/nfs/dbraw/zinc/73/05/60/407730560.db2.gz	DWWHCTPMIMPWSH-SWLSCSKDSA-N	1	1	321.377	1.793	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000171665556	407736676	/nfs/dbraw/zinc/73/66/76/407736676.db2.gz	XATYRAGAFKZZIO-UHFFFAOYSA-N	1	1	304.350	1.584	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N(C)CC[N@@H+](C)C1CC1	ZINC000186758713	407767215	/nfs/dbraw/zinc/76/72/15/407767215.db2.gz	FVECSPLNBAMNCT-LBPRGKRZSA-N	1	1	320.393	1.948	20	5		DDBDMO
C[NH+](C)C1CN(S(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000272159677	407797044	/nfs/dbraw/zinc/79/70/44/407797044.db2.gz	YTMJNDSLXKCXNF-UHFFFAOYSA-N	1	1	319.770	1.183	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(NCCC[N@H+]2CCC[C@H]2C(N)=O)c1	ZINC000268033998	407863914	/nfs/dbraw/zinc/86/39/14/407863914.db2.gz	LTRCVEVCIHXLKH-AWEZNQCLSA-N	1	1	306.366	1.655	20	5		DDBDMO
C[NH+](C)Cc1ccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])cc1F	ZINC000135191549	407988747	/nfs/dbraw/zinc/98/87/47/407988747.db2.gz	OHHDZUAOJWFLMG-UHFFFAOYSA-N	1	1	321.312	1.449	20	5		DDBDMO
Cc1nc(NCCC[N@H+]2CCC[C@H]2C(N)=O)ccc1[N+](=O)[O-]	ZINC000268505469	408074971	/nfs/dbraw/zinc/07/49/71/408074971.db2.gz	QYJCYZHVXLHHHI-LBPRGKRZSA-N	1	1	307.354	1.050	20	5		DDBDMO
C[C@@H]1CCC[C@H](CO)[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000136170970	408086485	/nfs/dbraw/zinc/08/64/85/408086485.db2.gz	KNVDZKVPTDSYKV-YUELXQCFSA-N	1	1	324.377	1.570	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCOC[C@@H]1C1CC1	ZINC000182297685	408120082	/nfs/dbraw/zinc/12/00/82/408120082.db2.gz	DCFFUNWRYHJCRQ-UKRRQHHQSA-N	1	1	322.361	1.445	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCOC[C@@H]1C1CC1	ZINC000182297685	408120086	/nfs/dbraw/zinc/12/00/86/408120086.db2.gz	DCFFUNWRYHJCRQ-UKRRQHHQSA-N	1	1	322.361	1.445	20	5		DDBDMO
C[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1nnc2ccccn21	ZINC000182679382	306706409	/nfs/dbraw/zinc/70/64/09/306706409.db2.gz	OCJYPVFKBDGIFW-JTQLQIEISA-N	1	1	301.310	1.185	20	5		DDBDMO
C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000246545905	408290451	/nfs/dbraw/zinc/29/04/51/408290451.db2.gz	QMPVBLWYBQFYSK-PWSUYJOCSA-N	1	1	304.350	1.486	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000269446503	408312175	/nfs/dbraw/zinc/31/21/75/408312175.db2.gz	FPEZMEOTWJAHEG-CYBMUJFWSA-N	1	1	321.377	1.432	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](c2cc[nH]n2)C1	ZINC000131260328	162010096	/nfs/dbraw/zinc/01/00/96/162010096.db2.gz	QUWXKTNIJFDGNH-GFCCVEGCSA-N	1	1	317.349	1.359	20	5		DDBDMO
COC[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172886920	162309241	/nfs/dbraw/zinc/30/92/41/162309241.db2.gz	HGHIYGDBQXIEIG-AWEZNQCLSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000172886920	162309244	/nfs/dbraw/zinc/30/92/44/162309244.db2.gz	HGHIYGDBQXIEIG-AWEZNQCLSA-N	1	1	323.349	1.271	20	5		DDBDMO
NC(=O)C[C@H]1CCC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000269631595	408368359	/nfs/dbraw/zinc/36/83/59/408368359.db2.gz	FWXWSESOKRYCRB-BXUZGUMPSA-N	1	1	307.350	1.216	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@H]1C	ZINC000247506082	408483035	/nfs/dbraw/zinc/48/30/35/408483035.db2.gz	XZVMHIZQSMTWGO-QMTHXVAHSA-N	1	1	306.366	1.757	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000270350591	408498024	/nfs/dbraw/zinc/49/80/24/408498024.db2.gz	GEGUWNOIANWIHM-UHFFFAOYSA-N	1	1	321.377	1.514	20	5		DDBDMO
COc1cccc(C(=O)N[C@@H]2C[C@H](C)[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000192690380	408631877	/nfs/dbraw/zinc/63/18/77/408631877.db2.gz	CVCKGRKQBODRJU-WDEREUQCSA-N	1	1	319.361	1.958	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CCCOCC2)c1	ZINC000275728958	408661837	/nfs/dbraw/zinc/66/18/37/408661837.db2.gz	ATYPEYQYSWRVJH-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCOCC2)c1	ZINC000275728958	408661841	/nfs/dbraw/zinc/66/18/41/408661841.db2.gz	ATYPEYQYSWRVJH-UHFFFAOYSA-N	1	1	307.350	1.355	20	5		DDBDMO
C[C@@H]([NH2+]CCCN1CCN(C)CC1)c1cccc([N+](=O)[O-])c1	ZINC000162111713	408670894	/nfs/dbraw/zinc/67/08/94/408670894.db2.gz	MVPVDQAFMZQEBU-CQSZACIVSA-N	1	1	306.410	1.883	20	5		DDBDMO
C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000249078353	408684670	/nfs/dbraw/zinc/68/46/70/408684670.db2.gz	SEQAWAMGMUYOIR-NEBZKDRISA-N	1	1	324.377	1.568	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421694	408699671	/nfs/dbraw/zinc/69/96/71/408699671.db2.gz	HBCPHFKSCWTAIW-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1CCC[C@@H](CO)[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421694	408699675	/nfs/dbraw/zinc/69/96/75/408699675.db2.gz	HBCPHFKSCWTAIW-NEPJUHHUSA-N	1	1	307.350	1.769	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)cc([N+](=O)[O-])c1	ZINC000285872577	408880566	/nfs/dbraw/zinc/88/05/66/408880566.db2.gz	RLCNJFFXPORUHD-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
CCN(CCC[NH+](CC)CC)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000276305366	408833170	/nfs/dbraw/zinc/83/31/70/408833170.db2.gz	AXMORYRAZLUXLT-UHFFFAOYSA-N	1	1	311.386	1.820	20	5		DDBDMO
CCOC(=O)c1c[nH+]ccc1NCCn1cc([N+](=O)[O-])cn1	ZINC000280810624	408837729	/nfs/dbraw/zinc/83/77/29/408837729.db2.gz	WVUHMXMRFJHMBY-UHFFFAOYSA-N	1	1	305.294	1.475	20	5		DDBDMO
Cc1cc(C(=O)N2CCO[C@@H]3CC[N@H+](C)C[C@@H]32)ccc1[N+](=O)[O-]	ZINC000285780985	408863571	/nfs/dbraw/zinc/86/35/71/408863571.db2.gz	NAVAKFBQSMKVFV-LSDHHAIUSA-N	1	1	319.361	1.448	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[NH+](C2CCC2)CC1	ZINC000276477297	408866422	/nfs/dbraw/zinc/86/64/22/408866422.db2.gz	FIQCKGLEJJRCMU-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(C(=O)NCc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000291991085	408957804	/nfs/dbraw/zinc/95/78/04/408957804.db2.gz	QNWIQZFCGPSMDA-INIZCTEOSA-N	1	1	318.377	1.832	20	5		DDBDMO
CC[N@H+]1CCN(c2nc3ccc([N+](=O)[O-])cc3c(=O)[nH]2)[C@H](C)C1	ZINC000286423380	408982986	/nfs/dbraw/zinc/98/29/86/408982986.db2.gz	REVGZMJSUVXMAB-SNVBAGLBSA-N	1	1	317.349	1.774	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCOCCO	ZINC000282256906	409020678	/nfs/dbraw/zinc/02/06/78/409020678.db2.gz	CLSXQRKQAHRNHH-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCOCCO	ZINC000282256906	409020680	/nfs/dbraw/zinc/02/06/80/409020680.db2.gz	CLSXQRKQAHRNHH-UHFFFAOYSA-N	1	1	312.366	1.823	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[NH+]2[C@@H](CO)CC[C@@H]2CO)c(Cl)c1	ZINC000287602204	409062956	/nfs/dbraw/zinc/06/29/56/409062956.db2.gz	YUXDSXLPQOMNNS-VXGBXAGGSA-N	1	1	300.742	1.566	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)CO	ZINC000293417148	409108869	/nfs/dbraw/zinc/10/88/69/409108869.db2.gz	MWNBOVHWDUJJBQ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](C)CO	ZINC000293417148	409108870	/nfs/dbraw/zinc/10/88/70/409108870.db2.gz	MWNBOVHWDUJJBQ-VIFPVBQESA-N	1	1	315.757	1.889	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1	ZINC000279269430	409181893	/nfs/dbraw/zinc/18/18/93/409181893.db2.gz	YSHSCTWKLFZZPT-PHIMTYICSA-N	1	1	305.334	1.237	20	5		DDBDMO
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000279281727	409184521	/nfs/dbraw/zinc/18/45/21/409184521.db2.gz	WWTQROIHFVCQPC-STQMWFEESA-N	1	1	322.340	1.673	20	5		DDBDMO
CO[C@H]1COC[C@@H]1[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C	ZINC000290245223	409335279	/nfs/dbraw/zinc/33/52/79/409335279.db2.gz	ZNFCFRXEXCGENW-OSMZGAPFSA-N	1	1	323.349	1.234	20	5		DDBDMO
CC[N@@H+](CCNC(=O)COc1ccc([N+](=O)[O-])c(C)c1)C1CC1	ZINC000280694065	409414705	/nfs/dbraw/zinc/41/47/05/409414705.db2.gz	ZTXRDENAIZNTRM-UHFFFAOYSA-N	1	1	321.377	1.883	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)cc1F	ZINC000316493828	164022700	/nfs/dbraw/zinc/02/27/00/164022700.db2.gz	XZRSZOVCYPUAJQ-CYBMUJFWSA-N	1	1	309.341	1.640	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](N3CCOCC3)C2)cc1F	ZINC000316493828	164022701	/nfs/dbraw/zinc/02/27/01/164022701.db2.gz	XZRSZOVCYPUAJQ-CYBMUJFWSA-N	1	1	309.341	1.640	20	5		DDBDMO
Cc1nn(C)c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000408130119	164236931	/nfs/dbraw/zinc/23/69/31/164236931.db2.gz	SVISMLNEOMLWSX-GXSJLCMTSA-N	1	1	309.370	1.191	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc4c(c([N+](=O)[O-])c3)OCO4)C[C@@H]21	ZINC000408471850	164342945	/nfs/dbraw/zinc/34/29/45/164342945.db2.gz	XZAKUTJATYYOGI-SKDRFNHKSA-N	1	1	319.317	1.100	20	5		DDBDMO
COc1c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-]	ZINC000331513247	409587637	/nfs/dbraw/zinc/58/76/37/409587637.db2.gz	MZHHIBLWVQVJGP-SNVBAGLBSA-N	1	1	305.334	1.570	20	5		DDBDMO
C[C@]1(CNC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCC[NH2+]C1	ZINC000342711787	409833932	/nfs/dbraw/zinc/83/39/32/409833932.db2.gz	AEQFFPACZKOHBT-HNNXBMFYSA-N	1	1	317.349	1.591	20	5		DDBDMO
C[C@@H]1C[N@H+](C)CCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000331920961	409799925	/nfs/dbraw/zinc/79/99/25/409799925.db2.gz	CAXRIHRYTULLJW-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12	ZINC000331920961	409799934	/nfs/dbraw/zinc/79/99/34/409799934.db2.gz	CAXRIHRYTULLJW-SNVBAGLBSA-N	1	1	302.334	1.852	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)CCn2cc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000354391099	409817245	/nfs/dbraw/zinc/81/72/45/409817245.db2.gz	JUGUTTHEQTXFQQ-CHWSQXEVSA-N	1	1	323.397	1.513	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccncc1	ZINC000338353613	409932358	/nfs/dbraw/zinc/93/23/58/409932358.db2.gz	SIVSKGWACQSASN-UHFFFAOYSA-N	1	1	314.345	1.525	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccncc1	ZINC000338353613	409932366	/nfs/dbraw/zinc/93/23/66/409932366.db2.gz	SIVSKGWACQSASN-UHFFFAOYSA-N	1	1	314.345	1.525	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@H](C)CN1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000332228477	409993985	/nfs/dbraw/zinc/99/39/85/409993985.db2.gz	LIEXJGVTLDXTAY-GHMZBOCLSA-N	1	1	303.366	1.996	20	5		DDBDMO
CCNC(=O)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)C(C)C	ZINC000339320342	410091333	/nfs/dbraw/zinc/09/13/33/410091333.db2.gz	XEAXOAMTGIJMJH-CQSZACIVSA-N	1	1	309.366	1.854	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCc3[nH+]c[nH]c3C2)n1	ZINC000357552051	410096302	/nfs/dbraw/zinc/09/63/02/410096302.db2.gz	VKEFWHLTDGHPRQ-QMMMGPOBSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2CCc3[nH]c[nH+]c3C2)n1	ZINC000357552051	410096313	/nfs/dbraw/zinc/09/63/13/410096313.db2.gz	VKEFWHLTDGHPRQ-QMMMGPOBSA-N	1	1	317.305	1.469	20	5		DDBDMO
C[C@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@@H+]1CCO	ZINC000351833537	410275432	/nfs/dbraw/zinc/27/54/32/410275432.db2.gz	IBQLKXZYPXFLEF-JTQLQIEISA-N	1	1	315.320	1.371	20	5		DDBDMO
C[C@H]1CN(Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1CCO	ZINC000351833537	410275438	/nfs/dbraw/zinc/27/54/38/410275438.db2.gz	IBQLKXZYPXFLEF-JTQLQIEISA-N	1	1	315.320	1.371	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H](C)CO	ZINC000339635286	410351280	/nfs/dbraw/zinc/35/12/80/410351280.db2.gz	UXNWLWCJTLNPDS-LBPRGKRZSA-N	1	1	309.366	1.935	20	5		DDBDMO
CN(C(=O)Cc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000347004999	410307267	/nfs/dbraw/zinc/30/72/67/410307267.db2.gz	KVUFLNXKPUOMMR-AWEZNQCLSA-N	1	1	303.362	1.832	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2csc([N+](=O)[O-])c2)CC1	ZINC000299067652	410507266	/nfs/dbraw/zinc/50/72/66/410507266.db2.gz	WCQFCKJJUJBDDS-UHFFFAOYSA-N	1	1	313.379	1.451	20	5		DDBDMO
Cc1sc(S(=O)(=O)NCC[N@H+](C)C2CC2)cc1[N+](=O)[O-]	ZINC000343491732	410491650	/nfs/dbraw/zinc/49/16/50/410491650.db2.gz	BONDOHXBNSOJIC-UHFFFAOYSA-N	1	1	319.408	1.337	20	5		DDBDMO
C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000347394886	410518572	/nfs/dbraw/zinc/51/85/72/410518572.db2.gz	XZERFUITGKMYLG-GFCCVEGCSA-N	1	1	306.366	1.727	20	5		DDBDMO
COC[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C1	ZINC000352233281	410565906	/nfs/dbraw/zinc/56/59/06/410565906.db2.gz	BOHGUXSLWWWKEN-IUODEOHRSA-N	1	1	319.361	1.668	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355555875	410578091	/nfs/dbraw/zinc/57/80/91/410578091.db2.gz	PWPSJCFUDVJHJQ-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2c([N+](=O)[O-])ncn2C)C1	ZINC000355555875	410578094	/nfs/dbraw/zinc/57/80/94/410578094.db2.gz	PWPSJCFUDVJHJQ-GFCCVEGCSA-N	1	1	323.397	1.457	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cnc1N	ZINC000343580045	410547675	/nfs/dbraw/zinc/54/76/75/410547675.db2.gz	VPAPTCDIMFBNSN-SNVBAGLBSA-N	1	1	307.354	1.176	20	5		DDBDMO
COC(=O)COc1ccc(C[N@H+]2CC[C@H](OC)C2)cc1[N+](=O)[O-]	ZINC000355720618	410659839	/nfs/dbraw/zinc/65/98/39/410659839.db2.gz	AJYYEXVYIDMIAQ-LBPRGKRZSA-N	1	1	324.333	1.367	20	5		DDBDMO
COC(=O)COc1ccc(C[N@@H+]2CC[C@H](OC)C2)cc1[N+](=O)[O-]	ZINC000355720618	410659845	/nfs/dbraw/zinc/65/98/45/410659845.db2.gz	AJYYEXVYIDMIAQ-LBPRGKRZSA-N	1	1	324.333	1.367	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1OC[C@H](O)C[NH+]1C[C@H](C)O[C@@H](C)C1	ZINC000340168601	410720013	/nfs/dbraw/zinc/72/00/13/410720013.db2.gz	SWJKQYHOQIVWLN-MELADBBJSA-N	1	1	324.377	1.752	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC[C@@](C)(O)C[NH+]1CCOCC1	ZINC000301782132	410795357	/nfs/dbraw/zinc/79/53/57/410795357.db2.gz	SZNOVUPFBPYXNZ-OAHLLOKOSA-N	1	1	309.366	1.398	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000330597688	410809997	/nfs/dbraw/zinc/80/99/97/410809997.db2.gz	SJQMLWYEKVHNTN-NWDGAFQWSA-N	1	1	307.350	1.525	20	5		DDBDMO
O=C(NCC[NH+]1CCC1)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000337596707	410885006	/nfs/dbraw/zinc/88/50/06/410885006.db2.gz	PERVIWKXJLJSPK-UHFFFAOYSA-N	1	1	304.350	1.605	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CCC[C@H]2CS(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000353467330	411004626	/nfs/dbraw/zinc/00/46/26/411004626.db2.gz	BFKHIONZKDEODA-LBPRGKRZSA-N	1	1	313.379	1.156	20	5		DDBDMO
Cc1ccc(C[N@H+]2CCC[C@H]2CS(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000353467330	411004631	/nfs/dbraw/zinc/00/46/31/411004631.db2.gz	BFKHIONZKDEODA-LBPRGKRZSA-N	1	1	313.379	1.156	20	5		DDBDMO
NC(=O)c1cccc(N[C@H]2CC[N@H+]3CCC[C@H]3C2)c1[N+](=O)[O-]	ZINC000341722586	411051996	/nfs/dbraw/zinc/05/19/96/411051996.db2.gz	OLOKNUXTFQUVRJ-QWRGUYRKSA-N	1	1	304.350	1.732	20	5		DDBDMO
C[C@H]1C[C@H](C(=O)NCCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000353580637	411071792	/nfs/dbraw/zinc/07/17/92/411071792.db2.gz	IQFZFLPGDNRFQS-QWHCGFSZSA-N	1	1	320.393	1.853	20	5		DDBDMO
Cc1cc(OCC(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000331201530	411014536	/nfs/dbraw/zinc/01/45/36/411014536.db2.gz	QJKPRYYDDORZGF-OLZOCXBDSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000331216888	411021638	/nfs/dbraw/zinc/02/16/38/411021638.db2.gz	PVNYOXLRRUJJDD-ZJUUUORDSA-N	1	1	309.370	1.654	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)CC1(O)CCC1	ZINC000353498245	411033439	/nfs/dbraw/zinc/03/34/39/411033439.db2.gz	UQSPZPSBNIUNFP-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)CC1(O)CCC1	ZINC000353498245	411033446	/nfs/dbraw/zinc/03/34/46/411033446.db2.gz	UQSPZPSBNIUNFP-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
[NH3+]CCC[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])c1ccccc1	ZINC000580714293	422949743	/nfs/dbraw/zinc/94/97/43/422949743.db2.gz	PYQQUOBZHNMXBX-NSHDSACASA-N	1	1	303.322	1.528	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](CO)C(C)(C)C	ZINC000134378102	196384057	/nfs/dbraw/zinc/38/40/57/196384057.db2.gz	CXHAGFPUOXZULD-CYBMUJFWSA-N	1	1	309.366	1.872	20	5		DDBDMO
O=C(CCN1CC[C@]2(CC[NH2+]C2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000360535655	418458265	/nfs/dbraw/zinc/45/82/65/418458265.db2.gz	QPKGCKMRQVLDPG-INIZCTEOSA-N	1	1	318.377	1.609	20	5		DDBDMO
CNc1c(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360947553	418551735	/nfs/dbraw/zinc/55/17/35/418551735.db2.gz	XMXCEBHQVHAFGA-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)cccc1[N+](=O)[O-]	ZINC000360947553	418551737	/nfs/dbraw/zinc/55/17/37/418551737.db2.gz	XMXCEBHQVHAFGA-WDEREUQCSA-N	1	1	306.366	1.801	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@H](O)C2(C)C)c([N+](=O)[O-])c1	ZINC000361420922	418649413	/nfs/dbraw/zinc/64/94/13/418649413.db2.gz	QECWKSOVMSGMPZ-AWEZNQCLSA-N	1	1	310.350	1.827	20	5		DDBDMO
CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1c([N+](=O)[O-])ncn1C)CC2	ZINC000361364977	418635710	/nfs/dbraw/zinc/63/57/10/418635710.db2.gz	CSLDUOQXZSMXOY-STQMWFEESA-N	1	1	324.381	1.080	20	5		DDBDMO
COCC[N@@H+](C)C[C@H](O)COc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000386741908	418741293	/nfs/dbraw/zinc/74/12/93/418741293.db2.gz	XUPHWKGYNWYNRS-NSHDSACASA-N	1	1	318.757	1.566	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000408073942	418786205	/nfs/dbraw/zinc/78/62/05/418786205.db2.gz	VDSKGHUOPYGWPJ-RYUDHWBXSA-N	1	1	321.377	1.986	20	5		DDBDMO
CC(C)C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(N)=O	ZINC000411165451	418875475	/nfs/dbraw/zinc/87/54/75/418875475.db2.gz	OTRSRKJFZSAWIW-UHFFFAOYSA-N	1	1	322.365	1.367	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681240	418893623	/nfs/dbraw/zinc/89/36/23/418893623.db2.gz	VYPRJWANGMBASF-GXTWGEPZSA-N	1	1	321.337	1.286	20	5		DDBDMO
Cc1cc([C@H]2CCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)no1	ZINC000365681240	418893628	/nfs/dbraw/zinc/89/36/28/418893628.db2.gz	VYPRJWANGMBASF-GXTWGEPZSA-N	1	1	321.337	1.286	20	5		DDBDMO
COC(=O)C(C)(C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411368632	418896367	/nfs/dbraw/zinc/89/63/67/418896367.db2.gz	OQGIUGZLUVONTC-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
COC(=O)C(C)(C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411368632	418896370	/nfs/dbraw/zinc/89/63/70/418896370.db2.gz	OQGIUGZLUVONTC-UHFFFAOYSA-N	1	1	323.349	1.807	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[N@H+](C)CC1	ZINC000298120523	228365147	/nfs/dbraw/zinc/36/51/47/228365147.db2.gz	TVAKQVSSTKMIEW-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCN(C)CC1	ZINC000298120523	228365150	/nfs/dbraw/zinc/36/51/50/228365150.db2.gz	TVAKQVSSTKMIEW-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCN(C)CC1	ZINC000298120523	228365152	/nfs/dbraw/zinc/36/51/52/228365152.db2.gz	TVAKQVSSTKMIEW-UHFFFAOYSA-N	1	1	320.393	1.869	20	5		DDBDMO
C[C@@H]1C[C@H](CO)C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1	ZINC000420952397	419381766	/nfs/dbraw/zinc/38/17/66/419381766.db2.gz	XWDXCUIEEUJJLA-NEPJUHHUSA-N	1	1	322.361	1.912	20	5		DDBDMO
CC(C)([NH2+]CC(=O)N1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000429250993	419991589	/nfs/dbraw/zinc/99/15/89/419991589.db2.gz	ANGBOSOSEHXGST-UHFFFAOYSA-N	1	1	307.350	1.278	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@@H](C)CN	ZINC000430929558	420211418	/nfs/dbraw/zinc/21/14/18/420211418.db2.gz	PEHPXTFTACBPTN-JTQLQIEISA-N	1	1	310.354	1.211	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](C)CN	ZINC000430929558	420211421	/nfs/dbraw/zinc/21/14/21/420211421.db2.gz	PEHPXTFTACBPTN-JTQLQIEISA-N	1	1	310.354	1.211	20	5		DDBDMO
C[C@H]1CN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC[C@@H]1[NH3+]	ZINC000430967673	420228659	/nfs/dbraw/zinc/22/86/59/420228659.db2.gz	UDUFBENVXWVGAC-FZMZJTMJSA-N	1	1	306.366	1.593	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444622893	230112792	/nfs/dbraw/zinc/11/27/92/230112792.db2.gz	WUBJQYXNGXRTFS-JTQLQIEISA-N	1	1	317.349	1.701	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000444622893	230112795	/nfs/dbraw/zinc/11/27/95/230112795.db2.gz	WUBJQYXNGXRTFS-JTQLQIEISA-N	1	1	317.349	1.701	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H](n2ccnn2)C1	ZINC000425505703	420403631	/nfs/dbraw/zinc/40/36/31/420403631.db2.gz	YWKLQIDLLTXKEO-CYBMUJFWSA-N	1	1	317.349	1.902	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@H+](C[C@@H](C)O)C[C@@H]2C)n1	ZINC000444830513	230139023	/nfs/dbraw/zinc/13/90/23/230139023.db2.gz	WNTPDWJZGCATNH-QWHCGFSZSA-N	1	1	308.382	1.498	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000493608103	420894873	/nfs/dbraw/zinc/89/48/73/420894873.db2.gz	CCFOEANGMPNPMV-ISRGKOJGSA-N	1	1	301.346	1.628	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN[C@@H]2CCC[N@@H+](CCCO)C2)c(F)c1	ZINC000449396970	421007006	/nfs/dbraw/zinc/00/70/06/421007006.db2.gz	NWIQMKKMOFQUFB-CYBMUJFWSA-N	1	1	311.357	1.670	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN[C@@H]2CCC[N@H+](CCCO)C2)c(F)c1	ZINC000449396970	421007009	/nfs/dbraw/zinc/00/70/09/421007009.db2.gz	NWIQMKKMOFQUFB-CYBMUJFWSA-N	1	1	311.357	1.670	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)Nc2ccncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000487190415	421009214	/nfs/dbraw/zinc/00/92/14/421009214.db2.gz	DBMAVNRFPOBVFS-ZDUSSCGKSA-N	1	1	307.354	1.216	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456026298	421090705	/nfs/dbraw/zinc/09/07/05/421090705.db2.gz	WZIYGHJULSACPS-ZJUUUORDSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000456026298	421090708	/nfs/dbraw/zinc/09/07/08/421090708.db2.gz	WZIYGHJULSACPS-ZJUUUORDSA-N	1	1	307.354	1.196	20	5		DDBDMO
CCCC[N@@H+](C)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(NC)n1	ZINC000456052321	421093424	/nfs/dbraw/zinc/09/34/24/421093424.db2.gz	PQLIQUMKUCDTIF-NSHDSACASA-N	1	1	323.397	1.882	20	5		DDBDMO
CC(C)[C@H]1CN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000489348695	421148867	/nfs/dbraw/zinc/14/88/67/421148867.db2.gz	NBESLTTUICQNNZ-OAHLLOKOSA-N	1	1	305.378	1.936	20	5		DDBDMO
Nc1c(F)c(NC[C@H]2CCC[N@H+]2CCCO)ccc1[N+](=O)[O-]	ZINC000450590408	421212961	/nfs/dbraw/zinc/21/29/61/421212961.db2.gz	DREQMIUMMJHKAI-SNVBAGLBSA-N	1	1	312.345	1.575	20	5		DDBDMO
Cc1nc(N2CC[N@H+]([C@@H]3C[C@@H]3C)C[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000450539288	421207779	/nfs/dbraw/zinc/20/77/79/421207779.db2.gz	JMAMGXCROZNZDX-NTZNESFSSA-N	1	1	305.382	1.860	20	5		DDBDMO
C[C@]1(CO)CCC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000545397465	421257803	/nfs/dbraw/zinc/25/78/03/421257803.db2.gz	MQHVCEFARJKFOX-OAHLLOKOSA-N	1	1	318.333	1.992	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)C(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000548059346	421394543	/nfs/dbraw/zinc/39/45/43/421394543.db2.gz	NKGFUDNIVDVTIE-UHFFFAOYSA-N	1	1	318.337	1.239	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1ccnc(N)c1[N+](=O)[O-])C1CCCC1	ZINC000548413567	421435273	/nfs/dbraw/zinc/43/52/73/421435273.db2.gz	BDIYGZZDNFYFMS-UHFFFAOYSA-N	1	1	307.354	1.176	20	5		DDBDMO
C[N@H+]1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000549845648	421510449	/nfs/dbraw/zinc/51/04/49/421510449.db2.gz	YYCSOENCOPPYEQ-UHFFFAOYSA-N	1	1	307.350	1.526	20	5		DDBDMO
O=C1C[C@]2(CC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)CN1	ZINC000581585768	422004535	/nfs/dbraw/zinc/00/45/35/422004535.db2.gz	QAJVBMHMHZODCY-OAHLLOKOSA-N	1	1	315.333	1.183	20	5		DDBDMO
O=C1C[C@]2(CC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)CN1	ZINC000581585768	422004540	/nfs/dbraw/zinc/00/45/40/422004540.db2.gz	QAJVBMHMHZODCY-OAHLLOKOSA-N	1	1	315.333	1.183	20	5		DDBDMO
C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](CO)O1	ZINC000190148202	263444511	/nfs/dbraw/zinc/44/45/11/263444511.db2.gz	XCYWJIKYBZVUOK-NWDGAFQWSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](CO)O1	ZINC000190148202	263444513	/nfs/dbraw/zinc/44/45/13/263444513.db2.gz	XCYWJIKYBZVUOK-NWDGAFQWSA-N	1	1	323.349	1.005	20	5		DDBDMO
NC(=O)c1cccc(NC[C@H]2CCCn3cc[nH+]c32)c1[N+](=O)[O-]	ZINC000342778462	271515593	/nfs/dbraw/zinc/51/55/93/271515593.db2.gz	IUEMOYDNJROCII-SNVBAGLBSA-N	1	1	315.333	1.880	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000344242528	271979199	/nfs/dbraw/zinc/97/91/99/271979199.db2.gz	OCTCKNVGZITEIC-SNVBAGLBSA-N	1	1	307.325	1.948	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(N2CCC[N@H+]([C@H](C)CO)CC2)n1	ZINC000345044330	272162384	/nfs/dbraw/zinc/16/23/84/272162384.db2.gz	OIGMNGLTSBWUDT-CYBMUJFWSA-N	1	1	308.382	1.500	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@H+](CCO)[C@@H](C)C2)c1	ZINC000302464333	274095710	/nfs/dbraw/zinc/09/57/10/274095710.db2.gz	VAVFUVXHVRMNHZ-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(F)c([N+](=O)[O-])c(N2CC[N@@H+](CCO)[C@@H](C)C2)c1	ZINC000302464333	274095713	/nfs/dbraw/zinc/09/57/13/274095713.db2.gz	VAVFUVXHVRMNHZ-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1N1CCC[N@H+](CCO)CC1	ZINC000129808133	275033568	/nfs/dbraw/zinc/03/35/68/275033568.db2.gz	CODUXKRUDRXHIU-UHFFFAOYSA-N	1	1	300.746	1.148	20	5		DDBDMO
CNc1c(C(=O)N(C)C[C@@H]2CCC[N@H+]2C)cccc1[N+](=O)[O-]	ZINC000317213092	277301390	/nfs/dbraw/zinc/30/13/90/277301390.db2.gz	AXIQEYMEIDAKBQ-NSHDSACASA-N	1	1	306.366	1.803	20	5		DDBDMO
Cc1n[nH]c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269110144	280187929	/nfs/dbraw/zinc/18/79/29/280187929.db2.gz	IESJCWOIFWESRD-WDEREUQCSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]3C[N@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269110144	280187931	/nfs/dbraw/zinc/18/79/31/280187931.db2.gz	IESJCWOIFWESRD-WDEREUQCSA-N	1	1	307.354	1.183	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1[N+](=O)[O-]	ZINC000269110144	280187935	/nfs/dbraw/zinc/18/79/35/280187935.db2.gz	IESJCWOIFWESRD-WDEREUQCSA-N	1	1	307.354	1.183	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1cccc([N+](=O)[O-])c1)[C@H]1CCSC1	ZINC000122739857	281160625	/nfs/dbraw/zinc/16/06/25/281160625.db2.gz	IYBYMRQMYUVXHS-ZDUSSCGKSA-N	1	1	309.391	1.648	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1	ZINC000354018279	298340854	/nfs/dbraw/zinc/34/08/54/298340854.db2.gz	FGBPOYVYQXYVGG-UHFFFAOYSA-N	1	1	309.322	1.063	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F	ZINC000362762441	300133933	/nfs/dbraw/zinc/13/39/33/300133933.db2.gz	JARWMHHVLVEUCH-SECBINFHSA-N	1	1	313.304	1.626	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124897	300215541	/nfs/dbraw/zinc/21/55/41/300215541.db2.gz	DHMOEQNNMWIJQT-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000363124897	300215544	/nfs/dbraw/zinc/21/55/44/300215544.db2.gz	DHMOEQNNMWIJQT-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@@H]1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000363124897	300215547	/nfs/dbraw/zinc/21/55/47/300215547.db2.gz	DHMOEQNNMWIJQT-BMFZPTHFSA-N	1	1	317.389	1.775	20	5		DDBDMO
C[C@H]1CN(c2cccc(C(N)=O)c2[N+](=O)[O-])CC[N@H+](C2CC2)C1	ZINC000450547691	300298522	/nfs/dbraw/zinc/29/85/22/300298522.db2.gz	OPGRZYWRURVHQF-LLVKDONJSA-N	1	1	318.377	1.614	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000363904170	300323748	/nfs/dbraw/zinc/32/37/48/300323748.db2.gz	LBUQBWLFSCICAU-GXFFZTMASA-N	1	1	319.365	1.128	20	5		DDBDMO
O=C1O[C@H](C[N@@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)CC12CC2	ZINC000369007172	301118160	/nfs/dbraw/zinc/11/81/60/301118160.db2.gz	GRHCOKNDLRSWQB-YPMHNXCESA-N	1	1	320.349	1.524	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@H]2CC[N@H+]3CCC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000369143536	301136768	/nfs/dbraw/zinc/13/67/68/301136768.db2.gz	KWOZVDDEPSBEQC-VHSXEESVSA-N	1	1	307.354	1.237	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469401	301345661	/nfs/dbraw/zinc/34/56/61/301345661.db2.gz	CUEOTLHVBXFTEC-FAAHXZRKSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000370469401	301345664	/nfs/dbraw/zinc/34/56/64/301345664.db2.gz	CUEOTLHVBXFTEC-FAAHXZRKSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000370469401	301345666	/nfs/dbraw/zinc/34/56/66/301345666.db2.gz	CUEOTLHVBXFTEC-FAAHXZRKSA-N	1	1	303.362	1.431	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])c1	ZINC000377331888	302170817	/nfs/dbraw/zinc/17/08/17/302170817.db2.gz	UTULODKKEFECGV-SECBINFHSA-N	1	1	317.305	1.469	20	5		DDBDMO
COC(=O)c1cnc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])c1	ZINC000377331888	302170820	/nfs/dbraw/zinc/17/08/20/302170820.db2.gz	UTULODKKEFECGV-SECBINFHSA-N	1	1	317.305	1.469	20	5		DDBDMO
C[NH+](C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@H]1CC1[N+](=O)[O-]	ZINC000377688095	302212454	/nfs/dbraw/zinc/21/24/54/302212454.db2.gz	IHMBXLLDENHMKW-YJNKXOJESA-N	1	1	303.362	1.386	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@H+]2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1	ZINC000377767458	302229335	/nfs/dbraw/zinc/22/93/35/302229335.db2.gz	MWILFINXCYXDFK-ZIAGYGMSSA-N	1	1	306.366	1.825	20	5		DDBDMO
Cn1cc[nH+]c1[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc32)C1	ZINC000378270553	302306351	/nfs/dbraw/zinc/30/63/51/302306351.db2.gz	SCLIXEJKNKOHKL-VIFPVBQESA-N	1	1	314.305	1.858	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)[C@H](CO)C1	ZINC000362080614	307013172	/nfs/dbraw/zinc/01/31/72/307013172.db2.gz	YGRBIKKXWWFXOJ-STQMWFEESA-N	1	1	321.377	1.792	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000372658335	307172744	/nfs/dbraw/zinc/17/27/44/307172744.db2.gz	YAFABQJYWLYJIZ-KKUMJFAQSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000372658335	307172745	/nfs/dbraw/zinc/17/27/45/307172745.db2.gz	YAFABQJYWLYJIZ-KKUMJFAQSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)[C@H]1CC1[N+](=O)[O-]	ZINC000372658335	307172746	/nfs/dbraw/zinc/17/27/46/307172746.db2.gz	YAFABQJYWLYJIZ-KKUMJFAQSA-N	1	1	303.362	1.432	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C	ZINC000376486047	307245750	/nfs/dbraw/zinc/24/57/50/307245750.db2.gz	QEEWVORJPJLVTI-FUNVUKJBSA-N	1	1	318.377	1.995	20	5		DDBDMO
Cc1nn(C)c(N2CC[N@H+](C3CCC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000582940395	337219943	/nfs/dbraw/zinc/21/99/43/337219943.db2.gz	XYNFRDJSZJPTMR-LLVKDONJSA-N	1	1	307.398	1.947	20	5		DDBDMO
Cc1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1C	ZINC000452046072	533875792	/nfs/dbraw/zinc/87/57/92/533875792.db2.gz	UZMSCMYTDBPDOW-INIZCTEOSA-N	1	1	318.377	1.901	20	5		DDBDMO
C[C@H]1COCC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000331926355	534022696	/nfs/dbraw/zinc/02/26/96/534022696.db2.gz	CUZOQUDSTBRKHI-OCCSQVGLSA-N	1	1	310.350	1.303	20	5		DDBDMO
C[C@@H]([N@@H+](C)C[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)O	ZINC000451357593	534284966	/nfs/dbraw/zinc/28/49/66/534284966.db2.gz	DPHARPFYCGAPOD-DGCLKSJQSA-N	1	1	312.366	1.426	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000459584239	528035371	/nfs/dbraw/zinc/03/53/71/528035371.db2.gz	HTFPUYMIQXEJIJ-UHFFFAOYSA-N	1	1	308.338	1.038	20	5		DDBDMO
C[C@@H](CNc1ccc([N+](=O)[O-])cc1-c1nn[nH]n1)[N@@H+](C)C1CC1	ZINC000736025458	598522762	/nfs/dbraw/zinc/52/27/62/598522762.db2.gz	GXOQJEUSYRABMZ-VIFPVBQESA-N	1	1	317.353	1.670	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000797731692	700021908	/nfs/dbraw/zinc/02/19/08/700021908.db2.gz	CPUIWWJQQQSAFE-LBPRGKRZSA-N	1	1	307.350	1.445	20	5		DDBDMO
Cc1cc(OCC(=O)N2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000797731692	700021910	/nfs/dbraw/zinc/02/19/10/700021910.db2.gz	CPUIWWJQQQSAFE-LBPRGKRZSA-N	1	1	307.350	1.445	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000068240347	696369504	/nfs/dbraw/zinc/36/95/04/696369504.db2.gz	KVAJPOYCOJHFHX-UHFFFAOYSA-N	1	1	322.321	1.671	20	5		DDBDMO
COCC(=O)N1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000980576782	696804390	/nfs/dbraw/zinc/80/43/90/696804390.db2.gz	DLXZETUMMCQPRL-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
COCC(=O)N1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000980576782	696804392	/nfs/dbraw/zinc/80/43/92/696804392.db2.gz	DLXZETUMMCQPRL-UHFFFAOYSA-N	1	1	307.350	1.276	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000151275448	696882753	/nfs/dbraw/zinc/88/27/53/696882753.db2.gz	FIWIVKNPXQQTGJ-CQSZACIVSA-N	1	1	306.366	1.589	20	5		DDBDMO
Cc1cc(C[N@H+](C)C2CCN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])CC2)on1	ZINC000985430606	697509995	/nfs/dbraw/zinc/50/99/95/697509995.db2.gz	GEHNQODABDWPSI-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1cc(C[N@@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)on1	ZINC000985430606	697509996	/nfs/dbraw/zinc/50/99/96/697509996.db2.gz	GEHNQODABDWPSI-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
Cc1cc(C[N@H+](C)C2CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])CC2)on1	ZINC000985430606	697509998	/nfs/dbraw/zinc/50/99/98/697509998.db2.gz	GEHNQODABDWPSI-ZIAGYGMSSA-N	1	1	322.365	1.071	20	5		DDBDMO
C[C@H]1COCCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000772819345	697681480	/nfs/dbraw/zinc/68/14/80/697681480.db2.gz	AUOGYKOXRBFAIE-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
C[C@H]1COCCC[N@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000772819345	697681484	/nfs/dbraw/zinc/68/14/84/697681484.db2.gz	AUOGYKOXRBFAIE-LBPRGKRZSA-N	1	1	317.349	1.922	20	5		DDBDMO
Cc1nn(C[N@H+](C)C[C@H]2CCCO2)c2ncc([N+](=O)[O-])cc12	ZINC000749954353	700194303	/nfs/dbraw/zinc/19/43/03/700194303.db2.gz	KIVLYRNQEFPWLJ-GFCCVEGCSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@@H+](C)C[C@H]2CCCO2)c2ncc([N+](=O)[O-])cc12	ZINC000749954353	700194306	/nfs/dbraw/zinc/19/43/06/700194306.db2.gz	KIVLYRNQEFPWLJ-GFCCVEGCSA-N	1	1	305.338	1.716	20	5		DDBDMO
CN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000776581637	698121172	/nfs/dbraw/zinc/12/11/72/698121172.db2.gz	FQAHGJLKHUBMJI-JKSUJKDBSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C2CC2)C1	ZINC000776581637	698121175	/nfs/dbraw/zinc/12/11/75/698121175.db2.gz	FQAHGJLKHUBMJI-JKSUJKDBSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C2CC2)C1	ZINC000776581637	698121177	/nfs/dbraw/zinc/12/11/77/698121177.db2.gz	FQAHGJLKHUBMJI-JKSUJKDBSA-N	1	1	305.378	1.797	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000781961838	698666252	/nfs/dbraw/zinc/66/62/52/698666252.db2.gz	JQDUYENKQWAOEK-GJZGRUSLSA-N	1	1	310.350	1.366	20	5		DDBDMO
CCCc1[nH]nc(C(=O)OCCn2cc[nH+]c2C)c1[N+](=O)[O-]	ZINC000796262025	699922330	/nfs/dbraw/zinc/92/23/30/699922330.db2.gz	VQBLEALLMNITMW-UHFFFAOYSA-N	1	1	307.310	1.632	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2CCOC[C@H]2CCO)cc1	ZINC000767586135	701118390	/nfs/dbraw/zinc/11/83/90/701118390.db2.gz	FTPMPKFIQZOZHN-CQSZACIVSA-N	1	1	310.350	1.447	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCOC[C@H]2CCO)cc1	ZINC000767586135	701118392	/nfs/dbraw/zinc/11/83/92/701118392.db2.gz	FTPMPKFIQZOZHN-CQSZACIVSA-N	1	1	310.350	1.447	20	5		DDBDMO
CN(C)c1cc[nH+]c(NCCOc2ccc([N+](=O)[O-])cc2)n1	ZINC000770464254	701279135	/nfs/dbraw/zinc/27/91/35/701279135.db2.gz	MOCFNTDWEOJPNK-UHFFFAOYSA-N	1	1	303.322	1.942	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840458603	702116972	/nfs/dbraw/zinc/11/69/72/702116972.db2.gz	CVGROMQSKOONJR-ZGKBOVNRSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1	ZINC000840458603	702116978	/nfs/dbraw/zinc/11/69/78/702116978.db2.gz	CVGROMQSKOONJR-ZGKBOVNRSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1	ZINC000840458603	702116984	/nfs/dbraw/zinc/11/69/84/702116984.db2.gz	CVGROMQSKOONJR-ZGKBOVNRSA-N	1	1	303.362	1.431	20	5		DDBDMO
CC[N@@H+](C[C@@H](C)OC)Cn1nc(C)c2cc([N+](=O)[O-])cnc21	ZINC000812301456	702143644	/nfs/dbraw/zinc/14/36/44/702143644.db2.gz	HPPGDNCYVGZVJG-SNVBAGLBSA-N	1	1	307.354	1.962	20	5		DDBDMO
Cc1cc(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)ccc1[N+](=O)[O-]	ZINC000812341056	702164107	/nfs/dbraw/zinc/16/41/07/702164107.db2.gz	FGPNUMORGSCIRZ-KGLIPLIRSA-N	1	1	303.362	1.927	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)Cc3cccc(F)c3[N+](=O)[O-])[C@@H]2C1	ZINC000868519333	702174153	/nfs/dbraw/zinc/17/41/53/702174153.db2.gz	AOSYIMLSSGVSQW-WCQYABFASA-N	1	1	307.325	1.439	20	5		DDBDMO
CNC(=O)NC[C@H]1CCCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000879333679	706653127	/nfs/dbraw/zinc/65/31/27/706653127.db2.gz	CMRHQRZYCXRUOO-OAHLLOKOSA-N	1	1	320.393	1.921	20	5		DDBDMO
Cc1ccc2c(c1)[C@@H]1C[N@@H+](C)CC[C@H]1N2C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000841024396	702314430	/nfs/dbraw/zinc/31/44/30/702314430.db2.gz	SNAQHXUZKQFKST-OCVGTWLNSA-N	1	1	315.373	1.795	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000817679669	702449157	/nfs/dbraw/zinc/44/91/57/702449157.db2.gz	VGRZZAXPJSTLFH-VIFPVBQESA-N	1	1	310.329	1.482	20	5		DDBDMO
CC(C)(C)[N@H+]1CC[C@@H]1COC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000845736055	703195021	/nfs/dbraw/zinc/19/50/21/703195021.db2.gz	RHGDHDLHLZRSJK-LLVKDONJSA-N	1	1	324.381	1.942	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)CN2CCN(c3[nH]cc[nH+]3)CC2)c1	ZINC000846876605	703345344	/nfs/dbraw/zinc/34/53/44/703345344.db2.gz	BMWJJSXEDPAJLB-AWEZNQCLSA-N	1	1	317.349	1.174	20	5		DDBDMO
CNc1nccc(C(=O)NCC[N@H+]2CCC[C@H]2C)c1[N+](=O)[O-]	ZINC000848373717	703544681	/nfs/dbraw/zinc/54/46/81/703544681.db2.gz	JJYRKYYHQIJQRT-SNVBAGLBSA-N	1	1	307.354	1.246	20	5		DDBDMO
C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCC2	ZINC000818971351	704038767	/nfs/dbraw/zinc/03/87/67/704038767.db2.gz	UPIJTTCFYZHHNQ-MFKMUULPSA-N	1	1	317.349	1.517	20	5		DDBDMO
CN(C)c1nc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cs1	ZINC000819128925	704073480	/nfs/dbraw/zinc/07/34/80/704073480.db2.gz	URFCXWXCMZKCPQ-CYBMUJFWSA-N	1	1	322.390	1.941	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N1CC[NH+](C[C@H](C)O)CC1	ZINC000822132982	704882571	/nfs/dbraw/zinc/88/25/71/704882571.db2.gz	PCGZAOIIEFMTQZ-LBPRGKRZSA-N	1	1	321.377	1.350	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)cc1[N+](=O)[O-]	ZINC000874848710	705202723	/nfs/dbraw/zinc/20/27/23/705202723.db2.gz	GMDIGNFSLFCPRD-OLZOCXBDSA-N	1	1	319.361	1.912	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000861343131	705435222	/nfs/dbraw/zinc/43/52/22/705435222.db2.gz	YYEATNIWWZEMQO-NHYWBVRUSA-N	1	1	323.349	1.443	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+](C2CC2)C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825379938	705658732	/nfs/dbraw/zinc/65/87/32/705658732.db2.gz	UECFAZGVPIEYPG-ABAIWWIYSA-N	1	1	319.361	1.229	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000825776605	705729664	/nfs/dbraw/zinc/72/96/64/705729664.db2.gz	JUIRMXGUFHTWHE-UKRRQHHQSA-N	1	1	319.361	1.229	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)C(C)(C)n3cc([N+](=O)[O-])cn3)CC[C@@H]21	ZINC000827328221	705976238	/nfs/dbraw/zinc/97/62/38/705976238.db2.gz	DFQWIIHZFAYDNH-YPMHNXCESA-N	1	1	321.381	1.079	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)ccc3[N+](=O)[O-])CC[C@H]21	ZINC000827331140	705977612	/nfs/dbraw/zinc/97/76/12/705977612.db2.gz	WSHUUTLNZSDACW-ZWNOBZJWSA-N	1	1	307.325	1.900	20	5		DDBDMO
O=C(NCC[N@@H+]1CC[C@H](O)C1)c1cccc([N+](=O)[O-])c1Cl	ZINC000863833918	706025022	/nfs/dbraw/zinc/02/50/22/706025022.db2.gz	XZCIVSFPVUVRSX-VIFPVBQESA-N	1	1	313.741	1.045	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000864610878	706212029	/nfs/dbraw/zinc/21/20/29/706212029.db2.gz	VBAGLXZVUVCWOE-GFCCVEGCSA-N	1	1	309.341	1.877	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CC2(C1)C[NH+](Cc1ccccc1)C2	ZINC000865999437	706589699	/nfs/dbraw/zinc/58/96/99/706589699.db2.gz	AAKYTTJYZVRSRK-UHFFFAOYSA-N	1	1	313.361	1.651	20	5		DDBDMO
C[C@H]([NH2+]C[C@@H](O)c1ccnn1C)c1c(F)cccc1[N+](=O)[O-]	ZINC000927127091	712945118	/nfs/dbraw/zinc/94/51/18/712945118.db2.gz	QWQSNJOQHJYYDB-TVQRCGJNSA-N	1	1	308.313	1.852	20	5		DDBDMO
O=[N+]([O-])c1c(F)nccc1N1CC[C@@H](C[NH+]2CCOCC2)C1	ZINC000882021658	707469616	/nfs/dbraw/zinc/46/96/16/707469616.db2.gz	FKIJGZALXFFXHH-NSHDSACASA-N	1	1	310.329	1.287	20	5		DDBDMO
C[N@H+]1CCC[C@@H]2[C@@H]1CCN2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000872779129	707596872	/nfs/dbraw/zinc/59/68/72/707596872.db2.gz	MYCHKUCDGUVBFQ-UONOGXRCSA-N	1	1	304.350	1.367	20	5		DDBDMO
C[N@@H+](CCCCNC(=O)c1cc([N+](=O)[O-])ccc1N)C1CC1	ZINC000837225990	707601341	/nfs/dbraw/zinc/60/13/41/707601341.db2.gz	XLVWQUWNNOQCGQ-UHFFFAOYSA-N	1	1	306.366	1.781	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000882489179	707660805	/nfs/dbraw/zinc/66/08/05/707660805.db2.gz	NRYBVLLZPIOUPU-ZDUSSCGKSA-N	1	1	316.361	1.829	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000882490315	707661323	/nfs/dbraw/zinc/66/13/23/707661323.db2.gz	MQSYWVSMDNSSRF-LLVKDONJSA-N	1	1	314.345	1.967	20	5		DDBDMO
CC[N@H+]1CC[C@@H]1CNC(=O)NCc1ccc(C)c([N+](=O)[O-])c1	ZINC000883757262	708059819	/nfs/dbraw/zinc/05/98/19/708059819.db2.gz	HTHZVSQQRSSMER-CYBMUJFWSA-N	1	1	306.366	1.797	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000886591278	708784332	/nfs/dbraw/zinc/78/43/32/708784332.db2.gz	QCBPNDGFODZLEX-GFCCVEGCSA-N	1	1	308.382	1.736	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])n1C	ZINC000886591278	708784335	/nfs/dbraw/zinc/78/43/35/708784335.db2.gz	QCBPNDGFODZLEX-GFCCVEGCSA-N	1	1	308.382	1.736	20	5		DDBDMO
CC(C)C[C@H]1C[N@H+](C)CCN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000886596182	708787643	/nfs/dbraw/zinc/78/76/43/708787643.db2.gz	YLRWCHBVDUKHKX-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
CC(C)C[C@H]1C[N@@H+](C)CCN1C(=O)c1c([N+](=O)[O-])cnn1C	ZINC000886596182	708787646	/nfs/dbraw/zinc/78/76/46/708787646.db2.gz	YLRWCHBVDUKHKX-NSHDSACASA-N	1	1	309.370	1.131	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CC[C@](CO)(C(F)(F)F)C2)n1	ZINC000886799700	708847336	/nfs/dbraw/zinc/84/73/36/708847336.db2.gz	VLBOFNFCCZMHFT-JTQLQIEISA-N	1	1	308.260	1.038	20	5		DDBDMO
O=C(NCc1ccc(Nc2cc[nH+]cc2)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000899024487	708956280	/nfs/dbraw/zinc/95/62/80/708956280.db2.gz	OLUTWQDPXDFCPT-HUUCEWRRSA-N	1	1	312.329	1.529	20	5		DDBDMO
C[N@H+](CCCF)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000887137352	708969745	/nfs/dbraw/zinc/96/97/45/708969745.db2.gz	FGLVGGMGISFKRJ-UHFFFAOYSA-N	1	1	313.285	1.553	20	5		DDBDMO
C[N@@H+](CCCF)CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000887137352	708969749	/nfs/dbraw/zinc/96/97/49/708969749.db2.gz	FGLVGGMGISFKRJ-UHFFFAOYSA-N	1	1	313.285	1.553	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@]2(C)C1	ZINC000887939163	709173322	/nfs/dbraw/zinc/17/33/22/709173322.db2.gz	RPWNJMMSWFEQGO-CJNGLKHVSA-N	1	1	303.362	1.547	20	5		DDBDMO
CCC[C@@H]1CN(c2c([N+](=O)[O-])cnn2C)CC[N@H+]1CCOC	ZINC000893055777	710547856	/nfs/dbraw/zinc/54/78/56/710547856.db2.gz	HNANMVQRSRYYMZ-GFCCVEGCSA-N	1	1	311.386	1.265	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)[C@@H]2C1	ZINC000893939074	710893394	/nfs/dbraw/zinc/89/33/94/710893394.db2.gz	HFDVBUMDOKJOLS-IAQYHMDHSA-N	1	1	316.361	1.620	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@@H]1CC[N@@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318421	711095733	/nfs/dbraw/zinc/09/57/33/711095733.db2.gz	PMQIJENKOFUFDS-LSDHHAIUSA-N	1	1	315.377	1.711	20	5		DDBDMO
Cn1ccnc1[C@H](NC[C@@H]1CC[N@H+]1C)c1cccc([N+](=O)[O-])c1	ZINC000903318421	711095737	/nfs/dbraw/zinc/09/57/37/711095737.db2.gz	PMQIJENKOFUFDS-LSDHHAIUSA-N	1	1	315.377	1.711	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2c1ncnc2sc([N+](=O)[O-])cc21	ZINC000894879972	711306213	/nfs/dbraw/zinc/30/62/13/711306213.db2.gz	ZQGOFKSKXHMEDM-DTORHVGOSA-N	1	1	305.363	1.882	20	5		DDBDMO
C[C@H](Nc1c(Cl)cncc1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCN1C	ZINC000895248267	711465307	/nfs/dbraw/zinc/46/53/07/711465307.db2.gz	ZPOXDGLMTYDWIL-CABZTGNLSA-N	1	1	313.789	1.111	20	5		DDBDMO
COc1c(O)ccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000895444173	711514004	/nfs/dbraw/zinc/51/40/04/711514004.db2.gz	RFGFWHZJYRQKMC-RYUDHWBXSA-N	1	1	308.334	1.777	20	5		DDBDMO
CN1CC[C@H]1CNc1nc(NC[C@@H]2CC[N@H+]2C)ccc1[N+](=O)[O-]	ZINC000895770306	711601589	/nfs/dbraw/zinc/60/15/89/711601589.db2.gz	LUBOMHMXXRLYHB-RYUDHWBXSA-N	1	1	320.397	1.222	20	5		DDBDMO
CSCc1nnc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)[nH]1	ZINC000895813185	711614130	/nfs/dbraw/zinc/61/41/30/711614130.db2.gz	GGCUMNRTCMICGY-UHFFFAOYSA-N	1	1	307.379	1.908	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1C1CCOCC1	ZINC000896523831	711738103	/nfs/dbraw/zinc/73/81/03/711738103.db2.gz	QYPQENCWBGYVEF-CYBMUJFWSA-N	1	1	323.397	1.785	20	5		DDBDMO
COc1cc(CN2CC[C@@H](CC[NH3+])C2)c([N+](=O)[O-])cc1OC	ZINC000904406423	711853630	/nfs/dbraw/zinc/85/36/30/711853630.db2.gz	SRZZLCMKEVIXHI-LLVKDONJSA-N	1	1	309.366	1.783	20	5		DDBDMO
C[N@H+]1CC[C@H]1CNC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000913931064	713321422	/nfs/dbraw/zinc/32/14/22/713321422.db2.gz	QGRFUOVZSOMDMA-ZDUSSCGKSA-N	1	1	307.354	1.010	20	5		DDBDMO
C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1	ZINC000908350611	712749308	/nfs/dbraw/zinc/74/93/08/712749308.db2.gz	ZUTSADOXPZLUGX-UFBFGSQYSA-N	1	1	324.768	1.607	20	5		DDBDMO
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(C[NH+]2CCCC2)C1=O	ZINC000915790432	713431461	/nfs/dbraw/zinc/43/14/61/713431461.db2.gz	XCIQXLWTAXVTCZ-OAHLLOKOSA-N	1	1	318.333	1.415	20	5		DDBDMO
C[C@H]([NH2+]CC[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1	ZINC000930214227	713778923	/nfs/dbraw/zinc/77/89/23/713778923.db2.gz	LXTUHVDGJMENEC-NSHDSACASA-N	1	1	311.357	1.714	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000931397838	714083912	/nfs/dbraw/zinc/08/39/12/714083912.db2.gz	ZYGOCKJBPOIMFQ-OKILXGFUSA-N	1	1	319.361	1.740	20	5		DDBDMO
COc1ccc(CN2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)cc1[N+](=O)[O-]	ZINC000933743532	714660991	/nfs/dbraw/zinc/66/09/91/714660991.db2.gz	GFGRSBJJUMKPPB-XJKSGUPXSA-N	1	1	305.378	1.987	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117634	714746000	/nfs/dbraw/zinc/74/60/00/714746000.db2.gz	HROOBCPPKROSOL-HUUCEWRRSA-N	1	1	319.361	1.593	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000934117634	714746002	/nfs/dbraw/zinc/74/60/02/714746002.db2.gz	HROOBCPPKROSOL-HUUCEWRRSA-N	1	1	319.361	1.593	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCCC[C@H]([C@H]3CCOC3)C2)n1	ZINC000934838776	714914287	/nfs/dbraw/zinc/91/42/87/714914287.db2.gz	OZFOKYWGXRIRGD-KBPBESRZSA-N	1	1	308.382	1.930	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H]3[C@H]2CC[N@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928552	721854121	/nfs/dbraw/zinc/85/41/21/721854121.db2.gz	OFDFHGNKIGDNSP-ZIAGYGMSSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cc1ccnc(N2CC[C@@H]3[C@H]2CC[N@@H+]3CCN(C)C)c1[N+](=O)[O-]	ZINC001164928552	721854123	/nfs/dbraw/zinc/85/41/23/721854123.db2.gz	OFDFHGNKIGDNSP-ZIAGYGMSSA-N	1	1	319.409	1.513	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1C[C@]23C[N@@H+](C)C[C@@]2(C1)CCCC3	ZINC001120900037	782221014	/nfs/dbraw/zinc/22/10/14/782221014.db2.gz	MDTOYKXLXMPVAP-GASCZTMLSA-N	1	1	305.382	1.641	20	5		DDBDMO
CC(C)[N@@H+](C)CC(=O)N(C)CCN(C)c1ncccc1[N+](=O)[O-]	ZINC001105415354	741196948	/nfs/dbraw/zinc/19/69/48/741196948.db2.gz	PYNCXHNZOVPHDQ-UHFFFAOYSA-N	1	1	323.397	1.225	20	5		DDBDMO
O=C(NCC[NH2+]C/C=C/c1ccc(Cl)cc1)[C@@H]1CC1[N+](=O)[O-]	ZINC001126936863	742853794	/nfs/dbraw/zinc/85/37/94/742853794.db2.gz	VFPSMGCVZWVGCT-GEYXIOIISA-N	1	1	323.780	1.724	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@@H]3C[N@H+](C)CC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC001186895577	744462254	/nfs/dbraw/zinc/46/22/54/744462254.db2.gz	IBULHIBSTHVVAW-PWSUYJOCSA-N	1	1	320.349	1.164	20	5		DDBDMO
C[C@@H](O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC001192490995	745795467	/nfs/dbraw/zinc/79/54/67/745795467.db2.gz	XTNDZGZBUZBVPO-MNOVXSKESA-N	1	1	318.333	1.848	20	5		DDBDMO
Cc1ncc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC001196907727	747005148	/nfs/dbraw/zinc/00/51/48/747005148.db2.gz	NBUJEVPDRIVBAJ-OAHLLOKOSA-N	1	1	302.334	1.691	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@@H+]2C[C@H](CCO)[C@H](CO)C2)c(Cl)c1	ZINC001198752039	747598667	/nfs/dbraw/zinc/59/86/67/747598667.db2.gz	HZEKDJBMNMFTRD-JQWIXIFHSA-N	1	1	314.769	1.671	20	5		DDBDMO
O=C(N[C@H]1CC[C@H]([NH2+]Cc2ccns2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001034644741	750627085	/nfs/dbraw/zinc/62/70/85/750627085.db2.gz	LMJRYXPSPAJODG-FPQZTECRSA-N	1	1	324.406	1.325	20	5		DDBDMO
CC(=O)NCc1ccc(C[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1	ZINC001034804814	750902522	/nfs/dbraw/zinc/90/25/22/750902522.db2.gz	MIMSOJHCBGLBQG-UHFFFAOYSA-N	1	1	317.349	1.254	20	5		DDBDMO
CCOC(=O)C1=C(O)CC[N@H+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169029690	762186800	/nfs/dbraw/zinc/18/68/00/762186800.db2.gz	VFSCUCSJTKGPJQ-RWMBFGLXSA-N	1	1	312.366	1.276	20	5		DDBDMO
COc1ccnc(O[C@@H]2CC[N@H+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)C2)c1	ZINC001169053569	762208263	/nfs/dbraw/zinc/20/82/63/762208263.db2.gz	ITPPFICTYNWZHF-GZBFAFLISA-N	1	1	321.377	1.989	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+]2CC[C@H](Oc3ncc(F)cn3)C2)C1	ZINC001169054390	762210305	/nfs/dbraw/zinc/21/03/05/762210305.db2.gz	LTEJMGNVMCYJCB-RTXFEEFZSA-N	1	1	310.329	1.514	20	5		DDBDMO
Cc1ncc(C[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)s1	ZINC001086363398	761492633	/nfs/dbraw/zinc/49/26/33/761492633.db2.gz	RNUWYYRISSVKLE-FPQZTECRSA-N	1	1	324.406	1.101	20	5		DDBDMO
O=C(N[C@H]1CC[C@H](C[NH2+]CC2CCC2)CC1)[C@@H]1CC1[N+](=O)[O-]	ZINC001050325720	763467580	/nfs/dbraw/zinc/46/75/80/763467580.db2.gz	LKQIVEVMZKRIRK-KBUPBQIOSA-N	1	1	309.410	1.716	20	5		DDBDMO
CCNC(=O)C[N@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170329587	766254791	/nfs/dbraw/zinc/25/47/91/766254791.db2.gz	RWODCHDXYWDLON-NSHDSACASA-N	1	1	309.366	1.602	20	5		DDBDMO
CCNC(=O)C[N@@H+](C)[C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-]	ZINC001170329587	766254797	/nfs/dbraw/zinc/25/47/97/766254797.db2.gz	RWODCHDXYWDLON-NSHDSACASA-N	1	1	309.366	1.602	20	5		DDBDMO
CC[NH+](CC)CC(=O)NCCNCc1csc([N+](=O)[O-])c1	ZINC001135508533	771541999	/nfs/dbraw/zinc/54/19/99/771541999.db2.gz	PUIVMHXTEUUQJH-UHFFFAOYSA-N	1	1	314.411	1.204	20	5		DDBDMO
Cc1c[nH+]cn1CC(=O)NCCNc1cccc(F)c1[N+](=O)[O-]	ZINC001094008637	775325533	/nfs/dbraw/zinc/32/55/33/775325533.db2.gz	RYHUTGSVVHVBSX-UHFFFAOYSA-N	1	1	321.312	1.467	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCOC[C@@H](O)C1)CC2	ZINC001172903901	776917088	/nfs/dbraw/zinc/91/70/88/776917088.db2.gz	JKBXUHKTIIBVFR-HOCLYGCPSA-N	1	1	306.362	1.535	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CCN1CCOCC1	ZINC001173228944	777062251	/nfs/dbraw/zinc/06/22/51/777062251.db2.gz	OEXVEUBSWGYNDO-CQSZACIVSA-N	1	1	307.394	1.790	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001173235891	777063980	/nfs/dbraw/zinc/06/39/80/777063980.db2.gz	CBLYZLMFSAWQKM-OCCSQVGLSA-N	1	1	320.393	1.919	20	5		DDBDMO
Cc1nc(C[NH2+]CCCCCCNC(=O)[C@@H]2CC2[N+](=O)[O-])co1	ZINC001178463761	779060998	/nfs/dbraw/zinc/06/09/98/779060998.db2.gz	LCGBGJYKWHMWNW-ZIAGYGMSSA-N	1	1	324.381	1.414	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(NCCn2ccnn2)ncc1[N+](=O)[O-]	ZINC001154623346	861292553	/nfs/dbraw/zinc/29/25/53/861292553.db2.gz	ZZDHPJDOHNJTIU-ZZXKWVIFSA-N	1	1	303.326	1.226	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC001326838085	861646128	/nfs/dbraw/zinc/64/61/28/861646128.db2.gz	AFNXLKZGSVWKEA-RWMBFGLXSA-N	1	1	308.382	1.630	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1	ZINC001326838085	861646134	/nfs/dbraw/zinc/64/61/34/861646134.db2.gz	AFNXLKZGSVWKEA-RWMBFGLXSA-N	1	1	308.382	1.630	20	5		DDBDMO
CS(=O)(=O)C1CC([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000715252871	846425878	/nfs/dbraw/zinc/42/58/78/846425878.db2.gz	YBWUSNLNMPUSBR-UHFFFAOYSA-N	1	1	318.782	1.913	20	5		DDBDMO
CN1CCO[C@@H](CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)C1	ZINC001155197297	861827714	/nfs/dbraw/zinc/82/77/14/861827714.db2.gz	KXWXFYTVLUKVRD-IHVVCDCBSA-N	1	1	321.381	1.265	20	5		DDBDMO
Cc1cccc(C[N@H+](C)CCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC001327213618	861969530	/nfs/dbraw/zinc/96/95/30/861969530.db2.gz	VGJSXUBUAGZGDA-HZPDHXFCSA-N	1	1	319.405	1.941	20	5		DDBDMO
Cc1cccc(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001327213618	861969542	/nfs/dbraw/zinc/96/95/42/861969542.db2.gz	VGJSXUBUAGZGDA-HZPDHXFCSA-N	1	1	319.405	1.941	20	5		DDBDMO
Cc1cccc(C[N@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001327213618	861969550	/nfs/dbraw/zinc/96/95/50/861969550.db2.gz	VGJSXUBUAGZGDA-HZPDHXFCSA-N	1	1	319.405	1.941	20	5		DDBDMO
C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)C1	ZINC001150030316	862035993	/nfs/dbraw/zinc/03/59/93/862035993.db2.gz	LHNSTEVKAGJJNX-CMPLNLGQSA-N	1	1	320.349	1.252	20	5		DDBDMO
O=C(Cc1cnc[nH]1)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC001155977798	862607072	/nfs/dbraw/zinc/60/70/72/862607072.db2.gz	IGHHQGPKAXSATP-UHFFFAOYSA-N	1	1	300.278	1.053	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(C[NH+](C)C)on1	ZINC001124075765	859563724	/nfs/dbraw/zinc/56/37/24/859563724.db2.gz	PGPKEBRHUOIDTQ-UHFFFAOYSA-N	1	1	321.289	1.872	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@](C)(CO)C2)c1	ZINC001328606029	863103625	/nfs/dbraw/zinc/10/36/25/863103625.db2.gz	XYAGOVGKEVHDTN-INIZCTEOSA-N	1	1	322.361	1.976	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@](C)(CO)C2)c1	ZINC001328606029	863103631	/nfs/dbraw/zinc/10/36/31/863103631.db2.gz	XYAGOVGKEVHDTN-INIZCTEOSA-N	1	1	322.361	1.976	20	5		DDBDMO
COC(=O)c1cnc(N2C[C@H]3CCC[N@@H+](C)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC001157266085	863695696	/nfs/dbraw/zinc/69/56/96/863695696.db2.gz	NQEOHOJJWFQXQE-ZWNOBZJWSA-N	1	1	320.349	1.307	20	5		DDBDMO
CCOc1nc(N2C[C@H]3[C@H](C2)CCC[N@H+]3C)ccc1[N+](=O)[O-]	ZINC001157271745	863701269	/nfs/dbraw/zinc/70/12/69/863701269.db2.gz	JEPFBZOOKHSRLO-AAEUAGOBSA-N	1	1	306.366	1.919	20	5		DDBDMO
CC(C)[N@@H+](C)CCNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1	ZINC001329991742	864000575	/nfs/dbraw/zinc/00/05/75/864000575.db2.gz	QRCZPGIHCHMFRV-UHFFFAOYSA-N	1	1	306.366	1.960	20	5		DDBDMO
CN1C[C@H](CNc2cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn2)CC1=O	ZINC001157909928	864251950	/nfs/dbraw/zinc/25/19/50/864251950.db2.gz	TWVWKLLCJUFLFO-ZWNMCFTASA-N	1	1	319.365	1.412	20	5		DDBDMO
CC(=O)O[C@@H]1C[C@@H]2C[C@H](Oc3cccnc3[N+](=O)[O-])C[C@H]1[N@H+]2C	ZINC001225629915	881945221	/nfs/dbraw/zinc/94/52/21/881945221.db2.gz	SUPDTKQTLZJECC-CIQGVGRVSA-N	1	1	321.333	1.535	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CC[N@H+]1C[C@H]3CC[C@@H](C1)O3)C2	ZINC001323458459	866623741	/nfs/dbraw/zinc/62/37/41/866623741.db2.gz	VYKXCHZWQLSQFR-IYBDPMFKSA-N	1	1	303.362	1.774	20	5		DDBDMO
O=[N+]([O-])c1ccc2c(c1)CN(CC[N@@H+]1C[C@H]3CC[C@@H](C1)O3)C2	ZINC001323458459	866623747	/nfs/dbraw/zinc/62/37/47/866623747.db2.gz	VYKXCHZWQLSQFR-IYBDPMFKSA-N	1	1	303.362	1.774	20	5		DDBDMO
C[NH+](C)/C=C/c1cc(N[C@H]2CNC(=O)C2(C)C)ncc1[N+](=O)[O-]	ZINC001163010976	867993889	/nfs/dbraw/zinc/99/38/89/867993889.db2.gz	HQVWYABLCDMOJQ-FYJFLYSWSA-N	1	1	319.365	1.459	20	5		DDBDMO
COc1cc(C)nc(N2CCC(F)(F)[C@@H]([NH3+])C2)c1[N+](=O)[O-]	ZINC001164319511	869123456	/nfs/dbraw/zinc/12/34/56/869123456.db2.gz	IMWNLTJWIYYZRQ-VIFPVBQESA-N	1	1	302.281	1.480	20	5		DDBDMO
COC(=O)c1cc(OC)c(O[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC001226430082	882426850	/nfs/dbraw/zinc/42/68/50/882426850.db2.gz	CERRPCORPJLBDP-SNVBAGLBSA-N	1	1	324.333	1.863	20	5		DDBDMO
C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C[C@]12CCC[C@H]1OCC2	ZINC001308169411	871478183	/nfs/dbraw/zinc/47/81/83/871478183.db2.gz	XTZMDJUWXCUSHN-GDBMZVCRSA-N	1	1	321.377	1.648	20	5		DDBDMO
CC(C)Cn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](C)C(C)(C)C1	ZINC001347610105	874209673	/nfs/dbraw/zinc/20/96/73/874209673.db2.gz	BPOLUPLRXZOPJA-GFCCVEGCSA-N	1	1	324.429	1.802	20	5		DDBDMO
O=[N+]([O-])CC[NH2+]C[C@](O)(c1ccc(Cl)cc1)C(F)(F)F	ZINC001356585808	879113775	/nfs/dbraw/zinc/11/37/75/879113775.db2.gz	WALIVZXAQOIBNB-JTQLQIEISA-N	1	1	312.675	1.956	20	5		DDBDMO
O=[N+]([O-])CCNC1CC[NH+](CCOc2ccc(F)cc2)CC1	ZINC001356610551	879129478	/nfs/dbraw/zinc/12/94/78/879129478.db2.gz	SFJMYNPKXFHHJN-UHFFFAOYSA-N	1	1	311.357	1.535	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2nnc(C[N+](=O)[O-])n2CC(C)C)C[C@H]1C	ZINC001358057078	880309648	/nfs/dbraw/zinc/30/96/48/880309648.db2.gz	HAQALPNFXSKUHY-OLZOCXBDSA-N	1	1	324.429	1.630	20	5		DDBDMO
CC(C)OCC(=O)NCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1	ZINC001235109764	888415159	/nfs/dbraw/zinc/41/51/59/888415159.db2.gz	OGPFECWTENAHSC-UHFFFAOYSA-N	1	1	323.393	1.958	20	5		DDBDMO
[NH3+][C@H](Cc1c[nH]cn1)c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247100865	893105743	/nfs/dbraw/zinc/10/57/43/893105743.db2.gz	NGDMRLXIIGTPMZ-MRVPVSSYSA-N	1	1	319.256	1.145	20	5		DDBDMO
CSCC[C@@H]([NH3+])c1nc(-c2ncc(F)cc2[N+](=O)[O-])no1	ZINC001247634040	893270295	/nfs/dbraw/zinc/27/02/95/893270295.db2.gz	HRHSELWMJASMKX-SSDOTTSWSA-N	1	1	313.314	1.932	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CCOC[C@H](O)C3)CC2)cc1	ZINC001254473573	896456156	/nfs/dbraw/zinc/45/61/56/896456156.db2.gz	GAKAXENKYYNZGN-MRXNPFEDSA-N	1	1	321.377	1.257	20	5		DDBDMO
O=C1NCC[C@]12CCC[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254598326	896525437	/nfs/dbraw/zinc/52/54/37/896525437.db2.gz	WHRJMOOUTXTYJI-RDJZCZTQSA-N	1	1	315.373	1.664	20	5		DDBDMO
C[N@@H+]([C@@H]1Cc2ccc([N+](=O)[O-])cc2C1)C1CCS(=O)(=O)CC1	ZINC001254605070	896528854	/nfs/dbraw/zinc/52/88/54/896528854.db2.gz	ZWYGSDCWJWULIC-OAHLLOKOSA-N	1	1	324.402	1.571	20	5		DDBDMO
Cc1c(C(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)cccc1[N+](=O)[O-]	ZINC001263980532	900854052	/nfs/dbraw/zinc/85/40/52/900854052.db2.gz	YCHIWWFHESJOCV-FPMFFAJLSA-N	1	1	303.362	1.973	20	5		DDBDMO
Cc1cc(NC(=O)[C@H]2C[N@@H+]3CCN2C[C@@H]3C)cc([N+](=O)[O-])c1	ZINC001264010944	900871466	/nfs/dbraw/zinc/87/14/66/900871466.db2.gz	QHRXEGHCDZKFKE-SMDDNHRTSA-N	1	1	304.350	1.230	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)n1	ZINC000248676001	282099015	/nfs/dbraw/zinc/09/90/15/282099015.db2.gz	TWCQAYSQYPHLMQ-QWRGUYRKSA-N	1	1	309.370	1.366	20	5		DDBDMO
C[C@H]1CCC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000305452876	231008206	/nfs/dbraw/zinc/00/82/06/231008206.db2.gz	RZSRBBZBFMRICC-SWLSCSKDSA-N	1	1	321.377	1.650	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)[C@@H]1CO	ZINC000305452876	231008208	/nfs/dbraw/zinc/00/82/08/231008208.db2.gz	RZSRBBZBFMRICC-SWLSCSKDSA-N	1	1	321.377	1.650	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)n1	ZINC000451345393	231072703	/nfs/dbraw/zinc/07/27/03/231072703.db2.gz	QROGHMBOQHWSSC-MGPQQGTHSA-N	1	1	308.382	1.807	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCCSCC2)c1	ZINC000089984440	185274383	/nfs/dbraw/zinc/27/43/83/185274383.db2.gz	CELYYVHIBGTSQA-ZDUSSCGKSA-N	1	1	312.391	1.773	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000272834716	210233677	/nfs/dbraw/zinc/23/36/77/210233677.db2.gz	FTQBASZHJLIMSP-NSHDSACASA-N	1	1	323.349	1.510	20	5		DDBDMO
COC(=O)[C@@H](C)C[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)C1CC1	ZINC000090525102	185300165	/nfs/dbraw/zinc/30/01/65/185300165.db2.gz	PQIDZLJHTAFJDT-NSHDSACASA-N	1	1	323.349	1.030	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNc1nc(C)cc(C(=O)OC)c1[N+](=O)[O-]	ZINC000286746685	219142421	/nfs/dbraw/zinc/14/24/21/219142421.db2.gz	FKHDCRIYPOHZAQ-NSHDSACASA-N	1	1	322.365	1.981	20	5		DDBDMO
C[C@H]1C[C@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C	ZINC000330897377	232145314	/nfs/dbraw/zinc/14/53/14/232145314.db2.gz	HLLLYKIXJRLJSP-NWDGAFQWSA-N	1	1	307.350	1.573	20	5		DDBDMO
CNC(=O)OC[C@H]1CCCC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000286951623	219241969	/nfs/dbraw/zinc/24/19/69/219241969.db2.gz	MRQHCLLDCDXYES-LLVKDONJSA-N	1	1	311.342	1.002	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CCC[N@@H+](C)C1	ZINC000617352617	363067236	/nfs/dbraw/zinc/06/72/36/363067236.db2.gz	DPBMKORTCROPSF-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(N)=O)CC1	ZINC000021847102	352175044	/nfs/dbraw/zinc/17/50/44/352175044.db2.gz	HVYOXLOCOZGBIB-JTQLQIEISA-N	1	1	320.349	1.119	20	5		DDBDMO
C[NH+]1CCN(CCCCNC(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000041362543	352304750	/nfs/dbraw/zinc/30/47/50/352304750.db2.gz	IEERQKXKVQKNBH-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
COCC[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000052940483	352633235	/nfs/dbraw/zinc/63/32/35/352633235.db2.gz	FETMIQLXWABHQU-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
COCC[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CC1	ZINC000052940483	352633238	/nfs/dbraw/zinc/63/32/38/352633238.db2.gz	FETMIQLXWABHQU-UHFFFAOYSA-N	1	1	319.361	1.595	20	5		DDBDMO
Cc1ccccc1C[NH+]1CCC(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC000053968489	352674372	/nfs/dbraw/zinc/67/43/72/352674372.db2.gz	ABDUDTMYONNUPN-HZPDHXFCSA-N	1	1	317.389	1.741	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000173181315	198193121	/nfs/dbraw/zinc/19/31/21/198193121.db2.gz	JCAYCOCRPXDHAY-ZDUSSCGKSA-N	1	1	303.362	1.738	20	5		DDBDMO
CCCNC(=O)C[NH+]1CCC(Nc2ccncc2[N+](=O)[O-])CC1	ZINC000066808716	353017686	/nfs/dbraw/zinc/01/76/86/353017686.db2.gz	AHCHJSBQSSMIKW-UHFFFAOYSA-N	1	1	321.381	1.392	20	5		DDBDMO
CN(C)c1[nH+]cc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1C	ZINC000074276822	353304078	/nfs/dbraw/zinc/30/40/78/353304078.db2.gz	HUTNWEFEEOGDPH-UHFFFAOYSA-N	1	1	320.309	1.915	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC[C@@H](c3ccccc3)C2)c1	ZINC000075675350	353375450	/nfs/dbraw/zinc/37/54/50/353375450.db2.gz	LCKZXHWNLNPITC-ZBFHGGJFSA-N	1	1	316.361	1.642	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@@H](C[NH+](CC)CC)C2)c1[N+](=O)[O-]	ZINC000174759723	198380543	/nfs/dbraw/zinc/38/05/43/198380543.db2.gz	SBWHBDBACCGKJH-NSHDSACASA-N	1	1	323.397	1.684	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000077555748	353475693	/nfs/dbraw/zinc/47/56/93/353475693.db2.gz	MPUMEBHXDNTISZ-ZDUSSCGKSA-N	1	1	321.377	1.964	20	5		DDBDMO
C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C1	ZINC000089930602	353783531	/nfs/dbraw/zinc/78/35/31/353783531.db2.gz	XHYRNOWWRRLCJY-ZYHUDNBSSA-N	1	1	307.350	1.287	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000091513456	353828923	/nfs/dbraw/zinc/82/89/23/353828923.db2.gz	IWQSRKSNJMYTIE-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@H+]1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000091513456	353828926	/nfs/dbraw/zinc/82/89/26/353828926.db2.gz	IWQSRKSNJMYTIE-ZDUSSCGKSA-N	1	1	305.378	1.674	20	5		DDBDMO
Cc1sc(C(=O)N[C@H](C)[C@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833495	354222676	/nfs/dbraw/zinc/22/26/76/354222676.db2.gz	WIAREDSNPPBDEK-LDYMZIIASA-N	1	1	313.379	1.414	20	5		DDBDMO
Cc1sc(C(=O)N[C@H](C)[C@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000156833495	354222680	/nfs/dbraw/zinc/22/26/80/354222680.db2.gz	WIAREDSNPPBDEK-LDYMZIIASA-N	1	1	313.379	1.414	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157630749	354226262	/nfs/dbraw/zinc/22/62/62/354226262.db2.gz	HFBKPJABSVGMIS-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
COc1ccc(C(=O)N[C@@H](C)[C@@H]2C[N@@H+](C)CCO2)cc1[N+](=O)[O-]	ZINC000157630749	354226266	/nfs/dbraw/zinc/22/62/66/354226266.db2.gz	HFBKPJABSVGMIS-HZMBPMFUSA-N	1	1	323.349	1.052	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc([N+](=O)[O-])c2cnccc12	ZINC000320457843	354527125	/nfs/dbraw/zinc/52/71/25/354527125.db2.gz	OTZUZJYNXFUXPE-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1	ZINC000320457843	354527130	/nfs/dbraw/zinc/52/71/30/354527130.db2.gz	OTZUZJYNXFUXPE-LBPRGKRZSA-N	1	1	315.377	1.801	20	5		DDBDMO
CC(C)[C@H]1CN(c2cc(N)c([N+](=O)[O-])c(CO)c2)CC[N@H+]1C	ZINC000588032357	354896663	/nfs/dbraw/zinc/89/66/63/354896663.db2.gz	WVWFPCXPAMNXHB-CQSZACIVSA-N	1	1	308.382	1.446	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588863025	354944405	/nfs/dbraw/zinc/94/44/05/354944405.db2.gz	NYGMJSNDNLUBLN-ZIAGYGMSSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C[C@@H]2CCC[C@H]2O)c1	ZINC000589501231	354997225	/nfs/dbraw/zinc/99/72/25/354997225.db2.gz	GMMBCECPNNLSRF-SWLSCSKDSA-N	1	1	322.361	1.974	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)COc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590044136	355042599	/nfs/dbraw/zinc/04/25/99/355042599.db2.gz	HGHYQLITGDWLKP-WCQYABFASA-N	1	1	305.334	1.136	20	5		DDBDMO
CC[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H]1CCOC1	ZINC000589737651	355017760	/nfs/dbraw/zinc/01/77/60/355017760.db2.gz	BQTYIEIQGBTGKX-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
CC[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)[C@H]1CCOC1	ZINC000589737651	355017763	/nfs/dbraw/zinc/01/77/63/355017763.db2.gz	BQTYIEIQGBTGKX-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
CCOc1cc(C[N@@H+](C[C@@H](C)O)[C@@H](C)CO)ccc1[N+](=O)[O-]	ZINC000276972768	213210993	/nfs/dbraw/zinc/21/09/93/213210993.db2.gz	XFELUBQVIIKZMC-NWDGAFQWSA-N	1	1	312.366	1.557	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(C(=O)CCOc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000590446885	355099510	/nfs/dbraw/zinc/09/95/10/355099510.db2.gz	WVSFCDSZUZUFFU-GXTWGEPZSA-N	1	1	319.361	1.526	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@H+](C)CCO1	ZINC000591510743	355322881	/nfs/dbraw/zinc/32/28/81/355322881.db2.gz	GADNKSURVSCSTA-WFASDCNBSA-N	1	1	321.377	1.661	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N[C@@H](C)[C@@H]1C[N@@H+](C)CCO1	ZINC000591510743	355322884	/nfs/dbraw/zinc/32/28/84/355322884.db2.gz	GADNKSURVSCSTA-WFASDCNBSA-N	1	1	321.377	1.661	20	5		DDBDMO
CC[C@H]1CN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC[C@H]1[NH3+]	ZINC000592330547	355560393	/nfs/dbraw/zinc/56/03/93/355560393.db2.gz	BZQYOKKRKFFVJL-JOYOIKCWSA-N	1	1	317.349	1.671	20	5		DDBDMO
C[C@H]1CC2(C[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1)CCOCC2	ZINC000592182738	355527885	/nfs/dbraw/zinc/52/78/85/355527885.db2.gz	QZAUSFSTTUEVCZ-GXTWGEPZSA-N	1	1	324.381	1.043	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@@H](C)[N@@H+](C)C[C@H]2C)c1	ZINC000593018894	355771456	/nfs/dbraw/zinc/77/14/56/355771456.db2.gz	BRLLJQBFZKGJGX-VXGBXAGGSA-N	1	1	321.377	1.906	20	5		DDBDMO
CN(C(=O)Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1	ZINC000593056960	355782678	/nfs/dbraw/zinc/78/26/78/355782678.db2.gz	BYHRPGHXFXGLCU-AWEZNQCLSA-N	1	1	321.352	1.972	20	5		DDBDMO
O=[N+]([O-])c1ccccc1/C=C\CN1CC([N@H+]2CC[C@@H](O)C2)C1	ZINC000593679840	355964975	/nfs/dbraw/zinc/96/49/75/355964975.db2.gz	MWJKRRGYKLRDAX-UYWPIULCSA-N	1	1	303.362	1.359	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(=O)NCC(F)F	ZINC000595054371	356377589	/nfs/dbraw/zinc/37/75/89/356377589.db2.gz	MGRYNMQBXDSHEG-QMMMGPOBSA-N	1	1	317.292	1.635	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595877532	356688315	/nfs/dbraw/zinc/68/83/15/356688315.db2.gz	UYMUJAUPTGUPTE-BLLLJJGKSA-N	1	1	321.377	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](C)[C@@](C)(CO)C1	ZINC000595877532	356688316	/nfs/dbraw/zinc/68/83/16/356688316.db2.gz	UYMUJAUPTGUPTE-BLLLJJGKSA-N	1	1	321.377	1.792	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)[C@@H]1C	ZINC000347202613	283207093	/nfs/dbraw/zinc/20/70/93/283207093.db2.gz	KTMUWLZPDKJMIW-PWSUYJOCSA-N	1	1	308.334	1.987	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H](C3CC[NH2+]CC3)C2)c1[N+](=O)[O-]	ZINC000595935840	356711768	/nfs/dbraw/zinc/71/17/68/356711768.db2.gz	WBIMUMFRVSLZOU-LBPRGKRZSA-N	1	1	321.381	1.478	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1N1CCC([N@H+]2CCCOCC2)CC1	ZINC000596269396	356838984	/nfs/dbraw/zinc/83/89/84/356838984.db2.gz	SSNQBQNWZDMISK-UHFFFAOYSA-N	1	1	309.370	1.019	20	5		DDBDMO
CCC[N@H+]1CC[C@H](NC(=O)CNc2ccccc2[N+](=O)[O-])C1	ZINC000598341580	357544499	/nfs/dbraw/zinc/54/44/99/357544499.db2.gz	CVABFNGSDJPNQT-LBPRGKRZSA-N	1	1	306.366	1.607	20	5		DDBDMO
C[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1CO	ZINC000598652066	357671841	/nfs/dbraw/zinc/67/18/41/357671841.db2.gz	WTISVTANRRKVJE-STQMWFEESA-N	1	1	321.377	1.874	20	5		DDBDMO
O=[N+]([O-])c1c2ccncc2ccc1N1CC[NH+](CCO)CC1	ZINC000599016217	357794409	/nfs/dbraw/zinc/79/44/09/357794409.db2.gz	NNIRYLFNORXWMO-UHFFFAOYSA-N	1	1	302.334	1.257	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1ccc2cnccc2c1[N+](=O)[O-]	ZINC000599042202	357800674	/nfs/dbraw/zinc/80/06/74/357800674.db2.gz	FNRXPZJTTQZTDX-ZDUSSCGKSA-N	1	1	315.377	1.801	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CCC([NH+]3CCOCC3)CC2)c(F)c1	ZINC000599104786	357816987	/nfs/dbraw/zinc/81/69/87/357816987.db2.gz	NWCQXMXJDHCIMX-UHFFFAOYSA-N	1	1	310.329	1.430	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCCC(F)(F)CC2)c1	ZINC000599552235	357971221	/nfs/dbraw/zinc/97/12/21/357971221.db2.gz	YRRQYGYJTZSDGV-LLVKDONJSA-N	1	1	304.297	1.273	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1(C(N)=O)CCCC1	ZINC000180700075	199199083	/nfs/dbraw/zinc/19/90/83/199199083.db2.gz	GEMOSGFIZZIGHO-CYBMUJFWSA-N	1	1	307.350	1.358	20	5		DDBDMO
C[C@@H]1CN(CCNc2cc[nH+]c3ccc([N+](=O)[O-])cc23)CCO1	ZINC000601111856	358406128	/nfs/dbraw/zinc/40/61/28/358406128.db2.gz	YLYYQZROCSJDQZ-GFCCVEGCSA-N	1	1	316.361	1.698	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(NC[C@@]3(O)CCSC3)c2c1	ZINC000601123823	358411268	/nfs/dbraw/zinc/41/12/68/358411268.db2.gz	LCAFPCPFLSAVFA-AWEZNQCLSA-N	1	1	305.359	1.845	20	5		DDBDMO
O=C1CC[C@@H]2CN(c3cc[nH+]c4ccc([N+](=O)[O-])cc43)CCN12	ZINC000601136730	358417031	/nfs/dbraw/zinc/41/70/31/358417031.db2.gz	WNCDJDQERPKUDS-GFCCVEGCSA-N	1	1	312.329	1.954	20	5		DDBDMO
Cc1nc(N[C@@H]2CCCC[C@H]2[NH+]2CCOCC2)ncc1[N+](=O)[O-]	ZINC000565579965	304077217	/nfs/dbraw/zinc/07/72/17/304077217.db2.gz	OXGREKMDVBFPGM-CHWSQXEVSA-N	1	1	321.381	1.749	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@]2(O)CC[N@@H+](Cc3ccccc3)C2)c1	ZINC000601959803	358753715	/nfs/dbraw/zinc/75/37/15/358753715.db2.gz	SHEDPSGHNMJXLX-OAHLLOKOSA-N	1	1	302.334	1.428	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNCc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000602546373	359038555	/nfs/dbraw/zinc/03/85/55/359038555.db2.gz	QZWBHDOAZRWIMO-LBPRGKRZSA-N	1	1	319.365	1.071	20	5		DDBDMO
CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602777232	359183233	/nfs/dbraw/zinc/18/32/33/359183233.db2.gz	CIZGGEMMSJMEAD-KGLIPLIRSA-N	1	1	307.398	1.658	20	5		DDBDMO
CCN1CC[C@H]2CC[C@@H](C1)[N@@H+]2CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602777232	359183237	/nfs/dbraw/zinc/18/32/37/359183237.db2.gz	CIZGGEMMSJMEAD-KGLIPLIRSA-N	1	1	307.398	1.658	20	5		DDBDMO
CCN1CC[C@H]2CC[C@@H](C1)[N@H+]2CCn1c(C)ncc1[N+](=O)[O-]	ZINC000602777232	359183242	/nfs/dbraw/zinc/18/32/42/359183242.db2.gz	CIZGGEMMSJMEAD-KGLIPLIRSA-N	1	1	307.398	1.658	20	5		DDBDMO
Cn1cc(C[N@@H+]2CCC[C@@H](N3CCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000602707132	359137228	/nfs/dbraw/zinc/13/72/28/359137228.db2.gz	CPDGQFNVZLCKQI-CQSZACIVSA-N	1	1	323.397	1.015	20	5		DDBDMO
Cn1cc(C[N@H+]2CCC[C@@H](N3CCOCC3)CC2)c([N+](=O)[O-])n1	ZINC000602707132	359137233	/nfs/dbraw/zinc/13/72/33/359137233.db2.gz	CPDGQFNVZLCKQI-CQSZACIVSA-N	1	1	323.397	1.015	20	5		DDBDMO
Cn1cc(CN2CCC[C@H]([C@@H]3C[C@H]([NH3+])CCO3)C2)c([N+](=O)[O-])n1	ZINC000603431403	359636658	/nfs/dbraw/zinc/63/66/58/359636658.db2.gz	WTRWYUQXPPVKMW-YUTCNCBUSA-N	1	1	323.397	1.047	20	5		DDBDMO
CNC(=O)[C@]1(C)CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000281062394	216053584	/nfs/dbraw/zinc/05/35/84/216053584.db2.gz	KDJQBMTXJZSTDR-OAHLLOKOSA-N	1	1	307.350	1.432	20	5		DDBDMO
C[N@H+]1CCCN(CCCNC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000609619849	360335995	/nfs/dbraw/zinc/33/59/95/360335995.db2.gz	MOZDGTWNYXXADL-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CN1CCC[N@H+](CCCNC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000609619849	360335999	/nfs/dbraw/zinc/33/59/99/360335999.db2.gz	MOZDGTWNYXXADL-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CN1CCC[N@@H+](CCCNC(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000609619849	360336003	/nfs/dbraw/zinc/33/60/03/360336003.db2.gz	MOZDGTWNYXXADL-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)c1[N+](=O)[O-]	ZINC000609479007	360311695	/nfs/dbraw/zinc/31/16/95/360311695.db2.gz	HJXOLPJPVPIJDT-SNVBAGLBSA-N	1	1	307.354	1.094	20	5		DDBDMO
CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000610244742	360396702	/nfs/dbraw/zinc/39/67/02/360396702.db2.gz	NBXOUQUBMOAVHP-GFCCVEGCSA-N	1	1	308.382	1.880	20	5		DDBDMO
CN(C(=O)C[N@H+](C)CCn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000610447569	360438378	/nfs/dbraw/zinc/43/83/78/360438378.db2.gz	CIBYWKQCMDTQJP-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)CCn1cc([N+](=O)[O-])cn1)C1CCCCC1	ZINC000610447569	360438382	/nfs/dbraw/zinc/43/83/82/360438382.db2.gz	CIBYWKQCMDTQJP-UHFFFAOYSA-N	1	1	323.397	1.514	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC[C@H]2c2cccc(F)c2)c1	ZINC000610504986	360455662	/nfs/dbraw/zinc/45/56/62/360455662.db2.gz	PSJITOCUXNSNOU-CABCVRRESA-N	1	1	320.324	1.738	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]2c2cccc(F)c2)c1	ZINC000610504986	360455668	/nfs/dbraw/zinc/45/56/68/360455668.db2.gz	PSJITOCUXNSNOU-CABCVRRESA-N	1	1	320.324	1.738	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C[C@@H]1C	ZINC000611088055	360618518	/nfs/dbraw/zinc/61/85/18/360618518.db2.gz	AQCFRFFLOIEQKD-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)C[C@@H]1C	ZINC000611088055	360618521	/nfs/dbraw/zinc/61/85/21/360618521.db2.gz	AQCFRFFLOIEQKD-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@H+]1CCN(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C[C@@H]1C	ZINC000611091739	360620154	/nfs/dbraw/zinc/62/01/54/360620154.db2.gz	FMXSVGPNSDCTHW-ZDUSSCGKSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[N@@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1CCCO1	ZINC000611253853	360681476	/nfs/dbraw/zinc/68/14/76/360681476.db2.gz	XNSYMTMFXAMKRQ-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
C[N@H+](Cc1cc2c(cc1[N+](=O)[O-])OCCO2)C[C@@H]1CCCO1	ZINC000611253853	360681479	/nfs/dbraw/zinc/68/14/79/360681479.db2.gz	XNSYMTMFXAMKRQ-LBPRGKRZSA-N	1	1	308.334	1.977	20	5		DDBDMO
COc1ccc(C[N@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cn1	ZINC000611209195	360660271	/nfs/dbraw/zinc/66/02/71/360660271.db2.gz	DIUAJUZZEVHTJT-UHFFFAOYSA-N	1	1	318.333	1.292	20	5		DDBDMO
COc1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cn1	ZINC000611209195	360660272	/nfs/dbraw/zinc/66/02/72/360660272.db2.gz	DIUAJUZZEVHTJT-UHFFFAOYSA-N	1	1	318.333	1.292	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[NH+]([C@H]3CCOC3)CC2)c(F)c1	ZINC000611349074	360703340	/nfs/dbraw/zinc/70/33/40/360703340.db2.gz	VFWVWZNAQOYFHO-AWEZNQCLSA-N	1	1	309.341	1.640	20	5		DDBDMO
O=C(c1csc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1	ZINC000619574255	364067833	/nfs/dbraw/zinc/06/78/33/364067833.db2.gz	LKWHLJZCHSUKJP-WDEREUQCSA-N	1	1	313.354	1.915	20	5		DDBDMO
Cc1cc(C(=O)NC[C@@H]2C[N@H+]3CCN2CCC3)ccc1[N+](=O)[O-]	ZINC000619873376	364170631	/nfs/dbraw/zinc/17/06/31/364170631.db2.gz	HZTNLJFSUYBHKT-CQSZACIVSA-N	1	1	318.377	1.023	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2C)ccc1[N+](=O)[O-]	ZINC000271763062	209192453	/nfs/dbraw/zinc/19/24/53/209192453.db2.gz	PFPYHVIJNFOAMJ-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
CC(C)(C(=O)NCC(F)(F)C[NH3+])c1ccc([N+](=O)[O-])cc1	ZINC000275167361	212164787	/nfs/dbraw/zinc/16/47/87/212164787.db2.gz	RJRGYAQNHVYJNU-UHFFFAOYSA-N	1	1	301.293	1.583	20	5		DDBDMO
C[N@H+]1CC[C@H](CNC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1	ZINC000264668541	204067342	/nfs/dbraw/zinc/06/73/42/204067342.db2.gz	LDIQZHJEMARMMN-SNVBAGLBSA-N	1	1	311.313	1.181	20	5		DDBDMO
CN(CCC[NH+]1CCN(C)CC1)C(=O)c1ccccc1[N+](=O)[O-]	ZINC000264662897	204062929	/nfs/dbraw/zinc/06/29/29/204062929.db2.gz	WFDFOSDFABNHAM-UHFFFAOYSA-N	1	1	320.393	1.304	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@H]1CNc1ccc2cc([N+](=O)[O-])ccc2n1	ZINC000264731183	204111394	/nfs/dbraw/zinc/11/13/94/204111394.db2.gz	IYRXYMWVFITABX-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@H+](C)[C@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000264731183	204111404	/nfs/dbraw/zinc/11/14/04/204111404.db2.gz	IYRXYMWVFITABX-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN1CC[N@@H+](C)[C@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000264731183	204111409	/nfs/dbraw/zinc/11/14/09/204111409.db2.gz	IYRXYMWVFITABX-CQSZACIVSA-N	1	1	315.377	1.801	20	5		DDBDMO
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCC[N@H+]1C	ZINC000264956129	204300301	/nfs/dbraw/zinc/30/03/01/204300301.db2.gz	YSWSUELVBOJRJJ-LBPRGKRZSA-N	1	1	306.366	1.485	20	5		DDBDMO
Cc1cc(C(=O)NCc2c[nH+]c(N(C)C)n2C)cc([N+](=O)[O-])c1	ZINC000265093108	204390300	/nfs/dbraw/zinc/39/03/00/204390300.db2.gz	DFOCQMSASGOEOH-UHFFFAOYSA-N	1	1	317.349	1.633	20	5		DDBDMO
CC[N@@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@H](C)C1	ZINC000288333729	220090706	/nfs/dbraw/zinc/09/07/06/220090706.db2.gz	IMGRSZJNGZKJJN-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)[C@H](C)C1	ZINC000288333729	220090708	/nfs/dbraw/zinc/09/07/08/220090708.db2.gz	IMGRSZJNGZKJJN-SECBINFHSA-N	1	1	310.329	1.482	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[NH+]2CCSCC2)c1	ZINC000266167297	205153277	/nfs/dbraw/zinc/15/32/77/205153277.db2.gz	VGHXDLPAKPKPGF-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
C[N@@H+](C[C@H](O)CN1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000351543670	284369929	/nfs/dbraw/zinc/36/99/29/284369929.db2.gz	SVCSBLYRIFPCGE-INIZCTEOSA-N	1	1	305.378	1.408	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-]	ZINC000109621886	194277700	/nfs/dbraw/zinc/27/77/00/194277700.db2.gz	KGKLFZGOYFPNKQ-LLVKDONJSA-N	1	1	321.381	1.581	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)C1	ZINC000109849696	194293671	/nfs/dbraw/zinc/29/36/71/194293671.db2.gz	BGWMDYGRGUEWBB-NSHDSACASA-N	1	1	318.377	1.851	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](O)C[C@H]1C	ZINC000340907090	251269186	/nfs/dbraw/zinc/26/91/86/251269186.db2.gz	LEQGREUCZROMJL-YPMHNXCESA-N	1	1	307.350	1.687	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCSC1	ZINC000119892202	195057364	/nfs/dbraw/zinc/05/73/64/195057364.db2.gz	DFWLCNYVMOKLCN-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)[C@@H]1CCSC1	ZINC000119892202	195057366	/nfs/dbraw/zinc/05/73/66/195057366.db2.gz	DFWLCNYVMOKLCN-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
COc1c(C(=O)N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000331520065	533392226	/nfs/dbraw/zinc/39/22/26/533392226.db2.gz	NVPNIHAVQHHCIW-GWCFXTLKSA-N	1	1	319.361	1.816	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(CC[N@@H+](C)C3)C2)c1	ZINC000292053778	286381354	/nfs/dbraw/zinc/38/13/54/286381354.db2.gz	AEOWKPKPEGDIFX-MRXNPFEDSA-N	1	1	319.361	1.771	20	5		DDBDMO
Cc1cc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)c(N)c([N+](=O)[O-])c1	ZINC000066620646	407255270	/nfs/dbraw/zinc/25/52/70/407255270.db2.gz	YKNINSQZFUPKNX-LLVKDONJSA-N	1	1	318.377	1.700	20	5		DDBDMO
CNC(=O)[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000111263946	407404110	/nfs/dbraw/zinc/40/41/10/407404110.db2.gz	CDXXZQWHLZNYHW-LBPRGKRZSA-N	1	1	307.350	1.432	20	5		DDBDMO
CC[C@@H]1C[N@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000271005829	407462795	/nfs/dbraw/zinc/46/27/95/407462795.db2.gz	ZEZYSRVSKDWVEW-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)C[C@@H]1O	ZINC000271005829	407462800	/nfs/dbraw/zinc/46/28/00/407462800.db2.gz	ZEZYSRVSKDWVEW-ABAIWWIYSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC[N@H+](CCCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000266547358	407554702	/nfs/dbraw/zinc/55/47/02/407554702.db2.gz	JZJPXNZVYSGWIF-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
CC[N@@H+](CCCO)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000266547358	407554710	/nfs/dbraw/zinc/55/47/10/407554710.db2.gz	JZJPXNZVYSGWIF-UHFFFAOYSA-N	1	1	306.322	1.849	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[N@@H+](C[C@@H](C)O)[C@H](C)C2)c1	ZINC000266326253	407536208	/nfs/dbraw/zinc/53/62/08/407536208.db2.gz	GGUIRBWWCXXQEK-VXGBXAGGSA-N	1	1	309.366	1.495	20	5		DDBDMO
CN(C(=O)C[N@@H+](C)C[C@H]1CCOC1)c1ccc([N+](=O)[O-])cc1	ZINC000178780584	407599213	/nfs/dbraw/zinc/59/92/13/407599213.db2.gz	QDFURPBXJMESBZ-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)Cc1ccc([N+](=O)[O-])cc1F	ZINC000152615136	407661074	/nfs/dbraw/zinc/66/10/74/407661074.db2.gz	OLIPCNNFLYFPHV-LLVKDONJSA-N	1	1	309.341	1.687	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2CC[C@@H](CN3CCOCC3)C2)c1	ZINC000129180659	407595733	/nfs/dbraw/zinc/59/57/33/407595733.db2.gz	FDKQNZHKYSJMJK-HNNXBMFYSA-N	1	1	305.378	1.749	20	5		DDBDMO
O=[N+]([O-])c1cccc(CN2CC[C@@H](C[NH+]3CCOCC3)C2)c1	ZINC000129180659	407595736	/nfs/dbraw/zinc/59/57/36/407595736.db2.gz	FDKQNZHKYSJMJK-HNNXBMFYSA-N	1	1	305.378	1.749	20	5		DDBDMO
C[N@@H+](CCOc1cccc([N+](=O)[O-])c1)CCc1cnccn1	ZINC000271401428	407669890	/nfs/dbraw/zinc/66/98/90/407669890.db2.gz	XDOWOYRURJCESZ-UHFFFAOYSA-N	1	1	302.334	1.938	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000115436473	407681937	/nfs/dbraw/zinc/68/19/37/407681937.db2.gz	MPUZIVRAPKGMKM-ZDUSSCGKSA-N	1	1	321.377	1.774	20	5		DDBDMO
NC(=O)c1ccc(N2CCC[N@H+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000171831411	407778284	/nfs/dbraw/zinc/77/82/84/407778284.db2.gz	BJEZHKOAKRAZCD-UHFFFAOYSA-N	1	1	304.350	1.368	20	5		DDBDMO
C[C@H](C[NH+]1CCOCC1)C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000272164025	407801426	/nfs/dbraw/zinc/80/14/26/407801426.db2.gz	ZSCCFCXYDDADKB-CHWSQXEVSA-N	1	1	321.377	1.740	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@]3(CCOC3)C2)c1	ZINC000153605310	407860304	/nfs/dbraw/zinc/86/03/04/407860304.db2.gz	AWLGLJXJMURAHC-HOCLYGCPSA-N	1	1	322.361	1.447	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C[N@H+]1C1CC1	ZINC000133592642	407863624	/nfs/dbraw/zinc/86/36/24/407863624.db2.gz	BIXNSZRZIVMUNB-DTWKUNHWSA-N	1	1	306.322	1.050	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCSC1	ZINC000154036105	407959528	/nfs/dbraw/zinc/95/95/28/407959528.db2.gz	NRWLGPBNAVNRBQ-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCSC1	ZINC000154036105	407959531	/nfs/dbraw/zinc/95/95/31/407959531.db2.gz	NRWLGPBNAVNRBQ-CYBMUJFWSA-N	1	1	321.402	1.921	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000181185951	407960858	/nfs/dbraw/zinc/96/08/58/407960858.db2.gz	BESGJGFMPCGNPP-LBPRGKRZSA-N	1	1	320.393	1.885	20	5		DDBDMO
C[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1ccccc1	ZINC000245419091	407971495	/nfs/dbraw/zinc/97/14/95/407971495.db2.gz	GWEXASAPDQAIKV-UHOFOFEASA-N	1	1	316.361	1.845	20	5		DDBDMO
COc1ccc(C(=O)N2CC[C@H]3CC[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000272544360	407976039	/nfs/dbraw/zinc/97/60/39/407976039.db2.gz	CJDIWVPGXCXKDV-BXUZGUMPSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000268158906	407920635	/nfs/dbraw/zinc/92/06/35/407920635.db2.gz	HNJFNEJZLORCAO-PRHODGIISA-N	1	1	322.340	1.529	20	5		DDBDMO
CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H](O)C(F)(F)F	ZINC000189465456	408025531	/nfs/dbraw/zinc/02/55/31/408025531.db2.gz	ZQRISUIKUDBWHW-RYUDHWBXSA-N	1	1	322.283	1.873	20	5		DDBDMO
CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C[C@H](O)C(F)(F)F	ZINC000189465456	408025535	/nfs/dbraw/zinc/02/55/35/408025535.db2.gz	ZQRISUIKUDBWHW-RYUDHWBXSA-N	1	1	322.283	1.873	20	5		DDBDMO
COC(=O)c1ccc(C[N@@H+](C)CCn2cc([N+](=O)[O-])cn2)cc1	ZINC000174818203	407996194	/nfs/dbraw/zinc/99/61/94/407996194.db2.gz	OVWBOAJZXYWMRZ-UHFFFAOYSA-N	1	1	318.333	1.710	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@H]2CCCC[C@H]12	ZINC000182472380	408171748	/nfs/dbraw/zinc/17/17/48/408171748.db2.gz	AIGNUCMCBSSGLY-MHEUCROKSA-N	1	1	308.382	1.663	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc([O-])cc([N+](=O)[O-])c1	ZINC000269284685	408252923	/nfs/dbraw/zinc/25/29/23/408252923.db2.gz	MXPBYTSBNKWDRY-KGLIPLIRSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284685	408252928	/nfs/dbraw/zinc/25/29/28/408252928.db2.gz	MXPBYTSBNKWDRY-KGLIPLIRSA-N	1	1	305.334	1.657	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1cc(O)cc([N+](=O)[O-])c1	ZINC000269284685	408252932	/nfs/dbraw/zinc/25/29/32/408252932.db2.gz	MXPBYTSBNKWDRY-KGLIPLIRSA-N	1	1	305.334	1.657	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C	ZINC000121481530	408221207	/nfs/dbraw/zinc/22/12/07/408221207.db2.gz	RTIFJYHIIYZQET-UHFFFAOYSA-N	1	1	322.365	1.218	20	5		DDBDMO
CC[N@H+]1CC[C@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2N)[C@@H](C)C1	ZINC000246479670	408267135	/nfs/dbraw/zinc/26/71/35/408267135.db2.gz	PJIQFBCQLYHMJI-AAEUAGOBSA-N	1	1	320.393	1.979	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)C1CCN(C)CC1	ZINC000183210432	408354561	/nfs/dbraw/zinc/35/45/61/408354561.db2.gz	ZCNKRZJFIZCJDC-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCO)C1CCN(C)CC1	ZINC000183210432	408354567	/nfs/dbraw/zinc/35/45/67/408354567.db2.gz	ZCNKRZJFIZCJDC-UHFFFAOYSA-N	1	1	307.394	1.792	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000274543565	408445898	/nfs/dbraw/zinc/44/58/98/408445898.db2.gz	UUUKGIOXRAHXEU-QMTHXVAHSA-N	1	1	306.366	1.589	20	5		DDBDMO
CCN1CC[NH+]([C@@H]2CCN(c3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000264422585	408484236	/nfs/dbraw/zinc/48/42/36/408484236.db2.gz	RJGMASGNSVJNIF-MRXNPFEDSA-N	1	1	304.394	1.811	20	5		DDBDMO
C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N)CC[N@H+]1C	ZINC000274660460	408485368	/nfs/dbraw/zinc/48/53/68/408485368.db2.gz	YSMGRNGSUQXUFB-WDEREUQCSA-N	1	1	306.366	1.732	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)C1	ZINC000176969475	408487459	/nfs/dbraw/zinc/48/74/59/408487459.db2.gz	VRQWHMARDLKRGF-NSHDSACASA-N	1	1	306.366	1.591	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2C)C1	ZINC000264483720	408508870	/nfs/dbraw/zinc/50/88/70/408508870.db2.gz	IFZBUTRPJZUCBB-LBPRGKRZSA-N	1	1	307.350	1.354	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000161338415	408590193	/nfs/dbraw/zinc/59/01/93/408590193.db2.gz	SLOBQXYPNJDLHK-JQWIXIFHSA-N	1	1	323.397	1.729	20	5		DDBDMO
C[C@@H](CNC(=O)c1c([N+](=O)[O-])cnn1C)[N@H+]1CCC[C@@H](C)C1	ZINC000162085609	408669436	/nfs/dbraw/zinc/66/94/36/408669436.db2.gz	DGUGWEBIWSYPPM-MNOVXSKESA-N	1	1	309.370	1.179	20	5		DDBDMO
Cc1cc(C)c(S(=O)(=O)NCC(F)(F)C[NH3+])cc1[N+](=O)[O-]	ZINC000193312548	408710585	/nfs/dbraw/zinc/71/05/85/408710585.db2.gz	QOVJLCHRYHPNOW-UHFFFAOYSA-N	1	1	323.321	1.084	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](O)[C@H](C)C1	ZINC000249558772	408743985	/nfs/dbraw/zinc/74/39/85/408743985.db2.gz	KVSLQAPEGLWDSI-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](O)[C@H](C)C1	ZINC000249558772	408743989	/nfs/dbraw/zinc/74/39/89/408743989.db2.gz	KVSLQAPEGLWDSI-GYSYKLTISA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000251714139	408785874	/nfs/dbraw/zinc/78/58/74/408785874.db2.gz	KVAYODZSJMPBNN-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000251714139	408785877	/nfs/dbraw/zinc/78/58/77/408785877.db2.gz	KVAYODZSJMPBNN-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001152	408755306	/nfs/dbraw/zinc/75/53/06/408755306.db2.gz	BQXDVDZVXPOLJA-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001152	408755311	/nfs/dbraw/zinc/75/53/11/408755311.db2.gz	BQXDVDZVXPOLJA-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C)C2)c1[N+](=O)[O-]	ZINC000178001152	408755314	/nfs/dbraw/zinc/75/53/14/408755314.db2.gz	BQXDVDZVXPOLJA-PWSUYJOCSA-N	1	1	321.381	1.437	20	5		DDBDMO
Cc1ccc(C(=O)N2CCO[C@H]3CC[N@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000285628909	408832498	/nfs/dbraw/zinc/83/24/98/408832498.db2.gz	DWTWENZGNXLTMU-CABCVRRESA-N	1	1	319.361	1.448	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12	ZINC000276309852	408833259	/nfs/dbraw/zinc/83/32/59/408833259.db2.gz	OFYNUDMOKQMMHB-ZIAGYGMSSA-N	1	1	304.350	1.534	20	5		DDBDMO
C[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1(CO)CC1	ZINC000285655663	408837367	/nfs/dbraw/zinc/83/73/67/408837367.db2.gz	YQYXLFDMYXELOX-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1(CO)CC1	ZINC000285655663	408837368	/nfs/dbraw/zinc/83/73/68/408837368.db2.gz	YQYXLFDMYXELOX-UHFFFAOYSA-N	1	1	313.741	1.643	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1N	ZINC000276501253	408871769	/nfs/dbraw/zinc/87/17/69/408871769.db2.gz	JMWODCZBGYTLRB-XPTSAGLGSA-N	1	1	304.350	1.390	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000281674567	408906952	/nfs/dbraw/zinc/90/69/52/408906952.db2.gz	LWIYKCOUAJRHLT-HZSPNIEDSA-N	1	1	324.377	1.834	20	5		DDBDMO
COC(=O)c1cc(C)nc(NCC2=CC[N@@H+](C)CC2)c1[N+](=O)[O-]	ZINC000286118578	408926941	/nfs/dbraw/zinc/92/69/41/408926941.db2.gz	FCVFGRYKGQRGSQ-UHFFFAOYSA-N	1	1	320.349	1.759	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1[N+](=O)[O-]	ZINC000277398214	408932837	/nfs/dbraw/zinc/93/28/37/408932837.db2.gz	BDSAUYFMYHYCIM-GFCCVEGCSA-N	1	1	321.381	1.383	20	5		DDBDMO
CCCN(CC[NH+]1CCCCC1)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000286280861	408955178	/nfs/dbraw/zinc/95/51/78/408955178.db2.gz	RFNPRCKBYCJTIF-UHFFFAOYSA-N	1	1	323.397	1.964	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1C[N@@H+](C)CCN1C	ZINC000287549763	409054191	/nfs/dbraw/zinc/05/41/91/409054191.db2.gz	WGCFISWEVPXTKZ-CYBMUJFWSA-N	1	1	306.366	1.455	20	5		DDBDMO
CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H]1C[N@H+](C)CCN1C	ZINC000287549763	409054194	/nfs/dbraw/zinc/05/41/94/409054194.db2.gz	WGCFISWEVPXTKZ-CYBMUJFWSA-N	1	1	306.366	1.455	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@H]3[NH2+]CC[C@@H]3C2)c1[N+](=O)[O-]	ZINC000293327964	409090489	/nfs/dbraw/zinc/09/04/89/409090489.db2.gz	IWNZLWPGLPHUML-NXEZZACHSA-N	1	1	307.354	1.094	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)c3cc4cc([N+](=O)[O-])ccc4o3)C[C@H]2C1	ZINC000279156394	409160416	/nfs/dbraw/zinc/16/04/16/409160416.db2.gz	FGCURTZZBGOCLG-TXEJJXNPSA-N	1	1	315.329	1.975	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573617	409364376	/nfs/dbraw/zinc/36/43/76/409364376.db2.gz	VRLHBEPQIHYMIO-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
C[C@H]1OCC[C@]12C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CCO2	ZINC000280573617	409364380	/nfs/dbraw/zinc/36/43/80/409364380.db2.gz	VRLHBEPQIHYMIO-CJNGLKHVSA-N	1	1	322.361	1.853	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CC[N@@H+](C)C1	ZINC000296105832	409432041	/nfs/dbraw/zinc/43/20/41/409432041.db2.gz	GYIPOHRGZYPOGJ-JTQLQIEISA-N	1	1	308.338	1.677	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNc2nccc(C(N)=O)c2[N+](=O)[O-])C1	ZINC000290575620	409449346	/nfs/dbraw/zinc/44/93/46/409449346.db2.gz	UZNYAZYOIGUGDC-SNVBAGLBSA-N	1	1	307.354	1.233	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H](C)C[N@@H+]1C	ZINC000408144233	164241963	/nfs/dbraw/zinc/24/19/63/164241963.db2.gz	HNHNOXLHBMRBGU-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(c([N+](=O)[O-])c2)OCO3)[C@@H](C)C[N@H+]1C	ZINC000408144233	164241965	/nfs/dbraw/zinc/24/19/65/164241965.db2.gz	HNHNOXLHBMRBGU-ZJUUUORDSA-N	1	1	321.333	1.488	20	5		DDBDMO
Cc1nn(CCC(=O)N2CC[N@H+](C)CC[C@H]2C)c(C)c1[N+](=O)[O-]	ZINC000354007556	409596248	/nfs/dbraw/zinc/59/62/48/409596248.db2.gz	QNFNCIDYEPSWPI-LLVKDONJSA-N	1	1	323.397	1.351	20	5		DDBDMO
COc1cc(C(=O)NCCn2cc[nH+]c2C)ccc1[N+](=O)[O-]	ZINC000338122570	409732284	/nfs/dbraw/zinc/73/22/84/409732284.db2.gz	ZXSLRXVKPDOBOK-UHFFFAOYSA-N	1	1	304.306	1.538	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(S(=O)(=O)N2CC([NH+](C)C)C2)c1C	ZINC000332047086	409835592	/nfs/dbraw/zinc/83/55/92/409835592.db2.gz	ZDJKYOYSOJLNTR-UHFFFAOYSA-N	1	1	313.379	1.146	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(CCn2cc([N+](=O)[O-])ccc2=O)C[C@@H]1C	ZINC000346185040	409850426	/nfs/dbraw/zinc/85/04/26/409850426.db2.gz	GNBHNVMYNZQDTE-QWHCGFSZSA-N	1	1	308.382	1.171	20	5		DDBDMO
CC[N@@H+](CCNC(=O)c1cc([N+](=O)[O-])ccc1OC)C1CC1	ZINC000338434503	409987296	/nfs/dbraw/zinc/98/72/96/409987296.db2.gz	DFCDDBVDXLFVIN-UHFFFAOYSA-N	1	1	307.350	1.818	20	5		DDBDMO
CNS(=O)(=O)CCC[N@@H+](C)CCc1cccc([N+](=O)[O-])c1	ZINC000338344303	409926882	/nfs/dbraw/zinc/92/68/82/409926882.db2.gz	AEWFTEVJGSTKIF-UHFFFAOYSA-N	1	1	315.395	1.008	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc(C[N@H+](C)[C@@H]2CCSC2)n1	ZINC000350893560	410009421	/nfs/dbraw/zinc/00/94/21/410009421.db2.gz	WZKCTRRKCPKYDU-MRVPVSSYSA-N	1	1	324.366	1.316	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc(C[N@@H+](C)[C@@H]2CCSC2)n1	ZINC000350893560	410009426	/nfs/dbraw/zinc/00/94/26/410009426.db2.gz	WZKCTRRKCPKYDU-MRVPVSSYSA-N	1	1	324.366	1.316	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)[C@@H]1C	ZINC000346609484	410034556	/nfs/dbraw/zinc/03/45/56/410034556.db2.gz	CZPGRZWINQMHCX-RISCZKNCSA-N	1	1	308.334	1.857	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@H](C)C1	ZINC000332351240	410085643	/nfs/dbraw/zinc/08/56/43/410085643.db2.gz	PJTGIVKPGZMIMR-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCOC[C@H](C)C1	ZINC000332351240	410085648	/nfs/dbraw/zinc/08/56/48/410085648.db2.gz	PJTGIVKPGZMIMR-VXGBXAGGSA-N	1	1	307.350	1.890	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091613	410107271	/nfs/dbraw/zinc/10/72/71/410107271.db2.gz	RZYJRFAKINTBDQ-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
Cc1c(NC(=O)[C@H](C)[N@H+]2CCC[C@H](CO)C2)cccc1[N+](=O)[O-]	ZINC000298091613	410107278	/nfs/dbraw/zinc/10/72/78/410107278.db2.gz	RZYJRFAKINTBDQ-STQMWFEESA-N	1	1	321.377	1.935	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@H]1CNC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000357916703	410325056	/nfs/dbraw/zinc/32/50/56/410325056.db2.gz	WSEVJZYYJYOOAN-LBPRGKRZSA-N	1	1	323.397	1.713	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)[C@H](O)C2)cccc1[N+](=O)[O-]	ZINC000351934581	410349680	/nfs/dbraw/zinc/34/96/80/410349680.db2.gz	IMWYPIVTIAYWBR-IINYFYTJSA-N	1	1	307.350	1.544	20	5		DDBDMO
COC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000298776305	410393845	/nfs/dbraw/zinc/39/38/45/410393845.db2.gz	DCVSZQLNBCNSEK-NSHDSACASA-N	1	1	321.333	1.418	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2F)CCC[N@H+]1C	ZINC000343437281	410450329	/nfs/dbraw/zinc/45/03/29/410450329.db2.gz	KYKOCKJMZVDLRB-QMTHXVAHSA-N	1	1	309.341	1.875	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](O)CC1	ZINC000339778641	410456333	/nfs/dbraw/zinc/45/63/33/410456333.db2.gz	FIKUKUKGBSPLAF-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H](O)CC1	ZINC000339778641	410456338	/nfs/dbraw/zinc/45/63/38/410456338.db2.gz	FIKUKUKGBSPLAF-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[N@H+]1CC[C@@H]2OCCN(C(=O)c3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC000355373633	410476017	/nfs/dbraw/zinc/47/60/17/410476017.db2.gz	ULJOLMVAHWISJQ-CABCVRRESA-N	1	1	319.361	1.530	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])CCC[N@H+]1C	ZINC000343472002	410476324	/nfs/dbraw/zinc/47/63/24/410476324.db2.gz	ZGDWPQBAXGHDIO-CHWSQXEVSA-N	1	1	320.393	1.630	20	5		DDBDMO
C[N@@H+](C[C@H](O)COc1cccc([N+](=O)[O-])c1)[C@H]1CCCOC1	ZINC000352186864	410534730	/nfs/dbraw/zinc/53/47/30/410534730.db2.gz	OJQDLPLIFVPMMG-KBPBESRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000339953020	410572380	/nfs/dbraw/zinc/57/23/80/410572380.db2.gz	MQVOTKDXQMPIBH-RYUDHWBXSA-N	1	1	318.377	1.993	20	5		DDBDMO
CC[N@@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C[C@H](C)O	ZINC000352223251	410557377	/nfs/dbraw/zinc/55/73/77/410557377.db2.gz	UOVPLNZKEQXFJA-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@H+](CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C[C@H](C)O	ZINC000352223251	410557382	/nfs/dbraw/zinc/55/73/82/410557382.db2.gz	UOVPLNZKEQXFJA-JTQLQIEISA-N	1	1	311.338	1.245	20	5		DDBDMO
CCOc1cc(N2CC[C@@H]3OCC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000579935188	422859139	/nfs/dbraw/zinc/85/91/39/422859139.db2.gz	PYMQBFCQTDSNTL-GJZGRUSLSA-N	1	1	321.377	1.903	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1OC[C@H](O)C[NH+]1C[C@@H](C)O[C@H](C)C1	ZINC000340168602	410721520	/nfs/dbraw/zinc/72/15/20/410721520.db2.gz	SWJKQYHOQIVWLN-MGPQQGTHSA-N	1	1	324.377	1.752	20	5		DDBDMO
CC(C)[C@H]1C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761723	410678823	/nfs/dbraw/zinc/67/88/23/410678823.db2.gz	SVXYYAOUBPXEOD-XJKSGUPXSA-N	1	1	324.377	1.691	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000343761723	410678826	/nfs/dbraw/zinc/67/88/26/410678826.db2.gz	SVXYYAOUBPXEOD-XJKSGUPXSA-N	1	1	324.377	1.691	20	5		DDBDMO
C[C@@H]1[C@@H](CO)CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337478270	410814343	/nfs/dbraw/zinc/81/43/43/410814343.db2.gz	UFCUVYKRIREALX-VXGBXAGGSA-N	1	1	307.350	1.626	20	5		DDBDMO
COC(=O)[C@@H](C)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337478260	410814669	/nfs/dbraw/zinc/81/46/69/410814669.db2.gz	UEOSBYOELGRFCG-SNVBAGLBSA-N	1	1	309.322	1.417	20	5		DDBDMO
COC(=O)[C@@H](C)[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000337478260	410814676	/nfs/dbraw/zinc/81/46/76/410814676.db2.gz	UEOSBYOELGRFCG-SNVBAGLBSA-N	1	1	309.322	1.417	20	5		DDBDMO
C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000348288524	410900293	/nfs/dbraw/zinc/90/02/93/410900293.db2.gz	WMCXNNYDUBSTDS-FBIMIBRVSA-N	1	1	322.287	1.425	20	5		DDBDMO
CCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000359947546	410964837	/nfs/dbraw/zinc/96/48/37/410964837.db2.gz	BSOFMWVIXBKDJG-SNVBAGLBSA-N	1	1	308.338	1.300	20	5		DDBDMO
Cn1cc([N+](=O)[O-])c(C(=O)NCC[N@H+]2CCCC(C)(C)C2)n1	ZINC000331289826	411060594	/nfs/dbraw/zinc/06/05/94/411060594.db2.gz	JKIVNEPSAIPXTK-UHFFFAOYSA-N	1	1	309.370	1.180	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)n1	ZINC000331208544	411016608	/nfs/dbraw/zinc/01/66/08/411016608.db2.gz	PVKWYRCXJZNDRV-NSHDSACASA-N	1	1	309.370	1.225	20	5		DDBDMO
C[C@@H]1C[C@@H](C(=O)Nc2n[nH]c3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000344215506	411032263	/nfs/dbraw/zinc/03/22/63/411032263.db2.gz	KVGSQMLKHXEROH-ZJUUUORDSA-N	1	1	317.349	2.140	20	5		DDBDMO
C[C@H](CO)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000131921168	196209925	/nfs/dbraw/zinc/20/99/25/196209925.db2.gz	VGOXDEZXWDYMIA-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000131921168	196209926	/nfs/dbraw/zinc/20/99/26/196209926.db2.gz	VGOXDEZXWDYMIA-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCCN1CC[NH+]([C@@H]2CCOC2)CC1	ZINC000366548313	418488436	/nfs/dbraw/zinc/48/84/36/418488436.db2.gz	ZTXOZHCLWVQWHQ-CQSZACIVSA-N	1	1	321.377	1.380	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000374850402	418568826	/nfs/dbraw/zinc/56/88/26/418568826.db2.gz	LOZRRATYLGWPCI-UHFFFAOYSA-N	1	1	324.356	1.874	20	5		DDBDMO
O=C(CC[N@@H+]1C[C@H]2[C@H](CO)[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000367849068	418645542	/nfs/dbraw/zinc/64/55/42/418645542.db2.gz	LDLSXUFFZUUVSD-WDNDVIMCSA-N	1	1	305.334	1.094	20	5		DDBDMO
Nc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@H+](C2CCCC2)C1	ZINC000367888856	418652949	/nfs/dbraw/zinc/65/29/49/418652949.db2.gz	ZDBQZLCPIQNPTP-LLVKDONJSA-N	1	1	318.377	1.924	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000375668207	418670787	/nfs/dbraw/zinc/67/07/87/418670787.db2.gz	DNOMXMNIDZOPBW-KKUMJFAQSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000375668207	418670789	/nfs/dbraw/zinc/67/07/89/418670789.db2.gz	DNOMXMNIDZOPBW-KKUMJFAQSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000375668207	418670792	/nfs/dbraw/zinc/67/07/92/418670792.db2.gz	DNOMXMNIDZOPBW-KKUMJFAQSA-N	1	1	303.362	1.290	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(NCc3c[nH+]c4n3CCCC4)nn21	ZINC000376490156	418698099	/nfs/dbraw/zinc/69/80/99/418698099.db2.gz	YAGZPZRBRPYXNN-UHFFFAOYSA-N	1	1	313.321	1.782	20	5		DDBDMO
O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000372470063	418873579	/nfs/dbraw/zinc/87/35/79/418873579.db2.gz	CZNCTTYBUZLTBH-WDEREUQCSA-N	1	1	305.334	1.657	20	5		DDBDMO
CCC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC	ZINC000411174676	418877055	/nfs/dbraw/zinc/87/70/55/418877055.db2.gz	CIWUWKOYNDAMNX-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
CCC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CC(=O)OC	ZINC000411174676	418877058	/nfs/dbraw/zinc/87/70/58/418877058.db2.gz	CIWUWKOYNDAMNX-UHFFFAOYSA-N	1	1	323.349	1.808	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)C[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344352	418893971	/nfs/dbraw/zinc/89/39/71/418893971.db2.gz	JDFDCYLZUQBWII-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1CO[C@@H](CO)C[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000411344352	418893972	/nfs/dbraw/zinc/89/39/72/418893972.db2.gz	JDFDCYLZUQBWII-BXUZGUMPSA-N	1	1	323.349	1.005	20	5		DDBDMO
COCC[C@@H]1COCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000365846813	418915660	/nfs/dbraw/zinc/91/56/60/418915660.db2.gz	KNWAHHBYHYKQOR-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
COCC[C@@H]1COCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000365846813	418915661	/nfs/dbraw/zinc/91/56/61/418915661.db2.gz	KNWAHHBYHYKQOR-CQSZACIVSA-N	1	1	310.350	1.711	20	5		DDBDMO
CNC(=O)[C@H]1CC[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C1	ZINC000420975176	419397511	/nfs/dbraw/zinc/39/75/11/419397511.db2.gz	NUVULYASXZUUSE-NSHDSACASA-N	1	1	323.349	1.050	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913824	419365703	/nfs/dbraw/zinc/36/57/03/419365703.db2.gz	GPXRHUQXQLSGAW-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913824	419365705	/nfs/dbraw/zinc/36/57/05/419365705.db2.gz	GPXRHUQXQLSGAW-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@@H]1C[C@@H](CO)C[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000420948118	419375880	/nfs/dbraw/zinc/37/58/80/419375880.db2.gz	VJWNIIKPZQWSPE-NFAWXSAZSA-N	1	1	324.377	1.285	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1CCO	ZINC000426272486	419425987	/nfs/dbraw/zinc/42/59/87/419425987.db2.gz	XJIPQPBTBYZEDS-LLVKDONJSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1CCO	ZINC000426272486	419425995	/nfs/dbraw/zinc/42/59/95/419425995.db2.gz	XJIPQPBTBYZEDS-LLVKDONJSA-N	1	1	323.349	1.389	20	5		DDBDMO
COc1ccc(OCC[N@@H+]2CC[C@]23CCOC3)c([N+](=O)[O-])c1	ZINC000421018713	419454166	/nfs/dbraw/zinc/45/41/66/419454166.db2.gz	LPUUIEKKDYALOF-OAHLLOKOSA-N	1	1	308.334	1.847	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CC[C@]23CCOC3)c([N+](=O)[O-])c1	ZINC000421018713	419454174	/nfs/dbraw/zinc/45/41/74/419454174.db2.gz	LPUUIEKKDYALOF-OAHLLOKOSA-N	1	1	308.334	1.847	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000421706856	419692760	/nfs/dbraw/zinc/69/27/60/419692760.db2.gz	VYWZMLRPSXHEID-ZDUSSCGKSA-N	1	1	320.393	1.949	20	5		DDBDMO
CN(C[C@@H]1CCC[N@H+]1C)C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000421710852	419696361	/nfs/dbraw/zinc/69/63/61/419696361.db2.gz	MPYIWBCGLGVTPM-NSHDSACASA-N	1	1	321.333	1.490	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)NC[C@@H](C)Cn2cc[nH+]c2C)n1	ZINC000427819708	419740308	/nfs/dbraw/zinc/74/03/08/419740308.db2.gz	RIRUSQHUCQVIJE-SNVBAGLBSA-N	1	1	320.353	1.382	20	5		DDBDMO
COCC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000428010767	419787848	/nfs/dbraw/zinc/78/78/48/419787848.db2.gz	MYCUINJYHJANJB-GFCCVEGCSA-N	1	1	323.349	1.141	20	5		DDBDMO
COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000428010767	419787855	/nfs/dbraw/zinc/78/78/55/419787855.db2.gz	MYCUINJYHJANJB-GFCCVEGCSA-N	1	1	323.349	1.141	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000429115374	419971839	/nfs/dbraw/zinc/97/18/39/419971839.db2.gz	ODOFYSSOUUSZLX-RWMBFGLXSA-N	1	1	310.350	1.180	20	5		DDBDMO
C[C@H]1CN(Cc2c([N+](=O)[O-])ncn2C)CC[N@H+](C2CCC2)C1	ZINC000429404342	420013861	/nfs/dbraw/zinc/01/38/61/420013861.db2.gz	QDLBKENHKLSLEJ-LBPRGKRZSA-N	1	1	307.398	1.635	20	5		DDBDMO
[NH3+]CC(F)(F)CN[C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1	ZINC000423333339	420016827	/nfs/dbraw/zinc/01/68/27/420016827.db2.gz	FDVAOWYQRGWDCH-ZJUUUORDSA-N	1	1	303.313	1.459	20	5		DDBDMO
[NH3+]CC(F)(F)CN[C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1	ZINC000423333337	420016883	/nfs/dbraw/zinc/01/68/83/420016883.db2.gz	FDVAOWYQRGWDCH-VHSXEESVSA-N	1	1	303.313	1.459	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@](C)(F)C1	ZINC000423691742	420129360	/nfs/dbraw/zinc/12/93/60/420129360.db2.gz	PXKVCSAARVWHJV-OAHLLOKOSA-N	1	1	309.341	1.985	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CC1(O)CCOCC1	ZINC000430192183	420087980	/nfs/dbraw/zinc/08/79/80/420087980.db2.gz	AUJVAONPPGMNFL-UHFFFAOYSA-N	1	1	310.350	1.577	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](C)C[C@@H]1CCN(C(C)=O)C1	ZINC000430209444	420090066	/nfs/dbraw/zinc/09/00/66/420090066.db2.gz	XWAXUZWUEATYNV-ZDUSSCGKSA-N	1	1	321.377	1.904	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1CC(N)=O	ZINC000430226176	420092478	/nfs/dbraw/zinc/09/24/78/420092478.db2.gz	MNTUBLDRMSCTJE-LBPRGKRZSA-N	1	1	307.350	1.833	20	5		DDBDMO
COc1ccc(NC(=O)[C@@H]2CC[NH2+]CC2(F)F)cc1[N+](=O)[O-]	ZINC000423726849	420144722	/nfs/dbraw/zinc/14/47/22/420144722.db2.gz	QBLGPUKTIDUCLU-VIFPVBQESA-N	1	1	315.276	1.787	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)CCN(C)C1CC([NH3+])C1	ZINC000420345585	420225336	/nfs/dbraw/zinc/22/53/36/420225336.db2.gz	ZVEHZYOQAFPICQ-UHFFFAOYSA-N	1	1	322.365	1.354	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CN[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228308	420250910	/nfs/dbraw/zinc/25/09/10/420250910.db2.gz	OJZOZNGWYMZMKJ-WBVHZDCISA-N	1	1	319.405	1.973	20	5		DDBDMO
CN1CC[C@](O)(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1	ZINC000433228308	420250915	/nfs/dbraw/zinc/25/09/15/420250915.db2.gz	OJZOZNGWYMZMKJ-WBVHZDCISA-N	1	1	319.405	1.973	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000416294085	420310900	/nfs/dbraw/zinc/31/09/00/420310900.db2.gz	KOZFTFHJLBULLF-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
Cc1ccc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000416294085	420310903	/nfs/dbraw/zinc/31/09/03/420310903.db2.gz	KOZFTFHJLBULLF-OLZOCXBDSA-N	1	1	321.377	1.430	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](CNc2c(C(N)=O)cccc2[N+](=O)[O-])C1	ZINC000420581447	420322569	/nfs/dbraw/zinc/32/25/69/420322569.db2.gz	GYJFMDNIKZYOLF-NSHDSACASA-N	1	1	306.366	1.838	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](C)[N@@H+](CCO)[C@@H](C)C1	ZINC000450796874	420534508	/nfs/dbraw/zinc/53/45/08/420534508.db2.gz	RIFOFVXOQCXYDG-PHIMTYICSA-N	1	1	311.386	1.011	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1C[C@@H](C)[N@H+](CCO)[C@@H](C)C1	ZINC000450796874	420534511	/nfs/dbraw/zinc/53/45/11/420534511.db2.gz	RIFOFVXOQCXYDG-PHIMTYICSA-N	1	1	311.386	1.011	20	5		DDBDMO
C[C@@H]1C[C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)CC[N@H+]1C	ZINC000442132922	420670455	/nfs/dbraw/zinc/67/04/55/420670455.db2.gz	QKSDANHFBDIYED-PWSUYJOCSA-N	1	1	320.349	1.132	20	5		DDBDMO
CNc1nc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)ccc1[N+](=O)[O-]	ZINC000455667259	421051510	/nfs/dbraw/zinc/05/15/10/421051510.db2.gz	QDHNQBOSDJAKMX-LLVKDONJSA-N	1	1	321.381	1.445	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@H+](C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-]	ZINC000455744138	421058501	/nfs/dbraw/zinc/05/85/01/421058501.db2.gz	YDXNJKRNOJPETN-CYBMUJFWSA-N	1	1	321.381	1.444	20	5		DDBDMO
CNc1nc(C(=O)N2CC[N@@H+](C)C[C@@H]2C(C)C)ccc1[N+](=O)[O-]	ZINC000455744138	421058505	/nfs/dbraw/zinc/05/85/05/421058505.db2.gz	YDXNJKRNOJPETN-CYBMUJFWSA-N	1	1	321.381	1.444	20	5		DDBDMO
Cn1nnc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1	ZINC000494355680	420999925	/nfs/dbraw/zinc/99/99/25/420999925.db2.gz	HAPPXZWNNHTNFT-WCQYABFASA-N	1	1	316.365	1.619	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@H]1C(=O)N(C)CCc1cccc([N+](=O)[O-])c1	ZINC000488357851	421085152	/nfs/dbraw/zinc/08/51/52/421085152.db2.gz	QFCSTNSJFLIXKU-IUODEOHRSA-N	1	1	305.378	1.793	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@H+]2CCO)c(Cl)c1	ZINC000450608499	421217271	/nfs/dbraw/zinc/21/72/71/421217271.db2.gz	DKUCBRSWAJQOOX-JTQLQIEISA-N	1	1	314.773	1.902	20	5		DDBDMO
O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@@H+]2CCO)c(Cl)c1	ZINC000450608499	421217274	/nfs/dbraw/zinc/21/72/74/421217274.db2.gz	DKUCBRSWAJQOOX-JTQLQIEISA-N	1	1	314.773	1.902	20	5		DDBDMO
COc1cccc(C(=O)NC[C@@H]2CCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000559823907	421226707	/nfs/dbraw/zinc/22/67/07/421226707.db2.gz	PAOFLCUBUYYQQA-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
CC(C)(C)[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC1	ZINC000546088571	421284357	/nfs/dbraw/zinc/28/43/57/421284357.db2.gz	RTXNPKBZMKBHFN-UHFFFAOYSA-N	1	1	321.381	1.518	20	5		DDBDMO
C[C@@]1(CO)CCC[N@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000546103885	421285080	/nfs/dbraw/zinc/28/50/80/421285080.db2.gz	BBMPGVLNBVVJCG-HNNXBMFYSA-N	1	1	308.334	1.808	20	5		DDBDMO
C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2c[nH]nc2[N+](=O)[O-])C1	ZINC000547754784	421363832	/nfs/dbraw/zinc/36/38/32/421363832.db2.gz	CTRIDWYOQRTNCV-PHIMTYICSA-N	1	1	309.370	1.416	20	5		DDBDMO
CC[C@@H]1C[N@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000518599850	421661255	/nfs/dbraw/zinc/66/12/55/421661255.db2.gz	UYJUEOJCWWUXDZ-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000518599850	421661256	/nfs/dbraw/zinc/66/12/56/421661256.db2.gz	UYJUEOJCWWUXDZ-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000533831723	421684178	/nfs/dbraw/zinc/68/41/78/421684178.db2.gz	UDVWNTSYUHTQKS-CQSZACIVSA-N	1	1	300.318	1.839	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)C1	ZINC000533831723	421684179	/nfs/dbraw/zinc/68/41/79/421684179.db2.gz	UDVWNTSYUHTQKS-CQSZACIVSA-N	1	1	300.318	1.839	20	5		DDBDMO
C[C@@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000520366850	421747163	/nfs/dbraw/zinc/74/71/63/421747163.db2.gz	IUZCQOXOYSTCJD-NEPJUHHUSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)c2c(N)cccc2[N+](=O)[O-])C1	ZINC000541857755	421809103	/nfs/dbraw/zinc/80/91/03/421809103.db2.gz	XFHDOEKXXZVCRS-NSHDSACASA-N	1	1	306.366	1.637	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2ccncc2)C1	ZINC000581139309	421908436	/nfs/dbraw/zinc/90/84/36/421908436.db2.gz	ARDKMDVHDBZFPA-AWEZNQCLSA-N	1	1	314.345	1.641	20	5		DDBDMO
CCc1nn(C)c(N2CC[N@H+](C3CC3)C[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000574898174	422210549	/nfs/dbraw/zinc/21/05/49/422210549.db2.gz	HEASUWOBIJBEAC-LLVKDONJSA-N	1	1	307.398	1.811	20	5		DDBDMO
Cc1cc(NC[C@H](C)[N@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000594590791	422352661	/nfs/dbraw/zinc/35/26/61/422352661.db2.gz	BUVDTJWJZDQZEN-RWMBFGLXSA-N	1	1	308.382	2.208	20	5		DDBDMO
Cc1cc(NC[C@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000594590791	422352667	/nfs/dbraw/zinc/35/26/67/422352667.db2.gz	BUVDTJWJZDQZEN-RWMBFGLXSA-N	1	1	308.382	2.208	20	5		DDBDMO
C[N@H+]1CCN(c2ncc([N+](=O)[O-])c(N)n2)CC12CCCCC2	ZINC000596251782	422371793	/nfs/dbraw/zinc/37/17/93/422371793.db2.gz	XYUCSMSXBCZGPA-UHFFFAOYSA-N	1	1	306.370	1.422	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(NC[C@H]3CC[N@H+]3C3CCCC3)nn21	ZINC000599164058	422402696	/nfs/dbraw/zinc/40/26/96/422402696.db2.gz	IUZFWPGKDPPXFG-GFCCVEGCSA-N	1	1	316.365	2.066	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCCN(C(=O)NCc3cccc([N+](=O)[O-])c3)[C@@H]2C1	ZINC000578884249	422669500	/nfs/dbraw/zinc/66/95/00/422669500.db2.gz	WHEBMULGBAYNNT-DZGCQCFKSA-N	1	1	318.377	1.830	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(C(=O)c2cc([N+](=O)[O-])cnc2C)C[C@H]1C	ZINC000345924843	272366656	/nfs/dbraw/zinc/36/66/56/272366656.db2.gz	SAIMDUFOGUAZRS-GHMZBOCLSA-N	1	1	306.366	1.853	20	5		DDBDMO
COc1cc(N2CC[N@H+](CCO)[C@@H](C)C2)c([N+](=O)[O-])cc1F	ZINC000302382405	274096505	/nfs/dbraw/zinc/09/65/05/274096505.db2.gz	GVEVIJIIFGMIES-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
COc1cc(N2CC[N@@H+](CCO)[C@@H](C)C2)c([N+](=O)[O-])cc1F	ZINC000302382405	274096507	/nfs/dbraw/zinc/09/65/07/274096507.db2.gz	GVEVIJIIFGMIES-JTQLQIEISA-N	1	1	313.329	1.245	20	5		DDBDMO
C[C@@H]1CN(c2ccc([N+](=O)[O-])c3cnccc32)CC[N@H+]1CCO	ZINC000302397744	274364183	/nfs/dbraw/zinc/36/41/83/274364183.db2.gz	JJDSQMJWOUWVMY-GFCCVEGCSA-N	1	1	316.361	1.646	20	5		DDBDMO
C[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(F)cc3[N+](=O)[O-])[C@@H]2C1	ZINC000408056062	277179859	/nfs/dbraw/zinc/17/98/59/277179859.db2.gz	CIYUCHIIYSYRMJ-ZIAGYGMSSA-N	1	1	323.324	1.279	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CCN(c3[nH+]ccn3C)CC2)n1	ZINC000268800465	281012865	/nfs/dbraw/zinc/01/28/65/281012865.db2.gz	JEZPDMLSHXSHAH-UHFFFAOYSA-N	1	1	302.338	1.358	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])[C@H]1CO	ZINC000305429850	533693633	/nfs/dbraw/zinc/69/36/33/533693633.db2.gz	DLDTWSBNFQCPSW-YGRLFVJLSA-N	1	1	307.350	1.287	20	5		DDBDMO
COC(=O)c1cc(NC(=O)[C@H]2C[N@@H+](C)C[C@@H]2C)cc([N+](=O)[O-])c1	ZINC000362804442	300145185	/nfs/dbraw/zinc/14/51/85/300145185.db2.gz	FLZNSQKZLGNWCZ-ZANVPECISA-N	1	1	321.333	1.518	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000363304921	300248001	/nfs/dbraw/zinc/24/80/01/300248001.db2.gz	MBOLJWVVDLJXAC-ILXRZTDVSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363304921	300248004	/nfs/dbraw/zinc/24/80/04/300248004.db2.gz	MBOLJWVVDLJXAC-ILXRZTDVSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)[C@H]1CC1[N+](=O)[O-]	ZINC000363304921	300248007	/nfs/dbraw/zinc/24/80/07/300248007.db2.gz	MBOLJWVVDLJXAC-ILXRZTDVSA-N	1	1	303.362	1.432	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000363324523	300251910	/nfs/dbraw/zinc/25/19/10/300251910.db2.gz	PQZHIGBGNIIQGF-KGLIPLIRSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000363564385	300282997	/nfs/dbraw/zinc/28/29/97/300282997.db2.gz	TXAHQHKEHIWWFB-KBPBESRZSA-N	1	1	303.362	1.880	20	5		DDBDMO
COc1cccc(N2CC[NH+]([C@@H]3CCOC3)CC2)c1[N+](=O)[O-]	ZINC000363697531	300298201	/nfs/dbraw/zinc/29/82/01/300298201.db2.gz	FLKYSOKFAQLASL-GFCCVEGCSA-N	1	1	307.350	1.514	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000364210742	300358406	/nfs/dbraw/zinc/35/84/06/300358406.db2.gz	FUQCMBKSISCLDA-GFCCVEGCSA-N	1	1	307.350	1.124	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]21	ZINC000368596848	301062022	/nfs/dbraw/zinc/06/20/22/301062022.db2.gz	WFOKGLZMQIUMCF-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
O=C1NCCCC[C@H]1[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000369012308	301119652	/nfs/dbraw/zinc/11/96/52/301119652.db2.gz	UWTKDQWGXVZDII-DGCLKSJQSA-N	1	1	307.354	1.097	20	5		DDBDMO
Cc1cn2c([nH+]1)CC[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])C2	ZINC000373676324	301714617	/nfs/dbraw/zinc/71/46/17/301714617.db2.gz	VSFOHHZQMKZGFL-LLVKDONJSA-N	1	1	315.333	1.626	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CC(O)(C2CC2)C1	ZINC000376478103	302082797	/nfs/dbraw/zinc/08/27/97/302082797.db2.gz	NVIDGTFITAFIIS-UHFFFAOYSA-N	1	1	319.361	1.689	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])c(N2CCC[N@H+](C3CCOCC3)CC2)c1	ZINC000376763352	302099636	/nfs/dbraw/zinc/09/96/36/302099636.db2.gz	FGOVPQVBKZZZPC-UHFFFAOYSA-N	1	1	320.393	1.868	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000533539688	303320887	/nfs/dbraw/zinc/32/08/87/303320887.db2.gz	GTLRIYNNDSIICG-KCQAQPDRSA-N	1	1	324.377	1.427	20	5		DDBDMO
CCc1ccc([C@@H](CO)[NH2+]Cc2c([N+](=O)[O-])ncn2C)cc1	ZINC000359624741	306958350	/nfs/dbraw/zinc/95/83/50/306958350.db2.gz	JJLQTPSYQBWJMW-CYBMUJFWSA-N	1	1	304.350	1.714	20	5		DDBDMO
O=C(C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)NC1CCCC1	ZINC000369489868	307121776	/nfs/dbraw/zinc/12/17/76/307121776.db2.gz	KMPPTNLICQNZCP-UHFFFAOYSA-N	1	1	321.381	1.487	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000371440810	307149658	/nfs/dbraw/zinc/14/96/58/307149658.db2.gz	UIFZCKVGGOWFDQ-OCCSQVGLSA-N	1	1	308.382	1.664	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)CC12CCC2	ZINC000371440811	307149682	/nfs/dbraw/zinc/14/96/82/307149682.db2.gz	UIFZCKVGGOWFDQ-TZMCWYRMSA-N	1	1	308.382	1.664	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1C1CCN(Cc2c([N+](=O)[O-])ncn2C)CC1	ZINC000582853735	337210629	/nfs/dbraw/zinc/21/06/29/337210629.db2.gz	LQKSSBKHMOUVHB-GFCCVEGCSA-N	1	1	323.397	1.013	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C1	ZINC000157855274	519890251	/nfs/dbraw/zinc/89/02/51/519890251.db2.gz	URGHYPCOUJIGRW-GFCCVEGCSA-N	1	1	309.370	1.030	20	5		DDBDMO
Cc1nc(NCC(C)(C)[NH+]2C[C@H](C)O[C@@H](C)C2)ncc1[N+](=O)[O-]	ZINC000296453158	534487132	/nfs/dbraw/zinc/48/71/32/534487132.db2.gz	IWHUKZBRKONVSM-QWRGUYRKSA-N	1	1	323.397	1.993	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CCC[C@@H]([C@@H](C)[NH3+])C2)c1[N+](=O)[O-]	ZINC000156444287	521326847	/nfs/dbraw/zinc/32/68/47/521326847.db2.gz	COPPJLYFHGEBFH-NXEZZACHSA-N	1	1	309.370	1.470	20	5		DDBDMO
[NH3+]CC(F)(F)CNCc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000414940304	534583502	/nfs/dbraw/zinc/58/35/02/534583502.db2.gz	ZQXREHJDFRSRLK-UHFFFAOYSA-N	1	1	311.235	1.880	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1COC1	ZINC000451283013	528399631	/nfs/dbraw/zinc/39/96/31/528399631.db2.gz	DVRRPQIAWDWDRP-UHFFFAOYSA-N	1	1	307.350	1.953	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000330890006	528549595	/nfs/dbraw/zinc/54/95/95/528549595.db2.gz	BPXYYFSFWDHXDO-UWVGGRQHSA-N	1	1	309.370	1.483	20	5		DDBDMO
Cc1cc(OCC(=O)NCC[N@@H+]2CCC[C@H]2C)ccc1[N+](=O)[O-]	ZINC000797629528	700016876	/nfs/dbraw/zinc/01/68/76/700016876.db2.gz	IJFIABWWFUKEQJ-CYBMUJFWSA-N	1	1	321.377	1.883	20	5		DDBDMO
O=C1N[C@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C[C@@H]2CO1	ZINC000799179864	700126785	/nfs/dbraw/zinc/12/67/85/700126785.db2.gz	ZTBZGQUGFDAXPJ-KWCYVHTRSA-N	1	1	321.333	1.059	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@@H](c3ccccn3)C2)c1	ZINC000799191557	700127670	/nfs/dbraw/zinc/12/76/70/700127670.db2.gz	NAELIFJNSVYBRE-TZMCWYRMSA-N	1	1	317.349	1.037	20	5		DDBDMO
Cc1nn(CN(C)CCCn2cc[nH+]c2C)c(C)c1[N+](=O)[O-]	ZINC000162804935	697330259	/nfs/dbraw/zinc/33/02/59/697330259.db2.gz	LTFDYFLWQUFWOW-UHFFFAOYSA-N	1	1	306.370	1.893	20	5		DDBDMO
Cc1nn(C[N@@H+]2CCCO[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000749954647	700194324	/nfs/dbraw/zinc/19/43/24/700194324.db2.gz	LRXCLRFJXGNWKN-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
Cc1nn(C[N@H+]2CCCO[C@H](C)C2)c2ncc([N+](=O)[O-])cc12	ZINC000749954647	700194326	/nfs/dbraw/zinc/19/43/26/700194326.db2.gz	LRXCLRFJXGNWKN-SNVBAGLBSA-N	1	1	305.338	1.716	20	5		DDBDMO
COC[C@H]1CC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)C1	ZINC000749954325	700194474	/nfs/dbraw/zinc/19/44/74/700194474.db2.gz	MXFDCSDLZMVUJT-NSHDSACASA-N	1	1	305.338	1.574	20	5		DDBDMO
C[C@@H]1CCC[N@H+](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278231	698091302	/nfs/dbraw/zinc/09/13/02/698091302.db2.gz	SMJWRJHCEFZQDU-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
C[C@@H]1CCC[N@@H+](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776278231	698091305	/nfs/dbraw/zinc/09/13/05/698091305.db2.gz	SMJWRJHCEFZQDU-CJNGLKHVSA-N	1	1	307.394	1.950	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2nnc3n2CCCC3)cc1	ZINC000776280132	698091942	/nfs/dbraw/zinc/09/19/42/698091942.db2.gz	ZXUZBOALSUPMFS-ZDUSSCGKSA-N	1	1	317.349	1.346	20	5		DDBDMO
CC(=O)NC[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776580557	698120560	/nfs/dbraw/zinc/12/05/60/698120560.db2.gz	WJWWKQOYHIPELB-CZUORRHYSA-N	1	1	321.377	1.476	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CCS[C@H]3COCC[C@@H]32)cc1	ZINC000776587138	698122483	/nfs/dbraw/zinc/12/24/83/698122483.db2.gz	ULYPECVAELXWFB-ZNMIVQPWSA-N	1	1	324.402	1.835	20	5		DDBDMO
COC(=O)[C@@]1(C)CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776586978	698122503	/nfs/dbraw/zinc/12/25/03/698122503.db2.gz	RTDPGTMBFZCJDY-ZFWWWQNUSA-N	1	1	308.334	1.513	20	5		DDBDMO
CC(=O)N1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000776605599	698125988	/nfs/dbraw/zinc/12/59/88/698125988.db2.gz	NLYPSMPRGUUGEA-OAHLLOKOSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC(=O)N1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)(C)C1	ZINC000776605599	698125990	/nfs/dbraw/zinc/12/59/90/698125990.db2.gz	NLYPSMPRGUUGEA-OAHLLOKOSA-N	1	1	321.377	1.571	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@H+]1C[C@@H]3C[C@]3(CO)C1)OCCO2	ZINC000783735364	698871856	/nfs/dbraw/zinc/87/18/56/698871856.db2.gz	PQGSBTPKJAAICQ-XHDPSFHLSA-N	1	1	306.318	1.180	20	5		DDBDMO
O=[N+]([O-])c1cc2c(cc1C[N@@H+]1C[C@@H]3C[C@]3(CO)C1)OCCO2	ZINC000783735364	698871863	/nfs/dbraw/zinc/87/18/63/698871863.db2.gz	PQGSBTPKJAAICQ-XHDPSFHLSA-N	1	1	306.318	1.180	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676960	699237910	/nfs/dbraw/zinc/23/79/10/699237910.db2.gz	BLUNENGNZDEQNR-ZWNOBZJWSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@]1(CO)C[C@@H](O)C[N@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000704676960	699237913	/nfs/dbraw/zinc/23/79/13/699237913.db2.gz	BLUNENGNZDEQNR-ZWNOBZJWSA-N	1	1	300.742	1.566	20	5		DDBDMO
C[C@@H]1[C@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@@H+]1C	ZINC000719624992	699303025	/nfs/dbraw/zinc/30/30/25/699303025.db2.gz	NLCCIGVLSLZIMT-VXNVDRBHSA-N	1	1	315.171	1.679	20	5		DDBDMO
C[C@@H]1[C@H](Nc2c(Br)cncc2[N+](=O)[O-])CC[N@H+]1C	ZINC000719624992	699303028	/nfs/dbraw/zinc/30/30/28/699303028.db2.gz	NLCCIGVLSLZIMT-VXNVDRBHSA-N	1	1	315.171	1.679	20	5		DDBDMO
C[C@@H](CN1CCOCC1)[N@@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000789334034	699377829	/nfs/dbraw/zinc/37/78/29/699377829.db2.gz	FUTRFFVAIWCMTP-XJKSGUPXSA-N	1	1	323.393	1.281	20	5		DDBDMO
CO[C@H](C)C[N@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000795749623	699889159	/nfs/dbraw/zinc/88/91/59/699889159.db2.gz	GWQUKICIUHEAOI-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
CO[C@H](C)C[N@@H+](C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000795749623	699889160	/nfs/dbraw/zinc/88/91/60/699889160.db2.gz	GWQUKICIUHEAOI-LLVKDONJSA-N	1	1	305.338	1.778	20	5		DDBDMO
C[C@@H]1CCC[N@H+]1CCNC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000744350064	699946324	/nfs/dbraw/zinc/94/63/24/699946324.db2.gz	PYYQNEJXNNFMHK-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@H]1C[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)Cc2ccccc21	ZINC000744385201	699947383	/nfs/dbraw/zinc/94/73/83/699947383.db2.gz	MZKFFYHYVHAYNT-SWLSCSKDSA-N	1	1	316.361	1.772	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1	ZINC000751918868	700326518	/nfs/dbraw/zinc/32/65/18/700326518.db2.gz	IEXCISVKVAWYOC-SEYXRHQNSA-N	1	1	321.377	1.693	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@@H+]1C	ZINC000760158138	700794212	/nfs/dbraw/zinc/79/42/12/700794212.db2.gz	UOCVYJNVJPPZOF-LLVKDONJSA-N	1	1	316.361	1.781	20	5		DDBDMO
C[C@@H]1CN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)CC[N@H+]1C	ZINC000760158138	700794215	/nfs/dbraw/zinc/79/42/15/700794215.db2.gz	UOCVYJNVJPPZOF-LLVKDONJSA-N	1	1	316.361	1.781	20	5		DDBDMO
COc1cc(C[NH2+]C2(C(N)=O)CCCC2)c([N+](=O)[O-])cc1F	ZINC000766826354	701064309	/nfs/dbraw/zinc/06/43/09/701064309.db2.gz	LYQFUCWPIRYAEI-UHFFFAOYSA-N	1	1	311.313	1.630	20	5		DDBDMO
CC[C@H](CO)[NH+]1CCN(c2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000804522713	701197237	/nfs/dbraw/zinc/19/72/37/701197237.db2.gz	XOBHCCUJBKYPQA-LLVKDONJSA-N	1	1	324.337	1.396	20	5		DDBDMO
C[C@@H]1CN(C(=O)[C@](C)([NH3+])c2cccc([N+](=O)[O-])c2)[C@H](C)CO1	ZINC000867945024	701846553	/nfs/dbraw/zinc/84/65/53/701846553.db2.gz	OHMZJSURKUKOKP-UEKVPHQBSA-N	1	1	307.350	1.405	20	5		DDBDMO
C[C@]([NH3+])(C(=O)N1C[C@@H]2COC[C@@]2(C)C1)c1cccc([N+](=O)[O-])c1	ZINC000867985416	701874333	/nfs/dbraw/zinc/87/43/33/701874333.db2.gz	CPQVMESUOFVANX-DAXOMENPSA-N	1	1	319.361	1.264	20	5		DDBDMO
Cc1c(C(=O)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000812343192	702166108	/nfs/dbraw/zinc/16/61/08/702166108.db2.gz	OXPMNORUCOJSDQ-OLZOCXBDSA-N	1	1	303.362	1.927	20	5		DDBDMO
COC(=O)c1cnc(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1	ZINC000866206645	706648371	/nfs/dbraw/zinc/64/83/71/706648371.db2.gz	FDJOIRCKPAVCPR-CMPLNLGQSA-N	1	1	320.349	1.307	20	5		DDBDMO
C[N@H+]1CC[C@]2(CCN(c3nc4ccccn4c3[N+](=O)[O-])C2)C1	ZINC000813635637	702388114	/nfs/dbraw/zinc/38/81/14/702388114.db2.gz	AHDHBKLIAMWTCE-HNNXBMFYSA-N	1	1	301.350	1.775	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccc([N+](=O)[O-])c2nonc21	ZINC000842046638	702663133	/nfs/dbraw/zinc/66/31/33/702663133.db2.gz	FTNOBBLOPYTYCA-NXEZZACHSA-N	1	1	321.337	1.022	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(CC(=O)Nc3ccccc3[N+](=O)[O-])CC[C@@H]21	ZINC000879576440	706724864	/nfs/dbraw/zinc/72/48/64/706724864.db2.gz	SCGJMWIDCQPDKF-OCCSQVGLSA-N	1	1	318.377	1.559	20	5		DDBDMO
Nc1n[nH]c(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)n1	ZINC000852056985	703914031	/nfs/dbraw/zinc/91/40/31/703914031.db2.gz	UINJNAPNEKKKAB-UHFFFAOYSA-N	1	1	320.328	1.814	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H](NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)cc1	ZINC000871188497	704240815	/nfs/dbraw/zinc/24/08/15/704240815.db2.gz	QAKIADHBLYIWOI-RRFJBIMHSA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC000871188497	704240818	/nfs/dbraw/zinc/24/08/18/704240818.db2.gz	QAKIADHBLYIWOI-RRFJBIMHSA-N	1	1	303.362	1.351	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)cc1	ZINC000871188497	704240820	/nfs/dbraw/zinc/24/08/20/704240820.db2.gz	QAKIADHBLYIWOI-RRFJBIMHSA-N	1	1	303.362	1.351	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000853587963	704277524	/nfs/dbraw/zinc/27/75/24/704277524.db2.gz	OZXYYWZDBUJWDI-GHMZBOCLSA-N	1	1	319.317	1.429	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC[C@@H]2COC[C@H]2C1	ZINC000853587963	704277525	/nfs/dbraw/zinc/27/75/25/704277525.db2.gz	OZXYYWZDBUJWDI-GHMZBOCLSA-N	1	1	319.317	1.429	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000856073447	704512222	/nfs/dbraw/zinc/51/22/22/704512222.db2.gz	QACKRPOGOBSDBN-SECBINFHSA-N	1	1	310.329	1.530	20	5		DDBDMO
Nc1ncc2c(n1)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000857924166	704643126	/nfs/dbraw/zinc/64/31/26/704643126.db2.gz	SFRMREXCXFATIQ-CQSZACIVSA-N	1	1	315.333	1.059	20	5		DDBDMO
Nc1ncc2c(n1)C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000857924166	704643127	/nfs/dbraw/zinc/64/31/27/704643127.db2.gz	SFRMREXCXFATIQ-CQSZACIVSA-N	1	1	315.333	1.059	20	5		DDBDMO
CON(C)C(=O)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000858319415	704693893	/nfs/dbraw/zinc/69/38/93/704693893.db2.gz	JQXIINJQGOIPJP-QMMMGPOBSA-N	1	1	301.730	1.746	20	5		DDBDMO
COC(=O)CC[C@@H]([NH3+])c1nc(-c2ccc([N+](=O)[O-])cc2C)no1	ZINC000822808411	705045761	/nfs/dbraw/zinc/04/57/61/705045761.db2.gz	SQASKWHVTBSICF-LLVKDONJSA-N	1	1	320.305	1.906	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1COC(=O)c1ccc([N+](=O)[O-])n1C	ZINC000861033124	705353563	/nfs/dbraw/zinc/35/35/63/705353563.db2.gz	GOCCJCCNBWIVFG-NSHDSACASA-N	1	1	311.338	1.201	20	5		DDBDMO
COc1cc(C[N@@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000862544489	705729616	/nfs/dbraw/zinc/72/96/16/705729616.db2.gz	ABSHTYRPBLTCPQ-GHMZBOCLSA-N	1	1	322.317	1.217	20	5		DDBDMO
COc1cc(C[N@H+]2C[C@@H]3COC(=O)[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000862544489	705729618	/nfs/dbraw/zinc/72/96/18/705729618.db2.gz	ABSHTYRPBLTCPQ-GHMZBOCLSA-N	1	1	322.317	1.217	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000825791308	705731338	/nfs/dbraw/zinc/73/13/38/705731338.db2.gz	GDNNAJGYBRMXJC-CQSZACIVSA-N	1	1	307.350	1.182	20	5		DDBDMO
C[N@H+]1CC[C@H]2CN(C(=O)c3cc([N+](=O)[O-])ccc3F)CC[C@@H]21	ZINC000827269310	705964776	/nfs/dbraw/zinc/96/47/76/705964776.db2.gz	WQWOONNHLACERH-HZMBPMFUSA-N	1	1	307.325	1.900	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC[C@H]21	ZINC000827320514	705975069	/nfs/dbraw/zinc/97/50/69/705975069.db2.gz	RZBLQYDYIYZJMY-QMTHXVAHSA-N	1	1	307.325	1.900	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)C[C@](C)(O)c1ccccc1	ZINC000878728336	706482890	/nfs/dbraw/zinc/48/28/90/706482890.db2.gz	LTSVJDSDYLHBRT-INIZCTEOSA-N	1	1	318.377	1.939	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000880134673	706886159	/nfs/dbraw/zinc/88/61/59/706886159.db2.gz	OIYAJPRLQNJLJW-CABCVRRESA-N	1	1	318.377	1.702	20	5		DDBDMO
C[N@H+]1CCC[C@H]2[C@H]1CCN2Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000880134029	706886452	/nfs/dbraw/zinc/88/64/52/706886452.db2.gz	LIXPZBIFJYGJHD-KGLIPLIRSA-N	1	1	318.377	1.362	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1cccc(F)c1[N+](=O)[O-]	ZINC000867147791	706909066	/nfs/dbraw/zinc/90/90/66/706909066.db2.gz	OJTOCWCQVJXYPU-WDEREUQCSA-N	1	1	309.341	1.827	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880529352	707005831	/nfs/dbraw/zinc/00/58/31/707005831.db2.gz	ALMXZUWXDKTOLB-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)[C@@H]12	ZINC000880529352	707005833	/nfs/dbraw/zinc/00/58/33/707005833.db2.gz	ALMXZUWXDKTOLB-IUODEOHRSA-N	1	1	319.361	1.574	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(N2CC[C@@H]3[C@H]2CCC[N@H+]3CCO)c1	ZINC000897221631	708259554	/nfs/dbraw/zinc/25/95/54/708259554.db2.gz	NXPCAXCOMKJUPJ-ZIAGYGMSSA-N	1	1	305.378	1.939	20	5		DDBDMO
C[C@H]1C[N@@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1O	ZINC000897683210	708418832	/nfs/dbraw/zinc/41/88/32/708418832.db2.gz	ATSMIWYWIBSXOU-XHDPSFHLSA-N	1	1	316.361	1.808	20	5		DDBDMO
COC(=O)[C@H]1CSCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886249984	708725628	/nfs/dbraw/zinc/72/56/28/708725628.db2.gz	XWJCOPMFSWUMEB-LLVKDONJSA-N	1	1	311.363	1.328	20	5		DDBDMO
COC(=O)[C@H]1CSCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1	ZINC000886249984	708725630	/nfs/dbraw/zinc/72/56/30/708725630.db2.gz	XWJCOPMFSWUMEB-LLVKDONJSA-N	1	1	311.363	1.328	20	5		DDBDMO
CC(C)C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000886595686	708787120	/nfs/dbraw/zinc/78/71/20/708787120.db2.gz	NVOPJYFJSVWIAL-CYBMUJFWSA-N	1	1	306.366	1.792	20	5		DDBDMO
CC(C)C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000886595686	708787123	/nfs/dbraw/zinc/78/71/23/708787123.db2.gz	NVOPJYFJSVWIAL-CYBMUJFWSA-N	1	1	306.366	1.792	20	5		DDBDMO
Cn1cc(C[N@H+](C)CCc2ccc3c(c2)OCO3)c([N+](=O)[O-])n1	ZINC000887093933	708953315	/nfs/dbraw/zinc/95/33/15/708953315.db2.gz	ZYVKEPCAJADUFY-UHFFFAOYSA-N	1	1	318.333	1.732	20	5		DDBDMO
Cn1cc(C[N@@H+](C)CCc2ccc3c(c2)OCO3)c([N+](=O)[O-])n1	ZINC000887093933	708953317	/nfs/dbraw/zinc/95/33/17/708953317.db2.gz	ZYVKEPCAJADUFY-UHFFFAOYSA-N	1	1	318.333	1.732	20	5		DDBDMO
CNc1c(C(=O)N2C[C@@H]3C[N@@H+](C)C[C@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000887927929	709167612	/nfs/dbraw/zinc/16/76/12/709167612.db2.gz	OHUITSZRJZNWDY-MEDUHNTESA-N	1	1	318.377	1.660	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@]2(C)C1	ZINC000887930310	709168379	/nfs/dbraw/zinc/16/83/79/709168379.db2.gz	CHPRYASEVUXYQI-PBHICJAKSA-N	1	1	317.389	1.938	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)CNc2ccccc2[N+](=O)[O-])[C@H](C)C1	ZINC000910288165	709868452	/nfs/dbraw/zinc/86/84/52/709868452.db2.gz	NUBIMLHFIDMWIN-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
C[C@H]1C[NH+](C(C)(C)CNc2c([N+](=O)[O-])cnn2C)C[C@H](C)O1	ZINC000891652292	710257576	/nfs/dbraw/zinc/25/75/76/710257576.db2.gz	ICCRWTHMMCOUOR-QWRGUYRKSA-N	1	1	311.386	1.628	20	5		DDBDMO
C[N@H+]1CC[C@@]2(CCN(c3ccc4nonc4c3[N+](=O)[O-])C2)C1	ZINC000893964400	710903135	/nfs/dbraw/zinc/90/31/35/710903135.db2.gz	QMBBZVWBTSATTP-CQSZACIVSA-N	1	1	303.322	1.663	20	5		DDBDMO
C[N@@H+]1CC[C@@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000928564871	713229818	/nfs/dbraw/zinc/22/98/18/713229818.db2.gz	GFFVDLSLQCFZRW-CYBMUJFWSA-N	1	1	315.333	1.214	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000928564871	713229820	/nfs/dbraw/zinc/22/98/20/713229820.db2.gz	GFFVDLSLQCFZRW-CYBMUJFWSA-N	1	1	315.333	1.214	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@@H+]2C)cc1OC	ZINC000928566291	713230515	/nfs/dbraw/zinc/23/05/15/713230515.db2.gz	FBBMLUVUDNBELW-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC[N@H+]2C)cc1OC	ZINC000928566291	713230517	/nfs/dbraw/zinc/23/05/17/713230517.db2.gz	FBBMLUVUDNBELW-JTQLQIEISA-N	1	1	323.349	1.436	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000895709030	711584967	/nfs/dbraw/zinc/58/49/67/711584967.db2.gz	XWXIMQXMKJXXKP-DRDHIDPGSA-N	1	1	306.318	1.218	20	5		DDBDMO
COC(=O)[C@]1(O)CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000895709030	711584970	/nfs/dbraw/zinc/58/49/70/711584970.db2.gz	XWXIMQXMKJXXKP-DRDHIDPGSA-N	1	1	306.318	1.218	20	5		DDBDMO
O=C1C[C@@H]([NH2+]CC[N+](=O)[O-])CN1c1ccc(Cl)c(F)c1	ZINC000905189259	711963581	/nfs/dbraw/zinc/96/35/81/711963581.db2.gz	HDEZEZYMPNNPDD-MRVPVSSYSA-N	1	1	301.705	1.451	20	5		DDBDMO
COc1ccc(NC(=O)C2C[NH+]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-]	ZINC000907298832	712536656	/nfs/dbraw/zinc/53/66/56/712536656.db2.gz	IILCSSOBBNSQMG-GFCCVEGCSA-N	1	1	321.333	1.263	20	5		DDBDMO
O=C(NC1CC2(C1)CC([NH2+]CC1CCC1)C2)[C@@H]1CC1[N+](=O)[O-]	ZINC000963792305	717907882	/nfs/dbraw/zinc/90/78/82/717907882.db2.gz	WROBHMPZAROKMM-QAALLOGESA-N	1	1	307.394	1.469	20	5		DDBDMO
COc1ccc(OCCN2CCn3cc[nH+]c32)c([N+](=O)[O-])c1	ZINC000931526130	714119696	/nfs/dbraw/zinc/11/96/96/714119696.db2.gz	MLKFCSBXCNJMPD-UHFFFAOYSA-N	1	1	304.306	1.699	20	5		DDBDMO
COC1(OC)CC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C[C@H]1O	ZINC000931641422	714147644	/nfs/dbraw/zinc/14/76/44/714147644.db2.gz	FALIPGCRDOTEOH-SMDDNHRTSA-N	1	1	310.350	1.712	20	5		DDBDMO
C[C@H](c1ccccc1[N+](=O)[O-])N1CCN(C)CC[N@@H+](C)CC1	ZINC000933995525	714717415	/nfs/dbraw/zinc/71/74/15/714717415.db2.gz	DKHCHTIIZQWYNC-CQSZACIVSA-N	1	1	306.410	1.835	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000935429748	715053237	/nfs/dbraw/zinc/05/32/37/715053237.db2.gz	FJEUQCISPZCDKZ-CABCVRRESA-N	1	1	321.377	1.129	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](C)[N@H+](C)C[C@H]2C)n1	ZINC001164631981	719256761	/nfs/dbraw/zinc/25/67/61/719256761.db2.gz	GSTXIWXRZISQES-VHSXEESVSA-N	1	1	308.338	1.305	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N2C[C@H](C)[N@@H+](C)C[C@H]2C)n1	ZINC001164631981	719256764	/nfs/dbraw/zinc/25/67/64/719256764.db2.gz	GSTXIWXRZISQES-VHSXEESVSA-N	1	1	308.338	1.305	20	5		DDBDMO
COc1nc(N2CC[NH+](C[C@@H]3CCCO3)CC2)ccc1[N+](=O)[O-]	ZINC001165037417	721903957	/nfs/dbraw/zinc/90/39/57/721903957.db2.gz	GRYQFBVYUAHAOY-LBPRGKRZSA-N	1	1	322.365	1.299	20	5		DDBDMO
Cc1[nH+]c(N)ccc1CNc1ccc([N+](=O)[O-])c2c1CNC2=O	ZINC001167787793	738571057	/nfs/dbraw/zinc/57/10/57/738571057.db2.gz	IFMDSEIKMMYNAE-UHFFFAOYSA-N	1	1	313.317	1.736	20	5		DDBDMO
COc1cccc([N+](=O)[O-])c1N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC001120959084	782257584	/nfs/dbraw/zinc/25/75/84/782257584.db2.gz	FLZNAZYKKRXQIA-DGCLKSJQSA-N	1	1	308.382	1.650	20	5		DDBDMO
Cc1cc(C[NH2+][C@H]2C[C@@H](NC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c(C)s1	ZINC001022064498	734369086	/nfs/dbraw/zinc/36/90/86/734369086.db2.gz	HJMPVZHFRMERQI-XJFOESAGSA-N	1	1	323.418	1.767	20	5		DDBDMO
CC(C)[NH2+]Cc1nc2c(s1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])C2	ZINC001089275407	744852930	/nfs/dbraw/zinc/85/29/30/744852930.db2.gz	VANAYJMGDWSEAS-MWLCHTKSSA-N	1	1	324.406	1.191	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1	ZINC001192490997	745795422	/nfs/dbraw/zinc/79/54/22/745795422.db2.gz	XTNDZGZBUZBVPO-WDEREUQCSA-N	1	1	318.333	1.848	20	5		DDBDMO
CCN(CCNc1ccc([N+](=O)[O-])cn1)C(=O)CC[N@@H+](C)CC	ZINC001106841850	746452610	/nfs/dbraw/zinc/45/26/10/746452610.db2.gz	TXLKCRKMRNQZCG-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759128	747248340	/nfs/dbraw/zinc/24/83/40/747248340.db2.gz	NBKNNJQCOGSYSI-GXTWGEPZSA-N	1	1	322.365	1.022	20	5		DDBDMO
CNC(=O)N[C@H]1CCC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197759128	747248344	/nfs/dbraw/zinc/24/83/44/747248344.db2.gz	NBKNNJQCOGSYSI-GXTWGEPZSA-N	1	1	322.365	1.022	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCCC[C@@H]1[C@@H]1CCCO1	ZINC001198685207	747576721	/nfs/dbraw/zinc/57/67/21/747576721.db2.gz	HZUCEWJFBCCKJK-CABCVRRESA-N	1	1	321.377	1.790	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC([NH2+]Cc2ccccc2F)CC1	ZINC000996430040	749588777	/nfs/dbraw/zinc/58/87/77/749588777.db2.gz	YVGNLTGDGBHNQT-UKRRQHHQSA-N	1	1	321.352	1.572	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CC3)C2)CC1	ZINC001035186572	751262377	/nfs/dbraw/zinc/26/23/77/751262377.db2.gz	GHZMCHYNZPPLBH-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@H+](CC3CC3)C2)CC1	ZINC001035186572	751262380	/nfs/dbraw/zinc/26/23/80/751262380.db2.gz	GHZMCHYNZPPLBH-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(CC[N@@H+](CC3CC3)C2)CC1	ZINC001035186572	751262382	/nfs/dbraw/zinc/26/23/82/751262382.db2.gz	GHZMCHYNZPPLBH-ZIAGYGMSSA-N	1	1	307.394	1.376	20	5		DDBDMO
CC(C)=CC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC2	ZINC001035186947	751287565	/nfs/dbraw/zinc/28/75/65/751287565.db2.gz	MVSLMQPKSRBLKD-HUUCEWRRSA-N	1	1	321.421	1.932	20	5		DDBDMO
CC(C)=CC[N@@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035186947	751287569	/nfs/dbraw/zinc/28/75/69/751287569.db2.gz	MVSLMQPKSRBLKD-HUUCEWRRSA-N	1	1	321.421	1.932	20	5		DDBDMO
CC(C)=CC[N@H+]1CCC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2	ZINC001035186947	751287572	/nfs/dbraw/zinc/28/75/72/751287572.db2.gz	MVSLMQPKSRBLKD-HUUCEWRRSA-N	1	1	321.421	1.932	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007605	762175658	/nfs/dbraw/zinc/17/56/58/762175658.db2.gz	OMIMZTMCAYEEAZ-YTWAJWBKSA-N	1	1	314.279	1.769	20	5		DDBDMO
O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](F)C2)C1	ZINC001169007605	762175664	/nfs/dbraw/zinc/17/56/64/762175664.db2.gz	OMIMZTMCAYEEAZ-YTWAJWBKSA-N	1	1	314.279	1.769	20	5		DDBDMO
CCNC(=O)CO[C@@H]1CCC[N@H+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)C1	ZINC001169039938	762193641	/nfs/dbraw/zinc/19/36/41/762193641.db2.gz	WAXJDACLXJLFCZ-BFHYXJOUSA-N	1	1	313.398	1.049	20	5		DDBDMO
CN1CCN(C2CC[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)CC1	ZINC001169026323	762203186	/nfs/dbraw/zinc/20/31/86/762203186.db2.gz	KVKJFFNMTGJGMT-GDBMZVCRSA-N	1	1	310.442	1.144	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000829037758	759863301	/nfs/dbraw/zinc/86/33/01/759863301.db2.gz	JFKOHHXKLXJHJS-DOMZBBRYSA-N	1	1	320.393	1.267	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](C)[C@H]1C[N@@H+](C)CCN1C	ZINC000829037759	759864222	/nfs/dbraw/zinc/86/42/22/759864222.db2.gz	JFKOHHXKLXJHJS-IUODEOHRSA-N	1	1	320.393	1.267	20	5		DDBDMO
CN(C(=O)[C@@H]1CC1[N+](=O)[O-])C1C[NH+](CC2CC3(CCC3)C2)C1	ZINC001042711401	764379168	/nfs/dbraw/zinc/37/91/68/764379168.db2.gz	SJMHTBGZXWDLEV-ZIAGYGMSSA-N	1	1	307.394	1.375	20	5		DDBDMO
C[N@H+](CC(=O)NCCNCc1ccccc1[N+](=O)[O-])C1CCC1	ZINC001129532171	766919255	/nfs/dbraw/zinc/91/92/55/766919255.db2.gz	UAPVSYOUJFCZPN-UHFFFAOYSA-N	1	1	320.393	1.285	20	5		DDBDMO
C[N@@H+](CC(=O)NCCNCc1ccccc1[N+](=O)[O-])C1CCC1	ZINC001129532171	766919256	/nfs/dbraw/zinc/91/92/56/766919256.db2.gz	UAPVSYOUJFCZPN-UHFFFAOYSA-N	1	1	320.393	1.285	20	5		DDBDMO
Cc1cc(C(=O)NCC[NH2+]Cc2c([N+](=O)[O-])ncn2C)cs1	ZINC001135320741	771437886	/nfs/dbraw/zinc/43/78/86/771437886.db2.gz	FOIICATUBKHGTN-UHFFFAOYSA-N	1	1	323.378	1.218	20	5		DDBDMO
CC(C)CCC[N@H+]1CCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC001147505908	773155418	/nfs/dbraw/zinc/15/54/18/773155418.db2.gz	AKMFYASPRZEAFX-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)CCC[N@@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147505908	773155422	/nfs/dbraw/zinc/15/54/22/773155422.db2.gz	AKMFYASPRZEAFX-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CC(C)CCC[N@H+]1CCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC001147505908	773155426	/nfs/dbraw/zinc/15/54/26/773155426.db2.gz	AKMFYASPRZEAFX-ZIAGYGMSSA-N	1	1	309.410	1.622	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)NCCNc1ncccc1[N+](=O)[O-]	ZINC001093770714	775066954	/nfs/dbraw/zinc/06/69/54/775066954.db2.gz	FBFQWSSKIKRIOW-UHFFFAOYSA-N	1	1	309.370	1.250	20	5		DDBDMO
CC[N@@H+](C)C(C)(C)C(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094639982	776161424	/nfs/dbraw/zinc/16/14/24/776161424.db2.gz	LFLSXGHPOFYJGE-UHFFFAOYSA-N	1	1	323.397	1.638	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2C[C@H](C)[C@H](O)C2)c1F	ZINC001173181331	777035546	/nfs/dbraw/zinc/03/55/46/777035546.db2.gz	OQGPBRHMPRPQTN-OPQQBVKSSA-N	1	1	312.341	1.986	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC(=O)N2CCC[C@H]2C1	ZINC001173235330	777065297	/nfs/dbraw/zinc/06/52/97/777065297.db2.gz	WEURANYEBVCLFG-DOMZBBRYSA-N	1	1	303.362	1.832	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC(=O)N2CCC[C@H]2C1	ZINC001173235330	777065300	/nfs/dbraw/zinc/06/53/00/777065300.db2.gz	WEURANYEBVCLFG-DOMZBBRYSA-N	1	1	303.362	1.832	20	5		DDBDMO
O=C(NCCCCCC[NH2+]C/C=C/Cl)[C@@H]1CC1[N+](=O)[O-]	ZINC001178450197	779034960	/nfs/dbraw/zinc/03/49/60/779034960.db2.gz	XBOKYXLXZLHLPF-IEVRTODYSA-N	1	1	303.790	1.670	20	5		DDBDMO
COCC[N@@H+]1[C@H](C)CN(c2c(C)cncc2[N+](=O)[O-])C[C@@H]1C	ZINC001118125986	781038767	/nfs/dbraw/zinc/03/87/67/781038767.db2.gz	CTFRNBAFIBAYNS-BETUJISGSA-N	1	1	308.382	1.844	20	5		DDBDMO
O=C(NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)C(F)F	ZINC001266579261	836492007	/nfs/dbraw/zinc/49/20/07/836492007.db2.gz	KWNAYYBOLNNPAV-UHFFFAOYSA-N	1	1	313.304	1.941	20	5		DDBDMO
Cc1ccc(F)cc1C[N@H+](C)CCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001272013746	844320188	/nfs/dbraw/zinc/32/01/88/844320188.db2.gz	SHWDMXUQUBZLQU-HUUCEWRRSA-N	1	1	323.368	1.690	20	5		DDBDMO
Cc1ccc(F)cc1C[N@@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001272013746	844320201	/nfs/dbraw/zinc/32/02/01/844320201.db2.gz	SHWDMXUQUBZLQU-HUUCEWRRSA-N	1	1	323.368	1.690	20	5		DDBDMO
Cc1ccc(F)cc1C[N@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC001272013746	844320212	/nfs/dbraw/zinc/32/02/12/844320212.db2.gz	SHWDMXUQUBZLQU-HUUCEWRRSA-N	1	1	323.368	1.690	20	5		DDBDMO
Cc1ccc(C)c(C[NH2+]CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])c1	ZINC001276002227	854128627	/nfs/dbraw/zinc/12/86/27/854128627.db2.gz	OSOLIADWPCRHFQ-HZPDHXFCSA-N	1	1	319.405	1.907	20	5		DDBDMO
O=[N+]([O-])C[C@@H](OC[C@H]1C[N@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961844	881612620	/nfs/dbraw/zinc/61/26/20/881612620.db2.gz	SBEBDIARCKVSJI-IAGOWNOFSA-N	1	1	320.389	1.959	20	5		DDBDMO
O=[N+]([O-])C[C@@H](OC[C@H]1C[N@@H+](Cc2ccccc2)CCO1)C1CC1	ZINC001224961844	881612625	/nfs/dbraw/zinc/61/26/25/881612625.db2.gz	SBEBDIARCKVSJI-IAGOWNOFSA-N	1	1	320.389	1.959	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N)[nH+]c2C)n1	ZINC001156986269	863500467	/nfs/dbraw/zinc/50/04/67/863500467.db2.gz	UNAGVNTXPCHTGX-UHFFFAOYSA-N	1	1	317.305	1.674	20	5		DDBDMO
CCC(CO)(CO)Nc1cc(/C=C/[NH+](C)C)c([N+](=O)[O-])cn1	ZINC001157199432	863649350	/nfs/dbraw/zinc/64/93/50/863649350.db2.gz	OMFQNKNLACDIGK-AATRIKPKSA-N	1	1	310.354	1.067	20	5		DDBDMO
O=C(NCCC[NH2+]Cc1ccc(F)cc1F)[C@@H]1CC1[N+](=O)[O-]	ZINC001157761124	864111157	/nfs/dbraw/zinc/11/11/57/864111157.db2.gz	NQWYOVYWPVCNLT-DGCLKSJQSA-N	1	1	313.304	1.226	20	5		DDBDMO
C[N@@H+](CCCCCF)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1	ZINC001331017153	864778305	/nfs/dbraw/zinc/77/83/05/864778305.db2.gz	VKUAYQNUAMXYGO-ZIAGYGMSSA-N	1	1	315.389	1.714	20	5		DDBDMO
C[N@H+](CCCCCF)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001331017153	864778314	/nfs/dbraw/zinc/77/83/14/864778314.db2.gz	VKUAYQNUAMXYGO-ZIAGYGMSSA-N	1	1	315.389	1.714	20	5		DDBDMO
C[N@@H+](CCCCCF)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1	ZINC001331017153	864778326	/nfs/dbraw/zinc/77/83/26/864778326.db2.gz	VKUAYQNUAMXYGO-ZIAGYGMSSA-N	1	1	315.389	1.714	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cnc1NCC(C)(C)[NH+]1CCN(C)CC1	ZINC001319856124	866347905	/nfs/dbraw/zinc/34/79/05/866347905.db2.gz	NNXDGNXBAAKUNU-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(CNC(=O)CC2CCC2)CC1	ZINC001323411701	866595895	/nfs/dbraw/zinc/59/58/95/866595895.db2.gz	MGZLRKONZXDQQI-UHFFFAOYSA-N	1	1	321.381	1.257	20	5		DDBDMO
Cc1nn(CN2C[C@@H]3CC[C@@H]([NH+](C)C)C[C@H]3C2)cc1[N+](=O)[O-]	ZINC001334748333	867808986	/nfs/dbraw/zinc/80/89/86/867808986.db2.gz	OSEVXSJYWMIWHO-MELADBBJSA-N	1	1	307.398	1.719	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2c(C)cncc2[N+](=O)[O-])CC1	ZINC001325566062	868142205	/nfs/dbraw/zinc/14/22/05/868142205.db2.gz	VLSYXFSUPHWFSN-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
Cc1cccc(N2CCN(c3ncc([N+](=O)[O-])c(C)n3)CC2)[nH+]1	ZINC001163668252	868611502	/nfs/dbraw/zinc/61/15/02/868611502.db2.gz	QABSVABSYDPSRL-UHFFFAOYSA-N	1	1	314.349	1.723	20	5		DDBDMO
Cc1cncc([N+](=O)[O-])c1N[C@H]1CCC[N@H+]2CCSC[C@H]12	ZINC001336836579	869173979	/nfs/dbraw/zinc/17/39/79/869173979.db2.gz	IOTRVKKINRNRJA-WCQYABFASA-N	1	1	308.407	1.712	20	5		DDBDMO
C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC001337536870	869530091	/nfs/dbraw/zinc/53/00/91/869530091.db2.gz	YJEZRZSZXVNQQA-SNVBAGLBSA-N	1	1	321.333	1.538	20	5		DDBDMO
CC(C)[N@@H+](C)CC1CCN(c2nnc(C[N+](=O)[O-])n2C)CC1	ZINC001339555398	870551581	/nfs/dbraw/zinc/55/15/81/870551581.db2.gz	VNPQWIYFOHQRNH-UHFFFAOYSA-N	1	1	310.402	1.148	20	5		DDBDMO
CC[N@H+]1CCCN(c2nnc([C@H](C)[N+](=O)[O-])n2CC(C)C)CC1	ZINC001342909967	872433832	/nfs/dbraw/zinc/43/38/32/872433832.db2.gz	RVOONFGEHGRVKL-ZDUSSCGKSA-N	1	1	324.429	1.804	20	5		DDBDMO
C[NH+](C)C1(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCOCC1	ZINC001356594703	879118634	/nfs/dbraw/zinc/11/86/34/879118634.db2.gz	DPLDQXJOBMFSMP-OAHLLOKOSA-N	1	1	323.393	1.329	20	5		DDBDMO
CC[N@H+]1CC[C@H](OCc2c(C(=O)OC)cccc2[N+](=O)[O-])C1	ZINC001222773193	880692174	/nfs/dbraw/zinc/69/21/74/880692174.db2.gz	IJHJJMAVWWEDCR-NSHDSACASA-N	1	1	308.334	1.992	20	5		DDBDMO
C[N@@H+](CCCNC(=O)c1ccn[nH]1)Cc1ccc([N+](=O)[O-])cc1	ZINC001234244437	887785823	/nfs/dbraw/zinc/78/58/23/887785823.db2.gz	ROIOIJMICICCTR-UHFFFAOYSA-N	1	1	317.349	1.570	20	5		DDBDMO
C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CCNC2(CC[NH2+]CC2)C1	ZINC001246594614	892719316	/nfs/dbraw/zinc/71/93/16/892719316.db2.gz	KFIOQPSMWNEITA-CQSZACIVSA-N	1	1	318.421	1.553	20	5		DDBDMO
N[C@]12CC[C@@H]1C[N@@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865056	892954025	/nfs/dbraw/zinc/95/40/25/892954025.db2.gz	XVZNMKRVJWRGNR-DYVFJYSZSA-N	1	1	316.405	1.987	20	5		DDBDMO
N[C@]12CC[C@@H]1C[N@H+](C1CCN(c3ccc([N+](=O)[O-])cc3)CC1)C2	ZINC001246865056	892954037	/nfs/dbraw/zinc/95/40/37/892954037.db2.gz	XVZNMKRVJWRGNR-DYVFJYSZSA-N	1	1	316.405	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@](F)(CO)C3)CC2)cc1	ZINC001254476367	896455909	/nfs/dbraw/zinc/45/59/09/896455909.db2.gz	ONZYRJKUTMTQTC-MRXNPFEDSA-N	1	1	323.368	1.970	20	5		DDBDMO
COc1cc(C(=O)NCC[NH+]2CC=CC2)cc([N+](=O)[O-])c1C	ZINC001255741297	897101499	/nfs/dbraw/zinc/10/14/99/897101499.db2.gz	MTRSUYYYGLYWON-UHFFFAOYSA-N	1	1	305.334	1.513	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)NCc3ccccc3[N+](=O)[O-])[C@@H]2C1	ZINC001263074192	900482088	/nfs/dbraw/zinc/48/20/88/900482088.db2.gz	ZQSAPGJGYPWFFI-BFHYXJOUSA-N	1	1	318.377	1.734	20	5		DDBDMO
C[C@H](CO)[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H](C)O	ZINC000248926102	282118691	/nfs/dbraw/zinc/11/86/91/282118691.db2.gz	LQDZHFBZMBREHV-ZJUUUORDSA-N	1	1	302.758	1.812	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](C)[C@@H]1CO	ZINC000249008422	282127061	/nfs/dbraw/zinc/12/70/61/282127061.db2.gz	ZWDVSFFSCBOUHW-GWCFXTLKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]1CO	ZINC000249008422	282127066	/nfs/dbraw/zinc/12/70/66/282127066.db2.gz	ZWDVSFFSCBOUHW-GWCFXTLKSA-N	1	1	323.349	1.245	20	5		DDBDMO
COc1cc(C[N@@H+]2CC[C@@H](n3cncn3)C2)ccc1[N+](=O)[O-]	ZINC000614420174	361846332	/nfs/dbraw/zinc/84/63/32/361846332.db2.gz	OJQPNXHSUAWEDE-GFCCVEGCSA-N	1	1	303.322	1.642	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](n3cncn3)C2)ccc1[N+](=O)[O-]	ZINC000614420174	361846333	/nfs/dbraw/zinc/84/63/33/361846333.db2.gz	OJQPNXHSUAWEDE-GFCCVEGCSA-N	1	1	303.322	1.642	20	5		DDBDMO
CC[C@]1(O)CC[N@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000495215048	529441549	/nfs/dbraw/zinc/44/15/49/529441549.db2.gz	ZLMZQURYLNHDEO-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[C@]1(O)CC[N@@H+](CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1	ZINC000495215048	529441551	/nfs/dbraw/zinc/44/15/51/529441551.db2.gz	ZLMZQURYLNHDEO-HNNXBMFYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[C@@H]1[C@H](CO)CC[N@H+]1C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000451263369	529485612	/nfs/dbraw/zinc/48/56/12/529485612.db2.gz	YUTPSTXYJUQYIG-BFHYXJOUSA-N	1	1	324.377	1.427	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000495198954	529573149	/nfs/dbraw/zinc/57/31/49/529573149.db2.gz	DSXBYXUOQIFNCY-OAHLLOKOSA-N	1	1	307.350	1.404	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000495198954	529573151	/nfs/dbraw/zinc/57/31/51/529573151.db2.gz	DSXBYXUOQIFNCY-OAHLLOKOSA-N	1	1	307.350	1.404	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@@H]1CCC[C@H]1O	ZINC000286654069	219105508	/nfs/dbraw/zinc/10/55/08/219105508.db2.gz	UHYODYGAFIUJQW-LERXQTSPSA-N	1	1	307.350	1.767	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1-c1noc([C@@H]2CCCc3[nH+]ccn32)n1	ZINC000354169978	290932670	/nfs/dbraw/zinc/93/26/70/290932670.db2.gz	PTDWDAKBPDQRQO-QMMMGPOBSA-N	1	1	315.293	1.501	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(N)=O)CC1	ZINC000021847101	352174830	/nfs/dbraw/zinc/17/48/30/352174830.db2.gz	HVYOXLOCOZGBIB-SNVBAGLBSA-N	1	1	320.349	1.119	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000025579734	352198919	/nfs/dbraw/zinc/19/89/19/352198919.db2.gz	PEEXVAMREACEDD-UHFFFAOYSA-N	1	1	310.329	1.356	20	5		DDBDMO
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CC2)CC1	ZINC000491307408	234129875	/nfs/dbraw/zinc/12/98/75/234129875.db2.gz	VIIYCXFASDCTMB-BAQGIRSFSA-N	1	1	301.346	1.915	20	5		DDBDMO
COC1CC[NH+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)CC1	ZINC000067376135	353045867	/nfs/dbraw/zinc/04/58/67/353045867.db2.gz	CZZIAJKDQQDQED-OAHLLOKOSA-N	1	1	319.361	1.811	20	5		DDBDMO
CC[N@@H+](C)CCNS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000068960639	353138869	/nfs/dbraw/zinc/13/88/69/353138869.db2.gz	XFJFEIBDYPXOLO-UHFFFAOYSA-N	1	1	301.368	1.133	20	5		DDBDMO
COc1ccc(CC(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-]	ZINC000069397347	353160257	/nfs/dbraw/zinc/16/02/57/353160257.db2.gz	XHXSNAHXZAJCCI-GFCCVEGCSA-N	1	1	319.361	1.499	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000069528740	353165662	/nfs/dbraw/zinc/16/56/62/353165662.db2.gz	BBBAJQHDBJYMDE-AWEZNQCLSA-N	1	1	321.377	1.364	20	5		DDBDMO
C[C@](O)(CNc1ccc([N+](=O)[O-])cc1F)C[NH+]1CCOCC1	ZINC000078343486	353512172	/nfs/dbraw/zinc/51/21/72/353512172.db2.gz	PFJQVHWVPHHMEY-AWEZNQCLSA-N	1	1	313.329	1.229	20	5		DDBDMO
COC[C@](C)(CCO)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1	ZINC000085904227	353738837	/nfs/dbraw/zinc/73/88/37/353738837.db2.gz	OAAGWLVZKSRKEG-AWEZNQCLSA-N	1	1	309.322	1.613	20	5		DDBDMO
COc1cc(N2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1[N+](=O)[O-]	ZINC000114007398	353978784	/nfs/dbraw/zinc/97/87/84/353978784.db2.gz	QXXYHGJJGSTCOW-CQSZACIVSA-N	1	1	321.377	1.639	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000142252833	354143883	/nfs/dbraw/zinc/14/38/83/354143883.db2.gz	TZBVPRAAJYYMKP-CYBMUJFWSA-N	1	1	319.361	1.670	20	5		DDBDMO
Cc1[nH+]ccn1CCNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000210014549	354309445	/nfs/dbraw/zinc/30/94/45/354309445.db2.gz	SPGJYDLJNXIZCR-DAXSKMNVSA-N	1	1	300.318	1.929	20	5		DDBDMO
C[C@@H]1C[C@H]([NH3+])CCN1C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000237411695	354341807	/nfs/dbraw/zinc/34/18/07/354341807.db2.gz	ZSGAGBBGMRRYHH-RKDXNWHRSA-N	1	1	303.322	1.423	20	5		DDBDMO
C[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H](O)C1CC1	ZINC000305238628	354469952	/nfs/dbraw/zinc/46/99/52/354469952.db2.gz	OZXJITONZSZEMT-OAHLLOKOSA-N	1	1	319.361	1.187	20	5		DDBDMO
C[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C[C@@H](O)C1CC1	ZINC000305238628	354469957	/nfs/dbraw/zinc/46/99/57/354469957.db2.gz	OZXJITONZSZEMT-OAHLLOKOSA-N	1	1	319.361	1.187	20	5		DDBDMO
O=C1CC[C@@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@H]2N1	ZINC000320069206	354524813	/nfs/dbraw/zinc/52/48/13/354524813.db2.gz	KAMSHELKFOBSKW-BXUZGUMPSA-N	1	1	307.325	1.834	20	5		DDBDMO
O=C1CC[C@@H]2C[N@@H+](Cc3ccc([N+](=O)[O-])cc3F)CC[C@H]2N1	ZINC000320069206	354524816	/nfs/dbraw/zinc/52/48/16/354524816.db2.gz	KAMSHELKFOBSKW-BXUZGUMPSA-N	1	1	307.325	1.834	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]([N@H+]2CC[C@@H](O)C2)C1	ZINC000588862582	354944141	/nfs/dbraw/zinc/94/41/41/354944141.db2.gz	GNUWJJLRWMGECZ-UONOGXRCSA-N	1	1	319.361	1.184	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](O)[C@@H](C)C2)c1	ZINC000589514770	354998832	/nfs/dbraw/zinc/99/88/32/354998832.db2.gz	LNSYVYHLUHZHFD-HZMBPMFUSA-N	1	1	308.334	1.584	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](O)[C@@H](C)C2)c1	ZINC000589514770	354998835	/nfs/dbraw/zinc/99/88/35/354998835.db2.gz	LNSYVYHLUHZHFD-HZMBPMFUSA-N	1	1	308.334	1.584	20	5		DDBDMO
C[N@H+]1C[C@H]2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3F)[C@@H]2C1	ZINC000589941437	355033699	/nfs/dbraw/zinc/03/36/99/355033699.db2.gz	INYUWYGNPWEOTJ-NOZJJQNGSA-N	1	1	308.313	1.902	20	5		DDBDMO
COc1ccc(CC(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-]	ZINC000590044225	355042615	/nfs/dbraw/zinc/04/26/15/355042615.db2.gz	ISKOCPSNGZIHLT-TZMCWYRMSA-N	1	1	319.361	1.308	20	5		DDBDMO
COC(=O)c1ccnc(N[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000590582630	355120155	/nfs/dbraw/zinc/12/01/55/355120155.db2.gz	BAINTBFDLMFLAY-JTQLQIEISA-N	1	1	308.338	1.671	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)c1	ZINC000590442950	355097519	/nfs/dbraw/zinc/09/75/19/355097519.db2.gz	IGLRAPYLOKYOIF-QMTHXVAHSA-N	1	1	305.334	1.380	20	5		DDBDMO
O=[N+]([O-])c1cnc(N2CC[NH+]([C@H]3CCC[C@H]3O)CC2)c(F)c1	ZINC000591144262	355253912	/nfs/dbraw/zinc/25/39/12/355253912.db2.gz	BVWRVCXXLKFITN-QWHCGFSZSA-N	1	1	310.329	1.164	20	5		DDBDMO
Cc1cnc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000591744917	355376524	/nfs/dbraw/zinc/37/65/24/355376524.db2.gz	OABUIASOISNUBE-LBPRGKRZSA-N	1	1	323.374	1.889	20	5		DDBDMO
COC(=O)[C@@H]1C[C@@H](O)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000592205583	355536847	/nfs/dbraw/zinc/53/68/47/355536847.db2.gz	DBOWGBVAMPIWTL-MPKXVKKWSA-N	1	1	308.334	1.512	20	5		DDBDMO
CC[C@@H]1CN(CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@@H]1[NH3+]	ZINC000592489677	355598370	/nfs/dbraw/zinc/59/83/70/355598370.db2.gz	ZMKOUBPUZMGZFT-OLZOCXBDSA-N	1	1	320.393	1.983	20	5		DDBDMO
CC[N@@H+](C)C[C@@H](O)COc1ccc(C(=O)OC)c([N+](=O)[O-])c1	ZINC000594571495	356252648	/nfs/dbraw/zinc/25/26/48/356252648.db2.gz	HRDPKWLDIQWLGV-SNVBAGLBSA-N	1	1	312.322	1.073	20	5		DDBDMO
Cc1noc(CN2CC[NH+](C[C@H]3CCCO3)CC2)c1[N+](=O)[O-]	ZINC000595288133	356433977	/nfs/dbraw/zinc/43/39/77/356433977.db2.gz	JZUMXEOKOLNCJJ-GFCCVEGCSA-N	1	1	310.354	1.188	20	5		DDBDMO
C[C@H]1CN(CC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421671	356485346	/nfs/dbraw/zinc/48/53/46/356485346.db2.gz	AHJRNGNZACRKRO-STQMWFEESA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@H]1CN(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421671	356485349	/nfs/dbraw/zinc/48/53/49/356485349.db2.gz	AHJRNGNZACRKRO-STQMWFEESA-N	1	1	320.393	1.457	20	5		DDBDMO
C[C@H]1C[NH+](CCN2CCc3ncc([N+](=O)[O-])cc3C2)C[C@H](C)O1	ZINC000595421671	356485354	/nfs/dbraw/zinc/48/53/54/356485354.db2.gz	AHJRNGNZACRKRO-STQMWFEESA-N	1	1	320.393	1.457	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@@H](Cn2ccnn2)C1	ZINC000595608844	356575709	/nfs/dbraw/zinc/57/57/09/356575709.db2.gz	XJRAZMVJFXZACX-CYBMUJFWSA-N	1	1	317.349	1.587	20	5		DDBDMO
COc1ccc(OCC[N@H+]2CCC[C@@H]2[C@@H](C)O)c([N+](=O)[O-])c1	ZINC000595766524	356643940	/nfs/dbraw/zinc/64/39/40/356643940.db2.gz	OPCYQTCGDIKFMT-DGCLKSJQSA-N	1	1	310.350	1.827	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595766831	356644147	/nfs/dbraw/zinc/64/41/47/356644147.db2.gz	RSELMDFXVOYNNE-SMDDNHRTSA-N	1	1	307.350	1.687	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1[C@H](C)O	ZINC000595766831	356644149	/nfs/dbraw/zinc/64/41/49/356644149.db2.gz	RSELMDFXVOYNNE-SMDDNHRTSA-N	1	1	307.350	1.687	20	5		DDBDMO
N[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC[C@H]1F	ZINC000595907132	356701080	/nfs/dbraw/zinc/70/10/80/356701080.db2.gz	QVYDKBZJNPHLHL-GHMZBOCLSA-N	1	1	310.329	1.295	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000596166795	356799497	/nfs/dbraw/zinc/79/94/97/356799497.db2.gz	WQOGNJRHMGBWAQ-RISCZKNCSA-N	1	1	318.377	1.614	20	5		DDBDMO
Cc1[nH+]ccn1CCCN(C)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596169612	356800081	/nfs/dbraw/zinc/80/00/81/356800081.db2.gz	JCSAKPSNQXTHGM-UHFFFAOYSA-N	1	1	317.349	1.725	20	5		DDBDMO
CCOc1cc(C[N@@H+]2CCC[C@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000276914496	213171933	/nfs/dbraw/zinc/17/19/33/213171933.db2.gz	NZIQTFHEEREXCG-AWEZNQCLSA-N	1	1	324.377	1.967	20	5		DDBDMO
CCOc1cc(C[N@H+]2CCC[C@H](OCCO)C2)ccc1[N+](=O)[O-]	ZINC000276914496	213171936	/nfs/dbraw/zinc/17/19/36/213171936.db2.gz	NZIQTFHEEREXCG-AWEZNQCLSA-N	1	1	324.377	1.967	20	5		DDBDMO
Cn1c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)ccc1[N+](=O)[O-]	ZINC000597574948	357234041	/nfs/dbraw/zinc/23/40/41/357234041.db2.gz	JEJUEPKJRNKHDZ-QWRGUYRKSA-N	1	1	310.329	1.192	20	5		DDBDMO
CCC[N@H+]1CC[C@@H](NC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000598342483	357545757	/nfs/dbraw/zinc/54/57/57/357545757.db2.gz	JBUZRGUUVCDAOP-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
O=[N+]([O-])c1ccc2ccnc(NCC[N@@H+]3CC[C@@H](O)C3)c2c1	ZINC000599175713	357840589	/nfs/dbraw/zinc/84/05/89/357840589.db2.gz	IZONVQPXFMCKKW-CYBMUJFWSA-N	1	1	302.334	1.622	20	5		DDBDMO
CC(=O)NC[C@@H]1CCCC[N@H+]1CCOc1cccc([N+](=O)[O-])c1	ZINC000599704193	358033471	/nfs/dbraw/zinc/03/34/71/358033471.db2.gz	QKGOGXSPNJXWMT-HNNXBMFYSA-N	1	1	321.377	1.964	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)NC[C@@H]2CCCC[N@@H+](C)C2)c1[N+](=O)[O-]	ZINC000600312319	358191983	/nfs/dbraw/zinc/19/19/83/358191983.db2.gz	DZZYAYVHDKHJBU-NSHDSACASA-N	1	1	323.397	1.903	20	5		DDBDMO
O=C(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cn1	ZINC000600473127	358234346	/nfs/dbraw/zinc/23/43/46/358234346.db2.gz	RFDADZSXFJXQNO-GFCCVEGCSA-N	1	1	304.350	1.737	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H]([C@H](C)O)C2)c([N+](=O)[O-])cc1OC	ZINC000180860869	199220349	/nfs/dbraw/zinc/22/03/49/199220349.db2.gz	RFYHUUHNTCHBKA-WDEREUQCSA-N	1	1	310.350	1.815	20	5		DDBDMO
Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1c(N)cccc1[N+](=O)[O-]	ZINC000180953257	199232784	/nfs/dbraw/zinc/23/27/84/199232784.db2.gz	NJLQXKIIBHPWMC-SNVBAGLBSA-N	1	1	317.349	1.748	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH+]ccc(N3CC[C@@H](O)[C@H](CO)C3)c2c1	ZINC000601175514	358433930	/nfs/dbraw/zinc/43/39/30/358433930.db2.gz	ICHDYARWBKHATG-ZUZCIYMTSA-N	1	1	303.318	1.323	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601975550	358762203	/nfs/dbraw/zinc/76/22/03/358762203.db2.gz	XSLRCYNSONMJDR-PHIMTYICSA-N	1	1	321.333	1.120	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000601975550	358762207	/nfs/dbraw/zinc/76/22/07/358762207.db2.gz	XSLRCYNSONMJDR-PHIMTYICSA-N	1	1	321.333	1.120	20	5		DDBDMO
Cn1cc(C[N@H+]2CC[C@](CO)(c3ccccc3)C2)c([N+](=O)[O-])n1	ZINC000602677053	359120381	/nfs/dbraw/zinc/12/03/81/359120381.db2.gz	QBJOOQCDYNOQLH-INIZCTEOSA-N	1	1	316.361	1.464	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(CNCCN3CCCOCC3)nc2c1	ZINC000602662356	359109654	/nfs/dbraw/zinc/10/96/54/359109654.db2.gz	MFIAJILYXXOHBD-UHFFFAOYSA-N	1	1	320.349	1.548	20	5		DDBDMO
CCN(C#N)CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602794249	359196381	/nfs/dbraw/zinc/19/63/81/359196381.db2.gz	MXPQUBDBFFMNIN-GFCCVEGCSA-N	1	1	304.354	1.279	20	5		DDBDMO
CCN(C#N)CC[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000602794249	359196385	/nfs/dbraw/zinc/19/63/85/359196385.db2.gz	MXPQUBDBFFMNIN-GFCCVEGCSA-N	1	1	304.354	1.279	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000187259699	200085002	/nfs/dbraw/zinc/08/50/02/200085002.db2.gz	UXDZFZLGJBRBKF-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1cc(C(=O)N2CC[N@@H+](CCO)[C@@H](C)C2)ccc1[N+](=O)[O-]	ZINC000187259699	200085004	/nfs/dbraw/zinc/08/50/04/200085004.db2.gz	UXDZFZLGJBRBKF-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[N@@H+](C)C1	ZINC000604278138	359732371	/nfs/dbraw/zinc/73/23/71/359732371.db2.gz	JXKPDZXSASKZFK-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCC[N@H+](C)C1	ZINC000604278138	359732376	/nfs/dbraw/zinc/73/23/76/359732376.db2.gz	JXKPDZXSASKZFK-LLVKDONJSA-N	1	1	313.379	1.276	20	5		DDBDMO
COc1ccc(CNC(=O)N[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000604290929	359733208	/nfs/dbraw/zinc/73/32/08/359733208.db2.gz	QWKPTCCSHRUJMQ-LBPRGKRZSA-N	1	1	322.365	1.497	20	5		DDBDMO
C[N@@H+]1CCC[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000604532825	359762066	/nfs/dbraw/zinc/76/20/66/359762066.db2.gz	NPZHTUREJKGCAC-LBPRGKRZSA-N	1	1	307.350	1.550	20	5		DDBDMO
C[N@H+]1CCC[C@H](NCc2cc3c(cc2[N+](=O)[O-])OCCO3)C1	ZINC000604532825	359762069	/nfs/dbraw/zinc/76/20/69/359762069.db2.gz	NPZHTUREJKGCAC-LBPRGKRZSA-N	1	1	307.350	1.550	20	5		DDBDMO
CC[N@@H+](C)C[C@@H]1CCN(c2nc(C(=O)OC)ccc2[N+](=O)[O-])C1	ZINC000281176142	216132079	/nfs/dbraw/zinc/13/20/79/216132079.db2.gz	NAVZAMYOXSSOHO-NSHDSACASA-N	1	1	322.365	1.554	20	5		DDBDMO
COc1cc(CN[C@@H]2CCC[N@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000608782073	360241956	/nfs/dbraw/zinc/24/19/56/360241956.db2.gz	SCKUNFSSKSTSMS-GFCCVEGCSA-N	1	1	309.366	1.796	20	5		DDBDMO
COc1cc(CN[C@@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])cc1OC	ZINC000608782073	360241959	/nfs/dbraw/zinc/24/19/59/360241959.db2.gz	SCKUNFSSKSTSMS-GFCCVEGCSA-N	1	1	309.366	1.796	20	5		DDBDMO
O=C(NCc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000609399947	360304636	/nfs/dbraw/zinc/30/46/36/360304636.db2.gz	WQHFQAPPSRXFHA-CQSZACIVSA-N	1	1	318.377	1.878	20	5		DDBDMO
C[N@H+]1CCC[C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1	ZINC000609257952	360276995	/nfs/dbraw/zinc/27/69/95/360276995.db2.gz	XMJKJWLLMUPOQT-GFCCVEGCSA-N	1	1	307.350	1.574	20	5		DDBDMO
CC[N@H+]1CCN(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611087362	360618326	/nfs/dbraw/zinc/61/83/26/360618326.db2.gz	BOJVPDDJSCYCCG-LBPRGKRZSA-N	1	1	321.377	1.699	20	5		DDBDMO
CC[N@H+]1CCN([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000611092124	360621407	/nfs/dbraw/zinc/62/14/07/360621407.db2.gz	JFIFQSJQYSRZOS-STQMWFEESA-N	1	1	320.393	1.948	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000611512045	360742600	/nfs/dbraw/zinc/74/26/00/360742600.db2.gz	YACOOVGFGPIIHO-SNVBAGLBSA-N	1	1	319.317	1.290	20	5		DDBDMO
COc1ccc(NC(=O)N[C@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000611826383	360836566	/nfs/dbraw/zinc/83/65/66/360836566.db2.gz	HLKOQLWWOSHWHQ-NSHDSACASA-N	1	1	308.338	1.819	20	5		DDBDMO
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]Cc1cn(C)nn1	ZINC000611973561	360877512	/nfs/dbraw/zinc/87/75/12/360877512.db2.gz	RFMLZPGJZYNLNE-SNVBAGLBSA-N	1	1	318.337	1.230	20	5		DDBDMO
COCC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCOC1	ZINC000618779146	363757934	/nfs/dbraw/zinc/75/79/34/363757934.db2.gz	KELIDDGMPUWDBO-GFCCVEGCSA-N	1	1	321.333	1.973	20	5		DDBDMO
COCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCOC1	ZINC000618779146	363757941	/nfs/dbraw/zinc/75/79/41/363757941.db2.gz	KELIDDGMPUWDBO-GFCCVEGCSA-N	1	1	321.333	1.973	20	5		DDBDMO
C[N@H+](CCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000281581663	216398676	/nfs/dbraw/zinc/39/86/76/216398676.db2.gz	DYFJHAPFJBGQAX-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
C[N@@H+](CCCO)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000281581663	216398679	/nfs/dbraw/zinc/39/86/79/216398679.db2.gz	DYFJHAPFJBGQAX-UHFFFAOYSA-N	1	1	301.730	1.501	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1	ZINC000619252435	363945373	/nfs/dbraw/zinc/94/53/73/363945373.db2.gz	LLOSIYFJQIKRRX-CABCVRRESA-N	1	1	321.352	1.782	20	5		DDBDMO
O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H]1CC[N@H+](C2CC2)C1	ZINC000359224452	299364034	/nfs/dbraw/zinc/36/40/34/299364034.db2.gz	IKCVZFYGXOTTEJ-GFCCVEGCSA-N	1	1	304.350	1.631	20	5		DDBDMO
CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1[nH]nc(C)c1[N+](=O)[O-]	ZINC000265032561	204356184	/nfs/dbraw/zinc/35/61/84/204356184.db2.gz	XOXVZKJKCPBUIV-LLVKDONJSA-N	1	1	309.370	1.621	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1CO	ZINC000265463895	204631924	/nfs/dbraw/zinc/63/19/24/204631924.db2.gz	HIAICKZNCACTHS-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCS(=O)(=O)C1	ZINC000282557537	217086604	/nfs/dbraw/zinc/08/66/04/217086604.db2.gz	XWOLDAFXJICKFO-CYBMUJFWSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[N@@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCS(=O)(=O)C1	ZINC000282557537	217086606	/nfs/dbraw/zinc/08/66/06/217086606.db2.gz	XWOLDAFXJICKFO-CYBMUJFWSA-N	1	1	312.391	1.504	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CN1CCc2ccc([N+](=O)[O-])cc2C1)C1CC1	ZINC000351543671	284370114	/nfs/dbraw/zinc/37/01/14/284370114.db2.gz	SVCSBLYRIFPCGE-MRXNPFEDSA-N	1	1	305.378	1.408	20	5		DDBDMO
C[N@@H+](C[C@@H](O)CNCCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC001120468339	781964816	/nfs/dbraw/zinc/96/48/16/781964816.db2.gz	MGBBDEGPRUUCDR-HNNXBMFYSA-N	1	1	308.382	1.051	20	5		DDBDMO
CN(C[C@@H](O)C[NH2+]CCNc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC001120468339	781964828	/nfs/dbraw/zinc/96/48/28/781964828.db2.gz	MGBBDEGPRUUCDR-HNNXBMFYSA-N	1	1	308.382	1.051	20	5		DDBDMO
C[C@H]1C[C@@H](CO)CC[N@H+]1C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000288573632	220251885	/nfs/dbraw/zinc/25/18/85/220251885.db2.gz	BLLUILYXXDOUDF-YDHLFZDLSA-N	1	1	324.377	1.427	20	5		DDBDMO
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CCO	ZINC000267901146	206326990	/nfs/dbraw/zinc/32/69/90/206326990.db2.gz	JSXLBEPUGNRLOO-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](C)CCO	ZINC000267901146	206326995	/nfs/dbraw/zinc/32/69/95/206326995.db2.gz	JSXLBEPUGNRLOO-MRVPVSSYSA-N	1	1	301.730	1.499	20	5		DDBDMO
C[N@H+]1CCN(C(=O)CNc2ccccc2[N+](=O)[O-])CC1(C)C	ZINC000579569450	422791782	/nfs/dbraw/zinc/79/17/82/422791782.db2.gz	QPYBRTIWKQSRJQ-UHFFFAOYSA-N	1	1	306.366	1.559	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@@H]3OCCN(C)[C@H]3C2)cc1[N+](=O)[O-]	ZINC000284504878	218056075	/nfs/dbraw/zinc/05/60/75/218056075.db2.gz	XXKNHUTVJNGTLR-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c1	ZINC000338583384	250039378	/nfs/dbraw/zinc/03/93/78/250039378.db2.gz	ZFYFCMUPCNVMDP-LLVKDONJSA-N	1	1	319.361	1.960	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000273900653	211155932	/nfs/dbraw/zinc/15/59/32/211155932.db2.gz	BOIYCNXYGFLFAL-CYBMUJFWSA-N	1	1	304.350	1.631	20	5		DDBDMO
O=C(NC1CC1)N[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1	ZINC000273900653	211155936	/nfs/dbraw/zinc/15/59/36/211155936.db2.gz	BOIYCNXYGFLFAL-CYBMUJFWSA-N	1	1	304.350	1.631	20	5		DDBDMO
CC[N@H+]1CCCC[C@H]1CNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000109966743	194300608	/nfs/dbraw/zinc/30/06/08/194300608.db2.gz	VEHCQVZXAIHOKJ-ZDUSSCGKSA-N	1	1	323.397	1.480	20	5		DDBDMO
CC(C)C[N@H+]1CCO[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)C1	ZINC000340472096	251071371	/nfs/dbraw/zinc/07/13/71/251071371.db2.gz	AOIUPGQMHVSXAJ-NSHDSACASA-N	1	1	310.354	1.010	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC)C1	ZINC000340969554	251309494	/nfs/dbraw/zinc/30/94/94/251309494.db2.gz	SLUGMVGBBUQRRR-NSHDSACASA-N	1	1	323.349	1.054	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](CO)[C@@H]2CCCO2)c(F)c1	ZINC000352403965	285027983	/nfs/dbraw/zinc/02/79/83/285027983.db2.gz	ZVWOFLRGOOESDQ-STQMWFEESA-N	1	1	302.277	1.503	20	5		DDBDMO
C[N@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCC(F)(F)F	ZINC000352538781	285126212	/nfs/dbraw/zinc/12/62/12/285126212.db2.gz	OUQCGYNFTWLIHV-UHFFFAOYSA-N	1	1	319.283	1.748	20	5		DDBDMO
C[N@@H+](CCc1ccccc1[N+](=O)[O-])CC(=O)NCC(F)(F)F	ZINC000352538781	285126214	/nfs/dbraw/zinc/12/62/14/285126214.db2.gz	OUQCGYNFTWLIHV-UHFFFAOYSA-N	1	1	319.283	1.748	20	5		DDBDMO
COCC(COC)[NH+]1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1	ZINC000413469081	533100795	/nfs/dbraw/zinc/10/07/95/533100795.db2.gz	ANVZVMRQBCXZLU-UHFFFAOYSA-N	1	1	324.381	1.082	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)[C@H]1CCC[C@@H]1O	ZINC000352661577	285205640	/nfs/dbraw/zinc/20/56/40/285205640.db2.gz	UHYODYGAFIUJQW-SWHYSGLUSA-N	1	1	307.350	1.767	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000155199891	197031105	/nfs/dbraw/zinc/03/11/05/197031105.db2.gz	MKAHHSGOYMJUAF-UHFFFAOYSA-N	1	1	323.349	1.419	20	5		DDBDMO
Cc1cc([N+](=O)[O-])c(C)cc1OC[C@H](O)C[NH+]1CCN(C)CC1	ZINC000414144596	224304934	/nfs/dbraw/zinc/30/49/34/224304934.db2.gz	OTALQRBWLPPRGQ-CQSZACIVSA-N	1	1	323.393	1.199	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+](CCCO)C2)c([N+](=O)[O-])c1	ZINC000295010721	224377201	/nfs/dbraw/zinc/37/72/01/224377201.db2.gz	SLMXSDIUKVCGAC-NSHDSACASA-N	1	1	324.337	1.762	20	5		DDBDMO
Cn1cc(CNC2CC[NH2+]CC2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000414780472	224393346	/nfs/dbraw/zinc/39/33/46/224393346.db2.gz	BEEQBTUDSNLVKQ-UHFFFAOYSA-N	1	1	315.377	1.837	20	5		DDBDMO
Cc1nn(C)c(C(=O)NC[C@@H](C)[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-]	ZINC000352869380	285348125	/nfs/dbraw/zinc/34/81/25/285348125.db2.gz	WJXRSTUEQCBWKN-WDEREUQCSA-N	1	1	323.397	1.629	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)COc2ccccc2[N+](=O)[O-])C1	ZINC000121607041	195316369	/nfs/dbraw/zinc/31/63/69/195316369.db2.gz	WFSSREXUQKGFRQ-GFCCVEGCSA-N	1	1	307.350	1.432	20	5		DDBDMO
Cc1n[nH]c(C(=O)N[C@@H](C)C[N@H+]2CCC[C@@H](C)C2)c1[N+](=O)[O-]	ZINC000299529279	533667944	/nfs/dbraw/zinc/66/79/44/533667944.db2.gz	LJMHPMTVSDYRGR-ZJUUUORDSA-N	1	1	309.370	1.477	20	5		DDBDMO
CCn1ccnc1C[NH2+]C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000568384616	304290075	/nfs/dbraw/zinc/29/00/75/304290075.db2.gz	SMWHCTYCJXWNEX-ZDUSSCGKSA-N	1	1	320.349	1.341	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@H+]2CC)c1[N+](=O)[O-]	ZINC000069220834	406692160	/nfs/dbraw/zinc/69/21/60/406692160.db2.gz	JPLWMAXQUJVQNB-SNVBAGLBSA-N	1	1	309.370	1.485	20	5		DDBDMO
C[NH+](C)CCN1CCC(CNC(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000074139106	406903874	/nfs/dbraw/zinc/90/38/74/406903874.db2.gz	ZPVGVYWINBNCMI-UHFFFAOYSA-N	1	1	324.381	1.191	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)C[C@H]1CCCO1	ZINC000076299726	406962499	/nfs/dbraw/zinc/96/24/99/406962499.db2.gz	QBCZRMUIVXAVIG-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H]1CCCO1	ZINC000076299726	406962501	/nfs/dbraw/zinc/96/25/01/406962501.db2.gz	QBCZRMUIVXAVIG-CYBMUJFWSA-N	1	1	307.350	1.953	20	5		DDBDMO
Cc1c(NC(=O)CC[N@@H+](CCO)C2CC2)cccc1[N+](=O)[O-]	ZINC000067965664	407292200	/nfs/dbraw/zinc/29/22/00/407292200.db2.gz	YQVBXQNFLFXOLK-UHFFFAOYSA-N	1	1	307.350	1.689	20	5		DDBDMO
CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000068011973	407293854	/nfs/dbraw/zinc/29/38/54/407293854.db2.gz	NQJRFKWOPHTPNQ-JTQLQIEISA-N	1	1	310.329	1.530	20	5		DDBDMO
C[C@H]1CCC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)C1	ZINC000098093509	407305593	/nfs/dbraw/zinc/30/55/93/407305593.db2.gz	TVGQGOIZTVVRTE-JTQLQIEISA-N	1	1	308.338	1.157	20	5		DDBDMO
C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCCCNC1=O	ZINC000105611717	407354791	/nfs/dbraw/zinc/35/47/91/407354791.db2.gz	UCXKSFNMZVUYKO-AWEZNQCLSA-N	1	1	307.350	1.574	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@](C)(O)C1	ZINC000124762879	407368722	/nfs/dbraw/zinc/36/87/22/407368722.db2.gz	NBZYONFCINZDKK-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@](C)(O)C1	ZINC000124762879	407368724	/nfs/dbraw/zinc/36/87/24/407368724.db2.gz	NBZYONFCINZDKK-IAQYHMDHSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[N@H+]1CC[C@H](CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])C1	ZINC000107888944	407381184	/nfs/dbraw/zinc/38/11/84/407381184.db2.gz	LSJLYMPUAWBAQS-LLVKDONJSA-N	1	1	307.350	1.675	20	5		DDBDMO
CCOC(=O)CC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000178558090	407491130	/nfs/dbraw/zinc/49/11/30/407491130.db2.gz	SYNWQRLRQHWBKB-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CCOC(=O)CC[N@@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000178558090	407491135	/nfs/dbraw/zinc/49/11/35/407491135.db2.gz	SYNWQRLRQHWBKB-UHFFFAOYSA-N	1	1	323.349	1.727	20	5		DDBDMO
CC[N@@H+](CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000185751101	407493686	/nfs/dbraw/zinc/49/36/86/407493686.db2.gz	LDFYBPDHAZRALF-UHFFFAOYSA-N	1	1	313.379	1.357	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@H](CO)C3)n2)cc1	ZINC000266898878	407666409	/nfs/dbraw/zinc/66/64/09/407666409.db2.gz	GBDGPFDCGNLQKV-JTQLQIEISA-N	1	1	304.306	1.459	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](CO)C3)n2)cc1	ZINC000266898878	407666416	/nfs/dbraw/zinc/66/64/16/407666416.db2.gz	GBDGPFDCGNLQKV-JTQLQIEISA-N	1	1	304.306	1.459	20	5		DDBDMO
C[C@@]1(CCCO)CCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O	ZINC000272064234	407762422	/nfs/dbraw/zinc/76/24/22/407762422.db2.gz	XIJWNPQMJFRSDG-HNNXBMFYSA-N	1	1	309.366	1.384	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@@H]2C)c1[N+](=O)[O-]	ZINC000268261560	407975685	/nfs/dbraw/zinc/97/56/85/407975685.db2.gz	ZJLIJBMCKPXAKK-GZMMTYOYSA-N	1	1	307.354	1.093	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546647	407976716	/nfs/dbraw/zinc/97/67/16/407976716.db2.gz	KEYPDMKEBPEMJK-NWDGAFQWSA-N	1	1	307.350	1.260	20	5		DDBDMO
C[C@H](O)[C@@H]1CC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000272546647	407976720	/nfs/dbraw/zinc/97/67/20/407976720.db2.gz	KEYPDMKEBPEMJK-NWDGAFQWSA-N	1	1	307.350	1.260	20	5		DDBDMO
CNC(=O)c1ccc(N[C@H]2C[N@H+](C3CC3)C[C@@H]2C)c([N+](=O)[O-])c1	ZINC000268171912	407925901	/nfs/dbraw/zinc/92/59/01/407925901.db2.gz	QTWXJGVYMYZILG-HZMBPMFUSA-N	1	1	318.377	1.849	20	5		DDBDMO
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)Cn1ccc([N+](=O)[O-])n1	ZINC000154310266	408013900	/nfs/dbraw/zinc/01/39/00/408013900.db2.gz	ZQJWZJJFOGIVNL-CYBMUJFWSA-N	1	1	323.397	1.418	20	5		DDBDMO
Cc1cc(C(=O)N2CC[NH+](C[C@H](C)O)CC2)cc([N+](=O)[O-])c1	ZINC000189727763	408091968	/nfs/dbraw/zinc/09/19/68/408091968.db2.gz	ZTXIEPNKRUGIHA-LBPRGKRZSA-N	1	1	307.350	1.042	20	5		DDBDMO
CC1(C)C[N@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182209585	408096332	/nfs/dbraw/zinc/09/63/32/408096332.db2.gz	HEWFACPKNJLCML-LBPRGKRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
CC1(C)C[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000182209585	408096343	/nfs/dbraw/zinc/09/63/43/408096343.db2.gz	HEWFACPKNJLCML-LBPRGKRZSA-N	1	1	310.350	1.445	20	5		DDBDMO
C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](CO)O1	ZINC000190148183	408175704	/nfs/dbraw/zinc/17/57/04/408175704.db2.gz	XCYWJIKYBZVUOK-VXGBXAGGSA-N	1	1	323.349	1.005	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H](CO)O1	ZINC000190148183	408175708	/nfs/dbraw/zinc/17/57/08/408175708.db2.gz	XCYWJIKYBZVUOK-VXGBXAGGSA-N	1	1	323.349	1.005	20	5		DDBDMO
COc1ccc(NC(=O)CC[NH+]2CCN(C)CC2)c([N+](=O)[O-])c1	ZINC000122187688	408263700	/nfs/dbraw/zinc/26/37/00/408263700.db2.gz	RHSIRTPMCHKUNA-UHFFFAOYSA-N	1	1	322.365	1.179	20	5		DDBDMO
COc1cccc2c1CC[N@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000182694720	408224920	/nfs/dbraw/zinc/22/49/20/408224920.db2.gz	IEXCTKPPXURADB-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
COc1cccc2c1CC[N@@H+](CCn1ccc([N+](=O)[O-])n1)C2	ZINC000182694720	408224924	/nfs/dbraw/zinc/22/49/24/408224924.db2.gz	IEXCTKPPXURADB-UHFFFAOYSA-N	1	1	302.334	1.858	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)Cn2cc([N+](=O)[O-])nc2C)[C@H](C)C1	ZINC000122321937	408283504	/nfs/dbraw/zinc/28/35/04/408283504.db2.gz	QUFUXUDOBALSOL-DGCLKSJQSA-N	1	1	323.397	1.288	20	5		DDBDMO
COc1ccc(OCC[N@H+]2C[C@@H](C)[C@H](CO)C2)c([N+](=O)[O-])c1	ZINC000190892592	408338976	/nfs/dbraw/zinc/33/89/76/408338976.db2.gz	LFXAKBUVMMJIAF-NEPJUHHUSA-N	1	1	310.350	1.542	20	5		DDBDMO
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@@H]2C1	ZINC000171584550	162226258	/nfs/dbraw/zinc/22/62/58/162226258.db2.gz	TYDHVVOLCGIPTR-LQYUOIDQSA-N	1	1	301.346	1.915	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H](OCCO)C1	ZINC000172300064	162269022	/nfs/dbraw/zinc/26/90/22/162269022.db2.gz	NBQZMTASQYSEOB-CYBMUJFWSA-N	1	1	310.350	1.447	20	5		DDBDMO
Cc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000173465924	162341388	/nfs/dbraw/zinc/34/13/88/162341388.db2.gz	ASJVGUJWZUEBDQ-LLVKDONJSA-N	1	1	303.322	1.973	20	5		DDBDMO
Cc1cc(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)on1	ZINC000173465924	162341389	/nfs/dbraw/zinc/34/13/89/162341389.db2.gz	ASJVGUJWZUEBDQ-LLVKDONJSA-N	1	1	303.322	1.973	20	5		DDBDMO
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H]([C@H](C)O)C1	ZINC000248586224	408592761	/nfs/dbraw/zinc/59/27/61/408592761.db2.gz	QYLOCRBARMMPDC-GRYCIOLGSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[N@@H+]1C[C@H]2CN(C(=O)/C=C/c3ccc([N+](=O)[O-])cc3)C[C@H]2C1	ZINC000192527381	408603726	/nfs/dbraw/zinc/60/37/26/408603726.db2.gz	CCFOEANGMPNPMV-XXIWEDNYSA-N	1	1	301.346	1.628	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)C2CC[NH+](C)CC2)c1[N+](=O)[O-]	ZINC000265611378	408711155	/nfs/dbraw/zinc/71/11/55/408711155.db2.gz	HEEVMHHYRUXMMQ-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H](C)C1	ZINC000251842402	408787308	/nfs/dbraw/zinc/78/73/08/408787308.db2.gz	OCWBEPSFWGQKRI-OLZOCXBDSA-N	1	1	321.377	1.051	20	5		DDBDMO
O=C(CC[N@@H+]1CCC[C@@H](O)C1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000185167431	408773018	/nfs/dbraw/zinc/77/30/18/408773018.db2.gz	IBMMZVQTLRBKMH-LLVKDONJSA-N	1	1	311.313	1.519	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000195197162	163312945	/nfs/dbraw/zinc/31/29/45/163312945.db2.gz	DQDURFPKVGMXDZ-OAHLLOKOSA-N	1	1	319.361	1.717	20	5		DDBDMO
O=C(NC1CC1)[C@H]1CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000195197162	163312948	/nfs/dbraw/zinc/31/29/48/163312948.db2.gz	DQDURFPKVGMXDZ-OAHLLOKOSA-N	1	1	319.361	1.717	20	5		DDBDMO
C[C@@H]1COCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000277658864	408987257	/nfs/dbraw/zinc/98/72/57/408987257.db2.gz	DOCQAEIIZUNIJZ-SNVBAGLBSA-N	1	1	311.313	1.783	20	5		DDBDMO
C[C@@H]1COCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000277658864	408987258	/nfs/dbraw/zinc/98/72/58/408987258.db2.gz	DOCQAEIIZUNIJZ-SNVBAGLBSA-N	1	1	311.313	1.783	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1NC(=O)[C@]1(F)CC[N@H+](C(C)(C)C)C1	ZINC000292184023	408996952	/nfs/dbraw/zinc/99/69/52/408996952.db2.gz	GQYVOAFGMZQIRC-ZDUSSCGKSA-N	1	1	313.333	1.479	20	5		DDBDMO
C[C@H]1CN(c2ccc(N)cc2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O	ZINC000286754038	408998611	/nfs/dbraw/zinc/99/86/11/408998611.db2.gz	RWGJHBQEBSEEEN-NSHDSACASA-N	1	1	308.382	1.458	20	5		DDBDMO
O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3C[C@@H](O)[C@@H](O)C3)o2)c1	ZINC000278418053	409083399	/nfs/dbraw/zinc/08/33/99/409083399.db2.gz	RCPJGRSNNHCQJV-OKILXGFUSA-N	1	1	304.302	1.392	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1	ZINC000283793800	409217567	/nfs/dbraw/zinc/21/75/67/409217567.db2.gz	SMWFFSVODWMVLE-UHFFFAOYSA-N	1	1	308.382	1.460	20	5		DDBDMO
C[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C2)C1	ZINC000294313464	409277164	/nfs/dbraw/zinc/27/71/64/409277164.db2.gz	WMVLZHSAUVWTJY-MRXNPFEDSA-N	1	1	318.377	1.735	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CC[C@H]3OCC[N@@H+](C)[C@@H]3C2)c1	ZINC000284896888	409367576	/nfs/dbraw/zinc/36/75/76/409367576.db2.gz	HHRAINCVHLNRLZ-HUUCEWRRSA-N	1	1	307.350	1.513	20	5		DDBDMO
C[C@@H]1C[NH2+]CC[C@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000262878596	163888593	/nfs/dbraw/zinc/88/85/93/163888593.db2.gz	VRYIFOJOOFWTRW-LDYMZIIASA-N	1	1	303.322	1.199	20	5		DDBDMO
CC1(C)C[C@@H](O)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1	ZINC000295984133	409391810	/nfs/dbraw/zinc/39/18/10/409391810.db2.gz	JLBZUDSBJLHPDT-ZDUSSCGKSA-N	1	1	309.366	1.239	20	5		DDBDMO
CC(C)C[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])nn2C)C1	ZINC000356739011	409563589	/nfs/dbraw/zinc/56/35/89/409563589.db2.gz	NOWIZDLTRVWKGT-LLVKDONJSA-N	1	1	309.370	1.036	20	5		DDBDMO
Cc1c(NC(=O)C(=O)NCC[N@H+](C)C2CC2)cccc1[N+](=O)[O-]	ZINC000344816313	409519915	/nfs/dbraw/zinc/51/99/15/409519915.db2.gz	SONMATBBZLEKGV-UHFFFAOYSA-N	1	1	320.349	1.052	20	5		DDBDMO
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C[C@H]3CCCOC3)C2)nc1	ZINC000331461060	409533000	/nfs/dbraw/zinc/53/30/00/409533000.db2.gz	JJJPGOIZHQZKRY-CHWSQXEVSA-N	1	1	306.366	1.903	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000344919659	409554238	/nfs/dbraw/zinc/55/42/38/409554238.db2.gz	CXBYFKRAGPWNFT-BPJJOFIESA-N	1	1	304.350	1.611	20	5		DDBDMO
CNC(=O)N[C@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1	ZINC000344919659	409554245	/nfs/dbraw/zinc/55/42/45/409554245.db2.gz	CXBYFKRAGPWNFT-BPJJOFIESA-N	1	1	304.350	1.611	20	5		DDBDMO
CNC(=O)c1ccc(N2CC[N@@H+](C)[C@H](C)[C@@H]2C)c([N+](=O)[O-])c1	ZINC000356793064	409611642	/nfs/dbraw/zinc/61/16/42/409611642.db2.gz	MFDVNPIRHISQSJ-MNOVXSKESA-N	1	1	306.366	1.483	20	5		DDBDMO
CC[N@H+]1C[C@@H](C)N(c2ccc(C(N)=O)cc2[N+](=O)[O-])C[C@H]1C	ZINC000345170668	409655879	/nfs/dbraw/zinc/65/58/79/409655879.db2.gz	IVKJNMOZGWWJKW-GHMZBOCLSA-N	1	1	306.366	1.613	20	5		DDBDMO
C[C@H]1C[C@H]1[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)C[C@@H](C)C1	ZINC000346224439	409863636	/nfs/dbraw/zinc/86/36/36/409863636.db2.gz	NUHFUYOGNIDLPV-GMXVVIOVSA-N	1	1	306.366	1.725	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])cnc2N)C1	ZINC000318799938	409883415	/nfs/dbraw/zinc/88/34/15/409883415.db2.gz	ATAHWFLTWDIJBO-SNVBAGLBSA-N	1	1	307.354	1.032	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)CCN1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000332311528	410060977	/nfs/dbraw/zinc/06/09/77/410060977.db2.gz	MWRJETUMFGDJFB-GFCCVEGCSA-N	1	1	318.377	1.120	20	5		DDBDMO
Cc1cc(NC(=O)C(=O)N2CCC[N@H+](C)CC2)ccc1[N+](=O)[O-]	ZINC000298389134	410207621	/nfs/dbraw/zinc/20/76/21/410207621.db2.gz	GVZTYAFIRZPLTK-UHFFFAOYSA-N	1	1	320.349	1.006	20	5		DDBDMO
CN(C)c1cc(NC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)cc[nH+]1	ZINC000346910712	410241592	/nfs/dbraw/zinc/24/15/92/410241592.db2.gz	CPCVIDICEXYUJW-UHFFFAOYSA-N	1	1	318.337	1.626	20	5		DDBDMO
CN(C(=O)COc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347011819	410312562	/nfs/dbraw/zinc/31/25/62/410312562.db2.gz	MNMPLZRQMTYPPW-AWEZNQCLSA-N	1	1	319.361	1.669	20	5		DDBDMO
CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000351963926	410375544	/nfs/dbraw/zinc/37/55/44/410375544.db2.gz	IIOHUWIVMVKKQP-LLVKDONJSA-N	1	1	309.370	1.702	20	5		DDBDMO
C[C@H]1[C@@H](N2CCOCC2)CC[N@@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000351997799	410402645	/nfs/dbraw/zinc/40/26/45/410402645.db2.gz	SNYMPGWFJWOWKC-AAEUAGOBSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H]1[C@@H](N2CCOCC2)CC[N@H+]1Cc1csc([N+](=O)[O-])c1	ZINC000351997799	410402648	/nfs/dbraw/zinc/40/26/48/410402648.db2.gz	SNYMPGWFJWOWKC-AAEUAGOBSA-N	1	1	311.407	1.951	20	5		DDBDMO
C[C@H]1[C@@H]([NH+]2CCOCC2)CCN1Cc1csc([N+](=O)[O-])c1	ZINC000351997799	410402653	/nfs/dbraw/zinc/40/26/53/410402653.db2.gz	SNYMPGWFJWOWKC-AAEUAGOBSA-N	1	1	311.407	1.951	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H]1CCC[N@@H+](C)[C@H]1C	ZINC000343444149	410459243	/nfs/dbraw/zinc/45/92/43/410459243.db2.gz	BACASZCRRBFRGP-JQWIXIFHSA-N	1	1	309.370	1.089	20	5		DDBDMO
COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@H](C)C(N)=O	ZINC000347313624	410465428	/nfs/dbraw/zinc/46/54/28/410465428.db2.gz	IIUHGGSENQCYKO-CNELAYHGSA-N	1	1	321.377	1.820	20	5		DDBDMO
COCC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)[C@H](C)C(N)=O	ZINC000347313624	410465434	/nfs/dbraw/zinc/46/54/34/410465434.db2.gz	IIUHGGSENQCYKO-CNELAYHGSA-N	1	1	321.377	1.820	20	5		DDBDMO
Cc1cc(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)cn2cc[nH+]c12	ZINC000355403925	410497088	/nfs/dbraw/zinc/49/70/88/410497088.db2.gz	PFKCJWUKWOGAOJ-UHFFFAOYSA-N	1	1	313.273	1.904	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000299212004	410571597	/nfs/dbraw/zinc/57/15/97/410571597.db2.gz	HDSIMKBMLZIZAC-UHFFFAOYSA-N	1	1	321.377	1.698	20	5		DDBDMO
COCC[N@H+]1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000299230249	410573725	/nfs/dbraw/zinc/57/37/25/410573725.db2.gz	RMVAAMYYUVEZRM-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
CC(C)[N@@H+]1CCO[C@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291222	410602176	/nfs/dbraw/zinc/60/21/76/410602176.db2.gz	XIRJIPVROBSPNP-WFASDCNBSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC(C)[N@H+]1CCO[C@H](C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)C1	ZINC000352291222	410602181	/nfs/dbraw/zinc/60/21/81/410602181.db2.gz	XIRJIPVROBSPNP-WFASDCNBSA-N	1	1	321.377	1.881	20	5		DDBDMO
CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C[C@@H](C)O	ZINC000352202811	410544575	/nfs/dbraw/zinc/54/45/75/410544575.db2.gz	MNIPCFRGUJJXTF-GFCCVEGCSA-N	1	1	309.366	1.935	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)NCc1cccc([N+](=O)[O-])c1C	ZINC000359530177	410713673	/nfs/dbraw/zinc/71/36/73/410713673.db2.gz	GVEPBBYVFSZIOI-UHFFFAOYSA-N	1	1	324.381	1.017	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CC[C@H]2Cc2ccccc2)c1	ZINC000353040144	410752353	/nfs/dbraw/zinc/75/23/53/410752353.db2.gz	NIBAZDMKTGMDLQ-GOEBONIOSA-N	1	1	316.361	1.469	20	5		DDBDMO
Cc1ccnc(NC[C@H]2C[N@@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301851253	410813325	/nfs/dbraw/zinc/81/33/25/410813325.db2.gz	FQNFOHSQIWESEZ-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
Cc1ccnc(NC[C@H]2C[N@H+]3CCCC[C@H]3CO2)c1[N+](=O)[O-]	ZINC000301851253	410813326	/nfs/dbraw/zinc/81/33/26/410813326.db2.gz	FQNFOHSQIWESEZ-STQMWFEESA-N	1	1	306.366	1.963	20	5		DDBDMO
COC(=O)c1cnc(N2CCC[N@H+](C3CC3)CC2)c([N+](=O)[O-])c1	ZINC000302667678	410848271	/nfs/dbraw/zinc/84/82/71/410848271.db2.gz	CNNIHVNALOSOBH-UHFFFAOYSA-N	1	1	320.349	1.451	20	5		DDBDMO
CCC[N@@H+](CC)C[C@H](C)NC(=O)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000359768756	410862854	/nfs/dbraw/zinc/86/28/54/410862854.db2.gz	WJFOXAWOJGCWFT-JTQLQIEISA-N	1	1	310.354	1.546	20	5		DDBDMO
C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C1CCN(CCO)CC1	ZINC000353360737	410942356	/nfs/dbraw/zinc/94/23/56/410942356.db2.gz	LIMSSPBDMGUYGM-XQRVVYSFSA-N	1	1	319.405	1.997	20	5		DDBDMO
CN(C/C=C\c1ccccc1[N+](=O)[O-])C1CC[NH+](CCO)CC1	ZINC000353360737	410942362	/nfs/dbraw/zinc/94/23/62/410942362.db2.gz	LIMSSPBDMGUYGM-XQRVVYSFSA-N	1	1	319.405	1.997	20	5		DDBDMO
COc1c(C(=O)N2C[C@H](C)[N@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000331053723	410921443	/nfs/dbraw/zinc/92/14/43/410921443.db2.gz	JNVHOMPLGILSJB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2C[C@H](C)[N@@H+](C)C[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000331053723	410921446	/nfs/dbraw/zinc/92/14/46/410921446.db2.gz	JNVHOMPLGILSJB-QWRGUYRKSA-N	1	1	307.350	1.768	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000344184701	411013132	/nfs/dbraw/zinc/01/31/32/411013132.db2.gz	RUDRAHNNXKSDHZ-UHFFFAOYSA-N	1	1	313.329	1.432	20	5		DDBDMO
COc1cc(C[N@@H+](C)[C@@H]2CCC[C@@H]2O)c([N+](=O)[O-])cc1OC	ZINC000348556871	411015664	/nfs/dbraw/zinc/01/56/64/411015664.db2.gz	QCPRJOWQPBLULT-YPMHNXCESA-N	1	1	310.350	1.957	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1C(=O)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000331426531	411084747	/nfs/dbraw/zinc/08/47/47/411084747.db2.gz	XZWAFRJLCNNKKW-DGCLKSJQSA-N	1	1	319.365	1.097	20	5		DDBDMO
C[NH2+][C@H]1CCCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)C1	ZINC000133062044	196308513	/nfs/dbraw/zinc/30/85/13/196308513.db2.gz	UPSNLDSKPOZUIW-VIFPVBQESA-N	1	1	303.322	1.295	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000416731807	225044488	/nfs/dbraw/zinc/04/44/88/225044488.db2.gz	ORGDMNPVXXSNTO-RYUDHWBXSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000416731807	225044491	/nfs/dbraw/zinc/04/44/91/225044491.db2.gz	ORGDMNPVXXSNTO-RYUDHWBXSA-N	1	1	322.365	1.514	20	5		DDBDMO
C[C@@H]1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)[C@@H](C)C[N@H+]1CCO	ZINC000419000361	226002033	/nfs/dbraw/zinc/00/20/33/226002033.db2.gz	OGAHVCDWMXBZHS-MNOVXSKESA-N	1	1	319.365	1.362	20	5		DDBDMO
C[C@H](CO)[N@H+]1CCCN(CCOc2ccccc2[N+](=O)[O-])CC1	ZINC000373743605	418456365	/nfs/dbraw/zinc/45/63/65/418456365.db2.gz	WYHCJROEHUIDRC-CQSZACIVSA-N	1	1	323.393	1.362	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1CN1CC[NH+]([C@H]2CCOC2)CC1	ZINC000366628409	418498443	/nfs/dbraw/zinc/49/84/43/418498443.db2.gz	MULLPXMSJSHVIJ-HNNXBMFYSA-N	1	1	321.377	1.510	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000366810985	418519839	/nfs/dbraw/zinc/51/98/39/418519839.db2.gz	QQKQLROFQGJROF-SWHYSGLUSA-N	1	1	305.334	1.245	20	5		DDBDMO
C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@H]2OCC(=O)N[C@H]2C1	ZINC000366810985	418519841	/nfs/dbraw/zinc/51/98/41/418519841.db2.gz	QQKQLROFQGJROF-SWHYSGLUSA-N	1	1	305.334	1.245	20	5		DDBDMO
CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)n1	ZINC000191840307	222110531	/nfs/dbraw/zinc/11/05/31/222110531.db2.gz	YTMOVQFBUWUNFR-NXEZZACHSA-N	1	1	307.354	1.166	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@@H+]2CCCOCC2)c1[N+](=O)[O-]	ZINC000192912517	222139304	/nfs/dbraw/zinc/13/93/04/222139304.db2.gz	LKBYDKVOHMTFQC-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
COc1cccc(C(=O)NCC[N@H+]2CCCOCC2)c1[N+](=O)[O-]	ZINC000192912517	222139310	/nfs/dbraw/zinc/13/93/10/222139310.db2.gz	LKBYDKVOHMTFQC-UHFFFAOYSA-N	1	1	323.349	1.056	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[N@H+](C)C[C@@H]1c1ccccc1	ZINC000375007215	418587338	/nfs/dbraw/zinc/58/73/38/418587338.db2.gz	ZONKNGOWOMVPJM-CQSZACIVSA-N	1	1	315.377	1.817	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CC[N@@H+](C)C[C@@H]1c1ccccc1	ZINC000375007215	418587340	/nfs/dbraw/zinc/58/73/40/418587340.db2.gz	ZONKNGOWOMVPJM-CQSZACIVSA-N	1	1	315.377	1.817	20	5		DDBDMO
COc1cccc(C(=O)NC[C@@H]2CC[N@H+](C3CC3)C2)c1[N+](=O)[O-]	ZINC000195442319	222202527	/nfs/dbraw/zinc/20/25/27/222202527.db2.gz	PDISVDSMHZSCCF-NSHDSACASA-N	1	1	319.361	1.818	20	5		DDBDMO
CO[C@@H]1CC[N@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000361369726	418637207	/nfs/dbraw/zinc/63/72/07/418637207.db2.gz	LPOZHXREVDABKO-CYBMUJFWSA-N	1	1	305.334	1.205	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)C1	ZINC000361369726	418637209	/nfs/dbraw/zinc/63/72/09/418637209.db2.gz	LPOZHXREVDABKO-CYBMUJFWSA-N	1	1	305.334	1.205	20	5		DDBDMO
CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC[N@H+]([C@@H](C)CO)CC1	ZINC000367927432	418658491	/nfs/dbraw/zinc/65/84/91/418658491.db2.gz	OHCFVTAFYIXWAF-LBPRGKRZSA-N	1	1	321.377	1.690	20	5		DDBDMO
CCn1cc(CC[N@H+]2CCC[C@@H](n3cc([N+](=O)[O-])cn3)C2)cn1	ZINC000375726088	418677704	/nfs/dbraw/zinc/67/77/04/418677704.db2.gz	GMYGQDAHZAFVSA-CQSZACIVSA-N	1	1	318.381	1.887	20	5		DDBDMO
COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+]2CCC[C@@H]2C1	ZINC000361630095	418693544	/nfs/dbraw/zinc/69/35/44/418693544.db2.gz	SILWVMMRZGCPMN-NWDGAFQWSA-N	1	1	319.361	1.960	20	5		DDBDMO
C[N@H+]1CC[C@H]2CCN(C(=O)c3c(N)cccc3[N+](=O)[O-])C[C@H]21	ZINC000371559689	418800842	/nfs/dbraw/zinc/80/08/42/418800842.db2.gz	AHDIACKQTAIOBH-GXFFZTMASA-N	1	1	304.350	1.343	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@@H+]1CCCC[C@@H](CO)C1	ZINC000371688063	418809560	/nfs/dbraw/zinc/80/95/60/418809560.db2.gz	CLWUJUQLBRZLQK-ZIAGYGMSSA-N	1	1	324.377	1.429	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H]1c2ccccc2CC[C@H]1CO	ZINC000365264494	418847851	/nfs/dbraw/zinc/84/78/51/418847851.db2.gz	GIRSQDFDRBKWDR-SWLSCSKDSA-N	1	1	316.361	1.714	20	5		DDBDMO
C[N@H+]1Cc2ccccc2[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000372298893	418851832	/nfs/dbraw/zinc/85/18/32/418851832.db2.gz	STPWUEODGMSDLF-OAHLLOKOSA-N	1	1	312.329	1.906	20	5		DDBDMO
C[N@@H+]1Cc2ccccc2[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000372298893	418851834	/nfs/dbraw/zinc/85/18/34/418851834.db2.gz	STPWUEODGMSDLF-OAHLLOKOSA-N	1	1	312.329	1.906	20	5		DDBDMO
O=[N+]([O-])c1cnn(CC[N@@H+]2CC[C@@](CO)(c3ccccc3)C2)c1	ZINC000365848497	418916160	/nfs/dbraw/zinc/91/61/60/418916160.db2.gz	QFUIPEZKRCNXNL-MRXNPFEDSA-N	1	1	316.361	1.427	20	5		DDBDMO
CCN1CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000411724177	419390981	/nfs/dbraw/zinc/39/09/81/419390981.db2.gz	YMFTWGOZDKSRLO-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CCN1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000411724177	419390984	/nfs/dbraw/zinc/39/09/84/419390984.db2.gz	YMFTWGOZDKSRLO-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
CC[C@@]1(O)CC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913827	419366673	/nfs/dbraw/zinc/36/66/73/419366673.db2.gz	GPXRHUQXQLSGAW-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
CC[C@@]1(O)CC[N@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000425913827	419366677	/nfs/dbraw/zinc/36/66/77/419366677.db2.gz	GPXRHUQXQLSGAW-XHDPSFHLSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H](C(=O)N(C)C)C1	ZINC000411958391	419525771	/nfs/dbraw/zinc/52/57/71/419525771.db2.gz	UUHFWBAOEZGHAZ-LBPRGKRZSA-N	1	1	307.350	1.514	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C/C=C\c1ccccc1[N+](=O)[O-]	ZINC000418109208	419539036	/nfs/dbraw/zinc/53/90/36/419539036.db2.gz	HXOVKGSHVRNCKP-IORUMNFESA-N	1	1	319.405	1.995	20	5		DDBDMO
Cc1ccc(CN2C[C@H](C)[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000418112744	419543531	/nfs/dbraw/zinc/54/35/31/419543531.db2.gz	LNOXLYBBJPMREP-KBPBESRZSA-N	1	1	307.394	1.790	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N(C)C[C@H]1CCC[N@H+]1C	ZINC000421710479	419699236	/nfs/dbraw/zinc/69/92/36/419699236.db2.gz	KVPSHHAESKRTLK-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=[N+]([O-])c1ncn(Cc2cccc(C[NH+]3CCOCC3)c2)n1	ZINC000421845146	419746914	/nfs/dbraw/zinc/74/69/14/419746914.db2.gz	PQUHRGHNJHUVQE-UHFFFAOYSA-N	1	1	303.322	1.067	20	5		DDBDMO
COCC[N@@H+](CCn1cc([N+](=O)[O-])cn1)[C@H]1CCCSC1	ZINC000433189204	229169261	/nfs/dbraw/zinc/16/92/61/229169261.db2.gz	DJOVJRQYTUDSDG-LBPRGKRZSA-N	1	1	314.411	1.635	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+](CCO)[C@H]1CCO[C@H]1C	ZINC000430248474	420096311	/nfs/dbraw/zinc/09/63/11/420096311.db2.gz	ZQKRBBPZMZWIOY-FZMZJTMJSA-N	1	1	310.350	1.575	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+](CCO)[C@H]1CCO[C@H]1C	ZINC000430248474	420096314	/nfs/dbraw/zinc/09/63/14/420096314.db2.gz	ZQKRBBPZMZWIOY-FZMZJTMJSA-N	1	1	310.350	1.575	20	5		DDBDMO
C[NH2+]C[C@H]1CCCN(CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000430605187	420155692	/nfs/dbraw/zinc/15/56/92/420155692.db2.gz	QARJNIVNTDMAAJ-CYBMUJFWSA-N	1	1	320.393	1.855	20	5		DDBDMO
C[NH2+]CCCN(C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000420389825	420256556	/nfs/dbraw/zinc/25/65/56/420256556.db2.gz	PIUWGFDUYJZYBX-UHFFFAOYSA-N	1	1	308.382	1.773	20	5		DDBDMO
C[N@H+]1CCC[C@H](CCNC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)C1	ZINC000458159282	420642845	/nfs/dbraw/zinc/64/28/45/420642845.db2.gz	DYMGIJVYVKDUTJ-GFCCVEGCSA-N	1	1	323.397	1.375	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000470182976	420931980	/nfs/dbraw/zinc/93/19/80/420931980.db2.gz	LHFYVTZGTRSOBY-JAMFPYSNSA-N	1	1	319.361	1.573	20	5		DDBDMO
C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1C[C@@H](C)O[C@@H](C(N)=O)C1	ZINC000470182976	420931983	/nfs/dbraw/zinc/93/19/83/420931983.db2.gz	LHFYVTZGTRSOBY-JAMFPYSNSA-N	1	1	319.361	1.573	20	5		DDBDMO
COCC[N@H+]1CCC[C@H]1CN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1	ZINC000450305627	421179477	/nfs/dbraw/zinc/17/94/77/421179477.db2.gz	AXQOTBOCMYUPKD-LBPRGKRZSA-N	1	1	319.365	1.416	20	5		DDBDMO
CC[C@H](C)[NH+]1CCN(C(=O)c2nn(CC)cc2[N+](=O)[O-])CC1	ZINC000456540321	421181012	/nfs/dbraw/zinc/18/10/12/421181012.db2.gz	ZGKFTCPPVFKFMS-NSHDSACASA-N	1	1	309.370	1.368	20	5		DDBDMO
O=[N+]([O-])c1cccc2c1ccnc2NC[C@@H]1C[NH+]2CCN1CC2	ZINC000450391831	421191963	/nfs/dbraw/zinc/19/19/63/421191963.db2.gz	NNLXNROHKPFATH-GFCCVEGCSA-N	1	1	313.361	1.555	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(=NC[C@@H]3CCCC[N@@H+]3CCO)[nH]c2c1	ZINC000450613305	421217206	/nfs/dbraw/zinc/21/72/06/421217206.db2.gz	LQJFJAAUGADEBW-LBPRGKRZSA-N	1	1	319.365	1.152	20	5		DDBDMO
C[C@H]1CCCC[N@H+]1CCCNC(=O)c1ccnc(N)c1[N+](=O)[O-]	ZINC000561083115	421305371	/nfs/dbraw/zinc/30/53/71/421305371.db2.gz	NFRBHOGIKMBLPC-NSHDSACASA-N	1	1	321.381	1.566	20	5		DDBDMO
C[C@H](CNC(=O)c1ccnc(N)c1[N+](=O)[O-])[N@H+]1CCC[C@@H](C)C1	ZINC000548058500	421394959	/nfs/dbraw/zinc/39/49/59/421394959.db2.gz	RIADYHQBPWQEQU-GHMZBOCLSA-N	1	1	321.381	1.422	20	5		DDBDMO
Nc1nccc(C(=O)N[C@@H]2CC[N@H+](C3CCCC3)C2)c1[N+](=O)[O-]	ZINC000514610810	421440268	/nfs/dbraw/zinc/44/02/68/421440268.db2.gz	ACZKGXLGTSFFTK-SNVBAGLBSA-N	1	1	319.365	1.319	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H](C)[N@H+]1C	ZINC000563951890	421560101	/nfs/dbraw/zinc/56/01/01/421560101.db2.gz	QGJWPDAQHNHJRZ-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H](C)[N@@H+]1C	ZINC000563951890	421560103	/nfs/dbraw/zinc/56/01/03/421560103.db2.gz	QGJWPDAQHNHJRZ-AOOOYVTPSA-N	1	1	321.333	1.488	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C)CCN1C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000563989954	421564050	/nfs/dbraw/zinc/56/40/50/421564050.db2.gz	OCBVGJBYIOMJFL-GFCCVEGCSA-N	1	1	306.366	1.559	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])cn2)C[C@H]1C	ZINC000531634752	421641181	/nfs/dbraw/zinc/64/11/81/421641181.db2.gz	JOTPWECCMASVLG-VXGBXAGGSA-N	1	1	306.366	1.935	20	5		DDBDMO
O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H](N3CCOCC3)C2)cc1	ZINC000571223224	421698701	/nfs/dbraw/zinc/69/87/01/421698701.db2.gz	TUJULPIJANMGBL-KRWDZBQOSA-N	1	1	319.405	1.934	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H](C)[N@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000536639859	421723619	/nfs/dbraw/zinc/72/36/19/421723619.db2.gz	APQSADAIZHZYTN-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
CNc1ccc(C(=O)N2C[C@@H](C)[N@@H+](C)C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000536639859	421723621	/nfs/dbraw/zinc/72/36/21/421723621.db2.gz	APQSADAIZHZYTN-MNOVXSKESA-N	1	1	306.366	1.801	20	5		DDBDMO
C[N@@H+](CCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)C1CC1	ZINC000520187028	421739308	/nfs/dbraw/zinc/73/93/08/421739308.db2.gz	YQORIOQOWLRGCU-UHFFFAOYSA-N	1	1	307.306	1.148	20	5		DDBDMO
CC(C)[N@H+]1CC[C@@H](CNC(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000543767969	421841400	/nfs/dbraw/zinc/84/14/00/421841400.db2.gz	ZGTHCZNQFDSXHT-NSHDSACASA-N	1	1	307.354	1.264	20	5		DDBDMO
Cc1nc(N[C@@H](C)C[N@H+](C)CCCN(C)C)ccc1[N+](=O)[O-]	ZINC000596361112	422376733	/nfs/dbraw/zinc/37/67/33/422376733.db2.gz	PRMPMOZHMIOHET-LBPRGKRZSA-N	1	1	309.414	1.982	20	5		DDBDMO
Cc1nc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)ccc1[N+](=O)[O-]	ZINC000596361112	422376738	/nfs/dbraw/zinc/37/67/38/422376738.db2.gz	PRMPMOZHMIOHET-LBPRGKRZSA-N	1	1	309.414	1.982	20	5		DDBDMO
COC(=O)c1cc(C)nc(N[C@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000342365435	271390803	/nfs/dbraw/zinc/39/08/03/271390803.db2.gz	VYYKYQXPAUYICL-MNOVXSKESA-N	1	1	322.365	1.979	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NCC[N@@H+](CC)C(C)C)c1[N+](=O)[O-]	ZINC000345577927	272282868	/nfs/dbraw/zinc/28/28/68/272282868.db2.gz	WVDUQOLEWNZYQL-UHFFFAOYSA-N	1	1	311.386	1.731	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(N(C)C[C@H]2CCC[N@H+]2C)n1	ZINC000319331328	274003973	/nfs/dbraw/zinc/00/39/73/274003973.db2.gz	RQRARFNGMINGKT-SNVBAGLBSA-N	1	1	308.338	1.307	20	5		DDBDMO
CC(C)c1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-]	ZINC000331216885	276041591	/nfs/dbraw/zinc/04/15/91/276041591.db2.gz	PVNYOXLRRUJJDD-NXEZZACHSA-N	1	1	309.370	1.654	20	5		DDBDMO
CC[N@H+](CCO)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000120011215	276349707	/nfs/dbraw/zinc/34/97/07/276349707.db2.gz	JNYKGRHIGMVOTR-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
CC[N@@H+](CCO)[C@H](C)C(=O)Nc1ccc(OC)cc1[N+](=O)[O-]	ZINC000120011215	276349709	/nfs/dbraw/zinc/34/97/09/276349709.db2.gz	JNYKGRHIGMVOTR-SNVBAGLBSA-N	1	1	311.338	1.245	20	5		DDBDMO
C[N@H+]1CCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C(C)(C)C1	ZINC000408054496	277109042	/nfs/dbraw/zinc/10/90/42/277109042.db2.gz	MFDOXQQPVHNPLZ-UHFFFAOYSA-N	1	1	321.377	1.987	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@@H+](CCO)CCCO)co2)cc1	ZINC000089897243	281027265	/nfs/dbraw/zinc/02/72/65/281027265.db2.gz	LKRBRDNANJKSIX-UHFFFAOYSA-N	1	1	321.333	1.427	20	5		DDBDMO
O=[N+]([O-])c1ccc(-c2nc(C[N@H+](CCO)CCCO)co2)cc1	ZINC000089897243	281027266	/nfs/dbraw/zinc/02/72/66/281027266.db2.gz	LKRBRDNANJKSIX-UHFFFAOYSA-N	1	1	321.333	1.427	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[N@@H+](C)CC[C@H]2C)c1	ZINC000353991328	298331586	/nfs/dbraw/zinc/33/15/86/298331586.db2.gz	AVOPKSMFDRAQBV-LLVKDONJSA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000362077235	300001546	/nfs/dbraw/zinc/00/15/46/300001546.db2.gz	MZTZSQYNALTNMR-VXGBXAGGSA-N	1	1	307.350	1.484	20	5		DDBDMO
C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1CO	ZINC000362077233	300001550	/nfs/dbraw/zinc/00/15/50/300001550.db2.gz	MZTZSQYNALTNMR-NWDGAFQWSA-N	1	1	307.350	1.484	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)N1CCC[N@H+]2CCC[C@@H]2C1	ZINC000363104345	300212172	/nfs/dbraw/zinc/21/21/72/300212172.db2.gz	OHGOWMDTQZUFLJ-CYBMUJFWSA-N	1	1	321.381	1.187	20	5		DDBDMO
O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1	ZINC000363564386	300282925	/nfs/dbraw/zinc/28/29/25/300282925.db2.gz	TXAHQHKEHIWWFB-KGLIPLIRSA-N	1	1	303.362	1.880	20	5		DDBDMO
O=[N+]([O-])c1ccc(N2CCC[N@H+](C3CC3)CC2)c2nonc21	ZINC000364050216	300339153	/nfs/dbraw/zinc/33/91/53/300339153.db2.gz	GERYGJUIRPODCD-UHFFFAOYSA-N	1	1	303.322	1.806	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CC[N@@H+]1C1CCN(C)CC1	ZINC000364383749	300387683	/nfs/dbraw/zinc/38/76/83/300387683.db2.gz	MPXBDTZNEXJFFM-ZDUSSCGKSA-N	1	1	319.409	1.595	20	5		DDBDMO
C[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CC[N@H+]1C1CCN(C)CC1	ZINC000364383749	300387685	/nfs/dbraw/zinc/38/76/85/300387685.db2.gz	MPXBDTZNEXJFFM-ZDUSSCGKSA-N	1	1	319.409	1.595	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)Cc3ccccc3[N+](=O)[O-])C[C@@H]21	ZINC000368596673	301061161	/nfs/dbraw/zinc/06/11/61/301061161.db2.gz	VVHQXTMTTFQXKN-DOMZBBRYSA-N	1	1	303.362	1.690	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368998918	301117584	/nfs/dbraw/zinc/11/75/84/301117584.db2.gz	CGPOCFCRLDOILB-LLVKDONJSA-N	1	1	309.370	1.343	20	5		DDBDMO
CC(C)(C)NC(=O)C[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368998918	301117585	/nfs/dbraw/zinc/11/75/85/301117585.db2.gz	CGPOCFCRLDOILB-LLVKDONJSA-N	1	1	309.370	1.343	20	5		DDBDMO
CC(C)C[N@H+]1CCCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000369310564	301161877	/nfs/dbraw/zinc/16/18/77/301161877.db2.gz	RNSLWWCHVFGVIA-UHFFFAOYSA-N	1	1	320.393	1.981	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000375994948	302021087	/nfs/dbraw/zinc/02/10/87/302021087.db2.gz	OJLALPCUDGNNMF-OUCADQQQSA-N	1	1	308.382	1.844	20	5		DDBDMO
O=C(Cc1ccccc1[N+](=O)[O-])NC[C@H]1C[N@H+]2CCC[C@@H]2CO1	ZINC000377475391	302182393	/nfs/dbraw/zinc/18/23/93/302182393.db2.gz	MBRLWJCLNUGEMC-KGLIPLIRSA-N	1	1	319.361	1.117	20	5		DDBDMO
Cn1cc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]2[C@@H](CCC[N@H+]2C)C1	ZINC000531726631	303253304	/nfs/dbraw/zinc/25/33/04/303253304.db2.gz	QXIZQSMBMSFAAQ-WCQYABFASA-N	1	1	306.366	1.490	20	5		DDBDMO
Cc1c(C(=O)N[C@H](C)CC[NH+]2CCOCC2)cccc1[N+](=O)[O-]	ZINC000357632574	306900719	/nfs/dbraw/zinc/90/07/19/306900719.db2.gz	ZJJDVPNJKIEUGK-GFCCVEGCSA-N	1	1	321.377	1.744	20	5		DDBDMO
O=[N+]([O-])c1cnc2ccc(N3CCC[N@H+]4CCC[C@H]4C3)nn21	ZINC000367303907	307091370	/nfs/dbraw/zinc/09/13/70/307091370.db2.gz	ZKKIDGQLFXTFDD-NSHDSACASA-N	1	1	302.338	1.312	20	5		DDBDMO
CNC(=O)CN1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000368831670	307110882	/nfs/dbraw/zinc/11/08/82/307110882.db2.gz	XPCZYZJZFLNFSM-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CNC(=O)CN1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)CC1	ZINC000368831670	307110883	/nfs/dbraw/zinc/11/08/83/307110883.db2.gz	XPCZYZJZFLNFSM-UHFFFAOYSA-N	1	1	320.393	1.157	20	5		DDBDMO
CCC[N@H+]1CCCN(C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)CC1	ZINC000373106603	307179004	/nfs/dbraw/zinc/17/90/04/307179004.db2.gz	KWAQTQKDZXUVLX-UHFFFAOYSA-N	1	1	308.338	1.253	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608737	307191941	/nfs/dbraw/zinc/19/19/41/307191941.db2.gz	DTVBFYPHPNCEIB-HLLBOEOZSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1	ZINC000373608737	307191942	/nfs/dbraw/zinc/19/19/42/307191942.db2.gz	DTVBFYPHPNCEIB-HLLBOEOZSA-N	1	1	317.389	1.823	20	5		DDBDMO
C[C@]1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCC[N@H+]1Cc1ccccc1	ZINC000373608737	307191943	/nfs/dbraw/zinc/19/19/43/307191943.db2.gz	DTVBFYPHPNCEIB-HLLBOEOZSA-N	1	1	317.389	1.823	20	5		DDBDMO
COc1cc(C(=O)N2CC[C@@H]3CC[N@@H+](C)[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000376642886	307251157	/nfs/dbraw/zinc/25/11/57/307251157.db2.gz	MLLUEUZLLUSESB-FZMZJTMJSA-N	1	1	319.361	1.770	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2CCC[C@H]3OCC[C@H]32)c([N+](=O)[O-])c1	ZINC000376673798	307253079	/nfs/dbraw/zinc/25/30/79/307253079.db2.gz	SDPKXIKXAALMBD-TZMCWYRMSA-N	1	1	305.334	1.447	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@H]3OCC[C@H]32)c([N+](=O)[O-])c1	ZINC000376673798	307253080	/nfs/dbraw/zinc/25/30/80/307253080.db2.gz	SDPKXIKXAALMBD-TZMCWYRMSA-N	1	1	305.334	1.447	20	5		DDBDMO
CNC(=O)c1ccc(NC[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1	ZINC000391175255	307294092	/nfs/dbraw/zinc/29/40/92/307294092.db2.gz	HRPZVBSLVSJZTF-LLVKDONJSA-N	1	1	318.377	1.851	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@]3(C2)CCC[NH2+]C3)c1[N+](=O)[O-]	ZINC000573968120	308257529	/nfs/dbraw/zinc/25/75/29/308257529.db2.gz	GMLBVFAIRYRGCM-OAHLLOKOSA-N	1	1	321.381	1.486	20	5		DDBDMO
COc1ccc(CC(=O)NC[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000600271916	490384281	/nfs/dbraw/zinc/38/42/81/490384281.db2.gz	KSYJLNKMPQZGBE-GFCCVEGCSA-N	1	1	307.350	1.356	20	5		DDBDMO
COC(=O)c1ccc(OCCn2cc[nH+]c2C)c([N+](=O)[O-])c1	ZINC000270617876	490715089	/nfs/dbraw/zinc/71/50/89/490715089.db2.gz	CQVBLQSGTAWJBT-UHFFFAOYSA-N	1	1	305.290	1.965	20	5		DDBDMO
COC(=O)c1cnc(NCC[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC000413439417	534306901	/nfs/dbraw/zinc/30/69/01/534306901.db2.gz	NOCSLFPLRKFDGF-LLVKDONJSA-N	1	1	322.365	1.920	20	5		DDBDMO
CC(C)=CC[N@H+]1CCCC2(CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C2)C1	ZINC000981764252	696907091	/nfs/dbraw/zinc/90/70/91/696907091.db2.gz	QLLGWXPKIWECGS-ZIAGYGMSSA-N	1	1	307.394	1.542	20	5		DDBDMO
CC(C)=CC[N@@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC000981764252	696907094	/nfs/dbraw/zinc/90/70/94/696907094.db2.gz	QLLGWXPKIWECGS-ZIAGYGMSSA-N	1	1	307.394	1.542	20	5		DDBDMO
CC(C)=CC[N@H+]1CCCC2(CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)C1	ZINC000981764252	696907099	/nfs/dbraw/zinc/90/70/99/696907099.db2.gz	QLLGWXPKIWECGS-ZIAGYGMSSA-N	1	1	307.394	1.542	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[N@@H+](CCCC2CCC2)CC1	ZINC000981138129	697015625	/nfs/dbraw/zinc/01/56/25/697015625.db2.gz	LNAAXAWHSTUGFW-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@H+](CCCC2CCC2)CC1	ZINC000981138129	697015628	/nfs/dbraw/zinc/01/56/28/697015628.db2.gz	LNAAXAWHSTUGFW-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC[N@@H+](CCCC2CCC2)CC1	ZINC000981138129	697015631	/nfs/dbraw/zinc/01/56/31/697015631.db2.gz	LNAAXAWHSTUGFW-HUUCEWRRSA-N	1	1	309.410	1.766	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CC[C@H](c2ccccn2)C1	ZINC000799197737	700127954	/nfs/dbraw/zinc/12/79/54/700127954.db2.gz	HWWXMFINDHZMAN-ZDUSSCGKSA-N	1	1	314.345	1.641	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CCC[C@@H](C3OCCO3)C2)cc1	ZINC000776582955	698121548	/nfs/dbraw/zinc/12/15/48/698121548.db2.gz	XSCFOWVCVMUPSE-HIFRSBDPSA-N	1	1	322.361	1.713	20	5		DDBDMO
COCC[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000786193008	699133528	/nfs/dbraw/zinc/13/35/28/699133528.db2.gz	VYNCWUNIDXTWLO-LSDHHAIUSA-N	1	1	310.350	1.366	20	5		DDBDMO
C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000711786884	699259679	/nfs/dbraw/zinc/25/96/79/699259679.db2.gz	TYJPSVLBDALVAU-KCJUWKMLSA-N	1	1	318.782	1.771	20	5		DDBDMO
CC[N@H+]1CCC[C@H](CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)C1	ZINC000729528431	699481628	/nfs/dbraw/zinc/48/16/28/699481628.db2.gz	AUIBIBMLFQTZKY-GFCCVEGCSA-N	1	1	320.393	1.947	20	5		DDBDMO
CCc1n[nH]c(C(=O)NCCn2cc[nH+]c2C(C)C)c1[N+](=O)[O-]	ZINC000731808569	699537457	/nfs/dbraw/zinc/53/74/57/699537457.db2.gz	AHJMVSAJRVPVSS-UHFFFAOYSA-N	1	1	320.353	1.630	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1	ZINC000791255963	699617788	/nfs/dbraw/zinc/61/77/88/699617788.db2.gz	AWMIERYDCUSQTN-TZMCWYRMSA-N	1	1	322.340	1.435	20	5		DDBDMO
CC[N@H+](C[C@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000738077783	699751991	/nfs/dbraw/zinc/75/19/91/699751991.db2.gz	XDHDAEAERAANHA-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
CC[N@@H+](C[C@H]1CCOC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O	ZINC000738077783	699751993	/nfs/dbraw/zinc/75/19/93/699751993.db2.gz	XDHDAEAERAANHA-LLVKDONJSA-N	1	1	321.333	1.819	20	5		DDBDMO
CC[N@H+](CCOC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000742146464	699861657	/nfs/dbraw/zinc/86/16/57/699861657.db2.gz	FXZHBUSWCRVZLI-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
CC[N@@H+](CCOC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1	ZINC000742146464	699861658	/nfs/dbraw/zinc/86/16/58/699861658.db2.gz	FXZHBUSWCRVZLI-UHFFFAOYSA-N	1	1	305.338	1.779	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC[N@H+]1C	ZINC000801911958	700352236	/nfs/dbraw/zinc/35/22/36/700352236.db2.gz	WNCUUOLZMFWUOS-IUCAKERBSA-N	1	1	310.329	1.529	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1C(=O)N1CCc2c(cccc2[N+](=O)[O-])C1	ZINC000757643433	700667283	/nfs/dbraw/zinc/66/72/83/700667283.db2.gz	RLQRXNODJSVCMK-HNNXBMFYSA-N	1	1	303.362	1.964	20	5		DDBDMO
CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(F)cc1N	ZINC000804778276	701212404	/nfs/dbraw/zinc/21/24/04/701212404.db2.gz	RCRRTITVVUUBDL-JTQLQIEISA-N	1	1	324.356	1.920	20	5		DDBDMO
CC[C@@H](CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1	ZINC000839517582	701721955	/nfs/dbraw/zinc/72/19/55/701721955.db2.gz	RZZHLJPQMORYBF-ARFHVFGLSA-N	1	1	317.389	1.605	20	5		DDBDMO
CC[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1	ZINC000839517582	701721958	/nfs/dbraw/zinc/72/19/58/701721958.db2.gz	RZZHLJPQMORYBF-ARFHVFGLSA-N	1	1	317.389	1.605	20	5		DDBDMO
CC[C@@H](CNC(=O)[C@@H]1CC1[N+](=O)[O-])[N@H+]1CCc2ccccc2C1	ZINC000839517582	701721960	/nfs/dbraw/zinc/72/19/60/701721960.db2.gz	RZZHLJPQMORYBF-ARFHVFGLSA-N	1	1	317.389	1.605	20	5		DDBDMO
O=C(N[C@@H](C[NH+]1CCCCC1)c1ccccc1)[C@@H]1CC1[N+](=O)[O-]	ZINC000839689149	701784193	/nfs/dbraw/zinc/78/41/93/701784193.db2.gz	KJRUVWAFVXYWDJ-OWCLPIDISA-N	1	1	317.389	1.995	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000839700198	701789631	/nfs/dbraw/zinc/78/96/31/701789631.db2.gz	CUEOTLHVBXFTEC-ZGKBOVNRSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1	ZINC000839700198	701789635	/nfs/dbraw/zinc/78/96/35/701789635.db2.gz	CUEOTLHVBXFTEC-ZGKBOVNRSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])C[N@H+]1Cc1ccccc1	ZINC000839700198	701789639	/nfs/dbraw/zinc/78/96/39/701789639.db2.gz	CUEOTLHVBXFTEC-ZGKBOVNRSA-N	1	1	303.362	1.431	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CCC1(C)C	ZINC000866113167	706622211	/nfs/dbraw/zinc/62/22/11/706622211.db2.gz	VHOUPKIJDOOXIO-UHFFFAOYSA-N	1	1	306.366	1.614	20	5		DDBDMO
CO[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@](C)(CO)C1	ZINC000879262752	706633524	/nfs/dbraw/zinc/63/35/24/706633524.db2.gz	ZIIGSPRBXDKZJZ-ZNMIVQPWSA-N	1	1	310.350	1.100	20	5		DDBDMO
CO[C@@H]1CC[C@H](C)[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000879318736	706647875	/nfs/dbraw/zinc/64/78/75/706647875.db2.gz	ZXQJKCVZBWBBBP-DUVNUKRYSA-N	1	1	324.377	1.834	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@H](O)CNCCC[NH+]2CCC(O)CC2)cc1	ZINC000843062800	702811110	/nfs/dbraw/zinc/81/11/10/702811110.db2.gz	SHTBRKSEGNNHND-MRXNPFEDSA-N	1	1	323.393	1.065	20	5		DDBDMO
O=C1NCCO[C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000879717945	706768692	/nfs/dbraw/zinc/76/86/92/706768692.db2.gz	IPMYMPSAVXJLSN-LSDHHAIUSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C1NCCO[C@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@@H]12	ZINC000879717945	706768694	/nfs/dbraw/zinc/76/86/94/706768694.db2.gz	IPMYMPSAVXJLSN-LSDHHAIUSA-N	1	1	319.361	1.117	20	5		DDBDMO
O=C1CC[C@@H](C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)O1	ZINC000851844328	703868910	/nfs/dbraw/zinc/86/89/10/703868910.db2.gz	VVWGGNHIXBTEKE-PWSUYJOCSA-N	1	1	306.322	1.182	20	5		DDBDMO
O=C1CCC2=C(CC[N@H+](CCOc3cccc([N+](=O)[O-])c3)C2)N1	ZINC000852300568	704003694	/nfs/dbraw/zinc/00/36/94/704003694.db2.gz	SIQCZBPDVTVKMZ-UHFFFAOYSA-N	1	1	317.345	1.843	20	5		DDBDMO
CC(C)CC(=O)N1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000879759800	706782699	/nfs/dbraw/zinc/78/26/99/706782699.db2.gz	GFOQHTOKDOKPOV-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
CC(C)CC(=O)N1CCC[N@@H+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000879759800	706782701	/nfs/dbraw/zinc/78/27/01/706782701.db2.gz	GFOQHTOKDOKPOV-UHFFFAOYSA-N	1	1	323.397	1.372	20	5		DDBDMO
O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCc3[nH]cnc3C2)cc1	ZINC000819321830	704107434	/nfs/dbraw/zinc/10/74/34/704107434.db2.gz	OGRPXRRHNZKITM-ABAIWWIYSA-N	1	1	302.334	1.498	20	5		DDBDMO
CN(CC(F)(F)F)C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870865426	704149467	/nfs/dbraw/zinc/14/94/67/704149467.db2.gz	STLLLRBDWNVNPV-NSHDSACASA-N	1	1	305.256	1.789	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2ncncc2C1	ZINC000880599579	707034634	/nfs/dbraw/zinc/03/46/34/707034634.db2.gz	MVSJOOQDGYVKDD-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCc2ncncc2C1	ZINC000880599579	707034638	/nfs/dbraw/zinc/03/46/38/707034638.db2.gz	MVSJOOQDGYVKDD-UHFFFAOYSA-N	1	1	300.318	1.952	20	5		DDBDMO
CC[N@H+]1CCC[C@@H]1CNC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823970660	705347700	/nfs/dbraw/zinc/34/77/00/705347700.db2.gz	GTSFGJNGYMAYJE-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000824964403	705567896	/nfs/dbraw/zinc/56/78/96/705567896.db2.gz	VWNOIOZLDZVTJC-CQSZACIVSA-N	1	1	309.366	1.475	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825505812	705684066	/nfs/dbraw/zinc/68/40/66/705684066.db2.gz	WJPDOLFFQPLBBE-WFASDCNBSA-N	1	1	321.377	1.476	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000825676175	705712821	/nfs/dbraw/zinc/71/28/21/705712821.db2.gz	SVXIGNOGWGMSKD-HNNXBMFYSA-N	1	1	321.377	1.571	20	5		DDBDMO
CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000826128924	705775060	/nfs/dbraw/zinc/77/50/60/705775060.db2.gz	WOJMARZIEYJPRE-CABCVRRESA-N	1	1	321.377	1.427	20	5		DDBDMO
C[NH2+]CCOCCN(C)Cc1ccc([N+](=O)[O-])c(Cl)c1	ZINC000863647586	705976086	/nfs/dbraw/zinc/97/60/86/705976086.db2.gz	RAVWLMGBTGWYLU-UHFFFAOYSA-N	1	1	301.774	1.916	20	5		DDBDMO
C[C@@H](c1nc(-c2cccc([N+](=O)[O-])c2)no1)N1CC[NH2+]CC1=O	ZINC000863658567	705978709	/nfs/dbraw/zinc/97/87/09/705978709.db2.gz	QLMYIDPXKAIQGD-VIFPVBQESA-N	1	1	317.305	1.138	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CN(C(=O)COc3ccc([N+](=O)[O-])cc3)CC[C@H]21	ZINC000827363507	705985604	/nfs/dbraw/zinc/98/56/04/705985604.db2.gz	BBEAWCZSVYSKJX-IUODEOHRSA-N	1	1	319.361	1.526	20	5		DDBDMO
C[C@@](O)(C[C@H](O)C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303411	706352247	/nfs/dbraw/zinc/35/22/47/706352247.db2.gz	PYUXGDIMAGHWMI-WMLDXEAASA-N	1	1	320.389	1.865	20	5		DDBDMO
C[C@@](O)(C[C@H](O)C[N@H+]1CCc2c(cccc2[N+](=O)[O-])C1)C1CC1	ZINC000878303411	706352248	/nfs/dbraw/zinc/35/22/48/706352248.db2.gz	PYUXGDIMAGHWMI-WMLDXEAASA-N	1	1	320.389	1.865	20	5		DDBDMO
O=C1NCC[C@H]2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)[C@H]12	ZINC000880529343	707006007	/nfs/dbraw/zinc/00/60/07/707006007.db2.gz	KXXXSLPMKUJTRF-HIFRSBDPSA-N	1	1	303.362	1.738	20	5		DDBDMO
CC(C)[N@H+]1CCCC[C@@H]1COC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000837611756	707695747	/nfs/dbraw/zinc/69/57/47/707695747.db2.gz	GMNCJPJTUQDVIP-LLVKDONJSA-N	1	1	310.354	1.748	20	5		DDBDMO
C[C@@](O)(C[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(F)F	ZINC000885937583	708666604	/nfs/dbraw/zinc/66/66/04/708666604.db2.gz	DFZXYNPUAMLZTA-CYBMUJFWSA-N	1	1	316.308	1.128	20	5		DDBDMO
O=C1CCCN1C[C@H]1CCCC[N@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886006455	708680459	/nfs/dbraw/zinc/68/04/59/708680459.db2.gz	RNAMWAIJCAADHY-CQSZACIVSA-N	1	1	318.377	1.967	20	5		DDBDMO
O=C1CCCN1C[C@H]1CCCC[N@@H+]1Cc1cccnc1[N+](=O)[O-]	ZINC000886006455	708680462	/nfs/dbraw/zinc/68/04/62/708680462.db2.gz	RNAMWAIJCAADHY-CQSZACIVSA-N	1	1	318.377	1.967	20	5		DDBDMO
O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](n2ccnn2)CC1	ZINC000886281192	708735059	/nfs/dbraw/zinc/73/50/59/708735059.db2.gz	UOLBDRODCAYVDC-CYBMUJFWSA-N	1	1	302.338	1.809	20	5		DDBDMO
C[C@@H]1[C@H](NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)CC[N@H+]1C	ZINC000928459993	713206131	/nfs/dbraw/zinc/20/61/31/713206131.db2.gz	YYGSZSDOSAXUHI-ZWNOBZJWSA-N	1	1	317.349	1.153	20	5		DDBDMO
C[N@@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C[C@H]1CO	ZINC000894881093	711306995	/nfs/dbraw/zinc/30/69/95/711306995.db2.gz	IRAHLWBGJMNFCI-JTQLQIEISA-N	1	1	301.293	1.645	20	5		DDBDMO
C[N@H+]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C[C@H]1CO	ZINC000894881093	711306999	/nfs/dbraw/zinc/30/69/99/711306999.db2.gz	IRAHLWBGJMNFCI-JTQLQIEISA-N	1	1	301.293	1.645	20	5		DDBDMO
C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000913535301	713248303	/nfs/dbraw/zinc/24/83/03/713248303.db2.gz	FZFIZYHYIQJZSB-PHIMTYICSA-N	1	1	319.317	1.242	20	5		DDBDMO
C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000913535301	713248304	/nfs/dbraw/zinc/24/83/04/713248304.db2.gz	FZFIZYHYIQJZSB-PHIMTYICSA-N	1	1	319.317	1.242	20	5		DDBDMO
CON(C)C(=O)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000895046281	711384931	/nfs/dbraw/zinc/38/49/31/711384931.db2.gz	HILFMTPJEGVYHN-UHFFFAOYSA-N	1	1	321.255	1.723	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@@H]1C[N@@H+](C)CCN1C	ZINC000895245596	711463542	/nfs/dbraw/zinc/46/35/42/711463542.db2.gz	GOMIIKIAYJDLQL-PWSUYJOCSA-N	1	1	310.402	1.166	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NCC[NH+]2CCSCC2)c1C	ZINC000896326450	711706795	/nfs/dbraw/zinc/70/67/95/711706795.db2.gz	ZBOAYQHKMFFFPJ-UHFFFAOYSA-N	1	1	323.418	1.990	20	5		DDBDMO
Cc1ccc(NC(=O)C2CN(C)CC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000905032444	711913985	/nfs/dbraw/zinc/91/39/85/711913985.db2.gz	LOPUCTPNMDPOTN-UHFFFAOYSA-N	1	1	306.366	1.335	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)c1C	ZINC000908347228	712748212	/nfs/dbraw/zinc/74/82/12/712748212.db2.gz	KRPHHXCWHVBQRK-TZMCWYRMSA-N	1	1	303.362	1.988	20	5		DDBDMO
CC[C@@H]([NH2+]CC[N+](=O)[O-])c1ccccc1OCC(=O)N(C)C	ZINC000930202512	713777157	/nfs/dbraw/zinc/77/71/57/713777157.db2.gz	WTNVJOJQWGVIEH-CYBMUJFWSA-N	1	1	309.366	1.471	20	5		DDBDMO
O=[N+]([O-])CCN1CCO[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]21	ZINC000930849526	713936917	/nfs/dbraw/zinc/93/69/17/713936917.db2.gz	NISJLVXVZGMSAN-CVEARBPZSA-N	1	1	305.378	1.238	20	5		DDBDMO
COC1(OC)CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H]1O	ZINC000931632931	714144352	/nfs/dbraw/zinc/14/43/52/714144352.db2.gz	DEQAEMIBSLUKBM-CYBMUJFWSA-N	1	1	314.313	1.290	20	5		DDBDMO
COC1(OC)CC[N@@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C[C@H]1O	ZINC000931632931	714144354	/nfs/dbraw/zinc/14/43/54/714144354.db2.gz	DEQAEMIBSLUKBM-CYBMUJFWSA-N	1	1	314.313	1.290	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CC[C@H](C1)N2C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000931721893	714169062	/nfs/dbraw/zinc/16/90/62/714169062.db2.gz	WPQWWTOELQBWDM-IMJJTQAJSA-N	1	1	305.378	1.797	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CCO1	ZINC000932346792	714315003	/nfs/dbraw/zinc/31/50/03/714315003.db2.gz	KUWZHCYPKDBHCG-CHWSQXEVSA-N	1	1	310.350	1.445	20	5		DDBDMO
CCOC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000932644238	714373667	/nfs/dbraw/zinc/37/36/67/714373667.db2.gz	HKPUXNHGSIEVEU-TZMCWYRMSA-N	1	1	308.334	1.513	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933218345	714539559	/nfs/dbraw/zinc/53/95/59/714539559.db2.gz	QVGVFUVUDKIYSE-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
CC[C@@H]1C(=O)NCCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000933218345	714539562	/nfs/dbraw/zinc/53/95/62/714539562.db2.gz	QVGVFUVUDKIYSE-KGLIPLIRSA-N	1	1	307.350	1.229	20	5		DDBDMO
COC[C@@H]1COCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000933329468	714563585	/nfs/dbraw/zinc/56/35/85/714563585.db2.gz	JCPKNKSIYRPADB-GFCCVEGCSA-N	1	1	323.349	1.271	20	5		DDBDMO
COC[C@@H]1COCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000933329468	714563587	/nfs/dbraw/zinc/56/35/87/714563587.db2.gz	JCPKNKSIYRPADB-GFCCVEGCSA-N	1	1	323.349	1.271	20	5		DDBDMO
CN1CCN(CCOc2ccc([N+](=O)[O-])cc2)CC[N@@H+](C)CC1	ZINC000933996582	714718206	/nfs/dbraw/zinc/71/82/06/714718206.db2.gz	PXNWHGCECQNGLD-UHFFFAOYSA-N	1	1	322.409	1.153	20	5		DDBDMO
Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@@H+](C)CCO	ZINC000924999438	714721667	/nfs/dbraw/zinc/72/16/67/714721667.db2.gz	OZQWHORYZAMFPL-UHFFFAOYSA-N	1	1	309.366	1.174	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@H]2CC[C@@H]2OC)c1	ZINC000934104979	714742105	/nfs/dbraw/zinc/74/21/05/714742105.db2.gz	APFMXUDUWLBOLA-KGLIPLIRSA-N	1	1	308.334	1.991	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H]2CC[C@@H]2OC)c1	ZINC000934104979	714742107	/nfs/dbraw/zinc/74/21/07/714742107.db2.gz	APFMXUDUWLBOLA-KGLIPLIRSA-N	1	1	308.334	1.991	20	5		DDBDMO
O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)cs1	ZINC000934258096	714777916	/nfs/dbraw/zinc/77/79/16/714777916.db2.gz	PWLFCIIGQNUBOP-CHWSQXEVSA-N	1	1	311.407	1.687	20	5		DDBDMO
CC(C)[NH+]1CC(NC(=O)[C@@H]2C[C@H]2c2cccc([N+](=O)[O-])c2)C1	ZINC000935479319	715065659	/nfs/dbraw/zinc/06/56/59/715065659.db2.gz	SQXNEUMYGXWSBY-LSDHHAIUSA-N	1	1	303.362	1.907	20	5		DDBDMO
C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3ccccc3[N+](=O)[O-])[C@H]2C1	ZINC001121198265	782404704	/nfs/dbraw/zinc/40/47/04/782404704.db2.gz	GKCMRVLRHFYRKH-IHRRRGAJSA-N	1	1	303.362	1.594	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(c2nnc(CCC[N+](=O)[O-])n2C)C1	ZINC001121288400	782442688	/nfs/dbraw/zinc/44/26/88/782442688.db2.gz	CYDDJYPFDMKZFX-ZDUSSCGKSA-N	1	1	324.429	1.193	20	5		DDBDMO
CC[N@H+]1CCCN(c2nnc(-c3c[nH]c([N+](=O)[O-])c3)n2C)CC1	ZINC001121373653	782478854	/nfs/dbraw/zinc/47/88/54/782478854.db2.gz	LFRUJCFBEZQPSL-UHFFFAOYSA-N	1	1	319.369	1.250	20	5		DDBDMO
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CCCC1	ZINC001029304635	740550230	/nfs/dbraw/zinc/55/02/30/740550230.db2.gz	CZLBEVJGSOKNBQ-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@H+]2CCC1CCCC1	ZINC001029304635	740550232	/nfs/dbraw/zinc/55/02/32/740550232.db2.gz	CZLBEVJGSOKNBQ-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1C[C@H]2CC[C@@H](C1)[N@@H+]2CCC1CCCC1	ZINC001029304635	740550234	/nfs/dbraw/zinc/55/02/34/740550234.db2.gz	CZLBEVJGSOKNBQ-QKPAOTATSA-N	1	1	321.421	1.907	20	5		DDBDMO
COc1c(O)ccc(CN[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@H]23)c1[N+](=O)[O-]	ZINC001184387307	744031368	/nfs/dbraw/zinc/03/13/68/744031368.db2.gz	IVUBZHDSDNQJDB-FRRDWIJNSA-N	1	1	321.377	1.739	20	5		DDBDMO
Cc1ncc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cn1	ZINC001196907726	747005641	/nfs/dbraw/zinc/00/56/41/747005641.db2.gz	NBUJEVPDRIVBAJ-HNNXBMFYSA-N	1	1	302.334	1.691	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197660398	747225332	/nfs/dbraw/zinc/22/53/32/747225332.db2.gz	NSAYYRJGWARKMI-AAEUAGOBSA-N	1	1	309.322	1.059	20	5		DDBDMO
COC(=O)N[C@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC001197660398	747225339	/nfs/dbraw/zinc/22/53/39/747225339.db2.gz	NSAYYRJGWARKMI-AAEUAGOBSA-N	1	1	309.322	1.059	20	5		DDBDMO
CNC(=O)N[C@@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC001197748165	747256866	/nfs/dbraw/zinc/25/68/66/747256866.db2.gz	FUHOXDCGGBAONO-GFCCVEGCSA-N	1	1	322.365	1.367	20	5		DDBDMO
CC[N@@H+](CCC(=O)NC)CCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC001198362442	747464739	/nfs/dbraw/zinc/46/47/39/747464739.db2.gz	FEJDGXAMZVLHLN-UHFFFAOYSA-N	1	1	322.365	1.381	20	5		DDBDMO
O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(C[NH2+]Cc2nccs2)CC1	ZINC000997770737	751271328	/nfs/dbraw/zinc/27/13/28/751271328.db2.gz	YDVIHHRHWSMRKJ-VXGBXAGGSA-N	1	1	324.406	1.137	20	5		DDBDMO
CCOC[C@@H]1C[N@H+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)Cc2c1cnn2C	ZINC001169019488	762199929	/nfs/dbraw/zinc/19/99/29/762199929.db2.gz	ISKAINDYZWOEGU-HZSPNIEDSA-N	1	1	322.409	1.801	20	5		DDBDMO
O=C(N1CCCC1)C12CC(C1)C[N@@H+]2[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169026251	762203177	/nfs/dbraw/zinc/20/31/77/762203177.db2.gz	WOEASBNNHKOJIK-PGOFDVKTSA-N	1	1	307.394	1.519	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169055297	762210308	/nfs/dbraw/zinc/21/03/08/762210308.db2.gz	PBRHVCPJGUSICP-RWMBFGLXSA-N	1	1	300.355	1.086	20	5		DDBDMO
COC(=O)CC[C@@H]1COCC[N@H+]1[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169055297	762210310	/nfs/dbraw/zinc/21/03/10/762210310.db2.gz	PBRHVCPJGUSICP-RWMBFGLXSA-N	1	1	300.355	1.086	20	5		DDBDMO
O=C(NC[C@H]1C[C@@H]([NH2+]CCC2CCCC2)C1)[C@@H]1CC1[N+](=O)[O-]	ZINC001086084214	760945060	/nfs/dbraw/zinc/94/50/60/760945060.db2.gz	ICMUPYPDWRBNDT-LXTVHRRPSA-N	1	1	309.410	1.716	20	5		DDBDMO
Cc1nc(Cl)nc(N2C[C@H]3[C@H](C2)CCC[N@@H+]3C)c1[N+](=O)[O-]	ZINC001157261461	764729496	/nfs/dbraw/zinc/72/94/96/764729496.db2.gz	RJNHITOONJUISB-UWVGGRQHSA-N	1	1	311.773	1.877	20	5		DDBDMO
COC(=O)c1ncc([N+](=O)[O-])cc1N[C@H]1C[C@H]2CC[N@@H+](C1)[C@H]2C	ZINC001170981380	772013628	/nfs/dbraw/zinc/01/36/28/772013628.db2.gz	XCSORZBTIRPWPT-AXFHLTTASA-N	1	1	320.349	1.671	20	5		DDBDMO
Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[NH+](C3CCC3)CC2)n1	ZINC001136768426	772138257	/nfs/dbraw/zinc/13/82/57/772138257.db2.gz	CBBMCHINPPAWHF-UHFFFAOYSA-N	1	1	304.350	1.609	20	5		DDBDMO
CC[N@@H+](C)CCC(=O)NCCCNc1ccc([N+](=O)[O-])cn1	ZINC001094573830	776049552	/nfs/dbraw/zinc/04/95/52/776049552.db2.gz	HTGLOVWVCSCNSR-UHFFFAOYSA-N	1	1	309.370	1.250	20	5		DDBDMO
Cc1ccc(C[N@@H+]2CC[C@H]3COC(=O)N[C@@H]3C2)cc1[N+](=O)[O-]	ZINC001171746261	776441842	/nfs/dbraw/zinc/44/18/42/776441842.db2.gz	VJDWDDHISLRHKA-QWHCGFSZSA-N	1	1	305.334	1.834	20	5		DDBDMO
Cc1ccc(C[N@H+]2CC[C@H]3COC(=O)N[C@@H]3C2)cc1[N+](=O)[O-]	ZINC001171746261	776441851	/nfs/dbraw/zinc/44/18/51/776441851.db2.gz	VJDWDDHISLRHKA-QWHCGFSZSA-N	1	1	305.334	1.834	20	5		DDBDMO
CN1CC[N@@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O	ZINC001172907722	776918335	/nfs/dbraw/zinc/91/83/35/776918335.db2.gz	HTUMYLPHWJRARA-AWEZNQCLSA-N	1	1	303.362	1.616	20	5		DDBDMO
CN1CC[N@H+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1=O	ZINC001172907722	776918343	/nfs/dbraw/zinc/91/83/43/776918343.db2.gz	HTUMYLPHWJRARA-AWEZNQCLSA-N	1	1	303.362	1.616	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](S(C)(=O)=O)C1	ZINC001173227214	777062580	/nfs/dbraw/zinc/06/25/80/777062580.db2.gz	OJTNPPXIAJJMPZ-SMDDNHRTSA-N	1	1	312.391	1.645	20	5		DDBDMO
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](S(C)(=O)=O)C1	ZINC001173227214	777062582	/nfs/dbraw/zinc/06/25/82/777062582.db2.gz	OJTNPPXIAJJMPZ-SMDDNHRTSA-N	1	1	312.391	1.645	20	5		DDBDMO
CCC[N@@H+](C)CCC(=O)N(C)CCNc1ccc([N+](=O)[O-])cn1	ZINC001101712685	777424337	/nfs/dbraw/zinc/42/43/37/777424337.db2.gz	HTKDAYISWNFGFA-UHFFFAOYSA-N	1	1	323.397	1.592	20	5		DDBDMO
C[NH+](C)Cc1cc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)no1	ZINC001120352768	781889459	/nfs/dbraw/zinc/88/94/59/781889459.db2.gz	DHVLJQYQHAACED-UHFFFAOYSA-N	1	1	316.317	1.847	20	5		DDBDMO
CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](CCCCCF)CC1	ZINC001270225648	842401161	/nfs/dbraw/zinc/40/11/61/842401161.db2.gz	LRIAMVMNIYQHDM-CHWSQXEVSA-N	1	1	315.389	1.762	20	5		DDBDMO
Cc1nc(NCC2(N(C)C)CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC001156176392	862777567	/nfs/dbraw/zinc/77/75/67/862777567.db2.gz	LQRYZHHQEMYXKL-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH2+]CCNC(=O)C1CCCCC1	ZINC001122822517	858981793	/nfs/dbraw/zinc/98/17/93/858981793.db2.gz	WDAONCUZFGLKKV-UHFFFAOYSA-N	1	1	309.370	1.114	20	5		DDBDMO
CNc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1	ZINC001157621053	863980720	/nfs/dbraw/zinc/98/07/20/863980720.db2.gz	UIFPXGPEYQBEJQ-BZNIZROVSA-N	1	1	318.377	1.660	20	5		DDBDMO
Cc1cc(C[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])c(C)s1	ZINC001157775227	864128456	/nfs/dbraw/zinc/12/84/56/864128456.db2.gz	LPDHDLGJYAEACT-CHWSQXEVSA-N	1	1	311.407	1.626	20	5		DDBDMO
CCc1ccc(CC[NH2+]CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1	ZINC001157775281	864131711	/nfs/dbraw/zinc/13/17/11/864131711.db2.gz	NMQBOGBJFBNCBG-HZPDHXFCSA-N	1	1	319.405	1.553	20	5		DDBDMO
N[C@@H](CCC[NH3+])Nc1ccc(-c2ccc(F)c([N+](=O)[O-])c2)nn1	ZINC001159788821	865524876	/nfs/dbraw/zinc/52/48/76/865524876.db2.gz	MPZWYXBMOSXBFE-CYBMUJFWSA-N	1	1	320.328	1.627	20	5		DDBDMO
Nc1cc([N+](=O)[O-])cnc1N[C@H]1CCC[C@@H]1[NH+]1CCOCC1	ZINC001160724982	866074278	/nfs/dbraw/zinc/07/42/78/866074278.db2.gz	NMQYNTXITJZPPM-STQMWFEESA-N	1	1	307.354	1.237	20	5		DDBDMO
C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCCNC1=O	ZINC001320080721	866458300	/nfs/dbraw/zinc/45/83/00/866458300.db2.gz	LLIAVZGHETUNQD-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCCNC1=O	ZINC001320080721	866458301	/nfs/dbraw/zinc/45/83/01/866458301.db2.gz	LLIAVZGHETUNQD-UONOGXRCSA-N	1	1	307.350	1.229	20	5		DDBDMO
COc1cc(NCCC[NH+]2CCN(C)CC2)cnc1[N+](=O)[O-]	ZINC001161709700	866921857	/nfs/dbraw/zinc/92/18/57/866921857.db2.gz	FNTIJBAONRFYJQ-UHFFFAOYSA-N	1	1	309.370	1.048	20	5		DDBDMO
C[N@@H+]1CCc2c(NCC(=O)NC3CC3)ccc([N+](=O)[O-])c2C1	ZINC001161897882	867080801	/nfs/dbraw/zinc/08/08/01/867080801.db2.gz	VRTIPZLOJOKLOF-UHFFFAOYSA-N	1	1	304.350	1.273	20	5		DDBDMO
C[N@H+]1CCc2c(NCC(=O)NC3CC3)ccc([N+](=O)[O-])c2C1	ZINC001161897882	867080819	/nfs/dbraw/zinc/08/08/19/867080819.db2.gz	VRTIPZLOJOKLOF-UHFFFAOYSA-N	1	1	304.350	1.273	20	5		DDBDMO
C[N@@H+]1CCO[C@@H](CNc2cc3cccnc3c([N+](=O)[O-])c2)C1	ZINC001162689391	867738282	/nfs/dbraw/zinc/73/82/82/867738282.db2.gz	FILYUIMRDNKPCC-ZDUSSCGKSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@H+]1CCO[C@@H](CNc2cc3cccnc3c([N+](=O)[O-])c2)C1	ZINC001162689391	867738300	/nfs/dbraw/zinc/73/83/00/867738300.db2.gz	FILYUIMRDNKPCC-ZDUSSCGKSA-N	1	1	302.334	1.886	20	5		DDBDMO
C[N@@H+]1CCN(c2cc([N+](=O)[O-])cc[n+]2[O-])[C@@H](c2ccccc2)C1	ZINC001163668764	868611084	/nfs/dbraw/zinc/61/10/84/868611084.db2.gz	DUYFTYCLTONGJZ-OAHLLOKOSA-N	1	1	314.345	1.721	20	5		DDBDMO
C[N@H+]1CCN(c2cc([N+](=O)[O-])cc[n+]2[O-])[C@@H](c2ccccc2)C1	ZINC001163668764	868611091	/nfs/dbraw/zinc/61/10/91/868611091.db2.gz	DUYFTYCLTONGJZ-OAHLLOKOSA-N	1	1	314.345	1.721	20	5		DDBDMO
COc1c(O)ccc(CN2CC[C@H]3C[N@@H+](C)C[C@H]32)c1[N+](=O)[O-]	ZINC001336813277	869159581	/nfs/dbraw/zinc/15/95/81/869159581.db2.gz	PMLCHDQIIZKRHG-CMPLNLGQSA-N	1	1	307.350	1.445	20	5		DDBDMO
COC(=O)Cc1ccc(O[C@H]2CCC[N@@H+](C)C2)c([N+](=O)[O-])c1	ZINC001226213699	882283092	/nfs/dbraw/zinc/28/30/92/882283092.db2.gz	FTWKUEIRTOLYTK-LBPRGKRZSA-N	1	1	308.334	1.783	20	5		DDBDMO
Cn1ccc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)n1	ZINC001317470688	870891885	/nfs/dbraw/zinc/89/18/85/870891885.db2.gz	WGOFBXZYPPLFRM-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
Cn1ccc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)n1	ZINC001317470688	870891893	/nfs/dbraw/zinc/89/18/93/870891893.db2.gz	WGOFBXZYPPLFRM-UHFFFAOYSA-N	1	1	317.349	1.190	20	5		DDBDMO
CCn1c([C@@H](C)[N+](=O)[O-])nnc1N1CC[N@@H+](C)[C@@H](C(C)C)C1	ZINC001340124499	870906229	/nfs/dbraw/zinc/90/62/29/870906229.db2.gz	TXWUGSXWXVWOAL-VXGBXAGGSA-N	1	1	310.402	1.412	20	5		DDBDMO
CC[C@H](C(=O)NCC(=O)c1ccc(OC)c([N+](=O)[O-])c1)[NH+](C)C	ZINC001302304393	871054706	/nfs/dbraw/zinc/05/47/06/871054706.db2.gz	WLYHZALIWZJCGO-LLVKDONJSA-N	1	1	323.349	1.243	20	5		DDBDMO
C[N@@H+]1[C@@H]2C[C@H](Oc3cc(Cl)c([N+](=O)[O-])cn3)[C@H]1CC(=O)C2	ZINC001226915491	882717938	/nfs/dbraw/zinc/71/79/38/882717938.db2.gz	KTSXKBJMMYWYJA-KOLSJAJHSA-N	1	1	311.725	1.826	20	5		DDBDMO
C[N@H+]1[C@@H]2C[C@H](Oc3cc(Cl)c([N+](=O)[O-])cn3)[C@H]1CC(=O)C2	ZINC001226915491	882717942	/nfs/dbraw/zinc/71/79/42/882717942.db2.gz	KTSXKBJMMYWYJA-KOLSJAJHSA-N	1	1	311.725	1.826	20	5		DDBDMO
COC(=O)c1cnc(NCCc2[nH+]ccn2C)c([N+](=O)[O-])c1	ZINC001347773070	874270732	/nfs/dbraw/zinc/27/07/32/874270732.db2.gz	SQEKEWHCFBISFR-UHFFFAOYSA-N	1	1	305.294	1.165	20	5		DDBDMO
CC[N@H+]1C[C@H](C)N(c2nnc(C[N+](=O)[O-])n2CC(C)C)C[C@@H]1C	ZINC001358057080	880309771	/nfs/dbraw/zinc/30/97/71/880309771.db2.gz	HAQALPNFXSKUHY-STQMWFEESA-N	1	1	324.429	1.630	20	5		DDBDMO
CC[N@H+]1CC[C@@H](Oc2n[nH]c(=O)c3cccc([N+](=O)[O-])c32)C1	ZINC001229368139	883949067	/nfs/dbraw/zinc/94/90/67/883949067.db2.gz	WYYFWUAQYIARTN-SECBINFHSA-N	1	1	304.306	1.717	20	5		DDBDMO
CO[C@@H]1CC[N@@H+](CCOc2c([N+](=O)[O-])cccc2[N+](=O)[O-])C1	ZINC001230314046	884427851	/nfs/dbraw/zinc/42/78/51/884427851.db2.gz	CTXSULIQRFABJS-SNVBAGLBSA-N	1	1	311.294	1.603	20	5		DDBDMO
CN(C)C[C@@]12C[C@@H]1C[N@@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254608192	896530496	/nfs/dbraw/zinc/53/04/96/896530496.db2.gz	PGQNOMMONJWUSZ-HYVNUMGLSA-N	1	1	301.390	1.946	20	5		DDBDMO
CN(C)C[C@@]12C[C@@H]1C[N@H+]([C@H]1Cc3ccc([N+](=O)[O-])cc3C1)C2	ZINC001254608192	896530510	/nfs/dbraw/zinc/53/05/10/896530510.db2.gz	PGQNOMMONJWUSZ-HYVNUMGLSA-N	1	1	301.390	1.946	20	5		DDBDMO
COc1cc(N2CCC([NH+]3CC(O)C3)CC2)ccc1[N+](=O)[O-]	ZINC001256093245	897280843	/nfs/dbraw/zinc/28/08/43/897280843.db2.gz	IVLCMWMKNREVSM-UHFFFAOYSA-N	1	1	307.350	1.249	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H](C)[C@@H](O)C1	ZINC000305761235	231042283	/nfs/dbraw/zinc/04/22/83/231042283.db2.gz	LIASSDBOXRMLCT-NHYWBVRUSA-N	1	1	321.377	1.935	20	5		DDBDMO
CN(C)C(=O)N[C@H]1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000451997254	231263043	/nfs/dbraw/zinc/26/30/43/231263043.db2.gz	QZZUIUZCNYGOID-AWEZNQCLSA-N	1	1	320.393	1.873	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@H](O)C[C@H](C)C1	ZINC000452073134	231289887	/nfs/dbraw/zinc/28/98/87/231289887.db2.gz	YKGHVHLIJPLEDC-GXFFZTMASA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@H](O)C[C@H](C)C1	ZINC000452073134	231289892	/nfs/dbraw/zinc/28/98/92/231289892.db2.gz	YKGHVHLIJPLEDC-GXFFZTMASA-N	1	1	307.350	1.544	20	5		DDBDMO
CC1(C)CN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCO	ZINC000614894892	362066900	/nfs/dbraw/zinc/06/69/00/362066900.db2.gz	LRABOULHZYJKHX-UHFFFAOYSA-N	1	1	321.377	1.052	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@@H](O)C[NH2+]Cc2ncccc2F)c1	ZINC000563704743	303971772	/nfs/dbraw/zinc/97/17/72/303971772.db2.gz	ASLCXXANTGXRMN-LBPRGKRZSA-N	1	1	321.308	1.658	20	5		DDBDMO
CC(C)[N@H+]1CCCN(C(=O)Nc2ccncc2[N+](=O)[O-])CC1	ZINC000272763720	210167130	/nfs/dbraw/zinc/16/71/30/210167130.db2.gz	WBAOFVNKUJJREI-UHFFFAOYSA-N	1	1	307.354	1.938	20	5		DDBDMO
Cc1nn(CCC(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(C)c1[N+](=O)[O-]	ZINC000330889535	232140381	/nfs/dbraw/zinc/14/03/81/232140381.db2.gz	BJXQGIRQTPTWCZ-ZWNOBZJWSA-N	1	1	323.397	1.397	20	5		DDBDMO
COc1cc(C[NH2+]C[C@@H](O)C(F)(F)F)c([N+](=O)[O-])cc1O	ZINC000616487186	362721320	/nfs/dbraw/zinc/72/13/20/362721320.db2.gz	ADBIFTWBICMOMZ-SNVBAGLBSA-N	1	1	310.228	1.322	20	5		DDBDMO
CN(C[C@H]1CCC[N@H+](C)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272582821	210000269	/nfs/dbraw/zinc/00/02/69/210000269.db2.gz	UKZSLMFTBDSIEX-NSHDSACASA-N	1	1	307.350	1.714	20	5		DDBDMO
CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000272582821	210000273	/nfs/dbraw/zinc/00/02/73/210000273.db2.gz	UKZSLMFTBDSIEX-NSHDSACASA-N	1	1	307.350	1.714	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)NCC[N@@H+]2CC=CCC2)c1	ZINC000279946088	215260620	/nfs/dbraw/zinc/26/06/20/215260620.db2.gz	HYWYGQWQOOSCGL-UHFFFAOYSA-N	1	1	305.334	1.595	20	5		DDBDMO
C[C@H]1CSCC[N@H+]1C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000181902570	186216785	/nfs/dbraw/zinc/21/67/85/186216785.db2.gz	PZPFXNFINAYNEN-RYUDHWBXSA-N	1	1	312.391	1.772	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](O)C1	ZINC000041886283	352317558	/nfs/dbraw/zinc/31/75/58/352317558.db2.gz	YPAKYRCCMLCUDM-ZDUSSCGKSA-N	1	1	307.350	1.689	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000041951217	352319796	/nfs/dbraw/zinc/31/97/96/352319796.db2.gz	LVBMDWDRYWRRRE-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CCN1CC[NH+](CCCNC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000041443589	352308444	/nfs/dbraw/zinc/30/84/44/352308444.db2.gz	BTHRCDNKNVOQJP-UHFFFAOYSA-N	1	1	320.393	1.352	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)C1	ZINC000491564789	234204885	/nfs/dbraw/zinc/20/48/85/234204885.db2.gz	ZAIKOVMKVHMVPY-GJBLVYBDSA-N	1	1	319.361	1.445	20	5		DDBDMO
O=C(COc1ccccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@@H]12	ZINC000060567937	352876721	/nfs/dbraw/zinc/87/67/21/352876721.db2.gz	DHVZYKURDPKTGB-STQMWFEESA-N	1	1	319.361	1.717	20	5		DDBDMO
COc1ccc(OCC[N@@H+](C)Cc2cnn(C)c2)c([N+](=O)[O-])c1	ZINC000173456774	198216695	/nfs/dbraw/zinc/21/66/95/198216695.db2.gz	QUUWPPBPDQPCLI-UHFFFAOYSA-N	1	1	320.349	1.848	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@H](O)C[N@H+]2CCc3ccccc3C2)c1	ZINC000174645630	198364697	/nfs/dbraw/zinc/36/46/97/198364697.db2.gz	NWSRAKGOBRQMNQ-OAHLLOKOSA-N	1	1	302.334	1.211	20	5		DDBDMO
CNC(=O)c1ccc(NCCCn2cc[nH+]c2C)c([N+](=O)[O-])c1	ZINC000078333264	353511135	/nfs/dbraw/zinc/51/11/35/353511135.db2.gz	TULKIVROYPKMOI-UHFFFAOYSA-N	1	1	317.349	1.962	20	5		DDBDMO
O=C(NCC1CCN(c2cc[nH+]cc2)CC1)[C@H]1CC1[N+](=O)[O-]	ZINC000093064736	353884289	/nfs/dbraw/zinc/88/42/89/353884289.db2.gz	SUAKRCKROVPJES-UONOGXRCSA-N	1	1	304.350	1.079	20	5		DDBDMO
C[N@H+](CCCO)C1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000093394638	353899645	/nfs/dbraw/zinc/89/96/45/353899645.db2.gz	JZPOWOXWUYJNOH-UHFFFAOYSA-N	1	1	323.393	1.579	20	5		DDBDMO
C[N@@H+](CCCO)C1CCN(Cc2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000093394638	353899650	/nfs/dbraw/zinc/89/96/50/353899650.db2.gz	JZPOWOXWUYJNOH-UHFFFAOYSA-N	1	1	323.393	1.579	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2CC[N@@H+](C)C[C@H]21	ZINC000277039176	213257530	/nfs/dbraw/zinc/25/75/30/213257530.db2.gz	HBIMQNHJZWFVRB-SMDDNHRTSA-N	1	1	319.361	1.770	20	5		DDBDMO
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[N@H+](C)CCO1	ZINC000157514849	354225427	/nfs/dbraw/zinc/22/54/27/354225427.db2.gz	GGKZTTCZVMWCFS-ZANVPECISA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)[C@@H]1C[N@@H+](C)CCO1	ZINC000157514849	354225429	/nfs/dbraw/zinc/22/54/29/354225429.db2.gz	GGKZTTCZVMWCFS-ZANVPECISA-N	1	1	311.313	1.183	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H](O)C1CC1	ZINC000305721029	354471247	/nfs/dbraw/zinc/47/12/47/354471247.db2.gz	IIVOKQRTTSZROA-IINYFYTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](O)C1CC1	ZINC000305721029	354471248	/nfs/dbraw/zinc/47/12/48/354471248.db2.gz	IIVOKQRTTSZROA-IINYFYTJSA-N	1	1	307.350	1.625	20	5		DDBDMO
CNC(=O)CCC[N@@H+](C)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC000589503690	354997743	/nfs/dbraw/zinc/99/77/43/354997743.db2.gz	YFXXOFNDXMZPEO-UHFFFAOYSA-N	1	1	323.349	1.339	20	5		DDBDMO
CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000590655918	355138611	/nfs/dbraw/zinc/13/86/11/355138611.db2.gz	MZFNRPSVYUMKFS-DGCLKSJQSA-N	1	1	322.361	1.959	20	5		DDBDMO
Cc1cc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2C)c([N+](=O)[O-])s1	ZINC000601319467	358494037	/nfs/dbraw/zinc/49/40/37/358494037.db2.gz	AXZIRYGWOHCPEL-SECBINFHSA-N	1	1	319.408	1.337	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC000332655732	235249360	/nfs/dbraw/zinc/24/93/60/235249360.db2.gz	VPKMKKBQWMATET-LLVKDONJSA-N	1	1	305.334	1.524	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CCC[C@H]([C@@H]3CCC[NH2+]C3)C2)c1[N+](=O)[O-]	ZINC000592256414	355548319	/nfs/dbraw/zinc/54/83/19/355548319.db2.gz	YYVKIUTXUBTMKW-NEPJUHHUSA-N	1	1	321.381	1.478	20	5		DDBDMO
CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C)C1	ZINC000592828686	355704763	/nfs/dbraw/zinc/70/47/63/355704763.db2.gz	HXVCOXXEHNZCCA-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
CCCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1	ZINC000592828686	355704764	/nfs/dbraw/zinc/70/47/64/355704764.db2.gz	HXVCOXXEHNZCCA-LBPRGKRZSA-N	1	1	307.350	1.857	20	5		DDBDMO
COC(=O)c1ccc([N+](=O)[O-])c(CN2C[C@@H](C)[N@@H+](C)C[C@@H]2C)c1	ZINC000593018888	355771280	/nfs/dbraw/zinc/77/12/80/355771280.db2.gz	BRLLJQBFZKGJGX-NEPJUHHUSA-N	1	1	321.377	1.906	20	5		DDBDMO
CC[C@@H]1C[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H](CC)CO1	ZINC000593060281	355783712	/nfs/dbraw/zinc/78/37/12/355783712.db2.gz	ZYKUJZVPGOESJM-FPMFFAJLSA-N	1	1	312.370	1.042	20	5		DDBDMO
C[C@@H]1[C@H](C)N(C(=O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C[N@H+]1C	ZINC000593187720	355819807	/nfs/dbraw/zinc/81/98/07/355819807.db2.gz	OIVRHKYZESLSSV-XQQFMLRXSA-N	1	1	321.377	1.913	20	5		DDBDMO
C[C@@H]1C[C@H](NC(=O)Cc2ccc(F)cc2[N+](=O)[O-])CC[N@H+]1C	ZINC000593485967	355900115	/nfs/dbraw/zinc/90/01/15/355900115.db2.gz	DRZSJBMUUCYXHG-ZWNOBZJWSA-N	1	1	309.341	1.875	20	5		DDBDMO
COCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C(C)(C)C1	ZINC000593876828	356036112	/nfs/dbraw/zinc/03/61/12/356036112.db2.gz	VDDNRVUUSVTUIV-UHFFFAOYSA-N	1	1	310.354	1.106	20	5		DDBDMO
COCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C(C)(C)C1	ZINC000593876828	356036115	/nfs/dbraw/zinc/03/61/15/356036115.db2.gz	VDDNRVUUSVTUIV-UHFFFAOYSA-N	1	1	310.354	1.106	20	5		DDBDMO
COCC[N@@H+](C)C[C@@H](O)CN[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000593969920	356077020	/nfs/dbraw/zinc/07/70/20/356077020.db2.gz	GNYIHCASRJFJJM-OLZOCXBDSA-N	1	1	311.382	1.185	20	5		DDBDMO
O=[N+]([O-])c1cc(F)c(CN2CC[N@H+]3C[C@H](O)C[C@H]3C2)c(F)c1	ZINC000594025462	356093127	/nfs/dbraw/zinc/09/31/27/356093127.db2.gz	MTBUFQZPENJHTH-WDEREUQCSA-N	1	1	313.304	1.124	20	5		DDBDMO
CCOc1cc(CN2CC[N@H+]3C[C@H](O)C[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000594026016	356093347	/nfs/dbraw/zinc/09/33/47/356093347.db2.gz	XANIQGLDOUENDC-UONOGXRCSA-N	1	1	321.377	1.244	20	5		DDBDMO
CCc1n[nH]c(C(=O)N[C@@H]2CCC[N@H+]3CCCC[C@@H]23)c1[N+](=O)[O-]	ZINC000594418562	356203705	/nfs/dbraw/zinc/20/37/05/356203705.db2.gz	KDZXQNSEIRHDJO-NEPJUHHUSA-N	1	1	321.381	1.627	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1n[nH]c(C)n1	ZINC000595033451	356375144	/nfs/dbraw/zinc/37/51/44/356375144.db2.gz	LVXJBAAUKWBULA-VIFPVBQESA-N	1	1	305.338	1.923	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1nnc(C)[nH]1	ZINC000595033451	356375145	/nfs/dbraw/zinc/37/51/45/356375145.db2.gz	LVXJBAAUKWBULA-VIFPVBQESA-N	1	1	305.338	1.923	20	5		DDBDMO
CO[C@@]1(CO)CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000595663747	356599336	/nfs/dbraw/zinc/59/93/36/356599336.db2.gz	UGFLRVDOLCYFOS-HNNXBMFYSA-N	1	1	310.350	1.447	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595741709	356631169	/nfs/dbraw/zinc/63/11/69/356631169.db2.gz	DCMWJXGXHHLLFO-ATCWAGBWSA-N	1	1	321.377	1.790	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595741709	356631170	/nfs/dbraw/zinc/63/11/70/356631170.db2.gz	DCMWJXGXHHLLFO-ATCWAGBWSA-N	1	1	321.377	1.790	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595741702	356631197	/nfs/dbraw/zinc/63/11/97/356631197.db2.gz	DBUWNENQQZKHKS-ZAZJYDDPSA-N	1	1	321.377	1.871	20	5		DDBDMO
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1	ZINC000595741702	356631198	/nfs/dbraw/zinc/63/11/98/356631198.db2.gz	DBUWNENQQZKHKS-ZAZJYDDPSA-N	1	1	321.377	1.871	20	5		DDBDMO
O=C1CC[C@H]2C[N@@H+](CCOc3ccccc3[N+](=O)[O-])CC[C@@H]2N1	ZINC000595737068	356629398	/nfs/dbraw/zinc/62/93/98/356629398.db2.gz	GOECIWRFBOWWRU-STQMWFEESA-N	1	1	319.361	1.574	20	5		DDBDMO
C[C@H](O)[C@H]1CCC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000595771471	356645901	/nfs/dbraw/zinc/64/59/01/356645901.db2.gz	PKEUKCPIBCBDEC-GXFFZTMASA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755611	356636933	/nfs/dbraw/zinc/63/69/33/356636933.db2.gz	BJOQBJIHWVLDEH-BMIGLBTASA-N	1	1	302.334	1.939	20	5		DDBDMO
C[C@]12COC[C@H]1C[N@@H+](Cc1nc3cc([N+](=O)[O-])ccc3[nH]1)C2	ZINC000595755611	356636935	/nfs/dbraw/zinc/63/69/35/356636935.db2.gz	BJOQBJIHWVLDEH-BMIGLBTASA-N	1	1	302.334	1.939	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)[C@@](C)(CO)C1	ZINC000595880770	356689161	/nfs/dbraw/zinc/68/91/61/356689161.db2.gz	ZBVMGICFWAKHGC-XHBSWPGZSA-N	1	1	321.377	1.872	20	5		DDBDMO
CC1(C)COCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596111929	356775822	/nfs/dbraw/zinc/77/58/22/356775822.db2.gz	DRWKXYBZHWGIEE-UHFFFAOYSA-N	1	1	322.365	1.216	20	5		DDBDMO
CC1(C)COCC[N@H+]1CCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596111929	356775826	/nfs/dbraw/zinc/77/58/26/356775826.db2.gz	DRWKXYBZHWGIEE-UHFFFAOYSA-N	1	1	322.365	1.216	20	5		DDBDMO
C[C@H]1C[N@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000596163184	356797925	/nfs/dbraw/zinc/79/79/25/356797925.db2.gz	QDQGZGPQBRBEEW-TVQRCGJNSA-N	1	1	304.350	1.588	20	5		DDBDMO
C[C@H]1C[N@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@@H](C)CO1	ZINC000596432694	356878724	/nfs/dbraw/zinc/87/87/24/356878724.db2.gz	RTUXGABZVDQRSF-QWRGUYRKSA-N	1	1	324.381	1.190	20	5		DDBDMO
C[C@H]1C[N@@H+](CCNc2cc(N)c([N+](=O)[O-])c(CO)c2)[C@@H](C)CO1	ZINC000596432694	356878726	/nfs/dbraw/zinc/87/87/26/356878726.db2.gz	RTUXGABZVDQRSF-QWRGUYRKSA-N	1	1	324.381	1.190	20	5		DDBDMO
CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CSC[NH2+]1	ZINC000237257673	202208597	/nfs/dbraw/zinc/20/85/97/202208597.db2.gz	HPZPEFTYBSYUMY-LLVKDONJSA-N	1	1	315.782	1.869	20	5		DDBDMO
Cn1ncc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+](C(C)(C)C)C1	ZINC000597859171	357360791	/nfs/dbraw/zinc/36/07/91/357360791.db2.gz	ALARUWBUKGAQJY-JTQLQIEISA-N	1	1	309.370	1.179	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@H]1C[C@@H](C(N)=O)C1	ZINC000599645767	358005040	/nfs/dbraw/zinc/00/50/40/358005040.db2.gz	XBEAIFRCWCYAFR-KLPPZKSPSA-N	1	1	320.349	1.037	20	5		DDBDMO
C[N@H+]1CCCC[C@@H](CNC(=O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000600311728	358191992	/nfs/dbraw/zinc/19/19/92/358191992.db2.gz	QRPZFZFSNXHGLP-ZDUSSCGKSA-N	1	1	321.377	1.822	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601136471	358417108	/nfs/dbraw/zinc/41/71/08/358417108.db2.gz	FLTNWQYPPPAFOG-HTQZYQBOSA-N	1	1	321.303	1.876	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C	ZINC000601136471	358417110	/nfs/dbraw/zinc/41/71/10/358417110.db2.gz	FLTNWQYPPPAFOG-HTQZYQBOSA-N	1	1	321.303	1.876	20	5		DDBDMO
O=C(c1c(F)cccc1[N+](=O)[O-])N1CC[C@@H]([N@H+]2CC[C@H](O)C2)C1	ZINC000601583513	358611466	/nfs/dbraw/zinc/61/14/66/358611466.db2.gz	BULNLEZDMKSBNN-MNOVXSKESA-N	1	1	323.324	1.015	20	5		DDBDMO
O=C(CC[N@H+]1C[C@@H]2COC[C@@H]2C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000601971438	358759761	/nfs/dbraw/zinc/75/97/61/358759761.db2.gz	BBXJUFFQMOSWRM-TXEJJXNPSA-N	1	1	305.334	1.502	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1	ZINC000602145616	358845538	/nfs/dbraw/zinc/84/55/38/358845538.db2.gz	ZSLXXUWNDQUUFC-GFCCVEGCSA-N	1	1	319.361	1.526	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602777760	359183809	/nfs/dbraw/zinc/18/38/09/359183809.db2.gz	LAQUCIKKXCRBTD-AWEZNQCLSA-N	1	1	309.414	1.763	20	5		DDBDMO
CCCNC(=O)[C@@H]1CCC[N@@H+](CCn2c(C)ncc2[N+](=O)[O-])C1	ZINC000602767112	359176434	/nfs/dbraw/zinc/17/64/34/359176434.db2.gz	VZCKVANTSDTRQW-CYBMUJFWSA-N	1	1	323.397	1.338	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@]1(CO)CC(C)C	ZINC000602817646	359212691	/nfs/dbraw/zinc/21/26/91/359212691.db2.gz	UZKLBQSFNGMILN-HNNXBMFYSA-N	1	1	310.398	1.973	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@](CO)(C(C)C)C1	ZINC000602830173	359221943	/nfs/dbraw/zinc/22/19/43/359221943.db2.gz	AEEPNBQADHWBHI-HNNXBMFYSA-N	1	1	310.398	1.830	20	5		DDBDMO
C[C@@]1(CO)C[C@@H](O)C[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1	ZINC000602899320	359281240	/nfs/dbraw/zinc/28/12/40/359281240.db2.gz	PNCNHHNHGNOMIP-HIFRSBDPSA-N	1	1	310.350	1.181	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Nc1c(C)cncc1[N+](=O)[O-]	ZINC000602960499	359323068	/nfs/dbraw/zinc/32/30/68/359323068.db2.gz	KOKLVZKGKPOWAQ-GFCCVEGCSA-N	1	1	321.381	1.668	20	5		DDBDMO
CCOc1cc(C[N@H+]2C[C@@H](OC)C[C@]2(C)CO)ccc1[N+](=O)[O-]	ZINC000602964946	359328937	/nfs/dbraw/zinc/32/89/37/359328937.db2.gz	WNRYUACUJOVMMJ-XJKSGUPXSA-N	1	1	324.377	1.965	20	5		DDBDMO
CCCc1n[nH]c(C(=O)N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000186751419	200003966	/nfs/dbraw/zinc/00/39/66/200003966.db2.gz	WUNRRGQOHNHXPM-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC[N@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000186751419	200003968	/nfs/dbraw/zinc/00/39/68/200003968.db2.gz	WUNRRGQOHNHXPM-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N(C)CC[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000186751419	200003971	/nfs/dbraw/zinc/00/39/71/200003971.db2.gz	WUNRRGQOHNHXPM-UHFFFAOYSA-N	1	1	309.370	1.437	20	5		DDBDMO
C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000186935403	200034634	/nfs/dbraw/zinc/03/46/34/200034634.db2.gz	KVAYODZSJMPBNN-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1	ZINC000186935403	200034636	/nfs/dbraw/zinc/03/46/36/200034636.db2.gz	KVAYODZSJMPBNN-VXGBXAGGSA-N	1	1	307.350	1.122	20	5		DDBDMO
COC[C@@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000603430495	359635227	/nfs/dbraw/zinc/63/52/27/359635227.db2.gz	BPCLIZRBMCRQPH-SECBINFHSA-N	1	1	306.265	1.293	20	5		DDBDMO
COc1ccc(CN2CC[N@@H+](CCO)[C@@H](C)C2)cc1[N+](=O)[O-]	ZINC000187651909	200139964	/nfs/dbraw/zinc/13/99/64/200139964.db2.gz	GXYGCWKPMUPKFI-LBPRGKRZSA-N	1	1	309.366	1.102	20	5		DDBDMO
CCC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1	ZINC000187918033	200177041	/nfs/dbraw/zinc/17/70/41/200177041.db2.gz	LZGZOTFQSXOAEW-LBPRGKRZSA-N	1	1	320.393	1.981	20	5		DDBDMO
O=[N+]([O-])c1ccc2[nH]c(N3CC[C@H]([NH+]4CCOCC4)C3)nc2c1	ZINC000618584776	363682370	/nfs/dbraw/zinc/68/23/70/363682370.db2.gz	FJGQDJYSYYKMGQ-LBPRGKRZSA-N	1	1	317.349	1.382	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1CN1CCCC2(CC[NH+](C)CC2)C1	ZINC000374075425	307202658	/nfs/dbraw/zinc/20/26/58/307202658.db2.gz	TUIBUYLUOZJTPL-UHFFFAOYSA-N	1	1	307.398	1.636	20	5		DDBDMO
Cc1cc(NC(=O)NCC[N@H+]2CCCOCC2)ccc1[N+](=O)[O-]	ZINC000188627121	200278234	/nfs/dbraw/zinc/27/82/34/200278234.db2.gz	OJBMMHXCLNCBGR-UHFFFAOYSA-N	1	1	322.365	1.747	20	5		DDBDMO
COCC[N@H+]1CCC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000609269888	360286193	/nfs/dbraw/zinc/28/61/93/360286193.db2.gz	YQHFUORAQNLHOR-ZDUSSCGKSA-N	1	1	307.350	1.435	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@@H+](CCCO)C2CC2)c2c(c1)COCO2	ZINC000610132988	360385462	/nfs/dbraw/zinc/38/54/62/360385462.db2.gz	OUXMAVVPZDRLTJ-UHFFFAOYSA-N	1	1	308.334	1.808	20	5		DDBDMO
O=[N+]([O-])c1cc(C[N@H+](CCCO)C2CC2)c2c(c1)COCO2	ZINC000610132988	360385465	/nfs/dbraw/zinc/38/54/65/360385465.db2.gz	OUXMAVVPZDRLTJ-UHFFFAOYSA-N	1	1	308.334	1.808	20	5		DDBDMO
CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1cc([N+](=O)[O-])cn1C	ZINC000610244743	360397147	/nfs/dbraw/zinc/39/71/47/360397147.db2.gz	NBXOUQUBMOAVHP-LBPRGKRZSA-N	1	1	308.382	1.880	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000610476250	360444688	/nfs/dbraw/zinc/44/46/88/360444688.db2.gz	ODPPFBUNTHNTLP-LBPRGKRZSA-N	1	1	321.381	1.067	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000610476250	360444692	/nfs/dbraw/zinc/44/46/92/360444692.db2.gz	ODPPFBUNTHNTLP-LBPRGKRZSA-N	1	1	321.381	1.067	20	5		DDBDMO
COCC1([N@@H+](C)C[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000611178928	360650096	/nfs/dbraw/zinc/65/00/96/360650096.db2.gz	TXBYYQACUQCZKY-ZDUSSCGKSA-N	1	1	310.350	1.445	20	5		DDBDMO
COCC1([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000611178465	360650443	/nfs/dbraw/zinc/65/04/43/360650443.db2.gz	BVBQYXOUBKRFBH-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
COCC1([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000611178465	360650449	/nfs/dbraw/zinc/65/04/49/360650449.db2.gz	BVBQYXOUBKRFBH-UHFFFAOYSA-N	1	1	323.349	1.653	20	5		DDBDMO
CNC(=O)[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C(C)C	ZINC000611396210	360710502	/nfs/dbraw/zinc/71/05/02/360710502.db2.gz	RXKSPSVGSCRRHM-ZDUSSCGKSA-N	1	1	306.322	1.596	20	5		DDBDMO
CC[C@H](O)C[NH+]1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000611616473	360777318	/nfs/dbraw/zinc/77/73/18/360777318.db2.gz	RYTCJDAYXGYBGN-ZDUSSCGKSA-N	1	1	308.382	1.500	20	5		DDBDMO
O=[N+]([O-])c1ccc(OCCC[N@H+]2C[C@@H]3COC[C@H](C2)O3)cc1	ZINC000619784323	364148984	/nfs/dbraw/zinc/14/89/84/364148984.db2.gz	SCRMHCKXJNFSDB-GASCZTMLSA-N	1	1	308.334	1.463	20	5		DDBDMO
Cc1n[nH]cc1C[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000093534884	193266121	/nfs/dbraw/zinc/26/61/21/193266121.db2.gz	BWRWCAWEZPUBBM-LBPRGKRZSA-N	1	1	302.338	1.708	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1C[N@H+](C)CCN1C	ZINC000264654994	204057753	/nfs/dbraw/zinc/05/77/53/204057753.db2.gz	PRIQNDJQIGQCBE-ZDUSSCGKSA-N	1	1	321.381	1.271	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc(OC)c(OC)c([N+](=O)[O-])c2)CC1	ZINC000266120980	205115408	/nfs/dbraw/zinc/11/54/08/205115408.db2.gz	YTZPJZQCZCGGAA-UHFFFAOYSA-N	1	1	323.349	1.390	20	5		DDBDMO
CC(C)[N@@H+](C)CCCNC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000266224981	205196379	/nfs/dbraw/zinc/19/63/79/205196379.db2.gz	BJZDPJXJDMCYQM-UHFFFAOYSA-N	1	1	322.409	1.878	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000104672922	194024179	/nfs/dbraw/zinc/02/41/79/194024179.db2.gz	KAJADZKRLDYALD-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
CNC(=O)[C@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1	ZINC000104672922	194024180	/nfs/dbraw/zinc/02/41/80/194024180.db2.gz	KAJADZKRLDYALD-CQSZACIVSA-N	1	1	307.350	1.574	20	5		DDBDMO
COCC[N@@H+](C)CCCNC(=O)c1cc(C)cc([N+](=O)[O-])c1N	ZINC000104848157	194046100	/nfs/dbraw/zinc/04/61/00/194046100.db2.gz	GVPZYLVFMHNKRE-UHFFFAOYSA-N	1	1	324.381	1.184	20	5		DDBDMO
CCOCCNC(=O)C[N@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285208482	218333658	/nfs/dbraw/zinc/33/36/58/218333658.db2.gz	DLOJSFKQAQIJEI-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
CCOCCNC(=O)C[N@@H+](C)CCc1ccccc1[N+](=O)[O-]	ZINC000285208482	218333662	/nfs/dbraw/zinc/33/36/62/218333662.db2.gz	DLOJSFKQAQIJEI-UHFFFAOYSA-N	1	1	309.366	1.222	20	5		DDBDMO
C[N@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1(CO)CCOCC1	ZINC000285292279	218369018	/nfs/dbraw/zinc/36/90/18/218369018.db2.gz	LJGWJZUABFJFNK-UHFFFAOYSA-N	1	1	316.304	1.846	20	5		DDBDMO
C[N@@H+](Cc1c(F)cc([N+](=O)[O-])cc1F)C1(CO)CCOCC1	ZINC000285292279	218369019	/nfs/dbraw/zinc/36/90/19/218369019.db2.gz	LJGWJZUABFJFNK-UHFFFAOYSA-N	1	1	316.304	1.846	20	5		DDBDMO
CC[C@@H](C)[N@@H+](C)CCNC(=O)CCn1cc([N+](=O)[O-])nc1C	ZINC000066140443	184392362	/nfs/dbraw/zinc/39/23/62/184392362.db2.gz	MJQMYAVUEWNTBH-LLVKDONJSA-N	1	1	311.386	1.336	20	5		DDBDMO
C[N@@H+](CCOc1ccccc1[N+](=O)[O-])C1(C(N)=O)CCCC1	ZINC000120096516	195095325	/nfs/dbraw/zinc/09/53/25/195095325.db2.gz	QEJZXUVTDBBRRD-UHFFFAOYSA-N	1	1	307.350	1.704	20	5		DDBDMO
O=[N+]([O-])c1cccc(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c1	ZINC000449433161	285153459	/nfs/dbraw/zinc/15/34/59/285153459.db2.gz	LASCQXKMVCSYIC-NUEKZKHPSA-N	1	1	306.362	1.957	20	5		DDBDMO
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2NC[C@@H]2C[NH2+]CCCO2)n1	ZINC000423493213	285168541	/nfs/dbraw/zinc/16/85/41/285168541.db2.gz	PPHYMRREQARMEF-MELADBBJSA-N	1	1	323.397	1.243	20	5		DDBDMO
CC[N@@H+](C)CCNC(=O)c1ccn(-c2ccccc2[N+](=O)[O-])n1	ZINC000157385656	197183531	/nfs/dbraw/zinc/18/35/31/197183531.db2.gz	CEVXLVWCNYTMEQ-UHFFFAOYSA-N	1	1	317.349	1.462	20	5		DDBDMO
C[C@H]([NH2+]CCCN1CCN(C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000122136522	195407792	/nfs/dbraw/zinc/40/77/92/195407792.db2.gz	RJXQZTRSRKXPOZ-AWEZNQCLSA-N	1	1	306.410	1.883	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000444348977	533400004	/nfs/dbraw/zinc/40/00/04/533400004.db2.gz	CPIADANUQANLFB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1cccc(C(=O)N2CC[N@@H+](C)[C@@H](C)[C@H]2C)c1[N+](=O)[O-]	ZINC000444348977	533400008	/nfs/dbraw/zinc/40/00/08/533400008.db2.gz	CPIADANUQANLFB-WDEREUQCSA-N	1	1	307.350	1.768	20	5		DDBDMO
Cc1[nH]nc(C(=O)N2CC[NH+](CCC(C)(C)C)CC2)c1[N+](=O)[O-]	ZINC000299569179	533660790	/nfs/dbraw/zinc/66/07/90/533660790.db2.gz	VMAPAQDJHXTKNK-UHFFFAOYSA-N	1	1	323.397	1.820	20	5		DDBDMO
CCn1ccnc1C[NH2+]C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000569332880	304346937	/nfs/dbraw/zinc/34/69/37/304346937.db2.gz	GEPVHAFYNRVGIW-GFCCVEGCSA-N	1	1	320.349	1.341	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000078619487	407036748	/nfs/dbraw/zinc/03/67/48/407036748.db2.gz	VEKQBDSEGMODRR-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
Cn1nc2c(cc1=O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000078619487	407036749	/nfs/dbraw/zinc/03/67/49/407036749.db2.gz	VEKQBDSEGMODRR-UHFFFAOYSA-N	1	1	300.318	1.247	20	5		DDBDMO
CC(C)(O)C[NH+]1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1	ZINC000122782443	407310321	/nfs/dbraw/zinc/31/03/21/407310321.db2.gz	JPQMPFWAEKYLAK-UHFFFAOYSA-N	1	1	314.773	1.536	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076087	407346528	/nfs/dbraw/zinc/34/65/28/407346528.db2.gz	DYBGGNXVQRNWFN-MNOVXSKESA-N	1	1	320.349	1.119	20	5		DDBDMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000104076087	407346529	/nfs/dbraw/zinc/34/65/29/407346529.db2.gz	DYBGGNXVQRNWFN-MNOVXSKESA-N	1	1	320.349	1.119	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000124721218	407368004	/nfs/dbraw/zinc/36/80/04/407368004.db2.gz	XNRBTZVELILIHX-PWSUYJOCSA-N	1	1	306.366	1.853	20	5		DDBDMO
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CC2)CC1	ZINC000126076564	407403944	/nfs/dbraw/zinc/40/39/44/407403944.db2.gz	APOAICAWROZQPP-GFCCVEGCSA-N	1	1	318.377	1.702	20	5		DDBDMO
CC[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)[C@H](C)C1	ZINC000185725705	407487121	/nfs/dbraw/zinc/48/71/21/407487121.db2.gz	AZZNSTXUYBMNIT-ZYHUDNBSSA-N	1	1	322.365	1.498	20	5		DDBDMO
CNC(=O)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(OC)c2)CC1	ZINC000266451613	407537600	/nfs/dbraw/zinc/53/76/00/407537600.db2.gz	XHYDLFVSRPGKHQ-UHFFFAOYSA-N	1	1	322.365	1.226	20	5		DDBDMO
CCCN(CC[NH+](CC)CC)C(=O)c1n[nH]c(C)c1[N+](=O)[O-]	ZINC000130243499	407669902	/nfs/dbraw/zinc/66/99/02/407669902.db2.gz	KAYWKQOTTHDVOF-UHFFFAOYSA-N	1	1	311.386	1.820	20	5		DDBDMO
CCOc1ccc([N+](=O)[O-])cc1C[N@@H+](C)CCCC(=O)NC	ZINC000179008646	407690848	/nfs/dbraw/zinc/69/08/48/407690848.db2.gz	VSZQGZQKCQKEMN-UHFFFAOYSA-N	1	1	309.366	1.952	20	5		DDBDMO
C[N@H+]1CCC[C@H]1CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1	ZINC000272067573	407761834	/nfs/dbraw/zinc/76/18/34/407761834.db2.gz	BMKRHOJSSPOLQX-VIFPVBQESA-N	1	1	321.362	1.424	20	5		DDBDMO
C[NH+]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1	ZINC000132062790	407766458	/nfs/dbraw/zinc/76/64/58/407766458.db2.gz	OCHOVBDWUDKLJB-UHFFFAOYSA-N	1	1	303.322	1.392	20	5		DDBDMO
COc1ccc(C(=O)N(C)[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-]	ZINC000153544315	407849387	/nfs/dbraw/zinc/84/93/87/407849387.db2.gz	MDZQOFIADZHDGR-GFCCVEGCSA-N	1	1	307.350	1.770	20	5		DDBDMO
O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H]1c1ccncc1	ZINC000153905949	407929545	/nfs/dbraw/zinc/92/95/45/407929545.db2.gz	ODUWTTADMDCGNE-OAHLLOKOSA-N	1	1	314.345	1.989	20	5		DDBDMO
COCCO[C@H]1CC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000189679199	408077539	/nfs/dbraw/zinc/07/75/39/408077539.db2.gz	ANMSTFJXXAVZQI-HNNXBMFYSA-N	1	1	310.350	1.711	20	5		DDBDMO
CCc1ccc(C(=O)N2CC[NH+](C[C@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000189745229	408097139	/nfs/dbraw/zinc/09/71/39/408097139.db2.gz	WMDLKJBGSYWEJM-LBPRGKRZSA-N	1	1	321.377	1.296	20	5		DDBDMO
[NH3+]CC(F)(F)CNC(=O)Cc1ccc([N+](=O)[O-])cc1Cl	ZINC000190208854	408189128	/nfs/dbraw/zinc/18/91/28/408189128.db2.gz	GHGUYSACDANCDO-UHFFFAOYSA-N	1	1	307.684	1.501	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)[C@@H]1CO	ZINC000190335261	408222135	/nfs/dbraw/zinc/22/21/35/408222135.db2.gz	XTJXPORVIIWHPV-OSAQELSMSA-N	1	1	310.350	1.037	20	5		DDBDMO
Nc1c(C(=O)N2CCC[N@H+](C3CC3)CC2)cccc1[N+](=O)[O-]	ZINC000176277501	408329146	/nfs/dbraw/zinc/32/91/46/408329146.db2.gz	NEUYQBMCMGOMEU-UHFFFAOYSA-N	1	1	304.350	1.487	20	5		DDBDMO
CN1CCC([N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CCO)CC1	ZINC000269371531	408286161	/nfs/dbraw/zinc/28/61/61/408286161.db2.gz	TUDIOUNKUGJGPZ-GQCTYLIASA-N	1	1	319.405	1.997	20	5		DDBDMO
C[NH+]1CCC(N(C/C=C/c2ccccc2[N+](=O)[O-])CCO)CC1	ZINC000269371531	408286167	/nfs/dbraw/zinc/28/61/67/408286167.db2.gz	TUDIOUNKUGJGPZ-GQCTYLIASA-N	1	1	319.405	1.997	20	5		DDBDMO
C[C@H](O)C[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000246825605	408348478	/nfs/dbraw/zinc/34/84/78/408348478.db2.gz	SWXZEWPEEFRXMD-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
C[C@H](O)C[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1C	ZINC000246825605	408348482	/nfs/dbraw/zinc/34/84/82/408348482.db2.gz	SWXZEWPEEFRXMD-NEPJUHHUSA-N	1	1	307.350	1.122	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2C[C@H]3CCC[C@@H](C2)[NH2+]3)c1[N+](=O)[O-]	ZINC000159726907	162148290	/nfs/dbraw/zinc/14/82/90/162148290.db2.gz	LSDVVYBJXZFNRZ-AOOOYVTPSA-N	1	1	307.354	1.237	20	5		DDBDMO
O=C(Cn1ccc([N+](=O)[O-])n1)N[C@H]1CC[N@@H+](CC2CCCC2)C1	ZINC000173257782	162328791	/nfs/dbraw/zinc/32/87/91/162328791.db2.gz	PFAHMBUJTMJUCI-ZDUSSCGKSA-N	1	1	321.381	1.172	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(N)c([N+](=O)[O-])c2)C1	ZINC000247301419	408447045	/nfs/dbraw/zinc/44/70/45/408447045.db2.gz	PBCGEQMXEZFIFI-JSGCOSHPSA-N	1	1	318.377	1.733	20	5		DDBDMO
Cc1nn(C)c(C(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c1[N+](=O)[O-]	ZINC000274440134	408406588	/nfs/dbraw/zinc/40/65/88/408406588.db2.gz	HGGRYSZDGGBPRP-NSHDSACASA-N	1	1	309.370	1.239	20	5		DDBDMO
COCC[NH+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000176995686	408490841	/nfs/dbraw/zinc/49/08/41/408490841.db2.gz	BTACWKGQCSXDRK-UHFFFAOYSA-N	1	1	320.349	1.500	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@H+]3CCC[C@H](OCCO)C3)nc2c1	ZINC000177079037	408513878	/nfs/dbraw/zinc/51/38/78/408513878.db2.gz	PTPUEOAHFGCKQX-LBPRGKRZSA-N	1	1	321.333	1.709	20	5		DDBDMO
O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](OCCO)C3)nc2c1	ZINC000177079037	408513883	/nfs/dbraw/zinc/51/38/83/408513883.db2.gz	PTPUEOAHFGCKQX-LBPRGKRZSA-N	1	1	321.333	1.709	20	5		DDBDMO
C[C@H]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])cc2)C[N@H+]1C1CC1	ZINC000177088023	408515956	/nfs/dbraw/zinc/51/59/56/408515956.db2.gz	LOLMANGLGOBSRZ-NWDGAFQWSA-N	1	1	319.361	1.715	20	5		DDBDMO
COC[C@@H](C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000265204221	408577949	/nfs/dbraw/zinc/57/79/49/408577949.db2.gz	UKCIPGSZZPPZPX-GFCCVEGCSA-N	1	1	307.350	1.388	20	5		DDBDMO
COCC[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000264606080	408540393	/nfs/dbraw/zinc/54/03/93/408540393.db2.gz	OLNPLLRKLCNINY-JTQLQIEISA-N	1	1	310.310	1.636	20	5		DDBDMO
COc1cccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)c1[N+](=O)[O-]	ZINC000192572293	408612224	/nfs/dbraw/zinc/61/22/24/408612224.db2.gz	OQQUABFCAZSULY-VXGBXAGGSA-N	1	1	319.361	1.912	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](CCO)C2CCOCC2)c1	ZINC000275667031	408639266	/nfs/dbraw/zinc/63/92/66/408639266.db2.gz	YTNNWDRPETTZRF-HNNXBMFYSA-N	1	1	310.350	1.102	20	5		DDBDMO
COCC[N@H+]1CC[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000265443821	408654034	/nfs/dbraw/zinc/65/40/34/408654034.db2.gz	ZZLILLFOZUOFOH-LBPRGKRZSA-N	1	1	322.365	1.745	20	5		DDBDMO
O=C(C[N@@H+](CCO)C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000275882657	408707721	/nfs/dbraw/zinc/70/77/21/408707721.db2.gz	QQWOMUNPUIBGJG-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
O=C(C[N@H+](CCO)C1CCC1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000275882657	408707725	/nfs/dbraw/zinc/70/77/25/408707725.db2.gz	QQWOMUNPUIBGJG-UHFFFAOYSA-N	1	1	319.361	1.331	20	5		DDBDMO
CC[C@@H]1C[N@@H+](CCOc2ccc(OC)cc2[N+](=O)[O-])C[C@@H]1O	ZINC000270855087	408708032	/nfs/dbraw/zinc/70/80/32/408708032.db2.gz	HGYXFZWRMWGFDJ-RISCZKNCSA-N	1	1	310.350	1.685	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H](C)C[NH+]2CCOCC2)cc1[N+](=O)[O-]	ZINC000270898541	408730767	/nfs/dbraw/zinc/73/07/67/408730767.db2.gz	FAHJOKXYWHDTHV-GFCCVEGCSA-N	1	1	307.350	1.810	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421616	408699768	/nfs/dbraw/zinc/69/97/68/408699768.db2.gz	HBCPHFKSCWTAIW-NWDGAFQWSA-N	1	1	307.350	1.769	20	5		DDBDMO
C[C@H]1CCC[C@H](CO)[N@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000162421616	408699772	/nfs/dbraw/zinc/69/97/72/408699772.db2.gz	HBCPHFKSCWTAIW-NWDGAFQWSA-N	1	1	307.350	1.769	20	5		DDBDMO
COc1cc(C(=O)NCCn2cc[nH+]c2C)cc([N+](=O)[O-])c1C	ZINC000276566323	408884097	/nfs/dbraw/zinc/88/40/97/408884097.db2.gz	DKHKCHYKORSUND-UHFFFAOYSA-N	1	1	318.333	1.847	20	5		DDBDMO
C[C@H](O)C[N@@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H](C)CO	ZINC000276184958	408824638	/nfs/dbraw/zinc/82/46/38/408824638.db2.gz	KUUOSNRVLYCABC-UWVGGRQHSA-N	1	1	302.758	1.812	20	5		DDBDMO
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@](C)(C(N)=O)C1	ZINC000280876171	408851418	/nfs/dbraw/zinc/85/14/18/408851418.db2.gz	ZUNTWEIMAUDJGS-ZUZCIYMTSA-N	1	1	320.349	1.119	20	5		DDBDMO
CCC[N@@H+](CC)C[C@@H](C)NC(=O)CCn1cc([N+](=O)[O-])cn1	ZINC000291472491	408870847	/nfs/dbraw/zinc/87/08/47/408870847.db2.gz	FGKSBYLGLZIWTM-GFCCVEGCSA-N	1	1	311.386	1.418	20	5		DDBDMO
Cc1cc(NCCN2CC[N@H+](C)C(C)(C)C2)ncc1[N+](=O)[O-]	ZINC000281677310	408909135	/nfs/dbraw/zinc/90/91/35/408909135.db2.gz	QJZQFDJZLPJHCX-UHFFFAOYSA-N	1	1	307.398	1.736	20	5		DDBDMO
CC(C)[N@@H+](C[C@@H](O)COc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000291730417	408913986	/nfs/dbraw/zinc/91/39/86/408913986.db2.gz	JNQUXPVYRWGIOO-HUUCEWRRSA-N	1	1	324.377	1.834	20	5		DDBDMO
C[C@@H]1CC[NH2+][C@H](C)[C@@H]1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000286095776	408923150	/nfs/dbraw/zinc/92/31/50/408923150.db2.gz	NJHBXOXQICRBMS-JRKPZEMJSA-N	1	1	317.349	1.587	20	5		DDBDMO
C[C@@H]1C[C@@H](N2CCOCC2)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000286071920	408918633	/nfs/dbraw/zinc/91/86/33/408918633.db2.gz	RWIARSIEYIOKTP-UKRRQHHQSA-N	1	1	305.378	1.890	20	5		DDBDMO
COC[C@@H](Cc1ccccc1)[N@@H+](C)CCn1ccc([N+](=O)[O-])n1	ZINC000191506287	163190214	/nfs/dbraw/zinc/19/02/14/163190214.db2.gz	AVNHUURKYUWUCB-OAHLLOKOSA-N	1	1	318.377	1.981	20	5		DDBDMO
Nc1ccc(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)cc1[N+](=O)[O-]	ZINC000277585734	408971570	/nfs/dbraw/zinc/97/15/70/408971570.db2.gz	RXIFLFXTBKHNHI-CYBMUJFWSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000292497108	409032369	/nfs/dbraw/zinc/03/23/69/409032369.db2.gz	UHFZNVUXYHUMSQ-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
C[C@H]1C[C@@H](O)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000292497108	409032371	/nfs/dbraw/zinc/03/23/71/409032371.db2.gz	UHFZNVUXYHUMSQ-GWCFXTLKSA-N	1	1	318.333	1.990	20	5		DDBDMO
Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])n[nH]1	ZINC000287505019	409046208	/nfs/dbraw/zinc/04/62/08/409046208.db2.gz	NWJSYQCOKHZCGZ-JTQLQIEISA-N	1	1	304.310	1.128	20	5		DDBDMO
Cc1cccc([N+](=O)[O-])c1C(=O)NCC[NH+]1CCSCC1	ZINC000278035757	409055407	/nfs/dbraw/zinc/05/54/07/409055407.db2.gz	RQYIHKCBOGHXIE-UHFFFAOYSA-N	1	1	309.391	1.682	20	5		DDBDMO
C[C@@H](CCCC[NH3+])NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000293530046	409131710	/nfs/dbraw/zinc/13/17/10/409131710.db2.gz	UYFAFFRORYZZSC-VIFPVBQESA-N	1	1	305.338	1.718	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](O)CC1	ZINC000293260978	409078006	/nfs/dbraw/zinc/07/80/06/409078006.db2.gz	UKNFNWAUAINCEY-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](O)CC1	ZINC000293260978	409078008	/nfs/dbraw/zinc/07/80/08/409078008.db2.gz	UKNFNWAUAINCEY-CYBMUJFWSA-N	1	1	307.350	1.689	20	5		DDBDMO
CCC[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)CC1	ZINC000283619932	409185960	/nfs/dbraw/zinc/18/59/60/409185960.db2.gz	AQHVBSGSVGPZNS-UHFFFAOYSA-N	1	1	310.329	1.484	20	5		DDBDMO
Cc1cc([N+](=O)[O-])ccc1CN1CCO[C@H]2CC[N@H+](C)C[C@@H]21	ZINC000284715648	409358180	/nfs/dbraw/zinc/35/81/80/409358180.db2.gz	ULZRFXDBGTWFQS-HOTGVXAUSA-N	1	1	305.378	1.808	20	5		DDBDMO
O=C(NC[C@H]1C[N@H+]2CCC[C@@H]2CO1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000321979915	164046224	/nfs/dbraw/zinc/04/62/24/164046224.db2.gz	OZBQQPQKLNAFRU-NEPJUHHUSA-N	1	1	323.324	1.327	20	5		DDBDMO
C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000408073605	164218576	/nfs/dbraw/zinc/21/85/76/164218576.db2.gz	QSZLWEPKKSPGMY-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000408073605	164218579	/nfs/dbraw/zinc/21/85/79/164218579.db2.gz	QSZLWEPKKSPGMY-IUCAKERBSA-N	1	1	310.329	1.481	20	5		DDBDMO
CC(C)C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])nn1C	ZINC000356725047	409552678	/nfs/dbraw/zinc/55/26/78/409552678.db2.gz	DJNSDUTWTRTTSK-NSHDSACASA-N	1	1	309.370	1.179	20	5		DDBDMO
O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CCC[C@H]2C2CCCC2)c1	ZINC000304380554	409617270	/nfs/dbraw/zinc/61/72/70/409617270.db2.gz	YGJBCMSHOCRDPS-GJZGRUSLSA-N	1	1	308.382	1.807	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000354007494	409596163	/nfs/dbraw/zinc/59/61/63/409596163.db2.gz	QDQWECMOTXLDPT-GFCCVEGCSA-N	1	1	307.350	1.526	20	5		DDBDMO
CC[C@H]1CN(c2ncc([N+](=O)[O-])c(C)n2)CC[N@H+]1CCOC	ZINC000296923786	409709572	/nfs/dbraw/zinc/70/95/72/409709572.db2.gz	AVFAXAYQNGQORS-LBPRGKRZSA-N	1	1	309.370	1.240	20	5		DDBDMO
C[C@@H]1[C@@H](C)[N@@H+](C)CCN1C(=O)CCOc1ccccc1[N+](=O)[O-]	ZINC000356843157	409656942	/nfs/dbraw/zinc/65/69/42/409656942.db2.gz	GBLWLEUAMPODOX-CHWSQXEVSA-N	1	1	321.377	1.915	20	5		DDBDMO
C[N@@H+](CC[C@H]1CCCO1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000342577196	409734415	/nfs/dbraw/zinc/73/44/15/409734415.db2.gz	BGLDWTNZVNQDCV-CYBMUJFWSA-N	1	1	307.350	1.695	20	5		DDBDMO
CC[N@H+]1CCCN(C(=O)c2ccc(NC)c([N+](=O)[O-])c2)CC1	ZINC000307853038	409779793	/nfs/dbraw/zinc/77/97/93/409779793.db2.gz	CEUQYVHJVUHFGG-UHFFFAOYSA-N	1	1	306.366	1.804	20	5		DDBDMO
C[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H](C)[N@@H+]1C	ZINC000339611645	410328503	/nfs/dbraw/zinc/32/85/03/410328503.db2.gz	GLWPKERAKRFTEM-PHIMTYICSA-N	1	1	303.366	1.996	20	5		DDBDMO
CN(C(=O)COc1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1	ZINC000347004969	410306658	/nfs/dbraw/zinc/30/66/58/410306658.db2.gz	KQGMVLTXUCCYCW-AWEZNQCLSA-N	1	1	319.361	1.669	20	5		DDBDMO
O=[N+]([O-])c1cccc(Cl)c1C[NH+]1[C@H](CO)CC[C@H]1CO	ZINC000347335066	410480261	/nfs/dbraw/zinc/48/02/61/410480261.db2.gz	NHQVUIIBYNJRFP-UWVGGRQHSA-N	1	1	300.742	1.566	20	5		DDBDMO
CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H]1CC[NH2+]CC1(F)F	ZINC000343419306	410436244	/nfs/dbraw/zinc/43/62/44/410436244.db2.gz	PUYOFKRRPRNWSZ-LLVKDONJSA-N	1	1	313.304	1.798	20	5		DDBDMO
CCCc1n[nH]c(C(=O)NC[C@H]2CCC[N@@H+]2CCC)c1[N+](=O)[O-]	ZINC000343631476	410583810	/nfs/dbraw/zinc/58/38/10/410583810.db2.gz	QSWQWNMAIKWAQM-LLVKDONJSA-N	1	1	323.397	1.875	20	5		DDBDMO
C[N@@H+](CC(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCSC1	ZINC000339974937	410589155	/nfs/dbraw/zinc/58/91/55/410589155.db2.gz	FETCZKXPOUJPCO-ZDUSSCGKSA-N	1	1	309.391	1.648	20	5		DDBDMO
CC[N@@H+](CCOC)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000343641435	410589284	/nfs/dbraw/zinc/58/92/84/410589284.db2.gz	CCWUCCCKJAWLOG-AWEZNQCLSA-N	1	1	307.350	1.668	20	5		DDBDMO
COC1CC([N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000352223605	410560989	/nfs/dbraw/zinc/56/09/89/410560989.db2.gz	WYTJNMPXRNFPJO-UHFFFAOYSA-N	1	1	307.350	1.951	20	5		DDBDMO
COC1CC([N@@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1	ZINC000352223605	410561001	/nfs/dbraw/zinc/56/10/01/410561001.db2.gz	WYTJNMPXRNFPJO-UHFFFAOYSA-N	1	1	307.350	1.951	20	5		DDBDMO
C[NH+]1CCN(C(=O)[C@H]2CCCN2c2ccc([N+](=O)[O-])cc2)CC1	ZINC000301120896	410661350	/nfs/dbraw/zinc/66/13/50/410661350.db2.gz	NOBASKIFASLQQS-OAHLLOKOSA-N	1	1	318.377	1.338	20	5		DDBDMO
Cc1sc(S(=O)(=O)NC[C@@H]2CCC[N@H+]2C)cc1[N+](=O)[O-]	ZINC000353055538	410761496	/nfs/dbraw/zinc/76/14/96/410761496.db2.gz	FLDIMNSKWBWSLM-VIFPVBQESA-N	1	1	319.408	1.337	20	5		DDBDMO
Cc1sc(S(=O)(=O)NC[C@@H]2CCC[N@@H+]2C)cc1[N+](=O)[O-]	ZINC000353055538	410761500	/nfs/dbraw/zinc/76/15/00/410761500.db2.gz	FLDIMNSKWBWSLM-VIFPVBQESA-N	1	1	319.408	1.337	20	5		DDBDMO
C[C@H]1C[N@H+](C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)CCO1	ZINC000302127763	410841376	/nfs/dbraw/zinc/84/13/76/410841376.db2.gz	XALKXEMOLQWYHK-NSHDSACASA-N	1	1	307.354	1.074	20	5		DDBDMO
Cc1c[nH]nc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000356122417	410847518	/nfs/dbraw/zinc/84/75/18/410847518.db2.gz	HAGYRKHJGPVAEJ-LLVKDONJSA-N	1	1	302.338	1.708	20	5		DDBDMO
Cc1c[nH]nc1C[N@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000356122417	410847532	/nfs/dbraw/zinc/84/75/32/410847532.db2.gz	HAGYRKHJGPVAEJ-LLVKDONJSA-N	1	1	302.338	1.708	20	5		DDBDMO
C[C@H](CNC(=O)c1cc([N+](=O)[O-])nn1C)[N@H+]1CCCC[C@H]1C	ZINC000356149517	410864804	/nfs/dbraw/zinc/86/48/04/410864804.db2.gz	HCCQAEIFKJKYQX-GHMZBOCLSA-N	1	1	309.370	1.321	20	5		DDBDMO
Cn1ccnc1[C@@H](NCC[NH+]1CCC1)c1cccc([N+](=O)[O-])c1	ZINC000353646693	411098734	/nfs/dbraw/zinc/09/87/34/411098734.db2.gz	QRRPWVJMHMVWRO-HNNXBMFYSA-N	1	1	315.377	1.713	20	5		DDBDMO
COc1c(C(=O)N2CC[N@H+](C)[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356654414	411118053	/nfs/dbraw/zinc/11/80/53/411118053.db2.gz	LNOGJJCWYFLLEN-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
COc1c(C(=O)N2CC[N@@H+](C)[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000356654414	411118055	/nfs/dbraw/zinc/11/80/55/411118055.db2.gz	LNOGJJCWYFLLEN-MNOVXSKESA-N	1	1	307.350	1.768	20	5		DDBDMO
O=[N+]([O-])c1cc(Cl)cnc1NCCC[NH+]1CCOCC1	ZINC000129759796	196073889	/nfs/dbraw/zinc/07/38/89/196073889.db2.gz	YDULMUQVMWSFBM-UHFFFAOYSA-N	1	1	300.746	1.777	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@H](C)[N@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000516314131	416721872	/nfs/dbraw/zinc/72/18/72/416721872.db2.gz	XHVVEDRPFPUWRR-VHSXEESVSA-N	1	1	307.354	1.196	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@H](C)[N@@H+](C)C[C@H]2C)c1[N+](=O)[O-]	ZINC000516314131	416721875	/nfs/dbraw/zinc/72/18/75/416721875.db2.gz	XHVVEDRPFPUWRR-VHSXEESVSA-N	1	1	307.354	1.196	20	5		DDBDMO
COC[C@@]1(C)CC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000296695819	226134075	/nfs/dbraw/zinc/13/40/75/226134075.db2.gz	METGVWBEINTYQI-CJNGLKHVSA-N	1	1	324.377	1.693	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H]2C[N@H+](C(C)C)CCO2)cc1[N+](=O)[O-]	ZINC000366817198	418522048	/nfs/dbraw/zinc/52/20/48/418522048.db2.gz	CYVGEWMXLOXPHF-CQSZACIVSA-N	1	1	307.350	1.951	20	5		DDBDMO
Cc1ccc(NC(=O)[C@H]2C[N@@H+](C(C)C)CCO2)cc1[N+](=O)[O-]	ZINC000366817198	418522049	/nfs/dbraw/zinc/52/20/49/418522049.db2.gz	CYVGEWMXLOXPHF-CQSZACIVSA-N	1	1	307.350	1.951	20	5		DDBDMO
COc1cccc(C(=O)NC[C@@H](C)[N@@H+](C)C2CC2)c1[N+](=O)[O-]	ZINC000192509393	418524413	/nfs/dbraw/zinc/52/44/13/418524413.db2.gz	PJHQRRMROYJXFQ-SNVBAGLBSA-N	1	1	307.350	1.816	20	5		DDBDMO
Cc1c([C@H]2CCC[N@H+]2CCn2cc([N+](=O)[O-])cn2)cnn1C	ZINC000367320675	418584105	/nfs/dbraw/zinc/58/41/05/418584105.db2.gz	YIRCZSPTEPTPLU-CQSZACIVSA-N	1	1	304.354	1.670	20	5		DDBDMO
NC(=O)c1ccc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c([N+](=O)[O-])c1	ZINC000361152138	418593954	/nfs/dbraw/zinc/59/39/54/418593954.db2.gz	ASGQJTIAAXEWFN-NNQSOWQGSA-N	1	1	319.361	1.287	20	5		DDBDMO
C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccc([N+](=O)[O-])cn2)C1	ZINC000361293309	418619422	/nfs/dbraw/zinc/61/94/22/418619422.db2.gz	WNBCFRFCADELGR-RISCZKNCSA-N	1	1	304.350	1.546	20	5		DDBDMO
COc1cc(C(=O)N2CC[NH2+]C[C@H]2C(F)F)ccc1[N+](=O)[O-]	ZINC000368005007	418672056	/nfs/dbraw/zinc/67/20/56/418672056.db2.gz	GQDNWADPQKMTHL-JTQLQIEISA-N	1	1	315.276	1.283	20	5		DDBDMO
COCCC[N@H+]1CCCN(c2cc(N)ccc2[N+](=O)[O-])CC1	ZINC000375704914	418675087	/nfs/dbraw/zinc/67/50/87/418675087.db2.gz	OGLCJERCCFOGKL-UHFFFAOYSA-N	1	1	308.382	1.726	20	5		DDBDMO
C[C@@]1(C(N)=O)CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000361567650	418679753	/nfs/dbraw/zinc/67/97/53/418679753.db2.gz	VUEZVENBVWCZCQ-OAHLLOKOSA-N	1	1	320.349	1.121	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]2C(=O)NC[C@H]2C1	ZINC000368072061	418683934	/nfs/dbraw/zinc/68/39/34/418683934.db2.gz	ODNKGJJCUICUSI-AAEUAGOBSA-N	1	1	305.334	1.171	20	5		DDBDMO
CC[C@H]1[C@H](CO)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000385849881	418738235	/nfs/dbraw/zinc/73/82/35/418738235.db2.gz	XKTKIJCYDLWFLX-STQMWFEESA-N	1	1	307.350	1.287	20	5		DDBDMO
O=C(N[C@@H]1CC[N@H+](C2CCCC2)C1)c1c[nH]c(=O)c([N+](=O)[O-])c1	ZINC000365631935	418885079	/nfs/dbraw/zinc/88/50/79/418885079.db2.gz	RUARDFNILZLJGN-LLVKDONJSA-N	1	1	320.349	1.442	20	5		DDBDMO
CCCc1[nH]nc(C(=O)N2CC[C@@]3(CCC[C@@H]3[NH3+])C2)c1[N+](=O)[O-]	ZINC000372788096	418902320	/nfs/dbraw/zinc/90/23/20/418902320.db2.gz	TXJCABZQDQUKNR-NHYWBVRUSA-N	1	1	321.381	1.614	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@@H+]1CCC[C@H]1CCO	ZINC000426230008	419410805	/nfs/dbraw/zinc/41/08/05/419410805.db2.gz	JTHPGXCFCIDNLL-STQMWFEESA-N	1	1	310.350	1.181	20	5		DDBDMO
Cc1ccc(CN2C[C@H](C)[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-]	ZINC000418112746	419542707	/nfs/dbraw/zinc/54/27/07/419542707.db2.gz	LNOXLYBBJPMREP-UONOGXRCSA-N	1	1	307.394	1.790	20	5		DDBDMO
COCC[N@@H+](C)CCNC(=O)c1cc([N+](=O)[O-])c(C)cc1C	ZINC000421762475	419715930	/nfs/dbraw/zinc/71/59/30/419715930.db2.gz	NCASECJYRMFJCH-UHFFFAOYSA-N	1	1	309.366	1.520	20	5		DDBDMO
CC(C)(NC(=O)NCC(F)(F)C[NH3+])c1ccc([N+](=O)[O-])cc1	ZINC000418535869	419862382	/nfs/dbraw/zinc/86/23/82/419862382.db2.gz	DZVBXNLAXCVQQJ-UHFFFAOYSA-N	1	1	316.308	1.723	20	5		DDBDMO
Cc1[nH+]c(N2CCOCC2)ccc1Nc1c([N+](=O)[O-])ncn1C	ZINC000432038667	229075164	/nfs/dbraw/zinc/07/51/64/229075164.db2.gz	STXUEKHGOAPLAB-UHFFFAOYSA-N	1	1	318.337	1.612	20	5		DDBDMO
Cc1c(NC(=O)CCN(C)C2CC([NH3+])C2)cccc1[N+](=O)[O-]	ZINC000420322436	420207857	/nfs/dbraw/zinc/20/78/57/420207857.db2.gz	ACASNNHUXLPSTI-UHFFFAOYSA-N	1	1	306.366	1.653	20	5		DDBDMO
C[C@@H]1CCN[C@@H](C)[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000420381745	420249845	/nfs/dbraw/zinc/24/98/45/420249845.db2.gz	ZJHWHSGTCDHDCS-WQGACYEGSA-N	1	1	320.393	1.900	20	5		DDBDMO
COc1cc(C[N@H+]2CC[C@@H](c3nnc[nH]3)C2)ccc1[N+](=O)[O-]	ZINC000425545568	420413065	/nfs/dbraw/zinc/41/30/65/420413065.db2.gz	KDJUHQYINAFYPN-LLVKDONJSA-N	1	1	303.322	1.711	20	5		DDBDMO
O=[N+]([O-])c1ccccc1OCC[N@H+]1CC[C@H](c2nnc[nH]2)C1	ZINC000425553395	420416936	/nfs/dbraw/zinc/41/69/36/420416936.db2.gz	UHMAPFGZPKPUJG-NSHDSACASA-N	1	1	303.322	1.581	20	5		DDBDMO
Cc1c(CC(=O)N2CC[N@H+](C)CC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000438840395	420466818	/nfs/dbraw/zinc/46/68/18/420466818.db2.gz	YUFFYOBXKPXSNE-GFCCVEGCSA-N	1	1	305.378	1.998	20	5		DDBDMO
O=[N+]([O-])c1cnc(NCC[N@@H+]2C[C@H]3CC[C@@H](C2)O3)c(Cl)c1	ZINC000450793946	420532561	/nfs/dbraw/zinc/53/25/61/420532561.db2.gz	QTMVEPHJDAJCBS-PHIMTYICSA-N	1	1	312.757	1.918	20	5		DDBDMO
C[C@H](C(=O)N1C[C@@H]2CC[N@@H+](C)[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F	ZINC000452970836	420691785	/nfs/dbraw/zinc/69/17/85/420691785.db2.gz	GDMRKSNKBOJLPB-ZIBATOQPSA-N	1	1	321.352	2.000	20	5		DDBDMO
O=C(/C=C\c1ccccc1[N+](=O)[O-])N1CC[NH2+]C[C@H]1C(F)F	ZINC000493138353	420766313	/nfs/dbraw/zinc/76/63/13/420766313.db2.gz	HWCIOCXYQZQPCB-FJOGCWAESA-N	1	1	311.288	1.674	20	5		DDBDMO
C[C@H]1C[N@H+](CCO)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000454131239	420803642	/nfs/dbraw/zinc/80/36/42/420803642.db2.gz	CREKNEVNRCVGEW-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
C[C@H]1C[N@@H+](CCO)CCN1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000454131239	420803645	/nfs/dbraw/zinc/80/36/45/420803645.db2.gz	CREKNEVNRCVGEW-NSHDSACASA-N	1	1	308.338	1.125	20	5		DDBDMO
O=C(NC[C@@H]1CCCC[N@@H+]1CCO)Nc1cccc([N+](=O)[O-])c1	ZINC000454139316	420805196	/nfs/dbraw/zinc/80/51/96/420805196.db2.gz	DQGFJQJNTNLXHH-AWEZNQCLSA-N	1	1	322.365	1.563	20	5		DDBDMO
C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1C[C@@H]2C(=O)NC(=O)[C@@H]2C1	ZINC000449522434	421021652	/nfs/dbraw/zinc/02/16/52/421021652.db2.gz	KTPROPGWHCEDRA-QCNRNOMUSA-N	1	1	315.329	1.203	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488725269	421107453	/nfs/dbraw/zinc/10/74/53/421107453.db2.gz	ALCAOBWMBAYRQG-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](CO)[C@@H]1C	ZINC000488725269	421107456	/nfs/dbraw/zinc/10/74/56/421107456.db2.gz	ALCAOBWMBAYRQG-NWDGAFQWSA-N	1	1	307.350	1.544	20	5		DDBDMO
C[C@H]1[C@H](CO)CC[N@H+]1CC(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000488799331	421118260	/nfs/dbraw/zinc/11/82/60/421118260.db2.gz	KJQKZVIWGSCKEF-AAEUAGOBSA-N	1	1	319.361	1.187	20	5		DDBDMO
CC(C)[C@@H]1CN(C(=O)c2c(N)cccc2[N+](=O)[O-])CC[N@H+]1C	ZINC000490295328	421191694	/nfs/dbraw/zinc/19/16/94/421191694.db2.gz	BRQCPOPSCUCPQD-ZDUSSCGKSA-N	1	1	306.366	1.589	20	5		DDBDMO
COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(COC(=O)N2)CC1	ZINC000496345684	421236120	/nfs/dbraw/zinc/23/61/20/421236120.db2.gz	NARJLUVKEJHWLB-UHFFFAOYSA-N	1	1	321.333	1.678	20	5		DDBDMO
CC[N@@H+](C)Cc1cccc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])c1	ZINC000547756174	421363193	/nfs/dbraw/zinc/36/31/93/421363193.db2.gz	OPLHDBHLQPBLLQ-UHFFFAOYSA-N	1	1	317.349	1.700	20	5		DDBDMO
COc1cc(C(=O)NCC[N@H+]2CC[C@H](C)C2)ccc1[N+](=O)[O-]	ZINC000562916498	421425651	/nfs/dbraw/zinc/42/56/51/421425651.db2.gz	IKTMQUINZQFZBY-NSHDSACASA-N	1	1	307.350	1.675	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@H+](CCO)C[C@@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965935	421432350	/nfs/dbraw/zinc/43/23/50/421432350.db2.gz	QFJRQASTGQOUDI-STQMWFEESA-N	1	1	321.377	1.223	20	5		DDBDMO
C[C@H](C(=O)N1CC[N@@H+](CCO)C[C@@H]1C)c1cccc([N+](=O)[O-])c1	ZINC000562965935	421432352	/nfs/dbraw/zinc/43/23/52/421432352.db2.gz	QFJRQASTGQOUDI-STQMWFEESA-N	1	1	321.377	1.223	20	5		DDBDMO
C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cn1	ZINC000548731892	421467785	/nfs/dbraw/zinc/46/77/85/421467785.db2.gz	LJQDKYVLLDTDRJ-ZDUSSCGKSA-N	1	1	306.366	1.840	20	5		DDBDMO
CC[NH+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000518709756	421663146	/nfs/dbraw/zinc/66/31/46/421663146.db2.gz	FZXKWRMAKUMOED-UHFFFAOYSA-N	1	1	307.306	1.101	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH2+]C[C@@H]2C(F)F)c1	ZINC000520218982	421741123	/nfs/dbraw/zinc/74/11/23/421741123.db2.gz	LGDNVWFOQMACAQ-LLVKDONJSA-N	1	1	315.276	1.283	20	5		DDBDMO
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc([N+](=O)[O-])cn1C	ZINC000520366851	421747095	/nfs/dbraw/zinc/74/70/95/421747095.db2.gz	IUZCQOXOYSTCJD-NWDGAFQWSA-N	1	1	308.382	1.784	20	5		DDBDMO
CC[C@@]1(O)CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000602983456	422440565	/nfs/dbraw/zinc/44/05/65/422440565.db2.gz	KRMLKZZSLLQRSB-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@@]1(O)CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000602983456	422440571	/nfs/dbraw/zinc/44/05/71/422440571.db2.gz	KRMLKZZSLLQRSB-OAHLLOKOSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@]1(O)CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000602983455	422440628	/nfs/dbraw/zinc/44/06/28/422440628.db2.gz	KRMLKZZSLLQRSB-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[C@]1(O)CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000602983455	422440633	/nfs/dbraw/zinc/44/06/33/422440633.db2.gz	KRMLKZZSLLQRSB-HNNXBMFYSA-N	1	1	307.350	1.770	20	5		DDBDMO
CC[N@@H+]1CCO[C@@H](C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000345825500	272345158	/nfs/dbraw/zinc/34/51/58/272345158.db2.gz	SCBZQTMIKKXGCV-CQSZACIVSA-N	1	1	321.377	1.667	20	5		DDBDMO
CC[N@H+]1CCO[C@@H](C(=O)NC(C)(C)c2ccccc2[N+](=O)[O-])C1	ZINC000345825500	272345161	/nfs/dbraw/zinc/34/51/61/272345161.db2.gz	SCBZQTMIKKXGCV-CQSZACIVSA-N	1	1	321.377	1.667	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(N2CCC[N@H+]([C@H](C)CO)CC2)c1	ZINC000338706022	274117796	/nfs/dbraw/zinc/11/77/96/274117796.db2.gz	RBHUHPAAFLIBKD-GFCCVEGCSA-N	1	1	309.366	1.496	20	5		DDBDMO
CC[N@H+]1CC[C@H]2OCCN(CCc3ccc([N+](=O)[O-])cc3)[C@H]2C1	ZINC000293161074	276235493	/nfs/dbraw/zinc/23/54/93/276235493.db2.gz	FOCNWHNXAFSCCW-DLBZAZTESA-N	1	1	319.405	1.932	20	5		DDBDMO
CN1CCNC[C@@H]1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21	ZINC000423522047	277116377	/nfs/dbraw/zinc/11/63/77/277116377.db2.gz	RENADVVNARJTTA-CZUORRHYSA-N	1	1	318.421	1.810	20	5		DDBDMO
C[N@H+]1CCC[C@H](CNC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000120685936	281123330	/nfs/dbraw/zinc/12/33/30/281123330.db2.gz	MZELINPHZARZCX-CQSZACIVSA-N	1	1	320.393	1.778	20	5		DDBDMO
C[C@@H]1CC[N@@H+](C)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000353994487	298333570	/nfs/dbraw/zinc/33/35/70/298333570.db2.gz	FTWRESXHQLUGSQ-CYBMUJFWSA-N	1	1	320.393	1.949	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)CC[C@@H]2C)ccc1[N+](=O)[O-]	ZINC000354008938	298338032	/nfs/dbraw/zinc/33/80/32/298338032.db2.gz	UGRWBFGHVPOLFG-NSHDSACASA-N	1	1	307.350	1.770	20	5		DDBDMO
C[C@H](CNC(=O)c1nn(C)cc1[N+](=O)[O-])[N@H+]1CCCC[C@H]1C	ZINC000357965267	299034776	/nfs/dbraw/zinc/03/47/76/299034776.db2.gz	QTTVCIBXTITYGH-GHMZBOCLSA-N	1	1	309.370	1.321	20	5		DDBDMO
C[C@@H]1C[N@@H+](C)C[C@@H]1C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000362982492	300193696	/nfs/dbraw/zinc/19/36/96/300193696.db2.gz	MEEQCJVGNRZGER-MFKMUULPSA-N	1	1	304.350	1.072	20	5		DDBDMO
O=C(CC[NH+]1CC(O)(C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000366744722	300742988	/nfs/dbraw/zinc/74/29/88/300742988.db2.gz	JPYFZRZGQXMNKY-UHFFFAOYSA-N	1	1	305.334	1.380	20	5		DDBDMO
C[C@H](c1cnccn1)[N@@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422065	301024509	/nfs/dbraw/zinc/02/45/09/301024509.db2.gz	KGZPAKLKQORXRQ-VXGBXAGGSA-N	1	1	302.338	1.979	20	5		DDBDMO
C[C@H](c1cnccn1)[N@H+]1CCC[C@@H](n2cc([N+](=O)[O-])cn2)C1	ZINC000368422065	301024512	/nfs/dbraw/zinc/02/45/12/301024512.db2.gz	KGZPAKLKQORXRQ-VXGBXAGGSA-N	1	1	302.338	1.979	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3ccc(N)c([N+](=O)[O-])c3)C[C@@H]21	ZINC000368596592	301061305	/nfs/dbraw/zinc/06/13/05/301061305.db2.gz	VMBVMCJIFIDKHT-YGRLFVJLSA-N	1	1	304.350	1.343	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCCO[C@@H]3CCC[C@H]32)c([N+](=O)[O-])c1	ZINC000369473839	301189470	/nfs/dbraw/zinc/18/94/70/301189470.db2.gz	UFPJXCZFQYOQHD-UKRRQHHQSA-N	1	1	319.361	1.837	20	5		DDBDMO
Cc1nc([C@H]2CCC[N@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370025409	301260593	/nfs/dbraw/zinc/26/05/93/301260593.db2.gz	DTPGOMHDMKNGCQ-NSHDSACASA-N	1	1	306.326	1.362	20	5		DDBDMO
Cc1nc([C@H]2CCC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)no1	ZINC000370025409	301260597	/nfs/dbraw/zinc/26/05/97/301260597.db2.gz	DTPGOMHDMKNGCQ-NSHDSACASA-N	1	1	306.326	1.362	20	5		DDBDMO
COC(=O)CN1CCC[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000370025974	301260649	/nfs/dbraw/zinc/26/06/49/301260649.db2.gz	LEHSMCTWBDXONO-UHFFFAOYSA-N	1	1	321.377	1.318	20	5		DDBDMO
CN(C(=O)C[N@H+]1CC[C@H]2OCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1	ZINC000376029743	302027003	/nfs/dbraw/zinc/02/70/03/302027003.db2.gz	QBWRQGVRMHVORI-SWLSCSKDSA-N	1	1	319.361	1.668	20	5		DDBDMO
C[NH+](C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000377688089	302212292	/nfs/dbraw/zinc/21/22/92/302212292.db2.gz	IHMBXLLDENHMKW-KBXIAJHMSA-N	1	1	303.362	1.386	20	5		DDBDMO
COCCNC(=O)C1([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1	ZINC000519632115	302845870	/nfs/dbraw/zinc/84/58/70/302845870.db2.gz	QCIUVXPRQHJZIN-GFCCVEGCSA-N	1	1	321.377	1.849	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[NH+]1CCC(OC[C@@H]2CCOC2)CC1	ZINC000534124067	303326716	/nfs/dbraw/zinc/32/67/16/303326716.db2.gz	IPTHARMFQMWRTJ-GFCCVEGCSA-N	1	1	324.381	1.346	20	5		DDBDMO
C[N@H+]1CC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])c(F)cc3N)[C@H]2C1	ZINC000367253621	307089842	/nfs/dbraw/zinc/08/98/42/307089842.db2.gz	SQYSIDXJDYWSPB-OTYXRUKQSA-N	1	1	322.340	1.482	20	5		DDBDMO
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@H](CC(N)=O)C1	ZINC000367377996	307092336	/nfs/dbraw/zinc/09/23/36/307092336.db2.gz	NVERFTSOIPHBAB-WDEREUQCSA-N	1	1	320.349	1.119	20	5		DDBDMO
O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)n1	ZINC000373142416	307180406	/nfs/dbraw/zinc/18/04/06/307180406.db2.gz	TWHLPVPDYYFKIS-UONOGXRCSA-N	1	1	308.382	1.930	20	5		DDBDMO
Cn1cnc([N+](=O)[O-])c1C[N@H+]1CCCC2(CC[NH+](C)CC2)C1	ZINC000374075425	307202657	/nfs/dbraw/zinc/20/26/57/307202657.db2.gz	TUIBUYLUOZJTPL-UHFFFAOYSA-N	1	1	307.398	1.636	20	5		DDBDMO
O=C1NC[C@@]2(CCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)O1	ZINC000375573269	307228305	/nfs/dbraw/zinc/22/83/05/307228305.db2.gz	VEZDRAZOVWTJDW-OAHLLOKOSA-N	1	1	321.333	1.548	20	5		DDBDMO
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CC[C@H]([NH+]2CCCC2)C1	ZINC000533195925	307636027	/nfs/dbraw/zinc/63/60/27/307636027.db2.gz	OONAZUZSXXUKQF-LBPRGKRZSA-N	1	1	305.334	1.611	20	5		DDBDMO
CN1CC[N@H+](C)C[C@@H]1CNc1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC000564893261	308010797	/nfs/dbraw/zinc/01/07/97/308010797.db2.gz	KSGQDOJZQFMDII-ZDUSSCGKSA-N	1	1	319.409	1.526	20	5		DDBDMO
CN1CC[N@@H+](C)C[C@@H]1CNc1nc2c(cc1[N+](=O)[O-])CCCC2	ZINC000564893261	308010798	/nfs/dbraw/zinc/01/07/98/308010798.db2.gz	KSGQDOJZQFMDII-ZDUSSCGKSA-N	1	1	319.409	1.526	20	5		DDBDMO
C[C@H](Cc1cnc[nH]1)C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000572012900	308208405	/nfs/dbraw/zinc/20/84/05/308208405.db2.gz	YQJLZZZPROARBO-LLVKDONJSA-N	1	1	302.334	1.855	20	5		DDBDMO
CC[N@@H+](C)C[C@H](O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000583478471	333366970	/nfs/dbraw/zinc/36/69/70/333366970.db2.gz	HNPUETNPTIWQKD-AWEZNQCLSA-N	1	1	322.409	1.029	20	5		DDBDMO
NC(=O)c1ccc(C[N@H+]2CCC[C@@H](CCO)CC2)c([N+](=O)[O-])c1	ZINC000421024312	484112467	/nfs/dbraw/zinc/11/24/67/484112467.db2.gz	XELBOZZOWWELHF-GFCCVEGCSA-N	1	1	321.377	1.678	20	5		DDBDMO
Cc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@H+]2CCCO)c1	ZINC000452363784	534319053	/nfs/dbraw/zinc/31/90/53/534319053.db2.gz	MDNSZGZSKIRVDO-ZDUSSCGKSA-N	1	1	321.377	1.480	20	5		DDBDMO
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])cnc2N)CC[N@H+](C2CC2)C1	ZINC000452178288	534405621	/nfs/dbraw/zinc/40/56/21/534405621.db2.gz	YVKKASSXXHIJEY-JTQLQIEISA-N	1	1	319.365	1.128	20	5		DDBDMO
C[C@H](O)C[N@@H+](C)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000156348610	525738609	/nfs/dbraw/zinc/73/86/09/525738609.db2.gz	LFEMGIGGICXMBI-JTQLQIEISA-N	1	1	309.322	1.205	20	5		DDBDMO
CCNC(=O)C(C)(C)[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000459600616	528034597	/nfs/dbraw/zinc/03/45/97/528034597.db2.gz	UABCKHKBGASPJW-UHFFFAOYSA-N	1	1	322.365	1.062	20	5		DDBDMO
CNC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000336859131	536434973	/nfs/dbraw/zinc/43/49/73/536434973.db2.gz	FIZDEHBJZDGWGA-CMPLNLGQSA-N	1	1	306.366	1.849	20	5		DDBDMO
C[N@H+]1CC[C@@H](CNc2ccc(-c3nn[nH]n3)cc2[N+](=O)[O-])C1	ZINC000736848360	598243580	/nfs/dbraw/zinc/24/35/80/598243580.db2.gz	LWEXFPVSDIVDGU-VIFPVBQESA-N	1	1	303.326	1.139	20	5		DDBDMO
C[N@@H+](C[C@@H]1CCOC1)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000176091921	697401339	/nfs/dbraw/zinc/40/13/39/697401339.db2.gz	KKWQBNUWVVAQGP-LBPRGKRZSA-N	1	1	317.349	1.779	20	5		DDBDMO
NC(=O)C[C@@H]1CCCC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776582166	698121099	/nfs/dbraw/zinc/12/10/99/698121099.db2.gz	RVCURFPACBJKPP-KBPBESRZSA-N	1	1	307.350	1.358	20	5		DDBDMO
NC(=O)CC[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000776583018	698121377	/nfs/dbraw/zinc/12/13/77/698121377.db2.gz	YNVFMJQMUPIYEW-WFASDCNBSA-N	1	1	321.377	1.606	20	5		DDBDMO
O=C(OCCC[NH+]1CCOCC1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000750888158	700255211	/nfs/dbraw/zinc/25/52/11/700255211.db2.gz	IKIBUJUKJIESMD-UHFFFAOYSA-N	1	1	312.297	1.613	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](C2OCCO2)C1	ZINC000719001647	699297204	/nfs/dbraw/zinc/29/72/04/699297204.db2.gz	PUZXGDLAJXMSIG-GFCCVEGCSA-N	1	1	310.354	1.185	20	5		DDBDMO
C[N@H+]1C[C@@H]2CCN(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H]2C1	ZINC000794927332	699836377	/nfs/dbraw/zinc/83/63/77/699836377.db2.gz	FLOBUBRMYNCKKV-SMDDNHRTSA-N	1	1	306.322	1.639	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000742197897	699866515	/nfs/dbraw/zinc/86/65/15/699866515.db2.gz	VXNXKJXNNADINH-JTQLQIEISA-N	1	1	323.349	1.388	20	5		DDBDMO
COc1cc(C(=O)N2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000742197897	699866518	/nfs/dbraw/zinc/86/65/18/699866518.db2.gz	VXNXKJXNNADINH-JTQLQIEISA-N	1	1	323.349	1.388	20	5		DDBDMO
Cc1nc([N+](=O)[O-])cn1CCC(=O)NCC[N@@H+]1CCC[C@H]1C	ZINC000742238651	699868818	/nfs/dbraw/zinc/86/88/18/699868818.db2.gz	GJOIMBORNCWDOA-LLVKDONJSA-N	1	1	309.370	1.090	20	5		DDBDMO
C[N@H+]1CC[C@](O)(CNC(=O)c2cccc(Cl)c2[N+](=O)[O-])C1	ZINC000762719246	700904410	/nfs/dbraw/zinc/90/44/10/700904410.db2.gz	RCJQGNXUCGHGLD-ZDUSSCGKSA-N	1	1	313.741	1.045	20	5		DDBDMO
Nc1ccc(N2CC[NH+](C[C@H]3CCCO3)CC2)c([N+](=O)[O-])c1	ZINC000804327378	701178619	/nfs/dbraw/zinc/17/86/19/701178619.db2.gz	OTCCJWOPFZVOSL-CYBMUJFWSA-N	1	1	306.366	1.478	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1C[N@H+](C)CCO1	ZINC000770474577	701279497	/nfs/dbraw/zinc/27/94/97/701279497.db2.gz	BOTKENIWKLUAQB-MNOVXSKESA-N	1	1	305.338	1.374	20	5		DDBDMO
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])[C@@H]1C[N@@H+](C)CCO1	ZINC000770474577	701279498	/nfs/dbraw/zinc/27/94/98/701279498.db2.gz	BOTKENIWKLUAQB-MNOVXSKESA-N	1	1	305.338	1.374	20	5		DDBDMO
Cc1[nH+]ccn1CCOC(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000771921956	701336998	/nfs/dbraw/zinc/33/69/98/701336998.db2.gz	INELRWQRLBFEFG-UHFFFAOYSA-N	1	1	308.269	1.678	20	5		DDBDMO
C[N@H+]1CCCC[C@H]1CCOC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1	ZINC000840223352	702034532	/nfs/dbraw/zinc/03/45/32/702034532.db2.gz	ZEKFTBHFOFDEEB-LBPRGKRZSA-N	1	1	324.381	1.944	20	5		DDBDMO
O=[N+]([O-])c1cccc([C@H](O)CN[C@H](CO)C[NH+]2CCCCC2)c1	ZINC000843113556	702821532	/nfs/dbraw/zinc/82/15/32/702821532.db2.gz	WZPCSHJMYZXRBC-GOEBONIOSA-N	1	1	323.393	1.065	20	5		DDBDMO
C[N@H+]1CCC[C@@H]1CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000844268663	703002050	/nfs/dbraw/zinc/00/20/50/703002050.db2.gz	OAQNMIKXUFWOAK-MRXNPFEDSA-N	1	1	304.394	1.811	20	5		DDBDMO
CNc1nccc(C(=O)N2C[C@@H]3CC[N@@H+](C)C[C@@H]3C2)c1[N+](=O)[O-]	ZINC000848102739	703506670	/nfs/dbraw/zinc/50/66/70/703506670.db2.gz	AZZOZPCJUHXKDT-WDEREUQCSA-N	1	1	319.365	1.055	20	5		DDBDMO
COc1ccnc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1F	ZINC000849330825	703635960	/nfs/dbraw/zinc/63/59/60/703635960.db2.gz	CYHISLNEFLMYCC-ZDUSSCGKSA-N	1	1	321.308	1.961	20	5		DDBDMO
O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000852664836	704096201	/nfs/dbraw/zinc/09/62/01/704096201.db2.gz	DNQGDSFIORBDOF-RYUDHWBXSA-N	1	1	307.306	1.971	20	5		DDBDMO
O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+][C@H]2CCn3ccnc32)c1	ZINC000819338135	704110131	/nfs/dbraw/zinc/11/01/31/704110131.db2.gz	WZPIWZSLBTVAJT-OCCSQVGLSA-N	1	1	318.333	1.266	20	5		DDBDMO
CN(CC1=CCCOC1)C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1	ZINC000870953784	704180435	/nfs/dbraw/zinc/18/04/35/704180435.db2.gz	NBLLJZZITYGDCV-MRXNPFEDSA-N	1	1	319.361	1.574	20	5		DDBDMO
C[N@H+]1CC[C@H](CC(=O)N2CCc3c(cccc3[N+](=O)[O-])C2)C1	ZINC000821339810	704393286	/nfs/dbraw/zinc/39/32/86/704393286.db2.gz	IPBPFKCGURAISS-GFCCVEGCSA-N	1	1	303.362	1.821	20	5		DDBDMO
CC[N@@H+](CCO)CCNC(=O)c1c(C)ccc([N+](=O)[O-])c1C	ZINC000822010659	704860364	/nfs/dbraw/zinc/86/03/64/704860364.db2.gz	CJQQHCOSVWCKFQ-UHFFFAOYSA-N	1	1	309.366	1.256	20	5		DDBDMO
COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@H+]3C)c1	ZINC000874845995	705200905	/nfs/dbraw/zinc/20/09/05/705200905.db2.gz	XBZSUSUIASOXQE-CABCVRRESA-N	1	1	319.361	1.912	20	5		DDBDMO
C[N@H+]1CC[C@@](O)(CNC(=O)c2cccc([N+](=O)[O-])c2Cl)C1	ZINC000860826877	705293460	/nfs/dbraw/zinc/29/34/60/705293460.db2.gz	PTVPFQICQXKUKV-CYBMUJFWSA-N	1	1	313.741	1.045	20	5		DDBDMO
CC[N@H+]1CCC[C@@H](CNC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000825505811	705684150	/nfs/dbraw/zinc/68/41/50/705684150.db2.gz	WJPDOLFFQPLBBE-SWLSCSKDSA-N	1	1	321.377	1.476	20	5		DDBDMO
Nc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1	ZINC000863032407	705852622	/nfs/dbraw/zinc/85/26/22/705852622.db2.gz	ODUKBJYEQVPWBM-ZDUSSCGKSA-N	1	1	318.377	1.924	20	5		DDBDMO
C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000827035606	705915972	/nfs/dbraw/zinc/91/59/72/705915972.db2.gz	RPHTYFSOPSWULA-KMUNFCNLSA-N	1	1	319.361	1.227	20	5		DDBDMO
Cn1cc(C[N@H+](C)C[C@@]2(O)CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000877605289	706156946	/nfs/dbraw/zinc/15/69/46/706156946.db2.gz	YLBBDPWYPNTHRA-INIZCTEOSA-N	1	1	316.361	1.594	20	5		DDBDMO
Cn1cc(C[N@@H+](C)C[C@@]2(O)CCc3ccccc32)c([N+](=O)[O-])n1	ZINC000877605289	706156949	/nfs/dbraw/zinc/15/69/49/706156949.db2.gz	YLBBDPWYPNTHRA-INIZCTEOSA-N	1	1	316.361	1.594	20	5		DDBDMO
CN1CCCC[C@@H]([N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265665	707355731	/nfs/dbraw/zinc/35/57/31/707355731.db2.gz	VALIDUBPBXBUIY-CABCVRRESA-N	1	1	321.377	1.571	20	5		DDBDMO
CN1CCCC[C@@H]([N@@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872265665	707355736	/nfs/dbraw/zinc/35/57/36/707355736.db2.gz	VALIDUBPBXBUIY-CABCVRRESA-N	1	1	321.377	1.571	20	5		DDBDMO
CC(=O)c1c(N[C@H](C)CN2CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000881951648	707440973	/nfs/dbraw/zinc/44/09/73/707440973.db2.gz	CQJJHYDEGIDSPS-GFCCVEGCSA-N	1	1	320.393	1.845	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000872784840	707599861	/nfs/dbraw/zinc/59/98/61/707599861.db2.gz	HNHFOZVZXSMLHA-AOOOYVTPSA-N	1	1	305.290	1.038	20	5		DDBDMO
O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1C[C@@H]2COC[C@@H]2C1	ZINC000872784840	707599864	/nfs/dbraw/zinc/59/98/64/707599864.db2.gz	HNHFOZVZXSMLHA-AOOOYVTPSA-N	1	1	305.290	1.038	20	5		DDBDMO
Cc1c(CNC[C@H]2CCC[N@@H+]2CCCO)cccc1[N+](=O)[O-]	ZINC000873128784	707742588	/nfs/dbraw/zinc/74/25/88/707742588.db2.gz	DJOLSMUDWAVFMC-OAHLLOKOSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1c(CNC[C@H]2CCC[N@H+]2CCCO)cccc1[N+](=O)[O-]	ZINC000873128784	707742591	/nfs/dbraw/zinc/74/25/91/707742591.db2.gz	DJOLSMUDWAVFMC-OAHLLOKOSA-N	1	1	307.394	1.840	20	5		DDBDMO
Cc1c(CNC2(CCO)CC[NH+](C)CC2)cccc1[N+](=O)[O-]	ZINC000873134733	707744451	/nfs/dbraw/zinc/74/44/51/707744451.db2.gz	TZILQSZZHYRDAV-UHFFFAOYSA-N	1	1	307.394	1.840	20	5		DDBDMO
CC[N@H+]1CC[C@H]1CNC(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000883372851	707986244	/nfs/dbraw/zinc/98/62/44/707986244.db2.gz	QFOGLHLWOXEMDT-ZDUSSCGKSA-N	1	1	322.365	1.367	20	5		DDBDMO
C[N@H+]1C[C@@H]2CN(c3cc(F)c([N+](=O)[O-])cc3CO)C[C@]2(C)C1	ZINC000896911728	708180674	/nfs/dbraw/zinc/18/06/74/708180674.db2.gz	BKVXSYDFBFJCGH-ABAIWWIYSA-N	1	1	309.341	1.614	20	5		DDBDMO
CCn1c(C)nc([N+](=O)[O-])c1N1CC[C@@H]2[C@H]1CCC[N@H+]2CCO	ZINC000897218458	708256604	/nfs/dbraw/zinc/25/66/04/708256604.db2.gz	CUFOEWYKWTUBCP-CHWSQXEVSA-N	1	1	323.397	1.155	20	5		DDBDMO
C[N@@H+](CCO)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000884823397	708387046	/nfs/dbraw/zinc/38/70/46/708387046.db2.gz	SWRZGIRJXKLKAM-UHFFFAOYSA-N	1	1	307.272	1.950	20	5		DDBDMO
C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1Cc1cccnc1[N+](=O)[O-]	ZINC000886157757	708707355	/nfs/dbraw/zinc/70/73/55/708707355.db2.gz	KFGJKHKYDKQAQJ-GFCCVEGCSA-N	1	1	308.382	1.267	20	5		DDBDMO
CCOc1cc(NC(=O)N2CC[NH+](C)CC2)ccc1[N+](=O)[O-]	ZINC000888835889	709388302	/nfs/dbraw/zinc/38/83/02/709388302.db2.gz	GNICXCWTCKWESP-UHFFFAOYSA-N	1	1	308.338	1.773	20	5		DDBDMO
C[N@H+]1CCC[C@](O)(CC(=O)NCc2ccccc2[N+](=O)[O-])C1	ZINC000900240658	709500735	/nfs/dbraw/zinc/50/07/35/709500735.db2.gz	MGBILCLEXXSNKS-HNNXBMFYSA-N	1	1	307.350	1.058	20	5		DDBDMO
O=C(c1ccc([N+](=O)[O-])cc1)N1CC[C@@H]2[C@H]1CCC[N@@H+]2CCO	ZINC000889778944	709631644	/nfs/dbraw/zinc/63/16/44/709631644.db2.gz	CEBSESVAAWCXKD-HUUCEWRRSA-N	1	1	319.361	1.266	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000913095969	713161875	/nfs/dbraw/zinc/16/18/75/713161875.db2.gz	ACVRCHDLJXGUKT-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095969	713161876	/nfs/dbraw/zinc/16/18/76/713161876.db2.gz	ACVRCHDLJXGUKT-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000913095969	713161877	/nfs/dbraw/zinc/16/18/77/713161877.db2.gz	ACVRCHDLJXGUKT-DMRZNYOFSA-N	1	1	317.389	1.678	20	5		DDBDMO
O=C1NCC2(CCOCC2)[C@@H]1[NH2+]Cc1csc([N+](=O)[O-])c1	ZINC000895773838	711603136	/nfs/dbraw/zinc/60/31/36/711603136.db2.gz	UXBKQLLVZODBKP-LLVKDONJSA-N	1	1	311.363	1.041	20	5		DDBDMO
COc1ccc(N2CC[NH+](CCCNCC[N+](=O)[O-])CC2)cc1	ZINC000905026903	711912608	/nfs/dbraw/zinc/91/26/08/711912608.db2.gz	OLRXLRZKCYYRNB-UHFFFAOYSA-N	1	1	322.409	1.074	20	5		DDBDMO
COc1ccc(CNC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc1[N+](=O)[O-]	ZINC000914300031	713373083	/nfs/dbraw/zinc/37/30/83/713373083.db2.gz	HTEHOWVAIWSVAU-CMPLNLGQSA-N	1	1	322.365	1.495	20	5		DDBDMO
COC(=O)c1cc([N+](=O)[O-])cn(CC[C@H]2CCCC[N@H+]2C)c1=O	ZINC000915668713	713426950	/nfs/dbraw/zinc/42/69/50/713426950.db2.gz	NHFOPRSWHOJENO-LLVKDONJSA-N	1	1	323.349	1.418	20	5		DDBDMO
O=[N+]([O-])c1nccn1Cc1ccc(C[NH+]2CCOCC2)cc1	ZINC000918386060	713540936	/nfs/dbraw/zinc/54/09/36/713540936.db2.gz	FGFFELHCOQSYFN-UHFFFAOYSA-N	1	1	302.334	1.672	20	5		DDBDMO
CC(C)[N@H+]1CC[C@H](N(C)C(=O)Nc2ccncc2[N+](=O)[O-])C1	ZINC000930619597	713879006	/nfs/dbraw/zinc/87/90/06/713879006.db2.gz	WTVCTQLUOLWRDV-NSHDSACASA-N	1	1	307.354	1.358	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CNC[C@@H]1CC[N@@H+]1C1CCOCC1	ZINC000922951786	714195963	/nfs/dbraw/zinc/19/59/63/714195963.db2.gz	RVRVTTIZIIGCLZ-HNNXBMFYSA-N	1	1	305.378	1.938	20	5		DDBDMO
O=[N+]([O-])c1ccccc1CNC[C@@H]1CC[N@H+]1C1CCOCC1	ZINC000922951786	714195966	/nfs/dbraw/zinc/19/59/66/714195966.db2.gz	RVRVTTIZIIGCLZ-HNNXBMFYSA-N	1	1	305.378	1.938	20	5		DDBDMO
CCc1n[nH]c(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923295039	714300803	/nfs/dbraw/zinc/30/08/03/714300803.db2.gz	QUUMHVCVHMDJCX-ZJUUUORDSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923295039	714300804	/nfs/dbraw/zinc/30/08/04/714300804.db2.gz	QUUMHVCVHMDJCX-ZJUUUORDSA-N	1	1	307.354	1.189	20	5		DDBDMO
CCc1[nH]nc(C(=O)N2[C@@H]3CC[C@H]2C[N@@H+](C)CC3)c1[N+](=O)[O-]	ZINC000923295039	714300808	/nfs/dbraw/zinc/30/08/08/714300808.db2.gz	QUUMHVCVHMDJCX-ZJUUUORDSA-N	1	1	307.354	1.189	20	5		DDBDMO
CC1(C)C[NH2+]CC[C@@H]1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000923368373	714329931	/nfs/dbraw/zinc/32/99/31/714329931.db2.gz	BHEBWAGJXUODRC-HIFRSBDPSA-N	1	1	323.393	1.312	20	5		DDBDMO
CC(C)[N@H+]1CCC[C@@H]1C(=O)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000932455631	714336393	/nfs/dbraw/zinc/33/63/93/714336393.db2.gz	MGTPULJXCJEJCM-OAHLLOKOSA-N	1	1	321.377	1.963	20	5		DDBDMO
Cc1ncc([N+](=O)[O-])n1CC(=O)N(C)CC[C@@H]1CCCC[N@H+]1C	ZINC000933623419	714633525	/nfs/dbraw/zinc/63/35/25/714633525.db2.gz	QSOHSNUOASNRCI-ZDUSSCGKSA-N	1	1	323.397	1.433	20	5		DDBDMO
Cc1cccc(C)c1C[N@@H+](C)C[C@@H](O)Cn1cc([N+](=O)[O-])cn1	ZINC000933765894	714667648	/nfs/dbraw/zinc/66/76/48/714667648.db2.gz	BWDCRHQBAVHXQV-OAHLLOKOSA-N	1	1	318.377	1.901	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120443	714747325	/nfs/dbraw/zinc/74/73/25/714747325.db2.gz	HFAHTNJCMULCOG-DGCLKSJQSA-N	1	1	307.350	1.951	20	5		DDBDMO
CO[C@@H]1CC[C@H]1[N@@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-]	ZINC000934120443	714747326	/nfs/dbraw/zinc/74/73/26/714747326.db2.gz	HFAHTNJCMULCOG-DGCLKSJQSA-N	1	1	307.350	1.951	20	5		DDBDMO
O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@H]2CCC[N@@H+]3CCO)cc1F	ZINC000934265790	714779959	/nfs/dbraw/zinc/77/99/59/714779959.db2.gz	NPMPFAOUQJSPQG-HZPDHXFCSA-N	1	1	323.368	1.765	20	5		DDBDMO
C[N@H+]1CC[C@@H]1CNC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000925419972	714850524	/nfs/dbraw/zinc/85/05/24/714850524.db2.gz	RTXDAHNQVXYQJK-OAHLLOKOSA-N	1	1	318.377	1.973	20	5		DDBDMO